data_6136 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6136 _Entry.Title ; Backbone Resonance Assignment of the L-Arabinose Binding Protein in Complex with D-Galactose ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2004-03-08 _Entry.Accession_date 2004-03-08 _Entry.Last_release_date 2004-06-25 _Entry.Original_release_date 2004-06-25 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Antonio 'Hernandez Daranas' . M. . 6136 2 Arnout Kalverda . P. . 6136 3 Anthony Chiovitty . . . 6136 4 Steve Homans . W. . 6136 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6136 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 818 6136 '1H chemical shifts' 270 6136 '15N chemical shifts' 270 6136 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 1 . . 2004-06-25 2004-03-08 original author . 6136 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6136 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 14755164 _Citation.Full_citation . _Citation.Title ; Backbone Resonance Assignment of the L-Arabinose Binding Protein in Complex with D-Galactose ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 28 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 191 _Citation.Page_last 192 _Citation.Year 2004 _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.Entry_ID _Citation_author.Citation_ID 1 Antonio 'Hernandez Daranas' . M. . 6136 1 2 Arnout Kalverda . P. . 6136 1 3 Anthony Chiovitty . . . 6136 1 4 Steve Homans . W. . 6136 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_ABP _Assembly.Sf_category assembly _Assembly.Sf_framecode system_ABP _Assembly.Entry_ID 6136 _Assembly.ID 1 _Assembly.Name 'E. coli L-Arabinose Binding Protein' _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 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 6136 1 stop_ 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 ABP 1 $ABP . . . native . . . . . 6136 1 2 D-galactose 2 $GAL . . . native . . . . . 6136 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'E. coli L-Arabinose Binding Protein' system 6136 1 ABP abbreviation 6136 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'Sugar transporter' 6136 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_ABP _Entity.Sf_category entity _Entity.Sf_framecode ABP _Entity.Entry_ID 6136 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'L-Arabinose Binding Protein' _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 ; ENLKLGFLVKQPEEPWFQTE WKFADKAGKDLGFEVIKIAV PDGEKTLNAIDSLAASGAKG FVICTPDPKLGSAIVAKARG YDMKVIAVDDQFVNAKGKPM DTVPLVMMAATKIGERQGQE LYKEMQKRGWDVKESAVMAI TANELDTARRRTTGSMDALK AAGFPEKQIYQVPTKSNDIP GAFDAANSMLVQHPEVKHWL IVGMNDSTVLGGVRATEGQG FKAADIIGIGINGVDAVSEL SKAQATGFYGSLLPSPDVHG YKSSEMLYNWVAKDVEPPKF TEVTDVVLITRDNFKEELEK KGLGGK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 306 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 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 no PDB 1ABE . "Novel Stereospecificity Of The L-Arabinose-Binding Protein" . . . . . 100.00 306 100.00 100.00 0.00e+00 . . . . 6136 1 2 no PDB 1ABF . "Substrate Specificity And Affinity Of A Protein Modulated By Bound Water Molecules" . . . . . 100.00 306 100.00 100.00 0.00e+00 . . . . 6136 1 3 no PDB 1APB . "A Pro To Gly Mutation In The Hinge Of The Arabinose-Binding Protein Enhances Binding And Alters Specificity: Sugar- Binding And" . . . . . 100.00 306 99.67 99.67 0.00e+00 . . . . 6136 1 4 no PDB 1BAP . "A Pro To Gly Mutation In The Hinge Of The Arabinose-Binding Protein Enhances Binding And Alters Specificity: Sugar- Binding And" . . . . . 100.00 306 99.67 99.67 0.00e+00 . . . . 6136 1 5 no PDB 2WRZ . "Crystal Structure Of An Arabinose Binding Protein With Designed Serotonin Binding Site In Open, Ligand-Free State" . . . . . 100.00 306 97.06 97.71 0.00e+00 . . . . 6136 1 6 no PDB 5ABP . "Substrate Specificity And Affinity Of A Protein Modulated By Bound Water Molecules" . . . . . 100.00 306 100.00 100.00 0.00e+00 . . . . 6136 1 7 no PDB 6ABP . "Sugar-Binding And Crystallographic Studies Of An Arabinose- Binding Protein Mutant (Met108leu) Which Exhibits Enhanced Affinity" . . . . . 100.00 306 99.67 100.00 0.00e+00 . . . . 6136 1 8 no PDB 7ABP . "Sugar-Binding And Crystallographic Studies Of An Arabinose- Binding Protein Mutant (Met108leu) Which Exhibits Enhanced Affinity" . . . . . 100.00 306 99.67 100.00 0.00e+00 . . . . 6136 1 9 no PDB 8ABP . "Sugar-Binding And Crystallographic Studies Of An Arabinose- Binding Protein Mutant (Met108leu) Which Exhibits Enhanced Affinity" . . . . . 100.00 306 99.67 100.00 0.00e+00 . . . . 6136 1 10 no PDB 9ABP . "A Pro To Gly Mutation In The Hinge Of The Arabinose-Binding Protein Enhances Binding And Alters Specificity: Sugar- Binding And" . . . . . 100.00 306 99.67 99.67 0.00e+00 . . . . 6136 1 11 no DBJ BAA15721 . "L-arabinose transporter subunit [Escherichia coli str. K-12 substr. W3110]" . . . . . 100.00 329 100.00 100.00 0.00e+00 . . . . 6136 1 12 no DBJ BAB36032 . "L-arabinose-binding periplasmic protein [Escherichia coli O157:H7 str. Sakai]" . . . . . 100.00 329 99.02 99.35 0.00e+00 . . . . 6136 1 13 no DBJ BAG77657 . "L-arabinose ABC transporter substrate binding component [Escherichia coli SE11]" . . . . . 100.00 346 100.00 100.00 0.00e+00 . . . . 6136 1 14 no DBJ BAI25989 . "L-arabinose-binding periplasmic protein AraF [Escherichia coli O26:H11 str. 11368]" . . . . . 100.00 329 100.00 100.00 0.00e+00 . . . . 6136 1 15 no DBJ BAI30952 . "L-arabinose-binding periplasmic protein AraF [Escherichia coli O103:H2 str. 12009]" . . . . . 100.00 329 99.35 99.67 0.00e+00 . . . . 6136 1 16 no EMBL CAA29476 . "unnamed protein product [Escherichia coli]" . . . . . 100.00 329 99.35 100.00 0.00e+00 . . . . 6136 1 17 no EMBL CAP76386 . "L-arabinose-binding periplasmic protein [Escherichia coli LF82]" . . . . . 100.00 329 98.69 99.35 0.00e+00 . . . . 6136 1 18 no EMBL CAQ32375 . "araF, subunit of arabinose ABC transporter [Escherichia coli BL21(DE3)]" . . . . . 100.00 329 100.00 100.00 0.00e+00 . . . . 6136 1 19 no EMBL CAQ98838 . "L-arabinose transporter subunit ; periplasmic-binding component of ABC superfamily [Escherichia coli IAI1]" . . . . . 100.00 329 100.00 100.00 0.00e+00 . . . . 6136 1 20 no EMBL CAR03257 . "L-arabinose transporter subunit ; periplasmic-binding component of ABC superfamily [Escherichia coli S88]" . . . . . 100.00 329 98.69 99.35 0.00e+00 . . . . 6136 1 21 no GB AAC74971 . "L-arabinose ABC transporter periplasmic binding protein [Escherichia coli str. K-12 substr. MG1655]" . . . . . 100.00 329 100.00 100.00 0.00e+00 . . . . 6136 1 22 no GB AAG56890 . "L-arabinose-binding periplasmic protein [Escherichia coli O157:H7 str. EDL933]" . . . . . 100.00 329 98.69 99.02 0.00e+00 . . . . 6136 1 23 no GB AAN80773 . "L-arabinose-binding periplasmic protein precursor [Escherichia coli CFT073]" . . . . . 100.00 346 98.37 99.35 0.00e+00 . . . . 6136 1 24 no GB AAZ87934 . "L-arabinose-binding periplasmic protein [Shigella sonnei Ss046]" . . . . . 100.00 329 99.67 100.00 0.00e+00 . . . . 6136 1 25 no GB ABB61277 . "L-arabinose-binding periplasmic protein [Shigella dysenteriae Sd197]" . . . . . 100.00 329 99.02 99.35 0.00e+00 . . . . 6136 1 26 no REF NP_288336 . "L-arabinose-binding periplasmic protein [Escherichia coli O157:H7 str. EDL933]" . . . . . 100.00 329 98.69 99.02 0.00e+00 . . . . 6136 1 27 no REF NP_310636 . "L-arabinose-binding periplasmic protein [Escherichia coli O157:H7 str. Sakai]" . . . . . 100.00 329 99.02 99.35 0.00e+00 . . . . 6136 1 28 no REF NP_416414 . "L-arabinose ABC transporter periplasmic binding protein [Escherichia coli str. K-12 substr. MG1655]" . . . . . 100.00 329 100.00 100.00 0.00e+00 . . . . 6136 1 29 no REF NP_754206 . "L-arabinose-binding periplasmic protein [Escherichia coli CFT073]" . . . . . 100.00 346 98.37 99.35 0.00e+00 . . . . 6136 1 30 no REF WP_000011369 . "arabinose ABC transporter substrate-binding protein [Escherichia coli]" . . . . . 100.00 346 100.00 100.00 0.00e+00 . . . . 6136 1 31 no SP P02924 . "RecName: Full=L-arabinose-binding periplasmic protein; Short=ABP; Flags: Precursor [Escherichia coli K-12]" . . . . . 100.00 329 100.00 100.00 0.00e+00 . . . . 6136 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'L-Arabinose Binding Protein' common 6136 1 ABP abbreviation 6136 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 GLU . 6136 1 2 2 ASN . 6136 1 3 3 LEU . 6136 1 4 4 LYS . 6136 1 5 5 LEU . 6136 1 6 6 GLY . 6136 1 7 7 PHE . 6136 1 8 8 LEU . 6136 1 9 9 VAL . 6136 1 10 10 LYS . 6136 1 11 11 GLN . 6136 1 12 12 PRO . 6136 1 13 13 GLU . 6136 1 14 14 GLU . 6136 1 15 15 PRO . 6136 1 16 16 TRP . 6136 1 17 17 PHE . 6136 1 18 18 GLN . 6136 1 19 19 THR . 6136 1 20 20 GLU . 6136 1 21 21 TRP . 6136 1 22 22 LYS . 6136 1 23 23 PHE . 6136 1 24 24 ALA . 6136 1 25 25 ASP . 6136 1 26 26 LYS . 6136 1 27 27 ALA . 6136 1 28 28 GLY . 6136 1 29 29 LYS . 6136 1 30 30 ASP . 6136 1 31 31 LEU . 6136 1 32 32 GLY . 6136 1 33 33 PHE . 6136 1 34 34 GLU . 6136 1 35 35 VAL . 6136 1 36 36 ILE . 6136 1 37 37 LYS . 6136 1 38 38 ILE . 6136 1 39 39 ALA . 6136 1 40 40 VAL . 6136 1 41 41 PRO . 6136 1 42 42 ASP . 6136 1 43 43 GLY . 6136 1 44 44 GLU . 6136 1 45 45 LYS . 6136 1 46 46 THR . 6136 1 47 47 LEU . 6136 1 48 48 ASN . 6136 1 49 49 ALA . 6136 1 50 50 ILE . 6136 1 51 51 ASP . 6136 1 52 52 SER . 6136 1 53 53 LEU . 6136 1 54 54 ALA . 6136 1 55 55 ALA . 6136 1 56 56 SER . 6136 1 57 57 GLY . 6136 1 58 58 ALA . 6136 1 59 59 LYS . 6136 1 60 60 GLY . 6136 1 61 61 PHE . 6136 1 62 62 VAL . 6136 1 63 63 ILE . 6136 1 64 64 CYS . 6136 1 65 65 THR . 6136 1 66 66 PRO . 6136 1 67 67 ASP . 6136 1 68 68 PRO . 6136 1 69 69 LYS . 6136 1 70 70 LEU . 6136 1 71 71 GLY . 6136 1 72 72 SER . 6136 1 73 73 ALA . 6136 1 74 74 ILE . 6136 1 75 75 VAL . 6136 1 76 76 ALA . 6136 1 77 77 LYS . 6136 1 78 78 ALA . 6136 1 79 79 ARG . 6136 1 80 80 GLY . 6136 1 81 81 TYR . 6136 1 82 82 ASP . 6136 1 83 83 MET . 6136 1 84 84 LYS . 6136 1 85 85 VAL . 6136 1 86 86 ILE . 6136 1 87 87 ALA . 6136 1 88 88 VAL . 6136 1 89 89 ASP . 6136 1 90 90 ASP . 6136 1 91 91 GLN . 6136 1 92 92 PHE . 6136 1 93 93 VAL . 6136 1 94 94 ASN . 6136 1 95 95 ALA . 6136 1 96 96 LYS . 6136 1 97 97 GLY . 6136 1 98 98 LYS . 6136 1 99 99 PRO . 6136 1 100 100 MET . 6136 1 101 101 ASP . 6136 1 102 102 THR . 6136 1 103 103 VAL . 6136 1 104 104 PRO . 6136 1 105 105 LEU . 6136 1 106 106 VAL . 6136 1 107 107 MET . 6136 1 108 108 MET . 6136 1 109 109 ALA . 6136 1 110 110 ALA . 6136 1 111 111 THR . 6136 1 112 112 LYS . 6136 1 113 113 ILE . 6136 1 114 114 GLY . 6136 1 115 115 GLU . 6136 1 116 116 ARG . 6136 1 117 117 GLN . 6136 1 118 118 GLY . 6136 1 119 119 GLN . 6136 1 120 120 GLU . 6136 1 121 121 LEU . 6136 1 122 122 TYR . 6136 1 123 123 LYS . 6136 1 124 124 GLU . 6136 1 125 125 MET . 6136 1 126 126 GLN . 6136 1 127 127 LYS . 6136 1 128 128 ARG . 6136 1 129 129 GLY . 6136 1 130 130 TRP . 6136 1 131 131 ASP . 6136 1 132 132 VAL . 6136 1 133 133 LYS . 6136 1 134 134 GLU . 6136 1 135 135 SER . 6136 1 136 136 ALA . 6136 1 137 137 VAL . 6136 1 138 138 MET . 6136 1 139 139 ALA . 6136 1 140 140 ILE . 6136 1 141 141 THR . 6136 1 142 142 ALA . 6136 1 143 143 ASN . 6136 1 144 144 GLU . 6136 1 145 145 LEU . 6136 1 146 146 ASP . 6136 1 147 147 THR . 6136 1 148 148 ALA . 6136 1 149 149 ARG . 6136 1 150 150 ARG . 6136 1 151 151 ARG . 6136 1 152 152 THR . 6136 1 153 153 THR . 6136 1 154 154 GLY . 6136 1 155 155 SER . 6136 1 156 156 MET . 6136 1 157 157 ASP . 6136 1 158 158 ALA . 6136 1 159 159 LEU . 6136 1 160 160 LYS . 6136 1 161 161 ALA . 6136 1 162 162 ALA . 6136 1 163 163 GLY . 6136 1 164 164 PHE . 6136 1 165 165 PRO . 6136 1 166 166 GLU . 6136 1 167 167 LYS . 6136 1 168 168 GLN . 6136 1 169 169 ILE . 6136 1 170 170 TYR . 6136 1 171 171 GLN . 6136 1 172 172 VAL . 6136 1 173 173 PRO . 6136 1 174 174 THR . 6136 1 175 175 LYS . 6136 1 176 176 SER . 6136 1 177 177 ASN . 6136 1 178 178 ASP . 6136 1 179 179 ILE . 6136 1 180 180 PRO . 6136 1 181 181 GLY . 6136 1 182 182 ALA . 6136 1 183 183 PHE . 6136 1 184 184 ASP . 6136 1 185 185 ALA . 6136 1 186 186 ALA . 6136 1 187 187 ASN . 6136 1 188 188 SER . 6136 1 189 189 MET . 6136 1 190 190 LEU . 6136 1 191 191 VAL . 6136 1 192 192 GLN . 6136 1 193 193 HIS . 6136 1 194 194 PRO . 6136 1 195 195 GLU . 6136 1 196 196 VAL . 6136 1 197 197 LYS . 6136 1 198 198 HIS . 6136 1 199 199 TRP . 6136 1 200 200 LEU . 6136 1 201 201 ILE . 6136 1 202 202 VAL . 6136 1 203 203 GLY . 6136 1 204 204 MET . 6136 1 205 205 ASN . 6136 1 206 206 ASP . 6136 1 207 207 SER . 6136 1 208 208 THR . 6136 1 209 209 VAL . 6136 1 210 210 LEU . 6136 1 211 211 GLY . 6136 1 212 212 GLY . 6136 1 213 213 VAL . 6136 1 214 214 ARG . 6136 1 215 215 ALA . 6136 1 216 216 THR . 6136 1 217 217 GLU . 6136 1 218 218 GLY . 6136 1 219 219 GLN . 6136 1 220 220 GLY . 6136 1 221 221 PHE . 6136 1 222 222 LYS . 6136 1 223 223 ALA . 6136 1 224 224 ALA . 6136 1 225 225 ASP . 6136 1 226 226 ILE . 6136 1 227 227 ILE . 6136 1 228 228 GLY . 6136 1 229 229 ILE . 6136 1 230 230 GLY . 6136 1 231 231 ILE . 6136 1 232 232 ASN . 6136 1 233 233 GLY . 6136 1 234 234 VAL . 6136 1 235 235 ASP . 6136 1 236 236 ALA . 6136 1 237 237 VAL . 6136 1 238 238 SER . 6136 1 239 239 GLU . 6136 1 240 240 LEU . 6136 1 241 241 SER . 6136 1 242 242 LYS . 6136 1 243 243 ALA . 6136 1 244 244 GLN . 6136 1 245 245 ALA . 6136 1 246 246 THR . 6136 1 247 247 GLY . 6136 1 248 248 PHE . 6136 1 249 249 TYR . 6136 1 250 250 GLY . 6136 1 251 251 SER . 6136 1 252 252 LEU . 6136 1 253 253 LEU . 6136 1 254 254 PRO . 6136 1 255 255 SER . 6136 1 256 256 PRO . 6136 1 257 257 ASP . 6136 1 258 258 VAL . 6136 1 259 259 HIS . 6136 1 260 260 GLY . 6136 1 261 261 TYR . 6136 1 262 262 LYS . 6136 1 263 263 SER . 6136 1 264 264 SER . 6136 1 265 265 GLU . 6136 1 266 266 MET . 6136 1 267 267 LEU . 6136 1 268 268 TYR . 6136 1 269 269 ASN . 6136 1 270 270 TRP . 6136 1 271 271 VAL . 6136 1 272 272 ALA . 6136 1 273 273 LYS . 6136 1 274 274 ASP . 6136 1 275 275 VAL . 6136 1 276 276 GLU . 6136 1 277 277 PRO . 6136 1 278 278 PRO . 6136 1 279 279 LYS . 6136 1 280 280 PHE . 6136 1 281 281 THR . 6136 1 282 282 GLU . 6136 1 283 283 VAL . 6136 1 284 284 THR . 6136 1 285 285 ASP . 6136 1 286 286 VAL . 6136 1 287 287 VAL . 6136 1 288 288 LEU . 6136 1 289 289 ILE . 6136 1 290 290 THR . 6136 1 291 291 ARG . 6136 1 292 292 ASP . 6136 1 293 293 ASN . 6136 1 294 294 PHE . 6136 1 295 295 LYS . 6136 1 296 296 GLU . 6136 1 297 297 GLU . 6136 1 298 298 LEU . 6136 1 299 299 GLU . 6136 1 300 300 LYS . 6136 1 301 301 LYS . 6136 1 302 302 GLY . 6136 1 303 303 LEU . 6136 1 304 304 GLY . 6136 1 305 305 GLY . 6136 1 306 306 LYS . 