data_17510 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17510 _Entry.Title ; 1H, 13C and 15N backbone and side-chain resonance assignments of Drosophila melanogaster Ssu72 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-03-04 _Entry.Accession_date 2011-03-04 _Entry.Last_release_date 2011-03-07 _Entry.Original_release_date 2011-03-07 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Jon Werner-Allen . W. . . 17510 2 Pei Zhou . . . . 17510 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17510 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 791 17510 '15N chemical shifts' 177 17510 '1H chemical shifts' 1287 17510 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2012-04-06 2011-03-04 update BMRB 'update entry citation' 17510 1 . . 2011-07-07 2011-03-04 original author 'original release' 17510 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17510 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21732054 _Citation.Full_citation . _Citation.Title ; (1)H, (13)C and (15)N backbone and side-chain resonance assignments of Drosophila melanogaster Ssu72. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 6 _Citation.Journal_issue 1 _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 57 _Citation.Page_last 61 _Citation.Year 2012 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Jon Werner-Allen . W. . . 17510 1 2 Pei Zhou . . . . 17510 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID CTD 17510 1 'RNA Pol II' 17510 1 Ssu72 17510 1 'cis proline' 17510 1 phosphatase 17510 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17510 _Assembly.ID 1 _Assembly.Name 'protein ligand complex' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Drosophila melanogaster Ssu72' 1 $Ssu72 A . yes native no no . . . 17510 1 2 'inorganic phosphate' 2 $entity_PO4 A . no native no no . . 'binds in the protein active site' 17510 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Ssu72 _Entity.Sf_category entity _Entity.Sf_framecode Ssu72 _Entity.Entry_ID 17510 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Ssu72 _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 ; GSHMTDPSKLAVAVVCSSNM NRSMEAHNFLAKKGFNVRSY GTGERVKLPGMAFDKPNVYE FGTKYEDIYRDLESKDKEFY TQNGLLHMLDRNRRIKKCPE RFQDTKEQFDIIVTVEERVY DLVVMHMESMESVDNRPVHV LNVDVVDNAEDALMGAFVIT DMINMMAKSTDLDNDIDELI QEFEERRKRVILHSVLFY ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 198 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _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_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'RNA polymerase II C-terminal domain phosphatase' 17510 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 -2 GLY . 17510 1 2 -1 SER . 17510 1 3 0 HIS . 17510 1 4 1 MET . 17510 1 5 2 THR . 17510 1 6 3 ASP . 17510 1 7 4 PRO . 17510 1 8 5 SER . 17510 1 9 6 LYS . 17510 1 10 7 LEU . 17510 1 11 8 ALA . 17510 1 12 9 VAL . 17510 1 13 10 ALA . 17510 1 14 11 VAL . 17510 1 15 12 VAL . 17510 1 16 13 CYS . 17510 1 17 14 SER . 17510 1 18 15 SER . 17510 1 19 16 ASN . 17510 1 20 17 MET . 17510 1 21 18 ASN . 17510 1 22 19 ARG . 17510 1 23 20 SER . 17510 1 24 21 MET . 17510 1 25 22 GLU . 17510 1 26 23 ALA . 17510 1 27 24 HIS . 17510 1 28 25 ASN . 17510 1 29 26 PHE . 17510 1 30 27 LEU . 17510 1 31 28 ALA . 17510 1 32 29 LYS . 17510 1 33 30 LYS . 17510 1 34 31 GLY . 17510 1 35 32 PHE . 17510 1 36 33 ASN . 17510 1 37 34 VAL . 17510 1 38 35 ARG . 17510 1 39 36 SER . 17510 1 40 37 TYR . 17510 1 41 38 GLY . 17510 1 42 39 THR . 17510 1 43 40 GLY . 17510 1 44 41 GLU . 17510 1 45 42 ARG . 17510 1 46 43 VAL . 17510 1 47 44 LYS . 17510 1 48 45 LEU . 17510 1 49 46 PRO . 17510 1 50 47 GLY . 17510 1 51 48 MET . 17510 1 52 49 ALA . 17510 1 53 50 PHE . 17510 1 54 51 ASP . 17510 1 55 52 LYS . 17510 1 56 53 PRO . 17510 1 57 54 ASN . 17510 1 58 55 VAL . 17510 1 59 56 TYR . 17510 1 60 57 GLU . 17510 1 61 58 PHE . 17510 1 62 59 GLY . 17510 1 63 60 THR . 17510 1 64 61 LYS . 17510 1 65 62 TYR . 17510 1 66 63 GLU . 17510 1 67 64 ASP . 17510 1 68 65 ILE . 17510 1 69 66 TYR . 17510 1 70 67 ARG . 17510 1 71 68 ASP . 17510 1 72 69 LEU . 17510 1 73 70 GLU . 17510 1 74 71 SER . 17510 1 75 72 LYS . 17510 1 76 73 ASP . 17510 1 77 74 LYS . 17510 1 78 75 GLU . 17510 1 79 76 PHE . 17510 1 80 77 TYR . 17510 1 81 78 THR . 17510 1 82 79 GLN . 17510 1 83 80 ASN . 17510 1 84 81 GLY . 17510 1 85 82 LEU . 17510 1 86 83 LEU . 17510 1 87 84 HIS . 17510 1 88 85 MET . 17510 1 89 86 LEU . 17510 1 90 87 ASP . 17510 1 91 88 ARG . 17510 1 92 89 ASN . 17510 1 93 90 ARG . 17510 1 94 91 ARG . 17510 1 95 92 ILE . 17510 1 96 93 LYS . 17510 1 97 94 LYS . 17510 1 98 95 CYS . 17510 1 99 96 PRO . 17510 1 100 97 GLU . 17510 1 101 98 ARG . 17510 1 102 99 PHE . 17510 1 103 100 GLN . 17510 1 104 101 ASP . 17510 1 105 102 THR . 17510 1 106 103 LYS . 17510 1 107 104 GLU . 17510 1 108 105 GLN . 17510 1 109 106 PHE . 17510 1 110 107 ASP . 17510 1 111 108 ILE . 17510 1 112 109 ILE . 17510 1 113 110 VAL . 17510 1 114 111 THR . 17510 1 115 112 VAL . 17510 1 116 113 GLU . 17510 1 117 114 GLU . 17510 1 118 115 ARG . 17510 1 119 116 VAL . 17510 1 120 117 TYR . 17510 1 121 118 ASP . 17510 1 122 119 LEU . 17510 1 123 120 VAL . 17510 1 124 121 VAL . 17510 1 125 122 MET . 17510 1 126 123 HIS . 17510 1 127 124 MET . 17510 1 128 125 GLU . 17510 1 129 126 SER . 17510 1 130 127 MET . 17510 1 131 128 GLU . 17510 1 132 129 SER . 17510 1 133 130 VAL . 17510 1 134 131 ASP . 17510 1 135 132 ASN . 17510 1 136 133 ARG . 17510 1 137 134 PRO . 17510 1 138 135 VAL . 17510 1 139 136 HIS . 17510 1 140 137 VAL . 17510 1 141 138 LEU . 17510 1 142 139 ASN . 17510 1 143 140 VAL . 17510 1 144 141 ASP . 17510 1 145 142 VAL . 17510 1 146 143 VAL . 17510 1 147 144 ASP . 17510 1 148 145 ASN . 17510 1 149 146 ALA . 17510 1 150 147 GLU . 17510 1 151 148 ASP . 17510 1 152 149 ALA . 17510 1 153 150 LEU . 17510 1 154 151 MET . 17510 1 155 152 GLY . 17510 1 156 153 ALA . 17510 1 157 154 PHE . 17510 1 158 155 VAL . 17510 1 159 156 ILE . 17510 1 160 157 THR . 17510 1 161 158 ASP . 17510 1 162 159 MET . 17510 1 163 160 ILE . 17510 1 164 161 ASN . 17510 1 165 162 MET . 17510 1 166 163 MET . 17510 1 167 164 ALA . 17510 1 168 165 LYS . 17510 1 169 166 SER . 17510 1 170 167 THR . 17510 1 171 168 ASP . 17510 1 172 169 LEU . 17510 1 173 170 ASP . 17510 1 174 171 ASN . 17510 1 175 172 ASP . 17510 1 176 173 ILE . 17510 1 177 174 ASP . 17510 1 178 175 GLU . 17510 1 179 176 LEU . 17510 1 180 177 ILE . 17510 1 181 178 GLN . 17510 1 182 179 GLU . 17510 1 183 180 PHE . 17510 1 184 181 GLU . 17510 1 185 182 GLU . 17510 1 186 183 ARG . 17510 1 187 184 ARG . 17510 1 188 185 LYS . 17510 1 189 186 ARG . 17510 1 190 187 VAL . 17510 1 191 188 ILE . 17510 1 192 189 LEU . 17510 1 193 190 HIS . 17510 1 194 191 SER . 17510 1 195 192 VAL . 17510 1 196 193 LEU . 17510 1 197 194 PHE . 17510 1 198 195 TYR . 17510 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 17510 1 . SER 2 2 17510 1 . HIS 3 3 17510 1 . MET 4 4 17510 1 . THR 5 5 17510 1 . ASP 6 6 17510 1 . PRO 7 7 17510 1 . SER 8 8 17510 1 . LYS 9 9 17510 1 . LEU 10 10 17510 1 . ALA 11 11 17510 1 . VAL 12 12 17510 1 . ALA 13 13 17510 1 . VAL 14 14 17510 1 . VAL 15 15 17510 1 . CYS 16 16 17510 1 . SER 17 17 17510 1 . SER 18 18 17510 1 . ASN 19 19 17510 1 . MET 20 20 17510 1 . ASN 21 21 17510 1 . ARG 22 22 17510 1 . SER 23 23 17510 1 . MET 24 24 17510 1 . GLU 25 25 17510 1 . ALA 26 26 17510 1 . HIS 27 27 17510 1 . ASN 28 28 17510 1 . PHE 29 29 17510 1 . LEU 30 30 17510 1 . ALA 31 31 17510 1 . LYS 32 32 17510 1 . LYS 33 33 17510 1 . GLY 34 34 17510 1 . PHE 35 35 17510 1 . ASN 36 36 17510 1 . VAL 37 37 17510 1 . ARG 38 38 17510 1 . SER 39 39 17510 1 . TYR 40 40 17510 1 . GLY 41 41 17510 1 . THR 42 42 17510 1 . GLY 43 43 17510 1 . GLU 44 44 17510 1 . ARG 45 45 17510 1 . VAL 46 46 17510 1 . LYS 47 47 17510 1 . LEU 48 48 17510 1 . PRO 49 49 17510 1 . GLY 50 50 17510 1 . MET 51 51 17510 1 . ALA 52 52 17510 1 . PHE 53 53 17510 1 . ASP 54 54 17510 1 . LYS 55 55 17510 1 . PRO 56 56 17510 1 . ASN 57 57 17510 1 . VAL 58 58 17510 1 . TYR 59 59 17510 1 . GLU 60 60 17510 1 . PHE 61 61 17510 1 . GLY 62 62 17510 1 . THR 63 63 17510 1 . LYS 64 64 17510 1 . TYR 65 65 17510 1 . GLU 66 66 17510 1 . ASP 67 67 17510 1 . ILE 68 68 17510 1 . TYR 69 69 17510 1 . ARG 70 70 17510 1 . ASP 71 71 17510 1 . LEU 72 72 17510 1 . GLU 73 73 17510 1 . SER 74 74 17510 1 . LYS 75 75 17510 1 . ASP 76 76 17510 1 . LYS 77 77 17510 1 . GLU 78 78 17510 1 . PHE 79 79 17510 1 . TYR 80 80 17510 1 . THR 81 81 17510 1 . GLN 82 82 17510 1 . ASN 83 83 17510 1 . GLY 84 84 17510 1 . LEU 85 85 17510 1 . LEU 86 86 17510 1 . HIS 87 87 17510 1 . MET 88 88 17510 1 . LEU 89 89 17510 1 . ASP 90 90 17510 1 . ARG 91 91 17510 1 . ASN 92 92 17510 1 . ARG 93 93 17510 1 . ARG 94 94 17510 1 . ILE 95 95 17510 1 . LYS 96 96 17510 1 . LYS 97 97 17510 1 . CYS 98 98 17510 1 . PRO 99 99 17510 1 . GLU 100 100 17510 1 . ARG 101 101 17510 1 . PHE 102 102 17510 1 . GLN 103 103 17510 1 . ASP 104 104 17510 1 . THR 105 105 17510 1 . LYS 106 106 17510 1 . GLU 107 107 17510 1 . GLN 108 108 17510 1 . PHE 109 109 17510 1 . ASP 110 110 17510 1 . ILE 111 111 17510 1 . ILE 112 112 17510 1 . VAL 113 113 17510 1 . THR 114 114 17510 1 . VAL 115 115 17510 1 . GLU 116 116 17510 1 . GLU 117 117 17510 1 . ARG 118 118 17510 1 . VAL 119 119 17510 1 . TYR 120 120 17510 1 . ASP 121 121 17510 1 . LEU 122 122 17510 1 . VAL 123 123 17510 1 . VAL 124 124 17510 1 . MET 125 125 17510 1 . HIS 126 126 17510 1 . MET 127 127 17510 1 . GLU 128 128 17510 1 . SER 129 129 17510 1 . MET 130 130 17510 1 . GLU 131 131 17510 1 . SER 132 132 17510 1 . VAL 133 133 17510 1 . ASP 134 134 17510 1 . ASN 135 135 17510 1 . ARG 136 136 17510 1 . PRO 137 137 17510 1 . VAL 138 138 17510 1 . HIS 139 139 17510 1 . VAL 140 140 17510 1 . LEU 141 141 17510 1 . ASN 142 142 17510 1 . VAL 143 143 17510 1 . ASP 144 144 17510 1 . VAL 145 145 17510 1 . VAL 146 146 17510 1 . ASP 147 147 17510 1 . ASN 148 148 17510 1 . ALA 149 149 17510 1 . GLU 150 150 17510 1 . ASP 151 151 17510 1 . ALA 152 152 17510 1 . LEU 153 153 17510 1 . MET 154 154 17510 1 . GLY 155 155 17510 1 . ALA 156 156 17510 1 . PHE 157 157 17510 1 . VAL 158 158 17510 1 . ILE 159 159 17510 1 . THR 160 160 17510 1 . ASP 161 161 17510 1 . MET 162 162 17510 1 . ILE 163 163 17510 1 . ASN 164 164 17510 1 . MET 165 165 17510 1 . MET 166 166 17510 1 . ALA 167 167 17510 1 . LYS 168 168 17510 1 . SER 169 169 17510 1 . THR 170 170 17510 1 . ASP 171 171 17510 1 . LEU 172 172 17510 1 . ASP 173 173 17510 1 . ASN 174 174 17510 1 . ASP 175 175 17510 1 . ILE 176 176 17510 1 . ASP 177 177 17510 1 . GLU 178 178 17510 1 . LEU 179 179 17510 1 . ILE 180 180 17510 1 . GLN 181 181 17510 1 . GLU 182 182 17510 1 . PHE 183 183 17510 1 . GLU 184 184 17510 1 . GLU 185 185 17510 1 . ARG 186 186 17510 1 . ARG 187 187 17510 1 . LYS 188 188 17510 1 . ARG 189 189 17510 1 . VAL 190 190 17510 1 . ILE 191 191 17510 1 . LEU 192 192 17510 1 . HIS 193 193 17510 1 . SER 194 194 17510 1 . VAL 195 195 17510 1 . LEU 196 196 17510 1 . PHE 197 197 17510 1 . TYR 198 198 17510 1 stop_ save_ save_entity_PO4 _Entity.Sf_category entity _Entity.Sf_framecode entity_PO4 _Entity.Entry_ID 17510 _Entity.ID 2 _Entity.BMRB_code PO4 _Entity.Name 'PHOSPHATE ION' _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 . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID PO4 _Entity.Nonpolymer_comp_label $chem_comp_PO4 _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 94.971 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'PHOSPHATE ION' BMRB 17510 2 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'PHOSPHATE ION' BMRB 17510 2 PO4 'Three letter code' 17510 2 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 PO4 $chem_comp_PO4 17510 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 17510 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Ssu72 . 7227 organism . 'Drosophila melanogaster' 'fruit fly' . . Eukaryota Metazoa Drosophila melanogaster . . . . . . . . . . . . . 17510 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 17510 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Ssu72 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pet15b . . . 17510 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_PO4 _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_PO4 _Chem_comp.Entry_ID 17510 _Chem_comp.ID PO4 _Chem_comp.Provenance PDB _Chem_comp.Name 'PHOSPHATE ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code PO4 _Chem_comp.PDB_code PO4 _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces IPS _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code PO4 _Chem_comp.Number_atoms_all 5 _Chem_comp.Number_atoms_nh 5 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)/p-3 _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 -3 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'O4 P' _Chem_comp.Formula_weight 94.971 _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 1IXG _Chem_comp.Processing_site EBI _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _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 InChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)/p-3 InChI InChI 1.03 17510 PO4 NBIIXXVUZAFLBC-UHFFFAOYSA-K InChIKey InChI 1.03 17510 PO4 [O-]P(=O)([O-])[O-] SMILES 'OpenEye OEToolkits' 1.5.0 17510 PO4 [O-]P(=O)([O-])[O-] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 17510 PO4 [O-]P([O-])([O-])=O SMILES ACDLabs 10.04 17510 PO4 [O-][P]([O-])([O-])=O SMILES CACTVS 3.341 17510 PO4 [O-][P]([O-])([O-])=O SMILES_CANONICAL CACTVS 3.341 17510 PO4 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 phosphate 'SYSTEMATIC NAME' ACDLabs 10.04 17510 PO4 phosphate 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 17510 PO4 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 P P P P . P . . N 0 . . . 1 no no . . . . 29.995 . 23.516 . 13.249 . 0.000 0.000 0.000 1 . 17510 PO4 O1 O1 O1 O1 . O . . N 0 . . . 1 no no . . . . 31.092 . 22.988 . 14.164 . 0.000 -1.288 -0.911 2 . 17510 PO4 O2 O2 O2 O2 . O . . N -1 . . . 1 no no . . . . 30.404 . 24.896 . 12.647 . 0.000 1.288 -0.911 3 . 17510 PO4 O3 O3 O3 O3 . O . . N -1 . . . 1 no no . . . . 29.646 . 22.518 . 12.126 . -1.288 0.000 0.911 4 . 17510 PO4 O4 O4 O4 O4 . O . . N -1 . . . 1 no no . . . . 28.727 . 23.744 . 14.161 . 1.288 0.000 0.911 5 . 17510 PO4 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 . DOUB P O1 no N 1 . 17510 PO4 2 . SING P O2 no N 2 . 17510 PO4 3 . SING P O3 no N 3 . 17510 PO4 4 . SING P O4 no N 4 . 17510 PO4 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 17510 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Ssu72 '[U-100% 13C; U-100% 15N]' . . 1 $Ssu72 . . 1 . . mM . . . . 17510 2 2 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17510 2 3 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17510 2 4 'Sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 17510 2 5 'Potassium chloride' 'natural abundance' . . . . . . 25 . . mM . . . . 17510 2 6 dithiothreitol 'natural abundance' . . . . . . 2 . . mM . . . . 17510 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 17510 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Ssu72 '[U-100% 13C; U-100% 15N]' . . 1 $Ssu72 . . 1 . . mM . . . . 17510 3 2 D2O 'natural abundance' . . . . . . 100 . . % . . . . 17510 3 3 'Sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 17510 3 4 'Potassium chloride' 'natural abundance' . . . . . . 25 . . mM . . . . 17510 3 5 dithiothreitol 'natural abundance' . . . . . . 2 . . mM . . . . 17510 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 17510 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Ssu72 '[U-10% 13C]' . . 1 $Ssu72 . . 1 . . mM . . . . 17510 4 2 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17510 4 3 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17510 4 4 'Sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 17510 4 5 'Potassium chloride' 'natural abundance' . . . . . . 25 . . mM . . . . 17510 4 6 dithiothreitol 'natural abundance' . . . . . . 2 . . mM . . . . 17510 4 stop_ save_ save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17510 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Ssu72 '[U-100% 13C; U-100% 15N; U-80% 2H]' . . 1 $Ssu72 . . 1 . . mM . . . . 17510 1 2 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17510 1 3 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17510 1 4 'Sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 17510 1 5 'Potassium chloride' 'natural abundance' . . . . . . 25 . . mM . . . . 17510 1 6 dithiothreitol 'natural abundance' . . . . . . 2 . . mM . . . . 17510 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 17510 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 75 . mM 17510 1 pH 8 . pH 17510 1 pressure 1 . atm 17510 1 temperature 273 . K 17510 1 stop_ save_ ############################ # Computer software used # ############################ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 17510 _Software.ID 1 _Software.Type . _Software.Name CARA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 17510 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17510 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17510 _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_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 17510 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17510 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 600 . . . 17510 1 2 spectrometer_2 Varian INOVA . 800 . . . 17510 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 17510 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17510 1 2 '3D HNCO' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17510 1 3 '3D HN(CA)CO' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17510 1 4 '3D HNCA' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17510 1 5 '3D HN(CO)CA' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17510 1 6 '3D HNCACB' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17510 1 7 '3D HN(COCA)CB' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17510 1 8 '3D HN(CA)HA' no 1 $NMR_spectrometer_expt . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17510 1 9 '3D HN(COCA)HA' no 1 $NMR_spectrometer_expt . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17510 1 10 '2D 1H-13C HSQC' no 1 $NMR_spectrometer_expt . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17510 1 11 '3D HCCH-TOCSY' no 1 $NMR_spectrometer_expt . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17510 1 12 '3D 1H-13C NOESY' no 1 $NMR_spectrometer_expt . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17510 1 13 '3D 1H-15N NOESY' no 1 $NMR_spectrometer_expt . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17510 1 14 '2D 1H-13C HSQC' no 1 $NMR_spectrometer_expt . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17510 1 stop_ save_ save_NMR_spectrometer_expt _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt _NMR_spec_expt.Entry_ID 17510 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name . _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $CARA _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 17510 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . 17510 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 17510 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . 17510 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 17510 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 17510 1 2 '3D HNCO' . . . 17510 1 3 '3D HN(CA)CO' . . . 17510 1 4 '3D HNCA' . . . 17510 1 5 '3D HN(CO)CA' . . . 17510 1 6 '3D HNCACB' . . . 17510 1 7 '3D HN(COCA)CB' . . . 17510 1 8 '3D HN(CA)HA' . . . 17510 1 9 '3D HN(COCA)HA' . . . 17510 1 10 '2D 1H-13C HSQC' . . . 17510 1 11 '3D HCCH-TOCSY' . . . 17510 1 12 '3D 1H-13C NOESY' . . . 17510 1 13 '3D 1H-15N NOESY' . . . 17510 1 14 '2D 1H-13C HSQC' . . . 17510 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 5 5 THR HA H 1 4.357 0.02 . 1 . . . . . 2 THR HA . 17510 1 2 . 1 1 5 5 THR HB H 1 4.244 0.02 . 1 . . . . . 2 THR HB . 17510 1 3 . 1 1 5 5 THR HG21 H 1 1.244 0.02 . 1 . . . . . 2 THR HG2 . 17510 1 4 . 1 1 5 5 THR HG22 H 1 1.244 0.02 . 1 . . . . . 2 THR HG2 . 17510 1 5 . 1 1 5 5 THR HG23 H 1 1.244 0.02 . 1 . . . . . 2 THR HG2 . 17510 1 6 . 1 1 5 5 THR CA C 13 62.132 0.40 . 1 . . . . . 2 THR CA . 17510 1 7 . 1 1 5 5 THR CB C 13 69.845 0.40 . 1 . . . . . 2 THR CB . 17510 1 8 . 1 1 5 5 THR CG2 C 13 21.902 0.40 . 1 . . . . . 2 THR CG2 . 17510 1 9 . 1 1 6 6 ASP HA H 1 5.019 0.02 . 1 . . . . . 3 ASP HA . 17510 1 10 . 1 1 6 6 ASP HB2 H 1 2.647 0.02 . 2 . . . . . 3 ASP HB2 . 17510 1 11 . 1 1 6 6 ASP HB3 H 1 2.859 0.02 . 2 . . . . . 3 ASP HB3 . 17510 1 12 . 1 1 6 6 ASP CA C 13 51.861 0.40 . 1 . . . . . 3 ASP CA . 17510 1 13 . 1 1 6 6 ASP CB C 13 41.692 0.40 . 1 . . . . . 3 ASP CB . 17510 1 14 . 1 1 7 7 PRO HA H 1 4.400 0.02 . 1 . . . . . 4 PRO HA . 17510 1 15 . 1 1 7 7 PRO HB2 H 1 1.774 0.02 . 2 . . . . . 4 PRO HB2 . 17510 1 16 . 1 1 7 7 PRO HB3 H 1 2.031 0.02 . 2 . . . . . 4 PRO HB3 . 17510 1 17 . 1 1 7 7 PRO HG2 H 1 1.961 0.02 . 2 . . . . . 4 PRO HG . 17510 1 18 . 1 1 7 7 PRO HG3 H 1 1.961 0.02 . 2 . . . . . 4 PRO HG . 17510 1 19 . 1 1 7 7 PRO HD2 H 1 3.905 0.02 . 2 . . . . . 4 PRO HD . 17510 1 20 . 1 1 7 7 PRO HD3 H 1 3.905 0.02 . 2 . . . . . 4 PRO HD . 17510 1 21 . 1 1 7 7 PRO CA C 13 64.125 0.40 . 1 . . . . . 4 PRO CA . 17510 1 22 . 1 1 7 7 PRO CB C 13 32.213 0.40 . 1 . . . . . 4 PRO CB . 17510 1 23 . 1 1 7 7 PRO CG C 13 27.210 0.40 . 1 . . . . . 4 PRO CG . 17510 1 24 . 1 1 7 7 PRO CD C 13 51.041 0.40 . 1 . . . . . 4 PRO CD . 17510 1 25 . 1 1 8 8 SER H H 1 8.374 0.02 . 1 . . . . . 5 SER H . 17510 1 26 . 1 1 8 8 SER HA H 1 4.422 0.02 . 1 . . . . . 5 SER HA . 17510 1 27 . 1 1 8 8 SER HB2 H 1 4.089 0.02 . 2 . . . . . 5 SER HB2 . 17510 1 28 . 1 1 8 8 SER HB3 H 1 3.976 0.02 . 2 . . . . . 5 SER HB3 . 17510 1 29 . 1 1 8 8 SER C C 13 175.107 0.40 . 1 . . . . . 5 SER C . 17510 1 30 . 1 1 8 8 SER CA C 13 59.668 0.40 . 1 . . . . . 5 SER CA . 17510 1 31 . 1 1 8 8 SER CB C 13 63.629 0.40 . 1 . . . . . 5 SER CB . 17510 1 32 . 1 1 8 8 SER N N 15 114.132 0.40 . 1 . . . . . 5 SER N . 17510 1 33 . 1 1 9 9 LYS H H 1 8.052 0.02 . 1 . . . . . 6 LYS H . 17510 1 34 . 1 1 9 9 LYS HA H 1 4.447 0.02 . 1 . . . . . 6 LYS HA . 17510 1 35 . 1 1 9 9 LYS HB2 H 1 2.089 0.02 . 2 . . . . . 6 LYS HB2 . 17510 1 36 . 1 1 9 9 LYS HB3 H 1 1.954 0.02 . 2 . . . . . 6 LYS HB3 . 17510 1 37 . 1 1 9 9 LYS HG2 H 1 1.592 0.02 . 2 . . . . . 6 LYS HG2 . 17510 1 38 . 1 1 9 9 LYS HG3 H 1 1.524 0.02 . 2 . . . . . 6 LYS HG3 . 17510 1 39 . 1 1 9 9 LYS HD2 H 1 1.790 0.02 . 2 . . . . . 6 LYS HD . 17510 1 40 . 1 1 9 9 LYS HD3 H 1 1.790 0.02 . 2 . . . . . 6 LYS HD . 17510 1 41 . 1 1 9 9 LYS HE2 H 1 3.092 0.02 . 2 . . . . . 6 LYS HE . 17510 1 42 . 1 1 9 9 LYS HE3 H 1 3.092 0.02 . 2 . . . . . 6 LYS HE . 17510 1 43 . 1 1 9 9 LYS C C 13 176.425 0.40 . 1 . . . . . 6 LYS C . 17510 1 44 . 1 1 9 9 LYS CA C 13 56.448 0.40 . 1 . . . . . 6 LYS CA . 17510 1 45 . 1 1 9 9 LYS CB C 13 32.980 0.40 . 1 . . . . . 6 LYS CB . 17510 1 46 . 1 1 9 9 LYS CG C 13 25.125 0.40 . 1 . . . . . 6 LYS CG . 17510 1 47 . 1 1 9 9 LYS CD C 13 29.076 0.40 . 1 . . . . . 6 LYS CD . 17510 1 48 . 