6136 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 . GLU 1 1 6136 1 . ASN 2 2 6136 1 . LEU 3 3 6136 1 . LYS 4 4 6136 1 . LEU 5 5 6136 1 . GLY 6 6 6136 1 . PHE 7 7 6136 1 . LEU 8 8 6136 1 . VAL 9 9 6136 1 . LYS 10 10 6136 1 . GLN 11 11 6136 1 . PRO 12 12 6136 1 . GLU 13 13 6136 1 . GLU 14 14 6136 1 . PRO 15 15 6136 1 . TRP 16 16 6136 1 . PHE 17 17 6136 1 . GLN 18 18 6136 1 . THR 19 19 6136 1 . GLU 20 20 6136 1 . TRP 21 21 6136 1 . LYS 22 22 6136 1 . PHE 23 23 6136 1 . ALA 24 24 6136 1 . ASP 25 25 6136 1 . LYS 26 26 6136 1 . ALA 27 27 6136 1 . GLY 28 28 6136 1 . LYS 29 29 6136 1 . ASP 30 30 6136 1 . LEU 31 31 6136 1 . GLY 32 32 6136 1 . PHE 33 33 6136 1 . GLU 34 34 6136 1 . VAL 35 35 6136 1 . ILE 36 36 6136 1 . LYS 37 37 6136 1 . ILE 38 38 6136 1 . ALA 39 39 6136 1 . VAL 40 40 6136 1 . PRO 41 41 6136 1 . ASP 42 42 6136 1 . GLY 43 43 6136 1 . GLU 44 44 6136 1 . LYS 45 45 6136 1 . THR 46 46 6136 1 . LEU 47 47 6136 1 . ASN 48 48 6136 1 . ALA 49 49 6136 1 . ILE 50 50 6136 1 . ASP 51 51 6136 1 . SER 52 52 6136 1 . LEU 53 53 6136 1 . ALA 54 54 6136 1 . ALA 55 55 6136 1 . SER 56 56 6136 1 . GLY 57 57 6136 1 . ALA 58 58 6136 1 . LYS 59 59 6136 1 . GLY 60 60 6136 1 . PHE 61 61 6136 1 . VAL 62 62 6136 1 . ILE 63 63 6136 1 . CYS 64 64 6136 1 . THR 65 65 6136 1 . PRO 66 66 6136 1 . ASP 67 67 6136 1 . PRO 68 68 6136 1 . LYS 69 69 6136 1 . LEU 70 70 6136 1 . GLY 71 71 6136 1 . SER 72 72 6136 1 . ALA 73 73 6136 1 . ILE 74 74 6136 1 . VAL 75 75 6136 1 . ALA 76 76 6136 1 . LYS 77 77 6136 1 . ALA 78 78 6136 1 . ARG 79 79 6136 1 . GLY 80 80 6136 1 . TYR 81 81 6136 1 . ASP 82 82 6136 1 . MET 83 83 6136 1 . LYS 84 84 6136 1 . VAL 85 85 6136 1 . ILE 86 86 6136 1 . ALA 87 87 6136 1 . VAL 88 88 6136 1 . ASP 89 89 6136 1 . ASP 90 90 6136 1 . GLN 91 91 6136 1 . PHE 92 92 6136 1 . VAL 93 93 6136 1 . ASN 94 94 6136 1 . ALA 95 95 6136 1 . LYS 96 96 6136 1 . GLY 97 97 6136 1 . LYS 98 98 6136 1 . PRO 99 99 6136 1 . MET 100 100 6136 1 . ASP 101 101 6136 1 . THR 102 102 6136 1 . VAL 103 103 6136 1 . PRO 104 104 6136 1 . LEU 105 105 6136 1 . VAL 106 106 6136 1 . MET 107 107 6136 1 . MET 108 108 6136 1 . ALA 109 109 6136 1 . ALA 110 110 6136 1 . THR 111 111 6136 1 . LYS 112 112 6136 1 . ILE 113 113 6136 1 . GLY 114 114 6136 1 . GLU 115 115 6136 1 . ARG 116 116 6136 1 . GLN 117 117 6136 1 . GLY 118 118 6136 1 . GLN 119 119 6136 1 . GLU 120 120 6136 1 . LEU 121 121 6136 1 . TYR 122 122 6136 1 . LYS 123 123 6136 1 . GLU 124 124 6136 1 . MET 125 125 6136 1 . GLN 126 126 6136 1 . LYS 127 127 6136 1 . ARG 128 128 6136 1 . GLY 129 129 6136 1 . TRP 130 130 6136 1 . ASP 131 131 6136 1 . VAL 132 132 6136 1 . LYS 133 133 6136 1 . GLU 134 134 6136 1 . SER 135 135 6136 1 . ALA 136 136 6136 1 . VAL 137 137 6136 1 . MET 138 138 6136 1 . ALA 139 139 6136 1 . ILE 140 140 6136 1 . THR 141 141 6136 1 . ALA 142 142 6136 1 . ASN 143 143 6136 1 . GLU 144 144 6136 1 . LEU 145 145 6136 1 . ASP 146 146 6136 1 . THR 147 147 6136 1 . ALA 148 148 6136 1 . ARG 149 149 6136 1 . ARG 150 150 6136 1 . ARG 151 151 6136 1 . THR 152 152 6136 1 . THR 153 153 6136 1 . GLY 154 154 6136 1 . SER 155 155 6136 1 . MET 156 156 6136 1 . ASP 157 157 6136 1 . ALA 158 158 6136 1 . LEU 159 159 6136 1 . LYS 160 160 6136 1 . ALA 161 161 6136 1 . ALA 162 162 6136 1 . GLY 163 163 6136 1 . PHE 164 164 6136 1 . PRO 165 165 6136 1 . GLU 166 166 6136 1 . LYS 167 167 6136 1 . GLN 168 168 6136 1 . ILE 169 169 6136 1 . TYR 170 170 6136 1 . GLN 171 171 6136 1 . VAL 172 172 6136 1 . PRO 173 173 6136 1 . THR 174 174 6136 1 . LYS 175 175 6136 1 . SER 176 176 6136 1 . ASN 177 177 6136 1 . ASP 178 178 6136 1 . ILE 179 179 6136 1 . PRO 180 180 6136 1 . GLY 181 181 6136 1 . ALA 182 182 6136 1 . PHE 183 183 6136 1 . ASP 184 184 6136 1 . ALA 185 185 6136 1 . ALA 186 186 6136 1 . ASN 187 187 6136 1 . SER 188 188 6136 1 . MET 189 189 6136 1 . LEU 190 190 6136 1 . VAL 191 191 6136 1 . GLN 192 192 6136 1 . HIS 193 193 6136 1 . PRO 194 194 6136 1 . GLU 195 195 6136 1 . VAL 196 196 6136 1 . LYS 197 197 6136 1 . HIS 198 198 6136 1 . TRP 199 199 6136 1 . LEU 200 200 6136 1 . ILE 201 201 6136 1 . VAL 202 202 6136 1 . GLY 203 203 6136 1 . MET 204 204 6136 1 . ASN 205 205 6136 1 . ASP 206 206 6136 1 . SER 207 207 6136 1 . THR 208 208 6136 1 . VAL 209 209 6136 1 . LEU 210 210 6136 1 . GLY 211 211 6136 1 . GLY 212 212 6136 1 . VAL 213 213 6136 1 . ARG 214 214 6136 1 . ALA 215 215 6136 1 . THR 216 216 6136 1 . GLU 217 217 6136 1 . GLY 218 218 6136 1 . GLN 219 219 6136 1 . GLY 220 220 6136 1 . PHE 221 221 6136 1 . LYS 222 222 6136 1 . ALA 223 223 6136 1 . ALA 224 224 6136 1 . ASP 225 225 6136 1 . ILE 226 226 6136 1 . ILE 227 227 6136 1 . GLY 228 228 6136 1 . ILE 229 229 6136 1 . GLY 230 230 6136 1 . ILE 231 231 6136 1 . ASN 232 232 6136 1 . GLY 233 233 6136 1 . VAL 234 234 6136 1 . ASP 235 235 6136 1 . ALA 236 236 6136 1 . VAL 237 237 6136 1 . SER 238 238 6136 1 . GLU 239 239 6136 1 . LEU 240 240 6136 1 . SER 241 241 6136 1 . LYS 242 242 6136 1 . ALA 243 243 6136 1 . GLN 244 244 6136 1 . ALA 245 245 6136 1 . THR 246 246 6136 1 . GLY 247 247 6136 1 . PHE 248 248 6136 1 . TYR 249 249 6136 1 . GLY 250 250 6136 1 . SER 251 251 6136 1 . LEU 252 252 6136 1 . LEU 253 253 6136 1 . PRO 254 254 6136 1 . SER 255 255 6136 1 . PRO 256 256 6136 1 . ASP 257 257 6136 1 . VAL 258 258 6136 1 . HIS 259 259 6136 1 . GLY 260 260 6136 1 . TYR 261 261 6136 1 . LYS 262 262 6136 1 . SER 263 263 6136 1 . SER 264 264 6136 1 . GLU 265 265 6136 1 . MET 266 266 6136 1 . LEU 267 267 6136 1 . TYR 268 268 6136 1 . ASN 269 269 6136 1 . TRP 270 270 6136 1 . VAL 271 271 6136 1 . ALA 272 272 6136 1 . LYS 273 273 6136 1 . ASP 274 274 6136 1 . VAL 275 275 6136 1 . GLU 276 276 6136 1 . PRO 277 277 6136 1 . PRO 278 278 6136 1 . LYS 279 279 6136 1 . PHE 280 280 6136 1 . THR 281 281 6136 1 . GLU 282 282 6136 1 . VAL 283 283 6136 1 . THR 284 284 6136 1 . ASP 285 285 6136 1 . VAL 286 286 6136 1 . VAL 287 287 6136 1 . LEU 288 288 6136 1 . ILE 289 289 6136 1 . THR 290 290 6136 1 . ARG 291 291 6136 1 . ASP 292 292 6136 1 . ASN 293 293 6136 1 . PHE 294 294 6136 1 . LYS 295 295 6136 1 . GLU 296 296 6136 1 . GLU 297 297 6136 1 . LEU 298 298 6136 1 . GLU 299 299 6136 1 . LYS 300 300 6136 1 . LYS 301 301 6136 1 . GLY 302 302 6136 1 . LEU 303 303 6136 1 . GLY 304 304 6136 1 . GLY 305 305 6136 1 . LYS 306 306 6136 1 stop_ save_ save_GAL _Entity.Sf_category entity _Entity.Sf_framecode GAL _Entity.Entry_ID 6136 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name GAL _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _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 . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID GAL _Entity.Nonpolymer_comp_label $chem_comp_GAL _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GAL . 6136 2 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 6136 _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.Subvariant _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.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $ABP . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . . . . . . . . . . . 6136 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 6136 _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_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _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.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $ABP . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6136 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_GAL _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_GAL _Chem_comp.Entry_ID 6136 _Chem_comp.ID GAL _Chem_comp.Provenance . _Chem_comp.Name BETA-D-GALACTOSE _Chem_comp.Type D-saccharide _Chem_comp.BMRB_code . _Chem_comp.PDB_code GAL _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 1999-07-08 _Chem_comp.Modified_date 2011-06-04 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces GLB _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code GAL _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code . _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'C6 H12 O6' _Chem_comp.Formula_weight 180.156 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code 2SBA _Chem_comp.Processing_site PDBE _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Thu Jun 23 09:51:37 2011 ; _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID OC1C(O)C(OC(O)C1O)CO SMILES ACDLabs 12.01 6136 GAL OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O SMILES_CANONICAL CACTVS 3.370 6136 GAL OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O SMILES CACTVS 3.370 6136 GAL C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O)O)O)O)O SMILES_CANONICAL 'OpenEye OEToolkits' 1.7.2 6136 GAL C(C1C(C(C(C(O1)O)O)O)O)O SMILES 'OpenEye OEToolkits' 1.7.2 6136 GAL InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6-/m1/s1 InChI InChI 1.03 6136 GAL WQZGKKKJIJFFOK-FPRJBGLDSA-N InChIKey InChI 1.03 6136 GAL stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID beta-D-galactopyranose 'SYSTEMATIC NAME' ACDLabs 12.01 6136 GAL (2R,3R,4S,5R,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.7.2 6136 GAL stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID C1 . C1 . . C . . R 0 . . . . no no . . . . 4.917 . 90.579 . 82.825 . 0.516 1.409 -0.191 1 . 6136 GAL C2 . C2 . . C . . R 0 . . . . no no . . . . 4.266 . 91.826 . 82.131 . 1.522 0.302 0.136 2 . 6136 GAL C3 . C3 . . C . . S 0 . . . . no no . . . . 4.688 . 91.932 . 80.680 . 1.103 -0.986 -0.578 3 . 6136 GAL C4 . C4 . . C . . R 0 . . . . no no . . . . 6.237 . 91.798 . 80.545 . -0.322 -1.352 -0.152 4 . 6136 GAL C5 . C5 . . C . . R 0 . . . . no no . . . . 6.741 . 90.512 . 81.139 . -1.258 -0.182 -0.468 5 . 6136 GAL C6 . C6 . . C . . N 0 . . . . no no . . . . 8.268 . 90.598 . 81.059 . -2.672 -0.516 0.009 6 . 6136 GAL O1 . O1 . . O . . N 0 . . . . no yes . . . . 5.162 . 90.127 . 84.186 . 0.870 2.599 0.517 7 . 6136 GAL O2 . O2 . . O . . N 0 . . . . no no . . . . 2.834 . 91.865 . 82.221 . 2.823 0.693 -0.308 8 . 6136 GAL O3 . O3 . . O . . N 0 . . . . no yes . . . . 4.152 . 93.123 . 80.095 . 1.995 -2.044 -0.220 9 . 6136 GAL O4 . O4 . . O . . N 0 . . . . no yes . . . . 6.919 . 92.828 . 81.225 . -0.348 -1.618 1.251 10 . 6136 GAL O5 . O5 . . O . . N 0 . . . . no no . . . . 6.348 . 90.446 . 82.531 . -0.793 0.992 0.202 11 . 6136 GAL O6 . O6 . . O . . N 0 . . . . no no . . . . 9.020 . 89.410 . 81.129 . -3.567 0.525 -0.389 12 . 6136 GAL H1 . H1 . . H . . N 0 . . . . no no . . . . 4.004 . 90.086 . 82.459 . 0.528 1.606 -1.263 13 . 6136 GAL H2 . H2 . . H . . N 0 . . . . no no . . . . 4.644 . 92.693 . 82.693 . 1.540 0.132 1.213 14 . 6136 GAL H3 . H3 . . H . . N 0 . . . . no no . . . . 4.267 . 91.093 . 80.106 . 1.133 -0.831 -1.657 15 . 6136 GAL H4 . H4 . . H . . N 0 . . . . no no . . . . 6.432 . 91.842 . 79.463 . -0.650 -2.237 -0.698 16 . 6136 GAL H5 . H5 . . H . . N 0 . . . . no no . . . . 6.343 . 89.630 . 80.615 . -1.269 -0.006 -1.544 17 . 6136 GAL H61 . H61 . . H . . N 0 . . . . no no . . . . 8.504 . 91.059 . 80.089 . -2.992 -1.459 -0.434 18 . 6136 GAL H62 . H62 . . H . . N 0 . . . . no no . . . . 8.590 . 91.221 . 81.907 . -2.678 -0.604 1.095 19 . 6136 GAL HO1 . HO1 . . H . . N 0 . . . . no no . . . . 5.598 . 89.283 . 84.166 . 0.274 3.343 0.357 20 . 6136 GAL HO2 . HO2 . . H . . N 0 . . . . no no . . . . 2.510 . 92.642 . 81.782 . 3.151 1.506 0.100 21 . 6136 GAL HO3 . HO3 . . H . . N 0 . . . . no no . . . . 4.423 . 93.179 . 79.186 . 2.918 -1.876 -0.455 22 . 6136 GAL HO4 . HO4 . . H . . N 0 . . . . no no . . . . 7.856 . 92.712 . 81.119 . 0.227 -2.347 1.524 23 . 6136 GAL HO6 . HO6 . . H . . N 0 . . . . no no . . . . 9.945 . 89.616 . 81.067 . -4.484 0.379 -0.119 24 . 6136 GAL stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING C1 C2 no N 1 . 6136 GAL 2 . SING C1 O1 no N 2 . 6136 GAL 3 . SING C1 O5 no N 3 . 6136 GAL 4 . SING C1 H1 no N 4 . 6136 GAL 5 . SING C2 C3 no N 5 . 6136 GAL 6 . SING C2 O2 no N 6 . 6136 GAL 7 . SING C2 H2 no N 7 . 6136 GAL 8 . SING C3 C4 no N 8 . 6136 GAL 9 . SING C3 O3 no N 9 . 6136 GAL 10 . SING C3 H3 no N 10 . 6136 GAL 11 . SING C4 C5 no N 11 . 6136 GAL 12 . SING C4 O4 no N 12 . 6136 GAL 13 . SING C4 H4 no N 13 . 6136 GAL 14 . SING C5 C6 no N 14 . 6136 GAL 15 . SING C5 O5 no N 15 . 6136 GAL 16 . SING C5 H5 no N 16 . 6136 GAL 17 . SING C6 O6 no N 17 . 6136 GAL 18 . SING C6 H61 no N 18 . 6136 GAL 19 . SING C6 H62 no N 19 . 6136 GAL 20 . SING O1 HO1 no N 20 . 6136 GAL 21 . SING O2 HO2 no N 21 . 6136 GAL 22 . SING O3 HO3 no N 22 . 6136 GAL 23 . SING O4 HO4 no N 23 . 6136 GAL 24 . SING O6 HO6 no N 24 . 6136 GAL stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6136 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'L-Arabinose Binding Protein' '[U-15N; U-13C; U-50% 2H]' . . 1 $ABP . . 1.5 . . mM . . . . 6136 1 2 D-GALACTOSE . . . 2 $GAL . . 1.5 . . mM . . . . 6136 1 stop_ save_ ####################### # Sample conditions # ####################### save_Exp-cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Exp-cond_1 _Sample_condition_list.Entry_ID 6136 _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 pH 7.0 0.1 pH 6136 1 temperature 308 0.2 K 6136 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 6136 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data processing' 6136 1 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 6136 _Software.ID 2 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'peak picking' 6136 2 assignments 6136 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer _NMR_spectrometer.Entry_ID 6136 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 6136 _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 NMR_spectrometer Varian INOVA . 600 . . . 6136 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 6136 _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 '1H-15N HSQC' . . . . . . . . . . . 1 $sample_1 . . . 1 $Exp-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6136 1 2 '1H-15N NOESY' . . . . . . . . . . . 1 $sample_1 . . . 1 $Exp-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6136 1 3 HNCA . . . . . . . . . . . 1 $sample_1 . . . 1 $Exp-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6136 1 4 HN(CO)CA . . . . . . . . . . . 1 $sample_1 . . . 1 $Exp-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6136 1 5 HNCO . . . . . . . . . . . 1 $sample_1 . . . 1 $Exp-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6136 1 6 HN(CA)CO . . . . . . . . . . . 1 $sample_1 . . . 1 $Exp-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6136 1 7 HN(CA)CB . . . . . . . . . . . 1 $sample_1 . . . 1 $Exp-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6136 1 8 HN(COCA)CB . . . . . . . . . . . 1 $sample_1 . . . 1 $Exp-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6136 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 6136 _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.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . 1 $entry_citation . . 1 $entry_citation 6136 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 6136 1 C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 6136 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_chem._shifts _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem._shifts _Assigned_chem_shift_list.Entry_ID 6136 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Exp-cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _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 $sample_1 . 6136 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.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 ASN C C 13 174.03 . . 1 . . . A 2 . . . 6136 1 2 . 1 1 2 2 ASN CA C 13 53.00 . . 1 . . . A 2 . . . 6136 1 3 . 1 1 2 2 ASN CB C 13 39.04 . . 1 . . . A 2 . . . 6136 1 4 . 1 1 3 3 LEU H H 1 8.52 . . 1 . . . A 3 . . . 6136 1 5 . 1 1 3 3 LEU C C 13 175.03 . . 1 . . . A 3 . . . 6136 1 6 . 1 1 3 3 LEU CA C 13 55.22 . . 1 . . . A 3 . . . 6136 1 7 . 1 1 3 3 LEU CB C 13 42.89 . . 1 . . . A 3 . . . 6136 1 8 . 1 1 3 3 LEU N N 15 124.73 . . 1 . . . A 3 . . . 6136 1 9 . 1 1 4 4 LYS H H 1 8.77 . . 1 . . . A 4 . . . 6136 1 10 . 1 1 4 4 LYS C C 13 174.96 . . 1 . . . A 4 . . . 6136 1 11 . 1 1 4 4 LYS CA C 13 54.58 . . 1 . . . A 4 . . . 6136 1 12 . 1 1 4 4 LYS CB C 13 34.73 . . 1 . . . A 4 . . . 6136 1 13 . 1 1 4 4 LYS N N 15 125.16 . . 1 . . . A 4 . . . 6136 1 14 . 1 1 5 5 LEU H H 1 8.88 . . 1 . . . A 5 . . . 6136 1 15 . 1 1 5 5 LEU C C 13 176.34 . . 1 . . . A 5 . . . 6136 1 16 . 1 1 5 5 LEU CA C 13 52.52 . . 1 . . . A 5 . . . 6136 1 17 . 1 1 5 5 LEU CB C 13 44.26 . . 1 . . . A 5 . . . 6136 1 18 . 1 1 5 5 LEU N N 15 120.89 . . 1 . . . A 5 . . . 6136 1 19 . 1 1 6 6 GLY H H 1 9.09 . . 1 . . . A 6 . . . 6136 1 20 . 1 1 6 6 GLY C C 13 173.15 . . 1 . . . A 6 . . . 6136 1 21 . 1 1 6 6 GLY CA C 13 44.62 . . 1 . . . A 6 . . . 6136 1 22 . 1 1 6 6 GLY N N 15 106.38 . . 1 . . . A 6 . . . 6136 1 23 . 1 1 7 7 PHE H H 1 8.97 . . 1 . . . A 7 . . . 6136 1 24 . 1 1 7 7 PHE C C 13 175.46 . . 1 . . . A 7 . . . 6136 1 25 . 1 1 7 7 PHE CA C 13 58.21 . . 1 . . . A 7 . . . 6136 1 26 . 1 1 7 7 PHE CB C 13 41.78 . . 1 . . . A 7 . . . 6136 1 27 . 1 1 7 7 PHE N N 15 124.30 . . 1 . . . A 7 . . . 6136 1 28 . 1 1 8 8 LEU H H 1 9.57 . . 1 . . . A 8 . . . 6136 1 29 . 1 1 8 8 LEU C C 13 176.18 . . 1 . . . A 8 . . . 6136 1 30 . 1 1 8 8 LEU CA C 13 54.00 . . 1 . . . A 8 . . . 6136 1 31 . 1 1 8 8 LEU CB C 13 42.27 . . 1 . . . A 8 . . . 6136 1 32 . 1 1 8 8 LEU N N 15 136.81 . . 1 . . . A 8 . . . 6136 1 33 . 1 1 9 9 VAL H H 1 7.59 . . 1 . . . A 9 . . . 6136 1 34 . 1 1 9 9 VAL C C 13 177.44 . . 1 . . . A 9 . . . 6136 1 35 . 1 1 9 9 VAL CA C 13 58.36 . . 1 . . . A 9 . . . 6136 1 36 . 1 1 9 9 VAL CB C 13 35.14 . . 1 . . . A 9 . . . 6136 1 37 . 1 1 9 9 VAL N N 15 110.88 . . 1 . . . A 9 . . . 6136 1 38 . 1 1 10 10 LYS H H 1 6.10 . . 1 . . . A 10 . . . 6136 1 39 . 1 1 10 10 LYS C C 13 174.72 . . 1 . . . A 10 . . . 6136 1 40 . 1 1 10 10 LYS CA C 13 56.94 . . 1 . . . A 10 . . . 6136 1 41 . 1 1 10 10 LYS CB C 13 41.95 . . 1 . . . A 10 . . . 6136 1 42 . 1 1 10 10 LYS N N 15 118.93 . . 1 . . . A 10 . . . 6136 1 43 . 1 1 12 12 PRO C C 13 175.81 . . 1 . . . A 12 . . . 6136 1 44 . 1 1 12 12 PRO CA C 13 63.74 . . 1 . . . A 12 . . . 6136 1 45 . 1 1 12 12 PRO CB C 13 32.37 . . 1 . . . A 12 . . . 6136 1 46 . 1 1 13 13 GLU H H 1 9.12 . . 1 . . . A 13 . . . 6136 1 47 . 1 1 13 13 GLU C C 13 177.77 . . 1 . . . A 13 . . . 6136 1 48 . 1 1 13 13 GLU CA C 13 57.15 . . 1 . . . A 13 . . . 6136 1 49 . 1 1 13 13 GLU CB C 13 28.61 . . 1 . . . A 13 . . . 6136 1 50 . 1 1 13 13 GLU N N 15 119.05 . . 1 . . . A 13 . . . 6136 1 51 . 1 1 14 14 GLU H H 1 7.74 . . 1 . . . A 14 . . . 6136 1 52 . 1 1 14 14 GLU C C 13 176.08 . . 1 . . . A 14 . . . 6136 1 53 . 1 1 14 14 GLU CA C 13 54.08 . . 1 . . . A 14 . . . 6136 1 54 . 1 1 14 14 GLU CB C 13 30.69 . . 1 . . . A 14 . . . 6136 1 55 . 1 1 14 14 GLU N N 15 122.17 . . 1 . . . A 14 . . . 6136 1 56 . 1 1 20 20 GLU H H 1 7.42 . . 1 . . . A 20 . . . 6136 1 57 . 1 1 20 20 GLU C C 13 178.83 . . 1 . . . A 20 . . . 6136 1 58 . 1 1 20 20 GLU CA C 13 60.75 . . 1 . . . A 20 . . . 6136 1 59 . 1 1 20 20 GLU CB C 13 28.25 . . 1 . . . A 20 . . . 6136 1 60 . 1 1 20 20 GLU N N 15 123.01 . . 1 . . . A 20 . . . 6136 1 61 . 1 1 21 21 TRP H H 1 7.74 . . 1 . . . A 21 . . . 6136 1 62 . 1 1 21 21 TRP C C 13 177.54 . . 1 . . . A 21 . . . 6136 1 63 . 1 1 21 21 TRP CA C 13 57.26 . . 1 . . . A 21 . . . 6136 1 64 . 1 1 21 21 TRP CB C 13 29.70 . . 1 . . . A 21 . . . 6136 1 65 . 1 1 21 21 TRP N N 15 117.61 . . 1 . . . A 21 . . . 6136 1 66 . 1 1 22 22 LYS H H 1 7.81 . . 1 . . . A 22 . . . 6136 1 67 . 1 1 22 22 LYS C C 13 179.73 . . 1 . . . A 22 . . . 6136 1 68 . 1 1 22 22 LYS CA C 13 59.15 . . 1 . . . A 22 . . . 6136 1 69 . 1 1 22 22 LYS CB C 13 32.35 . . 1 . . . A 22 . . . 6136 1 70 . 1 1 22 22 LYS N N 15 119.33 . . 1 . . . A 22 . . . 6136 1 71 . 1 1 23 23 PHE H H 1 8.11 . . 1 . . . A 23 . . . 6136 1 72 . 1 1 23 23 PHE C C 13 177.06 . . 1 . . . A 23 . . . 6136 1 73 . 1 1 23 23 PHE CA C 13 62.13 . . 1 . . . A 23 . . . 6136 1 74 . 1 1 23 23 PHE CB C 13 39.91 . . 1 . . . A 23 . . . 6136 1 75 . 1 1 23 23 PHE N N 15 118.98 . . 1 . . . A 23 . . . 6136 1 76 . 1 1 24 24 ALA H H 1 8.50 . . 1 . . . A 24 . . . 6136 1 77 . 1 1 24 24 ALA C C 13 179.43 . . 1 . . . A 24 . . . 6136 1 78 . 1 1 24 24 ALA CA C 13 55.20 . . 1 . . . A 24 . . . 6136 1 79 . 1 1 24 24 ALA CB C 13 18.98 . . 1 . . . A 24 . . . 6136 1 80 . 1 1 24 24 ALA N N 15 128.21 . . 1 . . . A 24 . . . 6136 1 81 . 1 1 25 25 ASP H H 1 7.89 . . 1 . . . A 25 . . . 6136 1 82 . 1 1 25 25 ASP C C 13 179.97 . . 1 . . . A 25 . . . 6136 1 83 . 1 1 25 25 ASP CA C 13 56.84 . . 1 . . . A 25 . . . 6136 1 84 . 1 1 25 25 ASP CB C 13 39.91 . . 1 . . . A 25 . . . 6136 1 85 . 1 1 25 25 ASP N N 15 117.61 . . 1 . . . A 25 . . . 6136 1 86 . 1 1 26 26 LYS H H 1 7.21 . . 1 . . . A 26 . . . 6136 1 87 . 1 1 26 26 LYS C C 13 177.39 . . 1 . . . A 26 . . . 6136 1 88 . 1 1 26 26 LYS CA C 13 59.58 . . 1 . . . A 26 . . . 6136 1 89 . 1 1 26 26 LYS CB C 13 32.07 . . 1 . . . A 26 . . . 6136 1 90 . 1 1 26 26 LYS N N 15 121.68 . . 1 . . . A 26 . . . 6136 1 91 . 1 1 27 27 ALA H H 1 7.70 . . 1 . . . A 27 . . . 6136 1 92 . 1 1 27 27 ALA C C 13 178.34 . . 1 . . . A 27 . . . 6136 1 93 . 1 1 27 27 ALA CA C 13 55.60 . . 1 . . . A 27 . . . 6136 1 94 . 1 1 27 27 ALA CB C 13 16.17 . . 1 . . . A 27 . . . 6136 1 95 . 1 1 27 27 ALA N N 15 124.32 . . 1 . . . A 27 . . . 6136 1 96 . 1 1 28 28 GLY H H 1 7.95 . . 1 . . . A 28 . . . 6136 1 97 . 1 1 28 28 GLY C C 13 177.33 . . 1 . . . A 28 . . . 6136 1 98 . 1 1 28 28 GLY CA C 13 45.84 . . 1 . . . A 28 . . . 6136 1 99 . 1 1 28 28 GLY N N 15 107.70 . . 1 . . . A 28 . . . 6136 1 100 . 1 1 29 29 LYS H H 1 7.63 . . 1 . . . A 29 . . . 6136 1 101 . 1 1 29 29 LYS C C 13 179.00 . . 1 . . . A 29 . . . 6136 1 102 . 1 1 29 29 LYS CA C 13 58.02 . . 1 . . . A 29 . . . 6136 1 103 . 1 1 29 29 LYS CB C 13 31.65 . . 1 . . . A 29 . . . 6136 1 104 . 1 1 29 29 LYS N N 15 124.10 . . 1 . . . A 29 . . . 6136 1 105 . 1 1 30 30 ASP H H 1 8.31 . . 1 . . . A 30 . . . 6136 1 106 . 1 1 30 30 ASP C C 13 178.49 . . 1 . . . A 30 . . . 6136 1 107 . 1 1 30 30 ASP CA C 13 56.70 . . 1 . . . A 30 . . . 6136 1 108 . 1 1 30 30 ASP CB C 13 40.20 . . 1 . . . A 30 . . . 6136 1 109 . 1 1 30 30 ASP N N 15 120.68 . . 1 . . . A 30 . . . 6136 1 110 . 1 1 31 31 LEU H H 1 8.21 . . 1 . . . A 31 . . . 6136 1 111 . 1 1 31 31 LEU C C 13 176.67 . . 1 . . . A 31 . . . 6136 1 112 . 1 1 31 31 LEU CA C 13 55.15 . . 1 . . . A 31 . . . 6136 1 113 . 1 1 31 31 LEU CB C 13 41.63 . . 1 . . . A 31 . . . 6136 1 114 . 1 1 31 31 LEU N N 15 118.38 . . 1 . . . A 31 . . . 6136 1 115 . 1 1 32 32 GLY H H 1 7.53 . . 1 . . . A 32 . . . 6136 1 116 . 1 1 32 32 GLY C C 13 173.62 . . 1 . . . A 32 . . . 6136 1 117 . 1 1 32 32 GLY CA C 13 46.36 . . 1 . . . A 32 . . . 6136 1 118 . 1 1 32 32 GLY N N 15 108.26 . . 1 . . . A 32 . . . 6136 1 119 . 1 1 33 33 PHE H H 1 8.46 . . 1 . . . A 33 . . . 6136 1 120 . 1 1 33 33 PHE C C 13 172.59 . . 1 . . . A 33 . . . 6136 1 121 . 1 1 33 33 PHE CA C 13 55.81 . . 1 . . . A 33 . . . 6136 1 122 . 1 1 33 33 PHE CB C 13 40.94 . . 1 . . . A 33 . . . 6136 1 123 . 1 1 33 33 PHE N N 15 118.19 . . 1 . . . A 33 . . . 6136 1 124 . 1 1 34 34 GLU H H 1 8.75 . . 1 . . . A 34 . . . 6136 1 125 . 1 1 34 34 GLU C C 13 174.79 . . 1 . . . A 34 . . . 6136 1 126 . 1 1 34 34 GLU CA C 13 54.53 . . 1 . . . A 34 . . . 6136 1 127 . 1 1 34 34 GLU CB C 13 32.15 . . 1 . . . A 34 . . . 6136 1 128 . 1 1 34 34 GLU N N 15 121.30 . . 1 . . . A 34 . . . 6136 1 129 . 1 1 35 35 VAL H H 1 8.59 . . 1 . . . A 35 . . . 6136 1 130 . 1 1 35 35 VAL C C 13 176.70 . . 1 . . . A 35 . . . 6136 1 131 . 1 1 35 35 VAL CA C 13 60.74 . . 1 . . . A 35 . . . 6136 1 132 . 1 1 35 35 VAL CB C 13 32.21 . . 1 . . . A 35 . . . 6136 1 133 . 1 1 35 35 VAL N N 15 125.72 . . 1 . . . A 35 . . . 6136 1 134 . 1 1 36 36 ILE H H 1 9.06 . . 1 . . . A 36 . . . 6136 1 135 . 1 1 36 36 ILE C C 13 174.67 . . 1 . . . A 36 . . . 6136 1 136 . 1 1 36 36 ILE CA C 13 60.74 . . 1 . . . A 36 . . . 6136 1 137 . 1 1 36 36 ILE CB C 13 37.64 . . 1 . . . A 36 . . . 6136 1 138 . 1 1 36 36 ILE N N 15 131.51 . . 1 . . . A 36 . . . 6136 1 139 . 1 1 37 37 LYS H H 1 8.37 . . 1 . . . A 37 . . . 6136 1 140 . 1 1 37 37 LYS C C 13 176.02 . . 1 . . . A 37 . . . 6136 1 141 . 1 1 37 37 LYS CA C 13 55.69 . . 1 . . . A 37 . . . 6136 1 142 . 1 1 37 37 LYS CB C 13 30.15 . . 1 . . . A 37 . . . 6136 1 143 . 1 1 37 37 LYS N N 15 131.31 . . 1 . . . A 37 . . . 6136 1 144 . 1 1 38 38 ILE H H 1 7.64 . . 1 . . . A 38 . . . 6136 1 145 . 1 1 38 38 ILE C C 13 174.99 . . 1 . . . A 38 . . . 6136 1 146 . 1 1 38 38 ILE CA C 13 60.83 . . 1 . . . A 38 . . . 6136 1 147 . 1 1 38 38 ILE CB C 13 42.20 . . 1 . . . A 38 . . . 6136 1 148 . 1 1 38 38 ILE N N 15 123.36 . . 1 . . . A 38 . . . 6136 1 149 . 1 1 39 39 ALA H H 1 9.03 . . 1 . . . A 39 . . . 6136 1 150 . 1 1 39 39 ALA C C 13 175.00 . . 1 . . . A 39 . . . 6136 1 151 . 1 1 39 39 ALA CA C 13 51.55 . . 1 . . . A 39 . . . 6136 1 152 . 1 1 39 39 ALA CB C 13 20.89 . . 1 . . . A 39 . . . 6136 1 153 . 1 1 39 39 ALA N N 15 131.86 . . 1 . . . A 39 . . . 6136 1 154 . 1 1 40 40 VAL H H 1 8.184 . . 1 . . . A 40 . . . 6136 1 155 . 1 1 40 40 VAL C C 13 172.64 . . 1 . . . A 40 . . . 6136 1 156 . 1 1 40 40 VAL CA C 13 56.003 . . 1 . . . A 40 . . . 6136 1 157 . 1 1 40 40 VAL CB C 13 31.54 . . 1 . . . A 40 . . . 6136 1 158 . 1 1 40 40 VAL N N 15 112.363 . . 1 . . . A 40 . . . 6136 1 159 . 1 1 43 43 GLY C C 13 174.63 . . 1 . . . A 43 . . . 6136 1 160 . 1 1 43 43 GLY CA C 13 48.46 . . 1 . . . A 43 . . . 6136 1 161 . 1 1 44 44 GLU H H 1 8.161 . . 1 . . . A 44 . . . 6136 1 162 . 1 1 44 44 GLU C C 13 179.67 . . 1 . . . A 44 . . . 6136 1 163 . 1 1 44 44 GLU CA C 13 59.661 . . 1 . . . A 44 . . . 6136 1 164 . 1 1 44 44 GLU CB C 13 29.51 . . 1 . . . A 44 . . . 6136 1 165 . 1 1 44 44 GLU N N 15 124.927 . . 1 . . . A 44 . . . 6136 1 166 . 1 1 45 45 LYS H H 1 8.953 . . 1 . . . A 45 . . . 6136 1 167 . 1 1 45 45 LYS C C 13 180.13 . . 1 . . . A 45 . . . 6136 1 168 . 1 1 45 45 LYS CA C 13 58.624 . . 1 . . . A 45 . . . 6136 1 169 . 1 1 45 45 LYS CB C 13 32.31 . . 1 . . . A 45 . . . 6136 1 170 . 1 1 45 45 LYS N N 15 118.212 . . 1 . . . A 45 . . . 6136 1 171 . 1 1 46 46 THR H H 1 7.896 . . 1 . . . A 46 . . . 6136 1 172 . 1 1 46 46 THR C C 13 174.92 . . 1 . . . A 46 . . . 6136 1 173 . 1 1 46 46 THR CA C 13 67.544 . . 1 . . . A 46 . . . 6136 1 174 . 1 1 46 46 THR CB C 13 67.01 . . 1 . . . A 46 . . . 6136 1 175 . 1 1 46 46 THR N N 15 118.272 . . 1 . . . A 46 . . . 6136 1 176 . 1 1 47 47 LEU H H 1 7.591 . . 1 . . . A 47 . . . 6136 1 177 . 1 1 47 47 LEU C C 13 179.18 . . 1 . . . A 47 . . . 6136 1 178 . 1 1 47 47 LEU CA C 13 58.218 . . 1 . . . A 47 . . . 6136 1 179 . 1 1 47 47 LEU CB C 13 39.44 . . 1 . . . A 47 . . . 6136 1 180 . 1 1 47 47 LEU N N 15 120.622 . . 1 . . . A 47 . . . 6136 1 181 . 1 1 48 48 ASN H H 1 8.012 . . 1 . . . A 48 . . . 6136 1 182 . 1 1 48 48 ASN C C 13 178.02 . . 1 . . . A 48 . . . 6136 1 183 . 1 1 48 48 ASN CA C 13 55.545 . . 1 . . . A 48 . . . 6136 1 184 . 1 1 48 48 ASN CB C 13 38.31 . . 1 . . . A 48 . . . 6136 1 185 . 1 1 48 48 ASN N N 15 117.205 . . 1 . . . A 48 . . . 6136 1 186 . 1 1 49 49 ALA H H 1 8.062 . . 1 . . . A 49 . . . 6136 1 187 . 1 1 49 49 ALA C C 13 179.32 . . 1 . . . A 49 . . . 6136 1 188 . 1 1 49 49 ALA CA C 13 54.507 . . 1 . . . A 49 . . . 6136 1 189 . 1 1 49 49 ALA CB C 13 19.42 . . 1 . . . A 49 . . . 6136 1 190 . 1 1 49 49 ALA N N 15 123.856 . . 1 . . . A 49 . . . 6136 1 191 . 1 1 50 50 ILE H H 1 7.315 . . 1 . . . A 50 . . . 6136 1 192 . 1 1 50 50 ILE C C 13 177.47 . . 1 . . . A 50 . . . 6136 1 193 . 1 1 50 50 ILE CA C 13 65.735 . . 1 . . . A 50 . . . 6136 1 194 . 1 1 50 50 ILE CB C 13 37.62 . . 1 . . . A 50 . . . 6136 1 195 . 1 1 50 50 ILE N N 15 119.141 . . 1 . . . A 50 . . . 6136 1 196 . 1 1 51 51 ASP H H 1 7.340 . . 1 . . . A 51 . . . 6136 1 197 . 1 1 51 51 ASP C C 13 179.14 . . 1 . . . A 51 . . . 6136 1 198 . 1 1 51 51 ASP CA C 13 57.799 . . 1 . . . A 51 . . . 6136 1 199 . 1 1 51 51 ASP CB C 13 39.67 . . 1 . . . A 51 . . . 6136 1 200 . 1 1 51 51 ASP N N 15 119.602 . . 1 . . . A 51 . . . 6136 1 201 . 1 1 52 52 SER H H 1 8.134 . . 1 . . . A 52 . . . 6136 1 202 . 1 1 52 52 SER C C 13 177.56 . . 1 . . . A 52 . . . 6136 1 203 . 1 1 52 52 SER CA C 13 61.151 . . 1 . . . A 52 . . . 6136 1 204 . 1 1 52 52 SER CB C 13 62.54 . . 1 . . . A 52 . . . 6136 1 205 . 1 1 52 52 SER N N 15 118.304 . . 1 . . . A 52 . . . 6136 1 206 . 1 1 53 53 LEU H H 1 8.240 . . 1 . . . A 53 . . . 6136 1 207 . 1 1 53 53 LEU C C 13 178.91 . . 1 . . . A 53 . . . 6136 1 208 . 1 1 53 53 LEU CA C 13 57.050 . . 1 . . . A 53 . . . 6136 1 209 . 1 1 53 53 LEU CB C 13 41.37 . . 1 . . . A 53 . . . 6136 1 210 . 1 1 53 53 LEU N N 15 122.758 . . 1 . . . A 53 . . . 6136 1 211 . 1 1 54 54 ALA H H 1 7.627 . . 1 . . . A 54 . . . 6136 1 212 . 1 1 54 54 ALA C C 13 181.50 . . 1 . . . A 54 . . . 6136 1 213 . 1 1 54 54 ALA CA C 13 54.686 . . 1 . . . A 54 . . . 6136 1 214 . 1 1 54 54 ALA CB C 13 16.02 . . 1 . . . A 54 . . . 6136 1 215 . 1 1 54 54 ALA N N 15 123.641 . . 1 . . . A 54 . . . 6136 1 216 . 1 1 55 55 ALA H H 1 7.608 . . 1 . . . A 55 . . . 6136 1 217 . 1 1 55 55 ALA C C 13 179.66 . . 1 . . . A 55 . . . 6136 1 218 . 1 1 55 55 ALA CA C 13 54.498 . . 1 . . . A 55 . . . 6136 1 219 . 1 1 55 55 ALA CB C 13 17.65 . . 1 . . . A 55 . . . 6136 1 220 . 1 1 55 55 ALA N N 15 122.999 . . 1 . . . A 55 . . . 6136 1 221 . 1 1 56 56 SER H H 1 7.584 . . 1 . . . A 56 . . . 6136 1 222 . 1 1 56 56 SER C C 13 173.71 . . 1 . . . A 56 . . . 6136 1 223 . 1 1 56 56 SER CA C 13 59.292 . . 1 . . . A 56 . . . 6136 1 224 . 1 1 56 56 SER CB C 13 64.09 . . 1 . . . A 56 . . . 6136 1 225 . 1 1 56 56 SER N N 15 113.118 . . 1 . . . A 56 . . . 6136 1 226 . 1 1 57 57 GLY H H 1 7.646 . . 1 . . . A 57 . . . 6136 1 227 . 1 1 57 57 GLY C C 13 175.28 . . 1 . . . A 57 . . . 6136 1 228 . 1 1 57 57 GLY CA C 13 45.036 . . 1 . . . A 57 . . . 6136 1 229 . 1 1 57 57 GLY N N 15 108.493 . . 1 . . . A 57 . . . 6136 1 230 . 1 1 58 58 ALA H H 1 7.896 . . 1 . . . A 58 . . . 6136 1 231 . 1 1 58 58 ALA C C 13 177.76 . . 1 . . . A 58 . . . 6136 1 232 . 1 1 58 58 ALA CA C 13 51.939 . . 1 . . . A 58 . . . 6136 1 233 . 1 1 58 58 ALA CB C 13 19.84 . . 1 . . . A 58 . . . 6136 1 234 . 1 1 58 58 ALA N N 15 122.326 . . 1 . . . A 58 . . . 6136 1 235 . 1 1 59 59 LYS H H 1 7.533 . . 1 . . . A 59 . . . 6136 1 236 . 1 1 59 59 LYS C C 13 176.41 . . 1 . . . A 59 . . . 6136 1 237 . 1 1 59 59 LYS CA C 13 54.695 . . 1 . . . A 59 . . . 6136 1 238 . 1 1 59 59 LYS CB C 13 33.55 . . 1 . . . A 59 . . . 6136 1 239 . 