1 1 9 9 LYS CE C 13 42.094 0.40 . 1 . . . . . 6 LYS CE . 17510 1 49 . 1 1 9 9 LYS N N 15 122.388 0.40 . 1 . . . . . 6 LYS N . 17510 1 50 . 1 1 10 10 LEU H H 1 7.848 0.02 . 1 . . . . . 7 LEU H . 17510 1 51 . 1 1 10 10 LEU HA H 1 4.552 0.02 . 1 . . . . . 7 LEU HA . 17510 1 52 . 1 1 10 10 LEU HB2 H 1 1.791 0.02 . 2 . . . . . 7 LEU HB2 . 17510 1 53 . 1 1 10 10 LEU HB3 H 1 1.657 0.02 . 2 . . . . . 7 LEU HB3 . 17510 1 54 . 1 1 10 10 LEU HG H 1 1.712 0.02 . 1 . . . . . 7 LEU HG . 17510 1 55 . 1 1 10 10 LEU HD11 H 1 0.967 0.02 . 1 . . . . . 7 LEU HD1 . 17510 1 56 . 1 1 10 10 LEU HD12 H 1 0.967 0.02 . 1 . . . . . 7 LEU HD1 . 17510 1 57 . 1 1 10 10 LEU HD13 H 1 0.967 0.02 . 1 . . . . . 7 LEU HD1 . 17510 1 58 . 1 1 10 10 LEU HD21 H 1 0.918 0.02 . 1 . . . . . 7 LEU HD2 . 17510 1 59 . 1 1 10 10 LEU HD22 H 1 0.918 0.02 . 1 . . . . . 7 LEU HD2 . 17510 1 60 . 1 1 10 10 LEU HD23 H 1 0.918 0.02 . 1 . . . . . 7 LEU HD2 . 17510 1 61 . 1 1 10 10 LEU C C 13 175.269 0.40 . 1 . . . . . 7 LEU C . 17510 1 62 . 1 1 10 10 LEU CA C 13 55.212 0.40 . 1 . . . . . 7 LEU CA . 17510 1 63 . 1 1 10 10 LEU CB C 13 43.894 0.40 . 1 . . . . . 7 LEU CB . 17510 1 64 . 1 1 10 10 LEU CG C 13 27.190 0.40 . 1 . . . . . 7 LEU CG . 17510 1 65 . 1 1 10 10 LEU CD1 C 13 25.099 0.40 . 1 . . . . . 7 LEU CD1 . 17510 1 66 . 1 1 10 10 LEU CD2 C 13 24.665 0.40 . 1 . . . . . 7 LEU CD2 . 17510 1 67 . 1 1 10 10 LEU N N 15 122.485 0.40 . 1 . . . . . 7 LEU N . 17510 1 68 . 1 1 11 11 ALA H H 1 9.993 0.02 . 1 . . . . . 8 ALA H . 17510 1 69 . 1 1 11 11 ALA HA H 1 5.232 0.02 . 1 . . . . . 8 ALA HA . 17510 1 70 . 1 1 11 11 ALA HB1 H 1 1.669 0.02 . 1 . . . . . 8 ALA HB . 17510 1 71 . 1 1 11 11 ALA HB2 H 1 1.669 0.02 . 1 . . . . . 8 ALA HB . 17510 1 72 . 1 1 11 11 ALA HB3 H 1 1.669 0.02 . 1 . . . . . 8 ALA HB . 17510 1 73 . 1 1 11 11 ALA C C 13 177.158 0.40 . 1 . . . . . 8 ALA C . 17510 1 74 . 1 1 11 11 ALA CA C 13 51.779 0.40 . 1 . . . . . 8 ALA CA . 17510 1 75 . 1 1 11 11 ALA CB C 13 19.833 0.40 . 1 . . . . . 8 ALA CB . 17510 1 76 . 1 1 11 11 ALA N N 15 129.680 0.40 . 1 . . . . . 8 ALA N . 17510 1 77 . 1 1 12 12 VAL H H 1 8.811 0.02 . 1 . . . . . 9 VAL H . 17510 1 78 . 1 1 12 12 VAL HA H 1 5.526 0.02 . 1 . . . . . 9 VAL HA . 17510 1 79 . 1 1 12 12 VAL HB H 1 1.934 0.02 . 1 . . . . . 9 VAL HB . 17510 1 80 . 1 1 12 12 VAL HG11 H 1 0.789 0.02 . 1 . . . . . 9 VAL HG1 . 17510 1 81 . 1 1 12 12 VAL HG12 H 1 0.789 0.02 . 1 . . . . . 9 VAL HG1 . 17510 1 82 . 1 1 12 12 VAL HG13 H 1 0.789 0.02 . 1 . . . . . 9 VAL HG1 . 17510 1 83 . 1 1 12 12 VAL HG21 H 1 0.888 0.02 . 1 . . . . . 9 VAL HG2 . 17510 1 84 . 1 1 12 12 VAL HG22 H 1 0.888 0.02 . 1 . . . . . 9 VAL HG2 . 17510 1 85 . 1 1 12 12 VAL HG23 H 1 0.888 0.02 . 1 . . . . . 9 VAL HG2 . 17510 1 86 . 1 1 12 12 VAL C C 13 173.885 0.40 . 1 . . . . . 9 VAL C . 17510 1 87 . 1 1 12 12 VAL CA C 13 59.885 0.40 . 1 . . . . . 9 VAL CA . 17510 1 88 . 1 1 12 12 VAL CB C 13 35.457 0.40 . 1 . . . . . 9 VAL CB . 17510 1 89 . 1 1 12 12 VAL CG1 C 13 21.091 0.40 . 1 . . . . . 9 VAL CG1 . 17510 1 90 . 1 1 12 12 VAL CG2 C 13 21.242 0.40 . 1 . . . . . 9 VAL CG2 . 17510 1 91 . 1 1 12 12 VAL N N 15 125.489 0.40 . 1 . . . . . 9 VAL N . 17510 1 92 . 1 1 13 13 ALA H H 1 8.490 0.02 . 1 . . . . . 10 ALA H . 17510 1 93 . 1 1 13 13 ALA HA H 1 5.456 0.02 . 1 . . . . . 10 ALA HA . 17510 1 94 . 1 1 13 13 ALA HB1 H 1 0.154 0.02 . 1 . . . . . 10 ALA HB . 17510 1 95 . 1 1 13 13 ALA HB2 H 1 0.154 0.02 . 1 . . . . . 10 ALA HB . 17510 1 96 . 1 1 13 13 ALA HB3 H 1 0.154 0.02 . 1 . . . . . 10 ALA HB . 17510 1 97 . 1 1 13 13 ALA C C 13 175.986 0.40 . 1 . . . . . 10 ALA C . 17510 1 98 . 1 1 13 13 ALA CA C 13 49.062 0.40 . 1 . . . . . 10 ALA CA . 17510 1 99 . 1 1 13 13 ALA CB C 13 19.731 0.40 . 1 . . . . . 10 ALA CB . 17510 1 100 . 1 1 13 13 ALA N N 15 127.442 0.40 . 1 . . . . . 10 ALA N . 17510 1 101 . 1 1 14 14 VAL H H 1 8.304 0.02 . 1 . . . . . 11 VAL H . 17510 1 102 . 1 1 14 14 VAL HA H 1 5.326 0.02 . 1 . . . . . 11 VAL HA . 17510 1 103 . 1 1 14 14 VAL HB H 1 1.732 0.02 . 1 . . . . . 11 VAL HB . 17510 1 104 . 1 1 14 14 VAL HG11 H 1 0.822 0.02 . 1 . . . . . 11 VAL HG1 . 17510 1 105 . 1 1 14 14 VAL HG12 H 1 0.822 0.02 . 1 . . . . . 11 VAL HG1 . 17510 1 106 . 1 1 14 14 VAL HG13 H 1 0.822 0.02 . 1 . . . . . 11 VAL HG1 . 17510 1 107 . 1 1 14 14 VAL HG21 H 1 0.741 0.02 . 1 . . . . . 11 VAL HG2 . 17510 1 108 . 1 1 14 14 VAL HG22 H 1 0.741 0.02 . 1 . . . . . 11 VAL HG2 . 17510 1 109 . 1 1 14 14 VAL HG23 H 1 0.741 0.02 . 1 . . . . . 11 VAL HG2 . 17510 1 110 . 1 1 14 14 VAL C C 13 175.041 0.40 . 1 . . . . . 11 VAL C . 17510 1 111 . 1 1 14 14 VAL CA C 13 59.891 0.40 . 1 . . . . . 11 VAL CA . 17510 1 112 . 1 1 14 14 VAL CB C 13 33.510 0.40 . 1 . . . . . 11 VAL CB . 17510 1 113 . 1 1 14 14 VAL CG1 C 13 21.938 0.40 . 1 . . . . . 11 VAL CG1 . 17510 1 114 . 1 1 14 14 VAL CG2 C 13 20.739 0.40 . 1 . . . . . 11 VAL CG2 . 17510 1 115 . 1 1 14 14 VAL N N 15 119.256 0.40 . 1 . . . . . 11 VAL N . 17510 1 116 . 1 1 15 15 VAL H H 1 9.176 0.02 . 1 . . . . . 12 VAL H . 17510 1 117 . 1 1 15 15 VAL HA H 1 5.305 0.02 . 1 . . . . . 12 VAL HA . 17510 1 118 . 1 1 15 15 VAL HB H 1 1.699 0.02 . 1 . . . . . 12 VAL HB . 17510 1 119 . 1 1 15 15 VAL HG11 H 1 0.809 0.02 . 1 . . . . . 12 VAL HG1 . 17510 1 120 . 1 1 15 15 VAL HG12 H 1 0.809 0.02 . 1 . . . . . 12 VAL HG1 . 17510 1 121 . 1 1 15 15 VAL HG13 H 1 0.809 0.02 . 1 . . . . . 12 VAL HG1 . 17510 1 122 . 1 1 15 15 VAL HG21 H 1 0.487 0.02 . 1 . . . . . 12 VAL HG2 . 17510 1 123 . 1 1 15 15 VAL HG22 H 1 0.487 0.02 . 1 . . . . . 12 VAL HG2 . 17510 1 124 . 1 1 15 15 VAL HG23 H 1 0.487 0.02 . 1 . . . . . 12 VAL HG2 . 17510 1 125 . 1 1 15 15 VAL C C 13 174.341 0.40 . 1 . . . . . 12 VAL C . 17510 1 126 . 1 1 15 15 VAL CA C 13 60.763 0.40 . 1 . . . . . 12 VAL CA . 17510 1 127 . 1 1 15 15 VAL CB C 13 35.317 0.40 . 1 . . . . . 12 VAL CB . 17510 1 128 . 1 1 15 15 VAL CG1 C 13 23.289 0.40 . 1 . . . . . 12 VAL CG1 . 17510 1 129 . 1 1 15 15 VAL CG2 C 13 21.931 0.40 . 1 . . . . . 12 VAL CG2 . 17510 1 130 . 1 1 15 15 VAL N N 15 126.537 0.40 . 1 . . . . . 12 VAL N . 17510 1 131 . 1 1 16 16 CYS H H 1 9.154 0.02 . 1 . . . . . 13 CYS H . 17510 1 132 . 1 1 16 16 CYS HA H 1 5.350 0.02 . 1 . . . . . 13 CYS HA . 17510 1 133 . 1 1 16 16 CYS HB2 H 1 3.091 0.02 . 2 . . . . . 13 CYS HB2 . 17510 1 134 . 1 1 16 16 CYS HB3 H 1 3.762 0.02 . 2 . . . . . 13 CYS HB3 . 17510 1 135 . 1 1 16 16 CYS C C 13 174.423 0.40 . 1 . . . . . 13 CYS C . 17510 1 136 . 1 1 16 16 CYS CA C 13 57.941 0.40 . 1 . . . . . 13 CYS CA . 17510 1 137 . 1 1 16 16 CYS CB C 13 33.094 0.40 . 1 . . . . . 13 CYS CB . 17510 1 138 . 1 1 16 16 CYS N N 15 126.123 0.40 . 1 . . . . . 13 CYS N . 17510 1 139 . 1 1 17 17 SER HA H 1 4.878 0.02 . 1 . . . . . 14 SER HA . 17510 1 140 . 1 1 17 17 SER HB2 H 1 4.251 0.02 . 2 . . . . . 14 SER HB2 . 17510 1 141 . 1 1 17 17 SER HB3 H 1 4.053 0.02 . 2 . . . . . 14 SER HB3 . 17510 1 142 . 1 1 17 17 SER CA C 13 61.371 0.40 . 1 . . . . . 14 SER CA . 17510 1 143 . 1 1 17 17 SER CB C 13 64.034 0.40 . 1 . . . . . 14 SER CB . 17510 1 144 . 1 1 18 18 SER HA H 1 5.037 0.02 . 1 . . . . . 15 SER HA . 17510 1 145 . 1 1 18 18 SER HB2 H 1 4.189 0.02 . 2 . . . . . 15 SER HB2 . 17510 1 146 . 1 1 18 18 SER HB3 H 1 4.413 0.02 . 2 . . . . . 15 SER HB3 . 17510 1 147 . 1 1 18 18 SER C C 13 172.053 0.40 . 1 . . . . . 15 SER C . 17510 1 148 . 1 1 18 18 SER CA C 13 59.779 0.40 . 1 . . . . . 15 SER CA . 17510 1 149 . 1 1 18 18 SER CB C 13 65.321 0.40 . 1 . . . . . 15 SER CB . 17510 1 150 . 1 1 19 19 ASN H H 1 9.440 0.02 . 1 . . . . . 16 ASN H . 17510 1 151 . 1 1 19 19 ASN HA H 1 3.947 0.02 . 1 . . . . . 16 ASN HA . 17510 1 152 . 1 1 19 19 ASN HB2 H 1 3.587 0.02 . 2 . . . . . 16 ASN HB2 . 17510 1 153 . 1 1 19 19 ASN HB3 H 1 2.777 0.02 . 2 . . . . . 16 ASN HB3 . 17510 1 154 . 1 1 19 19 ASN C C 13 172.192 0.40 . 1 . . . . . 16 ASN C . 17510 1 155 . 1 1 19 19 ASN CA C 13 53.861 0.40 . 1 . . . . . 16 ASN CA . 17510 1 156 . 1 1 19 19 ASN CB C 13 39.865 0.40 . 1 . . . . . 16 ASN CB . 17510 1 157 . 1 1 19 19 ASN N N 15 121.869 0.40 . 1 . . . . . 16 ASN N . 17510 1 158 . 1 1 20 20 MET H H 1 7.600 0.02 . 1 . . . . . 17 MET H . 17510 1 159 . 1 1 20 20 MET HA H 1 5.281 0.02 . 1 . . . . . 17 MET HA . 17510 1 160 . 1 1 20 20 MET HB2 H 1 2.370 0.02 . 2 . . . . . 17 MET HB2 . 17510 1 161 . 1 1 20 20 MET HB3 H 1 1.975 0.02 . 2 . . . . . 17 MET HB3 . 17510 1 162 . 1 1 20 20 MET HG2 H 1 1.599 0.02 . 2 . . . . . 17 MET HG2 . 17510 1 163 . 1 1 20 20 MET HG3 H 1 1.791 0.02 . 2 . . . . . 17 MET HG3 . 17510 1 164 . 1 1 20 20 MET HE1 H 1 1.981 0.02 . 1 . . . . . 17 MET HE . 17510 1 165 . 1 1 20 20 MET HE2 H 1 1.981 0.02 . 1 . . . . . 17 MET HE . 17510 1 166 . 1 1 20 20 MET HE3 H 1 1.981 0.02 . 1 . . . . . 17 MET HE . 17510 1 167 . 1 1 20 20 MET C C 13 174.309 0.40 . 1 . . . . . 17 MET C . 17510 1 168 . 1 1 20 20 MET CA C 13 62.040 0.40 . 1 . . . . . 17 MET CA . 17510 1 169 . 1 1 20 20 MET CB C 13 32.543 0.40 . 1 . . . . . 17 MET CB . 17510 1 170 . 1 1 20 20 MET CG C 13 28.144 0.40 . 1 . . . . . 17 MET CG . 17510 1 171 . 1 1 20 20 MET CE C 13 17.744 0.40 . 1 . . . . . 17 MET CE . 17510 1 172 . 1 1 20 20 MET N N 15 114.660 0.40 . 1 . . . . . 17 MET N . 17510 1 173 . 1 1 21 21 ASN HA H 1 5.134 0.02 . 1 . . . . . 18 ASN HA . 17510 1 174 . 1 1 21 21 ASN HB2 H 1 3.892 0.02 . 2 . . . . . 18 ASN HB2 . 17510 1 175 . 1 1 21 21 ASN HB3 H 1 2.947 0.02 . 2 . . . . . 18 ASN HB3 . 17510 1 176 . 1 1 21 21 ASN CA C 13 54.118 0.40 . 1 . . . . . 18 ASN CA . 17510 1 177 . 1 1 21 21 ASN CB C 13 39.778 0.40 . 1 . . . . . 18 ASN CB . 17510 1 178 . 1 1 22 22 ARG HA H 1 3.934 0.02 . 1 . . . . . 19 ARG HA . 17510 1 179 . 1 1 22 22 ARG C C 13 180.300 0.40 . 1 . . . . . 19 ARG C . 17510 1 180 . 1 1 22 22 ARG CA C 13 61.575 0.40 . 1 . . . . . 19 ARG CA . 17510 1 181 . 1 1 22 22 ARG CB C 13 31.737 0.40 . 1 . . . . . 19 ARG CB . 17510 1 182 . 1 1 23 23 SER H H 1 9.273 0.02 . 1 . . . . . 20 SER H . 17510 1 183 . 1 1 23 23 SER HA H 1 3.978 0.02 . 1 . . . . . 20 SER HA . 17510 1 184 . 1 1 23 23 SER HB2 H 1 4.094 0.02 . 2 . . . . . 20 SER HB . 17510 1 185 . 1 1 23 23 SER HB3 H 1 4.094 0.02 . 2 . . . . . 20 SER HB . 17510 1 186 . 1 1 23 23 SER C C 13 176.100 0.40 . 1 . . . . . 20 SER C . 17510 1 187 . 1 1 23 23 SER CA C 13 61.965 0.40 . 1 . . . . . 20 SER CA . 17510 1 188 . 1 1 23 23 SER CB C 13 61.377 0.40 . 1 . . . . . 20 SER CB . 17510 1 189 . 1 1 23 23 SER N N 15 111.693 0.40 . 1 . . . . . 20 SER N . 17510 1 190 . 1 1 24 24 MET H H 1 6.446 0.02 . 1 . . . . . 21 MET H . 17510 1 191 . 1 1 24 24 MET HA H 1 4.868 0.02 . 1 . . . . . 21 MET HA . 17510 1 192 . 1 1 24 24 MET HE1 H 1 1.607 0.02 . 1 . . . . . 21 MET HE . 17510 1 193 . 1 1 24 24 MET HE2 H 1 1.607 0.02 . 1 . . . . . 21 MET HE . 17510 1 194 . 1 1 24 24 MET HE3 H 1 1.607 0.02 . 1 . . . . . 21 MET HE . 17510 1 195 . 1 1 24 24 MET C C 13 178.689 0.40 . 1 . . . . . 21 MET C . 17510 1 196 . 1 1 24 24 MET CA C 13 55.573 0.40 . 1 . . . . . 21 MET CA . 17510 1 197 . 1 1 24 24 MET CB C 13 31.290 0.40 . 1 . . . . . 21 MET CB . 17510 1 198 . 1 1 24 24 MET CE C 13 17.259 0.40 . 1 . . . . . 21 MET CE . 17510 1 199 . 1 1 24 24 MET N N 15 121.381 0.40 . 1 . . . . . 21 MET N . 17510 1 200 . 1 1 25 25 GLU H H 1 8.222 0.02 . 1 . . . . . 22 GLU H . 17510 1 201 . 1 1 25 25 GLU HA H 1 4.285 0.02 . 1 . . . . . 22 GLU HA . 17510 1 202 . 1 1 25 25 GLU C C 13 179.259 0.40 . 1 . . . . . 22 GLU C . 17510 1 203 . 1 1 25 25 GLU CA C 13 58.735 0.40 . 1 . . . . . 22 GLU CA . 17510 1 204 . 1 1 25 25 GLU CB C 13 29.746 0.40 . 1 . . . . . 22 GLU CB . 17510 1 205 . 1 1 25 25 GLU N N 15 122.778 0.40 . 1 . . . . . 22 GLU N . 17510 1 206 . 1 1 26 26 ALA H H 1 7.261 0.02 . 1 . . . . . 23 ALA H . 17510 1 207 . 1 1 26 26 ALA HA H 1 4.110 0.02 . 1 . . . . . 23 ALA HA . 17510 1 208 . 1 1 26 26 ALA HB1 H 1 1.490 0.02 . 1 . . . . . 23 ALA HB . 17510 1 209 . 1 1 26 26 ALA HB2 H 1 1.490 0.02 . 1 . . . . . 23 ALA HB . 17510 1 210 . 1 1 26 26 ALA HB3 H 1 1.490 0.02 . 1 . . . . . 23 ALA HB . 17510 1 211 . 1 1 26 26 ALA C C 13 177.810 0.40 . 1 . . . . . 23 ALA C . 17510 1 212 . 1 1 26 26 ALA CA C 13 55.698 0.40 . 1 . . . . . 23 ALA CA . 17510 1 213 . 1 1 26 26 ALA CB C 13 18.047 0.40 . 1 . . . . . 23 ALA CB . 17510 1 214 . 1 1 26 26 ALA N N 15 118.593 0.40 . 1 . . . . . 23 ALA N . 17510 1 215 . 1 1 27 27 HIS H H 1 8.972 0.02 . 1 . . . . . 24 HIS H . 17510 1 216 . 1 1 27 27 HIS HA H 1 4.085 0.02 . 1 . . . . . 24 HIS HA . 17510 1 217 . 1 1 27 27 HIS HB2 H 1 3.390 0.02 . 2 . . . . . 24 HIS HB2 . 17510 1 218 . 1 1 27 27 HIS HB3 H 1 3.571 0.02 . 2 . . . . . 24 HIS HB3 . 17510 1 219 . 1 1 27 27 HIS HD2 H 1 7.004 0.02 . 1 . . . . . 24 HIS HD2 . 17510 1 220 . 1 1 27 27 HIS HE1 H 1 7.793 0.02 . 1 . . . . . 24 HIS HE1 . 17510 1 221 . 1 1 27 27 HIS C C 13 178.037 0.40 . 1 . . . . . 24 HIS C . 17510 1 222 . 1 1 27 27 HIS CA C 13 58.941 0.40 . 1 . . . . . 24 HIS CA . 17510 1 223 . 1 1 27 27 HIS CB C 13 33.505 0.40 . 1 . . . . . 24 HIS CB . 17510 1 224 . 1 1 27 27 HIS N N 15 119.886 0.40 . 1 . . . . . 24 HIS N . 17510 1 225 . 1 1 28 28 ASN H H 1 8.385 0.02 . 1 . . . . . 25 ASN H . 17510 1 226 . 1 1 28 28 ASN HA H 1 4.397 0.02 . 1 . . . . . 25 ASN HA . 17510 1 227 . 1 1 28 28 ASN HB2 H 1 2.817 0.02 . 2 . . . . . 25 ASN HB2 . 17510 1 228 . 1 1 28 28 ASN HB3 H 1 3.263 0.02 . 2 . . . . . 25 ASN HB3 . 17510 1 229 . 1 1 28 28 ASN C C 13 176.719 0.40 . 1 . . . . . 25 ASN C . 17510 1 230 . 1 1 28 28 ASN CA C 13 56.781 0.40 . 1 . . . . . 25 ASN CA . 17510 1 231 . 1 1 28 28 ASN CB C 13 39.483 0.40 . 1 . . . . . 25 ASN CB . 17510 1 232 . 1 1 28 28 ASN N N 15 116.055 0.40 . 1 . . . . . 25 ASN N . 17510 1 233 . 1 1 29 29 PHE H H 1 7.901 0.02 . 1 . . . . . 26 PHE H . 17510 1 234 . 1 1 29 29 PHE HA H 1 4.240 0.02 . 1 . . . . . 26 PHE HA . 17510 1 235 . 1 1 29 29 PHE HB2 H 1 3.270 0.02 . 2 . . . . . 26 PHE HB2 . 17510 1 236 . 1 1 29 29 PHE HB3 H 1 3.235 0.02 . 2 . . . . . 26 PHE HB3 . 17510 1 237 . 1 1 29 29 PHE HD1 H 1 7.393 0.02 . 3 . . . . . 26 PHE HD . 17510 1 238 . 1 1 29 29 PHE HD2 H 1 7.393 0.02 . 3 . . . . . 26 PHE HD . 17510 1 239 . 1 1 29 29 PHE HE1 H 1 7.270 0.02 . 3 . . . . . 26 PHE HE . 17510 1 240 . 1 1 29 29 PHE HE2 H 1 7.270 0.02 . 3 . . . . . 26 PHE HE . 17510 1 241 . 1 1 29 29 PHE HZ H 1 7.569 0.02 . 1 . . . . . 26 PHE HZ . 17510 1 242 . 1 1 29 29 PHE C C 13 178.689 0.40 . 1 . . . . . 26 PHE C . 17510 1 243 . 1 1 29 29 PHE CA C 13 61.647 0.40 . 1 . . . . . 26 PHE CA . 17510 1 244 . 1 1 29 29 PHE CB C 13 39.839 0.40 . 1 . . . . . 26 PHE CB . 17510 1 245 . 1 1 29 29 PHE CD1 C 13 131.470 0.40 . 3 . . . . . 26 PHE CD1 . 17510 1 246 . 1 1 29 29 PHE N N 15 118.518 0.40 . 1 . . . . . 26 PHE N . 17510 1 247 . 1 1 30 30 LEU H H 1 9.061 0.02 . 1 . . . . . 27 LEU H . 17510 1 248 . 1 1 30 30 LEU HA H 1 4.182 0.02 . 1 . . . . . 27 LEU HA . 17510 1 249 . 1 1 30 30 LEU HB2 H 1 2.144 0.02 . 2 . . . . . 27 LEU HB2 . 17510 1 250 . 1 1 30 30 LEU HB3 H 1 1.227 0.02 . 2 . . . . . 27 LEU HB3 . 17510 1 251 . 1 1 30 30 LEU HG H 1 2.012 0.02 . 1 . . . . . 27 LEU HG . 17510 1 252 . 1 1 30 30 LEU HD11 H 1 0.642 0.02 . 1 . . . . . 27 LEU HD1 . 17510 1 253 . 1 1 30 30 LEU HD12 H 1 0.642 0.02 . 1 . . . . . 27 LEU HD1 . 17510 1 254 . 1 1 30 30 LEU HD13 H 1 0.642 0.02 . 1 . . . . . 27 LEU HD1 . 17510 1 255 . 1 1 30 30 LEU HD21 H 1 0.642 0.02 . 1 . . . . . 27 LEU HD2 . 17510 1 256 . 1 1 30 30 LEU HD22 H 1 0.642 0.02 . 1 . . . . . 27 LEU HD2 . 17510 1 257 . 1 1 30 30 LEU HD23 H 1 0.642 0.02 . 1 . . . . . 27 LEU HD2 . 17510 1 258 . 1 1 30 30 LEU C C 13 179.698 0.40 . 1 . . . . . 27 LEU C . 17510 1 259 . 1 1 30 30 LEU CA C 13 58.404 0.40 . 1 . . . . . 27 LEU CA . 17510 1 260 . 1 1 30 30 LEU CB C 13 42.709 0.40 . 1 . . . . . 27 LEU CB . 17510 1 261 . 1 1 30 30 LEU CG C 13 27.424 0.40 . 1 . . . . . 27 LEU CG . 17510 1 262 . 1 1 30 30 LEU CD1 C 13 26.685 0.40 . 1 . . . . . 27 LEU CD1 . 17510 1 263 . 1 1 30 30 LEU CD2 C 13 25.883 0.40 . 1 . . . . . 27 LEU CD2 . 17510 1 264 . 1 1 30 30 LEU N N 15 119.437 0.40 . 1 . . . . . 27 LEU N . 17510 1 265 . 1 1 31 31 ALA H H 1 9.128 0.02 . 1 . . . . . 28 ALA H . 17510 1 266 . 1 1 31 31 ALA HA H 1 4.505 0.02 . 1 . . . . . 28 ALA HA . 17510 1 267 . 1 1 31 31 ALA HB1 H 1 1.744 0.02 . 1 . . . . . 28 ALA HB . 17510 1 268 . 1 1 31 31 ALA HB2 H 1 1.744 0.02 . 1 . . . . . 28 ALA HB . 17510 1 269 . 1 1 31 31 ALA HB3 H 1 1.744 0.02 . 1 . . . . . 28 ALA HB . 17510 1 270 . 1 1 31 31 ALA C C 13 182.759 0.40 . 1 . . . . . 28 ALA C . 17510 1 271 . 1 1 31 31 ALA CA C 13 55.220 0.40 . 1 . . . . . 28 ALA CA . 17510 1 272 . 1 1 31 31 ALA CB C 13 17.990 0.40 . 1 . . . . . 28 ALA CB . 17510 1 273 . 1 1 31 31 ALA N N 15 122.379 0.40 . 1 . . . . . 28 ALA N . 17510 1 274 . 1 1 32 32 LYS H H 1 7.961 0.02 . 1 . . . . . 29 LYS H . 17510 1 275 . 1 1 32 32 LYS HA H 1 4.200 0.02 . 1 . . . . . 29 LYS HA . 17510 1 276 . 1 1 32 32 LYS HB2 H 1 2.068 0.02 . 2 . . . . . 29 LYS HB2 . 17510 1 277 . 1 1 32 32 LYS HB3 H 1 1.983 0.02 . 2 . . . . . 29 LYS HB3 . 17510 1 278 . 1 1 32 32 LYS HG2 H 1 1.625 0.02 . 2 . . . . . 29 LYS HG2 . 17510 1 279 . 1 1 32 32 LYS HG3 H 1 1.817 0.02 . 2 . . . . . 29 LYS HG3 . 17510 1 280 . 1 1 32 32 LYS HD2 H 1 1.837 0.02 . 2 . . . . . 29 LYS HD2 . 17510 1 281 . 1 1 32 32 LYS HD3 H 1 1.931 0.02 . 2 . . . . . 29 LYS HD3 . 17510 1 282 . 1 1 32 32 LYS HE2 H 1 3.085 0.02 . 2 . . . . . 29 LYS HE . 17510 1 283 . 1 1 32 32 LYS HE3 H 1 3.085 0.02 . 2 . . . . . 29 LYS HE . 17510 1 284 . 1 1 32 32 LYS C C 13 178.526 0.40 . 1 . . . . . 29 LYS C . 17510 1 285 . 1 1 32 32 LYS CA C 13 59.110 0.40 . 1 . . . . . 29 LYS CA . 17510 1 286 . 1 1 32 32 LYS CB C 13 32.405 0.40 . 1 . . . . . 29 LYS CB . 17510 1 287 . 1 1 32 32 LYS CG C 13 27.429 0.40 . 1 . . . . . 29 LYS CG . 17510 1 288 . 1 1 32 32 LYS CD C 13 31.187 0.40 . 1 . . . . . 29 LYS CD . 17510 1 289 . 1 1 32 32 LYS CE C 13 42.000 0.40 . 1 . . . . . 29 LYS CE . 17510 1 290 . 1 1 32 32 LYS N N 15 120.121 0.40 . 1 . . . . . 29 LYS N . 17510 1 291 . 1 1 33 33 LYS H H 1 7.474 0.02 . 1 . . . . . 30 LYS H . 17510 1 292 . 1 1 33 33 LYS HA H 1 4.384 0.02 . 1 . . . . . 30 LYS HA . 17510 1 293 . 1 1 33 33 LYS HB2 H 1 2.246 0.02 . 2 . . . . . 30 LYS HB2 . 17510 1 294 . 1 1 33 33 LYS HB3 H 1 2.098 0.02 . 2 . . . . . 30 LYS HB3 . 17510 1 295 . 1 1 33 33 LYS HG2 H 1 1.579 0.02 . 2 . . . . . 30 LYS HG . 17510 1 296 . 1 1 33 33 LYS HG3 H 1 1.579 0.02 . 2 . . . . . 30 LYS HG . 17510 1 297 . 1 1 33 33 LYS HD2 H 1 1.683 0.02 . 2 . . . . . 30 LYS HD . 17510 1 298 . 1 1 33 33 LYS HD3 H 1 1.683 0.02 . 2 . . . . . 30 LYS HD . 17510 1 299 . 1 1 33 33 LYS HE2 H 1 2.875 0.02 . 2 . . . . . 30 LYS HE . 17510 1 300 . 1 1 33 33 LYS HE3 H 1 2.875 0.02 . 2 . . . . . 30 LYS HE . 17510 1 301 . 1 1 33 33 LYS C C 13 176.214 0.40 . 1 . . . . . 30 LYS C . 17510 1 302 . 1 1 33 33 LYS CA C 13 55.198 0.40 . 1 . . . . . 30 LYS CA . 17510 1 303 . 1 1 33 33 LYS CB C 13 32.803 0.40 . 1 . . . . . 30 LYS CB . 17510 1 304 . 1 1 33 33 LYS CG C 13 25.213 0.40 . 1 . . . . . 30 LYS CG . 17510 1 305 . 1 1 33 33 LYS CD C 13 28.859 0.40 . 1 . . . . . 30 LYS CD . 17510 1 306 . 1 1 33 33 LYS CE C 13 42.173 0.40 . 1 . . . . . 30 LYS CE . 17510 1 307 . 1 1 33 33 LYS N N 15 117.008 0.40 . 1 . . . . . 30 LYS N . 17510 1 308 . 1 1 34 34 GLY H H 1 7.828 0.02 . 1 . . . . . 31 GLY H . 17510 1 309 . 1 1 34 34 GLY HA2 H 1 4.144 0.02 . 2 . . . . . 31 GLY HA2 . 17510 1 310 . 1 1 34 34 GLY HA3 H 1 3.772 0.02 . 2 . . . . . 31 GLY HA3 . 17510 1 311 . 1 1 34 34 GLY C C 13 174.667 0.40 . 1 . . . . . 31 GLY C . 17510 1 312 . 1 1 34 34 GLY CA C 13 45.325 0.40 . 1 . . . . . 31 GLY CA . 17510 1 313 . 1 1 34 34 GLY N N 15 106.065 0.40 . 1 . . . . . 31 GLY N . 17510 1 314 . 1 1 35 35 PHE H H 1 7.789 0.02 . 1 . . . . . 32 PHE H . 17510 1 315 . 1 1 35 35 PHE HA H 1 4.501 0.02 . 1 . . . . . 32 PHE HA . 17510 1 316 . 1 1 35 35 PHE HB2 H 1 2.952 0.02 . 2 . . . . . 32 PHE HB2 . 17510 1 317 . 1 1 35 35 PHE HB3 H 1 2.638 0.02 . 2 . . . . . 32 PHE HB3 . 17510 1 318 . 1 1 35 35 PHE HD1 H 1 7.574 0.02 . 3 . . . . . 32 PHE HD . 17510 1 319 . 1 1 35 35 PHE HD2 H 1 7.574 0.02 . 3 . . . . . 32 PHE HD . 17510 1 320 . 1 1 35 35 PHE HE1 H 1 7.259 0.02 . 3 . . . . . 32 PHE HE . 17510 1 321 . 1 1 35 35 PHE HE2 H 1 7.259 0.02 . 3 . . . . . 32 PHE HE . 17510 1 322 . 1 1 35 35 PHE HZ H 1 7.430 0.02 . 1 . . . . . 32 PHE HZ . 17510 1 323 . 1 1 35 35 PHE C C 13 175.286 0.40 . 1 . . . . . 32 PHE C . 17510 1 324 . 1 1 35 35 PHE CA C 13 58.844 0.40 . 1 . . . . . 32 PHE CA . 17510 1 325 . 1 1 35 35 PHE CB C 13 39.662 0.40 . 1 . . . . . 32 PHE CB . 17510 1 326 . 1 1 35 35 PHE CD1 C 13 132.365 0.40 . 3 . . . . . 32 PHE CD1 . 17510 1 327 . 1 1 35 35 PHE N N 15 118.056 0.40 . 1 . . . . . 32 PHE N . 17510 1 328 . 1 1 36 36 ASN H H 1 9.509 0.02 . 1 . . . . . 33 ASN H . 17510 1 329 . 1 1 36 36 ASN HA H 1 4.897 0.02 . 1 . . . . . 33 ASN HA . 17510 1 330 . 1 1 36 36 ASN HB2 H 1 3.665 0.02 . 2 . . . . . 33 ASN HB2 . 17510 1 331 . 1 1 36 36 ASN HB3 H 1 2.973 0.02 . 2 . . . . . 33 ASN HB3 . 17510 1 332 . 1 1 36 36 ASN C C 13 173.218 0.40 . 1 . . . . . 33 ASN C . 17510 1 333 . 1 1 36 36 ASN CA C 13 52.614 0.40 . 1 . . . . . 33 ASN CA . 17510 1 334 . 1 1 36 36 ASN CB C 13 37.071 0.40 . 1 . . . . . 33 ASN CB . 17510 1 335 . 1 1 36 36 ASN N N 15 122.325 0.40 . 1 . . . . . 33 ASN N . 17510 1 336 . 1 1 37 37 VAL H H 1 7.774 0.02 . 1 . . . . . 34 VAL H . 17510 1 337 . 1 1 37 37 VAL HA H 1 5.565 0.02 . 1 . . . . . 34 VAL HA . 17510 1 338 . 1 1 37 37 VAL HB H 1 1.574 0.02 . 1 . . . . . 34 VAL HB . 17510 1 339 . 1 1 37 37 VAL HG11 H 1 0.880 0.02 . 1 . . . . . 34 VAL HG1 . 17510 1 340 . 1 1 37 37 VAL HG12 H 1 0.880 0.02 . 1 . . . . . 34 VAL HG1 . 17510 1 341 . 1 1 37 37 VAL HG13 H 1 0.880 0.02 . 1 . . . . . 34 VAL HG1 . 17510 1 342 . 1 1 37 37 VAL HG21 H 1 0.638 0.02 . 1 . . . . . 34 VAL HG2 . 17510 1 343 . 1 1 37 37 VAL HG22 H 1 0.638 0.02 . 1 . . . . . 34 VAL HG2 . 17510 1 344 . 1 1 37 37 VAL HG23 H 1 0.638 0.02 . 1 . . . . . 34 VAL HG2 . 17510 1 345 . 1 1 37 37 VAL C C 13 172.957 0.40 . 1 . . . . . 34 VAL C . 17510 1 346 . 1 1 37 37 VAL CA C 13 58.026 0.40 . 1 . . . . . 34 VAL CA . 17510 1 347 . 1 1 37 37 VAL CB C 13 34.981 0.40 . 1 . . . . . 34 VAL CB . 17510 1 348 . 1 1 37 37 VAL CG1 C 13 18.472 0.40 . 1 . . . . . 34 VAL CG1 . 17510 1 349 . 1 1 37 37 VAL CG2 C 13 23.039 0.40 . 1 . . . . . 34 VAL CG2 . 17510 1 350 . 1 1 37 37 VAL N N 15 122.875 0.40 . 1 . . . . . 34 VAL N . 17510 1 351 . 1 1 38 38 ARG H H 1 8.253 0.02 . 1 . . . . . 35 ARG H . 17510 1 352 . 1 1 38 38 ARG HA H 1 4.422 0.02 . 1 . . . . . 35 ARG HA . 17510 1 353 . 1 1 38 38 ARG HB2 H 1 2.237 0.02 . 2 . . . . . 35 ARG HB . 17510 1 354 . 1 1 38 38 ARG HB3 H 1 2.237 0.02 . 2 . . . . . 35 ARG HB . 17510 1 355 . 1 1 38 38 ARG HG2 H 1 1.987 0.02 . 2 . . . . . 35 ARG HG2 . 17510 1 356 . 1 1 38 38 ARG HG3 H 1 2.100 0.02 . 2 . . . . . 35 ARG HG3 . 17510 1 357 . 1 1 38 38 ARG HD2 H 1 3.628 0.02 . 2 . . . . . 35 ARG HD2 . 17510 1 358 . 1 1 38 38 ARG HD3 H 1 3.491 0.02 . 2 . . . . . 35 ARG HD3 . 17510 1 359 . 1 1 38 38 ARG C C 13 173.397 0.40 . 1 . . . . . 35 ARG C . 17510 1 360 . 1 1 38 38 ARG CA C 13 53.934 0.40 . 1 . . . . . 35 ARG CA . 17510 1 361 . 1 1 38 38 ARG CB C 13 35.954 0.40 . 1 . . . . . 35 ARG CB . 17510 1 362 . 1 1 38 38 ARG CG C 13 28.695 0.40 . 1 . . . . . 35 ARG CG . 17510 1 363 . 1 1 38 38 ARG CD C 13 43.058 0.40 . 