1 1 59 59 LYS N N 15 115.999 . . 1 . . . A 59 . . . 6136 1 240 . 1 1 60 60 GLY H H 1 7.537 . . 1 . . . A 60 . . . 6136 1 241 . 1 1 60 60 GLY C C 13 170.73 . . 1 . . . A 60 . . . 6136 1 242 . 1 1 60 60 GLY CA C 13 46.272 . . 1 . . . A 60 . . . 6136 1 243 . 1 1 60 60 GLY N N 15 105.222 . . 1 . . . A 60 . . . 6136 1 244 . 1 1 61 61 PHE H H 1 8.586 . . 1 . . . A 61 . . . 6136 1 245 . 1 1 61 61 PHE C C 13 171.39 . . 1 . . . A 61 . . . 6136 1 246 . 1 1 61 61 PHE CA C 13 56.24 . . 1 . . . A 61 . . . 6136 1 247 . 1 1 61 61 PHE CB C 13 39.74 . . 1 . . . A 61 . . . 6136 1 248 . 1 1 61 61 PHE N N 15 116.837 . . 1 . . . A 61 . . . 6136 1 249 . 1 1 62 62 VAL H H 1 8.015 . . 1 . . . A 62 . . . 6136 1 250 . 1 1 62 62 VAL C C 13 176.23 . . 1 . . . A 62 . . . 6136 1 251 . 1 1 62 62 VAL CA C 13 57.866 . . 1 . . . A 62 . . . 6136 1 252 . 1 1 62 62 VAL N N 15 121.928 . . 1 . . . A 62 . . . 6136 1 253 . 1 1 63 63 ILE H H 1 8.714 . . 1 . . . A 63 . . . 6136 1 254 . 1 1 63 63 ILE C C 13 174.75 . . 1 . . . A 63 . . . 6136 1 255 . 1 1 63 63 ILE CA C 13 57.590 . . 1 . . . A 63 . . . 6136 1 256 . 1 1 63 63 ILE CB C 13 42.69 . . 1 . . . A 63 . . . 6136 1 257 . 1 1 63 63 ILE N N 15 123.427 . . 1 . . . A 63 . . . 6136 1 258 . 1 1 64 64 CYS H H 1 8.657 . . 1 . . . A 64 . . . 6136 1 259 . 1 1 64 64 CYS C C 13 173.80 . . 1 . . . A 64 . . . 6136 1 260 . 1 1 64 64 CYS CA C 13 57.618 . . 1 . . . A 64 . . . 6136 1 261 . 1 1 64 64 CYS CB C 13 27.30 . . 1 . . . A 64 . . . 6136 1 262 . 1 1 64 64 CYS N N 15 131.553 . . 1 . . . A 64 . . . 6136 1 263 . 1 1 65 65 THR H H 1 9.410 . . 1 . . . A 65 . . . 6136 1 264 . 1 1 65 65 THR C C 13 170.91 . . 1 . . . A 65 . . . 6136 1 265 . 1 1 65 65 THR CA C 13 57.095 . . 1 . . . A 65 . . . 6136 1 266 . 1 1 65 65 THR CB C 13 71.03 . . 1 . . . A 65 . . . 6136 1 267 . 1 1 65 65 THR N N 15 123.187 . . 1 . . . A 65 . . . 6136 1 268 . 1 1 68 68 PRO C C 13 178.34 . . 1 . . . A 68 . . . 6136 1 269 . 1 1 68 68 PRO CA C 13 66.29 . . 1 . . . A 68 . . . 6136 1 270 . 1 1 68 68 PRO CB C 13 33.64 . . 1 . . . A 68 . . . 6136 1 271 . 1 1 69 69 LYS H H 1 8.377 . . 1 . . . A 69 . . . 6136 1 272 . 1 1 69 69 LYS C C 13 178.15 . . 1 . . . A 69 . . . 6136 1 273 . 1 1 69 69 LYS CA C 13 57.863 . . 1 . . . A 69 . . . 6136 1 274 . 1 1 69 69 LYS CB C 13 30.83 . . 1 . . . A 69 . . . 6136 1 275 . 1 1 69 69 LYS N N 15 115.929 . . 1 . . . A 69 . . . 6136 1 276 . 1 1 70 70 LEU H H 1 7.657 . . 1 . . . A 70 . . . 6136 1 277 . 1 1 70 70 LEU C C 13 176.40 . . 1 . . . A 70 . . . 6136 1 278 . 1 1 70 70 LEU CA C 13 54.578 . . 1 . . . A 70 . . . 6136 1 279 . 1 1 70 70 LEU CB C 13 42.74 . . 1 . . . A 70 . . . 6136 1 280 . 1 1 70 70 LEU N N 15 120.812 . . 1 . . . A 70 . . . 6136 1 281 . 1 1 71 71 GLY H H 1 7.724 . . 1 . . . A 71 . . . 6136 1 282 . 1 1 71 71 GLY C C 13 173.75 . . 1 . . . A 71 . . . 6136 1 283 . 1 1 71 71 GLY CA C 13 47.975 . . 1 . . . A 71 . . . 6136 1 284 . 1 1 71 71 GLY N N 15 106.036 . . 1 . . . A 71 . . . 6136 1 285 . 1 1 72 72 SER H H 1 9.013 . . 1 . . . A 72 . . . 6136 1 286 . 1 1 72 72 SER C C 13 176.31 . . 1 . . . A 72 . . . 6136 1 287 . 1 1 72 72 SER CA C 13 62.676 . . 1 . . . A 72 . . . 6136 1 288 . 1 1 72 72 SER CB C 13 62.26 . . 1 . . . A 72 . . . 6136 1 289 . 1 1 72 72 SER N N 15 117.244 . . 1 . . . A 72 . . . 6136 1 290 . 1 1 73 73 ALA H H 1 7.950 . . 1 . . . A 73 . . . 6136 1 291 . 1 1 73 73 ALA C C 13 180.63 . . 1 . . . A 73 . . . 6136 1 292 . 1 1 73 73 ALA CA C 13 54.480 . . 1 . . . A 73 . . . 6136 1 293 . 1 1 73 73 ALA CB C 13 18.28 . . 1 . . . A 73 . . . 6136 1 294 . 1 1 73 73 ALA N N 15 127.124 . . 1 . . . A 73 . . . 6136 1 295 . 1 1 74 74 ILE H H 1 8.312 . . 1 . . . A 74 . . . 6136 1 296 . 1 1 74 74 ILE C C 13 177.47 . . 1 . . . A 74 . . . 6136 1 297 . 1 1 74 74 ILE CA C 13 65.493 . . 1 . . . A 74 . . . 6136 1 298 . 1 1 74 74 ILE CB C 13 37.94 . . 1 . . . A 74 . . . 6136 1 299 . 1 1 74 74 ILE N N 15 119.983 . . 1 . . . A 74 . . . 6136 1 300 . 1 1 75 75 VAL H H 1 8.187 . . 1 . . . A 75 . . . 6136 1 301 . 1 1 75 75 VAL C C 13 178.25 . . 1 . . . A 75 . . . 6136 1 302 . 1 1 75 75 VAL CA C 13 66.843 . . 1 . . . A 75 . . . 6136 1 303 . 1 1 75 75 VAL CB C 13 31.71 . . 1 . . . A 75 . . . 6136 1 304 . 1 1 75 75 VAL N N 15 118.280 . . 1 . . . A 75 . . . 6136 1 305 . 1 1 76 76 ALA H H 1 7.981 . . 1 . . . A 76 . . . 6136 1 306 . 1 1 76 76 ALA C C 13 180.94 . . 1 . . . A 76 . . . 6136 1 307 . 1 1 76 76 ALA CA C 13 55.000 . . 1 . . . A 76 . . . 6136 1 308 . 1 1 76 76 ALA CB C 13 18.06 . . 1 . . . A 76 . . . 6136 1 309 . 1 1 76 76 ALA N N 15 122.156 . . 1 . . . A 76 . . . 6136 1 310 . 1 1 77 77 LYS H H 1 7.861 . . 1 . . . A 77 . . . 6136 1 311 . 1 1 77 77 LYS C C 13 179.02 . . 1 . . . A 77 . . . 6136 1 312 . 1 1 77 77 LYS CA C 13 58.443 . . 1 . . . A 77 . . . 6136 1 313 . 1 1 77 77 LYS CB C 13 31.85 . . 1 . . . A 77 . . . 6136 1 314 . 1 1 77 77 LYS N N 15 119.785 . . 1 . . . A 77 . . . 6136 1 315 . 1 1 78 78 ALA H H 1 8.586 . . 1 . . . A 78 . . . 6136 1 316 . 1 1 78 78 ALA C C 13 180.22 . . 1 . . . A 78 . . . 6136 1 317 . 1 1 78 78 ALA CA C 13 55.656 . . 1 . . . A 78 . . . 6136 1 318 . 1 1 78 78 ALA CB C 13 18.61 . . 1 . . . A 78 . . . 6136 1 319 . 1 1 78 78 ALA N N 15 121.231 . . 1 . . . A 78 . . . 6136 1 320 . 1 1 79 79 ARG H H 1 8.628 . . 1 . . . A 79 . . . 6136 1 321 . 1 1 79 79 ARG C C 13 180.92 . . 1 . . . A 79 . . . 6136 1 322 . 1 1 79 79 ARG CA C 13 58.846 . . 1 . . . A 79 . . . 6136 1 323 . 1 1 79 79 ARG CB C 13 29.44 . . 1 . . . A 79 . . . 6136 1 324 . 1 1 79 79 ARG N N 15 119.183 . . 1 . . . A 79 . . . 6136 1 325 . 1 1 80 80 GLY H H 1 7.567 . . 1 . . . A 80 . . . 6136 1 326 . 1 1 80 80 GLY C C 13 174.73 . . 1 . . . A 80 . . . 6136 1 327 . 1 1 80 80 GLY CA C 13 46.456 . . 1 . . . A 80 . . . 6136 1 328 . 1 1 80 80 GLY N N 15 108.045 . . 1 . . . A 80 . . . 6136 1 329 . 1 1 81 81 TYR H H 1 7.071 . . 1 . . . A 81 . . . 6136 1 330 . 1 1 81 81 TYR C C 13 174.70 . . 1 . . . A 81 . . . 6136 1 331 . 1 1 81 81 TYR CA C 13 55.471 . . 1 . . . A 81 . . . 6136 1 332 . 1 1 81 81 TYR CB C 13 39.35 . . 1 . . . A 81 . . . 6136 1 333 . 1 1 81 81 TYR N N 15 118.318 . . 1 . . . A 81 . . . 6136 1 334 . 1 1 82 82 ASP H H 1 8.015 . . 1 . . . A 82 . . . 6136 1 335 . 1 1 82 82 ASP C C 13 174.80 . . 1 . . . A 82 . . . 6136 1 336 . 1 1 82 82 ASP CA C 13 55.295 . . 1 . . . A 82 . . . 6136 1 337 . 1 1 82 82 ASP CB C 13 39.77 . . 1 . . . A 82 . . . 6136 1 338 . 1 1 82 82 ASP N N 15 120.408 . . 1 . . . A 82 . . . 6136 1 339 . 1 1 83 83 MET H H 1 8.016 . . 1 . . . A 83 . . . 6136 1 340 . 1 1 83 83 MET C C 13 175.56 . . 1 . . . A 83 . . . 6136 1 341 . 1 1 83 83 MET CA C 13 54.947 . . 1 . . . A 83 . . . 6136 1 342 . 1 1 83 83 MET CB C 13 36.03 . . 1 . . . A 83 . . . 6136 1 343 . 1 1 83 83 MET N N 15 115.892 . . 1 . . . A 83 . . . 6136 1 344 . 1 1 84 84 LYS H H 1 6.914 . . 1 . . . A 84 . . . 6136 1 345 . 1 1 84 84 LYS C C 13 174.62 . . 1 . . . A 84 . . . 6136 1 346 . 1 1 84 84 LYS CA C 13 54.545 . . 1 . . . A 84 . . . 6136 1 347 . 1 1 84 84 LYS CB C 13 33.30 . . 1 . . . A 84 . . . 6136 1 348 . 1 1 84 84 LYS N N 15 121.533 . . 1 . . . A 84 . . . 6136 1 349 . 1 1 85 85 VAL H H 1 6.901 . . 1 . . . A 85 . . . 6136 1 350 . 1 1 85 85 VAL C C 13 174.51 . . 1 . . . A 85 . . . 6136 1 351 . 1 1 85 85 VAL CA C 13 60.206 . . 1 . . . A 85 . . . 6136 1 352 . 1 1 85 85 VAL CB C 13 34.93 . . 1 . . . A 85 . . . 6136 1 353 . 1 1 85 85 VAL N N 15 119.330 . . 1 . . . A 85 . . . 6136 1 354 . 1 1 86 86 ILE H H 1 7.861 . . 1 . . . A 86 . . . 6136 1 355 . 1 1 86 86 ILE C C 13 173.52 . . 1 . . . A 86 . . . 6136 1 356 . 1 1 86 86 ILE CA C 13 59.954 . . 1 . . . A 86 . . . 6136 1 357 . 1 1 86 86 ILE CB C 13 41.68 . . 1 . . . A 86 . . . 6136 1 358 . 1 1 86 86 ILE N N 15 124.755 . . 1 . . . A 86 . . . 6136 1 359 . 1 1 87 87 ALA H H 1 8.766 . . 1 . . . A 87 . . . 6136 1 360 . 1 1 87 87 ALA C C 13 174.52 . . 1 . . . A 87 . . . 6136 1 361 . 1 1 87 87 ALA CA C 13 49.887 . . 1 . . . A 87 . . . 6136 1 362 . 1 1 87 87 ALA CB C 13 21.34 . . 1 . . . A 87 . . . 6136 1 363 . 1 1 87 87 ALA N N 15 129.794 . . 1 . . . A 87 . . . 6136 1 364 . 1 1 88 88 VAL H H 1 8.366 . . 1 . . . A 88 . . . 6136 1 365 . 1 1 88 88 VAL C C 13 175.41 . . 1 . . . A 88 . . . 6136 1 366 . 1 1 88 88 VAL CA C 13 58.276 . . 1 . . . A 88 . . . 6136 1 367 . 1 1 88 88 VAL CB C 13 36.41 . . 1 . . . A 88 . . . 6136 1 368 . 1 1 88 88 VAL N N 15 122.626 . . 1 . . . A 88 . . . 6136 1 369 . 1 1 89 89 ASP H H 1 8.868 . . 1 . . . A 89 . . . 6136 1 370 . 1 1 89 89 ASP C C 13 176.52 . . 1 . . . A 89 . . . 6136 1 371 . 1 1 89 89 ASP CA C 13 62.485 . . 1 . . . A 89 . . . 6136 1 372 . 1 1 89 89 ASP CB C 13 41.33 . . 1 . . . A 89 . . . 6136 1 373 . 1 1 89 89 ASP N N 15 116.949 . . 1 . . . A 89 . . . 6136 1 374 . 1 1 90 90 ASP H H 1 9.146 . . 1 . . . A 90 . . . 6136 1 375 . 1 1 90 90 ASP C C 13 174.73 . . 1 . . . A 90 . . . 6136 1 376 . 1 1 90 90 ASP CA C 13 53.038 . . 1 . . . A 90 . . . 6136 1 377 . 1 1 90 90 ASP CB C 13 40.81 . . 1 . . . A 90 . . . 6136 1 378 . 1 1 90 90 ASP N N 15 125.777 . . 1 . . . A 90 . . . 6136 1 379 . 1 1 91 91 GLN H H 1 8.229 . . 1 . . . A 91 . . . 6136 1 380 . 1 1 91 91 GLN C C 13 175.88 . . 1 . . . A 91 . . . 6136 1 381 . 1 1 91 91 GLN CA C 13 55.563 . . 1 . . . A 91 . . . 6136 1 382 . 1 1 91 91 GLN CB C 13 29.45 . . 1 . . . A 91 . . . 6136 1 383 . 1 1 91 91 GLN N N 15 124.969 . . 1 . . . A 91 . . . 6136 1 384 . 1 1 92 92 PHE H H 1 8.907 . . 1 . . . A 92 . . . 6136 1 385 . 1 1 92 92 PHE C C 13 176.24 . . 1 . . . A 92 . . . 6136 1 386 . 1 1 92 92 PHE CA C 13 54.92 . . 1 . . . A 92 . . . 6136 1 387 . 1 1 92 92 PHE CB C 13 39.45 . . 1 . . . A 92 . . . 6136 1 388 . 1 1 92 92 PHE N N 15 125.550 . . 1 . . . A 92 . . . 6136 1 389 . 1 1 93 93 VAL H H 1 7.846 . . 1 . . . A 93 . . . 6136 1 390 . 1 1 93 93 VAL C C 13 175.14 . . 1 . . . A 93 . . . 6136 1 391 . 1 1 93 93 VAL CA C 13 58.95 . . 1 . . . A 93 . . . 6136 1 392 . 1 1 93 93 VAL CB C 13 35.09 . . 1 . . . A 93 . . . 6136 1 393 . 1 1 93 93 VAL N N 15 114.742 . . 1 . . . A 93 . . . 6136 1 394 . 1 1 94 94 ASN H H 1 8.709 . . 1 . . . A 94 . . . 6136 1 395 . 1 1 94 94 ASN CA C 13 50.893 . . 1 . . . A 94 . . . 6136 1 396 . 1 1 94 94 ASN CB C 13 38.60 . . 1 . . . A 94 . . . 6136 1 397 . 1 1 94 94 ASN N N 15 120.404 . . 1 . . . A 94 . . . 6136 1 398 . 1 1 95 95 ALA C C 13 178.79 . . 1 . . . A 95 . . . 6136 1 399 . 1 1 95 95 ALA CA C 13 54.74 . . 1 . . . A 95 . . . 6136 1 400 . 1 1 95 95 ALA CB C 13 18.72 . . 1 . . . A 95 . . . 6136 1 401 . 1 1 96 96 LYS H H 1 7.423 . . 1 . . . A 96 . . . 6136 1 402 . 1 1 96 96 LYS C C 13 176.86 . . 1 . . . A 96 . . . 6136 1 403 . 1 1 96 96 LYS CA C 13 54.744 . . 1 . . . A 96 . . . 6136 1 404 . 1 1 96 96 LYS CB C 13 32.27 . . 1 . . . A 96 . . . 6136 1 405 . 1 1 96 96 LYS N N 15 115.516 . . 1 . . . A 96 . . . 6136 1 406 . 1 1 97 97 GLY H H 1 8.140 . . 1 . . . A 97 . . . 6136 1 407 . 1 1 97 97 GLY C C 13 174.03 . . 1 . . . A 97 . . . 6136 1 408 . 1 1 97 97 GLY CA C 13 45.098 . . 1 . . . A 97 . . . 6136 1 409 . 1 1 97 97 GLY N N 15 108.492 . . 1 . . . A 97 . . . 6136 1 410 . 1 1 98 98 LYS H H 1 7.708 . . 1 . . . A 98 . . . 6136 1 411 . 1 1 98 98 LYS C C 13 176.09 . . 1 . . . A 98 . . . 6136 1 412 . 1 1 98 98 LYS CA C 13 52.472 . . 1 . . . A 98 . . . 6136 1 413 . 1 1 98 98 LYS CB C 13 31.78 . . 1 . . . A 98 . . . 6136 1 414 . 1 1 98 98 LYS N N 15 122.168 . . 1 . . . A 98 . . . 6136 1 415 . 1 1 104 104 PRO C C 13 174.19 . . 1 . . . A 104 . . . 6136 1 416 . 1 1 104 104 PRO CA C 13 62.88 . . 1 . . . A 104 . . . 6136 1 417 . 1 1 104 104 PRO CB C 13 31.02 . . 1 . . . A 104 . . . 6136 1 418 . 1 1 105 105 LEU H H 1 7.622 . . 1 . . . A 105 . . . 6136 1 419 . 1 1 105 105 LEU C C 13 176.35 . . 1 . . . A 105 . . . 6136 1 420 . 1 1 105 105 LEU CA C 13 53.018 . . 1 . . . A 105 . . . 6136 1 421 . 1 1 105 105 LEU CB C 13 46.97 . . 1 . . . A 105 . . . 6136 1 422 . 1 1 105 105 LEU N N 15 123.848 . . 1 . . . A 105 . . . 6136 1 423 . 1 1 106 106 VAL H H 1 8.317 . . 1 . . . A 106 . . . 6136 1 424 . 1 1 106 106 VAL C C 13 173.21 . . 1 . . . A 106 . . . 6136 1 425 . 1 1 106 106 VAL CA C 13 60.71 . . 1 . . . A 106 . . . 6136 1 426 . 1 1 106 106 VAL CB C 13 32.91 . . 1 . . . A 106 . . . 6136 1 427 . 1 1 106 106 VAL N N 15 129.224 . . 1 . . . A 106 . . . 6136 1 428 . 1 1 107 107 MET H H 1 8.588 . . 1 . . . A 107 . . . 6136 1 429 . 1 1 107 107 MET C C 13 173.11 . . 1 . . . A 107 . . . 6136 1 430 . 1 1 107 107 MET CA C 13 53.931 . . 1 . . . A 107 . . . 6136 1 431 . 1 1 107 107 MET CB C 13 35.48 . . 1 . . . A 107 . . . 6136 1 432 . 1 1 107 107 MET N N 15 121.928 . . 1 . . . A 107 . . . 6136 1 433 . 1 1 108 108 MET H H 1 7.577 . . 1 . . . A 108 . . . 6136 1 434 . 1 1 108 108 MET C C 13 176.45 . . 1 . . . A 108 . . . 6136 1 435 . 1 1 108 108 MET CA C 13 55.352 . . 1 . . . A 108 . . . 6136 1 436 . 1 1 108 108 MET CB C 13 35.38 . . 1 . . . A 108 . . . 6136 1 437 . 1 1 108 108 MET N N 15 116.358 . . 1 . . . A 108 . . . 6136 1 438 . 1 1 109 109 ALA H H 1 7.328 . . 1 . . . A 109 . . . 6136 1 439 . 1 1 109 109 ALA C C 13 175.40 . . 1 . . . A 109 . . . 6136 1 440 . 1 1 109 109 ALA CA C 13 50.558 . . 1 . . . A 109 . . . 6136 1 441 . 1 1 109 109 ALA CB C 13 16.94 . . 1 . . . A 109 . . . 6136 1 442 . 1 1 109 109 ALA N N 15 124.566 . . 1 . . . A 109 . . . 6136 1 443 . 1 1 110 110 ALA H H 1 7.674 . . 1 . . . A 110 . . . 6136 1 444 . 1 1 110 110 ALA C C 13 178.08 . . 1 . . . A 110 . . . 6136 1 445 . 1 1 110 110 ALA CA C 13 56.165 . . 1 . . . A 110 . . . 6136 1 446 . 1 1 110 110 ALA CB C 13 21.41 . . 1 . . . A 110 . . . 6136 1 447 . 1 1 110 110 ALA N N 15 128.729 . . 1 . . . A 110 . . . 6136 1 448 . 1 1 111 111 THR H H 1 8.406 . . 1 . . . A 111 . . . 6136 1 449 . 1 1 111 111 THR C C 13 175.80 . . 1 . . . A 111 . . . 6136 1 450 . 1 1 111 111 THR CA C 13 67.508 . . 1 . . . A 111 . . . 6136 1 451 . 1 1 111 111 THR CB C 13 68.59 . . 1 . . . A 111 . . . 6136 1 452 . 1 1 111 111 THR N N 15 115.461 . . 1 . . . A 111 . . . 6136 1 453 . 1 1 112 112 LYS H H 1 7.285 . . 1 . . . A 112 . . . 6136 1 454 . 1 1 112 112 LYS C C 13 180.06 . . 1 . . . A 112 . . . 6136 1 455 . 1 1 112 112 LYS CA C 13 58.174 . . 1 . . . A 112 . . . 6136 1 456 . 1 1 112 112 LYS CB C 13 31.70 . . 1 . . . A 112 . . . 6136 1 457 . 1 1 112 112 LYS N N 15 120.000 . . 1 . . . A 112 . . . 6136 1 458 . 1 1 113 113 ILE H H 1 8.347 . . 1 . . . A 113 . . . 6136 1 459 . 1 1 113 113 ILE C C 13 177.57 . . 1 . . . A 113 . . . 6136 1 460 . 1 1 113 113 ILE CA C 13 64.783 . . 1 . . . A 113 . . . 6136 1 461 . 1 1 113 113 ILE CB C 13 36.68 . . 1 . . . A 113 . . . 6136 1 462 . 1 1 113 113 ILE N N 15 122.808 . . 1 . . . A 113 . . . 6136 1 463 . 1 1 114 114 GLY H H 1 8.335 . . 1 . . . A 114 . . . 6136 1 464 . 1 1 114 114 GLY C C 13 175.40 . . 1 . . . A 114 . . . 6136 1 465 . 1 1 114 114 GLY CA C 13 47.686 . . 1 . . . A 114 . . . 6136 1 466 . 1 1 114 114 GLY N N 15 109.506 . . 1 . . . A 114 . . . 6136 1 467 . 1 1 115 115 GLU H H 1 8.417 . . 1 . . . A 115 . . . 6136 1 468 . 1 1 115 115 GLU C C 13 178.44 . . 1 . . . A 115 . . . 6136 1 469 . 1 1 115 115 GLU CA C 13 58.804 . . 1 . . . A 115 . . . 6136 1 470 . 1 1 115 115 GLU CB C 13 29.27 . . 1 . . . A 115 . . . 6136 1 471 . 1 1 115 115 GLU N N 15 121.457 . . 1 . . . A 115 . . . 6136 1 472 . 1 1 116 116 ARG H H 1 7.485 . . 1 . . . A 116 . . . 6136 1 473 . 1 1 116 116 ARG C C 13 177.70 . . 1 . . . A 116 . . . 6136 1 474 . 1 1 116 116 ARG CA C 13 56.912 . . 1 . . . A 116 . . . 6136 1 475 . 1 1 116 116 ARG CB C 13 27.66 . . 1 . . . A 116 . . . 6136 1 476 . 1 1 116 116 ARG N N 15 118.668 . . 1 . . . A 116 . . . 6136 1 477 . 1 1 117 117 GLN H H 1 7.958 . . 1 . . . A 117 . . . 6136 1 478 . 1 1 117 117 GLN C C 13 177.22 . . 1 . . . A 117 . . . 6136 1 479 . 1 1 117 117 GLN CA C 13 60.493 . . 1 . . . A 117 . . . 6136 1 480 . 1 1 117 117 GLN CB C 13 30.09 . . 1 . . . A 117 . . . 6136 1 481 . 1 1 117 117 GLN N N 15 121.482 . . 1 . . . A 117 . . . 6136 1 482 . 1 1 118 118 GLY H H 1 8.208 . . 1 . . . A 118 . . . 6136 1 483 . 1 1 118 118 GLY C C 13 175.69 . . 1 . . . A 118 . . . 6136 1 484 . 1 1 118 118 GLY CA C 13 48.398 . . 1 . . . A 118 . . . 6136 1 485 . 1 1 118 118 GLY N N 15 108.361 . . 1 . . . A 118 . . . 6136 1 486 . 1 1 119 119 GLN H H 1 8.303 . . 1 . . . A 119 . . . 6136 1 487 . 1 1 119 119 GLN C C 13 180.06 . . 1 . . . A 119 . . . 6136 1 488 . 1 1 119 119 GLN CA C 13 58.886 . . 1 . . . A 119 . . . 6136 1 489 . 1 1 119 119 GLN CB C 13 28.21 . . 1 . . . A 119 . . . 6136 1 490 . 1 1 119 119 GLN N N 15 120.214 . . 1 . . . A 119 . . . 6136 1 491 . 1 1 120 120 GLU H H 1 8.455 . . 1 . . . A 120 . . . 6136 1 492 . 1 1 120 120 GLU C C 13 180.13 . . 1 . . . A 120 . . . 6136 1 493 . 1 1 120 120 GLU CA C 13 57.803 . . 1 . . . A 120 . . . 6136 1 494 . 1 1 120 120 GLU CB C 13 28.30 . . 1 . . . A 120 . . . 6136 1 495 . 1 1 120 120 GLU N N 15 119.178 . . 1 . . . A 120 . . . 6136 1 496 . 1 1 121 121 LEU H H 1 8.587 . . 1 . . . A 121 . . . 6136 1 497 . 1 1 121 121 LEU C C 13 177.56 . . 1 . . . A 121 . . . 6136 1 498 . 1 1 121 121 LEU CA C 13 57.818 . . 1 . . . A 121 . . . 6136 1 499 . 1 1 121 121 LEU CB C 13 42.85 . . 1 . . . A 121 . . . 6136 1 500 . 1 1 121 121 LEU N N 15 124.022 . . 1 . . . A 121 . . . 6136 1 501 . 1 1 122 122 TYR H H 1 7.681 . . 1 . . . A 122 . . . 6136 1 502 . 1 1 122 122 TYR C C 13 177.15 . . 1 . . . A 122 . . . 6136 1 503 . 1 1 122 122 TYR CA C 13 62.067 . . 1 . . . A 122 . . . 6136 1 504 . 1 1 122 122 TYR CB C 13 38.20 . . 1 . . . A 122 . . . 6136 1 505 . 1 1 122 122 TYR N N 15 119.180 . . 1 . . . A 122 . . . 6136 1 506 . 1 1 123 123 LYS H H 1 7.787 . . 1 . . . A 123 . . . 6136 1 507 . 1 1 123 123 LYS C C 13 179.24 . . 1 . . . A 123 . . . 6136 1 508 . 1 1 123 123 LYS CA C 13 59.262 . . 1 . . . A 123 . . . 6136 1 509 . 1 1 123 123 LYS CB C 13 32.73 . . 1 . . . A 123 . . . 6136 1 510 . 1 1 123 123 LYS N N 15 117.857 . . 1 . . . A 123 . . . 6136 1 511 . 1 1 124 124 GLU H H 1 7.457 . . 1 . . . A 124 . . . 6136 1 512 . 1 1 124 124 GLU C C 13 177.11 . . 1 . . . A 124 . . . 6136 1 513 . 1 1 124 124 GLU CA C 13 56.987 . . 1 . . . A 124 . . . 6136 1 514 . 1 1 124 124 GLU CB C 13 26.99 . . 1 . . . A 124 . . . 6136 1 515 . 1 1 124 124 GLU N N 15 121.450 . . 1 . . . A 124 . . . 6136 1 516 . 1 1 125 125 MET H H 1 7.680 . . 1 . . . A 125 . . . 6136 1 517 . 1 1 125 125 MET C C 13 178.21 . . 1 . . . A 125 . . . 6136 1 518 . 1 1 125 125 MET CA C 13 58.994 . . 1 . . . A 125 . . . 6136 1 519 . 1 1 125 125 MET CB C 13 31.42 . . 1 . . . A 125 . . . 6136 1 520 . 1 1 125 125 MET N N 15 122.128 . . 1 . . . A 125 . . . 6136 1 521 . 1 1 126 126 GLN H H 1 7.749 . . 1 . . . A 126 . . . 6136 1 522 . 1 1 126 126 GLN C C 13 179.51 . . 1 . . . A 126 . . . 6136 1 523 . 1 1 126 126 GLN CA C 13 57.99 . . 1 . . . A 126 . . . 6136 1 524 . 1 1 126 126 GLN CB C 13 28.50 . . 1 . . . A 126 . . . 6136 1 525 . 1 1 126 126 GLN N N 15 117.226 . . 1 . . . A 126 . . . 6136 1 526 . 1 1 127 127 LYS H H 1 7.482 . . 1 . . . A 127 . . . 6136 1 527 . 1 1 127 127 LYS C C 13 178.73 . . 1 . . . A 127 . . . 6136 1 528 . 1 1 127 127 LYS CA C 13 58.773 . . 1 . . . A 127 . . . 6136 1 529 . 1 1 127 127 LYS CB C 13 32.03 . . 1 . . . A 127 . . . 6136 1 530 . 1 1 127 127 LYS N N 15 122.193 . . 1 . . . A 127 . . . 6136 1 531 . 1 1 128 128 ARG H H 1 7.205 . . 1 . . . A 128 . . . 6136 1 532 . 1 1 128 128 ARG C C 13 177.48 . . 1 . . . A 128 . . . 6136 1 533 . 1 1 128 128 ARG CA C 13 57.338 . . 1 . . . A 128 . . . 6136 1 534 . 1 1 128 128 ARG CB C 13 30.10 . . 1 . . . A 128 . . . 6136 1 535 . 1 1 128 128 ARG N N 15 116.132 . . 1 . . . A 128 . . . 6136 1 536 . 1 1 129 129 GLY H H 1 7.496 . . 1 . . . A 129 . . . 6136 1 537 . 1 1 129 129 GLY C C 13 174.76 . . 1 . . . A 129 . . . 6136 1 538 . 1 1 129 129 GLY CA C 13 45.724 . . 1 . . . A 129 . . . 6136 1 539 . 1 1 129 129 GLY N N 15 107.360 . . 1 . . . A 129 . . . 6136 1 540 . 1 1 130 130 TRP H H 1 6.493 . . 1 . . . A 130 . . . 6136 1 541 . 1 1 130 130 TRP C C 13 176.20 . . 1 . . . A 130 . . . 6136 1 542 . 1 1 130 130 TRP CA C 13 54.796 . . 1 . . . A 130 . . . 6136 1 543 . 1 1 130 130 TRP CB C 13 30.44 . . 1 . . . A 130 . . . 6136 1 544 . 1 1 130 130 TRP N N 15 118.118 . . 1 . . . A 130 . . . 6136 1 545 . 1 1 131 131 ASP H H 1 8.234 . . 1 . . . A 131 . . . 6136 1 546 . 1 1 131 131 ASP C C 13 179.29 . . 1 . . . A 131 . . . 6136 1 547 . 1 1 131 131 ASP CA C 13 53.229 . . 1 . . . A 131 . . . 6136 1 548 . 1 1 131 131 ASP CB C 13 40.95 . . 1 . . . A 131 . . . 6136 1 549 . 1 1 131 131 ASP N N 15 121.525 . . 1 . . . A 131 . . . 6136 1 550 . 1 1 132 132 VAL H H 1 8.946 . . 1 . . . A 132 . . . 6136 1 551 . 1 1 132 132 VAL C C 13 177.16 . . 1 . . . A 132 . . . 6136 1 552 . 1 1 132 132 VAL CA C 13 65.290 . . 1 . . . A 132 . . . 6136 1 553 . 1 1 132 132 VAL CB C 13 31.49 . . 1 . . . A 132 . . . 6136 1 554 . 1 1 132 132 VAL N N 15 133.309 . . 1 . . . A 132 . . . 6136 1 555 . 1 1 133 133 LYS H H 1 8.401 . . 1 . . . A 133 . . . 6136 1 556 . 1 1 133 133 LYS C C 13 177.63 . . 1 . . . A 133 . . . 6136 1 557 . 1 1 133 133 LYS CA C 13 58.693 . . 1 . . . A 133 . . . 6136 1 558 . 1 1 133 133 LYS CB C 13 31.59 . . 1 . . . A 133 . . . 6136 1 559 . 1 1 133 133 LYS N N 15 120.248 . . 1 . . . A 133 . . . 6136 1 560 . 1 1 134 134 GLU H H 1 7.118 . . 1 . . . A 134 . . . 6136 1 561 . 1 1 134 134 GLU C C 13 175.27 . . 1 . . . A 134 . . . 6136 1 562 . 1 1 134 134 GLU CA C 13 54.328 . . 1 . . . A 134 . . . 6136 1 563 . 1 1 134 134 GLU CB C 13 30.76 . . 1 . . . A 134 . . . 6136 1 564 . 1 1 134 134 GLU N N 15 114.807 . . 1 . . . A 134 . . . 6136 1 565 . 1 1 135 135 SER H H 1 7.281 . . 1 . . . A 135 . . . 6136 1 566 . 1 1 135 135 SER C C 13 172.39 . . 1 . . . A 135 . . . 6136 1 567 . 1 1 135 135 SER CA C 13 57.467 . . 1 . . . A 135 . . . 6136 1 568 . 1 1 135 135 SER CB C 13 65.06 . . 1 . . . A 135 . . . 6136 1 569 . 1 1 135 135 SER N N 15 115.880 . . 1 . . . A 135 . . . 6136 1 570 . 1 1 136 136 ALA H H 1 8.105 . . 1 . . . A 136 . . . 6136 1 571 . 1 1 136 136 ALA C C 13 173.94 . . 1 . . . A 136 . . . 6136 1 572 . 1 1 136 136 ALA CA C 13 51.932 . . 1 . . . A 136 . . . 6136 1 573 . 1 1 136 136 ALA CB C 13 23.84 . . 1 . . . A 136 . . . 6136 1 574 . 1 1 136 136 ALA N N 15 122.867 . . 1 . . . A 136 . . . 6136 1 575 . 1 1 137 137 VAL H H 1 8.300 . . 1 . . . A 137 . . . 6136 1 576 . 1 1 137 137 VAL C C 13 174.79 . . 1 . . . A 137 . . . 6136 1 577 . 1 1 137 137 VAL CA C 13 59.559 . . 1 . . . A 137 . . . 6136 1 578 . 1 1 137 137 VAL CB C 13 34.44 . . 1 . . . A 137 . . . 6136 1 579 . 1 1 137 137 VAL N N 15 119.305 . . 1 . . . A 137 . . . 6136 1 580 . 1 1 138 138 MET H H 1 9.317 . . 1 . . . A 138 . . . 6136 1 581 . 1 1 138 138 MET C C 13 172.70 . . 1 . . . A 138 . . . 6136 1 582 . 1 1 138 138 MET CA C 13 53.406 . . 1 . . . A 138 . . . 6136 1 583 . 1 1 138 138 MET CB C 13 35.34 . . 1 . . . A 138 . . . 6136 1 584 . 1 1 138 138 MET N N 15 127.443 . . 1 . . . A 138 . . . 6136 1 585 . 1 1 139 139 ALA H H 1 9.119 . . 1 . . . A 139 . . . 6136 1 586 . 1 1 139 139 ALA C C 13 174.03 . . 1 . . . A 139 . . . 6136 1 587 . 1 1 139 139 ALA CA C 13 49.599 . . 1 . . . A 139 . . . 6136 1 588 . 1 1 139 139 ALA CB C 13 19.70 . . 1 . . . A 139 . . . 6136 1 589 . 1 1 139 139 ALA N N 15 130.950 . . 1 . . . A 139 . . . 6136 1 590 . 1 1 140 140 ILE H H 1 8.488 . . 1 . . . A 140 . . . 6136 1 591 . 1 1 140 140 ILE C C 13 177.20 . . 1 . . . A 140 . . . 6136 1 592 . 1 1 140 140 ILE CA C 13 60.156 . . 1 . . . A 140 . . . 6136 1 593 . 1 1 140 140 ILE CB C 13 37.95 . . 1 . . . A 140 . . . 6136 1 594 . 1 1 140 140 ILE N N 15 127.923 . . 1 . . . A 140 . . . 6136 1 595 . 1 1 141 141 THR H H 1 8.811 . . 1 . . . A 141 . . . 6136 1 596 . 1 1 141 141 THR C C 13 172.45 . . 1 . . . A 141 . . . 6136 1 597 . 1 1 141 141 THR CA C 13 60.795 . . 1 . . . A 141 . . . 6136 1 598 . 1 1 141 141 THR CB C 13 71.42 . . 1 . . . A 141 . . . 6136 1 599 . 1 1 141 141 THR N N 15 118.929 . . 1 . . . A 141 . . . 6136 1 600 . 1 1 142 142 ALA H H 1 9.195 . . 1 . . . A 142 . . . 6136 1 601 . 1 1 142 142 ALA C C 13 177.32 . . 1 . . . A 142 . . . 6136 1 602 . 1 1 142 142 ALA CA C 13 50.16 . . 1 . . . A 142 . . . 6136 1 603 . 1 1 142 142 ALA CB C 13 19.14 . . 1 . . . A 142 . . . 6136 1 604 . 1 1 142 142 ALA N N 15 129.459 . . 1 . . . A 142 . . . 6136 1 605 . 1 1 143 143 ASN H H 1 8.498 . . 1 . . . A 143 . . . 6136 1 606 . 1 1 143 143 ASN C C 13 176.49 . . 1 . . . A 143 . . . 6136 1 607 . 1 1 143 143 ASN CA C 13 55.149 . . 1 . . . A 143 . . . 6136 1 608 . 1 1 143 143 ASN CB C 13 37.97 . . 1 . . . A 143 . . . 6136 1 609 . 1 1 143 143 ASN N N 15 115.656 . . 1 . . . A 143 . . . 6136 1 610 . 1 1 144 144 GLU H H 1 8.661 . . 1 . . . A 144 . . . 6136 1 611 . 1 1 144 144 GLU C C 13 175.45 . . 1 . . . A 144 . . . 6136 1 612 . 1 1 144 144 GLU CA C 13 57.404 . . 1 . . . A 144 . . . 6136 1 613 . 1 1 144 144 GLU CB C 13 28.61 . . 1 . . . A 144 . . . 6136 1 614 . 1 1 144 144 GLU N N 15 118.748 . . 1 . . . A 144 . . . 6136 1 615 . 1 1 145 145 LEU H H 1 8.087 . . 1 . . . A 145 . . . 6136 1 616 . 1 1 145 145 LEU C C 13 176.41 . . 1 . . . A 145 . . . 6136 1 617 . 1 1 145 145 LEU CA C 13 53.051 . . 1 . . . A 145 . . . 6136 1 618 . 1 1 145 145 LEU CB C 13 42.01 . . 1 . . . A 145 . . . 6136 1 619 . 1 1 145 145 LEU N N 15 124.314 . . 1 . . . A 145 . . . 6136 1 620 . 1 1 146 146 ASP H H 1 8.499 . . 1 . . . A 146 . . . 6136 1 621 . 1 1 146 146 ASP C C 13 177.28 . . 1 . . . A 146 . . . 6136 1 622 . 1 1 146 146 ASP CA C 13 59.548 . . 1 . . . A 146 . . . 6136 1 623 . 1 1 146 146 ASP CB C 13 42.03 . . 1 . . . A 146 . . . 6136 1 624 . 1 1 146 146 ASP N N 15 131.102 . . 1 . . . A 146 . . . 6136 1 625 . 1 1 147 147 THR C C 13 175.63 . . 1 . . . A 147 . . . 6136 1 626 . 1 1 147 147 THR CA C 13 63.69 . . 1 . . . A 147 . . . 6136 1 627 . 1 1 148 148 ALA H H 1 6.934 . . 1 . . . A 148 . . . 6136 1 628 . 1 1 148 148 ALA C C 13 177.93 . . 1 . . . A 148 . . . 6136 1 629 . 1 1 148 148 ALA CA C 13 55.236 . . 1 . . . A 148 . . . 6136 1 630 . 1 1 148 148 ALA CB C 13 18.80 . . 1 . . . A 148 . . . 6136 1 631 . 1 1 148 148 ALA N N 15 128.354 . . 1 . . . A 148 . . . 6136 1 632 . 1 1 149 149 ARG H H 1 8.373 . . 1 . . . A 149 . . . 6136 1 633 . 1 1 149 149 ARG C C 13 179.45 . . 1 . . . A 149 . . . 6136 1 634 . 1 1 149 149 ARG CA C 13 58.435 . . 1 . . . A 149 . . . 6136 1 635 . 1 1 149 149 ARG CB C 13 30.50 . . 1 . . . A 149 . . . 6136 1 636 . 1 1 149 149 ARG N N 15 121.071 . . 1 . . . A 149 . . . 6136 1 637 . 1 1 150 150 ARG H H 1 8.862 . . 1 . . . A 150 . . . 6136 1 638 . 1 1 150 150 ARG C C 13 180.19 . . 1 . . . A 150 . . . 6136 1 639 . 1 1 150 150 ARG CA C 13 59.614 . . 1 . . . A 150 . . . 6136 1 640 . 1 1 150 150 ARG CB C 13 30.70 . . 1 . . . A 150 . . . 6136 1 641 . 1 1 150 150 ARG N N 15 118.045 . . 1 . . . A 150 . . . 6136 1 642 . 1 1 151 151 ARG H H 1 6.998 . . 1 . . . A 151 . . . 6136 1 643 . 1 1 151 151 ARG C C 13 178.89 . . 1 . . . A 151 . . . 6136 1 644 . 1 1 151 151 ARG CA C 13 59.453 . . 1 . . . A 151 . . . 6136 1 645 . 1 1 151 151 ARG CB C 13 31.98 . . 1 . . . A 151 . . . 6136 1 646 . 1 1 151 151 ARG N N 15 119.545 . . 1 . . . A 151 . . . 6136 1 647 . 1 1 152 152 THR H H 1 8.686 . . 1 . . . A 152 . . . 6136 1 648 . 1 1 152 152 THR C C 13 177.69 . . 1 . . . A 152 . . . 6136 1 649 . 1 1 152 152 THR CA C 13 65.913 . . 1 . . . A 152 . . . 6136 1 650 . 1 1 152 152 THR CB C 13 67.23 . . 1 . . . A 152 . . . 6136 1 651 . 1 1 152 152 THR N N 15 111.594 . . 1 . . . A 152 . . . 6136 1 652 . 1 1 153 153 THR H H 1 8.893 . . 1 . . . A 153 . . . 6136 1 653 . 1 1 153 153 THR C C 13 175.37 . . 1 . . . A 153 . . . 6136 1 654 . 1 1 153 153 THR CA C 13 67.266 . . 1 . . . A 153 . . . 6136 1 655 . 1 1 153 153 THR N N 15 121.071 . . 1 . . . A 153 . . . 6136 1 656 . 1 1 154 154 GLY H H 1 7.763 . . 1 . . . A 154 . . . 6136 1 657 . 1 1 154 154 GLY C C 13 174.62 . . 1 . . . A 154 . . . 6136 1 658 . 1 1 154 154 GLY CA C 13 46.775 . . 1 . . . A 154 . . . 6136 1 659 . 1 1 154 154 GLY N N 15 110.216 . . 1 . . . A 154 . . . 6136 1 660 . 1 1 155 155 SER H H 1 7.718 . . 1 . . . A 155 . . . 6136 1 661 . 1 1 155 155 SER C C 13 178.17 . . 1 . . . A 155 . . . 6136 1 662 . 1 1 155 155 SER CA C 13 61.167 . . 1 . . . A 155 . . . 6136 1 663 . 1 1 155 155 SER CB C 13 64.25 . . 1 . . . A 155 . . . 6136 1 664 . 1 1 155 155 SER N N 15 117.179 . . 1 . . . A 155 . . . 6136 1 665 . 1 1 156 156 MET H H 1 8.009 . . 1 . . . A 156 . . . 6136 1 666 . 1 1 156 156 MET C C 13 178.12 . . 1 . . . A 156 . . . 6136 1 667 . 1 1 156 156 MET CA C 13 60.728 . . 1 . . . A 156 . . . 6136 1 668 . 1 1 156 156 MET CB C 13 34.48 . . 1 . . . A 156 . . . 6136 1 669 . 1 1 156 156 MET N N 15 116.453 . . 1 . . . A 156 . . . 6136 1 670 . 1 1 157 157 ASP H H 1 8.857 . . 1 . . . A 157 . . . 6136 1 671 . 1 1 157 157 ASP C C 13 179.52 . . 1 . . . A 157 . . . 6136 1 672 . 1 1 157 157 ASP CA C 13 57.505 . . 1 . . . A 157 . . . 6136 1 673 . 1 1 157 157 ASP CB C 13 39.55 . . 1 . . . A 157 . . . 6136 1 674 . 1 1 157 157 ASP N N 15 120.604 . . 1 . . . A 157 . . . 6136 1 675 . 1 1 158 158 ALA H H 1 8.176 . . 1 . . . A 158 . . . 6136 1 676 . 1 1 158 158 ALA C C 13 181.23 . . 1 . . . A 158 . . . 6136 1 677 . 1 1 158 158 ALA CA C 13 54.756 . . 1 . . . A 158 . . . 6136 1 678 . 1 1 158 158 ALA CB C 13 19.90 . . 1 . . . A 158 . . . 6136 1 679 . 1 1 158 158 ALA N N 15 125.292 . . 1 . . . A 158 . . . 6136 1 680 . 1 1 159 159 LEU H H 1 8.152 . . 1 . . . A 159 . . . 6136 1 681 . 1 1 159 159 LEU C C 13 178.62 . . 1 . . . A 159 . . . 6136 1 682 . 1 1 159 159 LEU CA C 13 58.537 . . 1 . . . A 159 . . . 6136 1 683 . 1 1 159 159 LEU CB C 13 41.44 . . 1 . . . A 159 . . . 6136 1 684 . 1 1 159 159 LEU N N 15 122.063 . . 1 . . . A 159 . . . 6136 1 685 . 1 1 160 160 LYS H H 1 8.243 . . 1 . . . A 160 . . . 6136 1 686 . 1 1 160 160 LYS C C 13 181.18 . . 1 . . . A 160 . . . 6136 1 687 . 1 1 160 160 LYS CA C 13 59.154 . . 1 . . . A 160 . . . 6136 1 688 . 1 1 160 160 LYS CB C 13 31.79 . . 1 . . . A 160 . . . 6136 1 689 . 1 1 160 160 LYS N N 15 119.977 . . 1 . . . A 160 . . . 6136 1 690 . 1 1 161 161 ALA H H 1 8.299 . . 1 . . . A 161 . . . 6136 1 691 . 1 1 161 161 ALA C C 13 179.01 . . 1 . . . A 161 . . . 6136 1 692 . 1 1 161 161 ALA CA C 13 54.345 . . 1 . . . A 161 . . . 6136 1 693 . 1 1 161 161 ALA CB C 13 17.66 . . 1 . . . A 161 . . . 6136 1 694 . 