1 . . . . . 35 ARG CD . 17510 1 364 . 1 1 38 38 ARG N N 15 125.778 0.40 . 1 . . . . . 35 ARG N . 17510 1 365 . 1 1 39 39 SER H H 1 8.444 0.02 . 1 . . . . . 36 SER H . 17510 1 366 . 1 1 39 39 SER HA H 1 5.633 0.02 . 1 . . . . . 36 SER HA . 17510 1 367 . 1 1 39 39 SER HB2 H 1 3.747 0.02 . 2 . . . . . 36 SER HB2 . 17510 1 368 . 1 1 39 39 SER HB3 H 1 3.590 0.02 . 2 . . . . . 36 SER HB3 . 17510 1 369 . 1 1 39 39 SER C C 13 172.029 0.40 . 1 . . . . . 36 SER C . 17510 1 370 . 1 1 39 39 SER CA C 13 55.968 0.40 . 1 . . . . . 36 SER CA . 17510 1 371 . 1 1 39 39 SER CB C 13 64.550 0.40 . 1 . . . . . 36 SER CB . 17510 1 372 . 1 1 39 39 SER N N 15 113.397 0.40 . 1 . . . . . 36 SER N . 17510 1 373 . 1 1 40 40 TYR H H 1 8.149 0.02 . 1 . . . . . 37 TYR H . 17510 1 374 . 1 1 40 40 TYR HA H 1 5.248 0.02 . 1 . . . . . 37 TYR HA . 17510 1 375 . 1 1 40 40 TYR HB2 H 1 3.472 0.02 . 2 . . . . . 37 TYR HB2 . 17510 1 376 . 1 1 40 40 TYR HB3 H 1 2.498 0.02 . 2 . . . . . 37 TYR HB3 . 17510 1 377 . 1 1 40 40 TYR C C 13 174.618 0.40 . 1 . . . . . 37 TYR C . 17510 1 378 . 1 1 40 40 TYR CA C 13 56.432 0.40 . 1 . . . . . 37 TYR CA . 17510 1 379 . 1 1 40 40 TYR CB C 13 47.169 0.40 . 1 . . . . . 37 TYR CB . 17510 1 380 . 1 1 40 40 TYR N N 15 112.536 0.40 . 1 . . . . . 37 TYR N . 17510 1 381 . 1 1 41 41 GLY H H 1 9.320 0.02 . 1 . . . . . 38 GLY H . 17510 1 382 . 1 1 41 41 GLY HA2 H 1 5.556 0.02 . 2 . . . . . 38 GLY HA2 . 17510 1 383 . 1 1 41 41 GLY HA3 H 1 3.500 0.02 . 2 . . . . . 38 GLY HA3 . 17510 1 384 . 1 1 41 41 GLY C C 13 174.406 0.40 . 1 . . . . . 38 GLY C . 17510 1 385 . 1 1 41 41 GLY CA C 13 43.866 0.40 . 1 . . . . . 38 GLY CA . 17510 1 386 . 1 1 41 41 GLY N N 15 105.745 0.40 . 1 . . . . . 38 GLY N . 17510 1 387 . 1 1 42 42 THR H H 1 8.589 0.02 . 1 . . . . . 39 THR H . 17510 1 388 . 1 1 42 42 THR HA H 1 5.440 0.02 . 1 . . . . . 39 THR HA . 17510 1 389 . 1 1 42 42 THR HB H 1 4.584 0.02 . 1 . . . . . 39 THR HB . 17510 1 390 . 1 1 42 42 THR HG21 H 1 1.125 0.02 . 1 . . . . . 39 THR HG2 . 17510 1 391 . 1 1 42 42 THR HG22 H 1 1.125 0.02 . 1 . . . . . 39 THR HG2 . 17510 1 392 . 1 1 42 42 THR HG23 H 1 1.125 0.02 . 1 . . . . . 39 THR HG2 . 17510 1 393 . 1 1 42 42 THR C C 13 177.061 0.40 . 1 . . . . . 39 THR C . 17510 1 394 . 1 1 42 42 THR CA C 13 61.146 0.40 . 1 . . . . . 39 THR CA . 17510 1 395 . 1 1 42 42 THR CB C 13 71.350 0.40 . 1 . . . . . 39 THR CB . 17510 1 396 . 1 1 42 42 THR CG2 C 13 23.382 0.40 . 1 . . . . . 39 THR CG2 . 17510 1 397 . 1 1 42 42 THR N N 15 108.428 0.40 . 1 . . . . . 39 THR N . 17510 1 398 . 1 1 43 43 GLY H H 1 9.216 0.02 . 1 . . . . . 40 GLY H . 17510 1 399 . 1 1 43 43 GLY C C 13 172.452 0.40 . 1 . . . . . 40 GLY C . 17510 1 400 . 1 1 43 43 GLY CA C 13 45.099 0.40 . 1 . . . . . 40 GLY CA . 17510 1 401 . 1 1 43 43 GLY N N 15 111.193 0.40 . 1 . . . . . 40 GLY N . 17510 1 402 . 1 1 44 44 GLU HA H 1 4.254 0.02 . 1 . . . . . 41 GLU HA . 17510 1 403 . 1 1 44 44 GLU HB2 H 1 2.202 0.02 . 2 . . . . . 41 GLU HB2 . 17510 1 404 . 1 1 44 44 GLU HB3 H 1 2.118 0.02 . 2 . . . . . 41 GLU HB3 . 17510 1 405 . 1 1 44 44 GLU HG2 H 1 2.523 0.02 . 2 . . . . . 41 GLU HG2 . 17510 1 406 . 1 1 44 44 GLU HG3 H 1 2.426 0.02 . 2 . . . . . 41 GLU HG3 . 17510 1 407 . 1 1 44 44 GLU C C 13 177.871 0.40 . 1 . . . . . 41 GLU C . 17510 1 408 . 1 1 44 44 GLU CA C 13 59.258 0.40 . 1 . . . . . 41 GLU CA . 17510 1 409 . 1 1 44 44 GLU CB C 13 30.676 0.40 . 1 . . . . . 41 GLU CB . 17510 1 410 . 1 1 44 44 GLU CG C 13 37.155 0.40 . 1 . . . . . 41 GLU CG . 17510 1 411 . 1 1 45 45 ARG H H 1 8.018 0.02 . 1 . . . . . 42 ARG H . 17510 1 412 . 1 1 45 45 ARG HA H 1 4.578 0.02 . 1 . . . . . 42 ARG HA . 17510 1 413 . 1 1 45 45 ARG HB2 H 1 1.987 0.02 . 2 . . . . . 42 ARG HB2 . 17510 1 414 . 1 1 45 45 ARG HB3 H 1 1.553 0.02 . 2 . . . . . 42 ARG HB3 . 17510 1 415 . 1 1 45 45 ARG HG2 H 1 1.674 0.02 . 2 . . . . . 42 ARG HG2 . 17510 1 416 . 1 1 45 45 ARG HG3 H 1 1.559 0.02 . 2 . . . . . 42 ARG HG3 . 17510 1 417 . 1 1 45 45 ARG HD2 H 1 3.130 0.02 . 2 . . . . . 42 ARG HD2 . 17510 1 418 . 1 1 45 45 ARG HD3 H 1 3.034 0.02 . 2 . . . . . 42 ARG HD3 . 17510 1 419 . 1 1 45 45 ARG C C 13 172.974 0.40 . 1 . . . . . 42 ARG C . 17510 1 420 . 1 1 45 45 ARG CA C 13 54.357 0.40 . 1 . . . . . 42 ARG CA . 17510 1 421 . 1 1 45 45 ARG CB C 13 34.099 0.40 . 1 . . . . . 42 ARG CB . 17510 1 422 . 1 1 45 45 ARG CG C 13 27.581 0.40 . 1 . . . . . 42 ARG CG . 17510 1 423 . 1 1 45 45 ARG CD C 13 43.276 0.40 . 1 . . . . . 42 ARG CD . 17510 1 424 . 1 1 45 45 ARG N N 15 115.530 0.40 . 1 . . . . . 42 ARG N . 17510 1 425 . 1 1 46 46 VAL H H 1 8.615 0.02 . 1 . . . . . 43 VAL H . 17510 1 426 . 1 1 46 46 VAL HA H 1 3.550 0.02 . 1 . . . . . 43 VAL HA . 17510 1 427 . 1 1 46 46 VAL HB H 1 1.861 0.02 . 1 . . . . . 43 VAL HB . 17510 1 428 . 1 1 46 46 VAL HG11 H 1 0.791 0.02 . 1 . . . . . 43 VAL HG1 . 17510 1 429 . 1 1 46 46 VAL HG12 H 1 0.791 0.02 . 1 . . . . . 43 VAL HG1 . 17510 1 430 . 1 1 46 46 VAL HG13 H 1 0.791 0.02 . 1 . . . . . 43 VAL HG1 . 17510 1 431 . 1 1 46 46 VAL HG21 H 1 -0.053 0.02 . 1 . . . . . 43 VAL HG2 . 17510 1 432 . 1 1 46 46 VAL HG22 H 1 -0.053 0.02 . 1 . . . . . 43 VAL HG2 . 17510 1 433 . 1 1 46 46 VAL HG23 H 1 -0.053 0.02 . 1 . . . . . 43 VAL HG2 . 17510 1 434 . 1 1 46 46 VAL C C 13 174.325 0.40 . 1 . . . . . 43 VAL C . 17510 1 435 . 1 1 46 46 VAL CA C 13 62.566 0.40 . 1 . . . . . 43 VAL CA . 17510 1 436 . 1 1 46 46 VAL CB C 13 32.498 0.40 . 1 . . . . . 43 VAL CB . 17510 1 437 . 1 1 46 46 VAL CG1 C 13 21.761 0.40 . 1 . . . . . 43 VAL CG1 . 17510 1 438 . 1 1 46 46 VAL CG2 C 13 19.022 0.40 . 1 . . . . . 43 VAL CG2 . 17510 1 439 . 1 1 46 46 VAL N N 15 122.311 0.40 . 1 . . . . . 43 VAL N . 17510 1 440 . 1 1 47 47 LYS H H 1 8.376 0.02 . 1 . . . . . 44 LYS H . 17510 1 441 . 1 1 47 47 LYS HA H 1 5.315 0.02 . 1 . . . . . 44 LYS HA . 17510 1 442 . 1 1 47 47 LYS HB2 H 1 1.693 0.02 . 2 . . . . . 44 LYS HB2 . 17510 1 443 . 1 1 47 47 LYS HB3 H 1 1.745 0.02 . 2 . . . . . 44 LYS HB3 . 17510 1 444 . 1 1 47 47 LYS HG2 H 1 1.271 0.02 . 2 . . . . . 44 LYS HG2 . 17510 1 445 . 1 1 47 47 LYS HG3 H 1 1.404 0.02 . 2 . . . . . 44 LYS HG3 . 17510 1 446 . 1 1 47 47 LYS HD2 H 1 1.680 0.02 . 2 . . . . . 44 LYS HD . 17510 1 447 . 1 1 47 47 LYS HD3 H 1 1.680 0.02 . 2 . . . . . 44 LYS HD . 17510 1 448 . 1 1 47 47 LYS HE2 H 1 2.918 0.02 . 2 . . . . . 44 LYS HE . 17510 1 449 . 1 1 47 47 LYS HE3 H 1 2.918 0.02 . 2 . . . . . 44 LYS HE . 17510 1 450 . 1 1 47 47 LYS C C 13 175.041 0.40 . 1 . . . . . 44 LYS C . 17510 1 451 . 1 1 47 47 LYS CA C 13 55.283 0.40 . 1 . . . . . 44 LYS CA . 17510 1 452 . 1 1 47 47 LYS CB C 13 35.197 0.40 . 1 . . . . . 44 LYS CB . 17510 1 453 . 1 1 47 47 LYS CG C 13 25.495 0.40 . 1 . . . . . 44 LYS CG . 17510 1 454 . 1 1 47 47 LYS CD C 13 30.047 0.40 . 1 . . . . . 44 LYS CD . 17510 1 455 . 1 1 47 47 LYS CE C 13 41.917 0.40 . 1 . . . . . 44 LYS CE . 17510 1 456 . 1 1 47 47 LYS N N 15 125.907 0.40 . 1 . . . . . 44 LYS N . 17510 1 457 . 1 1 48 48 LEU H H 1 9.275 0.02 . 1 . . . . . 45 LEU H . 17510 1 458 . 1 1 48 48 LEU HA H 1 5.114 0.02 . 1 . . . . . 45 LEU HA . 17510 1 459 . 1 1 48 48 LEU HB2 H 1 1.793 0.02 . 2 . . . . . 45 LEU HB2 . 17510 1 460 . 1 1 48 48 LEU HB3 H 1 1.899 0.02 . 2 . . . . . 45 LEU HB3 . 17510 1 461 . 1 1 48 48 LEU HG H 1 1.885 0.02 . 1 . . . . . 45 LEU HG . 17510 1 462 . 1 1 48 48 LEU HD11 H 1 1.110 0.02 . 1 . . . . . 45 LEU HD1 . 17510 1 463 . 1 1 48 48 LEU HD12 H 1 1.110 0.02 . 1 . . . . . 45 LEU HD1 . 17510 1 464 . 1 1 48 48 LEU HD13 H 1 1.110 0.02 . 1 . . . . . 45 LEU HD1 . 17510 1 465 . 1 1 48 48 LEU HD21 H 1 1.155 0.02 . 1 . . . . . 45 LEU HD2 . 17510 1 466 . 1 1 48 48 LEU HD22 H 1 1.155 0.02 . 1 . . . . . 45 LEU HD2 . 17510 1 467 . 1 1 48 48 LEU HD23 H 1 1.155 0.02 . 1 . . . . . 45 LEU HD2 . 17510 1 468 . 1 1 48 48 LEU C C 13 173.625 0.40 . 1 . . . . . 45 LEU C . 17510 1 469 . 1 1 48 48 LEU CA C 13 52.248 0.40 . 1 . . . . . 45 LEU CA . 17510 1 470 . 1 1 48 48 LEU CB C 13 44.485 0.40 . 1 . . . . . 45 LEU CB . 17510 1 471 . 1 1 48 48 LEU CG C 13 28.407 0.40 . 1 . . . . . 45 LEU CG . 17510 1 472 . 1 1 48 48 LEU CD1 C 13 26.985 0.40 . 1 . . . . . 45 LEU CD1 . 17510 1 473 . 1 1 48 48 LEU CD2 C 13 25.899 0.40 . 1 . . . . . 45 LEU CD2 . 17510 1 474 . 1 1 48 48 LEU N N 15 125.237 0.40 . 1 . . . . . 45 LEU N . 17510 1 475 . 1 1 49 49 PRO HA H 1 4.452 0.02 . 1 . . . . . 46 PRO HA . 17510 1 476 . 1 1 49 49 PRO HB2 H 1 2.597 0.02 . 2 . . . . . 46 PRO HB . 17510 1 477 . 1 1 49 49 PRO HB3 H 1 2.597 0.02 . 2 . . . . . 46 PRO HB . 17510 1 478 . 1 1 49 49 PRO HG2 H 1 2.329 0.02 . 2 . . . . . 46 PRO HG2 . 17510 1 479 . 1 1 49 49 PRO HG3 H 1 2.242 0.02 . 2 . . . . . 46 PRO HG3 . 17510 1 480 . 1 1 49 49 PRO HD2 H 1 4.093 0.02 . 2 . . . . . 46 PRO HD2 . 17510 1 481 . 1 1 49 49 PRO HD3 H 1 3.780 0.02 . 2 . . . . . 46 PRO HD3 . 17510 1 482 . 1 1 49 49 PRO C C 13 176.293 0.40 . 1 . . . . . 46 PRO C . 17510 1 483 . 1 1 49 49 PRO CA C 13 63.930 0.40 . 1 . . . . . 46 PRO CA . 17510 1 484 . 1 1 49 49 PRO CB C 13 32.936 0.40 . 1 . . . . . 46 PRO CB . 17510 1 485 . 1 1 49 49 PRO CG C 13 27.876 0.40 . 1 . . . . . 46 PRO CG . 17510 1 486 . 1 1 49 49 PRO CD C 13 50.940 0.40 . 1 . . . . . 46 PRO CD . 17510 1 487 . 1 1 50 50 GLY H H 1 8.747 0.02 . 1 . . . . . 47 GLY H . 17510 1 488 . 1 1 50 50 GLY HA2 H 1 4.055 0.02 . 2 . . . . . 47 GLY HA2 . 17510 1 489 . 1 1 50 50 GLY HA3 H 1 5.067 0.02 . 2 . . . . . 47 GLY HA3 . 17510 1 490 . 1 1 50 50 GLY C C 13 174.667 0.40 . 1 . . . . . 47 GLY C . 17510 1 491 . 1 1 50 50 GLY CA C 13 43.767 0.40 . 1 . . . . . 47 GLY CA . 17510 1 492 . 1 1 50 50 GLY N N 15 108.728 0.40 . 1 . . . . . 47 GLY N . 17510 1 493 . 1 1 51 51 MET HA H 1 4.030 0.02 . 1 . . . . . 48 MET HA . 17510 1 494 . 1 1 51 51 MET HB2 H 1 1.609 0.02 . 2 . . . . . 48 MET HB2 . 17510 1 495 . 1 1 51 51 MET HB3 H 1 2.184 0.02 . 2 . . . . . 48 MET HB3 . 17510 1 496 . 1 1 51 51 MET HG2 H 1 1.832 0.02 . 2 . . . . . 48 MET HG2 . 17510 1 497 . 1 1 51 51 MET HG3 H 1 1.653 0.02 . 2 . . . . . 48 MET HG3 . 17510 1 498 . 1 1 51 51 MET HE1 H 1 1.791 0.02 . 1 . . . . . 48 MET HE . 17510 1 499 . 1 1 51 51 MET HE2 H 1 1.791 0.02 . 1 . . . . . 48 MET HE . 17510 1 500 . 1 1 51 51 MET HE3 H 1 1.791 0.02 . 1 . . . . . 48 MET HE . 17510 1 501 . 1 1 51 51 MET C C 13 175.565 0.40 . 1 . . . . . 48 MET C . 17510 1 502 . 1 1 51 51 MET CA C 13 56.882 0.40 . 1 . . . . . 48 MET CA . 17510 1 503 . 1 1 51 51 MET CB C 13 32.021 0.40 . 1 . . . . . 48 MET CB . 17510 1 504 . 1 1 51 51 MET CG C 13 32.792 0.40 . 1 . . . . . 48 MET CG . 17510 1 505 . 1 1 51 51 MET CE C 13 17.259 0.40 . 1 . . . . . 48 MET CE . 17510 1 506 . 1 1 52 52 ALA H H 1 7.707 0.02 . 1 . . . . . 49 ALA H . 17510 1 507 . 1 1 52 52 ALA HA H 1 4.704 0.02 . 1 . . . . . 49 ALA HA . 17510 1 508 . 1 1 52 52 ALA HB1 H 1 1.447 0.02 . 1 . . . . . 49 ALA HB . 17510 1 509 . 1 1 52 52 ALA HB2 H 1 1.447 0.02 . 1 . . . . . 49 ALA HB . 17510 1 510 . 1 1 52 52 ALA HB3 H 1 1.447 0.02 . 1 . . . . . 49 ALA HB . 17510 1 511 . 1 1 52 52 ALA C C 13 179.194 0.40 . 1 . . . . . 49 ALA C . 17510 1 512 . 1 1 52 52 ALA CA C 13 50.902 0.40 . 1 . . . . . 49 ALA CA . 17510 1 513 . 1 1 52 52 ALA CB C 13 22.146 0.40 . 1 . . . . . 49 ALA CB . 17510 1 514 . 1 1 52 52 ALA N N 15 118.797 0.40 . 1 . . . . . 49 ALA N . 17510 1 515 . 1 1 53 53 PHE HA H 1 4.360 0.02 . 1 . . . . . 50 PHE HA . 17510 1 516 . 1 1 53 53 PHE HB2 H 1 3.332 0.02 . 2 . . . . . 50 PHE HB2 . 17510 1 517 . 1 1 53 53 PHE HB3 H 1 3.222 0.02 . 2 . . . . . 50 PHE HB3 . 17510 1 518 . 1 1 53 53 PHE HD1 H 1 7.362 0.02 . 3 . . . . . 50 PHE HD . 17510 1 519 . 1 1 53 53 PHE HD2 H 1 7.362 0.02 . 3 . . . . . 50 PHE HD . 17510 1 520 . 1 1 53 53 PHE HE1 H 1 7.468 0.02 . 3 . . . . . 50 PHE HE . 17510 1 521 . 1 1 53 53 PHE HE2 H 1 7.468 0.02 . 3 . . . . . 50 PHE HE . 17510 1 522 . 1 1 53 53 PHE HZ H 1 7.141 0.02 . 1 . . . . . 50 PHE HZ . 17510 1 523 . 1 1 53 53 PHE C C 13 175.225 0.40 . 1 . . . . . 50 PHE C . 17510 1 524 . 1 1 53 53 PHE CA C 13 60.306 0.40 . 1 . . . . . 50 PHE CA . 17510 1 525 . 1 1 53 53 PHE CB C 13 38.664 0.40 . 1 . . . . . 50 PHE CB . 17510 1 526 . 1 1 53 53 PHE CD1 C 13 132.269 0.40 . 3 . . . . . 50 PHE CD1 . 17510 1 527 . 1 1 54 54 ASP H H 1 8.293 0.02 . 1 . . . . . 51 ASP H . 17510 1 528 . 1 1 54 54 ASP HA H 1 4.470 0.02 . 1 . . . . . 51 ASP HA . 17510 1 529 . 1 1 54 54 ASP HB2 H 1 2.305 0.02 . 2 . . . . . 51 ASP HB2 . 17510 1 530 . 1 1 54 54 ASP HB3 H 1 2.785 0.02 . 2 . . . . . 51 ASP HB3 . 17510 1 531 . 1 1 54 54 ASP C C 13 175.302 0.40 . 1 . . . . . 51 ASP C . 17510 1 532 . 1 1 54 54 ASP CA C 13 52.585 0.40 . 1 . . . . . 51 ASP CA . 17510 1 533 . 1 1 54 54 ASP CB C 13 39.761 0.40 . 1 . . . . . 51 ASP CB . 17510 1 534 . 1 1 54 54 ASP N N 15 115.834 0.40 . 1 . . . . . 51 ASP N . 17510 1 535 . 1 1 55 55 LYS H H 1 7.468 0.02 . 1 . . . . . 52 LYS H . 17510 1 536 . 1 1 55 55 LYS HA H 1 4.876 0.02 . 1 . . . . . 52 LYS HA . 17510 1 537 . 1 1 55 55 LYS HB2 H 1 1.900 0.02 . 2 . . . . . 52 LYS HB2 . 17510 1 538 . 1 1 55 55 LYS HB3 H 1 1.573 0.02 . 2 . . . . . 52 LYS HB3 . 17510 1 539 . 1 1 55 55 LYS HG2 H 1 1.326 0.02 . 2 . . . . . 52 LYS HG2 . 17510 1 540 . 1 1 55 55 LYS HG3 H 1 1.404 0.02 . 2 . . . . . 52 LYS HG3 . 17510 1 541 . 1 1 55 55 LYS HD2 H 1 1.761 0.02 . 2 . . . . . 52 LYS HD2 . 17510 1 542 . 1 1 55 55 LYS HD3 H 1 1.603 0.02 . 2 . . . . . 52 LYS HD3 . 17510 1 543 . 1 1 55 55 LYS HE2 H 1 2.983 0.02 . 2 . . . . . 52 LYS HE . 17510 1 544 . 1 1 55 55 LYS HE3 H 1 2.983 0.02 . 2 . . . . . 52 LYS HE . 17510 1 545 . 1 1 55 55 LYS C C 13 172.632 0.40 . 1 . . . . . 52 LYS C . 17510 1 546 . 1 1 55 55 LYS CA C 13 53.463 0.40 . 1 . . . . . 52 LYS CA . 17510 1 547 . 1 1 55 55 LYS CB C 13 33.475 0.40 . 1 . . . . . 52 LYS CB . 17510 1 548 . 1 1 55 55 LYS CG C 13 24.124 0.40 . 1 . . . . . 52 LYS CG . 17510 1 549 . 1 1 55 55 LYS CD C 13 29.275 0.40 . 1 . . . . . 52 LYS CD . 17510 1 550 . 1 1 55 55 LYS CE C 13 42.314 0.40 . 1 . . . . . 52 LYS CE . 17510 1 551 . 1 1 55 55 LYS N N 15 119.140 0.40 . 1 . . . . . 52 LYS N . 17510 1 552 . 1 1 56 56 PRO HA H 1 4.689 0.02 . 1 . . . . . 53 PRO HA . 17510 1 553 . 1 1 56 56 PRO HB2 H 1 2.297 0.02 . 2 . . . . . 53 PRO HB2 . 17510 1 554 . 1 1 56 56 PRO HB3 H 1 1.800 0.02 . 2 . . . . . 53 PRO HB3 . 17510 1 555 . 1 1 56 56 PRO HG2 H 1 1.737 0.02 . 2 . . . . . 53 PRO HG2 . 17510 1 556 . 1 1 56 56 PRO HG3 H 1 1.964 0.02 . 2 . . . . . 53 PRO HG3 . 17510 1 557 . 1 1 56 56 PRO HD2 H 1 3.580 0.02 . 2 . . . . . 53 PRO HD2 . 17510 1 558 . 1 1 56 56 PRO HD3 H 1 3.353 0.02 . 2 . . . . . 53 PRO HD3 . 17510 1 559 . 1 1 56 56 PRO CA C 13 63.159 0.40 . 1 . . . . . 53 PRO CA . 17510 1 560 . 1 1 56 56 PRO CB C 13 32.151 0.40 . 1 . . . . . 53 PRO CB . 17510 1 561 . 1 1 56 56 PRO CG C 13 26.622 0.40 . 1 . . . . . 53 PRO CG . 17510 1 562 . 1 1 56 56 PRO CD C 13 50.148 0.40 . 1 . . . . . 53 PRO CD . 17510 1 563 . 1 1 57 57 ASN H H 1 8.771 0.02 . 1 . . . . . 54 ASN H . 17510 1 564 . 1 1 57 57 ASN HA H 1 4.712 0.02 . 1 . . . . . 54 ASN HA . 17510 1 565 . 1 1 57 57 ASN HB2 H 1 2.781 0.02 . 2 . . . . . 54 ASN HB2 . 17510 1 566 . 1 1 57 57 ASN HB3 H 1 2.658 0.02 . 2 . . . . . 54 ASN HB3 . 17510 1 567 . 1 1 57 57 ASN C C 13 172.892 0.40 . 1 . . . . . 54 ASN C . 17510 1 568 . 1 1 57 57 ASN CA C 13 53.526 0.40 . 1 . . . . . 54 ASN CA . 17510 1 569 . 1 1 57 57 ASN CB C 13 41.054 0.40 . 1 . . . . . 54 ASN CB . 17510 1 570 . 1 1 57 57 ASN N N 15 118.944 0.40 . 1 . . . . . 54 ASN N . 17510 1 571 . 1 1 58 58 VAL H H 1 7.900 0.02 . 1 . . . . . 55 VAL H . 17510 1 572 . 1 1 58 58 VAL HA H 1 5.115 0.02 . 1 . . . . . 55 VAL HA . 17510 1 573 . 1 1 58 58 VAL HB H 1 1.713 0.02 . 1 . . . . . 55 VAL HB . 17510 1 574 . 1 1 58 58 VAL HG11 H 1 0.803 0.02 . 1 . . . . . 55 VAL HG1 . 17510 1 575 . 1 1 58 58 VAL HG12 H 1 0.803 0.02 . 1 . . . . . 55 VAL HG1 . 17510 1 576 . 1 1 58 58 VAL HG13 H 1 0.803 0.02 . 1 . . . . . 55 VAL HG1 . 17510 1 577 . 1 1 58 58 VAL HG21 H 1 0.780 0.02 . 1 . . . . . 55 VAL HG2 . 17510 1 578 . 1 1 58 58 VAL HG22 H 1 0.780 0.02 . 1 . . . . . 55 VAL HG2 . 17510 1 579 . 1 1 58 58 VAL HG23 H 1 0.780 0.02 . 1 . . . . . 55 VAL HG2 . 17510 1 580 . 1 1 58 58 VAL C C 13 174.504 0.40 . 1 . . . . . 55 VAL C . 17510 1 581 . 1 1 58 58 VAL CA C 13 60.479 0.40 . 1 . . . . . 55 VAL CA . 17510 1 582 . 1 1 58 58 VAL CB C 13 34.449 0.40 . 1 . . . . . 55 VAL CB . 17510 1 583 . 1 1 58 58 VAL CG1 C 13 22.019 0.40 . 1 . . . . . 55 VAL CG1 . 17510 1 584 . 1 1 58 58 VAL CG2 C 13 20.700 0.40 . 1 . . . . . 55 VAL CG2 . 17510 1 585 . 1 1 58 58 VAL N N 15 122.171 0.40 . 1 . . . . . 55 VAL N . 17510 1 586 . 1 1 59 59 TYR H H 1 9.018 0.02 . 1 . . . . . 56 TYR H . 17510 1 587 . 1 1 59 59 TYR HA H 1 4.778 0.02 . 1 . . . . . 56 TYR HA . 17510 1 588 . 1 1 59 59 TYR HD1 H 1 6.889 0.02 . 3 . . . . . 56 TYR HD . 17510 1 589 . 1 1 59 59 TYR HD2 H 1 6.889 0.02 . 3 . . . . . 56 TYR HD . 17510 1 590 . 1 1 59 59 TYR HE1 H 1 6.474 0.02 . 3 . . . . . 56 TYR HE . 17510 1 591 . 1 1 59 59 TYR HE2 H 1 6.474 0.02 . 3 . . . . . 56 TYR HE . 17510 1 592 . 1 1 59 59 TYR C C 13 174.618 0.40 . 1 . . . . . 56 TYR C . 17510 1 593 . 1 1 59 59 TYR CA C 13 55.801 0.40 . 1 . . . . . 56 TYR CA . 17510 1 594 . 1 1 59 59 TYR CB C 13 41.854 0.40 . 1 . . . . . 56 TYR CB . 17510 1 595 . 1 1 59 59 TYR CD1 C 13 133.791 0.40 . 3 . . . . . 56 TYR CD1 . 17510 1 596 . 1 1 59 59 TYR N N 15 123.069 0.40 . 1 . . . . . 56 TYR N . 17510 1 597 . 1 1 60 60 GLU H H 1 8.871 0.02 . 1 . . . . . 57 GLU H . 17510 1 598 . 1 1 60 60 GLU HA H 1 4.662 0.02 . 1 . . . . . 57 GLU HA . 17510 1 599 . 1 1 60 60 GLU HB2 H 1 1.812 0.02 . 2 . . . . . 57 GLU HB . 17510 1 600 . 1 1 60 60 GLU HB3 H 1 1.812 0.02 . 2 . . . . . 57 GLU HB . 17510 1 601 . 1 1 60 60 GLU HG2 H 1 2.553 0.02 . 2 . . . . . 57 GLU HG2 . 17510 1 602 . 1 1 60 60 GLU HG3 H 1 2.413 0.02 . 2 . . . . . 57 GLU HG3 . 17510 1 603 . 1 1 60 60 GLU C C 13 180.464 0.40 . 1 . . . . . 57 GLU C . 17510 1 604 . 1 1 60 60 GLU CA C 13 55.734 0.40 . 1 . . . . . 57 GLU CA . 17510 1 605 . 1 1 60 60 GLU CB C 13 30.032 0.40 . 1 . . . . . 57 GLU CB . 17510 1 606 . 1 1 60 60 GLU CG C 13 36.403 0.40 . 1 . . . . . 57 GLU CG . 17510 1 607 . 1 1 60 60 GLU N N 15 119.599 0.40 . 1 . . . . . 57 GLU N . 17510 1 608 . 1 1 61 61 PHE H H 1 9.552 0.02 . 1 . . . . . 58 PHE H . 17510 1 609 . 1 1 61 61 PHE HA H 1 3.922 0.02 . 1 . . . . . 58 PHE HA . 17510 1 610 . 1 1 61 61 PHE HB2 H 1 3.082 0.02 . 2 . . . . . 58 PHE HB2 . 17510 1 611 . 1 1 61 61 PHE HB3 H 1 3.035 0.02 . 2 . . . . . 58 PHE HB3 . 17510 1 612 . 1 1 61 61 PHE HD1 H 1 7.003 0.02 . 3 . . . . . 58 PHE HD . 17510 1 613 . 1 1 61 61 PHE HD2 H 1 7.003 0.02 . 3 . . . . . 58 PHE HD . 17510 1 614 . 1 1 61 61 PHE HE1 H 1 7.345 0.02 . 3 . . . . . 58 PHE HE . 17510 1 615 . 1 1 61 61 PHE HE2 H 1 7.345 0.02 . 3 . . . . . 58 PHE HE . 17510 1 616 . 1 1 61 61 PHE C C 13 176.425 0.40 . 1 . . . . . 58 PHE C . 17510 1 617 . 1 1 61 61 PHE CA C 13 62.837 0.40 . 1 . . . . . 58 PHE CA . 17510 1 618 . 1 1 61 61 PHE CB C 13 38.658 0.40 . 1 . . . . . 58 PHE CB . 17510 1 619 . 1 1 61 61 PHE N N 15 123.267 0.40 . 1 . . . . . 58 PHE N . 17510 1 620 . 1 1 62 62 GLY H H 1 7.944 0.02 . 1 . . . . . 59 GLY H . 17510 1 621 . 1 1 62 62 GLY C C 13 173.967 0.40 . 1 . . . . . 59 GLY C . 17510 1 622 . 1 1 62 62 GLY CA C 13 45.076 0.40 . 1 . . . . . 59 GLY CA . 17510 1 623 . 1 1 62 62 GLY N N 15 108.658 0.40 . 1 . . . . . 59 GLY N . 17510 1 624 . 1 1 63 63 THR H H 1 7.401 0.02 . 1 . . . . . 60 THR H . 17510 1 625 . 1 1 63 63 THR HA H 1 4.162 0.02 . 1 . . . . . 60 THR HA . 17510 1 626 . 1 1 63 63 THR HB H 1 3.821 0.02 . 1 . . . . . 60 THR HB . 17510 1 627 . 1 1 63 63 THR HG21 H 1 1.328 0.02 . 1 . . . . . 60 THR HG2 . 17510 1 628 . 1 1 63 63 THR HG22 H 1 1.328 0.02 . 1 . . . . . 60 THR HG2 . 17510 1 629 . 1 1 63 63 THR HG23 H 1 1.328 0.02 . 1 . . . . . 60 THR HG2 . 17510 1 630 . 1 1 63 63 THR C C 13 173.136 0.40 . 1 . . . . . 60 THR C . 17510 1 631 . 1 1 63 63 THR CA C 13 63.365 0.40 . 1 . . . . . 60 THR CA . 17510 1 632 . 1 1 63 63 THR CB C 13 69.304 0.40 . 1 . . . . . 60 THR CB . 17510 1 633 . 1 1 63 63 THR CG2 C 13 21.702 0.40 . 1 . . . . . 60 THR CG2 . 17510 1 634 . 1 1 63 63 THR N N 15 118.611 0.40 . 1 . . . . . 60 THR N . 17510 1 635 . 1 1 64 64 LYS H H 1 9.111 0.02 . 1 . . . . . 61 LYS H . 17510 1 636 . 1 1 64 64 LYS HA H 1 4.260 0.02 . 1 . . . . . 61 LYS HA . 17510 1 637 . 1 1 64 64 LYS C C 13 179.340 0.40 . 1 . . . . . 61 LYS C . 17510 1 638 . 1 1 64 64 LYS CA C 13 57.471 0.40 . 1 . . . . . 61 LYS CA . 17510 1 639 . 1 1 64 64 LYS CB C 13 32.320 0.40 . 1 . . . . . 61 LYS CB . 17510 1 640 . 1 1 64 64 LYS N N 15 124.822 0.40 . 1 . . . . . 61 LYS N . 17510 1 641 . 1 1 65 65 TYR H H 1 8.425 0.02 . 1 . . . . . 62 TYR H . 17510 1 642 . 1 1 65 65 TYR HA H 1 4.116 0.02 . 1 . . . . . 62 TYR HA . 17510 1 643 . 1 1 65 65 TYR HB2 H 1 2.827 0.02 . 2 . . . . . 62 TYR HB . 17510 1 644 . 1 1 65 65 TYR HB3 H 1 2.827 0.02 . 2 . . . . . 62 TYR HB . 17510 1 645 . 1 1 65 65 TYR HD1 H 1 7.220 0.02 . 3 . . . . . 62 TYR HD . 17510 1 646 . 1 1 65 65 TYR HD2 H 1 7.220 0.02 . 3 . . . . . 62 TYR HD . 17510 1 647 . 1 1 65 65 TYR HE1 H 1 6.902 0.02 . 3 . . . . . 62 TYR HE . 17510 1 648 . 1 1 65 65 TYR HE2 H 1 6.902 0.02 . 3 . . . . . 62 TYR HE . 17510 1 649 . 1 1 65 65 TYR C C 13 178.738 0.40 . 1 . . . . . 62 TYR C . 17510 1 650 . 1 1 65 65 TYR CA C 13 62.507 0.40 . 1 . . . . . 62 TYR CA . 17510 1 651 . 1 1 65 65 TYR CB C 13 37.963 0.40 . 1 . . . . . 62 TYR CB . 17510 1 652 . 1 1 65 65 TYR N N 15 121.669 0.40 . 1 . . . . . 62 TYR N . 17510 1 653 . 1 1 66 66 GLU H H 1 9.634 0.02 . 1 . . . . . 63 GLU H . 17510 1 654 . 1 1 66 66 GLU HA H 1 4.080 0.02 . 1 . . . . . 63 GLU HA . 17510 1 655 . 1 1 66 66 GLU HB2 H 1 1.925 0.02 . 2 . . . . . 63 GLU HB . 17510 1 656 . 1 1 66 66 GLU HB3 H 1 1.925 0.02 . 2 . . . . . 63 GLU HB . 17510 1 657 . 1 1 66 66 GLU HG2 H 1 2.383 0.02 . 2 . . . . . 63 GLU HG2 . 17510 1 658 . 1 1 66 66 GLU HG3 H 1 2.221 0.02 . 2 . . . . . 63 GLU HG3 . 17510 1 659 . 1 1 66 66 GLU C C 13 177.207 0.40 . 1 . . . . . 63 GLU C . 17510 1 660 . 1 1 66 66 GLU CA C 13 59.103 0.40 . 1 . . . . . 63 GLU CA . 17510 1 661 . 1 1 66 66 GLU CB C 13 30.360 0.40 . 1 . . . . . 63 GLU CB . 17510 1 662 . 1 1 66 66 GLU CG C 13 35.850 0.40 . 1 . . . . . 63 GLU CG . 17510 1 663 . 1 1 66 66 GLU N N 15 116.712 0.40 . 1 . . . . . 63 GLU N . 17510 1 664 . 1 1 67 67 ASP H H 1 7.040 0.02 . 1 . . . . . 64 ASP H . 17510 1 665 . 1 1 67 67 ASP HA H 1 4.669 0.02 . 1 . . . . . 64 ASP HA . 17510 1 666 . 1 1 67 67 ASP HB2 H 1 2.841 0.02 . 2 . . . . . 64 ASP HB2 . 17510 1 667 . 1 1 67 67 ASP HB3 H 1 2.754 0.02 . 2 . . . . . 64 ASP HB3 . 17510 1 668 . 1 1 67 67 ASP C C 13 179.014 0.40 . 1 . . . . . 64 ASP C . 17510 1 669 . 1 1 67 67 ASP CA C 13 57.141 0.40 . 1 . . . . . 64 ASP CA . 17510 1 670 . 1 1 67 67 ASP CB C 13 40.053 0.40 . 1 . . . . . 64 ASP CB . 17510 1 671 . 1 1 67 67 ASP N N 15 120.415 0.40 . 1 . . . . . 64 ASP N . 17510 1 672 . 1 1 68 68 ILE H H 1 7.697 0.02 . 1 . . . . . 65 ILE H . 17510 1 673 . 1 1 68 68 ILE HA H 1 3.228 0.02 . 1 . . . . . 65 ILE HA . 17510 1 674 . 1 1 68 68 ILE HB H 1 1.735 0.02 . 1 . . . . . 65 ILE HB . 17510 1 675 . 1 1 68 68 ILE HG12 H 1 1.331 0.02 . 2 . . . . . 65 ILE HG12 . 17510 1 676 . 1 1 68 68 ILE HG13 H 1 -0.651 0.02 . 2 . . . . . 65 ILE HG13 . 17510 1 677 . 1 1 68 68 ILE HG21 H 1 0.483 0.02 . 