1 1 161 161 ALA N N 15 124.221 . . 1 . . . A 161 . . . 6136 1 695 . 1 1 162 162 ALA H H 1 7.312 . . 1 . . . A 162 . . . 6136 1 696 . 1 1 162 162 ALA C C 13 176.75 . . 1 . . . A 162 . . . 6136 1 697 . 1 1 162 162 ALA CA C 13 52.184 . . 1 . . . A 162 . . . 6136 1 698 . 1 1 162 162 ALA CB C 13 17.22 . . 1 . . . A 162 . . . 6136 1 699 . 1 1 162 162 ALA N N 15 119.513 . . 1 . . . A 162 . . . 6136 1 700 . 1 1 163 163 GLY H H 1 7.139 . . 1 . . . A 163 . . . 6136 1 701 . 1 1 163 163 GLY C C 13 174.68 . . 1 . . . A 163 . . . 6136 1 702 . 1 1 163 163 GLY CA C 13 43.916 . . 1 . . . A 163 . . . 6136 1 703 . 1 1 163 163 GLY N N 15 102.143 . . 1 . . . A 163 . . . 6136 1 704 . 1 1 164 164 PHE H H 1 8.373 . . 1 . . . A 164 . . . 6136 1 705 . 1 1 164 164 PHE C C 13 173.98 . . 1 . . . A 164 . . . 6136 1 706 . 1 1 164 164 PHE CA C 13 57.698 . . 1 . . . A 164 . . . 6136 1 707 . 1 1 164 164 PHE CB C 13 41.14 . . 1 . . . A 164 . . . 6136 1 708 . 1 1 164 164 PHE N N 15 128.074 . . 1 . . . A 164 . . . 6136 1 709 . 1 1 165 165 PRO C C 13 178.05 . . 1 . . . A 165 . . . 6136 1 710 . 1 1 165 165 PRO CA C 13 62.99 . . 1 . . . A 165 . . . 6136 1 711 . 1 1 165 165 PRO CB C 13 32.05 . . 1 . . . A 165 . . . 6136 1 712 . 1 1 166 166 GLU H H 1 8.492 . . 1 . . . A 166 . . . 6136 1 713 . 1 1 166 166 GLU C C 13 178.08 . . 1 . . . A 166 . . . 6136 1 714 . 1 1 166 166 GLU CA C 13 59.028 . . 1 . . . A 166 . . . 6136 1 715 . 1 1 166 166 GLU CB C 13 29.38 . . 1 . . . A 166 . . . 6136 1 716 . 1 1 166 166 GLU N N 15 127.242 . . 1 . . . A 166 . . . 6136 1 717 . 1 1 167 167 LYS H H 1 8.257 . . 1 . . . A 167 . . . 6136 1 718 . 1 1 167 167 LYS C C 13 176.84 . . 1 . . . A 167 . . . 6136 1 719 . 1 1 167 167 LYS CA C 13 57.318 . . 1 . . . A 167 . . . 6136 1 720 . 1 1 167 167 LYS CB C 13 31.70 . . 1 . . . A 167 . . . 6136 1 721 . 1 1 167 167 LYS N N 15 116.715 . . 1 . . . A 167 . . . 6136 1 722 . 1 1 168 168 GLN H H 1 7.331 . . 1 . . . A 168 . . . 6136 1 723 . 1 1 168 168 GLN C C 13 172.01 . . 1 . . . A 168 . . . 6136 1 724 . 1 1 168 168 GLN CA C 13 53.903 . . 1 . . . A 168 . . . 6136 1 725 . 1 1 168 168 GLN CB C 13 29.12 . . 1 . . . A 168 . . . 6136 1 726 . 1 1 168 168 GLN N N 15 116.614 . . 1 . . . A 168 . . . 6136 1 727 . 1 1 169 169 ILE H H 1 6.706 . . 1 . . . A 169 . . . 6136 1 728 . 1 1 169 169 ILE C C 13 174.16 . . 1 . . . A 169 . . . 6136 1 729 . 1 1 169 169 ILE CA C 13 61.095 . . 1 . . . A 169 . . . 6136 1 730 . 1 1 169 169 ILE CB C 13 37.18 . . 1 . . . A 169 . . . 6136 1 731 . 1 1 169 169 ILE N N 15 119.306 . . 1 . . . A 169 . . . 6136 1 732 . 1 1 170 170 TYR H H 1 8.958 . . 1 . . . A 170 . . . 6136 1 733 . 1 1 170 170 TYR C C 13 174.36 . . 1 . . . A 170 . . . 6136 1 734 . 1 1 170 170 TYR CA C 13 55.434 . . 1 . . . A 170 . . . 6136 1 735 . 1 1 170 170 TYR CB C 13 39.91 . . 1 . . . A 170 . . . 6136 1 736 . 1 1 170 170 TYR N N 15 130.990 . . 1 . . . A 170 . . . 6136 1 737 . 1 1 171 171 GLN H H 1 8.571 . . 1 . . . A 171 . . . 6136 1 738 . 1 1 171 171 GLN C C 13 175.61 . . 1 . . . A 171 . . . 6136 1 739 . 1 1 171 171 GLN CA C 13 54.102 . . 1 . . . A 171 . . . 6136 1 740 . 1 1 171 171 GLN CB C 13 31.67 . . 1 . . . A 171 . . . 6136 1 741 . 1 1 171 171 GLN N N 15 121.811 . . 1 . . . A 171 . . . 6136 1 742 . 1 1 172 172 VAL H H 1 9.131 . . 1 . . . A 172 . . . 6136 1 743 . 1 1 172 172 VAL C C 13 170.94 . . 1 . . . A 172 . . . 6136 1 744 . 1 1 172 172 VAL CA C 13 56.570 . . 1 . . . A 172 . . . 6136 1 745 . 1 1 172 172 VAL CB C 13 35.45 . . 1 . . . A 172 . . . 6136 1 746 . 1 1 172 172 VAL N N 15 122.985 . . 1 . . . A 172 . . . 6136 1 747 . 1 1 173 173 PRO C C 13 177.33 . . 1 . . . A 173 . . . 6136 1 748 . 1 1 173 173 PRO CA C 13 61.44 . . 1 . . . A 173 . . . 6136 1 749 . 1 1 173 173 PRO CB C 13 32.85 . . 1 . . . A 173 . . . 6136 1 750 . 1 1 174 174 THR H H 1 8.638 . . 1 . . . A 174 . . . 6136 1 751 . 1 1 174 174 THR C C 13 175.03 . . 1 . . . A 174 . . . 6136 1 752 . 1 1 174 174 THR CA C 13 57.822 . . 1 . . . A 174 . . . 6136 1 753 . 1 1 174 174 THR CB C 13 70.20 . . 1 . . . A 174 . . . 6136 1 754 . 1 1 174 174 THR N N 15 114.467 . . 1 . . . A 174 . . . 6136 1 755 . 1 1 175 175 LYS H H 1 9.112 . . 1 . . . A 175 . . . 6136 1 756 . 1 1 175 175 LYS C C 13 175.97 . . 1 . . . A 175 . . . 6136 1 757 . 1 1 175 175 LYS CA C 13 57.14 . . 1 . . . A 175 . . . 6136 1 758 . 1 1 175 175 LYS CB C 13 32.65 . . 1 . . . A 175 . . . 6136 1 759 . 1 1 175 175 LYS N N 15 130.101 . . 1 . . . A 175 . . . 6136 1 760 . 1 1 176 176 SER H H 1 7.512 . . 1 . . . A 176 . . . 6136 1 761 . 1 1 176 176 SER CA C 13 57.413 . . 1 . . . A 176 . . . 6136 1 762 . 1 1 176 176 SER CB C 13 63.85 . . 1 . . . A 176 . . . 6136 1 763 . 1 1 176 176 SER N N 15 110.740 . . 1 . . . A 176 . . . 6136 1 764 . 1 1 177 177 ASN H H 1 9.081 . . 1 . . . A 177 . . . 6136 1 765 . 1 1 177 177 ASN C C 13 173.25 . . 1 . . . A 177 . . . 6136 1 766 . 1 1 177 177 ASN CA C 13 51.59 . . 1 . . . A 177 . . . 6136 1 767 . 1 1 177 177 ASN CB C 13 37.05 . . 1 . . . A 177 . . . 6136 1 768 . 1 1 177 177 ASN N N 15 126.058 . . 1 . . . A 177 . . . 6136 1 769 . 1 1 178 178 ASP H H 1 7.935 . . 1 . . . A 178 . . . 6136 1 770 . 1 1 178 178 ASP C C 13 173.24 . . 1 . . . A 178 . . . 6136 1 771 . 1 1 178 178 ASP CA C 13 51.661 . . 1 . . . A 178 . . . 6136 1 772 . 1 1 178 178 ASP CB C 13 41.44 . . 1 . . . A 178 . . . 6136 1 773 . 1 1 178 178 ASP N N 15 120.000 . . 1 . . . A 178 . . . 6136 1 774 . 1 1 179 179 ILE H H 1 8.492 . . 1 . . . A 179 . . . 6136 1 775 . 1 1 179 179 ILE CA C 13 66.902 . . 1 . . . A 179 . . . 6136 1 776 . 1 1 179 179 ILE CB C 13 35.17 . . 1 . . . A 179 . . . 6136 1 777 . 1 1 179 179 ILE N N 15 117.857 . . 1 . . . A 179 . . . 6136 1 778 . 1 1 180 180 PRO C C 13 179.79 . . 1 . . . A 180 . . . 6136 1 779 . 1 1 180 180 PRO CA C 13 65.79 . . 1 . . . A 180 . . . 6136 1 780 . 1 1 180 180 PRO CB C 13 30.78 . . 1 . . . A 180 . . . 6136 1 781 . 1 1 181 181 GLY H H 1 8.045 . . 1 . . . A 181 . . . 6136 1 782 . 1 1 181 181 GLY C C 13 177.46 . . 1 . . . A 181 . . . 6136 1 783 . 1 1 181 181 GLY CA C 13 46.996 . . 1 . . . A 181 . . . 6136 1 784 . 1 1 181 181 GLY N N 15 106.691 . . 1 . . . A 181 . . . 6136 1 785 . 1 1 182 182 ALA H H 1 8.016 . . 1 . . . A 182 . . . 6136 1 786 . 1 1 182 182 ALA C C 13 178.41 . . 1 . . . A 182 . . . 6136 1 787 . 1 1 182 182 ALA CA C 13 54.975 . . 1 . . . A 182 . . . 6136 1 788 . 1 1 182 182 ALA CB C 13 21.29 . . 1 . . . A 182 . . . 6136 1 789 . 1 1 182 182 ALA N N 15 126.930 . . 1 . . . A 182 . . . 6136 1 790 . 1 1 183 183 PHE H H 1 8.976 . . 1 . . . A 183 . . . 6136 1 791 . 1 1 183 183 PHE C C 13 177.38 . . 1 . . . A 183 . . . 6136 1 792 . 1 1 183 183 PHE CA C 13 60.650 . . 1 . . . A 183 . . . 6136 1 793 . 1 1 183 183 PHE CB C 13 39.86 . . 1 . . . A 183 . . . 6136 1 794 . 1 1 183 183 PHE N N 15 120.866 . . 1 . . . A 183 . . . 6136 1 795 . 1 1 184 184 ASP H H 1 7.890 . . 1 . . . A 184 . . . 6136 1 796 . 1 1 184 184 ASP C C 13 179.49 . . 1 . . . A 184 . . . 6136 1 797 . 1 1 184 184 ASP CA C 13 57.090 . . 1 . . . A 184 . . . 6136 1 798 . 1 1 184 184 ASP CB C 13 40.73 . . 1 . . . A 184 . . . 6136 1 799 . 1 1 184 184 ASP N N 15 120.412 . . 1 . . . A 184 . . . 6136 1 800 . 1 1 185 185 ALA H H 1 7.866 . . 1 . . . A 185 . . . 6136 1 801 . 1 1 185 185 ALA C C 13 179.81 . . 1 . . . A 185 . . . 6136 1 802 . 1 1 185 185 ALA CA C 13 54.698 . . 1 . . . A 185 . . . 6136 1 803 . 1 1 185 185 ALA CB C 13 19.07 . . 1 . . . A 185 . . . 6136 1 804 . 1 1 185 185 ALA N N 15 124.038 . . 1 . . . A 185 . . . 6136 1 805 . 1 1 186 186 ALA H H 1 8.831 . . 1 . . . A 186 . . . 6136 1 806 . 1 1 186 186 ALA C C 13 179.90 . . 1 . . . A 186 . . . 6136 1 807 . 1 1 186 186 ALA CA C 13 54.514 . . 1 . . . A 186 . . . 6136 1 808 . 1 1 186 186 ALA CB C 13 20.77 . . 1 . . . A 186 . . . 6136 1 809 . 1 1 186 186 ALA N N 15 121.552 . . 1 . . . A 186 . . . 6136 1 810 . 1 1 187 187 ASN H H 1 8.306 . . 1 . . . A 187 . . . 6136 1 811 . 1 1 187 187 ASN C C 13 177.33 . . 1 . . . A 187 . . . 6136 1 812 . 1 1 187 187 ASN CA C 13 56.508 . . 1 . . . A 187 . . . 6136 1 813 . 1 1 187 187 ASN CB C 13 38.01 . . 1 . . . A 187 . . . 6136 1 814 . 1 1 187 187 ASN N N 15 117.185 . . 1 . . . A 187 . . . 6136 1 815 . 1 1 188 188 SER H H 1 7.409 . . 1 . . . A 188 . . . 6136 1 816 . 1 1 188 188 SER C C 13 175.77 . . 1 . . . A 188 . . . 6136 1 817 . 1 1 188 188 SER CA C 13 61.030 . . 1 . . . A 188 . . . 6136 1 818 . 1 1 188 188 SER CB C 13 62.86 . . 1 . . . A 188 . . . 6136 1 819 . 1 1 188 188 SER N N 15 113.815 . . 1 . . . A 188 . . . 6136 1 820 . 1 1 189 189 MET H H 1 7.283 . . 1 . . . A 189 . . . 6136 1 821 . 1 1 189 189 MET C C 13 177.96 . . 1 . . . A 189 . . . 6136 1 822 . 1 1 189 189 MET CA C 13 55.946 . . 1 . . . A 189 . . . 6136 1 823 . 1 1 189 189 MET CB C 13 31.83 . . 1 . . . A 189 . . . 6136 1 824 . 1 1 189 189 MET N N 15 122.340 . . 1 . . . A 189 . . . 6136 1 825 . 1 1 190 190 LEU H H 1 8.265 . . 1 . . . A 190 . . . 6136 1 826 . 1 1 190 190 LEU C C 13 180.50 . . 1 . . . A 190 . . . 6136 1 827 . 1 1 190 190 LEU CA C 13 56.004 . . 1 . . . A 190 . . . 6136 1 828 . 1 1 190 190 LEU CB C 13 41.25 . . 1 . . . A 190 . . . 6136 1 829 . 1 1 190 190 LEU N N 15 121.605 . . 1 . . . A 190 . . . 6136 1 830 . 1 1 191 191 VAL H H 1 7.259 . . 1 . . . A 191 . . . 6136 1 831 . 1 1 191 191 VAL C C 13 177.38 . . 1 . . . A 191 . . . 6136 1 832 . 1 1 191 191 VAL CA C 13 64.157 . . 1 . . . A 191 . . . 6136 1 833 . 1 1 191 191 VAL CB C 13 31.44 . . 1 . . . A 191 . . . 6136 1 834 . 1 1 191 191 VAL N N 15 113.767 . . 1 . . . A 191 . . . 6136 1 835 . 1 1 192 192 GLN H H 1 7.063 . . 1 . . . A 192 . . . 6136 1 836 . 1 1 192 192 GLN C C 13 175.68 . . 1 . . . A 192 . . . 6136 1 837 . 1 1 192 192 GLN CA C 13 56.455 . . 1 . . . A 192 . . . 6136 1 838 . 1 1 192 192 GLN CB C 13 30.05 . . 1 . . . A 192 . . . 6136 1 839 . 1 1 192 192 GLN N N 15 117.421 . . 1 . . . A 192 . . . 6136 1 840 . 1 1 193 193 HIS H H 1 7.342 . . 1 . . . A 193 . . . 6136 1 841 . 1 1 193 193 HIS C C 13 173.02 . . 1 . . . A 193 . . . 6136 1 842 . 1 1 193 193 HIS CA C 13 54.093 . . 1 . . . A 193 . . . 6136 1 843 . 1 1 193 193 HIS CB C 13 29.61 . . 1 . . . A 193 . . . 6136 1 844 . 1 1 193 193 HIS N N 15 115.386 . . 1 . . . A 193 . . . 6136 1 845 . 1 1 194 194 PRO C C 13 176.44 . . 1 . . . A 194 . . . 6136 1 846 . 1 1 194 194 PRO CA C 13 64.34 . . 1 . . . A 194 . . . 6136 1 847 . 1 1 194 194 PRO CB C 13 31.89 . . 1 . . . A 194 . . . 6136 1 848 . 1 1 195 195 GLU H H 1 9.838 . . 1 . . . A 195 . . . 6136 1 849 . 1 1 195 195 GLU C C 13 176.32 . . 1 . . . A 195 . . . 6136 1 850 . 1 1 195 195 GLU CA C 13 56.865 . . 1 . . . A 195 . . . 6136 1 851 . 1 1 195 195 GLU CB C 13 27.69 . . 1 . . . A 195 . . . 6136 1 852 . 1 1 195 195 GLU N N 15 121.444 . . 1 . . . A 195 . . . 6136 1 853 . 1 1 196 196 VAL H H 1 6.878 . . 1 . . . A 196 . . . 6136 1 854 . 1 1 196 196 VAL C C 13 175.72 . . 1 . . . A 196 . . . 6136 1 855 . 1 1 196 196 VAL CA C 13 63.620 . . 1 . . . A 196 . . . 6136 1 856 . 1 1 196 196 VAL CB C 13 32.07 . . 1 . . . A 196 . . . 6136 1 857 . 1 1 196 196 VAL N N 15 124.094 . . 1 . . . A 196 . . . 6136 1 858 . 1 1 197 197 LYS H H 1 7.811 . . 1 . . . A 197 . . . 6136 1 859 . 1 1 197 197 LYS C C 13 175.29 . . 1 . . . A 197 . . . 6136 1 860 . 1 1 197 197 LYS CA C 13 55.384 . . 1 . . . A 197 . . . 6136 1 861 . 1 1 197 197 LYS CB C 13 33.14 . . 1 . . . A 197 . . . 6136 1 862 . 1 1 197 197 LYS N N 15 124.457 . . 1 . . . A 197 . . . 6136 1 863 . 1 1 198 198 HIS H H 1 6.753 . . 1 . . . A 198 . . . 6136 1 864 . 1 1 198 198 HIS C C 13 173.45 . . 1 . . . A 198 . . . 6136 1 865 . 1 1 198 198 HIS CA C 13 51.909 . . 1 . . . A 198 . . . 6136 1 866 . 1 1 198 198 HIS CB C 13 28.06 . . 1 . . . A 198 . . . 6136 1 867 . 1 1 198 198 HIS N N 15 116.871 . . 1 . . . A 198 . . . 6136 1 868 . 1 1 199 199 TRP H H 1 8.192 . . 1 . . . A 199 . . . 6136 1 869 . 1 1 199 199 TRP C C 13 175.74 . . 1 . . . A 199 . . . 6136 1 870 . 1 1 199 199 TRP CA C 13 56.092 . . 1 . . . A 199 . . . 6136 1 871 . 1 1 199 199 TRP CB C 13 32.82 . . 1 . . . A 199 . . . 6136 1 872 . 1 1 199 199 TRP N N 15 121.072 . . 1 . . . A 199 . . . 6136 1 873 . 1 1 200 200 LEU H H 1 8.912 . . 1 . . . A 200 . . . 6136 1 874 . 1 1 200 200 LEU C C 13 176.31 . . 1 . . . A 200 . . . 6136 1 875 . 1 1 200 200 LEU CA C 13 53.477 . . 1 . . . A 200 . . . 6136 1 876 . 1 1 200 200 LEU CB C 13 42.70 . . 1 . . . A 200 . . . 6136 1 877 . 1 1 200 200 LEU N N 15 121.647 . . 1 . . . A 200 . . . 6136 1 878 . 1 1 201 201 ILE H H 1 8.622 . . 1 . . . A 201 . . . 6136 1 879 . 1 1 201 201 ILE C C 13 173.88 . . 1 . . . A 201 . . . 6136 1 880 . 1 1 201 201 ILE CA C 13 59.941 . . 1 . . . A 201 . . . 6136 1 881 . 1 1 201 201 ILE CB C 13 38.49 . . 1 . . . A 201 . . . 6136 1 882 . 1 1 201 201 ILE N N 15 123.452 . . 1 . . . A 201 . . . 6136 1 883 . 1 1 202 202 VAL H H 1 9.098 . . 1 . . . A 202 . . . 6136 1 884 . 1 1 202 202 VAL C C 13 173.77 . . 1 . . . A 202 . . . 6136 1 885 . 1 1 202 202 VAL CA C 13 61.717 . . 1 . . . A 202 . . . 6136 1 886 . 1 1 202 202 VAL CB C 13 34.57 . . 1 . . . A 202 . . . 6136 1 887 . 1 1 202 202 VAL N N 15 128.315 . . 1 . . . A 202 . . . 6136 1 888 . 1 1 203 203 GLY H H 1 6.388 . . 1 . . . A 203 . . . 6136 1 889 . 1 1 203 203 GLY C C 13 172.99 . . 1 . . . A 203 . . . 6136 1 890 . 1 1 203 203 GLY CA C 13 44.149 . . 1 . . . A 203 . . . 6136 1 891 . 1 1 203 203 GLY N N 15 109.039 . . 1 . . . A 203 . . . 6136 1 892 . 1 1 204 204 MET H H 1 9.619 . . 1 . . . A 204 . . . 6136 1 893 . 1 1 204 204 MET C C 13 172.12 . . 1 . . . A 204 . . . 6136 1 894 . 1 1 204 204 MET CA C 13 58.219 . . 1 . . . A 204 . . . 6136 1 895 . 1 1 204 204 MET CB C 13 32.49 . . 1 . . . A 204 . . . 6136 1 896 . 1 1 204 204 MET N N 15 118.686 . . 1 . . . A 204 . . . 6136 1 897 . 1 1 205 205 ASN H H 1 7.143 . . 1 . . . A 205 . . . 6136 1 898 . 1 1 205 205 ASN C C 13 175.47 . . 1 . . . A 205 . . . 6136 1 899 . 1 1 205 205 ASN CA C 13 50.960 . . 1 . . . A 205 . . . 6136 1 900 . 1 1 205 205 ASN CB C 13 39.57 . . 1 . . . A 205 . . . 6136 1 901 . 1 1 205 205 ASN N N 15 113.351 . . 1 . . . A 205 . . . 6136 1 902 . 1 1 206 206 ASP H H 1 7.963 . . 1 . . . A 206 . . . 6136 1 903 . 1 1 206 206 ASP C C 13 177.38 . . 1 . . . A 206 . . . 6136 1 904 . 1 1 206 206 ASP CA C 13 58.938 . . 1 . . . A 206 . . . 6136 1 905 . 1 1 206 206 ASP CB C 13 41.94 . . 1 . . . A 206 . . . 6136 1 906 . 1 1 206 206 ASP N N 15 120.651 . . 1 . . . A 206 . . . 6136 1 907 . 1 1 207 207 SER H H 1 9.117 . . 1 . . . A 207 . . . 6136 1 908 . 1 1 207 207 SER C C 13 174.90 . . 1 . . . A 207 . . . 6136 1 909 . 1 1 207 207 SER CA C 13 63.054 . . 1 . . . A 207 . . . 6136 1 910 . 1 1 207 207 SER N N 15 115.912 . . 1 . . . A 207 . . . 6136 1 911 . 1 1 208 208 THR H H 1 7.535 . . 1 . . . A 208 . . . 6136 1 912 . 1 1 208 208 THR C C 13 175.28 . . 1 . . . A 208 . . . 6136 1 913 . 1 1 208 208 THR CA C 13 66.105 . . 1 . . . A 208 . . . 6136 1 914 . 1 1 208 208 THR CB C 13 68.81 . . 1 . . . A 208 . . . 6136 1 915 . 1 1 208 208 THR N N 15 116.808 . . 1 . . . A 208 . . . 6136 1 916 . 1 1 209 209 VAL H H 1 7.680 . . 1 . . . A 209 . . . 6136 1 917 . 1 1 209 209 VAL C C 13 178.27 . . 1 . . . A 209 . . . 6136 1 918 . 1 1 209 209 VAL CA C 13 67.148 . . 1 . . . A 209 . . . 6136 1 919 . 1 1 209 209 VAL CB C 13 32.21 . . 1 . . . A 209 . . . 6136 1 920 . 1 1 209 209 VAL N N 15 120.642 . . 1 . . . A 209 . . . 6136 1 921 . 1 1 210 210 LEU H H 1 9.413 . . 1 . . . A 210 . . . 6136 1 922 . 1 1 210 210 LEU C C 13 179.08 . . 1 . . . A 210 . . . 6136 1 923 . 1 1 210 210 LEU CA C 13 58.312 . . 1 . . . A 210 . . . 6136 1 924 . 1 1 210 210 LEU CB C 13 41.38 . . 1 . . . A 210 . . . 6136 1 925 . 1 1 210 210 LEU N N 15 121.510 . . 1 . . . A 210 . . . 6136 1 926 . 1 1 211 211 GLY H H 1 8.267 . . 1 . . . A 211 . . . 6136 1 927 . 1 1 211 211 GLY C C 13 175.79 . . 1 . . . A 211 . . . 6136 1 928 . 1 1 211 211 GLY CA C 13 48.459 . . 1 . . . A 211 . . . 6136 1 929 . 1 1 211 211 GLY N N 15 106.677 . . 1 . . . A 211 . . . 6136 1 930 . 1 1 212 212 GLY H H 1 7.531 . . 1 . . . A 212 . . . 6136 1 931 . 1 1 212 212 GLY C C 13 175.30 . . 1 . . . A 212 . . . 6136 1 932 . 1 1 212 212 GLY CA C 13 47.246 . . 1 . . . A 212 . . . 6136 1 933 . 1 1 212 212 GLY N N 15 107.789 . . 1 . . . A 212 . . . 6136 1 934 . 1 1 213 213 VAL H H 1 8.777 . . 1 . . . A 213 . . . 6136 1 935 . 1 1 213 213 VAL C C 13 179.27 . . 1 . . . A 213 . . . 6136 1 936 . 1 1 213 213 VAL CA C 13 67.127 . . 1 . . . A 213 . . . 6136 1 937 . 1 1 213 213 VAL CB C 13 31.13 . . 1 . . . A 213 . . . 6136 1 938 . 1 1 213 213 VAL N N 15 124.693 . . 1 . . . A 213 . . . 6136 1 939 . 1 1 214 214 ARG H H 1 9.136 . . 1 . . . A 214 . . . 6136 1 940 . 1 1 214 214 ARG C C 13 180.32 . . 1 . . . A 214 . . . 6136 1 941 . 1 1 214 214 ARG CA C 13 58.294 . . 1 . . . A 214 . . . 6136 1 942 . 1 1 214 214 ARG CB C 13 32.75 . . 1 . . . A 214 . . . 6136 1 943 . 1 1 214 214 ARG N N 15 120.625 . . 1 . . . A 214 . . . 6136 1 944 . 1 1 215 215 ALA H H 1 7.901 . . 1 . . . A 215 . . . 6136 1 945 . 1 1 215 215 ALA C C 13 180.60 . . 1 . . . A 215 . . . 6136 1 946 . 1 1 215 215 ALA CA C 13 55.03 . . 1 . . . A 215 . . . 6136 1 947 . 1 1 215 215 ALA CB C 13 18.29 . . 1 . . . A 215 . . . 6136 1 948 . 1 1 215 215 ALA N N 15 123.751 . . 1 . . . A 215 . . . 6136 1 949 . 1 1 216 216 THR H H 1 7.883 . . 1 . . . A 216 . . . 6136 1 950 . 1 1 216 216 THR C C 13 177.72 . . 1 . . . A 216 . . . 6136 1 951 . 1 1 216 216 THR CA C 13 66.096 . . 1 . . . A 216 . . . 6136 1 952 . 1 1 216 216 THR CB C 13 67.92 . . 1 . . . A 216 . . . 6136 1 953 . 1 1 216 216 THR N N 15 113.141 . . 1 . . . A 216 . . . 6136 1 954 . 1 1 217 217 GLU H H 1 8.111 . . 1 . . . A 217 . . . 6136 1 955 . 1 1 217 217 GLU C C 13 181.45 . . 1 . . . A 217 . . . 6136 1 956 . 1 1 217 217 GLU CA C 13 58.704 . . 1 . . . A 217 . . . 6136 1 957 . 1 1 217 217 GLU CB C 13 29.16 . . 1 . . . A 217 . . . 6136 1 958 . 1 1 217 217 GLU N N 15 124.927 . . 1 . . . A 217 . . . 6136 1 959 . 1 1 218 218 GLY H H 1 7.871 . . 1 . . . A 218 . . . 6136 1 960 . 1 1 218 218 GLY C C 13 174.91 . . 1 . . . A 218 . . . 6136 1 961 . 1 1 218 218 GLY CA C 13 46.431 . . 1 . . . A 218 . . . 6136 1 962 . 1 1 218 218 GLY N N 15 108.359 . . 1 . . . A 218 . . . 6136 1 963 . 1 1 219 219 GLN H H 1 7.199 . . 1 . . . A 219 . . . 6136 1 964 . 1 1 219 219 GLN C C 13 175.78 . . 1 . . . A 219 . . . 6136 1 965 . 1 1 219 219 GLN CA C 13 54.335 . . 1 . . . A 219 . . . 6136 1 966 . 1 1 219 219 GLN CB C 13 28.24 . . 1 . . . A 219 . . . 6136 1 967 . 1 1 219 219 GLN N N 15 117.266 . . 1 . . . A 219 . . . 6136 1 968 . 1 1 220 220 GLY H H 1 7.697 . . 1 . . . A 220 . . . 6136 1 969 . 1 1 220 220 GLY C C 13 174.85 . . 1 . . . A 220 . . . 6136 1 970 . 1 1 220 220 GLY CA C 13 45.335 . . 1 . . . A 220 . . . 6136 1 971 . 1 1 220 220 GLY N N 15 106.711 . . 1 . . . A 220 . . . 6136 1 972 . 1 1 221 221 PHE H H 1 7.690 . . 1 . . . A 221 . . . 6136 1 973 . 1 1 221 221 PHE C C 13 177.07 . . 1 . . . A 221 . . . 6136 1 974 . 1 1 221 221 PHE CA C 13 59.116 . . 1 . . . A 221 . . . 6136 1 975 . 1 1 221 221 PHE CB C 13 39.76 . . 1 . . . A 221 . . . 6136 1 976 . 1 1 221 221 PHE N N 15 119.073 . . 1 . . . A 221 . . . 6136 1 977 . 1 1 222 222 LYS H H 1 9.359 . . 1 . . . A 222 . . . 6136 1 978 . 1 1 222 222 LYS C C 13 177.36 . . 1 . . . A 222 . . . 6136 1 979 . 1 1 222 222 LYS CA C 13 54.813 . . 1 . . . A 222 . . . 6136 1 980 . 1 1 222 222 LYS CB C 13 32.98 . . 1 . . . A 222 . . . 6136 1 981 . 1 1 222 222 LYS N N 15 125.744 . . 1 . . . A 222 . . . 6136 1 982 . 1 1 223 223 ALA H H 1 8.317 . . 1 . . . A 223 . . . 6136 1 983 . 1 1 223 223 ALA C C 13 178.75 . . 1 . . . A 223 . . . 6136 1 984 . 1 1 223 223 ALA CA C 13 55.397 . . 1 . . . A 223 . . . 6136 1 985 . 1 1 223 223 ALA CB C 13 18.09 . . 1 . . . A 223 . . . 6136 1 986 . 1 1 223 223 ALA N N 15 123.211 . . 1 . . . A 223 . . . 6136 1 987 . 1 1 224 224 ALA H H 1 7.865 . . 1 . . . A 224 . . . 6136 1 988 . 1 1 224 224 ALA C C 13 179.70 . . 1 . . . A 224 . . . 6136 1 989 . 1 1 224 224 ALA CA C 13 54.348 . . 1 . . . A 224 . . . 6136 1 990 . 1 1 224 224 ALA CB C 13 19.24 . . 1 . . . A 224 . . . 6136 1 991 . 1 1 224 224 ALA N N 15 115.541 . . 1 . . . A 224 . . . 6136 1 992 . 1 1 225 225 ASP H H 1 7.924 . . 1 . . . A 225 . . . 6136 1 993 . 1 1 225 225 ASP C C 13 172.39 . . 1 . . . A 225 . . . 6136 1 994 . 1 1 225 225 ASP CA C 13 56.403 . . 1 . . . A 225 . . . 6136 1 995 . 1 1 225 225 ASP CB C 13 43.57 . . 1 . . . A 225 . . . 6136 1 996 . 1 1 225 225 ASP N N 15 116.333 . . 1 . . . A 225 . . . 6136 1 997 . 1 1 226 226 ILE H H 1 7.628 . . 1 . . . A 226 . . . 6136 1 998 . 1 1 226 226 ILE C C 13 174.88 . . 1 . . . A 226 . . . 6136 1 999 . 1 1 226 226 ILE CA C 13 58.232 . . 1 . . . A 226 . . . 6136 1 1000 . 1 1 226 226 ILE CB C 13 40.70 . . 1 . . . A 226 . . . 6136 1 1001 . 1 1 226 226 ILE N N 15 120.591 . . 1 . . . A 226 . . . 6136 1 1002 . 1 1 227 227 ILE H H 1 8.760 . . 1 . . . A 227 . . . 6136 1 1003 . 1 1 227 227 ILE C C 13 174.29 . . 1 . . . A 227 . . . 6136 1 1004 . 1 1 227 227 ILE CA C 13 61.630 . . 1 . . . A 227 . . . 6136 1 1005 . 1 1 227 227 ILE CB C 13 40.46 . . 1 . . . A 227 . . . 6136 1 1006 . 1 1 227 227 ILE N N 15 123.129 . . 1 . . . A 227 . . . 6136 1 1007 . 1 1 228 228 GLY H H 1 8.410 . . 1 . . . A 228 . . . 6136 1 1008 . 1 1 228 228 GLY CA C 13 44.652 . . 1 . . . A 228 . . . 6136 1 1009 . 1 1 228 228 GLY N N 15 113.521 . . 1 . . . A 228 . . . 6136 1 1010 . 1 1 229 229 ILE C C 13 175.88 . . 1 . . . A 229 . . . 6136 1 1011 . 1 1 229 229 ILE CA C 13 59.09 . . 1 . . . A 229 . . . 6136 1 1012 . 1 1 229 229 ILE CB C 13 40.25 . . 1 . . . A 229 . . . 6136 1 1013 . 1 1 230 230 GLY H H 1 8.394 . . 1 . . . A 230 . . . 6136 1 1014 . 1 1 230 230 GLY C C 13 172.71 . . 1 . . . A 230 . . . 6136 1 1015 . 1 1 230 230 GLY CA C 13 43.75 . . 1 . . . A 230 . . . 6136 1 1016 . 1 1 230 230 GLY N N 15 115.464 . . 1 . . . A 230 . . . 6136 1 1017 . 1 1 231 231 ILE H H 1 5.647 . . 1 . . . A 231 . . . 6136 1 1018 . 1 1 231 231 ILE C C 13 173.75 . . 1 . . . A 231 . . . 6136 1 1019 . 1 1 231 231 ILE CA C 13 62.877 . . 1 . . . A 231 . . . 6136 1 1020 . 1 1 231 231 ILE CB C 13 42.50 . . 1 . . . A 231 . . . 6136 1 1021 . 1 1 231 231 ILE N N 15 115.937 . . 1 . . . A 231 . . . 6136 1 1022 . 1 1 232 232 ASN H H 1 8.051 . . 1 . . . A 232 . . . 6136 1 1023 . 1 1 232 232 ASN C C 13 178.25 . . 1 . . . A 232 . . . 6136 1 1024 . 1 1 232 232 ASN CA C 13 58.267 . . 1 . . . A 232 . . . 6136 1 1025 . 1 1 232 232 ASN CB C 13 37.45 . . 1 . . . A 232 . . . 6136 1 1026 . 1 1 232 232 ASN N N 15 120.003 . . 1 . . . A 232 . . . 6136 1 1027 . 1 1 233 233 GLY H H 1 9.108 . . 1 . . . A 233 . . . 6136 1 1028 . 1 1 233 233 GLY C C 13 175.81 . . 1 . . . A 233 . . . 6136 1 1029 . 1 1 233 233 GLY CA C 13 47.61 . . 1 . . . A 233 . . . 6136 1 1030 . 1 1 233 233 GLY N N 15 118.735 . . 1 . . . A 233 . . . 6136 1 1031 . 1 1 234 234 VAL H H 1 8.726 . . 1 . . . A 234 . . . 6136 1 1032 . 1 1 234 234 VAL C C 13 177.06 . . 1 . . . A 234 . . . 6136 1 1033 . 1 1 234 234 VAL CA C 13 63.509 . . 1 . . . A 234 . . . 6136 1 1034 . 1 1 234 234 VAL CB C 13 30.87 . . 1 . . . A 234 . . . 6136 1 1035 . 1 1 234 234 VAL N N 15 116.358 . . 1 . . . A 234 . . . 6136 1 1036 . 1 1 235 235 ASP H H 1 6.359 . . 1 . . . A 235 . . . 6136 1 1037 . 1 1 235 235 ASP C C 13 176.66 . . 1 . . . A 235 . . . 6136 1 1038 . 1 1 235 235 ASP CA C 13 55.614 . . 1 . . . A 235 . . . 6136 1 1039 . 1 1 235 235 ASP CB C 13 40.48 . . 1 . . . A 235 . . . 6136 1 1040 . 1 1 235 235 ASP N N 15 119.659 . . 1 . . . A 235 . . . 6136 1 1041 . 1 1 236 236 ALA H H 1 7.196 . . 1 . . . A 236 . . . 6136 1 1042 . 1 1 236 236 ALA C C 13 176.72 . . 1 . . . A 236 . . . 6136 1 1043 . 1 1 236 236 ALA CA C 13 51.201 . . 1 . . . A 236 . . . 6136 1 1044 . 1 1 236 236 ALA CB C 13 20.48 . . 1 . . . A 236 . . . 6136 1 1045 . 1 1 236 236 ALA N N 15 121.531 . . 1 . . . A 236 . . . 6136 1 1046 . 1 1 237 237 VAL H H 1 6.768 . . 1 . . . A 237 . . . 6136 1 1047 . 1 1 237 237 VAL C C 13 178.13 . . 1 . . . A 237 . . . 6136 1 1048 . 1 1 237 237 VAL CA C 13 67.294 . . 1 . . . A 237 . . . 6136 1 1049 . 1 1 237 237 VAL CB C 13 31.51 . . 1 . . . A 237 . . . 6136 1 1050 . 1 1 237 237 VAL N N 15 119.975 . . 1 . . . A 237 . . . 6136 1 1051 . 1 1 238 238 SER C C 13 175.98 . . 1 . . . A 238 . . . 6136 1 1052 . 1 1 238 238 SER CA C 13 61.44 . . 1 . . . A 238 . . . 6136 1 1053 . 1 1 239 239 GLU H H 1 7.358 . . 1 . . . A 239 . . . 6136 1 1054 . 1 1 239 239 GLU C C 13 179.08 . . 1 . . . A 239 . . . 6136 1 1055 . 1 1 239 239 GLU CA C 13 58.074 . . 1 . . . A 239 . . . 6136 1 1056 . 1 1 239 239 GLU CB C 13 28.57 . . 1 . . . A 239 . . . 6136 1 1057 . 1 1 239 239 GLU N N 15 123.672 . . 1 . . . A 239 . . . 6136 1 1058 . 1 1 240 240 LEU H H 1 7.708 . . 1 . . . A 240 . . . 6136 1 1059 . 1 1 240 240 LEU C C 13 175.47 . . 1 . . . A 240 . . . 6136 1 1060 . 1 1 240 240 LEU CA C 13 55.915 . . 1 . . . A 240 . . . 6136 1 1061 . 1 1 240 240 LEU CB C 13 39.64 . . 1 . . . A 240 . . . 6136 1 1062 . 1 1 240 240 LEU N N 15 117.857 . . 1 . . . A 240 . . . 6136 1 1063 . 1 1 241 241 SER H H 1 7.229 . . 1 . . . A 241 . . . 6136 1 1064 . 1 1 241 241 SER C C 13 174.33 . . 1 . . . A 241 . . . 6136 1 1065 . 1 1 241 241 SER CA C 13 59.114 . . 1 . . . A 241 . . . 6136 1 1066 . 1 1 241 241 SER CB C 13 63.8 . . 1 . . . A 241 . . . 6136 1 1067 . 1 1 241 241 SER N N 15 110.517 . . 1 . . . A 241 . . . 6136 1 1068 . 1 1 242 242 LYS H H 1 6.945 . . 1 . . . A 242 . . . 6136 1 1069 . 1 1 242 242 LYS C C 13 176.63 . . 1 . . . A 242 . . . 6136 1 1070 . 1 1 242 242 LYS CA C 13 57.041 . . 1 . . . A 242 . . . 6136 1 1071 . 1 1 242 242 LYS CB C 13 33.55 . . 1 . . . A 242 . . . 6136 1 1072 . 1 1 242 242 LYS N N 15 122.568 . . 1 . . . A 242 . . . 6136 1 1073 . 1 1 243 243 ALA C C 13 177.94 . . 1 . . . A 243 . . . 6136 1 1074 . 1 1 243 243 ALA CA C 13 54.04 . . 1 . . . A 243 . . . 6136 1 1075 . 1 1 243 243 ALA CB C 13 19.03 . . 1 . . . A 243 . . . 6136 1 1076 . 1 1 244 244 GLN H H 1 7.495 . . 1 . . . A 244 . . . 6136 1 1077 . 1 1 244 244 GLN C C 13 174.66 . . 1 . . . A 244 . . . 6136 1 1078 . 1 1 244 244 GLN CA C 13 53.904 . . 1 . . . A 244 . . . 6136 1 1079 . 1 1 244 244 GLN CB C 13 30.20 . . 1 . . . A 244 . . . 6136 1 1080 . 1 1 244 244 GLN N N 15 115.480 . . 1 . . . A 244 . . . 6136 1 1081 . 1 1 245 245 ALA H H 1 8.321 . . 1 . . . A 245 . . . 6136 1 1082 . 1 1 245 245 ALA C C 13 177.43 . . 1 . . . A 245 . . . 6136 1 1083 . 1 1 245 245 ALA CA C 13 52.702 . . 1 . . . A 245 . . . 6136 1 1084 . 1 1 245 245 ALA CB C 13 18.88 . . 1 . . . A 245 . . . 6136 1 1085 . 1 1 245 245 ALA N N 15 125.134 . . 1 . . . A 245 . . . 6136 1 1086 . 1 1 246 246 THR H H 1 7.743 . . 1 . . . A 246 . . . 6136 1 1087 . 1 1 246 246 THR C C 13 175.13 . . 1 . . . A 246 . . . 6136 1 1088 . 1 1 246 246 THR CA C 13 59.197 . . 1 . . . A 246 . . . 6136 1 1089 . 1 1 246 246 THR CB C 13 72.75 . . 1 . . . A 246 . . . 6136 1 1090 . 1 1 246 246 THR N N 15 112.296 . . 1 . . . A 246 . . . 6136 1 1091 . 1 1 247 247 GLY H H 1 9.838 . . 1 . . . A 247 . . . 6136 1 1092 . 1 1 247 247 GLY C C 13 171.15 . . 1 . . . A 247 . . . 6136 1 1093 . 1 1 247 247 GLY CA C 13 46.045 . . 1 . . . A 247 . . . 6136 1 1094 . 1 1 247 247 GLY N N 15 106.568 . . 1 . . . A 247 . . . 6136 1 1095 . 1 1 248 248 PHE H H 1 8.181 . . 1 . . . A 248 . . . 6136 1 1096 . 1 1 248 248 PHE C C 13 172.41 . . 1 . . . A 248 . . . 6136 1 1097 . 1 1 248 248 PHE CA C 13 57.164 . . 1 . . . A 248 . . . 6136 1 1098 . 1 1 248 248 PHE CB C 13 39.55 . . 1 . . . A 248 . . . 6136 1 1099 . 1 1 248 248 PHE N N 15 122.786 . . 1 . . . A 248 . . . 6136 1 1100 . 1 1 249 249 TYR H H 1 8.658 . . 1 . . . A 249 . . . 6136 1 1101 . 1 1 249 249 TYR C C 13 174.25 . . 1 . . . A 249 . . . 6136 1 1102 . 1 1 249 249 TYR CA C 13 59.393 . . 1 . . . A 249 . . . 6136 1 1103 . 1 1 249 249 TYR CB C 13 43.80 . . 1 . . . A 249 . . . 6136 1 1104 . 1 1 249 249 TYR N N 15 130.890 . . 1 . . . A 249 . . . 6136 1 1105 . 1 1 250 250 GLY H H 1 6.611 . . 1 . . . A 250 . . . 6136 1 1106 . 1 1 250 250 GLY C C 13 169.38 . . 1 . . . A 250 . . . 6136 1 1107 . 1 1 250 250 GLY CA C 13 45.011 . . 1 . . . A 250 . . . 6136 1 1108 . 1 1 250 250 GLY N N 15 99.641 . . 1 . . . A 250 . . . 6136 1 1109 . 1 1 251 251 SER H H 1 9.191 . . 1 . . . A 251 . . . 6136 1 1110 . 1 1 251 251 SER C C 13 172.67 . . 1 . . . A 251 . . . 6136 1 1111 . 1 1 251 251 SER CA C 13 56.265 . . 1 . . . A 251 . . . 6136 1 1112 . 1 1 251 251 SER CB C 13 64.81 . . 1 . . . A 251 . . . 6136 1 1113 . 1 1 251 251 SER N N 15 112.990 . . 1 . . . A 251 . . . 6136 1 1114 . 1 1 252 252 LEU H H 1 8.247 . . 1 . . . A 252 . . . 6136 1 1115 . 1 1 252 252 LEU C C 13 173.49 . . 1 . . . A 252 . . . 6136 1 1116 . 1 1 252 252 LEU CA C 13 53.25 . . 1 . . . A 252 . . . 6136 1 1117 . 1 1 252 252 LEU CB C 13 39.96 . . 1 . . . A 252 . . . 6136 1 1118 . 1 1 252 252 LEU N N 15 128.609 . . 1 . . . A 252 . . . 6136 1 1119 . 1 1 253 253 LEU H H 1 9.367 . . 1 . . . A 253 . . . 6136 1 1120 . 1 1 253 253 LEU CA C 13 52.020 . . 1 . . . A 253 . . . 6136 1 1121 . 1 1 253 253 LEU CB C 13 43.35 . . 1 . . . A 253 . . . 6136 1 1122 . 1 1 253 253 LEU N N 15 129.675 . . 1 . . . A 253 . . . 6136 1 1123 . 1 1 256 256 PRO C C 13 177.71 . . 1 . . . A 256 . . . 6136 1 1124 . 1 1 256 256 PRO CA C 13 64.44 . . 1 . . . A 256 . . . 6136 1 1125 . 1 1 257 257 ASP H H 1 9.550 . . 1 . . . A 257 . . . 6136 1 1126 . 1 1 257 257 ASP C C 13 177.43 . . 1 . . . A 257 . . . 6136 1 1127 . 1 1 257 257 ASP CA C 13 55.495 . . 1 . . . A 257 . . . 6136 1 1128 . 1 1 257 257 ASP CB C 13 35.50 . . 1 . . . A 257 . . . 6136 1 1129 . 1 1 257 257 ASP N N 15 115.073 . . 1 . . . A 257 . . . 6136 1 1130 . 1 1 258 258 VAL H H 1 6.648 . . 1 . . . A 258 . . . 6136 1 1131 . 1 1 258 258 VAL C C 13 178.45 . . 1 . . . A 258 . . . 6136 1 1132 . 1 1 258 258 VAL CA C 13 65.431 . . 1 . . . A 258 . . . 6136 1 1133 . 1 1 258 258 VAL CB C 13 31.16 . . 1 . . . A 258 . . . 6136 1 1134 . 1 1 258 258 VAL N N 15 121.713 . . 1 . . . A 258 . . . 6136 1 1135 . 1 1 259 259 HIS H H 1 7.868 . . 1 . . . A 259 . . . 6136 1 1136 . 1 1 259 259 HIS C C 13 178.71 . . 1 . . . A 259 . . . 6136 1 1137 . 1 1 259 259 HIS CA C 13 60.697 . . 1 . . . A 259 . . . 6136 1 1138 . 1 1 259 259 HIS CB C 13 28.88 . . 1 . . . A 259 . . . 6136 1 1139 . 