1 . . . . . 65 ILE HG2 . 17510 1 678 . 1 1 68 68 ILE HG22 H 1 0.483 0.02 . 1 . . . . . 65 ILE HG2 . 17510 1 679 . 1 1 68 68 ILE HG23 H 1 0.483 0.02 . 1 . . . . . 65 ILE HG2 . 17510 1 680 . 1 1 68 68 ILE HD11 H 1 0.240 0.02 . 1 . . . . . 65 ILE HD1 . 17510 1 681 . 1 1 68 68 ILE HD12 H 1 0.240 0.02 . 1 . . . . . 65 ILE HD1 . 17510 1 682 . 1 1 68 68 ILE HD13 H 1 0.240 0.02 . 1 . . . . . 65 ILE HD1 . 17510 1 683 . 1 1 68 68 ILE C C 13 176.735 0.40 . 1 . . . . . 65 ILE C . 17510 1 684 . 1 1 68 68 ILE CA C 13 65.709 0.40 . 1 . . . . . 65 ILE CA . 17510 1 685 . 1 1 68 68 ILE CB C 13 37.388 0.40 . 1 . . . . . 65 ILE CB . 17510 1 686 . 1 1 68 68 ILE CG1 C 13 27.654 0.40 . 1 . . . . . 65 ILE CG1 . 17510 1 687 . 1 1 68 68 ILE CG2 C 13 17.578 0.40 . 1 . . . . . 65 ILE CG2 . 17510 1 688 . 1 1 68 68 ILE CD1 C 13 13.583 0.40 . 1 . . . . . 65 ILE CD1 . 17510 1 689 . 1 1 68 68 ILE N N 15 124.493 0.40 . 1 . . . . . 65 ILE N . 17510 1 690 . 1 1 69 69 TYR H H 1 8.572 0.02 . 1 . . . . . 66 TYR H . 17510 1 691 . 1 1 69 69 TYR HA H 1 3.623 0.02 . 1 . . . . . 66 TYR HA . 17510 1 692 . 1 1 69 69 TYR HB2 H 1 3.521 0.02 . 2 . . . . . 66 TYR HB2 . 17510 1 693 . 1 1 69 69 TYR HB3 H 1 2.777 0.02 . 2 . . . . . 66 TYR HB3 . 17510 1 694 . 1 1 69 69 TYR HD1 H 1 6.917 0.02 . 3 . . . . . 66 TYR HD . 17510 1 695 . 1 1 69 69 TYR HD2 H 1 6.917 0.02 . 3 . . . . . 66 TYR HD . 17510 1 696 . 1 1 69 69 TYR HE1 H 1 6.851 0.02 . 3 . . . . . 66 TYR HE . 17510 1 697 . 1 1 69 69 TYR HE2 H 1 6.851 0.02 . 3 . . . . . 66 TYR HE . 17510 1 698 . 1 1 69 69 TYR C C 13 176.572 0.40 . 1 . . . . . 66 TYR C . 17510 1 699 . 1 1 69 69 TYR CA C 13 61.788 0.40 . 1 . . . . . 66 TYR CA . 17510 1 700 . 1 1 69 69 TYR CB C 13 38.291 0.40 . 1 . . . . . 66 TYR CB . 17510 1 701 . 1 1 69 69 TYR CD1 C 13 133.364 0.40 . 3 . . . . . 66 TYR CD1 . 17510 1 702 . 1 1 69 69 TYR N N 15 120.107 0.40 . 1 . . . . . 66 TYR N . 17510 1 703 . 1 1 70 70 ARG H H 1 7.929 0.02 . 1 . . . . . 67 ARG H . 17510 1 704 . 1 1 70 70 ARG HA H 1 4.264 0.02 . 1 . . . . . 67 ARG HA . 17510 1 705 . 1 1 70 70 ARG HB2 H 1 2.101 0.02 . 2 . . . . . 67 ARG HB2 . 17510 1 706 . 1 1 70 70 ARG HB3 H 1 1.929 0.02 . 2 . . . . . 67 ARG HB3 . 17510 1 707 . 1 1 70 70 ARG HG2 H 1 1.927 0.02 . 2 . . . . . 67 ARG HG2 . 17510 1 708 . 1 1 70 70 ARG HG3 H 1 2.116 0.02 . 2 . . . . . 67 ARG HG3 . 17510 1 709 . 1 1 70 70 ARG HD2 H 1 3.415 0.02 . 2 . . . . . 67 ARG HD2 . 17510 1 710 . 1 1 70 70 ARG HD3 H 1 3.370 0.02 . 2 . . . . . 67 ARG HD3 . 17510 1 711 . 1 1 70 70 ARG C C 13 179.080 0.40 . 1 . . . . . 67 ARG C . 17510 1 712 . 1 1 70 70 ARG CA C 13 59.118 0.40 . 1 . . . . . 67 ARG CA . 17510 1 713 . 1 1 70 70 ARG CB C 13 30.360 0.40 . 1 . . . . . 67 ARG CB . 17510 1 714 . 1 1 70 70 ARG CG C 13 28.066 0.40 . 1 . . . . . 67 ARG CG . 17510 1 715 . 1 1 70 70 ARG CD C 13 43.349 0.40 . 1 . . . . . 67 ARG CD . 17510 1 716 . 1 1 70 70 ARG N N 15 116.652 0.40 . 1 . . . . . 67 ARG N . 17510 1 717 . 1 1 71 71 ASP H H 1 7.969 0.02 . 1 . . . . . 68 ASP H . 17510 1 718 . 1 1 71 71 ASP HA H 1 4.476 0.02 . 1 . . . . . 68 ASP HA . 17510 1 719 . 1 1 71 71 ASP HB2 H 1 2.800 0.02 . 2 . . . . . 68 ASP HB2 . 17510 1 720 . 1 1 71 71 ASP HB3 H 1 2.935 0.02 . 2 . . . . . 68 ASP HB3 . 17510 1 721 . 1 1 71 71 ASP C C 13 178.379 0.40 . 1 . . . . . 68 ASP C . 17510 1 722 . 1 1 71 71 ASP CA C 13 57.828 0.40 . 1 . . . . . 68 ASP CA . 17510 1 723 . 1 1 71 71 ASP CB C 13 42.188 0.40 . 1 . . . . . 68 ASP CB . 17510 1 724 . 1 1 71 71 ASP N N 15 120.897 0.40 . 1 . . . . . 68 ASP N . 17510 1 725 . 1 1 72 72 LEU H H 1 8.285 0.02 . 1 . . . . . 69 LEU H . 17510 1 726 . 1 1 72 72 LEU HA H 1 3.686 0.02 . 1 . . . . . 69 LEU HA . 17510 1 727 . 1 1 72 72 LEU HB2 H 1 0.641 0.02 . 2 . . . . . 69 LEU HB2 . 17510 1 728 . 1 1 72 72 LEU HB3 H 1 1.469 0.02 . 2 . . . . . 69 LEU HB3 . 17510 1 729 . 1 1 72 72 LEU HG H 1 1.672 0.02 . 1 . . . . . 69 LEU HG . 17510 1 730 . 1 1 72 72 LEU HD11 H 1 0.452 0.02 . 1 . . . . . 69 LEU HD1 . 17510 1 731 . 1 1 72 72 LEU HD12 H 1 0.452 0.02 . 1 . . . . . 69 LEU HD1 . 17510 1 732 . 1 1 72 72 LEU HD13 H 1 0.452 0.02 . 1 . . . . . 69 LEU HD1 . 17510 1 733 . 1 1 72 72 LEU HD21 H 1 0.129 0.02 . 1 . . . . . 69 LEU HD2 . 17510 1 734 . 1 1 72 72 LEU HD22 H 1 0.129 0.02 . 1 . . . . . 69 LEU HD2 . 17510 1 735 . 1 1 72 72 LEU HD23 H 1 0.129 0.02 . 1 . . . . . 69 LEU HD2 . 17510 1 736 . 1 1 72 72 LEU C C 13 178.966 0.40 . 1 . . . . . 69 LEU C . 17510 1 737 . 1 1 72 72 LEU CA C 13 58.012 0.40 . 1 . . . . . 69 LEU CA . 17510 1 738 . 1 1 72 72 LEU CB C 13 39.930 0.40 . 1 . . . . . 69 LEU CB . 17510 1 739 . 1 1 72 72 LEU CG C 13 25.737 0.40 . 1 . . . . . 69 LEU CG . 17510 1 740 . 1 1 72 72 LEU CD1 C 13 26.418 0.40 . 1 . . . . . 69 LEU CD1 . 17510 1 741 . 1 1 72 72 LEU CD2 C 13 21.525 0.40 . 1 . . . . . 69 LEU CD2 . 17510 1 742 . 1 1 72 72 LEU N N 15 118.744 0.40 . 1 . . . . . 69 LEU N . 17510 1 743 . 1 1 73 73 GLU H H 1 8.686 0.02 . 1 . . . . . 70 GLU H . 17510 1 744 . 1 1 73 73 GLU HA H 1 3.631 0.02 . 1 . . . . . 70 GLU HA . 17510 1 745 . 1 1 73 73 GLU HB2 H 1 2.154 0.02 . 2 . . . . . 70 GLU HB2 . 17510 1 746 . 1 1 73 73 GLU HB3 H 1 1.982 0.02 . 2 . . . . . 70 GLU HB3 . 17510 1 747 . 1 1 73 73 GLU HG2 H 1 2.153 0.02 . 2 . . . . . 70 GLU HG2 . 17510 1 748 . 1 1 73 73 GLU HG3 H 1 2.240 0.02 . 2 . . . . . 70 GLU HG3 . 17510 1 749 . 1 1 73 73 GLU C C 13 177.500 0.40 . 1 . . . . . 70 GLU C . 17510 1 750 . 1 1 73 73 GLU CA C 13 60.053 0.40 . 1 . . . . . 70 GLU CA . 17510 1 751 . 1 1 73 73 GLU CB C 13 30.335 0.40 . 1 . . . . . 70 GLU CB . 17510 1 752 . 1 1 73 73 GLU CG C 13 37.587 0.40 . 1 . . . . . 70 GLU CG . 17510 1 753 . 1 1 73 73 GLU N N 15 118.950 0.40 . 1 . . . . . 70 GLU N . 17510 1 754 . 1 1 74 74 SER H H 1 7.836 0.02 . 1 . . . . . 71 SER H . 17510 1 755 . 1 1 74 74 SER HA H 1 4.386 0.02 . 1 . . . . . 71 SER HA . 17510 1 756 . 1 1 74 74 SER HB2 H 1 4.144 0.02 . 2 . . . . . 71 SER HB . 17510 1 757 . 1 1 74 74 SER HB3 H 1 4.144 0.02 . 2 . . . . . 71 SER HB . 17510 1 758 . 1 1 74 74 SER C C 13 176.002 0.40 . 1 . . . . . 71 SER C . 17510 1 759 . 1 1 74 74 SER CA C 13 60.588 0.40 . 1 . . . . . 71 SER CA . 17510 1 760 . 1 1 74 74 SER CB C 13 63.409 0.40 . 1 . . . . . 71 SER CB . 17510 1 761 . 1 1 74 74 SER N N 15 111.722 0.40 . 1 . . . . . 71 SER N . 17510 1 762 . 1 1 75 75 LYS H H 1 7.855 0.02 . 1 . . . . . 72 LYS H . 17510 1 763 . 1 1 75 75 LYS HA H 1 4.200 0.02 . 1 . . . . . 72 LYS HA . 17510 1 764 . 1 1 75 75 LYS HB2 H 1 2.011 0.02 . 2 . . . . . 72 LYS HB2 . 17510 1 765 . 1 1 75 75 LYS HB3 H 1 2.159 0.02 . 2 . . . . . 72 LYS HB3 . 17510 1 766 . 1 1 75 75 LYS HG2 H 1 1.737 0.02 . 2 . . . . . 72 LYS HG . 17510 1 767 . 1 1 75 75 LYS HG3 H 1 1.737 0.02 . 2 . . . . . 72 LYS HG . 17510 1 768 . 1 1 75 75 LYS HD2 H 1 1.501 0.02 . 2 . . . . . 72 LYS HD2 . 17510 1 769 . 1 1 75 75 LYS HD3 H 1 1.746 0.02 . 2 . . . . . 72 LYS HD3 . 17510 1 770 . 1 1 75 75 LYS HE2 H 1 3.042 0.02 . 2 . . . . . 72 LYS HE . 17510 1 771 . 1 1 75 75 LYS HE3 H 1 3.042 0.02 . 2 . . . . . 72 LYS HE . 17510 1 772 . 1 1 75 75 LYS C C 13 177.907 0.40 . 1 . . . . . 72 LYS C . 17510 1 773 . 1 1 75 75 LYS CA C 13 59.898 0.40 . 1 . . . . . 72 LYS CA . 17510 1 774 . 1 1 75 75 LYS CB C 13 33.979 0.40 . 1 . . . . . 72 LYS CB . 17510 1 775 . 1 1 75 75 LYS CG C 13 25.672 0.40 . 1 . . . . . 72 LYS CG . 17510 1 776 . 1 1 75 75 LYS CD C 13 29.312 0.40 . 1 . . . . . 72 LYS CD . 17510 1 777 . 1 1 75 75 LYS CE C 13 42.006 0.40 . 1 . . . . . 72 LYS CE . 17510 1 778 . 1 1 75 75 LYS N N 15 123.667 0.40 . 1 . . . . . 72 LYS N . 17510 1 779 . 1 1 76 76 ASP H H 1 7.993 0.02 . 1 . . . . . 73 ASP H . 17510 1 780 . 1 1 76 76 ASP HA H 1 4.574 0.02 . 1 . . . . . 73 ASP HA . 17510 1 781 . 1 1 76 76 ASP HB2 H 1 2.931 0.02 . 2 . . . . . 73 ASP HB2 . 17510 1 782 . 1 1 76 76 ASP HB3 H 1 3.063 0.02 . 2 . . . . . 73 ASP HB3 . 17510 1 783 . 1 1 76 76 ASP C C 13 173.446 0.40 . 1 . . . . . 73 ASP C . 17510 1 784 . 1 1 76 76 ASP CA C 13 55.249 0.40 . 1 . . . . . 73 ASP CA . 17510 1 785 . 1 1 76 76 ASP CB C 13 40.828 0.40 . 1 . . . . . 73 ASP CB . 17510 1 786 . 1 1 76 76 ASP N N 15 114.447 0.40 . 1 . . . . . 73 ASP N . 17510 1 787 . 1 1 77 77 LYS H H 1 8.876 0.02 . 1 . . . . . 74 LYS H . 17510 1 788 . 1 1 77 77 LYS HA H 1 3.956 0.02 . 1 . . . . . 74 LYS HA . 17510 1 789 . 1 1 77 77 LYS HB2 H 1 2.388 0.02 . 2 . . . . . 74 LYS HB . 17510 1 790 . 1 1 77 77 LYS HB3 H 1 2.388 0.02 . 2 . . . . . 74 LYS HB . 17510 1 791 . 1 1 77 77 LYS HG2 H 1 1.447 0.02 . 2 . . . . . 74 LYS HG2 . 17510 1 792 . 1 1 77 77 LYS HG3 H 1 1.376 0.02 . 2 . . . . . 74 LYS HG3 . 17510 1 793 . 1 1 77 77 LYS HD2 H 1 1.810 0.02 . 2 . . . . . 74 LYS HD . 17510 1 794 . 1 1 77 77 LYS HD3 H 1 1.810 0.02 . 2 . . . . . 74 LYS HD . 17510 1 795 . 1 1 77 77 LYS HE2 H 1 3.053 0.02 . 2 . . . . . 74 LYS HE . 17510 1 796 . 1 1 77 77 LYS HE3 H 1 3.053 0.02 . 2 . . . . . 74 LYS HE . 17510 1 797 . 1 1 77 77 LYS C C 13 179.112 0.40 . 1 . . . . . 74 LYS C . 17510 1 798 . 1 1 77 77 LYS CA C 13 61.050 0.40 . 1 . . . . . 74 LYS CA . 17510 1 799 . 1 1 77 77 LYS CB C 13 32.300 0.40 . 1 . . . . . 74 LYS CB . 17510 1 800 . 1 1 77 77 LYS CG C 13 25.064 0.40 . 1 . . . . . 74 LYS CG . 17510 1 801 . 1 1 77 77 LYS CD C 13 29.985 0.40 . 1 . . . . . 74 LYS CD . 17510 1 802 . 1 1 77 77 LYS CE C 13 42.000 0.40 . 1 . . . . . 74 LYS CE . 17510 1 803 . 1 1 77 77 LYS N N 15 128.277 0.40 . 1 . . . . . 74 LYS N . 17510 1 804 . 1 1 78 78 GLU H H 1 8.653 0.02 . 1 . . . . . 75 GLU H . 17510 1 805 . 1 1 78 78 GLU HA H 1 4.172 0.02 . 1 . . . . . 75 GLU HA . 17510 1 806 . 1 1 78 78 GLU HB2 H 1 2.179 0.02 . 2 . . . . . 75 GLU HB . 17510 1 807 . 1 1 78 78 GLU HB3 H 1 2.179 0.02 . 2 . . . . . 75 GLU HB . 17510 1 808 . 1 1 78 78 GLU HG2 H 1 2.390 0.02 . 2 . . . . . 75 GLU HG . 17510 1 809 . 1 1 78 78 GLU HG3 H 1 2.390 0.02 . 2 . . . . . 75 GLU HG . 17510 1 810 . 1 1 78 78 GLU C C 13 178.917 0.40 . 1 . . . . . 75 GLU C . 17510 1 811 . 1 1 78 78 GLU CA C 13 59.984 0.40 . 1 . . . . . 75 GLU CA . 17510 1 812 . 1 1 78 78 GLU CB C 13 29.200 0.40 . 1 . . . . . 75 GLU CB . 17510 1 813 . 1 1 78 78 GLU CG C 13 36.720 0.40 . 1 . . . . . 75 GLU CG . 17510 1 814 . 1 1 78 78 GLU N N 15 119.982 0.40 . 1 . . . . . 75 GLU N . 17510 1 815 . 1 1 79 79 PHE H H 1 8.574 0.02 . 1 . . . . . 76 PHE H . 17510 1 816 . 1 1 79 79 PHE HA H 1 4.032 0.02 . 1 . . . . . 76 PHE HA . 17510 1 817 . 1 1 79 79 PHE HB2 H 1 2.457 0.02 . 2 . . . . . 76 PHE HB2 . 17510 1 818 . 1 1 79 79 PHE HB3 H 1 3.082 0.02 . 2 . . . . . 76 PHE HB3 . 17510 1 819 . 1 1 79 79 PHE HD1 H 1 6.229 0.02 . 3 . . . . . 76 PHE HD . 17510 1 820 . 1 1 79 79 PHE HD2 H 1 6.229 0.02 . 3 . . . . . 76 PHE HD . 17510 1 821 . 1 1 79 79 PHE HE1 H 1 7.029 0.02 . 3 . . . . . 76 PHE HE . 17510 1 822 . 1 1 79 79 PHE HE2 H 1 7.029 0.02 . 3 . . . . . 76 PHE HE . 17510 1 823 . 1 1 79 79 PHE HZ H 1 7.221 0.02 . 1 . . . . . 76 PHE HZ . 17510 1 824 . 1 1 79 79 PHE C C 13 177.891 0.40 . 1 . . . . . 76 PHE C . 17510 1 825 . 1 1 79 79 PHE CA C 13 61.907 0.40 . 1 . . . . . 76 PHE CA . 17510 1 826 . 1 1 79 79 PHE CB C 13 39.693 0.40 . 1 . . . . . 76 PHE CB . 17510 1 827 . 1 1 79 79 PHE CD1 C 13 132.218 0.40 . 3 . . . . . 76 PHE CD1 . 17510 1 828 . 1 1 79 79 PHE N N 15 123.621 0.40 . 1 . . . . . 76 PHE N . 17510 1 829 . 1 1 80 80 TYR H H 1 7.992 0.02 . 1 . . . . . 77 TYR H . 17510 1 830 . 1 1 80 80 TYR HA H 1 4.828 0.02 . 1 . . . . . 77 TYR HA . 17510 1 831 . 1 1 80 80 TYR HB2 H 1 3.142 0.02 . 2 . . . . . 77 TYR HB2 . 17510 1 832 . 1 1 80 80 TYR HB3 H 1 2.535 0.02 . 2 . . . . . 77 TYR HB3 . 17510 1 833 . 1 1 80 80 TYR HE1 H 1 7.101 0.02 . 3 . . . . . 77 TYR HE . 17510 1 834 . 1 1 80 80 TYR HE2 H 1 7.101 0.02 . 3 . . . . . 77 TYR HE . 17510 1 835 . 1 1 80 80 TYR C C 13 176.719 0.40 . 1 . . . . . 77 TYR C . 17510 1 836 . 1 1 80 80 TYR CA C 13 60.651 0.40 . 1 . . . . . 77 TYR CA . 17510 1 837 . 1 1 80 80 TYR CB C 13 37.050 0.40 . 1 . . . . . 77 TYR CB . 17510 1 838 . 1 1 80 80 TYR N N 15 113.112 0.40 . 1 . . . . . 77 TYR N . 17510 1 839 . 1 1 81 81 THR H H 1 7.866 0.02 . 1 . . . . . 78 THR H . 17510 1 840 . 1 1 81 81 THR HA H 1 4.349 0.02 . 1 . . . . . 78 THR HA . 17510 1 841 . 1 1 81 81 THR HB H 1 4.500 0.02 . 1 . . . . . 78 THR HB . 17510 1 842 . 1 1 81 81 THR HG21 H 1 1.305 0.02 . 1 . . . . . 78 THR HG2 . 17510 1 843 . 1 1 81 81 THR HG22 H 1 1.305 0.02 . 1 . . . . . 78 THR HG2 . 17510 1 844 . 1 1 81 81 THR HG23 H 1 1.305 0.02 . 1 . . . . . 78 THR HG2 . 17510 1 845 . 1 1 81 81 THR C C 13 177.858 0.40 . 1 . . . . . 78 THR C . 17510 1 846 . 1 1 81 81 THR CA C 13 66.258 0.40 . 1 . . . . . 78 THR CA . 17510 1 847 . 1 1 81 81 THR CB C 13 68.498 0.40 . 1 . . . . . 78 THR CB . 17510 1 848 . 1 1 81 81 THR CG2 C 13 20.712 0.40 . 1 . . . . . 78 THR CG2 . 17510 1 849 . 1 1 81 81 THR N N 15 118.052 0.40 . 1 . . . . . 78 THR N . 17510 1 850 . 1 1 82 82 GLN H H 1 8.320 0.02 . 1 . . . . . 79 GLN H . 17510 1 851 . 1 1 82 82 GLN HA H 1 4.095 0.02 . 1 . . . . . 79 GLN HA . 17510 1 852 . 1 1 82 82 GLN HB2 H 1 2.176 0.02 . 2 . . . . . 79 GLN HB2 . 17510 1 853 . 1 1 82 82 GLN HB3 H 1 2.128 0.02 . 2 . . . . . 79 GLN HB3 . 17510 1 854 . 1 1 82 82 GLN HG2 H 1 2.629 0.02 . 2 . . . . . 79 GLN HG2 . 17510 1 855 . 1 1 82 82 GLN HG3 H 1 2.482 0.02 . 2 . . . . . 79 GLN HG3 . 17510 1 856 . 1 1 82 82 GLN C C 13 177.093 0.40 . 1 . . . . . 79 GLN C . 17510 1 857 . 1 1 82 82 GLN CA C 13 58.949 0.40 . 1 . . . . . 79 GLN CA . 17510 1 858 . 1 1 82 82 GLN CB C 13 27.945 0.40 . 1 . . . . . 79 GLN CB . 17510 1 859 . 1 1 82 82 GLN CG C 13 33.684 0.40 . 1 . . . . . 79 GLN CG . 17510 1 860 . 1 1 82 82 GLN N N 15 122.852 0.40 . 1 . . . . . 79 GLN N . 17510 1 861 . 1 1 83 83 ASN H H 1 7.702 0.02 . 1 . . . . . 80 ASN H . 17510 1 862 . 1 1 83 83 ASN HA H 1 4.666 0.02 . 1 . . . . . 80 ASN HA . 17510 1 863 . 1 1 83 83 ASN HB2 H 1 3.117 0.02 . 2 . . . . . 80 ASN HB2 . 17510 1 864 . 1 1 83 83 ASN HB3 H 1 2.351 0.02 . 2 . . . . . 80 ASN HB3 . 17510 1 865 . 1 1 83 83 ASN C C 13 176.670 0.40 . 1 . . . . . 80 ASN C . 17510 1 866 . 1 1 83 83 ASN CA C 13 51.886 0.40 . 1 . . . . . 80 ASN CA . 17510 1 867 . 1 1 83 83 ASN CB C 13 36.986 0.40 . 1 . . . . . 80 ASN CB . 17510 1 868 . 1 1 83 83 ASN N N 15 114.267 0.40 . 1 . . . . . 80 ASN N . 17510 1 869 . 1 1 84 84 GLY H H 1 7.514 0.02 . 1 . . . . . 81 GLY H . 17510 1 870 . 1 1 84 84 GLY HA2 H 1 4.297 0.02 . 2 . . . . . 81 GLY HA2 . 17510 1 871 . 1 1 84 84 GLY HA3 H 1 4.095 0.02 . 2 . . . . . 81 GLY HA3 . 17510 1 872 . 1 1 84 84 GLY C C 13 176.002 0.40 . 1 . . . . . 81 GLY C . 17510 1 873 . 1 1 84 84 GLY CA C 13 45.753 0.40 . 1 . . . . . 81 GLY CA . 17510 1 874 . 1 1 84 84 GLY N N 15 105.253 0.40 . 1 . . . . . 81 GLY N . 17510 1 875 . 1 1 85 85 LEU H H 1 8.305 0.02 . 1 . . . . . 82 LEU H . 17510 1 876 . 1 1 85 85 LEU HA H 1 4.342 0.02 . 1 . . . . . 82 LEU HA . 17510 1 877 . 1 1 85 85 LEU HB2 H 1 2.366 0.02 . 2 . . . . . 82 LEU HB2 . 17510 1 878 . 1 1 85 85 LEU HB3 H 1 1.465 0.02 . 2 . . . . . 82 LEU HB3 . 17510 1 879 . 1 1 85 85 LEU HG H 1 1.906 0.02 . 1 . . . . . 82 LEU HG . 17510 1 880 . 1 1 85 85 LEU HD11 H 1 1.247 0.02 . 1 . . . . . 82 LEU HD1 . 17510 1 881 . 1 1 85 85 LEU HD12 H 1 1.247 0.02 . 1 . . . . . 82 LEU HD1 . 17510 1 882 . 1 1 85 85 LEU HD13 H 1 1.247 0.02 . 1 . . . . . 82 LEU HD1 . 17510 1 883 . 1 1 85 85 LEU HD21 H 1 1.090 0.02 . 1 . . . . . 82 LEU HD2 . 17510 1 884 . 1 1 85 85 LEU HD22 H 1 1.090 0.02 . 1 . . . . . 82 LEU HD2 . 17510 1 885 . 1 1 85 85 LEU HD23 H 1 1.090 0.02 . 1 . . . . . 82 LEU HD2 . 17510 1 886 . 1 1 85 85 LEU C C 13 179.454 0.40 . 1 . . . . . 82 LEU C . 17510 1 887 . 1 1 85 85 LEU CA C 13 58.656 0.40 . 1 . . . . . 82 LEU CA . 17510 1 888 . 1 1 85 85 LEU CB C 13 41.393 0.40 . 1 . . . . . 82 LEU CB . 17510 1 889 . 1 1 85 85 LEU CG C 13 28.326 0.40 . 1 . . . . . 82 LEU CG . 17510 1 890 . 1 1 85 85 LEU CD1 C 13 26.340 0.40 . 1 . . . . . 82 LEU CD1 . 17510 1 891 . 1 1 85 85 LEU CD2 C 13 24.314 0.40 . 1 . . . . . 82 LEU CD2 . 17510 1 892 . 1 1 85 85 LEU N N 15 123.996 0.40 . 1 . . . . . 82 LEU N . 17510 1 893 . 1 1 86 86 LEU H H 1 8.271 0.02 . 1 . . . . . 83 LEU H . 17510 1 894 . 1 1 86 86 LEU HA H 1 4.042 0.02 . 1 . . . . . 83 LEU HA . 17510 1 895 . 1 1 86 86 LEU HB2 H 1 1.390 0.02 . 2 . . . . . 83 LEU HB2 . 17510 1 896 . 1 1 86 86 LEU HB3 H 1 1.726 0.02 . 2 . . . . . 83 LEU HB3 . 17510 1 897 . 1 1 86 86 LEU HG H 1 1.361 0.02 . 1 . . . . . 83 LEU HG . 17510 1 898 . 1 1 86 86 LEU HD11 H 1 0.754 0.02 . 1 . . . . . 83 LEU HD1 . 17510 1 899 . 1 1 86 86 LEU HD12 H 1 0.754 0.02 . 1 . . . . . 83 LEU HD1 . 17510 1 900 . 1 1 86 86 LEU HD13 H 1 0.754 0.02 . 1 . . . . . 83 LEU HD1 . 17510 1 901 . 1 1 86 86 LEU HD21 H 1 0.084 0.02 . 1 . . . . . 83 LEU HD2 . 17510 1 902 . 1 1 86 86 LEU HD22 H 1 0.084 0.02 . 1 . . . . . 83 LEU HD2 . 17510 1 903 . 1 1 86 86 LEU HD23 H 1 0.084 0.02 . 1 . . . . . 83 LEU HD2 . 17510 1 904 . 1 1 86 86 LEU C C 13 179.031 0.40 . 1 . . . . . 83 LEU C . 17510 1 905 . 1 1 86 86 LEU CA C 13 58.936 0.40 . 1 . . . . . 83 LEU CA . 17510 1 906 . 1 1 86 86 LEU CB C 13 38.599 0.40 . 1 . . . . . 83 LEU CB . 17510 1 907 . 1 1 86 86 LEU CG C 13 27.100 0.40 . 1 . . . . . 83 LEU CG . 17510 1 908 . 1 1 86 86 LEU CD1 C 13 26.121 0.40 . 1 . . . . . 83 LEU CD1 . 17510 1 909 . 1 1 86 86 LEU CD2 C 13 22.483 0.40 . 1 . . . . . 83 LEU CD2 . 17510 1 910 . 1 1 86 86 LEU N N 15 117.599 0.40 . 1 . . . . . 83 LEU N . 17510 1 911 . 1 1 87 87 HIS H H 1 8.286 0.02 . 1 . . . . . 84 HIS H . 17510 1 912 . 1 1 87 87 HIS HA H 1 4.460 0.02 . 1 . . . . . 84 HIS HA . 17510 1 913 . 1 1 87 87 HIS HB2 H 1 3.236 0.02 . 2 . . . . . 84 HIS HB2 . 17510 1 914 . 1 1 87 87 HIS HB3 H 1 3.186 0.02 . 2 . . . . . 84 HIS HB3 . 17510 1 915 . 1 1 87 87 HIS HD2 H 1 7.065 0.02 . 1 . . . . . 84 HIS HD2 . 17510 1 916 . 1 1 87 87 HIS C C 13 178.168 0.40 . 1 . . . . . 84 HIS C . 17510 1 917 . 1 1 87 87 HIS CA C 13 60.054 0.40 . 1 . . . . . 84 HIS CA . 17510 1 918 . 1 1 87 87 HIS CB C 13 30.592 0.40 . 1 . . . . . 84 HIS CB . 17510 1 919 . 1 1 87 87 HIS N N 15 119.476 0.40 . 1 . . . . . 84 HIS N . 17510 1 920 . 1 1 88 88 MET H H 1 7.973 0.02 . 1 . . . . . 85 MET H . 17510 1 921 . 1 1 88 88 MET HA H 1 3.893 0.02 . 1 . . . . . 85 MET HA . 17510 1 922 . 1 1 88 88 MET HB2 H 1 2.407 0.02 . 2 . . . . . 85 MET HB2 . 17510 1 923 . 1 1 88 88 MET HB3 H 1 2.349 0.02 . 2 . . . . . 85 MET HB3 . 17510 1 924 . 1 1 88 88 MET HG2 H 1 2.225 0.02 . 2 . . . . . 85 MET HG2 . 17510 1 925 . 1 1 88 88 MET HG3 H 1 2.736 0.02 . 2 . . . . . 85 MET HG3 . 17510 1 926 . 1 1 88 88 MET HE1 H 1 2.106 0.02 . 1 . . . . . 85 MET HE . 17510 1 927 . 1 1 88 88 MET HE2 H 1 2.106 0.02 . 1 . . . . . 85 MET HE . 17510 1 928 . 1 1 88 88 MET HE3 H 1 2.106 0.02 . 1 . . . . . 85 MET HE . 17510 1 929 . 1 1 88 88 MET C C 13 178.086 0.40 . 1 . . . . . 85 MET C . 17510 1 930 . 1 1 88 88 MET CA C 13 59.284 0.40 . 1 . . . . . 85 MET CA . 17510 1 931 . 1 1 88 88 MET CB C 13 33.966 0.40 . 1 . . . . . 85 MET CB . 17510 1 932 . 1 1 88 88 MET CG C 13 31.127 0.40 . 1 . . . . . 85 MET CG . 17510 1 933 . 1 1 88 88 MET CE C 13 16.553 0.40 . 1 . . . . . 85 MET CE . 17510 1 934 . 1 1 88 88 MET N N 15 121.174 0.40 . 1 . . . . . 85 MET N . 17510 1 935 . 1 1 89 89 LEU H H 1 8.443 0.02 . 1 . . . . . 86 LEU H . 17510 1 936 . 1 1 89 89 LEU HA H 1 3.813 0.02 . 1 . . . . . 86 LEU HA . 17510 1 937 . 1 1 89 89 LEU HB2 H 1 1.589 0.02 . 2 . . . . . 86 LEU HB2 . 17510 1 938 . 1 1 89 89 LEU HB3 H 1 2.387 0.02 . 2 . . . . . 86 LEU HB3 . 17510 1 939 . 1 1 89 89 LEU HG H 1 1.898 0.02 . 1 . . . . . 86 LEU HG . 17510 1 940 . 1 1 89 89 LEU HD11 H 1 0.903 0.02 . 1 . . . . . 86 LEU HD1 . 17510 1 941 . 1 1 89 89 LEU HD12 H 1 0.903 0.02 . 1 . . . . . 86 LEU HD1 . 17510 1 942 . 1 1 89 89 LEU HD13 H 1 0.903 0.02 . 1 . . . . . 86 LEU HD1 . 17510 1 943 . 1 1 89 89 LEU HD21 H 1 1.171 0.02 . 1 . . . . . 86 LEU HD2 . 17510 1 944 . 1 1 89 89 LEU HD22 H 1 1.171 0.02 . 1 . . . . . 86 LEU HD2 . 17510 1 945 . 1 1 89 89 LEU HD23 H 1 1.171 0.02 . 1 . . . . . 86 LEU HD2 . 17510 1 946 . 1 1 89 89 LEU C C 13 178.656 0.40 . 1 . . . . . 86 LEU C . 17510 1 947 . 1 1 89 89 LEU CA C 13 57.992 0.40 . 1 . . . . . 86 LEU CA . 17510 1 948 . 1 1 89 89 LEU CB C 13 43.446 0.40 . 1 . . . . . 86 LEU CB . 17510 1 949 . 1 1 89 89 LEU CG C 13 28.311 0.40 . 1 . . . . . 86 LEU CG . 17510 1 950 . 1 1 89 89 LEU CD1 C 13 27.295 0.40 . 1 . . . . . 86 LEU CD1 . 17510 1 951 . 1 1 89 89 LEU CD2 C 13 24.975 0.40 . 1 . . . . . 86 LEU CD2 . 17510 1 952 . 1 1 89 89 LEU N N 15 119.808 0.40 . 1 . . . . . 86 LEU N . 17510 1 953 . 1 1 90 90 ASP H H 1 8.625 0.02 . 1 . . . . . 87 ASP H . 17510 1 954 . 1 1 90 90 ASP HA H 1 4.228 0.02 . 1 . . . . . 87 ASP HA . 17510 1 955 . 1 1 90 90 ASP HB2 H 1 2.798 0.02 . 2 . . . . . 87 ASP HB2 . 17510 1 956 . 1 1 90 90 ASP HB3 H 1 2.919 0.02 . 2 . . . . . 87 ASP HB3 . 17510 1 957 . 1 1 90 90 ASP C C 13 177.109 0.40 . 1 . . . . . 87 ASP C . 17510 1 958 . 1 1 90 90 ASP CA C 13 57.381 0.40 . 1 . . . . . 87 ASP CA . 17510 1 959 . 1 1 90 90 ASP CB C 13 42.181 0.40 . 1 . . . . . 87 ASP CB . 17510 1 960 . 1 1 90 90 ASP N N 15 121.383 0.40 . 1 . . . . . 87 ASP N . 17510 1 961 . 1 1 91 91 ARG H H 1 7.867 0.02 . 1 . . . . . 88 ARG H . 17510 1 962 . 1 1 91 91 ARG HA H 1 3.800 0.02 . 1 . . . . . 88 ARG HA . 17510 1 963 . 1 1 91 91 ARG HB2 H 1 2.095 0.02 . 2 . . . . . 88 ARG HB2 . 17510 1 964 . 1 1 91 91 ARG HB3 H 1 1.779 0.02 . 2 . . . . . 88 ARG HB3 . 17510 1 965 . 1 1 91 91 ARG HG2 H 1 1.328 0.02 . 2 . . . . . 88 ARG HG2 . 17510 1 966 . 1 1 91 91 ARG HG3 H 1 1.988 0.02 . 2 . . . . . 88 ARG HG3 . 17510 1 967 . 1 1 91 91 ARG HD2 H 1 3.040 0.02 . 2 . . . . . 88 ARG HD2 . 17510 1 968 . 1 1 91 91 ARG HD3 H 1 3.162 0.02 . 2 . . . . . 88 ARG HD3 . 17510 1 969 . 1 1 91 91 ARG C C 13 180.105 0.40 . 1 . . . . . 88 ARG C . 17510 1 970 . 1 1 91 91 ARG CA C 13 59.170 0.40 . 1 . . . . . 88 ARG CA . 17510 1 971 . 1 1 91 91 ARG CB C 13 27.733 0.40 . 1 . . . . . 88 ARG CB . 17510 1 972 . 1 1 91 91 ARG CG C 13 25.872 0.40 . 1 . . . . . 88 ARG CG . 17510 1 973 . 1 1 91 91 ARG CD C 13 42.437 0.40 . 1 . . . . . 88 ARG CD . 17510 1 974 . 1 1 91 91 ARG N N 15 119.477 0.40 . 1 . . . . . 88 ARG N . 17510 1 975 . 1 1 92 92 ASN H H 1 8.280 0.02 . 1 . . . . . 89 ASN H . 17510 1 976 . 1 1 92 92 ASN HA H 1 3.797 0.02 . 1 . . . . . 89 ASN HA . 17510 1 977 . 1 1 92 92 ASN HB2 H 1 0.710 0.02 . 2 . . . . . 89 ASN HB2 . 17510 1 978 . 1 1 92 92 ASN HB3 H 1 2.156 0.02 . 2 . . . . . 89 ASN HB3 . 17510 1 979 . 1 1 92 92 ASN C C 13 176.377 0.40 . 1 . . . . . 89 ASN C . 17510 1 980 . 1 1 92 92 ASN CA C 13 55.640 0.40 . 1 . . . . . 89 ASN CA . 17510 1 981 . 1 1 92 92 ASN CB C 13 35.033 0.40 . 1 . . . . . 89 ASN CB . 17510 1 982 . 1 1 92 92 ASN N N 15 118.649 0.40 . 1 . . . . . 89 ASN N . 17510 1 983 . 1 1 93 93 ARG H H 1 8.126 0.02 . 1 . . . . . 90 ARG H . 17510 1 984 . 1 1 93 93 ARG HA H 1 4.757 0.02 . 1 . . . . . 90 ARG HA . 17510 1 985 . 1 1 93 93 ARG HB2 H 1 2.172 0.02 . 2 . . . . . 90 ARG HB . 17510 1 986 . 1 1 93 93 ARG HB3 H 1 2.172 0.02 . 2 . . . . . 90 ARG HB . 17510 1 987 . 1 1 93 93 ARG HG2 H 1 2.141 0.02 . 2 . . . . . 90 ARG HG2 . 17510 1 988 . 1 1 93 93 ARG HG3 H 1 1.713 0.02 . 2 . . . . . 90 ARG HG3 . 17510 1 989 . 1 1 93 93 ARG HD2 H 1 2.750 0.02 . 2 . . . . . 90 ARG HD2 . 17510 1 990 . 1 1 93 93 ARG HD3 H 1 3.183 0.02 . 2 . . . . . 90 ARG HD3 . 17510 1 991 . 1 1 93 93 ARG C C 13 176.849 0.40 . 1 . . . . . 90 ARG C . 17510 1 992 . 1 1 93 93 ARG CA C 13 57.422 0.40 . 1 . . . . . 90 ARG CA . 17510 1 993 . 1 1 93 93 ARG CB C 13 29.495 0.40 . 1 . . . . . 90 ARG CB . 17510 1 994 . 1 1 93 93 ARG CG C 13 25.842 0.40 . 1 . . . . . 90 ARG CG . 17510 1 995 . 1 1 93 93 ARG CD C 13 44.136 0.40 . 1 . . . . . 90 ARG CD . 17510 1 996 . 1 1 93 93 ARG N N 15 116.910 0.40 . 1 . . . . . 90 ARG N . 17510 1 997 . 1 1 94 94 ARG H H 1 7.199 0.02 . 1 . . . . . 91 ARG H . 17510 1 998 . 1 1 94 94 ARG HA H 1 4.179 0.02 . 1 . . . . . 91 ARG HA . 17510 1 999 . 1 1 94 94 ARG HB2 H 1 1.984 0.02 . 2 . . . . . 91 ARG HB2 . 17510 1 1000 . 1 1 94 94 ARG HB3 H 1 2.136 0.02 . 2 . . . . . 91 ARG HB3 . 17510 1 1001 . 1 1 94 94 ARG HG2 H 1 1.642 0.02 . 2 . . . . . 91 ARG HG2 . 17510 1 1002 . 1 1 94 94 ARG HG3 H 1 1.837 0.02 . 2 . . . . . 91 ARG HG3 . 17510 1 1003 . 1 1 94 94 ARG HD2 H 1 3.229 0.02 . 2 . . . . . 91 ARG HD2 . 17510 1 1004 . 1 1 94 94 ARG HD3 H 1 3.127 0.02 . 2 . . . . . 91 ARG HD3 . 17510 1 1005 . 1 1 94 94 ARG C C 13 177.061 0.40 . 1 . . . . . 91 ARG C . 17510 1 1006 . 1 1 94 94 ARG CA C 13 57.431 0.40 . 1 . . . . . 91 ARG CA . 17510 1 1007 . 1 1 94 94 ARG CB C 13 29.899 0.40 . 1 . . . . . 91 ARG CB . 17510 1 1008 . 1 1 94 94 ARG CG C 13 28.399 0.40 . 1 . . . . . 91 ARG CG . 17510 1 1009 . 1 1 94 94 ARG CD C 13 43.528 0.40 . 1 . . . . . 91 ARG CD . 17510 1 1010 . 1 1 94 94 ARG N N 15 118.436 0.40 . 1 . . . . . 91 ARG N . 17510 1 1011 . 1 1 95 95 ILE H H 1 7.607 0.02 . 1 . . . . . 92 ILE H . 17510 1 1012 . 1 1 95 95 ILE HA H 1 3.815 0.02 . 1 . . . . . 92 ILE HA . 17510 1 1013 . 1 1 95 95 ILE HB H 1 1.713 0.02 . 1 . . . . . 92 ILE HB . 17510 1 1014 . 1 1 95 95 ILE HG12 H 1 1.665 0.02 . 2 . . . . . 92 ILE HG12 . 17510 1 1015 . 1 1 95 95 ILE HG13 H 1 0.886 0.02 . 2 . . . . . 92 ILE HG13 . 17510 1 1016 . 1 1 95 95 ILE HG21 H 1 0.167 0.02 . 1 . . . . . 92 ILE HG2 . 17510 1 1017 . 1 1 95 95 ILE HG22 H 1 0.167 0.02 . 1 . . . . . 92 ILE HG2 . 17510 1 1018 . 1 1 95 95 ILE HG23 H 1 0.167 0.02 . 1 . . . . . 92 ILE HG2 . 17510 1 1019 . 1 1 95 95 ILE HD11 H 1 0.658 0.02 . 1 . . . . . 92 ILE HD1 . 17510 1 1020 . 1 1 95 95 ILE HD12 H 1 0.658 0.02 . 1 . . . . . 92 ILE HD1 . 17510 1 1021 . 1 1 95 95 ILE HD13 H 1 0.658 0.02 . 1 . . . . . 92 ILE HD1 . 17510 1 1022 . 1 1 95 95 ILE C C 13 175.872 0.40 . 1 . . . . . 92 ILE C . 17510 1 1023 . 1 1 95 95 ILE CA C 13 63.838 0.40 . 1 . . . . . 92 ILE CA . 17510 1 1024 . 1 1 95 95 ILE CB C 13 38.613 0.40 . 1 . . . . . 92 ILE CB . 17510 1 1025 . 1 1 95 95 ILE CG1 C 13 28.208 0.40 . 1 . . . . . 92 ILE CG1 . 17510 1 1026 . 1 1 95 95 ILE CG2 C 13 15.408 0.40 . 1 . . . . . 92 ILE CG2 . 17510 1 1027 . 1 1 95 95 ILE CD1 C 13 13.874 0.40 . 1 . . . . . 92 ILE CD1 . 17510 1 1028 . 1 1 95 95 ILE N N 15 120.983 0.40 . 1 . . . . . 92 ILE N . 17510 1 1029 . 1 1 96 96 LYS H H 1 8.410 0.02 . 1 . . . . . 93 LYS H . 17510 1 1030 . 1 1 96 96 LYS HA H 1 4.734 0.02 . 1 . . . . . 93 LYS HA . 17510 1 1031 . 1 1 96 96 LYS HB2 H 1 2.289 0.02 . 2 . . . . . 93 LYS HB . 17510 1 1032 . 1 1 96 96 LYS HB3 H 1 2.289 0.02 . 2 . . . . . 93 LYS HB . 17510 1 1033 . 1 1 96 96 LYS C C 13 173.625 0.40 . 1 . . . . . 93 LYS C . 17510 1 1034 . 1 1 96 96 LYS CA C 13 55.511 0.40 . 1 . . . . . 93 LYS CA . 17510 1 1035 . 1 1 96 96 LYS CB C 13 33.436 0.40 . 1 . . . . . 93 LYS CB . 17510 1 1036 . 1 1 96 96 LYS N N 15 115.079 0.40 . 1 . . . . . 93 LYS N . 17510 1 1037 . 1 1 97 97 LYS H H 1 8.214 0.02 . 1 . . . . . 94 LYS H . 17510 1 1038 . 1 1 97 97 LYS HA H 1 4.381 0.02 . 1 . . . . . 94 LYS HA . 17510 1 1039 . 1 1 97 97 LYS HB2 H 1 2.071 0.02 . 2 . . . . . 94 LYS HB2 . 17510 1 1040 . 1 1 97 97 LYS HB3 H 1 1.935 0.02 . 2 . . . . . 94 LYS HB3 . 17510 1 1041 . 1 1 97 97 LYS HG2 H 1 1.716 0.02 . 2 . . . . . 94 LYS HG2 . 17510 1 1042 . 1 1 97 97 LYS HG3 H 1 1.569 0.02 . 2 . . . . . 94 LYS HG3 . 17510 1 1043 . 1 1 97 97 LYS HD2 H 1 1.817 0.02 . 2 . . . . . 94 LYS HD . 17510 1 1044 . 1 1 97 97 LYS HD3 H 1 1.817 0.02 . 2 . . . . . 94 LYS HD . 17510 1 1045 . 1 1 97 97 LYS HE2 H 1 3.065 0.02 . 2 . . . . . 94 LYS HE . 17510 1 1046 . 1 1 97 97 LYS HE3 H 1 3.065 0.02 . 2 . . . . . 94 LYS HE . 17510 1 1047 . 1 1 97 97 LYS C C 13 179.177 0.40 . 1 . . . . . 94 LYS C . 17510 1 1048 . 1 1 97 97 LYS CA C 13 59.924 0.40 . 1 . . . . . 94 LYS CA . 17510 1 1049 . 1 1 97 97 LYS CB C 13 34.355 0.40 . 1 . . . . . 94 LYS CB . 17510 1 1050 . 1 1 97 97 LYS CG C 13 25.644 0.40 . 1 . . . . . 94 LYS CG . 17510 1 1051 . 1 1 97 97 LYS CD C 13 29.901 0.40 . 1 . . . . . 94 LYS CD . 17510 1 1052 . 1 1 97 97 LYS CE C 13 42.064 0.40 . 1 . . . . . 94 LYS CE . 17510 1 1053 . 1 1 97 97 LYS N N 15 114.267 0.40 . 1 . . . . . 94 LYS N . 17510 1 1054 . 1 1 98 98 CYS H H 1 8.365 0.02 . 1 . . . . . 95 CYS H . 17510 1 1055 . 1 1 98 98 CYS HA H 1 4.400 0.02 . 1 . . . . . 95 CYS HA . 17510 1 1056 . 1 1 98 98 CYS HB2 H 1 2.514 0.02 . 2 . . . . . 95 CYS HB2 . 17510 1 1057 . 1 1 98 98 CYS HB3 H 1 2.326 0.02 . 2 . . . . . 95 CYS HB3 . 17510 1 1058 . 1 1 98 98 CYS CA C 13 54.079 0.40 . 1 . . . . . 95 CYS CA . 17510 1 1059 . 1 1 98 98 CYS CB C 13 31.178 0.40 . 1 . . . . . 95 CYS CB . 17510 1 1060 . 1 1 98 98 CYS N N 15 114.051 0.40 . 1 . . . . . 95 CYS N . 17510 1 1061 . 1 1 99 99 PRO CA C 13 62.261 0.40 . 1 . . . . . 96 PRO CA . 17510 1 1062 . 1 1 99 99 PRO CB C 13 32.448 0.40 . 1 . . . . . 96 PRO CB . 17510 1 1063 . 1 1 100 100 GLU H H 1 9.261 0.02 . 1 . . . . . 97 GLU H . 17510 1 1064 . 1 1 100 100 GLU HA H 1 4.906 0.02 . 1 . . . . . 97 GLU HA . 17510 1 1065 . 1 1 100 100 GLU HB2 H 1 2.139 0.02 . 2 . . . . . 97 GLU HB2 . 17510 1 1066 . 1 1 100 100 GLU HB3 H 1 2.461 0.02 . 2 . . . . . 97 GLU HB3 . 17510 1 1067 . 1 1 100 100 GLU HG2 H 1 2.266 0.02 . 2 . . . . . 97 GLU HG2 . 17510 1 1068 . 1 1 100 100 GLU HG3 H 1 2.628 0.02 . 2 . . . . . 97 GLU HG3 . 17510 1 1069 . 1 1 100 100 GLU C C 13 174.162 0.40 . 1 . . . . . 97 GLU C . 17510 1 1070 . 1 1 100 100 GLU CA C 13 55.398 0.40 . 1 . . . . . 97 GLU CA . 17510 1 1071 . 1 1 100 100 GLU CB C 13 36.091 0.40 . 1 . . . . . 97 GLU CB . 17510 1 1072 . 1 1 100 100 GLU CG C 13 38.225 0.40 . 1 . . . . . 97 GLU CG . 17510 1 1073 . 1 1 100 100 GLU N N 15 123.787 0.40 . 1 . . . . . 97 GLU N . 17510 1 1074 . 1 1 101 101 ARG H H 1 9.219 0.02 . 1 . . . . . 98 ARG H . 17510 1 1075 . 1 1 101 101 ARG HA H 1 4.405 0.02 . 1 . . . . . 98 ARG HA . 17510 1 1076 . 1 1 101 101 ARG HB2 H 1 0.512 0.02 . 2 . . . . . 98 ARG HB2 . 17510 1 1077 . 1 1 101 101 ARG HB3 H 1 1.598 0.02 . 2 . . . . . 98 ARG HB3 . 17510 1 1078 . 1 1 101 101 ARG HG2 H 1 0.920 0.02 . 2 . . . . . 98 ARG HG . 17510 1 1079 . 1 1 101 101 ARG HG3 H 1 0.920 0.02 . 2 . . . . . 98 ARG HG . 17510 1 1080 . 1 1 101 101 ARG HD2 H 1 2.909 0.02 . 2 . . . . . 98 ARG HD . 17510 1 1081 . 1 1 101 101 ARG HD3 H 1 2.909 0.02 . 2 . . . . . 98 ARG HD . 17510 1 1082 . 1 1 101 101 ARG C C 13 178.233 0.40 . 1 . . . . . 98 ARG C . 17510 1 1083 . 1 1 101 101 ARG CA C 13 55.169 0.40 . 1 . . . . . 98 ARG CA . 17510 1 1084 . 1 1 101 101 ARG CB C 13 31.189 0.40 . 1 . . . . . 98 ARG CB . 17510 1 1085 . 1 1 101 101 ARG CG C 13 28.450 0.40 . 1 . . . . . 98 ARG CG . 17510 1 1086 . 1 1 101 101 ARG CD C 13 43.332 0.40 . 1 . . . . . 98 ARG CD . 17510 1 1087 . 1 1 101 101 ARG N N 15 125.276 0.40 . 1 . . . . . 98 ARG N . 17510 1 1088 . 1 1 102 102 PHE H H 1 9.747 0.02 . 1 . . . . . 99 PHE H . 17510 1 1089 . 1 1 102 102 PHE HA H 1 3.357 0.02 . 1 . . . . . 99 PHE HA . 17510 1 1090 . 1 1 102 102 PHE HB2 H 1 2.450 0.02 . 2 . . . . . 99 PHE HB2 . 17510 1 1091 . 1 1 102 102 PHE HB3 H 1 2.847 0.02 . 2 . . . . . 99 PHE HB3 . 17510 1 1092 . 1 1 102 102 PHE HD1 H 1 6.427 0.02 . 3 . . . . . 99 PHE HD . 17510 1 1093 . 1 1 102 102 PHE HD2 H 1 6.427 0.02 . 3 . . . . . 99 PHE HD . 17510 1 1094 . 1 1 102 102 PHE HE1 H 1 7.138 0.02 . 3 . . . . . 99 PHE HE . 17510 1 1095 . 1 1 102 102 PHE HE2 H 1 7.138 0.02 . 3 . . . . . 99 PHE HE . 17510 1 1096 . 1 1 102 102 PHE HZ H 1 7.475 0.02 . 1 . . . . . 99 PHE HZ . 17510 1 1097 . 1 1 102 102 PHE C C 13 176.751 0.40 . 1 . . . . . 99 PHE C . 17510 1 1098 . 1 1 102 102 PHE CA C 13 61.719 0.40 . 1 . . . . . 99 PHE CA . 17510 1 1099 . 1 1 102 102 PHE CB C 13 39.638 0.40 . 1 . . . . . 99 PHE CB . 17510 1 1100 . 1 1 102 102 PHE CD1 C 13 130.983 0.40 . 3 . . . . . 99 PHE CD1 . 17510 1 1101 . 1 1 102 102 PHE N N 15 130.970 0.40 . 1 . . . . . 99 PHE N . 17510 1 1102 . 1 1 103 103 GLN H H 1 10.545 0.02 . 1 . . . . . 100 GLN H . 17510 1 1103 . 1 1 103 103 GLN HA H 1 2.388 0.02 . 1 . . . . . 100 GLN HA . 17510 1 1104 . 1 1 103 103 GLN HB2 H 1 1.396 0.02 . 2 . . . . . 100 GLN HB2 . 17510 1 1105 . 1 1 103 103 GLN HB3 H 1 1.824 0.02 . 2 . . . . . 100 GLN HB3 . 17510 1 1106 . 1 1 103 103 GLN HG2 H 1 2.778 0.02 . 2 . . . . . 100 GLN HG2 . 17510 1 1107 . 1 1 103 103 GLN HG3 H 1 1.518 0.02 . 2 . . . . . 100 GLN HG3 . 17510 1 1108 . 1 1 103 103 GLN C C 13 174.765 0.40 . 1 . . . . . 100 GLN C . 17510 1 1109 . 1 1 103 103 GLN CA C 13 58.739 0.40 . 1 . . . . . 100 GLN CA . 17510 1 1110 . 1 1 103 103 GLN CB C 13 27.723 0.40 . 1 . . . . . 100 GLN CB . 17510 1 1111 . 1 1 103 103 GLN CG C 13 35.279 0.40 . 1 . . . . . 100 GLN CG . 17510 1 1112 . 1 1 103 103 GLN N N 15 117.288 0.40 . 1 . . . . . 100 GLN N . 17510 1 1113 . 1 1 104 104 ASP H H 1 6.832 0.02 . 1 . . . . . 101 ASP H . 17510 1 1114 . 1 1 104 104 ASP HA H 1 4.798 0.02 . 1 . . . . . 101 ASP HA . 17510 1 1115 . 1 1 104 104 ASP HB2 H 1 2.457 0.02 . 2 . . . . . 101 ASP HB2 . 17510 1 1116 . 1 1 104 104 ASP HB3 H 1 2.957 0.02 . 2 . . . . . 101 ASP HB3 . 17510 1 1117 . 1 1 104 104 ASP C C 13 176.425 0.40 . 1 . . . . . 101 ASP C . 17510 1 1118 . 1 1 104 104 ASP CA C 13 53.966 0.40 . 1 . . . . . 101 ASP CA . 17510 1 1119 . 1 1 104 104 ASP CB C 13 42.500 0.40 . 1 . . . . . 101 ASP CB . 17510 1 1120 . 1 1 104 104 ASP N N 15 114.168 0.40 . 1 . . . . . 101 ASP N . 17510 1 1121 . 1 1 105 105 THR H H 1 7.172 0.02 . 1 . . . . . 102 THR H . 17510 1 1122 . 1 1 105 105 THR HA H 1 4.569 0.02 . 1 . . . . . 102 THR HA . 17510 1 1123 . 1 1 105 105 THR HB H 1 3.909 0.02 . 1 . . . . . 102 THR HB . 17510 1 1124 . 1 1 105 105 THR HG21 H 1 0.819 0.02 . 1 . . . . . 102 THR HG2 . 17510 1 1125 . 1 1 105 105 THR HG22 H 1 0.819 0.02 . 1 . . . . . 102 THR HG2 . 17510 1 1126 . 1 1 105 105 THR HG23 H 1 0.819 0.02 . 1 . . . . . 102 THR HG2 . 17510 1 1127 . 1 1 105 105 THR C C 13 173.853 0.40 . 1 . . . . . 102 THR C . 17510 1 1128 . 1 1 105 105 THR CA C 13 62.175 0.40 . 1 . . . . . 102 THR CA . 17510 1 1129 . 1 1 105 105 THR CB C 13 70.047 0.40 . 1 . . . . . 102 THR CB . 17510 1 1130 . 1 1 105 105 THR CG2 C 13 19.117 0.40 . 1 . . . . . 102 THR CG2 . 17510 1 1131 . 1 1 105 105 THR N N 15 115.372 0.40 . 1 . . . . . 102 THR N . 17510 1 1132 . 1 1 106 106 LYS HA H 1 4.647 0.02 . 1 . . . . . 103 LYS HA . 17510 1 1133 . 1 1 106 106 LYS HB2 H 1 2.075 0.02 . 2 . . . . . 103 LYS HB . 17510 1 1134 . 1 1 106 106 LYS HB3 H 1 2.075 0.02 . 2 . . . . . 103 LYS HB . 17510 1 1135 . 1 1 106 106 LYS HG2 H 1 1.531 0.02 . 2 . . . . . 103 LYS HG2 . 17510 1 1136 . 1 1 106 106 LYS HG3 H 1 1.462 0.02 . 2 . . . . . 103 LYS HG3 . 17510 1 1137 . 1 1 106 106 LYS HD2 H 1 1.702 0.02 . 2 . . . . . 103 LYS HD2 . 17510 1 1138 . 1 1 106 106 LYS HD3 H 1 1.734 0.02 . 2 . . . . . 103 LYS HD3 . 17510 1 1139 . 1 1 106 106 LYS HE2 H 1 3.053 0.02 . 2 . . . . . 103 LYS HE . 17510 1 1140 . 1 1 106 106 LYS HE3 H 1 3.053 0.02 . 2 . . . . . 103 LYS HE . 17510 1 1141 . 1 1 106 106 LYS C C 13 177.082 0.40 . 1 . . . . . 103 LYS C . 17510 1 1142 . 1 1 106 106 LYS CA C 13 54.921 0.40 . 1 . . . . . 103 LYS CA . 17510 1 1143 . 1 1 106 106 LYS CB C 13 32.168 0.40 . 1 . . . . . 103 LYS CB . 17510 1 1144 . 1 1 106 106 LYS CG C 13 24.894 0.40 . 1 . . . . . 103 LYS CG . 17510 1 1145 . 1 1 106 106 LYS CD C 13 28.514 0.40 . 1 . . . . . 103 LYS CD . 17510 1 1146 . 1 1 106 106 LYS CE C 13 41.345 0.40 . 1 . . . . . 103 LYS CE . 17510 1 1147 . 1 1 107 107 GLU H H 1 8.053 0.02 . 1 . . . . . 104 GLU H . 17510 1 1148 . 1 1 107 107 GLU HA H 1 3.887 0.02 . 1 . . . . . 104 GLU HA . 17510 1 1149 . 1 1 107 107 GLU HB2 H 1 1.812 0.02 . 2 . . . . . 104 GLU HB2 . 17510 1 1150 . 1 1 107 107 GLU HB3 H 1 1.617 0.02 . 2 . . . . . 104 GLU HB3 . 17510 1 1151 . 1 1 107 107 GLU HG2 H 1 2.229 0.02 . 2 . . . . . 104 GLU HG . 17510 1 1152 . 1 1 107 107 GLU HG3 H 1 2.229 0.02 . 2 . . . . . 104 GLU HG . 17510 1 1153 . 1 1 107 107 GLU C C 13 174.097 0.40 . 1 . . . . . 104 GLU C . 17510 1 1154 . 1 1 107 107 GLU CA C 13 56.475 0.40 . 1 . . . . . 104 GLU CA . 17510 1 1155 . 1 1 107 107 GLU CB C 13 30.869 0.40 . 1 . . . . . 104 GLU CB . 17510 1 1156 . 1 1 107 107 GLU CG C 13 35.964 0.40 . 1 . . . . . 104 GLU CG . 17510 1 1157 . 1 1 107 107 GLU N N 15 122.520 0.40 . 1 . . . . . 104 GLU N . 17510 1 1158 . 1 1 108 108 GLN H H 1 7.784 0.02 . 1 . . . . . 105 GLN H . 17510 1 1159 . 1 1 108 108 GLN HA H 1 3.951 0.02 . 1 . . . . . 105 GLN HA . 17510 1 1160 . 1 1 108 108 GLN HB2 H 1 1.303 0.02 . 2 . . . . . 105 GLN HB2 . 17510 1 1161 . 1 1 108 108 GLN HB3 H 1 0.807 0.02 . 2 . . . . . 105 GLN HB3 . 17510 1 1162 . 1 1 108 108 GLN HG2 H 1 1.875 0.02 . 2 . . . . . 105 GLN HG2 . 17510 1 1163 . 1 1 108 108 GLN HG3 H 1 1.043 0.02 . 2 . . . . . 105 GLN HG3 . 17510 1 1164 . 1 1 108 108 GLN C C 13 174.488 0.40 . 1 . . . . . 105 GLN C . 17510 1 1165 . 1 1 108 108 GLN CA C 13 54.050 0.40 . 1 . . . . . 105 GLN CA . 17510 1 1166 . 1 1 108 108 GLN CB C 13 31.365 0.40 . 1 . . . . . 105 GLN CB . 17510 1 1167 . 1 1 108 108 GLN CG C 13 32.955 0.40 . 1 . . . . . 105 GLN CG . 17510 1 1168 . 1 1 108 108 GLN N N 15 117.957 0.40 . 1 . . . . . 105 GLN N . 17510 1 1169 . 1 1 109 109 PHE H H 1 7.628 0.02 . 1 . . . . . 106 PHE H . 17510 1 1170 . 1 1 109 109 PHE HA H 1 4.644 0.02 . 1 . . . . . 106 PHE HA . 17510 1 1171 . 1 1 109 109 PHE HD1 H 1 7.110 0.02 . 3 . . . . . 106 PHE HD . 17510 1 1172 . 1 1 109 109 PHE HD2 H 1 7.110 0.02 . 3 . . . . . 106 PHE HD . 17510 1 1173 . 1 1 109 109 PHE HE1 H 1 7.188 0.02 . 3 . . . . . 106 PHE HE . 17510 1 1174 . 1 1 109 109 PHE HE2 H 1 7.188 0.02 . 3 . . . . . 106 PHE HE . 17510 1 1175 . 1 1 109 109 PHE C C 13 173.641 0.40 . 1 . . . . . 106 PHE C . 17510 1 1176 . 1 1 109 109 PHE CA C 13 57.512 0.40 . 1 . . . . . 106 PHE CA . 17510 1 1177 . 1 1 109 109 PHE CB C 13 42.865 0.40 . 1 . . . . . 106 PHE CB . 17510 1 1178 . 1 1 109 109 PHE N N 15 118.090 0.40 . 1 . . . . . 106 PHE N . 17510 1 1179 . 1 1 110 110 ASP H H 1 9.414 0.02 . 1 . . . . . 107 ASP H . 17510 1 1180 . 1 1 110 110 ASP HA H 1 5.222 0.02 . 1 . . . . . 107 ASP HA . 17510 1 1181 . 1 1 110 110 ASP HB2 H 1 2.820 0.02 . 2 . . . . . 107 ASP HB2 . 17510 1 1182 . 1 1 110 110 ASP HB3 H 1 3.024 0.02 . 2 . . . . . 107 ASP HB3 . 17510 1 1183 . 1 1 110 110 ASP C C 13 177.663 0.40 . 1 . . . . . 107 ASP C . 17510 1 1184 . 1 1 110 110 ASP CA C 13 57.088 0.40 . 1 . . . . . 107 ASP CA . 17510 1 1185 . 1 1 110 110 ASP CB C 13 44.382 0.40 . 1 . . . . . 107 ASP CB . 17510 1 1186 . 1 1 110 110 ASP N N 15 117.015 0.40 . 1 . . . . . 107 ASP N . 17510 1 1187 . 1 1 111 111 ILE H H 1 7.925 0.02 . 1 . . . . . 108 ILE H . 17510 1 1188 . 1 1 111 111 ILE HA H 1 5.230 0.02 . 1 . . . . . 108 ILE HA . 17510 1 1189 . 1 1 111 111 ILE HB H 1 1.669 0.02 . 1 . . . . . 108 ILE HB . 17510 1 1190 . 1 1 111 111 ILE HG12 H 1 1.624 0.02 . 2 . . . . . 108 ILE HG12 . 17510 1 1191 . 1 1 111 111 ILE HG13 H 1 1.164 0.02 . 2 . . . . . 108 ILE HG13 . 17510 1 1192 . 1 1 111 111 ILE HG21 H 1 0.888 0.02 . 1 . . . . . 108 ILE HG2 . 17510 1 1193 . 1 1 111 111 ILE HG22 H 1 0.888 0.02 . 1 . . . . . 108 ILE HG2 . 17510 1 1194 . 1 1 111 111 ILE HG23 H 1 0.888 0.02 . 1 . . . . . 108 ILE HG2 . 17510 1 1195 . 1 1 111 111 ILE HD11 H 1 0.897 0.02 . 1 . . . . . 108 ILE HD1 . 17510 1 1196 . 1 1 111 111 ILE HD12 H 1 0.897 0.02 . 1 . . . . . 108 ILE HD1 . 17510 1 1197 . 1 1 111 111 ILE HD13 H 1 0.897 0.02 . 1 . . . . . 108 ILE HD1 . 17510 1 1198 . 1 1 111 111 ILE C C 13 173.706 0.40 . 1 . . . . . 108 ILE C . 17510 1 1199 . 1 1 111 111 ILE CA C 13 59.715 0.40 . 1 . . . . . 108 ILE CA . 17510 1 1200 . 1 1 111 111 ILE CB C 13 43.798 0.40 . 1 . . . . . 108 ILE CB . 17510 1 1201 . 1 1 111 111 ILE CG1 C 13 27.947 0.40 . 1 . . . . . 108 ILE CG1 . 17510 1 1202 . 1 1 111 111 ILE CG2 C 13 18.136 0.40 . 1 . . . . . 108 ILE CG2 . 17510 1 1203 . 1 1 111 111 ILE CD1 C 13 14.913 0.40 . 1 . . . . . 108 ILE CD1 . 17510 1 1204 . 1 1 111 111 ILE N N 15 118.490 0.40 . 1 . . . . . 108 ILE N . 17510 1 1205 . 1 1 112 112 ILE H H 1 9.348 0.02 . 1 . . . . . 109 ILE H . 17510 1 1206 . 1 1 112 112 ILE HA H 1 4.760 0.02 . 1 . . . . . 109 ILE HA . 17510 1 1207 . 1 1 112 112 ILE HB H 1 1.637 0.02 . 1 . . . . . 109 ILE HB . 17510 1 1208 . 1 1 112 112 ILE HG12 H 1 0.755 0.02 . 2 . . . . . 109 ILE HG1 . 17510 1 1209 . 1 1 112 112 ILE HG13 H 1 0.755 0.02 . 2 . . . . . 109 ILE HG1 . 17510 1 1210 . 1 1 112 112 ILE HG21 H 1 0.504 0.02 . 1 . . . . . 109 ILE HG2 . 17510 1 1211 . 1 1 112 112 ILE HG22 H 1 0.504 0.02 . 1 . . . . . 109 ILE HG2 . 17510 1 1212 . 1 1 112 112 ILE HG23 H 1 0.504 0.02 . 1 . . . . . 109 ILE HG2 . 17510 1 1213 . 1 1 112 112 ILE HD11 H 1 1.025 0.02 . 1 . . . . . 109 ILE HD1 . 17510 1 1214 . 1 1 112 112 ILE HD12 H 1 1.025 0.02 . 1 . . . . . 109 ILE HD1 . 17510 1 1215 . 1 1 112 112 ILE HD13 H 1 1.025 0.02 . 1 . . . . . 109 ILE HD1 . 17510 1 1216 . 1 1 112 112 ILE C C 13 173.739 0.40 . 1 . . . . . 109 ILE C . 17510 1 1217 . 1 1 112 112 ILE CA C 13 60.080 0.40 . 1 . . . . . 109 ILE CA . 17510 1 1218 . 1 1 112 112 ILE CB C 13 41.319 0.40 . 1 . . . . . 109 ILE CB . 17510 1 1219 . 1 1 112 112 ILE CG1 C 13 27.592 0.40 . 1 . . . . . 109 ILE CG1 . 17510 1 1220 . 1 1 112 112 ILE CG2 C 13 17.406 0.40 . 1 . . . . . 109 ILE CG2 . 17510 1 1221 . 1 1 112 112 ILE CD1 C 13 14.665 0.40 . 1 . . . . . 109 ILE CD1 . 17510 1 1222 . 1 1 112 112 ILE N N 15 127.648 0.40 . 1 . . . . . 109 ILE N . 17510 1 1223 . 1 1 113 113 VAL H H 1 9.367 0.02 . 1 . . . . . 110 VAL H . 17510 1 1224 . 1 1 113 113 VAL HA H 1 5.445 0.02 . 1 . . . . . 110 VAL HA . 17510 1 1225 . 1 1 113 113 VAL HB H 1 1.971 0.02 . 1 . . . . . 110 VAL HB . 17510 1 1226 . 1 1 113 113 VAL HG11 H 1 0.920 0.02 . 1 . . . . . 110 VAL HG1 . 17510 1 1227 . 1 1 113 113 VAL HG12 H 1 0.920 0.02 . 1 . . . . . 110 VAL HG1 . 17510 1 1228 . 1 1 113 113 VAL HG13 H 1 0.920 0.02 . 1 . . . . . 110 VAL HG1 . 17510 1 1229 . 1 1 113 113 VAL HG21 H 1 0.834 0.02 . 1 . . . . . 110 VAL HG2 . 17510 1 1230 . 1 1 113 113 VAL HG22 H 1 0.834 0.02 . 1 . . . . . 110 VAL HG2 . 17510 1 1231 . 1 1 113 113 VAL HG23 H 1 0.834 0.02 . 1 . . . . . 110 VAL HG2 . 17510 1 1232 . 1 1 113 113 VAL C C 13 175.237 0.40 . 1 . . . . . 110 VAL C . 17510 1 1233 . 1 1 113 113 VAL CA C 13 59.910 0.40 . 1 . . . . . 110 VAL CA . 17510 1 1234 . 1 1 113 113 VAL CB C 13 34.064 0.40 . 1 . . . . . 110 VAL CB . 17510 1 1235 . 1 1 113 113 VAL CG1 C 13 21.528 0.40 . 1 . . . . . 110 VAL CG1 . 17510 1 1236 . 1 1 113 113 VAL CG2 C 13 22.025 0.40 . 1 . . . . . 110 VAL CG2 . 17510 1 1237 . 1 1 113 113 VAL N N 15 127.409 0.40 . 1 . . . . . 110 VAL N . 17510 1 1238 . 1 1 114 114 THR H H 1 9.848 0.02 . 1 . . . . . 111 THR H . 17510 1 1239 . 1 1 114 114 THR HA H 1 5.440 0.02 . 1 . . . . . 111 THR HA . 17510 1 1240 . 1 1 114 114 THR HB H 1 4.304 0.02 . 1 . . . . . 111 THR HB . 17510 1 1241 . 1 1 114 114 THR HG21 H 1 0.940 0.02 . 1 . . . . . 111 THR HG2 . 17510 1 1242 . 1 1 114 114 THR HG22 H 1 0.940 0.02 . 1 . . . . . 111 THR HG2 . 17510 1 1243 . 1 1 114 114 THR HG23 H 1 0.940 0.02 . 1 . . . . . 111 THR HG2 . 17510 1 1244 . 1 1 114 114 THR C C 13 175.676 0.40 . 1 . . . . . 111 THR C . 17510 1 1245 . 1 1 114 114 THR CA C 13 60.336 0.40 . 1 . . . . . 111 THR CA . 17510 1 1246 . 1 1 114 114 THR CB C 13 70.431 0.40 . 1 . . . . . 111 THR CB . 17510 1 1247 . 1 1 114 114 THR CG2 C 13 22.571 0.40 . 1 . . . . . 111 THR CG2 . 17510 1 1248 . 1 1 114 114 THR N N 15 118.757 0.40 . 1 . . . . . 111 THR N . 17510 1 1249 . 1 1 115 115 VAL H H 1 6.663 0.02 . 1 . . . . . 112 VAL H . 17510 1 1250 . 1 1 115 115 VAL HA H 1 5.581 0.02 . 1 . . . . . 112 VAL HA . 17510 1 1251 . 1 1 115 115 VAL HB H 1 2.809 0.02 . 1 . . . . . 112 VAL HB . 17510 1 1252 . 1 1 115 115 VAL HG11 H 1 0.750 0.02 . 1 . . . . . 112 VAL HG1 . 17510 1 1253 . 1 1 115 115 VAL HG12 H 1 0.750 0.02 . 1 . . . . . 112 VAL HG1 . 17510 1 1254 . 1 1 115 115 VAL HG13 H 1 0.750 0.02 . 1 . . . . . 112 VAL HG1 . 17510 1 1255 . 1 1 115 115 VAL HG21 H 1 1.092 0.02 . 1 . . . . . 112 VAL HG2 . 17510 1 1256 . 1 1 115 115 VAL HG22 H 1 1.092 0.02 . 1 . . . . . 112 VAL HG2 . 17510 1 1257 . 1 1 115 115 VAL HG23 H 1 1.092 0.02 . 1 . . . . . 112 VAL HG2 . 17510 1 1258 . 1 1 115 115 VAL C C 13 175.595 0.40 . 1 . . . . . 112 VAL C . 17510 1 1259 . 1 1 115 115 VAL CA C 13 60.558 0.40 . 1 . . . . . 112 VAL CA . 17510 1 1260 . 1 1 115 115 VAL CB C 13 31.535 0.40 . 1 . . . . . 112 VAL CB . 17510 1 1261 . 1 1 115 115 VAL CG1 C 13 19.888 0.40 . 1 . . . . . 112 VAL CG1 . 17510 1 1262 . 1 1 115 115 VAL CG2 C 13 18.039 0.40 . 1 . . . . . 112 VAL CG2 . 17510 1 1263 . 1 1 115 115 VAL N N 15 105.410 0.40 . 1 . . . . . 112 VAL N . 17510 1 1264 . 1 1 116 116 GLU H H 1 7.370 0.02 . 1 . . . . . 113 GLU H . 17510 1 1265 . 1 1 116 116 GLU HA H 1 5.012 0.02 . 1 . . . . . 113 GLU HA . 17510 1 1266 . 1 1 116 116 GLU HB2 H 1 2.593 0.02 . 2 . . . . . 113 GLU HB2 . 17510 1 1267 . 1 1 116 116 GLU HB3 H 1 2.464 0.02 . 2 . . . . . 113 GLU HB3 . 17510 1 1268 . 1 1 116 116 GLU HG2 H 1 2.462 0.02 . 2 . . . . . 113 GLU HG2 . 17510 1 1269 . 1 1 116 116 GLU HG3 H 1 2.381 0.02 . 2 . . . . . 113 GLU HG3 . 17510 1 1270 . 1 1 116 116 GLU C C 13 177.288 0.40 . 1 . . . . . 113 GLU C . 17510 1 1271 . 1 1 116 116 GLU CA C 13 56.552 0.40 . 1 . . . . . 113 GLU CA . 17510 1 1272 . 1 1 116 116 GLU CB C 13 33.037 0.40 . 1 . . . . . 113 GLU CB . 17510 1 1273 . 1 1 116 116 GLU CG C 13 37.332 0.40 . 1 . . . . . 113 GLU CG . 17510 1 1274 . 1 1 116 116 GLU N N 15 115.458 0.40 . 1 . . . . . 113 GLU N . 17510 1 1275 . 1 1 117 117 GLU H H 1 9.201 0.02 . 1 . . . . . 114 GLU H . 17510 1 1276 . 1 1 117 117 GLU HA H 1 3.751 0.02 . 1 . . . . . 114 GLU HA . 17510 1 1277 . 1 1 117 117 GLU HB2 H 1 2.116 0.02 . 2 . . . . . 114 GLU HB2 . 17510 1 1278 . 1 1 117 117 GLU HB3 H 1 2.076 0.02 . 2 . . . . . 114 GLU HB3 . 17510 1 1279 . 1 1 117 117 GLU HG2 H 1 2.311 0.02 . 2 . . . . . 114 GLU HG2 . 17510 1 1280 . 1 1 117 117 GLU HG3 H 1 2.238 0.02 . 2 . . . . . 114 GLU HG3 . 17510 1 1281 . 1 1 117 117 GLU C C 13 176.963 0.40 . 1 . . . . . 114 GLU C . 17510 1 1282 . 1 1 117 117 GLU CA C 13 60.645 0.40 . 1 . . . . . 114 GLU CA . 17510 1 1283 . 1 1 117 117 GLU CB C 13 29.473 0.40 . 1 . . . . . 114 GLU CB . 17510 1 1284 . 1 1 117 117 GLU CG C 13 36.737 0.40 . 1 . . . . . 114 GLU CG . 17510 1 1285 . 1 1 117 117 GLU N N 15 127.682 0.40 . 1 . . . . . 114 GLU N . 17510 1 1286 . 1 1 118 118 ARG H H 1 8.869 0.02 . 1 . . . . . 115 ARG H . 17510 1 1287 . 1 1 118 118 ARG HA H 1 4.307 0.02 . 1 . . . . . 115 ARG HA . 17510 1 1288 . 1 1 118 118 ARG HB2 H 1 1.985 0.02 . 2 . . . . . 115 ARG HB2 . 17510 1 1289 . 1 1 118 118 ARG HB3 H 1 2.083 0.02 . 2 . . . . . 115 ARG HB3 . 17510 1 1290 . 1 1 118 118 ARG HG2 H 1 1.793 0.02 . 2 . . . . . 115 ARG HG2 . 17510 1 1291 . 1 1 118 118 ARG HG3 H 1 1.828 0.02 . 2 . . . . . 