1 1 259 259 HIS N N 15 118.278 . . 1 . . . A 259 . . . 6136 1 1140 . 1 1 260 260 GLY H H 1 8.186 . . 1 . . . A 260 . . . 6136 1 1141 . 1 1 260 260 GLY C C 13 173.54 . . 1 . . . A 260 . . . 6136 1 1142 . 1 1 260 260 GLY CA C 13 47.112 . . 1 . . . A 260 . . . 6136 1 1143 . 1 1 260 260 GLY N N 15 104.361 . . 1 . . . A 260 . . . 6136 1 1144 . 1 1 261 261 TYR H H 1 8.720 . . 1 . . . A 261 . . . 6136 1 1145 . 1 1 261 261 TYR C C 13 177.49 . . 1 . . . A 261 . . . 6136 1 1146 . 1 1 261 261 TYR CA C 13 61.714 . . 1 . . . A 261 . . . 6136 1 1147 . 1 1 261 261 TYR CB C 13 40.55 . . 1 . . . A 261 . . . 6136 1 1148 . 1 1 261 261 TYR N N 15 123.832 . . 1 . . . A 261 . . . 6136 1 1149 . 1 1 262 262 LYS H H 1 9.338 . . 1 . . . A 262 . . . 6136 1 1150 . 1 1 262 262 LYS C C 13 179.93 . . 1 . . . A 262 . . . 6136 1 1151 . 1 1 262 262 LYS CA C 13 58.711 . . 1 . . . A 262 . . . 6136 1 1152 . 1 1 262 262 LYS CB C 13 31.89 . . 1 . . . A 262 . . . 6136 1 1153 . 1 1 262 262 LYS N N 15 117.572 . . 1 . . . A 262 . . . 6136 1 1154 . 1 1 263 263 SER H H 1 7.160 . . 1 . . . A 263 . . . 6136 1 1155 . 1 1 263 263 SER C C 13 175.91 . . 1 . . . A 263 . . . 6136 1 1156 . 1 1 263 263 SER CA C 13 62.625 . . 1 . . . A 263 . . . 6136 1 1157 . 1 1 263 263 SER CB C 13 61.37 . . 1 . . . A 263 . . . 6136 1 1158 . 1 1 263 263 SER N N 15 112.485 . . 1 . . . A 263 . . . 6136 1 1159 . 1 1 264 264 SER H H 1 6.961 . . 1 . . . A 264 . . . 6136 1 1160 . 1 1 264 264 SER C C 13 174.81 . . 1 . . . A 264 . . . 6136 1 1161 . 1 1 264 264 SER CA C 13 63.018 . . 1 . . . A 264 . . . 6136 1 1162 . 1 1 264 264 SER N N 15 119.387 . . 1 . . . A 264 . . . 6136 1 1163 . 1 1 265 265 GLU H H 1 8.878 . . 1 . . . A 265 . . . 6136 1 1164 . 1 1 265 265 GLU C C 13 178.31 . . 1 . . . A 265 . . . 6136 1 1165 . 1 1 265 265 GLU CA C 13 59.497 . . 1 . . . A 265 . . . 6136 1 1166 . 1 1 265 265 GLU CB C 13 30.35 . . 1 . . . A 265 . . . 6136 1 1167 . 1 1 265 265 GLU N N 15 124.779 . . 1 . . . A 265 . . . 6136 1 1168 . 1 1 266 266 MET H H 1 8.627 . . 1 . . . A 266 . . . 6136 1 1169 . 1 1 266 266 MET C C 13 179.72 . . 1 . . . A 266 . . . 6136 1 1170 . 1 1 266 266 MET CA C 13 59.238 . . 1 . . . A 266 . . . 6136 1 1171 . 1 1 266 266 MET CB C 13 33.55 . . 1 . . . A 266 . . . 6136 1 1172 . 1 1 266 266 MET N N 15 118.286 . . 1 . . . A 266 . . . 6136 1 1173 . 1 1 267 267 LEU H H 1 7.952 . . 1 . . . A 267 . . . 6136 1 1174 . 1 1 267 267 LEU C C 13 177.32 . . 1 . . . A 267 . . . 6136 1 1175 . 1 1 267 267 LEU CA C 13 57.896 . . 1 . . . A 267 . . . 6136 1 1176 . 1 1 267 267 LEU CB C 13 40.75 . . 1 . . . A 267 . . . 6136 1 1177 . 1 1 267 267 LEU N N 15 122.999 . . 1 . . . A 267 . . . 6136 1 1178 . 1 1 268 268 TYR H H 1 8.489 . . 1 . . . A 268 . . . 6136 1 1179 . 1 1 268 268 TYR C C 13 176.54 . . 1 . . . A 268 . . . 6136 1 1180 . 1 1 268 268 TYR CA C 13 62.121 . . 1 . . . A 268 . . . 6136 1 1181 . 1 1 268 268 TYR CB C 13 37.62 . . 1 . . . A 268 . . . 6136 1 1182 . 1 1 268 268 TYR N N 15 121.011 . . 1 . . . A 268 . . . 6136 1 1183 . 1 1 269 269 ASN H H 1 8.565 . . 1 . . . A 269 . . . 6136 1 1184 . 1 1 269 269 ASN C C 13 177.94 . . 1 . . . A 269 . . . 6136 1 1185 . 1 1 269 269 ASN CA C 13 55.846 . . 1 . . . A 269 . . . 6136 1 1186 . 1 1 269 269 ASN CB C 13 37.82 . . 1 . . . A 269 . . . 6136 1 1187 . 1 1 269 269 ASN N N 15 117.629 . . 1 . . . A 269 . . . 6136 1 1188 . 1 1 270 270 TRP H H 1 7.979 . . 1 . . . A 270 . . . 6136 1 1189 . 1 1 270 270 TRP C C 13 178.59 . . 1 . . . A 270 . . . 6136 1 1190 . 1 1 270 270 TRP CA C 13 57.031 . . 1 . . . A 270 . . . 6136 1 1191 . 1 1 270 270 TRP CB C 13 30.84 . . 1 . . . A 270 . . . 6136 1 1192 . 1 1 270 270 TRP N N 15 124.481 . . 1 . . . A 270 . . . 6136 1 1193 . 1 1 271 271 VAL H H 1 8.305 . . 1 . . . A 271 . . . 6136 1 1194 . 1 1 271 271 VAL C C 13 177.33 . . 1 . . . A 271 . . . 6136 1 1195 . 1 1 271 271 VAL CA C 13 64.685 . . 1 . . . A 271 . . . 6136 1 1196 . 1 1 271 271 VAL CB C 13 32.41 . . 1 . . . A 271 . . . 6136 1 1197 . 1 1 271 271 VAL N N 15 117.643 . . 1 . . . A 271 . . . 6136 1 1198 . 1 1 272 272 ALA H H 1 8.936 . . 1 . . . A 272 . . . 6136 1 1199 . 1 1 272 272 ALA C C 13 179.28 . . 1 . . . A 272 . . . 6136 1 1200 . 1 1 272 272 ALA CA C 13 53.302 . . 1 . . . A 272 . . . 6136 1 1201 . 1 1 272 272 ALA CB C 13 19.09 . . 1 . . . A 272 . . . 6136 1 1202 . 1 1 272 272 ALA N N 15 119.838 . . 1 . . . A 272 . . . 6136 1 1203 . 1 1 273 273 LYS H H 1 6.778 . . 1 . . . A 273 . . . 6136 1 1204 . 1 1 273 273 LYS C C 13 175.35 . . 1 . . . A 273 . . . 6136 1 1205 . 1 1 273 273 LYS CA C 13 53.421 . . 1 . . . A 273 . . . 6136 1 1206 . 1 1 273 273 LYS CB C 13 33.67 . . 1 . . . A 273 . . . 6136 1 1207 . 1 1 273 273 LYS N N 15 113.657 . . 1 . . . A 273 . . . 6136 1 1208 . 1 1 274 274 ASP H H 1 7.190 . . 1 . . . A 274 . . . 6136 1 1209 . 1 1 274 274 ASP C C 13 174.99 . . 1 . . . A 274 . . . 6136 1 1210 . 1 1 274 274 ASP CA C 13 55.674 . . 1 . . . A 274 . . . 6136 1 1211 . 1 1 274 274 ASP CB C 13 39.84 . . 1 . . . A 274 . . . 6136 1 1212 . 1 1 274 274 ASP N N 15 117.643 . . 1 . . . A 274 . . . 6136 1 1213 . 1 1 275 275 VAL H H 1 7.623 . . 1 . . . A 275 . . . 6136 1 1214 . 1 1 275 275 VAL C C 13 175.20 . . 1 . . . A 275 . . . 6136 1 1215 . 1 1 275 275 VAL CA C 13 61.479 . . 1 . . . A 275 . . . 6136 1 1216 . 1 1 275 275 VAL CB C 13 31.92 . . 1 . . . A 275 . . . 6136 1 1217 . 1 1 275 275 VAL N N 15 120.382 . . 1 . . . A 275 . . . 6136 1 1218 . 1 1 276 276 GLU H H 1 8.359 . . 1 . . . A 276 . . . 6136 1 1219 . 1 1 276 276 GLU C C 13 173.86 . . 1 . . . A 276 . . . 6136 1 1220 . 1 1 276 276 GLU CA C 13 53.859 . . 1 . . . A 276 . . . 6136 1 1221 . 1 1 276 276 GLU CB C 13 29.53 . . 1 . . . A 276 . . . 6136 1 1222 . 1 1 276 276 GLU N N 15 132.031 . . 1 . . . A 276 . . . 6136 1 1223 . 1 1 278 278 PRO C C 13 177.45 . . 1 . . . A 278 . . . 6136 1 1224 . 1 1 278 278 PRO CA C 13 61.62 . . 1 . . . A 278 . . . 6136 1 1225 . 1 1 278 278 PRO CB C 13 31.60 . . 1 . . . A 278 . . . 6136 1 1226 . 1 1 279 279 LYS H H 1 8.289 . . 1 . . . A 279 . . . 6136 1 1227 . 1 1 279 279 LYS C C 13 177.17 . . 1 . . . A 279 . . . 6136 1 1228 . 1 1 279 279 LYS CA C 13 58.019 . . 1 . . . A 279 . . . 6136 1 1229 . 1 1 279 279 LYS CB C 13 32.07 . . 1 . . . A 279 . . . 6136 1 1230 . 1 1 279 279 LYS N N 15 121.512 . . 1 . . . A 279 . . . 6136 1 1231 . 1 1 280 280 PHE H H 1 7.877 . . 1 . . . A 280 . . . 6136 1 1232 . 1 1 280 280 PHE C C 13 173.74 . . 1 . . . A 280 . . . 6136 1 1233 . 1 1 280 280 PHE CA C 13 57.366 . . 1 . . . A 280 . . . 6136 1 1234 . 1 1 280 280 PHE CB C 13 42.29 . . 1 . . . A 280 . . . 6136 1 1235 . 1 1 280 280 PHE N N 15 119.357 . . 1 . . . A 280 . . . 6136 1 1236 . 1 1 281 281 THR H H 1 7.860 . . 1 . . . A 281 . . . 6136 1 1237 . 1 1 281 281 THR C C 13 171.34 . . 1 . . . A 281 . . . 6136 1 1238 . 1 1 281 281 THR CA C 13 62.384 . . 1 . . . A 281 . . . 6136 1 1239 . 1 1 281 281 THR CB C 13 70.40 . . 1 . . . A 281 . . . 6136 1 1240 . 1 1 281 281 THR N N 15 126.175 . . 1 . . . A 281 . . . 6136 1 1241 . 1 1 282 282 GLU H H 1 8.353 . . 1 . . . A 282 . . . 6136 1 1242 . 1 1 282 282 GLU C C 13 175.26 . . 1 . . . A 282 . . . 6136 1 1243 . 1 1 282 282 GLU CA C 13 53.263 . . 1 . . . A 282 . . . 6136 1 1244 . 1 1 282 282 GLU CB C 13 32.21 . . 1 . . . A 282 . . . 6136 1 1245 . 1 1 282 282 GLU N N 15 126.630 . . 1 . . . A 282 . . . 6136 1 1246 . 1 1 283 283 VAL H H 1 8.632 . . 1 . . . A 283 . . . 6136 1 1247 . 1 1 283 283 VAL C C 13 179.22 . . 1 . . . A 283 . . . 6136 1 1248 . 1 1 283 283 VAL CA C 13 62.436 . . 1 . . . A 283 . . . 6136 1 1249 . 1 1 283 283 VAL CB C 13 32.04 . . 1 . . . A 283 . . . 6136 1 1250 . 1 1 283 283 VAL N N 15 127.892 . . 1 . . . A 283 . . . 6136 1 1251 . 1 1 284 284 THR C C 13 174.35 . . 1 . . . A 284 . . . 6136 1 1252 . 1 1 284 284 THR CA C 13 62.69 . . 1 . . . A 284 . . . 6136 1 1253 . 1 1 285 285 ASP H H 1 7.139 . . 1 . . . A 285 . . . 6136 1 1254 . 1 1 285 285 ASP C C 13 175.26 . . 1 . . . A 285 . . . 6136 1 1255 . 1 1 285 285 ASP CA C 13 55.506 . . 1 . . . A 285 . . . 6136 1 1256 . 1 1 285 285 ASP CB C 13 41.42 . . 1 . . . A 285 . . . 6136 1 1257 . 1 1 285 285 ASP N N 15 122.560 . . 1 . . . A 285 . . . 6136 1 1258 . 1 1 286 286 VAL H H 1 7.887 . . 1 . . . A 286 . . . 6136 1 1259 . 1 1 286 286 VAL C C 13 172.56 . . 1 . . . A 286 . . . 6136 1 1260 . 1 1 286 286 VAL CA C 13 61.055 . . 1 . . . A 286 . . . 6136 1 1261 . 1 1 286 286 VAL CB C 13 33.13 . . 1 . . . A 286 . . . 6136 1 1262 . 1 1 286 286 VAL N N 15 117.409 . . 1 . . . A 286 . . . 6136 1 1263 . 1 1 287 287 VAL H H 1 7.763 . . 1 . . . A 287 . . . 6136 1 1264 . 1 1 287 287 VAL C C 13 173.62 . . 1 . . . A 287 . . . 6136 1 1265 . 1 1 287 287 VAL CA C 13 59.98 . . 1 . . . A 287 . . . 6136 1 1266 . 1 1 287 287 VAL CB C 13 35.93 . . 1 . . . A 287 . . . 6136 1 1267 . 1 1 287 287 VAL N N 15 124.063 . . 1 . . . A 287 . . . 6136 1 1268 . 1 1 288 288 LEU H H 1 8.334 . . 1 . . . A 288 . . . 6136 1 1269 . 1 1 288 288 LEU C C 13 175.85 . . 1 . . . A 288 . . . 6136 1 1270 . 1 1 288 288 LEU CA C 13 55.08 . . 1 . . . A 288 . . . 6136 1 1271 . 1 1 288 288 LEU CB C 13 41.73 . . 1 . . . A 288 . . . 6136 1 1272 . 1 1 288 288 LEU N N 15 127.947 . . 1 . . . A 288 . . . 6136 1 1273 . 1 1 289 289 ILE H H 1 9.450 . . 1 . . . A 289 . . . 6136 1 1274 . 1 1 289 289 ILE C C 13 174.00 . . 1 . . . A 289 . . . 6136 1 1275 . 1 1 289 289 ILE CA C 13 58.548 . . 1 . . . A 289 . . . 6136 1 1276 . 1 1 289 289 ILE CB C 13 40.47 . . 1 . . . A 289 . . . 6136 1 1277 . 1 1 289 289 ILE N N 15 123.871 . . 1 . . . A 289 . . . 6136 1 1278 . 1 1 290 290 THR H H 1 9.095 . . 1 . . . A 290 . . . 6136 1 1279 . 1 1 290 290 THR C C 13 175.70 . . 1 . . . A 290 . . . 6136 1 1280 . 1 1 290 290 THR CA C 13 58.952 . . 1 . . . A 290 . . . 6136 1 1281 . 1 1 290 290 THR CB C 13 72.25 . . 1 . . . A 290 . . . 6136 1 1282 . 1 1 290 290 THR N N 15 114.485 . . 1 . . . A 290 . . . 6136 1 1283 . 1 1 291 291 ARG H H 1 8.964 . . 1 . . . A 291 . . . 6136 1 1284 . 1 1 291 291 ARG C C 13 177.25 . . 1 . . . A 291 . . . 6136 1 1285 . 1 1 291 291 ARG CA C 13 60.354 . . 1 . . . A 291 . . . 6136 1 1286 . 1 1 291 291 ARG CB C 13 29.86 . . 1 . . . A 291 . . . 6136 1 1287 . 1 1 291 291 ARG N N 15 119.709 . . 1 . . . A 291 . . . 6136 1 1288 . 1 1 292 292 ASP H H 1 7.847 . . 1 . . . A 292 . . . 6136 1 1289 . 1 1 292 292 ASP C C 13 176.94 . . 1 . . . A 292 . . . 6136 1 1290 . 1 1 292 292 ASP CA C 13 55.897 . . 1 . . . A 292 . . . 6136 1 1291 . 1 1 292 292 ASP CB C 13 41.65 . . 1 . . . A 292 . . . 6136 1 1292 . 1 1 292 292 ASP N N 15 114.617 . . 1 . . . A 292 . . . 6136 1 1293 . 1 1 293 293 ASN H H 1 7.360 . . 1 . . . A 293 . . . 6136 1 1294 . 1 1 293 293 ASN C C 13 179.11 . . 1 . . . A 293 . . . 6136 1 1295 . 1 1 293 293 ASN CA C 13 52.599 . . 1 . . . A 293 . . . 6136 1 1296 . 1 1 293 293 ASN CB C 13 40.46 . . 1 . . . A 293 . . . 6136 1 1297 . 1 1 293 293 ASN N N 15 115.744 . . 1 . . . A 293 . . . 6136 1 1298 . 1 1 294 294 PHE H H 1 8.129 . . 1 . . . A 294 . . . 6136 1 1299 . 1 1 294 294 PHE C C 13 175.78 . . 1 . . . A 294 . . . 6136 1 1300 . 1 1 294 294 PHE CA C 13 61.882 . . 1 . . . A 294 . . . 6136 1 1301 . 1 1 294 294 PHE CB C 13 38.24 . . 1 . . . A 294 . . . 6136 1 1302 . 1 1 294 294 PHE N N 15 119.513 . . 1 . . . A 294 . . . 6136 1 1303 . 1 1 295 295 LYS H H 1 6.759 . . 1 . . . A 295 . . . 6136 1 1304 . 1 1 295 295 LYS C C 13 179.04 . . 1 . . . A 295 . . . 6136 1 1305 . 1 1 295 295 LYS CA C 13 59.356 . . 1 . . . A 295 . . . 6136 1 1306 . 1 1 295 295 LYS CB C 13 31.07 . . 1 . . . A 295 . . . 6136 1 1307 . 1 1 295 295 LYS N N 15 121.477 . . 1 . . . A 295 . . . 6136 1 1308 . 1 1 296 296 GLU H H 1 7.890 . . 1 . . . A 296 . . . 6136 1 1309 . 1 1 296 296 GLU C C 13 179.54 . . 1 . . . A 296 . . . 6136 1 1310 . 1 1 296 296 GLU CA C 13 58.95 . . 1 . . . A 296 . . . 6136 1 1311 . 1 1 296 296 GLU CB C 13 29.08 . . 1 . . . A 296 . . . 6136 1 1312 . 1 1 296 296 GLU N N 15 119.948 . . 1 . . . A 296 . . . 6136 1 1313 . 1 1 297 297 GLU H H 1 7.912 . . 1 . . . A 297 . . . 6136 1 1314 . 1 1 297 297 GLU C C 13 180.05 . . 1 . . . A 297 . . . 6136 1 1315 . 1 1 297 297 GLU CA C 13 58.183 . . 1 . . . A 297 . . . 6136 1 1316 . 1 1 297 297 GLU CB C 13 30.57 . . 1 . . . A 297 . . . 6136 1 1317 . 1 1 297 297 GLU N N 15 118.356 . . 1 . . . A 297 . . . 6136 1 1318 . 1 1 298 298 LEU H H 1 8.211 . . 1 . . . A 298 . . . 6136 1 1319 . 1 1 298 298 LEU C C 13 179.67 . . 1 . . . A 298 . . . 6136 1 1320 . 1 1 298 298 LEU CA C 13 58.346 . . 1 . . . A 298 . . . 6136 1 1321 . 1 1 298 298 LEU CB C 13 40.49 . . 1 . . . A 298 . . . 6136 1 1322 . 1 1 298 298 LEU N N 15 120.214 . . 1 . . . A 298 . . . 6136 1 1323 . 1 1 299 299 GLU H H 1 7.754 . . 1 . . . A 299 . . . 6136 1 1324 . 1 1 299 299 GLU C C 13 180.61 . . 1 . . . A 299 . . . 6136 1 1325 . 1 1 299 299 GLU CA C 13 59.090 . . 1 . . . A 299 . . . 6136 1 1326 . 1 1 299 299 GLU CB C 13 29.05 . . 1 . . . A 299 . . . 6136 1 1327 . 1 1 299 299 GLU N N 15 120.342 . . 1 . . . A 299 . . . 6136 1 1328 . 1 1 300 300 LYS H H 1 7.918 . . 1 . . . A 300 . . . 6136 1 1329 . 1 1 300 300 LYS C C 13 178.11 . . 1 . . . A 300 . . . 6136 1 1330 . 1 1 300 300 LYS CA C 13 59.184 . . 1 . . . A 300 . . . 6136 1 1331 . 1 1 300 300 LYS CB C 13 32.33 . . 1 . . . A 300 . . . 6136 1 1332 . 1 1 300 300 LYS N N 15 121.300 . . 1 . . . A 300 . . . 6136 1 1333 . 1 1 301 301 LYS H H 1 7.033 . . 1 . . . A 301 . . . 6136 1 1334 . 1 1 301 301 LYS C C 13 176.28 . . 1 . . . A 301 . . . 6136 1 1335 . 1 1 301 301 LYS CA C 13 59.207 . . 1 . . . A 301 . . . 6136 1 1336 . 1 1 301 301 LYS CB C 13 33.74 . . 1 . . . A 301 . . . 6136 1 1337 . 1 1 301 301 LYS N N 15 116.745 . . 1 . . . A 301 . . . 6136 1 1338 . 1 1 302 302 GLY H H 1 7.737 . . 1 . . . A 302 . . . 6136 1 1339 . 1 1 302 302 GLY C C 13 175.43 . . 1 . . . A 302 . . . 6136 1 1340 . 1 1 302 302 GLY CA C 13 45.725 . . 1 . . . A 302 . . . 6136 1 1341 . 1 1 302 302 GLY N N 15 107.821 . . 1 . . . A 302 . . . 6136 1 1342 . 1 1 303 303 LEU H H 1 7.771 . . 1 . . . A 303 . . . 6136 1 1343 . 1 1 303 303 LEU C C 13 176.54 . . 1 . . . A 303 . . . 6136 1 1344 . 1 1 303 303 LEU CA C 13 53.382 . . 1 . . . A 303 . . . 6136 1 1345 . 1 1 303 303 LEU CB C 13 42.31 . . 1 . . . A 303 . . . 6136 1 1346 . 1 1 303 303 LEU N N 15 118.328 . . 1 . . . A 303 . . . 6136 1 1347 . 1 1 304 304 GLY H H 1 8.093 . . 1 . . . A 304 . . . 6136 1 1348 . 1 1 304 304 GLY C C 13 174.03 . . 1 . . . A 304 . . . 6136 1 1349 . 1 1 304 304 GLY CA C 13 44.908 . . 1 . . . A 304 . . . 6136 1 1350 . 1 1 304 304 GLY N N 15 108.850 . . 1 . . . A 304 . . . 6136 1 1351 . 1 1 305 305 GLY H H 1 8.199 . . 1 . . . A 305 . . . 6136 1 1352 . 1 1 305 305 GLY C C 13 173.15 . . 1 . . . A 305 . . . 6136 1 1353 . 1 1 305 305 GLY CA C 13 44.994 . . 1 . . . A 305 . . . 6136 1 1354 . 1 1 305 305 GLY N N 15 110.063 . . 1 . . . A 305 . . . 6136 1 1355 . 1 1 306 306 LYS H H 1 7.694 . . 1 . . . A 306 . . . 6136 1 1356 . 1 1 306 306 LYS C C 13 181.416 . . 1 . . . A 306 . . . 6136 1 1357 . 1 1 306 306 LYS CA C 13 57.28 . . 1 . . . A 306 . . . 6136 1 1358 . 1 1 306 306 LYS N N 15 126.508 . . 1 . . . A 306 . . . 6136 1 stop_ save_