115 ARG HG3 . 17510 1 1292 . 1 1 118 118 ARG HD2 H 1 3.411 0.02 . 2 . . . . . 115 ARG HD2 . 17510 1 1293 . 1 1 118 118 ARG HD3 H 1 3.335 0.02 . 2 . . . . . 115 ARG HD3 . 17510 1 1294 . 1 1 118 118 ARG C C 13 178.819 0.40 . 1 . . . . . 115 ARG C . 17510 1 1295 . 1 1 118 118 ARG CA C 13 59.321 0.40 . 1 . . . . . 115 ARG CA . 17510 1 1296 . 1 1 118 118 ARG CB C 13 30.401 0.40 . 1 . . . . . 115 ARG CB . 17510 1 1297 . 1 1 118 118 ARG CG C 13 27.416 0.40 . 1 . . . . . 115 ARG CG . 17510 1 1298 . 1 1 118 118 ARG CD C 13 43.401 0.40 . 1 . . . . . 115 ARG CD . 17510 1 1299 . 1 1 118 118 ARG N N 15 116.718 0.40 . 1 . . . . . 115 ARG N . 17510 1 1300 . 1 1 119 119 VAL H H 1 7.182 0.02 . 1 . . . . . 116 VAL H . 17510 1 1301 . 1 1 119 119 VAL HA H 1 3.806 0.02 . 1 . . . . . 116 VAL HA . 17510 1 1302 . 1 1 119 119 VAL HB H 1 2.425 0.02 . 1 . . . . . 116 VAL HB . 17510 1 1303 . 1 1 119 119 VAL HG11 H 1 0.992 0.02 . 1 . . . . . 116 VAL HG1 . 17510 1 1304 . 1 1 119 119 VAL HG12 H 1 0.992 0.02 . 1 . . . . . 116 VAL HG1 . 17510 1 1305 . 1 1 119 119 VAL HG13 H 1 0.992 0.02 . 1 . . . . . 116 VAL HG1 . 17510 1 1306 . 1 1 119 119 VAL HG21 H 1 0.972 0.02 . 1 . . . . . 116 VAL HG2 . 17510 1 1307 . 1 1 119 119 VAL HG22 H 1 0.972 0.02 . 1 . . . . . 116 VAL HG2 . 17510 1 1308 . 1 1 119 119 VAL HG23 H 1 0.972 0.02 . 1 . . . . . 116 VAL HG2 . 17510 1 1309 . 1 1 119 119 VAL C C 13 177.126 0.40 . 1 . . . . . 116 VAL C . 17510 1 1310 . 1 1 119 119 VAL CA C 13 65.669 0.40 . 1 . . . . . 116 VAL CA . 17510 1 1311 . 1 1 119 119 VAL CB C 13 32.154 0.40 . 1 . . . . . 116 VAL CB . 17510 1 1312 . 1 1 119 119 VAL CG1 C 13 21.492 0.40 . 1 . . . . . 116 VAL CG1 . 17510 1 1313 . 1 1 119 119 VAL CG2 C 13 22.225 0.40 . 1 . . . . . 116 VAL CG2 . 17510 1 1314 . 1 1 119 119 VAL N N 15 119.573 0.40 . 1 . . . . . 116 VAL N . 17510 1 1315 . 1 1 120 120 TYR H H 1 8.204 0.02 . 1 . . . . . 117 TYR H . 17510 1 1316 . 1 1 120 120 TYR HA H 1 3.925 0.02 . 1 . . . . . 117 TYR HA . 17510 1 1317 . 1 1 120 120 TYR HB2 H 1 3.262 0.02 . 2 . . . . . 117 TYR HB2 . 17510 1 1318 . 1 1 120 120 TYR HB3 H 1 3.373 0.02 . 2 . . . . . 117 TYR HB3 . 17510 1 1319 . 1 1 120 120 TYR HD1 H 1 7.104 0.02 . 3 . . . . . 117 TYR HD . 17510 1 1320 . 1 1 120 120 TYR HD2 H 1 7.104 0.02 . 3 . . . . . 117 TYR HD . 17510 1 1321 . 1 1 120 120 TYR HE1 H 1 6.595 0.02 . 3 . . . . . 117 TYR HE . 17510 1 1322 . 1 1 120 120 TYR HE2 H 1 6.595 0.02 . 3 . . . . . 117 TYR HE . 17510 1 1323 . 1 1 120 120 TYR C C 13 176.621 0.40 . 1 . . . . . 117 TYR C . 17510 1 1324 . 1 1 120 120 TYR CA C 13 62.767 0.40 . 1 . . . . . 117 TYR CA . 17510 1 1325 . 1 1 120 120 TYR CB C 13 37.245 0.40 . 1 . . . . . 117 TYR CB . 17510 1 1326 . 1 1 120 120 TYR CD1 C 13 134.069 0.40 . 3 . . . . . 117 TYR CD1 . 17510 1 1327 . 1 1 120 120 TYR N N 15 122.725 0.40 . 1 . . . . . 117 TYR N . 17510 1 1328 . 1 1 121 121 ASP H H 1 8.810 0.02 . 1 . . . . . 118 ASP H . 17510 1 1329 . 1 1 121 121 ASP HA H 1 4.249 0.02 . 1 . . . . . 118 ASP HA . 17510 1 1330 . 1 1 121 121 ASP HB2 H 1 2.813 0.02 . 2 . . . . . 118 ASP HB2 . 17510 1 1331 . 1 1 121 121 ASP HB3 H 1 2.647 0.02 . 2 . . . . . 118 ASP HB3 . 17510 1 1332 . 1 1 121 121 ASP C C 13 179.503 0.40 . 1 . . . . . 118 ASP C . 17510 1 1333 . 1 1 121 121 ASP CA C 13 57.401 0.40 . 1 . . . . . 118 ASP CA . 17510 1 1334 . 1 1 121 121 ASP CB C 13 40.198 0.40 . 1 . . . . . 118 ASP CB . 17510 1 1335 . 1 1 121 121 ASP N N 15 117.268 0.40 . 1 . . . . . 118 ASP N . 17510 1 1336 . 1 1 122 122 LEU H H 1 7.552 0.02 . 1 . . . . . 119 LEU H . 17510 1 1337 . 1 1 122 122 LEU HA H 1 4.236 0.02 . 1 . . . . . 119 LEU HA . 17510 1 1338 . 1 1 122 122 LEU HB2 H 1 1.389 0.02 . 2 . . . . . 119 LEU HB2 . 17510 1 1339 . 1 1 122 122 LEU HB3 H 1 2.204 0.02 . 2 . . . . . 119 LEU HB3 . 17510 1 1340 . 1 1 122 122 LEU HG H 1 2.022 0.02 . 1 . . . . . 119 LEU HG . 17510 1 1341 . 1 1 122 122 LEU HD11 H 1 0.995 0.02 . 1 . . . . . 119 LEU HD1 . 17510 1 1342 . 1 1 122 122 LEU HD12 H 1 0.995 0.02 . 1 . . . . . 119 LEU HD1 . 17510 1 1343 . 1 1 122 122 LEU HD13 H 1 0.995 0.02 . 1 . . . . . 119 LEU HD1 . 17510 1 1344 . 1 1 122 122 LEU HD21 H 1 1.021 0.02 . 1 . . . . . 119 LEU HD2 . 17510 1 1345 . 1 1 122 122 LEU HD22 H 1 1.021 0.02 . 1 . . . . . 119 LEU HD2 . 17510 1 1346 . 1 1 122 122 LEU HD23 H 1 1.021 0.02 . 1 . . . . . 119 LEU HD2 . 17510 1 1347 . 1 1 122 122 LEU C C 13 180.236 0.40 . 1 . . . . . 119 LEU C . 17510 1 1348 . 1 1 122 122 LEU CA C 13 58.310 0.40 . 1 . . . . . 119 LEU CA . 17510 1 1349 . 1 1 122 122 LEU CB C 13 42.559 0.40 . 1 . . . . . 119 LEU CB . 17510 1 1350 . 1 1 122 122 LEU CG C 13 27.313 0.40 . 1 . . . . . 119 LEU CG . 17510 1 1351 . 1 1 122 122 LEU CD1 C 13 26.086 0.40 . 1 . . . . . 119 LEU CD1 . 17510 1 1352 . 1 1 122 122 LEU CD2 C 13 23.219 0.40 . 1 . . . . . 119 LEU CD2 . 17510 1 1353 . 1 1 122 122 LEU N N 15 120.658 0.40 . 1 . . . . . 119 LEU N . 17510 1 1354 . 1 1 123 123 VAL H H 1 8.596 0.02 . 1 . . . . . 120 VAL H . 17510 1 1355 . 1 1 123 123 VAL HA H 1 3.452 0.02 . 1 . . . . . 120 VAL HA . 17510 1 1356 . 1 1 123 123 VAL HB H 1 2.001 0.02 . 1 . . . . . 120 VAL HB . 17510 1 1357 . 1 1 123 123 VAL HG11 H 1 0.516 0.02 . 1 . . . . . 120 VAL HG1 . 17510 1 1358 . 1 1 123 123 VAL HG12 H 1 0.516 0.02 . 1 . . . . . 120 VAL HG1 . 17510 1 1359 . 1 1 123 123 VAL HG13 H 1 0.516 0.02 . 1 . . . . . 120 VAL HG1 . 17510 1 1360 . 1 1 123 123 VAL HG21 H 1 0.294 0.02 . 1 . . . . . 120 VAL HG2 . 17510 1 1361 . 1 1 123 123 VAL HG22 H 1 0.294 0.02 . 1 . . . . . 120 VAL HG2 . 17510 1 1362 . 1 1 123 123 VAL HG23 H 1 0.294 0.02 . 1 . . . . . 120 VAL HG2 . 17510 1 1363 . 1 1 123 123 VAL C C 13 177.630 0.40 . 1 . . . . . 120 VAL C . 17510 1 1364 . 1 1 123 123 VAL CA C 13 67.387 0.40 . 1 . . . . . 120 VAL CA . 17510 1 1365 . 1 1 123 123 VAL CB C 13 31.254 0.40 . 1 . . . . . 120 VAL CB . 17510 1 1366 . 1 1 123 123 VAL CG1 C 13 21.416 0.40 . 1 . . . . . 120 VAL CG1 . 17510 1 1367 . 1 1 123 123 VAL CG2 C 13 23.168 0.40 . 1 . . . . . 120 VAL CG2 . 17510 1 1368 . 1 1 123 123 VAL N N 15 123.233 0.40 . 1 . . . . . 120 VAL N . 17510 1 1369 . 1 1 124 124 VAL H H 1 8.639 0.02 . 1 . . . . . 121 VAL H . 17510 1 1370 . 1 1 124 124 VAL HA H 1 3.261 0.02 . 1 . . . . . 121 VAL HA . 17510 1 1371 . 1 1 124 124 VAL HB H 1 1.841 0.02 . 1 . . . . . 121 VAL HB . 17510 1 1372 . 1 1 124 124 VAL HG11 H 1 0.761 0.02 . 1 . . . . . 121 VAL HG1 . 17510 1 1373 . 1 1 124 124 VAL HG12 H 1 0.761 0.02 . 1 . . . . . 121 VAL HG1 . 17510 1 1374 . 1 1 124 124 VAL HG13 H 1 0.761 0.02 . 1 . . . . . 121 VAL HG1 . 17510 1 1375 . 1 1 124 124 VAL HG21 H 1 0.312 0.02 . 1 . . . . . 121 VAL HG2 . 17510 1 1376 . 1 1 124 124 VAL HG22 H 1 0.312 0.02 . 1 . . . . . 121 VAL HG2 . 17510 1 1377 . 1 1 124 124 VAL HG23 H 1 0.312 0.02 . 1 . . . . . 121 VAL HG2 . 17510 1 1378 . 1 1 124 124 VAL C C 13 177.940 0.40 . 1 . . . . . 121 VAL C . 17510 1 1379 . 1 1 124 124 VAL CA C 13 67.508 0.40 . 1 . . . . . 121 VAL CA . 17510 1 1380 . 1 1 124 124 VAL CB C 13 31.547 0.40 . 1 . . . . . 121 VAL CB . 17510 1 1381 . 1 1 124 124 VAL CG1 C 13 21.070 0.40 . 1 . . . . . 121 VAL CG1 . 17510 1 1382 . 1 1 124 124 VAL CG2 C 13 21.672 0.40 . 1 . . . . . 121 VAL CG2 . 17510 1 1383 . 1 1 124 124 VAL N N 15 120.236 0.40 . 1 . . . . . 121 VAL N . 17510 1 1384 . 1 1 125 125 MET H H 1 8.230 0.02 . 1 . . . . . 122 MET H . 17510 1 1385 . 1 1 125 125 MET HA H 1 4.188 0.02 . 1 . . . . . 122 MET HA . 17510 1 1386 . 1 1 125 125 MET HB2 H 1 2.312 0.02 . 2 . . . . . 122 MET HB2 . 17510 1 1387 . 1 1 125 125 MET HB3 H 1 2.200 0.02 . 2 . . . . . 122 MET HB3 . 17510 1 1388 . 1 1 125 125 MET HG2 H 1 2.785 0.02 . 2 . . . . . 122 MET HG2 . 17510 1 1389 . 1 1 125 125 MET HG3 H 1 2.666 0.02 . 2 . . . . . 122 MET HG3 . 17510 1 1390 . 1 1 125 125 MET HE1 H 1 2.183 0.02 . 1 . . . . . 122 MET HE . 17510 1 1391 . 1 1 125 125 MET HE2 H 1 2.183 0.02 . 1 . . . . . 122 MET HE . 17510 1 1392 . 1 1 125 125 MET HE3 H 1 2.183 0.02 . 1 . . . . . 122 MET HE . 17510 1 1393 . 1 1 125 125 MET C C 13 179.340 0.40 . 1 . . . . . 122 MET C . 17510 1 1394 . 1 1 125 125 MET CA C 13 59.090 0.40 . 1 . . . . . 122 MET CA . 17510 1 1395 . 1 1 125 125 MET CB C 13 33.366 0.40 . 1 . . . . . 122 MET CB . 17510 1 1396 . 1 1 125 125 MET CG C 13 32.123 0.40 . 1 . . . . . 122 MET CG . 17510 1 1397 . 1 1 125 125 MET CE C 13 16.998 0.40 . 1 . . . . . 122 MET CE . 17510 1 1398 . 1 1 125 125 MET N N 15 117.240 0.40 . 1 . . . . . 122 MET N . 17510 1 1399 . 1 1 126 126 HIS H H 1 8.211 0.02 . 1 . . . . . 123 HIS H . 17510 1 1400 . 1 1 126 126 HIS HA H 1 4.421 0.02 . 1 . . . . . 123 HIS HA . 17510 1 1401 . 1 1 126 126 HIS HB2 H 1 3.349 0.02 . 2 . . . . . 123 HIS HB2 . 17510 1 1402 . 1 1 126 126 HIS HB3 H 1 3.430 0.02 . 2 . . . . . 123 HIS HB3 . 17510 1 1403 . 1 1 126 126 HIS HE1 H 1 7.806 0.02 . 1 . . . . . 123 HIS HE1 . 17510 1 1404 . 1 1 126 126 HIS C C 13 178.966 0.40 . 1 . . . . . 123 HIS C . 17510 1 1405 . 1 1 126 126 HIS CA C 13 60.373 0.40 . 1 . . . . . 123 HIS CA . 17510 1 1406 . 1 1 126 126 HIS CB C 13 31.545 0.40 . 1 . . . . . 123 HIS CB . 17510 1 1407 . 1 1 126 126 HIS N N 15 119.753 0.40 . 1 . . . . . 123 HIS N . 17510 1 1408 . 1 1 127 127 MET H H 1 8.598 0.02 . 1 . . . . . 124 MET H . 17510 1 1409 . 1 1 127 127 MET HA H 1 4.158 0.02 . 1 . . . . . 124 MET HA . 17510 1 1410 . 1 1 127 127 MET HG2 H 1 2.723 0.02 . 2 . . . . . 124 MET HG . 17510 1 1411 . 1 1 127 127 MET HG3 H 1 2.723 0.02 . 2 . . . . . 124 MET HG . 17510 1 1412 . 1 1 127 127 MET HE1 H 1 1.453 0.02 . 1 . . . . . 124 MET HE . 17510 1 1413 . 1 1 127 127 MET HE2 H 1 1.453 0.02 . 1 . . . . . 124 MET HE . 17510 1 1414 . 1 1 127 127 MET HE3 H 1 1.453 0.02 . 1 . . . . . 124 MET HE . 17510 1 1415 . 1 1 127 127 MET C C 13 179.747 0.40 . 1 . . . . . 124 MET C . 17510 1 1416 . 1 1 127 127 MET CA C 13 57.837 0.40 . 1 . . . . . 124 MET CA . 17510 1 1417 . 1 1 127 127 MET CB C 13 31.698 0.40 . 1 . . . . . 124 MET CB . 17510 1 1418 . 1 1 127 127 MET CG C 13 32.650 0.40 . 1 . . . . . 124 MET CG . 17510 1 1419 . 1 1 127 127 MET CE C 13 16.573 0.40 . 1 . . . . . 124 MET CE . 17510 1 1420 . 1 1 127 127 MET N N 15 118.318 0.40 . 1 . . . . . 124 MET N . 17510 1 1421 . 1 1 128 128 GLU H H 1 8.782 0.02 . 1 . . . . . 125 GLU H . 17510 1 1422 . 1 1 128 128 GLU HA H 1 4.189 0.02 . 1 . . . . . 125 GLU HA . 17510 1 1423 . 1 1 128 128 GLU HB2 H 1 2.177 0.02 . 2 . . . . . 125 GLU HB2 . 17510 1 1424 . 1 1 128 128 GLU HB3 H 1 2.075 0.02 . 2 . . . . . 125 GLU HB3 . 17510 1 1425 . 1 1 128 128 GLU HG2 H 1 2.570 0.02 . 2 . . . . . 125 GLU HG2 . 17510 1 1426 . 1 1 128 128 GLU HG3 H 1 2.253 0.02 . 2 . . . . . 125 GLU HG3 . 17510 1 1427 . 1 1 128 128 GLU C C 13 177.696 0.40 . 1 . . . . . 125 GLU C . 17510 1 1428 . 1 1 128 128 GLU CA C 13 58.789 0.40 . 1 . . . . . 125 GLU CA . 17510 1 1429 . 1 1 128 128 GLU CB C 13 29.737 0.40 . 1 . . . . . 125 GLU CB . 17510 1 1430 . 1 1 128 128 GLU CG C 13 37.597 0.40 . 1 . . . . . 125 GLU CG . 17510 1 1431 . 1 1 128 128 GLU N N 15 118.863 0.40 . 1 . . . . . 125 GLU N . 17510 1 1432 . 1 1 129 129 SER H H 1 7.590 0.02 . 1 . . . . . 126 SER H . 17510 1 1433 . 1 1 129 129 SER HA H 1 4.425 0.02 . 1 . . . . . 126 SER HA . 17510 1 1434 . 1 1 129 129 SER HB2 H 1 4.055 0.02 . 2 . . . . . 126 SER HB . 17510 1 1435 . 1 1 129 129 SER HB3 H 1 4.055 0.02 . 2 . . . . . 126 SER HB . 17510 1 1436 . 1 1 129 129 SER C C 13 173.934 0.40 . 1 . . . . . 126 SER C . 17510 1 1437 . 1 1 129 129 SER CA C 13 59.859 0.40 . 1 . . . . . 126 SER CA . 17510 1 1438 . 1 1 129 129 SER CB C 13 63.866 0.40 . 1 . . . . . 126 SER CB . 17510 1 1439 . 1 1 129 129 SER N N 15 113.880 0.40 . 1 . . . . . 126 SER N . 17510 1 1440 . 1 1 130 130 MET H H 1 7.265 0.02 . 1 . . . . . 127 MET H . 17510 1 1441 . 1 1 130 130 MET HA H 1 4.516 0.02 . 1 . . . . . 127 MET HA . 17510 1 1442 . 1 1 130 130 MET HB2 H 1 2.163 0.02 . 2 . . . . . 127 MET HB2 . 17510 1 1443 . 1 1 130 130 MET HB3 H 1 2.062 0.02 . 2 . . . . . 127 MET HB3 . 17510 1 1444 . 1 1 130 130 MET HG2 H 1 2.559 0.02 . 2 . . . . . 127 MET HG2 . 17510 1 1445 . 1 1 130 130 MET HG3 H 1 2.476 0.02 . 2 . . . . . 127 MET HG3 . 17510 1 1446 . 1 1 130 130 MET HE1 H 1 2.073 0.02 . 1 . . . . . 127 MET HE . 17510 1 1447 . 1 1 130 130 MET HE2 H 1 2.073 0.02 . 1 . . . . . 127 MET HE . 17510 1 1448 . 1 1 130 130 MET HE3 H 1 2.073 0.02 . 1 . . . . . 127 MET HE . 17510 1 1449 . 1 1 130 130 MET C C 13 175.318 0.40 . 1 . . . . . 127 MET C . 17510 1 1450 . 1 1 130 130 MET CA C 13 54.861 0.40 . 1 . . . . . 127 MET CA . 17510 1 1451 . 1 1 130 130 MET CB C 13 34.069 0.40 . 1 . . . . . 127 MET CB . 17510 1 1452 . 1 1 130 130 MET CG C 13 31.675 0.40 . 1 . . . . . 127 MET CG . 17510 1 1453 . 1 1 130 130 MET CE C 13 17.481 0.40 . 1 . . . . . 127 MET CE . 17510 1 1454 . 1 1 130 130 MET N N 15 122.239 0.40 . 1 . . . . . 127 MET N . 17510 1 1455 . 1 1 131 131 GLU H H 1 8.465 0.02 . 1 . . . . . 128 GLU H . 17510 1 1456 . 1 1 131 131 GLU HA H 1 4.289 0.02 . 1 . . . . . 128 GLU HA . 17510 1 1457 . 1 1 131 131 GLU HB2 H 1 2.011 0.02 . 2 . . . . . 128 GLU HB . 17510 1 1458 . 1 1 131 131 GLU HB3 H 1 2.011 0.02 . 2 . . . . . 128 GLU HB . 17510 1 1459 . 1 1 131 131 GLU HG2 H 1 2.266 0.02 . 2 . . . . . 128 GLU HG2 . 17510 1 1460 . 1 1 131 131 GLU HG3 H 1 2.349 0.02 . 2 . . . . . 128 GLU HG3 . 17510 1 1461 . 1 1 131 131 GLU C C 13 176.523 0.40 . 1 . . . . . 128 GLU C . 17510 1 1462 . 1 1 131 131 GLU CA C 13 56.396 0.40 . 1 . . . . . 128 GLU CA . 17510 1 1463 . 1 1 131 131 GLU CB C 13 30.124 0.40 . 1 . . . . . 128 GLU CB . 17510 1 1464 . 1 1 131 131 GLU CG C 13 36.419 0.40 . 1 . . . . . 128 GLU CG . 17510 1 1465 . 1 1 131 131 GLU N N 15 122.550 0.40 . 1 . . . . . 128 GLU N . 17510 1 1466 . 1 1 132 132 SER H H 1 8.641 0.02 . 1 . . . . . 129 SER H . 17510 1 1467 . 1 1 132 132 SER HA H 1 4.445 0.02 . 1 . . . . . 129 SER HA . 17510 1 1468 . 1 1 132 132 SER HB2 H 1 3.822 0.02 . 2 . . . . . 129 SER HB . 17510 1 1469 . 1 1 132 132 SER HB3 H 1 3.822 0.02 . 2 . . . . . 129 SER HB . 17510 1 1470 . 1 1 132 132 SER C C 13 174.569 0.40 . 1 . . . . . 129 SER C . 17510 1 1471 . 1 1 132 132 SER CA C 13 58.713 0.40 . 1 . . . . . 129 SER CA . 17510 1 1472 . 1 1 132 132 SER CB C 13 63.171 0.40 . 1 . . . . . 129 SER CB . 17510 1 1473 . 1 1 132 132 SER N N 15 121.030 0.40 . 1 . . . . . 129 SER N . 17510 1 1474 . 1 1 133 133 VAL H H 1 9.496 0.02 . 1 . . . . . 130 VAL H . 17510 1 1475 . 1 1 133 133 VAL HA H 1 4.335 0.02 . 1 . . . . . 130 VAL HA . 17510 1 1476 . 1 1 133 133 VAL HB H 1 2.138 0.02 . 1 . . . . . 130 VAL HB . 17510 1 1477 . 1 1 133 133 VAL HG11 H 1 0.981 0.02 . 1 . . . . . 130 VAL HG1 . 17510 1 1478 . 1 1 133 133 VAL HG12 H 1 0.981 0.02 . 1 . . . . . 130 VAL HG1 . 17510 1 1479 . 1 1 133 133 VAL HG13 H 1 0.981 0.02 . 1 . . . . . 130 VAL HG1 . 17510 1 1480 . 1 1 133 133 VAL HG21 H 1 1.006 0.02 . 1 . . . . . 130 VAL HG2 . 17510 1 1481 . 1 1 133 133 VAL HG22 H 1 1.006 0.02 . 1 . . . . . 130 VAL HG2 . 17510 1 1482 . 1 1 133 133 VAL HG23 H 1 1.006 0.02 . 1 . . . . . 130 VAL HG2 . 17510 1 1483 . 1 1 133 133 VAL C C 13 176.393 0.40 . 1 . . . . . 130 VAL C . 17510 1 1484 . 1 1 133 133 VAL CA C 13 63.154 0.40 . 1 . . . . . 130 VAL CA . 17510 1 1485 . 1 1 133 133 VAL CB C 13 34.433 0.40 . 1 . . . . . 130 VAL CB . 17510 1 1486 . 1 1 133 133 VAL CG1 C 13 21.452 0.40 . 1 . . . . . 130 VAL CG1 . 17510 1 1487 . 1 1 133 133 VAL CG2 C 13 20.390 0.40 . 1 . . . . . 130 VAL CG2 . 17510 1 1488 . 1 1 133 133 VAL N N 15 124.403 0.40 . 1 . . . . . 130 VAL N . 17510 1 1489 . 1 1 134 134 ASP H H 1 9.225 0.02 . 1 . . . . . 131 ASP H . 17510 1 1490 . 1 1 134 134 ASP HA H 1 4.843 0.02 . 1 . . . . . 131 ASP HA . 17510 1 1491 . 1 1 134 134 ASP HB2 H 1 2.454 0.02 . 2 . . . . . 131 ASP HB2 . 17510 1 1492 . 1 1 134 134 ASP HB3 H 1 2.770 0.02 . 2 . . . . . 131 ASP HB3 . 17510 1 1493 . 1 1 134 134 ASP C C 13 176.670 0.40 . 1 . . . . . 131 ASP C . 17510 1 1494 . 1 1 134 134 ASP CA C 13 55.472 0.40 . 1 . . . . . 131 ASP CA . 17510 1 1495 . 1 1 134 134 ASP CB C 13 42.293 0.40 . 1 . . . . . 131 ASP CB . 17510 1 1496 . 1 1 134 134 ASP N N 15 122.875 0.40 . 1 . . . . . 131 ASP N . 17510 1 1497 . 1 1 135 135 ASN H H 1 9.125 0.02 . 1 . . . . . 132 ASN H . 17510 1 1498 . 1 1 135 135 ASN HA H 1 4.261 0.02 . 1 . . . . . 132 ASN HA . 17510 1 1499 . 1 1 135 135 ASN HB2 H 1 3.045 0.02 . 2 . . . . . 132 ASN HB2 . 17510 1 1500 . 1 1 135 135 ASN HB3 H 1 2.764 0.02 . 2 . . . . . 132 ASN HB3 . 17510 1 1501 . 1 1 135 135 ASN C C 13 173.885 0.40 . 1 . . . . . 132 ASN C . 17510 1 1502 . 1 1 135 135 ASN CA C 13 54.373 0.40 . 1 . . . . . 132 ASN CA . 17510 1 1503 . 1 1 135 135 ASN CB C 13 37.500 0.40 . 1 . . . . . 132 ASN CB . 17510 1 1504 . 1 1 135 135 ASN N N 15 120.170 0.40 . 1 . . . . . 132 ASN N . 17510 1 1505 . 1 1 136 136 ARG H H 1 7.912 0.02 . 1 . . . . . 133 ARG H . 17510 1 1506 . 1 1 136 136 ARG HA H 1 5.174 0.02 . 1 . . . . . 133 ARG HA . 17510 1 1507 . 1 1 136 136 ARG HB2 H 1 1.844 0.02 . 2 . . . . . 133 ARG HB2 . 17510 1 1508 . 1 1 136 136 ARG HB3 H 1 1.982 0.02 . 2 . . . . . 133 ARG HB3 . 17510 1 1509 . 1 1 136 136 ARG HG2 H 1 1.767 0.02 . 2 . . . . . 133 ARG HG2 . 17510 1 1510 . 1 1 136 136 ARG HG3 H 1 1.871 0.02 . 2 . . . . . 133 ARG HG3 . 17510 1 1511 . 1 1 136 136 ARG HD2 H 1 3.250 0.02 . 2 . . . . . 133 ARG HD2 . 17510 1 1512 . 1 1 136 136 ARG HD3 H 1 3.096 0.02 . 2 . . . . . 133 ARG HD3 . 17510 1 1513 . 1 1 136 136 ARG C C 13 173.348 0.40 . 1 . . . . . 133 ARG C . 17510 1 1514 . 1 1 136 136 ARG CA C 13 52.856 0.40 . 1 . . . . . 133 ARG CA . 17510 1 1515 . 1 1 136 136 ARG CB C 13 33.098 0.40 . 1 . . . . . 133 ARG CB . 17510 1 1516 . 1 1 136 136 ARG CG C 13 26.994 0.40 . 1 . . . . . 133 ARG CG . 17510 1 1517 . 1 1 136 136 ARG CD C 13 44.033 0.40 . 1 . . . . . 133 ARG CD . 17510 1 1518 . 1 1 136 136 ARG N N 15 121.512 0.40 . 1 . . . . . 133 ARG N . 17510 1 1519 . 1 1 137 137 PRO HA H 1 4.551 0.02 . 1 . . . . . 134 PRO HA . 17510 1 1520 . 1 1 137 137 PRO HB2 H 1 1.554 0.02 . 2 . . . . . 134 PRO HB2 . 17510 1 1521 . 1 1 137 137 PRO HB3 H 1 1.851 0.02 . 2 . . . . . 134 PRO HB3 . 17510 1 1522 . 1 1 137 137 PRO HG2 H 1 2.243 0.02 . 2 . . . . . 134 PRO HG2 . 17510 1 1523 . 1 1 137 137 PRO HG3 H 1 2.333 0.02 . 2 . . . . . 134 PRO HG3 . 17510 1 1524 . 1 1 137 137 PRO HD2 H 1 4.057 0.02 . 2 . . . . . 134 PRO HD2 . 17510 1 1525 . 1 1 137 137 PRO HD3 H 1 4.210 0.02 . 2 . . . . . 134 PRO HD3 . 17510 1 1526 . 1 1 137 137 PRO C C 13 176.339 0.40 . 1 . . . . . 134 PRO C . 17510 1 1527 . 1 1 137 137 PRO CA C 13 62.321 0.40 . 1 . . . . . 134 PRO CA . 17510 1 1528 . 1 1 137 137 PRO CB C 13 32.917 0.40 . 1 . . . . . 134 PRO CB . 17510 1 1529 . 1 1 137 137 PRO CG C 13 27.493 0.40 . 1 . . . . . 134 PRO CG . 17510 1 1530 . 1 1 137 137 PRO CD C 13 51.481 0.40 . 1 . . . . . 134 PRO CD . 17510 1 1531 . 1 1 138 138 VAL H H 1 8.825 0.02 . 1 . . . . . 135 VAL H . 17510 1 1532 . 1 1 138 138 VAL HA H 1 4.576 0.02 . 1 . . . . . 135 VAL HA . 17510 1 1533 . 1 1 138 138 VAL HB H 1 2.339 0.02 . 1 . . . . . 135 VAL HB . 17510 1 1534 . 1 1 138 138 VAL HG11 H 1 0.324 0.02 . 1 . . . . . 135 VAL HG1 . 17510 1 1535 . 1 1 138 138 VAL HG12 H 1 0.324 0.02 . 1 . . . . . 135 VAL HG1 . 17510 1 1536 . 1 1 138 138 VAL HG13 H 1 0.324 0.02 . 1 . . . . . 135 VAL HG1 . 17510 1 1537 . 1 1 138 138 VAL HG21 H 1 0.784 0.02 . 1 . . . . . 135 VAL HG2 . 17510 1 1538 . 1 1 138 138 VAL HG22 H 1 0.784 0.02 . 1 . . . . . 135 VAL HG2 . 17510 1 1539 . 1 1 138 138 VAL HG23 H 1 0.784 0.02 . 1 . . . . . 135 VAL HG2 . 17510 1 1540 . 1 1 138 138 VAL C C 13 172.697 0.40 . 1 . . . . . 135 VAL C . 17510 1 1541 . 1 1 138 138 VAL CA C 13 59.204 0.40 . 1 . . . . . 135 VAL CA . 17510 1 1542 . 1 1 138 138 VAL CB C 13 34.256 0.40 . 1 . . . . . 135 VAL CB . 17510 1 1543 . 1 1 138 138 VAL CG1 C 13 18.968 0.40 . 1 . . . . . 135 VAL CG1 . 17510 1 1544 . 1 1 138 138 VAL CG2 C 13 22.778 0.40 . 1 . . . . . 135 VAL CG2 . 17510 1 1545 . 1 1 138 138 VAL N N 15 122.324 0.40 . 1 . . . . . 135 VAL N . 17510 1 1546 . 1 1 139 139 HIS H H 1 7.594 0.02 . 1 . . . . . 136 HIS H . 17510 1 1547 . 1 1 139 139 HIS HA H 1 4.869 0.02 . 1 . . . . . 136 HIS HA . 17510 1 1548 . 1 1 139 139 HIS HB2 H 1 3.094 0.02 . 2 . . . . . 136 HIS HB2 . 17510 1 1549 . 1 1 139 139 HIS HB3 H 1 2.842 0.02 . 2 . . . . . 136 HIS HB3 . 17510 1 1550 . 1 1 139 139 HIS HD2 H 1 6.983 0.02 . 1 . . . . . 136 HIS HD2 . 17510 1 1551 . 1 1 139 139 HIS HE1 H 1 8.073 0.02 . 1 . . . . . 136 HIS HE1 . 17510 1 1552 . 1 1 139 139 HIS C C 13 173.804 0.40 . 1 . . . . . 136 HIS C . 17510 1 1553 . 1 1 139 139 HIS CA C 13 56.306 0.40 . 1 . . . . . 136 HIS CA . 17510 1 1554 . 1 1 139 139 HIS CB C 13 33.548 0.40 . 1 . . . . . 136 HIS CB . 17510 1 1555 . 1 1 139 139 HIS N N 15 125.775 0.40 . 1 . . . . . 136 HIS N . 17510 1 1556 . 1 1 140 140 VAL H H 1 9.304 0.02 . 1 . . . . . 137 VAL H . 17510 1 1557 . 1 1 140 140 VAL HA H 1 5.260 0.02 . 1 . . . . . 137 VAL HA . 17510 1 1558 . 1 1 140 140 VAL HB H 1 1.939 0.02 . 1 . . . . . 137 VAL HB . 17510 1 1559 . 1 1 140 140 VAL HG11 H 1 0.776 0.02 . 1 . . . . . 137 VAL HG1 . 17510 1 1560 . 1 1 140 140 VAL HG12 H 1 0.776 0.02 . 1 . . . . . 137 VAL HG1 . 17510 1 1561 . 1 1 140 140 VAL HG13 H 1 0.776 0.02 . 1 . . . . . 137 VAL HG1 . 17510 1 1562 . 1 1 140 140 VAL HG21 H 1 0.769 0.02 . 1 . . . . . 137 VAL HG2 . 17510 1 1563 . 1 1 140 140 VAL HG22 H 1 0.769 0.02 . 1 . . . . . 137 VAL HG2 . 17510 1 1564 . 1 1 140 140 VAL HG23 H 1 0.769 0.02 . 1 . . . . . 137 VAL HG2 . 17510 1 1565 . 1 1 140 140 VAL C C 13 175.269 0.40 . 1 . . . . . 137 VAL C . 17510 1 1566 . 1 1 140 140 VAL CA C 13 61.045 0.40 . 1 . . . . . 137 VAL CA . 17510 1 1567 . 1 1 140 140 VAL CB C 13 32.551 0.40 . 1 . . . . . 137 VAL CB . 17510 1 1568 . 1 1 140 140 VAL CG1 C 13 22.122 0.40 . 1 . . . . . 137 VAL CG1 . 17510 1 1569 . 1 1 140 140 VAL CG2 C 13 21.837 0.40 . 1 . . . . . 137 VAL CG2 . 17510 1 1570 . 1 1 140 140 VAL N N 15 125.942 0.40 . 1 . . . . . 137 VAL N . 17510 1 1571 . 1 1 141 141 LEU H H 1 9.545 0.02 . 1 . . . . . 138 LEU H . 17510 1 1572 . 1 1 141 141 LEU HA H 1 5.948 0.02 . 1 . . . . . 138 LEU HA . 17510 1 1573 . 1 1 141 141 LEU HB2 H 1 1.636 0.02 . 2 . . . . . 138 LEU HB2 . 17510 1 1574 . 1 1 141 141 LEU HB3 H 1 1.419 0.02 . 2 . . . . . 138 LEU HB3 . 17510 1 1575 . 1 1 141 141 LEU HG H 1 1.768 0.02 . 1 . . . . . 138 LEU HG . 17510 1 1576 . 1 1 141 141 LEU HD11 H 1 0.863 0.02 . 1 . . . . . 138 LEU HD1 . 17510 1 1577 . 1 1 141 141 LEU HD12 H 1 0.863 0.02 . 1 . . . . . 138 LEU HD1 . 17510 1 1578 . 1 1 141 141 LEU HD13 H 1 0.863 0.02 . 1 . . . . . 138 LEU HD1 . 17510 1 1579 . 1 1 141 141 LEU HD21 H 1 0.854 0.02 . 1 . . . . . 138 LEU HD2 . 17510 1 1580 . 1 1 141 141 LEU HD22 H 1 0.854 0.02 . 1 . . . . . 138 LEU HD2 . 17510 1 1581 . 1 1 141 141 LEU HD23 H 1 0.854 0.02 . 1 . . . . . 138 LEU HD2 . 17510 1 1582 . 1 1 141 141 LEU C C 13 174.423 0.40 . 1 . . . . . 138 LEU C . 17510 1 1583 . 1 1 141 141 LEU CA C 13 53.297 0.40 . 1 . . . . . 138 LEU CA . 17510 1 1584 . 1 1 141 141 LEU CB C 13 46.512 0.40 . 1 . . . . . 138 LEU CB . 17510 1 1585 . 1 1 141 141 LEU CG C 13 28.141 0.40 . 1 . . . . . 138 LEU CG . 17510 1 1586 . 1 1 141 141 LEU CD1 C 13 27.004 0.40 . 1 . . . . . 138 LEU CD1 . 17510 1 1587 . 1 1 141 141 LEU CD2 C 13 26.601 0.40 . 1 . . . . . 138 LEU CD2 . 17510 1 1588 . 1 1 141 141 LEU N N 15 127.984 0.40 . 1 . . . . . 138 LEU N . 17510 1 1589 . 1 1 142 142 ASN H H 1 8.734 0.02 . 1 . . . . . 139 ASN H . 17510 1 1590 . 1 1 142 142 ASN HA H 1 5.472 0.02 . 1 . . . . . 139 ASN HA . 17510 1 1591 . 1 1 142 142 ASN HB2 H 1 1.975 0.02 . 2 . . . . . 139 ASN HB2 . 17510 1 1592 . 1 1 142 142 ASN HB3 H 1 2.146 0.02 . 2 . . . . . 139 ASN HB3 . 17510 1 1593 . 1 1 142 142 ASN C C 13 173.413 0.40 . 1 . . . . . 139 ASN C . 17510 1 1594 . 1 1 142 142 ASN CA C 13 52.643 0.40 . 1 . . . . . 139 ASN CA . 17510 1 1595 . 1 1 142 142 ASN CB C 13 42.658 0.40 . 1 . . . . . 139 ASN CB . 17510 1 1596 . 1 1 142 142 ASN N N 15 119.190 0.40 . 1 . . . . . 139 ASN N . 17510 1 1597 . 1 1 143 143 VAL H H 1 8.452 0.02 . 1 . . . . . 140 VAL H . 17510 1 1598 . 1 1 143 143 VAL HA H 1 4.098 0.02 . 1 . . . . . 140 VAL HA . 17510 1 1599 . 1 1 143 143 VAL HB H 1 1.842 0.02 . 1 . . . . . 140 VAL HB . 17510 1 1600 . 1 1 143 143 VAL HG11 H 1 0.776 0.02 . 1 . . . . . 140 VAL HG1 . 17510 1 1601 . 1 1 143 143 VAL HG12 H 1 0.776 0.02 . 1 . . . . . 140 VAL HG1 . 17510 1 1602 . 1 1 143 143 VAL HG13 H 1 0.776 0.02 . 1 . . . . . 140 VAL HG1 . 17510 1 1603 . 1 1 143 143 VAL HG21 H 1 0.797 0.02 . 1 . . . . . 140 VAL HG2 . 17510 1 1604 . 1 1 143 143 VAL HG22 H 1 0.797 0.02 . 1 . . . . . 140 VAL HG2 . 17510 1 1605 . 1 1 143 143 VAL HG23 H 1 0.797 0.02 . 1 . . . . . 140 VAL HG2 . 17510 1 1606 . 1 1 143 143 VAL C C 13 172.876 0.40 . 1 . . . . . 140 VAL C . 17510 1 1607 . 1 1 143 143 VAL CA C 13 60.286 0.40 . 1 . . . . . 140 VAL CA . 17510 1 1608 . 1 1 143 143 VAL CB C 13 33.757 0.40 . 1 . . . . . 140 VAL CB . 17510 1 1609 . 1 1 143 143 VAL CG1 C 13 20.615 0.40 . 1 . . . . . 140 VAL CG1 . 17510 1 1610 . 1 1 143 143 VAL CG2 C 13 21.420 0.40 . 1 . . . . . 140 VAL CG2 . 17510 1 1611 . 1 1 143 143 VAL N N 15 125.804 0.40 . 1 . . . . . 140 VAL N . 17510 1 1612 . 1 1 144 144 ASP H H 1 8.122 0.02 . 1 . . . . . 141 ASP H . 17510 1 1613 . 1 1 144 144 ASP HA H 1 4.457 0.02 . 1 . . . . . 141 ASP HA . 17510 1 1614 . 1 1 144 144 ASP HB2 H 1 2.495 0.02 . 2 . . . . . 141 ASP HB2 . 17510 1 1615 . 1 1 144 144 ASP HB3 H 1 2.603 0.02 . 2 . . . . . 141 ASP HB3 . 17510 1 1616 . 1 1 144 144 ASP C C 13 177.272 0.40 . 1 . . . . . 141 ASP C . 17510 1 1617 . 1 1 144 144 ASP CA C 13 56.103 0.40 . 1 . . . . . 141 ASP CA . 17510 1 1618 . 1 1 144 144 ASP CB C 13 41.930 0.40 . 1 . . . . . 141 ASP CB . 17510 1 1619 . 1 1 144 144 ASP N N 15 122.788 0.40 . 1 . . . . . 141 ASP N . 17510 1 1620 . 1 1 145 145 VAL H H 1 9.238 0.02 . 1 . . . . . 142 VAL H . 17510 1 1621 . 1 1 145 145 VAL HA H 1 4.239 0.02 . 1 . . . . . 142 VAL HA . 17510 1 1622 . 1 1 145 145 VAL HB H 1 2.108 0.02 . 1 . . . . . 142 VAL HB . 17510 1 1623 . 1 1 145 145 VAL HG11 H 1 1.172 0.02 . 1 . . . . . 142 VAL HG1 . 17510 1 1624 . 1 1 145 145 VAL HG12 H 1 1.172 0.02 . 1 . . . . . 142 VAL HG1 . 17510 1 1625 . 1 1 145 145 VAL HG13 H 1 1.172 0.02 . 1 . . . . . 142 VAL HG1 . 17510 1 1626 . 1 1 145 145 VAL HG21 H 1 1.044 0.02 . 1 . . . . . 142 VAL HG2 . 17510 1 1627 . 1 1 145 145 VAL HG22 H 1 1.044 0.02 . 1 . . . . . 142 VAL HG2 . 17510 1 1628 . 1 1 145 145 VAL HG23 H 1 1.044 0.02 . 1 . . . . . 142 VAL HG2 . 17510 1 1629 . 1 1 145 145 VAL C C 13 175.872 0.40 . 1 . . . . . 142 VAL C . 17510 1 1630 . 1 1 145 145 VAL CA C 13 61.831 0.40 . 1 . . . . . 142 VAL CA . 17510 1 1631 . 1 1 145 145 VAL CB C 13 36.079 0.40 . 1 . . . . . 142 VAL CB . 17510 1 1632 . 1 1 145 145 VAL CG1 C 13 22.094 0.40 . 1 . . . . . 142 VAL CG1 . 17510 1 1633 . 1 1 145 145 VAL CG2 C 13 21.168 0.40 . 1 . . . . . 142 VAL CG2 . 17510 1 1634 . 1 1 145 145 VAL N N 15 126.878 0.40 . 1 . . . . . 142 VAL N . 17510 1 1635 . 1 1 146 146 VAL H H 1 9.514 0.02 . 1 . . . . . 143 VAL H . 17510 1 1636 . 1 1 146 146 VAL HA H 1 4.113 0.02 . 1 . . . . . 143 VAL HA . 17510 1 1637 . 1 1 146 146 VAL HB H 1 2.128 0.02 . 1 . . . . . 143 VAL HB . 17510 1 1638 . 1 1 146 146 VAL HG11 H 1 1.097 0.02 . 1 . . . . . 143 VAL HG1 . 17510 1 1639 . 1 1 146 146 VAL HG12 H 1 1.097 0.02 . 1 . . . . . 143 VAL HG1 . 17510 1 1640 . 1 1 146 146 VAL HG13 H 1 1.097 0.02 . 1 . . . . . 143 VAL HG1 . 17510 1 1641 . 1 1 146 146 VAL HG21 H 1 1.102 0.02 . 1 . . . . . 143 VAL HG2 . 17510 1 1642 . 1 1 146 146 VAL HG22 H 1 1.102 0.02 . 1 . . . . . 143 VAL HG2 . 17510 1 1643 . 1 1 146 146 VAL HG23 H 1 1.102 0.02 . 1 . . . . . 143 VAL HG2 . 17510 1 1644 . 1 1 146 146 VAL C C 13 175.937 0.40 . 1 . . . . . 143 VAL C . 17510 1 1645 . 1 1 146 146 VAL CA C 13 63.508 0.40 . 1 . . . . . 143 VAL CA . 17510 1 1646 . 1 1 146 146 VAL CB C 13 32.003 0.40 . 1 . . . . . 143 VAL CB . 17510 1 1647 . 1 1 146 146 VAL CG1 C 13 22.440 0.40 . 1 . . . . . 143 VAL CG1 . 17510 1 1648 . 1 1 146 146 VAL CG2 C 13 22.256 0.40 . 1 . . . . . 143 VAL CG2 . 17510 1 1649 . 1 1 146 146 VAL N N 15 130.960 0.40 . 1 . . . . . 143 VAL N . 17510 1 1650 . 1 1 147 147 ASP H H 1 8.693 0.02 . 1 . . . . . 144 ASP H . 17510 1 1651 . 1 1 147 147 ASP HA H 1 4.492 0.02 . 1 . . . . . 144 ASP HA . 17510 1 1652 . 1 1 147 147 ASP C C 13 175.155 0.40 . 1 . . . . . 144 ASP C . 17510 1 1653 . 1 1 147 147 ASP CA C 13 53.942 0.40 . 1 . . . . . 144 ASP CA . 17510 1 1654 . 1 1 147 147 ASP CB C 13 38.851 0.40 . 1 . . . . . 144 ASP CB . 17510 1 1655 . 1 1 147 147 ASP N N 15 123.358 0.40 . 1 . . . . . 144 ASP N . 17510 1 1656 . 1 1 148 148 ASN H H 1 8.625 0.02 . 1 . . . . . 145 ASN H . 17510 1 1657 . 1 1 148 148 ASN HA H 1 4.816 0.02 . 1 . . . . . 145 ASN HA . 17510 1 1658 . 1 1 148 148 ASN HB2 H 1 3.009 0.02 . 2 . . . . . 145 ASN HB2 . 17510 1 1659 . 1 1 148 148 ASN HB3 H 1 3.119 0.02 . 2 . . . . . 145 ASN HB3 . 17510 1 1660 . 1 1 148 148 ASN C C 13 175.497 0.40 . 1 . . . . . 145 ASN C . 17510 1 1661 . 1 1 148 148 ASN CA C 13 52.879 0.40 . 1 . . . . . 145 ASN CA . 17510 1 1662 . 1 1 148 148 ASN CB C 13 40.385 0.40 . 1 . . . . . 145 ASN CB . 17510 1 1663 . 1 1 148 148 ASN N N 15 120.055 0.40 . 1 . . . . . 145 ASN N . 17510 1 1664 . 1 1 149 149 ALA HA H 1 4.323 0.02 . 1 . . . . . 146 ALA HA . 17510 1 1665 . 1 1 149 149 ALA HB1 H 1 1.552 0.02 . 1 . . . . . 146 ALA HB . 17510 1 1666 . 1 1 149 149 ALA HB2 H 1 1.552 0.02 . 1 . . . . . 146 ALA HB . 17510 1 1667 . 1 1 149 149 ALA HB3 H 1 1.552 0.02 . 1 . . . . . 146 ALA HB . 17510 1 1668 . 1 1 149 149 ALA CA C 13 55.494 0.40 . 1 . . . . . 146 ALA CA . 17510 1 1669 . 1 1 149 149 ALA CB C 13 18.938 0.40 . 1 . . . . . 146 ALA CB . 17510 1 1670 . 1 1 150 150 GLU H H 1 8.603 0.02 . 1 . . . . . 147 GLU H . 17510 1 1671 . 1 1 150 150 GLU HA H 1 4.205 0.02 . 1 . . . . . 147 GLU HA . 17510 1 1672 . 1 1 150 150 GLU HB2 H 1 2.183 0.02 . 2 . . . . . 147 GLU HB2 . 17510 1 1673 . 1 1 150 150 GLU HB3 H 1 2.118 0.02 . 2 . . . . . 147 GLU HB3 . 17510 1 1674 . 1 1 150 150 GLU HG2 H 1 2.378 0.02 . 2 . . . . . 147 GLU HG . 17510 1 1675 . 1 1 150 150 GLU HG3 H 1 2.378 0.02 . 2 . . . . . 147 GLU HG . 17510 1 1676 . 1 1 150 150 GLU C C 13 179.080 0.40 . 1 . . . . . 147 GLU C . 17510 1 1677 . 1 1 150 150 GLU CA C 13 59.766 0.40 . 1 . . . . . 147 GLU CA . 17510 1 1678 . 1 1 150 150 GLU CB C 13 29.698 0.40 . 1 . . . . . 147 GLU CB . 17510 1 1679 . 1 1 150 150 GLU CG C 13 36.937 0.40 . 1 . . . . . 147 GLU CG . 17510 1 1680 . 1 1 150 150 GLU N N 15 119.570 0.40 . 1 . . . . . 147 GLU N . 17510 1 1681 . 1 1 151 151 ASP H H 1 9.122 0.02 . 1 . . . . . 148 ASP H . 17510 1 1682 . 1 1 151 151 ASP HA H 1 4.813 0.02 . 1 . . . . . 148 ASP HA . 17510 1 1683 . 1 1 151 151 ASP HB2 H 1 2.696 0.02 . 2 . . . . . 148 ASP HB2 . 17510 1 1684 . 1 1 151 151 ASP HB3 H 1 3.010 0.02 . 2 . . . . . 148 ASP HB3 . 17510 1 1685 . 1 1 151 151 ASP CA C 13 56.874 0.40 . 1 . . . . . 148 ASP CA . 17510 1 1686 . 1 1 151 151 ASP CB C 13 41.393 0.40 . 1 . . . . . 148 ASP CB . 17510 1 1687 . 1 1 151 151 ASP N N 15 121.306 0.40 . 1 . . . . . 148 ASP N . 17510 1 1688 . 1 1 152 152 ALA H H 1 8.425 0.02 . 1 . . . . . 149 ALA H . 17510 1 1689 . 1 1 152 152 ALA HA H 1 4.257 0.02 . 1 . . . . . 149 ALA HA . 17510 1 1690 . 1 1 152 152 ALA HB1 H 1 1.600 0.02 . 1 . . . . . 149 ALA HB . 17510 1 1691 . 1 1 152 152 ALA HB2 H 1 1.600 0.02 . 1 . . . . . 149 ALA HB . 17510 1 1692 . 1 1 152 152 ALA HB3 H 1 1.600 0.02 . 1 . . . . . 149 ALA HB . 17510 1 1693 . 1 1 152 152 ALA C C 13 180.138 0.40 . 1 . . . . . 149 ALA C . 17510 1 1694 . 1 1 152 152 ALA CA C 13 55.116 0.40 . 1 . . . . . 149 ALA CA . 17510 1 1695 . 1 1 152 152 ALA CB C 13 19.175 0.40 . 1 . . . . . 149 ALA CB . 17510 1 1696 . 1 1 152 152 ALA N N 15 121.710 0.40 . 1 . . . . . 149 ALA N . 17510 1 1697 . 1 1 153 153 LEU H H 1 7.514 0.02 . 1 . . . . . 150 LEU H . 17510 1 1698 . 1 1 153 153 LEU HA H 1 4.125 0.02 . 1 . . . . . 150 LEU HA . 17510 1 1699 . 1 1 153 153 LEU HB2 H 1 1.757 0.02 . 2 . . . . . 150 LEU HB2 . 17510 1 1700 . 1 1 153 153 LEU HB3 H 1 1.939 0.02 . 2 . . . . . 150 LEU HB3 . 17510 1 1701 . 1 1 153 153 LEU HG H 1 1.602 0.02 . 1 . . . . . 150 LEU HG . 17510 1 1702 . 1 1 153 153 LEU HD11 H 1 1.021 0.02 . 1 . . . . . 150 LEU HD1 . 17510 1 1703 . 1 1 153 153 LEU HD12 H 1 1.021 0.02 . 1 . . . . . 150 LEU HD1 . 17510 1 1704 . 1 1 153 153 LEU HD13 H 1 1.021 0.02 . 1 . . . . . 150 LEU HD1 . 17510 1 1705 . 1 1 153 153 LEU HD21 H 1 1.052 0.02 . 1 . . . . . 150 LEU HD2 . 17510 1 1706 . 1 1 153 153 LEU HD22 H 1 1.052 0.02 . 1 . . . . . 150 LEU HD2 . 17510 1 1707 . 1 1 153 153 LEU HD23 H 1 1.052 0.02 . 1 . . . . . 150 LEU HD2 . 17510 1 1708 . 1 1 153 153 LEU C C 13 177.793 0.40 . 1 . . . . . 150 LEU C . 17510 1 1709 . 1 1 153 153 LEU CA C 13 57.976 0.40 . 1 . . . . . 150 LEU CA . 17510 1 1710 . 1 1 153 153 LEU CB C 13 41.818 0.40 . 1 . . . . . 150 LEU CB . 17510 1 1711 . 1 1 153 153 LEU CG C 13 27.364 0.40 . 1 . . . . . 150 LEU CG . 17510 1 1712 . 1 1 153 153 LEU CD1 C 13 24.381 0.40 . 1 . . . . . 150 LEU CD1 . 17510 1 1713 . 1 1 153 153 LEU CD2 C 13 25.349 0.40 . 1 . . . . . 150 LEU CD2 . 17510 1 1714 . 1 1 153 153 LEU N N 15 119.699 0.40 . 1 . . . . . 150 LEU N . 17510 1 1715 . 1 1 154 154 MET H H 1 7.701 0.02 . 1 . . . . . 151 MET H . 17510 1 1716 . 1 1 154 154 MET HA H 1 4.459 0.02 . 1 . . . . . 151 MET HA . 17510 1 1717 . 1 1 154 154 MET HB2 H 1 2.310 0.02 . 2 . . . . . 151 MET HB . 17510 1 1718 . 1 1 154 154 MET HB3 H 1 2.310 0.02 . 2 . . . . . 151 MET HB . 17510 1 1719 . 1 1 154 154 MET HG2 H 1 2.796 0.02 . 2 . . . . . 151 MET HG . 17510 1 1720 . 1 1 154 154 MET HG3 H 1 2.796 0.02 . 2 . . . . . 151 MET HG . 17510 1 1721 . 1 1 154 154 MET HE1 H 1 2.181 0.02 . 1 . . . . . 151 MET HE . 17510 1 1722 . 1 1 154 154 MET HE2 H 1 2.181 0.02 . 1 . . . . . 151 MET HE . 17510 1 1723 . 1 1 154 154 MET HE3 H 1 2.181 0.02 . 1 . . . . . 151 MET HE . 17510 1 1724 . 1 1 154 154 MET C C 13 179.780 0.40 . 1 . . . . . 151 MET C . 17510 1 1725 . 1 1 154 154 MET CA C 13 57.830 0.40 . 1 . . . . . 151 MET CA . 17510 1 1726 . 1 1 154 154 MET CB C 13 31.734 0.40 . 1 . . . . . 151 MET CB . 17510 1 1727 . 1 1 154 154 MET CG C 13 32.469 0.40 . 1 . . . . . 151 MET CG . 17510 1 1728 . 1 1 154 154 MET CE C 13 17.265 0.40 . 1 . . . . . 151 MET CE . 17510 1 1729 . 1 1 154 154 MET N N 15 117.324 0.40 . 1 . . . . . 151 MET N . 17510 1 1730 . 1 1 155 155 GLY H H 1 9.375 0.02 . 1 . . . . . 152 GLY H . 17510 1 1731 . 1 1 155 155 GLY HA2 H 1 3.882 0.02 . 2 . . . . . 152 GLY HA2 . 17510 1 1732 . 1 1 155 155 GLY HA3 H 1 3.716 0.02 . 2 . . . . . 152 GLY HA3 . 17510 1 1733 . 1 1 155 155 GLY C C 13 174.455 0.40 . 1 . . . . . 152 GLY C . 17510 1 1734 . 1 1 155 155 GLY CA C 13 47.005 0.40 . 1 . . . . . 152 GLY CA . 17510 1 1735 . 1 1 155 155 GLY N N 15 108.099 0.40 . 1 . . . . . 152 GLY N . 17510 1 1736 . 1 1 156 156 ALA H H 1 7.946 0.02 . 1 . . . . . 153 ALA H . 17510 1 1737 . 1 1 156 156 ALA HA H 1 3.887 0.02 . 1 . . . . . 153 ALA HA . 17510 1 1738 . 1 1 156 156 ALA HB1 H 1 1.246 0.02 . 1 . . . . . 153 ALA HB . 17510 1 1739 . 1 1 156 156 ALA HB2 H 1 1.246 0.02 . 1 . . . . . 153 ALA HB . 17510 1 1740 . 1 1 156 156 ALA HB3 H 1 1.246 0.02 . 1 . . . . . 153 ALA HB . 17510 1 1741 . 1 1 156 156 ALA C C 13 180.350 0.40 . 1 . . . . . 153 ALA C . 17510 1 1742 . 1 1 156 156 ALA CA C 13 55.695 0.40 . 1 . . . . . 153 ALA CA . 17510 1 1743 . 1 1 156 156 ALA CB C 13 17.759 0.40 . 1 . . . . . 153 ALA CB . 17510 1 1744 . 1 1 156 156 ALA N N 15 124.085 0.40 . 1 . . . . . 153 ALA N . 17510 1 1745 . 1 1 157 157 PHE H H 1 7.849 0.02 . 1 . . . . . 154 PHE H . 17510 1 1746 . 1 1 157 157 PHE HA H 1 4.214 0.02 . 1 . . . . . 154 PHE HA . 17510 1 1747 . 1 1 157 157 PHE HB2 H 1 3.381 0.02 . 2 . . . . . 154 PHE HB2 . 17510 1 1748 . 1 1 157 157 PHE HB3 H 1 3.353 0.02 . 2 . . . . . 154 PHE HB3 . 17510 1 1749 . 1 1 157 157 PHE HD1 H 1 7.253 0.02 . 3 . . . . . 154 PHE HD . 17510 1 1750 . 1 1 157 157 PHE HD2 H 1 7.253 0.02 . 3 . . . . . 154 PHE HD . 17510 1 1751 . 1 1 157 157 PHE HE1 H 1 7.271 0.02 . 3 . . . . . 154 PHE HE . 17510 1 1752 . 1 1 157 157 PHE HE2 H 1 7.271 0.02 . 3 . . . . . 154 PHE HE . 17510 1 1753 . 1 1 157 157 PHE C C 13 178.428 0.40 . 1 . . . . . 154 PHE C . 17510 1 1754 . 1 1 157 157 PHE CA C 13 60.862 0.40 . 1 . . . . . 154 PHE CA . 17510 1 1755 . 1 1 157 157 PHE CB C 13 38.410 0.40 . 1 . . . . . 154 PHE CB . 17510 1 1756 . 1 1 157 157 PHE CD1 C 13 131.673 0.40 . 3 . . . . . 154 PHE CD1 . 17510 1 1757 . 1 1 157 157 PHE N N 15 119.857 0.40 . 1 . . . . . 154 PHE N . 17510 1 1758 . 1 1 158 158 VAL H H 1 8.150 0.02 . 1 . . . . . 155 VAL H . 17510 1 1759 . 1 1 158 158 VAL HA H 1 3.848 0.02 . 1 . . . . . 155 VAL HA . 17510 1 1760 . 1 1 158 158 VAL HB H 1 2.383 0.02 . 1 . . . . . 155 VAL HB . 17510 1 1761 . 1 1 158 158 VAL HG11 H 1 1.127 0.02 . 1 . . . . . 155 VAL HG1 . 17510 1 1762 . 1 1 158 158 VAL HG12 H 1 1.127 0.02 . 1 . . . . . 155 VAL HG1 . 17510 1 1763 . 1 1 158 158 VAL HG13 H 1 1.127 0.02 . 1 . . . . . 155 VAL HG1 . 17510 1 1764 . 1 1 158 158 VAL HG21 H 1 1.252 0.02 . 1 . . . . . 155 VAL HG2 . 17510 1 1765 . 1 1 158 158 VAL HG22 H 1 1.252 0.02 . 1 . . . . . 155 VAL HG2 . 17510 1 1766 . 1 1 158 158 VAL HG23 H 1 1.252 0.02 . 1 . . . . . 155 VAL HG2 . 17510 1 1767 . 1 1 158 158 VAL C C 13 177.793 0.40 . 1 . . . . . 155 VAL C . 17510 1 1768 . 1 1 158 158 VAL CA C 13 66.828 0.40 . 1 . . . . . 155 VAL CA . 17510 1 1769 . 1 1 158 158 VAL CB C 13 31.912 0.40 . 1 . . . . . 155 VAL CB . 17510 1 1770 . 1 1 158 158 VAL CG1 C 13 22.001 0.40 . 1 . . . . . 155 VAL CG1 . 17510 1 1771 . 1 1 158 158 VAL CG2 C 13 22.893 0.40 . 1 . . . . . 155 VAL CG2 . 17510 1 1772 . 1 1 158 158 VAL N N 15 120.546 0.40 . 1 . . . . . 155 VAL N . 17510 1 1773 . 1 1 159 159 ILE H H 1 8.896 0.02 . 1 . . . . . 156 ILE H . 17510 1 1774 . 1 1 159 159 ILE HA H 1 3.463 0.02 . 1 . . . . . 156 ILE HA . 17510 1 1775 . 1 1 159 159 ILE HB H 1 1.817 0.02 . 1 . . . . . 156 ILE HB . 17510 1 1776 . 1 1 159 159 ILE HG21 H 1 0.783 0.02 . 1 . . . . . 156 ILE HG2 . 17510 1 1777 . 1 1 159 159 ILE HG22 H 1 0.783 0.02 . 1 . . . . . 156 ILE HG2 . 17510 1 1778 . 1 1 159 159 ILE HG23 H 1 0.783 0.02 . 1 . . . . . 156 ILE HG2 . 17510 1 1779 . 1 1 159 159 ILE HD11 H 1 0.673 0.02 . 1 . . . . . 156 ILE HD1 . 17510 1 1780 . 1 1 159 159 ILE HD12 H 1 0.673 0.02 . 1 . . . . . 156 ILE HD1 . 17510 1 1781 . 1 1 159 159 ILE HD13 H 1 0.673 0.02 . 1 . . . . . 156 ILE HD1 . 17510 1 1782 . 1 1 159 159 ILE C C 13 177.288 0.40 . 1 . . . . . 156 ILE C . 17510 1 1783 . 1 1 159 159 ILE CA C 13 66.237 0.40 . 1 . . . . . 156 ILE CA . 17510 1 1784 . 1 1 159 159 ILE CB C 13 38.560 0.40 . 1 . . . . . 156 ILE CB . 17510 1 1785 . 1 1 159 159 ILE CG2 C 13 17.232 0.40 . 1 . . . . . 156 ILE CG2 . 17510 1 1786 . 1 1 159 159 ILE CD1 C 13 13.552 0.40 . 1 . . . . . 156 ILE CD1 . 17510 1 1787 . 1 1 159 159 ILE N N 15 120.202 0.40 . 1 . . . . . 156 ILE N . 17510 1 1788 . 1 1 160 160 THR H H 1 8.003 0.02 . 1 . . . . . 157 THR H . 17510 1 1789 . 1 1 160 160 THR HA H 1 4.317 0.02 . 1 . . . . . 157 THR HA . 17510 1 1790 . 1 1 160 160 THR HB H 1 3.701 0.02 . 1 . . . . . 157 THR HB . 17510 1 1791 . 1 1 160 160 THR HG21 H 1 1.302 0.02 . 1 . . . . . 157 THR HG2 . 17510 1 1792 . 1 1 160 160 THR HG22 H 1 1.302 0.02 . 1 . . . . . 157 THR HG2 . 17510 1 1793 . 1 1 160 160 THR HG23 H 1 1.302 0.02 . 1 . . . . . 157 THR HG2 . 17510 1 1794 . 1 1 160 160 THR C C 13 175.595 0.40 . 1 . . . . . 157 THR C . 17510 1 1795 . 1 1 160 160 THR CA C 13 67.504 0.40 . 1 . . . . . 157 THR CA . 17510 1 1796 . 1 1 160 160 THR CB C 13 68.023 0.40 . 1 . . . . . 157 THR CB . 17510 1 1797 . 1 1 160 160 THR CG2 C 13 21.633 0.40 . 1 . . . . . 157 THR CG2 . 17510 1 1798 . 1 1 160 160 THR N N 15 116.708 0.40 . 1 . . . . . 157 THR N . 17510 1 1799 . 1 1 161 161 ASP H H 1 8.032 0.02 . 1 . . . . . 158 ASP H . 17510 1 1800 . 1 1 161 161 ASP HA H 1 4.527 0.02 . 1 . . . . . 158 ASP HA . 17510 1 1801 . 1 1 161 161 ASP HB2 H 1 3.037 0.02 . 2 . . . . . 158 ASP HB2 . 17510 1 1802 . 1 1 161 161 ASP HB3 H 1 2.986 0.02 . 2 . . . . . 158 ASP HB3 . 17510 1 1803 . 1 1 161 161 ASP C C 13 178.331 0.40 . 1 . . . . . 158 ASP C . 17510 1 1804 . 1 1 161 161 ASP CA C 13 57.434 0.40 . 1 . . . . . 158 ASP CA . 17510 1 1805 . 1 1 161 161 ASP CB C 13 41.141 0.40 . 1 . . . . . 158 ASP CB . 17510 1 1806 . 1 1 161 161 ASP N N 15 122.426 0.40 . 1 . . . . . 158 ASP N . 17510 1 1807 . 1 1 162 162 MET H H 1 8.180 0.02 . 1 . . . . . 159 MET H . 17510 1 1808 . 1 1 162 162 MET HA H 1 3.464 0.02 . 1 . . . . . 159 MET HA . 17510 1 1809 . 1 1 162 162 MET HB2 H 1 1.492 0.02 . 2 . . . . . 159 MET HB2 . 17510 1 1810 . 1 1 162 162 MET HB3 H 1 1.966 0.02 . 2 . . . . . 159 MET HB3 . 17510 1 1811 . 1 1 162 162 MET HG2 H 1 1.547 0.02 . 2 . . . . . 159 MET HG2 . 17510 1 1812 . 1 1 162 162 MET HG3 H 1 1.742 0.02 . 2 . . . . . 159 MET HG3 . 17510 1 1813 . 1 1 162 162 MET HE1 H 1 1.672 0.02 . 1 . . . . . 159 MET HE . 17510 1 1814 . 1 1 162 162 MET HE2 H 1 1.672 0.02 . 1 . . . . . 159 MET HE . 17510 1 1815 . 1 1 162 162 MET HE3 H 1 1.672 0.02 . 1 . . . . . 159 MET HE . 17510 1 1816 . 1 1 162 162 MET C C 13 178.005 0.40 . 1 . . . . . 159 MET C . 17510 1 1817 . 1 1 162 162 MET CA C 13 59.558 0.40 . 1 . . . . . 159 MET CA . 17510 1 1818 . 1 1 162 162 MET CB C 13 33.080 0.40 . 1 . . . . . 159 MET CB . 17510 1 1819 . 1 1 162 162 MET CG C 13 31.363 0.40 . 1 . . . . . 159 MET CG . 17510 1 1820 . 1 1 162 162 MET CE C 13 17.562 0.40 . 1 . . . . . 159 MET CE . 17510 1 1821 . 1 1 162 162 MET N N 15 119.798 0.40 . 1 . . . . . 159 MET N . 17510 1 1822 . 1 1 163 163 ILE H H 1 8.464 0.02 . 1 . . . . . 160 ILE H . 17510 1 1823 . 1 1 163 163 ILE HA H 1 3.506 0.02 . 1 . . . . . 160 ILE HA . 17510 1 1824 . 1 1 163 163 ILE HB H 1 1.710 0.02 . 1 . . . . . 160 ILE HB . 17510 1 1825 . 1 1 163 163 ILE HG12 H 1 1.551 0.02 . 2 . . . . . 160 ILE HG12 . 17510 1 1826 . 1 1 163 163 ILE HG13 H 1 1.143 0.02 . 2 . . . . . 160 ILE HG13 . 17510 1 1827 . 1 1 163 163 ILE HG21 H 1 0.251 0.02 . 1 . . . . . 160 ILE HG2 . 17510 1 1828 . 1 1 163 163 ILE HG22 H 1 0.251 0.02 . 1 . . . . . 160 ILE HG2 . 17510 1 1829 . 1 1 163 163 ILE HG23 H 1 0.251 0.02 . 1 . . . . . 160 ILE HG2 . 17510 1 1830 . 1 1 163 163 ILE HD11 H 1 0.550 0.02 . 1 . . . . . 160 ILE HD1 . 17510 1 1831 . 1 1 163 163 ILE HD12 H 1 0.550 0.02 . 1 . . . . . 160 ILE HD1 . 17510 1 1832 . 1 1 163 163 ILE HD13 H 1 0.550 0.02 . 1 . . . . . 160 ILE HD1 . 17510 1 1833 . 1 1 163 163 ILE C C 13 177.484 0.40 . 1 . . . . . 160 ILE C . 17510 1 1834 . 1 1 163 163 ILE CA C 13 62.801 0.40 . 1 . . . . . 160 ILE CA . 17510 1 1835 . 1 1 163 163 ILE CB C 13 35.213 0.40 . 1 . . . . . 160 ILE CB . 17510 1 1836 . 1 1 163 163 ILE CG1 C 13 27.880 0.40 . 1 . . . . . 160 ILE CG1 . 17510 1 1837 . 1 1 163 163 ILE CG2 C 13 17.615 0.40 . 1 . . . . . 160 ILE CG2 . 17510 1 1838 . 1 1 163 163 ILE CD1 C 13 10.706 0.40 . 1 . . . . . 160 ILE CD1 . 17510 1 1839 . 1 1 163 163 ILE N N 15 119.196 0.40 . 1 . . . . . 160 ILE N . 17510 1 1840 . 1 1 164 164 ASN H H 1 8.736 0.02 . 1 . . . . . 161 ASN H . 17510 1 1841 . 1 1 164 164 ASN HA H 1 4.574 0.02 . 1 . . . . . 161 ASN HA . 17510 1 1842 . 1 1 164 164 ASN HB2 H 1 3.048 0.02 . 2 . . . . . 161 ASN HB . 17510 1 1843 . 1 1 164 164 ASN HB3 H 1 3.048 0.02 . 2 . . . . . 161 ASN HB . 17510 1 1844 . 1 1 164 164 ASN C C 13 177.696 0.40 . 1 . . . . . 161 ASN C . 17510 1 1845 . 1 1 164 164 ASN CA C 13 57.043 0.40 . 1 . . . . . 161 ASN CA . 17510 1 1846 . 1 1 164 164 ASN CB C 13 39.206 0.40 . 1 . . . . . 161 ASN CB . 17510 1 1847 . 1 1 164 164 ASN N N 15 118.907 0.40 . 1 . . . . . 161 ASN N . 17510 1 1848 . 1 1 165 165 MET H H 1 7.865 0.02 . 1 . . . . . 162 MET H . 17510 1 1849 . 1 1 165 165 MET HA H 1 4.209 0.02 . 1 . . . . . 162 MET HA . 17510 1 1850 . 1 1 165 165 MET HB2 H 1 2.278 0.02 . 2 . . . . . 162 MET HB2 . 17510 1 1851 . 1 1 165 165 MET HB3 H 1 2.370 0.02 . 2 . . . . . 162 MET HB3 . 17510 1 1852 . 1 1 165 165 MET HG2 H 1 2.699 0.02 . 2 . . . . . 162 MET HG2 . 17510 1 1853 . 1 1 165 165 MET HG3 H 1 2.888 0.02 . 2 . . . . . 162 MET HG3 . 17510 1 1854 . 1 1 165 165 MET HE1 H 1 2.148 0.02 . 1 . . . . . 162 MET HE . 17510 1 1855 . 1 1 165 165 MET HE2 H 1 2.148 0.02 . 1 . . . . . 162 MET HE . 17510 1 1856 . 1 1 165 165 MET HE3 H 1 2.148 0.02 . 1 . . . . . 162 MET HE . 17510 1 1857 . 1 1 165 165 MET C C 13 179.161 0.40 . 1 . . . . . 162 MET C . 17510 1 1858 . 1 1 165 165 MET CA C 13 58.856 0.40 . 1 . . . . . 162 MET CA . 17510 1 1859 . 1 1 165 165 MET CB C 13 32.564 0.40 . 1 . . . . . 162 MET CB . 17510 1 1860 . 1 1 165 165 MET CG C 13 32.394 0.40 . 1 . . . . . 162 MET CG . 17510 1 1861 . 1 1 165 165 MET CE C 13 17.421 0.40 . 1 . . . . . 162 MET CE . 17510 1 1862 . 1 1 165 165 MET N N 15 116.607 0.40 . 1 . . . . . 162 MET N . 17510 1 1863 . 1 1 166 166 MET H H 1 8.226 0.02 . 1 . . . . . 163 MET H . 17510 1 1864 . 1 1 166 166 MET HA H 1 3.919 0.02 . 1 . . . . . 163 MET HA . 17510 1 1865 . 1 1 166 166 MET HG2 H 1 2.779 0.02 . 2 . . . . . 163 MET HG2 . 17510 1 1866 . 1 1 166 166 MET HG3 H 1 2.323 0.02 . 2 . . . . . 163 MET HG3 . 17510 1 1867 . 1 1 166 166 MET HE1 H 1 1.764 0.02 . 1 . . . . . 163 MET HE . 17510 1 1868 . 1 1 166 166 MET HE2 H 1 1.764 0.02 . 1 . . . . . 163 MET HE . 17510 1 1869 . 1 1 166 166 MET HE3 H 1 1.764 0.02 . 1 . . . . . 163 MET HE . 17510 1 1870 . 1 1 166 166 MET C C 13 178.135 0.40 . 1 . . . . . 163 MET C . 17510 1 1871 . 1 1 166 166 MET CA C 13 59.185 0.40 . 1 . . . . . 163 MET CA . 17510 1 1872 . 1 1 166 166 MET CB C 13 31.721 0.40 . 1 . . . . . 163 MET CB . 17510 1 1873 . 1 1 166 166 MET CG C 13 34.255 0.40 . 1 . . . . . 163 MET CG . 17510 1 1874 . 1 1 166 166 MET CE C 13 18.510 0.40 . 1 . . . . . 163 MET CE . 17510 1 1875 . 1 1 166 166 MET N N 15 119.137 0.40 . 1 . . . . . 163 MET N . 17510 1 1876 . 1 1 167 167 ALA H H 1 8.780 0.02 . 1 . . . . . 164 ALA H . 17510 1 1877 . 1 1 167 167 ALA HA H 1 4.227 0.02 . 1 . . . . . 164 ALA HA . 17510 1 1878 . 1 1 167 167 ALA HB1 H 1 1.734 0.02 . 1 . . . . . 164 ALA HB . 17510 1 1879 . 1 1 167 167 ALA HB2 H 1 1.734 0.02 . 1 . . . . . 164 ALA HB . 17510 1 1880 . 1 1 167 167 ALA HB3 H 1 1.734 0.02 . 1 . . . . . 164 ALA HB . 17510 1 1881 . 1 1 167 167 ALA C C 13 177.907 0.40 . 1 . . . . . 164 ALA C . 17510 1 1882 . 1 1 167 167 ALA CA C 13 53.960 0.40 . 1 . . . . . 164 ALA CA . 17510 1 1883 . 1 1 167 167 ALA CB C 13 18.766 0.40 . 1 . . . . . 164 ALA CB . 17510 1 1884 . 1 1 167 167 ALA N N 15 120.410 0.40 . 1 . . . . . 164 ALA N . 17510 1 1885 . 1 1 168 168 LYS H H 1 7.313 0.02 . 1 . . . . . 165 LYS H . 17510 1 1886 . 1 1 168 168 LYS HA H 1 4.344 0.02 . 1 . . . . . 165 LYS HA . 17510 1 1887 . 1 1 168 168 LYS HG2 H 1 1.778 0.02 . 2 . . . . . 165 LYS HG2 . 17510 1 1888 . 1 1 168 168 LYS HG3 H 1 1.611 0.02 . 2 . . . . . 165 LYS HG3 . 17510 1 1889 . 1 1 168 168 LYS HE2 H 1 3.062 0.02 . 2 . . . . . 165 LYS HE . 17510 1 1890 . 1 1 168 168 LYS HE3 H 1 3.062 0.02 . 2 . . . . . 165 LYS HE . 17510 1 1891 . 1 1 168 168 LYS C C 13 177.207 0.40 . 1 . . . . . 165 LYS C . 17510 1 1892 . 1 1 168 168 LYS CA C 13 56.643 0.40 . 1 . . . . . 165 LYS CA . 17510 1 1893 . 1 1 168 168 LYS CB C 13 32.947 0.40 . 1 . . . . . 165 LYS CB . 17510 1 1894 . 1 1 168 168 LYS CG C 13 25.293 0.40 . 1 . . . . . 165 LYS CG . 17510 1 1895 . 1 1 168 168 LYS CE C 13 41.876 0.40 . 1 . . . . . 165 LYS CE . 17510 1 1896 . 1 1 168 168 LYS N N 15 114.965 0.40 . 1 . . . . . 165 LYS N . 17510 1 1897 . 1 1 169 169 SER H H 1 7.230 0.02 . 1 . . . . . 166 SER H . 17510 1 1898 . 1 1 169 169 SER HA H 1 4.461 0.02 . 1 . . . . . 166 SER HA . 17510 1 1899 . 1 1 169 169 SER HB2 H 1 3.836 0.02 . 2 . . . . . 166 SER HB2 . 17510 1 1900 . 1 1 169 169 SER HB3 H 1 3.972 0.02 . 2 . . . . . 166 SER HB3 . 17510 1 1901 . 1 1 169 169 SER C C 13 176.539 0.40 . 1 . . . . . 166 SER C . 17510 1 1902 . 1 1 169 169 SER CA C 13 58.737 0.40 . 1 . . . . . 166 SER CA . 17510 1 1903 . 1 1 169 169 SER CB C 13 63.643 0.40 . 1 . . . . . 166 SER CB . 17510 1 1904 . 1 1 169 169 SER N N 15 113.454 0.40 . 1 . . . . . 166 SER N . 17510 1 1905 . 1 1 170 170 THR HA H 1 4.517 0.02 . 1 . . . . . 167 THR HA . 17510 1 1906 . 1 1 170 170 THR HB H 1 4.595 0.02 . 1 . . . . . 167 THR HB . 17510 1 1907 . 1 1 170 170 THR HG21 H 1 1.321 0.02 . 1 . . . . . 167 THR HG2 . 17510 1 1908 . 1 1 170 170 THR HG22 H 1 1.321 0.02 . 1 . . . . . 167 THR HG2 . 17510 1 1909 . 1 1 170 170 THR HG23 H 1 1.321 0.02 . 1 . . . . . 167 THR HG2 . 17510 1 1910 . 1 1 170 170 THR CA C 13 62.202 0.40 . 1 . . . . . 167 THR CA . 17510 1 1911 . 1 1 170 170 THR CB C 13 69.001 0.40 . 1 . . . . . 167 THR CB . 17510 1 1912 . 1 1 170 170 THR CG2 C 13 21.993 0.40 . 1 . . . . . 167 THR CG2 . 17510 1 1913 . 1 1 171 171 ASP H H 1 8.441 0.02 . 1 . . . . . 168 ASP H . 17510 1 1914 . 1 1 171 171 ASP HA H 1 4.756 0.02 . 1 . . . . . 168 ASP HA . 17510 1 1915 . 1 1 171 171 ASP HB2 H 1 2.829 0.02 . 2 . . . . . 168 ASP HB2 . 17510 1 1916 . 1 1 171 171 ASP HB3 H 1 2.588 0.02 . 2 . . . . . 168 ASP HB3 . 17510 1 1917 . 1 1 171 171 ASP C C 13 175.302 0.40 . 1 . . . . . 168 ASP C . 17510 1 1918 . 1 1 171 171 ASP CA C 13 53.217 0.40 . 1 . . . . . 168 ASP CA . 17510 1 1919 . 1 1 171 171 ASP CB C 13 40.210 0.40 . 1 . . . . . 168 ASP CB . 17510 1 1920 . 1 1 171 171 ASP N N 15 123.719 0.40 . 1 . . . . . 168 ASP N . 17510 1 1921 . 1 1 172 172 LEU H H 1 8.778 0.02 . 1 . . . . . 169 LEU H . 17510 1 1922 . 1 1 172 172 LEU HA H 1 4.090 0.02 . 1 . . . . . 169 LEU HA . 17510 1 1923 . 1 1 172 172 LEU HB2 H 1 1.659 0.02 . 2 . . . . . 169 LEU HB2 . 17510 1 1924 . 1 1 172 172 LEU HB3 H 1 1.786 0.02 . 2 . . . . . 169 LEU HB3 . 17510 1 1925 . 1 1 172 172 LEU HG H 1 1.426 0.02 . 1 . . . . . 169 LEU HG . 17510 1 1926 . 1 1 172 172 LEU HD11 H 1 0.932 0.02 . 1 . . . . . 169 LEU HD1 . 17510 1 1927 . 1 1 172 172 LEU HD12 H 1 0.932 0.02 . 1 . . . . . 169 LEU HD1 . 17510 1 1928 . 1 1 172 172 LEU HD13 H 1 0.932 0.02 . 1 . . . . . 169 LEU HD1 . 17510 1 1929 . 1 1 172 172 LEU HD21 H 1 0.895 0.02 . 1 . . . . . 169 LEU HD2 . 17510 1 1930 . 1 1 172 172 LEU HD22 H 1 0.895 0.02 . 1 . . . . . 169 LEU HD2 . 17510 1 1931 . 1 1 172 172 LEU HD23 H 1 0.895 0.02 . 1 . . . . . 169 LEU HD2 . 17510 1 1932 . 1 1 172 172 LEU C C 13 178.037 0.40 . 1 . . . . . 169 LEU C . 17510 1 1933 . 1 1 172 172 LEU CA C 13 58.775 0.40 . 1 . . . . . 169 LEU CA . 17510 1 1934 . 1 1 172 172 LEU CB C 13 41.686 0.40 . 1 . . . . . 169 LEU CB . 17510 1 1935 . 1 1 172 172 LEU CG C 13 27.236 0.40 . 1 . . . . . 169 LEU CG . 17510 1 1936 . 1 1 172 172 LEU CD1 C 13 23.546 0.40 . 1 . . . . . 169 LEU CD1 . 17510 1 1937 . 1 1 172 172 LEU CD2 C 13 25.296 0.40 . 1 . . . . . 169 LEU CD2 . 17510 1 1938 . 1 1 172 172 LEU N N 15 126.895 0.40 . 1 . . . . . 169 LEU N . 17510 1 1939 . 1 1 173 173 ASP H H 1 8.517 0.02 . 1 . . . . . 170 ASP H . 17510 1 1940 . 1 1 173 173 ASP HA H 1 4.417 0.02 . 1 . . . . . 170 ASP HA . 17510 1 1941 . 1 1 173 173 ASP HB2 H 1 2.840 0.02 . 2 . . . . . 170 ASP HB2 . 17510 1 1942 . 1 1 173 173 ASP HB3 H 1 2.734 0.02 . 2 . . . . . 170 ASP HB3 . 17510 1 1943 . 1 1 173 173 ASP C C 13 178.493 0.40 . 1 . . . . . 170 ASP C . 17510 1 1944 . 1 1 173 173 ASP CA C 13 57.763 0.40 . 1 . . . . . 170 ASP CA . 17510 1 1945 . 1 1 173 173 ASP CB C 13 40.714 0.40 . 1 . . . . . 170 ASP CB . 17510 1 1946 . 1 1 173 173 ASP N N 15 115.533 0.40 . 1 . . . . . 170 ASP N . 17510 1 1947 . 1 1 174 174 ASN H H 1 7.411 0.02 . 1 . . . . . 171 ASN H . 17510 1 1948 . 1 1 174 174 ASN HA H 1 4.853 0.02 . 1 . . . . . 171 ASN HA . 17510 1 1949 . 1 1 174 174 ASN HB2 H 1 2.669 0.02 . 2 . . . . . 171 ASN HB2 . 17510 1 1950 . 1 1 174 174 ASN HB3 H 1 2.827 0.02 . 2 . . . . . 171 ASN HB3 . 17510 1 1951 . 1 1 174 174 ASN C C 13 176.181 0.40 . 1 . . . . . 171 ASN C . 17510 1 1952 . 1 1 174 174 ASN CA C 13 54.929 0.40 . 1 . . . . . 171 ASN CA . 17510 1 1953 . 1 1 174 174 ASN CB C 13 40.201 0.40 . 1 . . . . . 171 ASN CB . 17510 1 1954 . 1 1 174 174 ASN N N 15 114.679 0.40 . 1 . . . . . 171 ASN N . 17510 1 1955 . 1 1 175 175 ASP H H 1 8.175 0.02 . 1 . . . . . 172 ASP H . 17510 1 1956 . 1 1 175 175 ASP HA H 1 4.824 0.02 . 1 . . . . . 172 ASP HA . 17510 1 1957 . 1 1 175 175 ASP HB2 H 1 2.766 0.02 . 2 . . . . . 172 ASP HB2 . 17510 1 1958 . 1 1 175 175 ASP HB3 H 1 2.615 0.02 . 2 . . . . . 172 ASP HB3 . 17510 1 1959 . 1 1 175 175 ASP C C 13 178.575 0.40 . 1 . . . . . 172 ASP C . 17510 1 1960 . 1 1 175 175 ASP CA C 13 55.478 0.40 . 1 . . . . . 172 ASP CA . 17510 1 1961 . 1 1 175 175 ASP CB C 13 41.577 0.40 . 1 . . . . . 172 ASP CB . 17510 1 1962 . 1 1 175 175 ASP N N 15 119.137 0.40 . 1 . . . . . 172 ASP N . 17510 1 1963 . 1 1 176 176 ILE H H 1 8.419 0.02 . 1 . . . . . 173 ILE H . 17510 1 1964 . 1 1 176 176 ILE HA H 1 3.826 0.02 . 1 . . . . . 173 ILE HA . 17510 1 1965 . 1 1 176 176 ILE HB H 1 1.937 0.02 . 1 . . . . . 173 ILE HB . 17510 1 1966 . 1 1 176 176 ILE HG12 H 1 1.107 0.02 . 2 . . . . . 173 ILE HG12 . 17510 1 1967 . 1 1 176 176 ILE HG13 H 1 0.846 0.02 . 2 . . . . . 173 ILE HG13 . 17510 1 1968 . 1 1 176 176 ILE HG21 H 1 0.859 0.02 . 1 . . . . . 173 ILE HG2 . 17510 1 1969 . 1 1 176 176 ILE HG22 H 1 0.859 0.02 . 1 . . . . . 173 ILE HG2 . 17510 1 1970 . 1 1 176 176 ILE HG23 H 1 0.859 0.02 . 1 . . . . . 173 ILE HG2 . 17510 1 1971 . 1 1 176 176 ILE HD11 H 1 0.371 0.02 . 1 . . . . . 173 ILE HD1 . 17510 1 1972 . 1 1 176 176 ILE HD12 H 1 0.371 0.02 . 1 . . . . . 173 ILE HD1 . 17510 1 1973 . 1 1 176 176 ILE HD13 H 1 0.371 0.02 . 1 . . . . . 173 ILE HD1 . 17510 1 1974 . 1 1 176 176 ILE C C 13 175.204 0.40 . 1 . . . . . 173 ILE C . 17510 1 1975 . 1 1 176 176 ILE CA C 13 65.284 0.40 . 1 . . . . . 173 ILE CA . 17510 1 1976 . 1 1 176 176 ILE CB C 13 37.446 0.40 . 1 . . . . . 173 ILE CB . 17510 1 1977 . 1 1 176 176 ILE CG1 C 13 29.209 0.40 . 1 . . . . . 173 ILE CG1 . 17510 1 1978 . 1 1 176 176 ILE CG2 C 13 17.044 0.40 . 1 . . . . . 173 ILE CG2 . 17510 1 1979 . 1 1 176 176 ILE CD1 C 13 13.945 0.40 . 1 . . . . . 173 ILE CD1 . 17510 1 1980 . 1 1 176 176 ILE N N 15 120.200 0.40 . 1 . . . . . 173 ILE N . 17510 1 1981 . 1 1 177 177 ASP H H 1 8.214 0.02 . 1 . . . . . 174 ASP H . 17510 1 1982 . 1 1 177 177 ASP HA H 1 4.347 0.02 . 1 . . . . . 174 ASP HA . 17510 1 1983 . 1 1 177 177 ASP HB2 H 1 2.711 0.02 . 2 . . . . . 174 ASP HB2 . 17510 1 1984 . 1 1 177 177 ASP HB3 H 1 2.773 0.02 . 2 . . . . . 174 ASP HB3 . 17510 1 1985 . 1 1 177 177 ASP C C 13 179.226 0.40 . 1 . . . . . 174 ASP C . 17510 1 1986 . 1 1 177 177 ASP CA C 13 58.218 0.40 . 1 . . . . . 174 ASP CA . 17510 1 1987 . 1 1 177 177 ASP CB C 13 40.216 0.40 . 1 . . . . . 174 ASP CB . 17510 1 1988 . 1 1 177 177 ASP N N 15 122.104 0.40 . 1 . . . . . 174 ASP N . 17510 1 1989 . 1 1 178 178 GLU H H 1 8.156 0.02 . 1 . . . . . 175 GLU H . 17510 1 1990 . 1 1 178 178 GLU HA H 1 4.180 0.02 . 1 . . . . . 175 GLU HA . 17510 1 1991 . 1 1 178 178 GLU HB2 H 1 2.170 0.02 . 2 . . . . . 175 GLU HB . 17510 1 1992 . 1 1 178 178 GLU HB3 H 1 2.170 0.02 . 2 . . . . . 175 GLU HB . 17510 1 1993 . 1 1 178 178 GLU HG2 H 1 2.383 0.02 . 2 . . . . . 175 GLU HG . 17510 1 1994 . 1 1 178 178 GLU HG3 H 1 2.383 0.02 . 2 . . . . . 175 GLU HG . 17510 1 1995 . 1 1 178 178 GLU C C 13 179.275 0.40 . 1 . . . . . 175 GLU C . 17510 1 1996 . 1 1 178 178 GLU CA C 13 59.375 0.40 . 1 . . . . . 175 GLU CA . 17510 1 1997 . 1 1 178 178 GLU CB C 13 29.435 0.40 . 1 . . . . . 175 GLU CB . 17510 1 1998 . 1 1 178 178 GLU CG C 13 37.000 0.40 . 1 . . . . . 175 GLU CG . 17510 1 1999 . 1 1 178 178 GLU N N 15 120.850 0.40 . 1 . . . . . 175 GLU N . 17510 1 2000 . 1 1 179 179 LEU H H 1 8.067 0.02 . 1 . . . . . 176 LEU H . 17510 1 2001 . 1 1 179 179 LEU HA H 1 4.214 0.02 . 1 . . . . . 176 LEU HA . 17510 1 2002 . 1 1 179 179 LEU HB2 H 1 1.460 0.02 . 2 . . . . . 176 LEU HB2 . 17510 1 2003 . 1 1 179 179 LEU HB3 H 1 1.929 0.02 . 2 . . . . . 176 LEU HB3 . 17510 1 2004 . 1 1 179 179 LEU HG H 1 1.858 0.02 . 1 . . . . . 176 LEU HG . 17510 1 2005 . 1 1 179 179 LEU HD11 H 1 0.854 0.02 . 1 . . . . . 176 LEU HD1 . 17510 1 2006 . 1 1 179 179 LEU HD12 H 1 0.854 0.02 . 1 . . . . . 176 LEU HD1 . 17510 1 2007 . 1 1 179 179 LEU HD13 H 1 0.854 0.02 . 1 . . . . . 176 LEU HD1 . 17510 1 2008 . 1 1 179 179 LEU HD21 H 1 0.896 0.02 . 1 . . . . . 176 LEU HD2 . 17510 1 2009 . 1 1 179 179 LEU HD22 H 1 0.896 0.02 . 1 . . . . . 176 LEU HD2 . 17510 1 2010 . 1 1 179 179 LEU HD23 H 1 0.896 0.02 . 1 . . . . . 176 LEU HD2 . 17510 1 2011 . 1 1 179 179 LEU C C 13 179.340 0.40 . 1 . . . . . 176 LEU C . 17510 1 2012 . 1 1 179 179 LEU CA C 13 58.250 0.40 . 1 . . . . . 176 LEU CA . 17510 1 2013 . 1 1 179 179 LEU CB C 13 42.009 0.40 . 1 . . . . . 176 LEU CB . 17510 1 2014 . 1 1 179 179 LEU CG C 13 26.819 0.40 . 1 . . . . . 176 LEU CG . 17510 1 2015 . 1 1 179 179 LEU CD1 C 13 26.762 0.40 . 1 . . . . . 176 LEU CD1 . 17510 1 2016 . 1 1 179 179 LEU CD2 C 13 23.594 0.40 . 1 . . . . . 176 LEU CD2 . 17510 1 2017 . 1 1 179 179 LEU N N 15 121.655 0.40 . 1 . . . . . 176 LEU N . 17510 1 2018 . 1 1 180 180 ILE H H 1 8.749 0.02 . 1 . . . . . 177 ILE H . 17510 1 2019 . 1 1 180 180 ILE HA H 1 3.516 0.02 . 1 . . . . . 177 ILE HA . 17510 1 2020 . 1 1 180 180 ILE HB H 1 1.951 0.02 . 1 . . . . . 177 ILE HB . 17510 1 2021 . 1 1 180 180 ILE HG12 H 1 0.755 0.02 . 2 . . . . . 177 ILE HG12 . 17510 1 2022 . 1 1 180 180 ILE HG13 H 1 1.628 0.02 . 2 . . . . . 177 ILE HG13 . 17510 1 2023 . 1 1 180 180 ILE HG21 H 1 0.941 0.02 . 1 . . . . . 177 ILE HG2 . 17510 1 2024 . 1 1 180 180 ILE HG22 H 1 0.941 0.02 . 1 . . . . . 177 ILE HG2 . 17510 1 2025 . 1 1 180 180 ILE HG23 H 1 0.941 0.02 . 1 . . . . . 177 ILE HG2 . 17510 1 2026 . 1 1 180 180 ILE HD11 H 1 0.502 0.02 . 1 . . . . . 177 ILE HD1 . 17510 1 2027 . 1 1 180 180 ILE HD12 H 1 0.502 0.02 . 1 . . . . . 177 ILE HD1 . 17510 1 2028 . 1 1 180 180 ILE HD13 H 1 0.502 0.02 . 1 . . . . . 177 ILE HD1 . 17510 1 2029 . 1 1 180 180 ILE C C 13 177.696 0.40 . 1 . . . . . 177 ILE C . 17510 1 2030 . 1 1 180 180 ILE CA C 13 66.283 0.40 . 1 . . . . . 177 ILE CA . 17510 1 2031 . 1 1 180 180 ILE CB C 13 37.772 0.40 . 1 . . . . . 177 ILE CB . 17510 1 2032 . 1 1 180 180 ILE CG1 C 13 29.713 0.40 . 1 . . . . . 177 ILE CG1 . 17510 1 2033 . 1 1 180 180 ILE CG2 C 13 17.774 0.40 . 1 . . . . . 177 ILE CG2 . 17510 1 2034 . 1 1 180 180 ILE CD1 C 13 14.124 0.40 . 1 . . . . . 177 ILE CD1 . 17510 1 2035 . 1 1 180 180 ILE N N 15 119.358 0.40 . 1 . . . . . 177 ILE N . 17510 1 2036 . 1 1 181 181 GLN H H 1 7.728 0.02 . 1 . . . . . 178 GLN H . 17510 1 2037 . 1 1 181 181 GLN HA H 1 4.301 0.02 . 1 . . . . . 178 GLN HA . 17510 1 2038 . 1 1 181 181 GLN HB2 H 1 2.284 0.02 . 2 . . . . . 178 GLN HB . 17510 1 2039 . 1 1 181 181 GLN HB3 H 1 2.284 0.02 . 2 . . . . . 178 GLN HB . 17510 1 2040 . 1 1 181 181 GLN HG2 H 1 2.529 0.02 . 2 . . . . . 178 GLN HG2 . 17510 1 2041 . 1 1 181 181 GLN HG3 H 1 2.670 0.02 . 2 . . . . . 178 GLN HG3 . 17510 1 2042 . 1 1 181 181 GLN C C 13 178.982 0.40 . 1 . . . . . 178 GLN C . 17510 1 2043 . 1 1 181 181 GLN CA C 13 59.374 0.40 . 1 . . . . . 178 GLN CA . 17510 1 2044 . 1 1 181 181 GLN CB C 13 28.622 0.40 . 1 . . . . . 178 GLN CB . 17510 1 2045 . 1 1 181 181 GLN CG C 13 34.333 0.40 . 1 . . . . . 178 GLN CG . 17510 1 2046 . 1 1 181 181 GLN N N 15 118.797 0.40 . 1 . . . . . 178 GLN N . 17510 1 2047 . 1 1 182 182 GLU H H 1 8.069 0.02 . 1 . . . . . 179 GLU H . 17510 1 2048 . 1 1 182 182 GLU HA H 1 4.188 0.02 . 1 . . . . . 179 GLU HA . 17510 1 2049 . 1 1 182 182 GLU C C 13 178.852 0.40 . 1 . . . . . 179 GLU C . 17510 1 2050 . 1 1 182 182 GLU CA C 13 59.485 0.40 . 1 . . . . . 179 GLU CA . 17510 1 2051 . 1 1 182 182 GLU CB C 13 28.968 0.40 . 1 . . . . . 179 GLU CB . 17510 1 2052 . 1 1 182 182 GLU N N 15 120.028 0.40 . 1 . . . . . 179 GLU N . 17510 1 2053 . 1 1 183 183 PHE H H 1 8.558 0.02 . 1 . . . . . 180 PHE H . 17510 1 2054 . 1 1 183 183 PHE HA H 1 4.033 0.02 . 1 . . . . . 180 PHE HA . 17510 1 2055 . 1 1 183 183 PHE HB2 H 1 3.138 0.02 . 2 . . . . . 180 PHE HB2 . 17510 1 2056 . 1 1 183 183 PHE HB3 H 1 3.210 0.02 . 2 . . . . . 180 PHE HB3 . 17510 1 2057 . 1 1 183 183 PHE HD1 H 1 7.282 0.02 . 3 . . . . . 180 PHE HD . 17510 1 2058 . 1 1 183 183 PHE HD2 H 1 7.282 0.02 . 3 . . . . . 180 PHE HD . 17510 1 2059 . 1 1 183 183 PHE HE1 H 1 7.298 0.02 . 3 . . . . . 180 PHE HE . 17510 1 2060 . 1 1 183 183 PHE HE2 H 1 7.298 0.02 . 3 . . . . . 180 PHE HE . 17510 1 2061 . 1 1 183 183 PHE C C 13 178.103 0.40 . 1 . . . . . 180 PHE C . 17510 1 2062 . 1 1 183 183 PHE CA C 13 62.685 0.40 . 1 . . . . . 180 PHE CA . 17510 1 2063 . 1 1 183 183 PHE CB C 13 39.481 0.40 . 1 . . . . . 180 PHE CB . 17510 1 2064 . 1 1 183 183 PHE CD1 C 13 131.950 0.40 . 3 . . . . . 180 PHE CD1 . 17510 1 2065 . 1 1 183 183 PHE N N 15 121.475 0.40 . 1 . . . . . 180 PHE N . 17510 1 2066 . 1 1 184 184 GLU H H 1 9.205 0.02 . 1 . . . . . 181 GLU H . 17510 1 2067 . 1 1 184 184 GLU HA H 1 4.111 0.02 . 1 . . . . . 181 GLU HA . 17510 1 2068 . 1 1 184 184 GLU HB2 H 1 2.084 0.02 . 2 . . . . . 181 GLU HB2 . 17510 1 2069 . 1 1 184 184 GLU HB3 H 1 2.429 0.02 . 2 . . . . . 181 GLU HB3 . 17510 1 2070 . 1 1 184 184 GLU HG2 H 1 2.802 0.02 . 2 . . . . . 181 GLU HG2 . 17510 1 2071 . 1 1 184 184 GLU HG3 H 1 2.516 0.02 . 2 . . . . . 181 GLU HG3 . 17510 1 2072 . 1 1 184 184 GLU C C 13 180.285 0.40 . 1 . . . . . 181 GLU C . 17510 1 2073 . 1 1 184 184 GLU CA C 13 60.421 0.40 . 1 . . . . . 181 GLU CA . 17510 1 2074 . 1 1 184 184 GLU CB C 13 30.444 0.40 . 1 . . . . . 181 GLU CB . 17510 1 2075 . 1 1 184 184 GLU CG C 13 37.828 0.40 . 1 . . . . . 181 GLU CG . 17510 1 2076 . 1 1 184 184 GLU N N 15 120.942 0.40 . 1 . . . . . 181 GLU N . 17510 1 2077 . 1 1 185 185 GLU H H 1 7.864 0.02 . 1 . . . . . 182 GLU H . 17510 1 2078 . 1 1 185 185 GLU HA H 1 4.159 0.02 . 1 . . . . . 182 GLU HA . 17510 1 2079 . 1 1 185 185 GLU C C 13 178.607 0.40 . 1 . . . . . 182 GLU C . 17510 1 2080 . 1 1 185 185 GLU CA C 13 59.090 0.40 . 1 . . . . . 182 GLU CA . 17510 1 2081 . 1 1 185 185 GLU CB C 13 29.417 0.40 . 1 . . . . . 182 GLU CB . 17510 1 2082 . 1 1 185 185 GLU N N 15 118.876 0.40 . 1 . . . . . 182 GLU N . 17510 1 2083 . 1 1 186 186 ARG H H 1 8.178 0.02 . 1 . . . . . 183 ARG H . 17510 1 2084 . 1 1 186 186 ARG HA H 1 4.204 0.02 . 1 . . . . . 183 ARG HA . 17510 1 2085 . 1 1 186 186 ARG C C 13 178.559 0.40 . 1 . . . . . 183 ARG C . 17510 1 2086 . 1 1 186 186 ARG CA C 13 58.913 0.40 . 1 . . . . . 183 ARG CA . 17510 1 2087 . 1 1 186 186 ARG CB C 13 30.897 0.40 . 1 . . . . . 183 ARG CB . 17510 1 2088 . 1 1 186 186 ARG N N 15 117.629 0.40 . 1 . . . . . 183 ARG N . 17510 1 2089 . 1 1 187 187 ARG H H 1 8.266 0.02 . 1 . . . . . 184 ARG H . 17510 1 2090 . 1 1 187 187 ARG HA H 1 4.399 0.02 . 1 . . . . . 184 ARG HA . 17510 1 2091 . 1 1 187 187 ARG HB2 H 1 1.818 0.02 . 2 . . . . . 184 ARG HB2 . 17510 1 2092 . 1 1 187 187 ARG HB3 H 1 1.897 0.02 . 2 . . . . . 184 ARG HB3 . 17510 1 2093 . 1 1 187 187 ARG HG2 H 1 1.330 0.02 . 2 . . . . . 184 ARG HG . 17510 1 2094 . 1 1 187 187 ARG HG3 H 1 1.330 0.02 . 2 . . . . . 184 ARG HG . 17510 1 2095 . 1 1 187 187 ARG HD2 H 1 3.088 0.02 . 2 . . . . . 184 ARG HD2 . 17510 1 2096 . 1 1 187 187 ARG HD3 H 1 3.024 0.02 . 2 . . . . . 184 ARG HD3 . 17510 1 2097 . 1 1 187 187 ARG C C 13 175.546 0.40 . 1 . . . . . 184 ARG C . 17510 1 2098 . 1 1 187 187 ARG CA C 13 54.411 0.40 . 1 . . . . . 184 ARG CA . 17510 1 2099 . 1 1 187 187 ARG CB C 13 29.887 0.40 . 1 . . . . . 184 ARG CB . 17510 1 2100 . 1 1 187 187 ARG CG C 13 26.824 0.40 . 1 . . . . . 184 ARG CG . 17510 1 2101 . 1 1 187 187 ARG CD C 13 42.395 0.40 . 1 . . . . . 184 ARG CD . 17510 1 2102 . 1 1 187 187 ARG N N 15 114.167 0.40 . 1 . . . . . 184 ARG N . 17510 1 2103 . 1 1 188 188 LYS H H 1 7.871 0.02 . 1 . . . . . 185 LYS H . 17510 1 2104 . 1 1 188 188 LYS HA H 1 4.072 0.02 . 1 . . . . . 185 LYS HA . 17510 1 2105 . 1 1 188 188 LYS HB2 H 1 1.672 0.02 . 2 . . . . . 185 LYS HB2 . 17510 1 2106 . 1 1 188 188 LYS HB3 H 1 1.776 0.02 . 2 . . . . . 185 LYS HB3 . 17510 1 2107 . 1 1 188 188 LYS HG2 H 1 1.362 0.02 . 2 . . . . . 185 LYS HG2 . 17510 1 2108 . 1 1 188 188 LYS HG3 H 1 1.407 0.02 . 2 . . . . . 185 LYS HG3 . 17510 1 2109 . 1 1 188 188 LYS C C 13 175.400 0.40 . 1 . . . . . 185 LYS C . 17510 1 2110 . 1 1 188 188 LYS CA C 13 56.524 0.40 . 1 . . . . . 185 LYS CA . 17510 1 2111 . 1 1 188 188 LYS CB C 13 28.893 0.40 . 1 . . . . . 185 LYS CB . 17510 1 2112 . 1 1 188 188 LYS CG C 13 24.884 0.40 . 1 . . . . . 185 LYS CG . 17510 1 2113 . 1 1 188 188 LYS N N 15 117.221 0.40 . 1 . . . . . 185 LYS N . 17510 1 2114 . 1 1 189 189 ARG H H 1 7.527 0.02 . 1 . . . . . 186 ARG H . 17510 1 2115 . 1 1 189 189 ARG HA H 1 4.755 0.02 . 1 . . . . . 186 ARG HA . 17510 1 2116 . 1 1 189 189 ARG HB2 H 1 1.525 0.02 . 2 . . . . . 186 ARG HB2 . 17510 1 2117 . 1 1 189 189 ARG HB3 H 1 1.965 0.02 . 2 . . . . . 186 ARG HB3 . 17510 1 2118 . 1 1 189 189 ARG HG2 H 1 1.711 0.02 . 2 . . . . . 186 ARG HG2 . 17510 1 2119 . 1 1 189 189 ARG HG3 H 1 1.674 0.02 . 2 . . . . . 186 ARG HG3 . 17510 1 2120 . 1 1 189 189 ARG HD2 H 1 3.368 0.02 . 2 . . . . . 186 ARG HD2 . 17510 1 2121 . 1 1 189 189 ARG HD3 H 1 3.131 0.02 . 2 . . . . . 186 ARG HD3 . 17510 1 2122 . 1 1 189 189 ARG C C 13 174.488 0.40 . 1 . . . . . 186 ARG C . 17510 1 2123 . 1 1 189 189 ARG CA C 13 53.981 0.40 . 1 . . . . . 186 ARG CA . 17510 1 2124 . 1 1 189 189 ARG CB C 13 34.222 0.40 . 1 . . . . . 186 ARG CB . 17510 1 2125 . 1 1 189 189 ARG CG C 13 27.381 0.40 . 1 . . . . . 186 ARG CG . 17510 1 2126 . 1 1 189 189 ARG CD C 13 43.434 0.40 . 1 . . . . . 186 ARG CD . 17510 1 2127 . 1 1 189 189 ARG N N 15 116.578 0.40 . 1 . . . . . 186 ARG N . 17510 1 2128 . 1 1 190 190 VAL H H 1 8.109 0.02 . 1 . . . . . 187 VAL H . 17510 1 2129 . 1 1 190 190 VAL HA H 1 4.122 0.02 . 1 . . . . . 187 VAL HA . 17510 1 2130 . 1 1 190 190 VAL HB H 1 1.929 0.02 . 1 . . . . . 187 VAL HB . 17510 1 2131 . 1 1 190 190 VAL HG11 H 1 0.908 0.02 . 1 . . . . . 187 VAL HG1 . 17510 1 2132 . 1 1 190 190 VAL HG12 H 1 0.908 0.02 . 1 . . . . . 187 VAL HG1 . 17510 1 2133 . 1 1 190 190 VAL HG13 H 1 0.908 0.02 . 1 . . . . . 187 VAL HG1 . 17510 1 2134 . 1 1 190 190 VAL HG21 H 1 1.007 0.02 . 1 . . . . . 187 VAL HG2 . 17510 1 2135 . 1 1 190 190 VAL HG22 H 1 1.007 0.02 . 1 . . . . . 187 VAL HG2 . 17510 1 2136 . 1 1 190 190 VAL HG23 H 1 1.007 0.02 . 1 . . . . . 187 VAL HG2 . 17510 1 2137 . 1 1 190 190 VAL C C 13 176.084 0.40 . 1 . . . . . 187 VAL C . 17510 1 2138 . 1 1 190 190 VAL CA C 13 62.577 0.40 . 1 . . . . . 187 VAL CA . 17510 1 2139 . 1 1 190 190 VAL CB C 13 33.043 0.40 . 1 . . . . . 187 VAL CB . 17510 1 2140 . 1 1 190 190 VAL CG1 C 13 21.113 0.40 . 1 . . . . . 187 VAL CG1 . 17510 1 2141 . 1 1 190 190 VAL CG2 C 13 21.592 0.40 . 1 . . . . . 187 VAL CG2 . 17510 1 2142 . 1 1 190 190 VAL N N 15 121.277 0.40 . 1 . . . . . 187 VAL N . 17510 1 2143 . 1 1 191 191 ILE H H 1 9.787 0.02 . 1 . . . . . 188 ILE H . 17510 1 2144 . 1 1 191 191 ILE HA H 1 4.883 0.02 . 1 . . . . . 188 ILE HA . 17510 1 2145 . 1 1 191 191 ILE HB H 1 1.964 0.02 . 1 . . . . . 188 ILE HB . 17510 1 2146 . 1 1 191 191 ILE HG12 H 1 1.578 0.02 . 2 . . . . . 188 ILE HG12 . 17510 1 2147 . 1 1 191 191 ILE HG13 H 1 1.407 0.02 . 2 . . . . . 188 ILE HG13 . 17510 1 2148 . 1 1 191 191 ILE HG21 H 1 0.849 0.02 . 1 . . . . . 188 ILE HG2 . 17510 1 2149 . 1 1 191 191 ILE HG22 H 1 0.849 0.02 . 1 . . . . . 188 ILE HG2 . 17510 1 2150 . 1 1 191 191 ILE HG23 H 1 0.849 0.02 . 1 . . . . . 188 ILE HG2 . 17510 1 2151 . 1 1 191 191 ILE HD11 H 1 0.860 0.02 . 1 . . . . . 188 ILE HD1 . 17510 1 2152 . 1 1 191 191 ILE HD12 H 1 0.860 0.02 . 1 . . . . . 188 ILE HD1 . 17510 1 2153 . 1 1 191 191 ILE HD13 H 1 0.860 0.02 . 1 . . . . . 188 ILE HD1 . 17510 1 2154 . 1 1 191 191 ILE C C 13 175.937 0.40 . 1 . . . . . 188 ILE C . 17510 1 2155 . 1 1 191 191 ILE CA C 13 58.951 0.40 . 1 . . . . . 188 ILE CA . 17510 1 2156 . 1 1 191 191 ILE CB C 13 39.246 0.40 . 1 . . . . . 188 ILE CB . 17510 1 2157 . 1 1 191 191 ILE CG1 C 13 27.803 0.40 . 1 . . . . . 188 ILE CG1 . 17510 1 2158 . 1 1 191 191 ILE CG2 C 13 17.652 0.40 . 1 . . . . . 188 ILE CG2 . 17510 1 2159 . 1 1 191 191 ILE CD1 C 13 13.207 0.40 . 1 . . . . . 188 ILE CD1 . 17510 1 2160 . 1 1 191 191 ILE N N 15 131.740 0.40 . 1 . . . . . 188 ILE N . 17510 1 2161 . 1 1 192 192 LEU H H 1 7.441 0.02 . 1 . . . . . 189 LEU H . 17510 1 2162 . 1 1 192 192 LEU HA H 1 4.526 0.02 . 1 . . . . . 189 LEU HA . 17510 1 2163 . 1 1 192 192 LEU HB2 H 1 1.028 0.02 . 2 . . . . . 189 LEU HB2 . 17510 1 2164 . 1 1 192 192 LEU HB3 H 1 0.773 0.02 . 2 . . . . . 189 LEU HB3 . 17510 1 2165 . 1 1 192 192 LEU HG H 1 1.625 0.02 . 1 . . . . . 189 LEU HG . 17510 1 2166 . 1 1 192 192 LEU HD11 H 1 0.471 0.02 . 1 . . . . . 189 LEU HD1 . 17510 1 2167 . 1 1 192 192 LEU HD12 H 1 0.471 0.02 . 1 . . . . . 189 LEU HD1 . 17510 1 2168 . 1 1 192 192 LEU HD13 H 1 0.471 0.02 . 1 . . . . . 189 LEU HD1 . 17510 1 2169 . 1 1 192 192 LEU HD21 H 1 0.757 0.02 . 1 . . . . . 189 LEU HD2 . 17510 1 2170 . 1 1 192 192 LEU HD22 H 1 0.757 0.02 . 1 . . . . . 189 LEU HD2 . 17510 1 2171 . 1 1 192 192 LEU HD23 H 1 0.757 0.02 . 1 . . . . . 189 LEU HD2 . 17510 1 2172 . 1 1 192 192 LEU C C 13 175.742 0.40 . 1 . . . . . 189 LEU C . 17510 1 2173 . 1 1 192 192 LEU CA C 13 54.133 0.40 . 1 . . . . . 189 LEU CA . 17510 1 2174 . 1 1 192 192 LEU CB C 13 41.883 0.40 . 1 . . . . . 189 LEU CB . 17510 1 2175 . 1 1 192 192 LEU CG C 13 26.051 0.40 . 1 . . . . . 189 LEU CG . 17510 1 2176 . 1 1 192 192 LEU CD1 C 13 25.257 0.40 . 1 . . . . . 189 LEU CD1 . 17510 1 2177 . 1 1 192 192 LEU CD2 C 13 22.377 0.40 . 1 . . . . . 189 LEU CD2 . 17510 1 2178 . 1 1 192 192 LEU N N 15 126.597 0.40 . 1 . . . . . 189 LEU N . 17510 1 2179 . 1 1 193 193 HIS H H 1 8.409 0.02 . 1 . . . . . 190 HIS H . 17510 1 2180 . 1 1 193 193 HIS HA H 1 6.246 0.02 . 1 . . . . . 190 HIS HA . 17510 1 2181 . 1 1 193 193 HIS HB2 H 1 2.958 0.02 . 2 . . . . . 190 HIS HB2 . 17510 1 2182 . 1 1 193 193 HIS HB3 H 1 3.015 0.02 . 2 . . . . . 190 HIS HB3 . 17510 1 2183 . 1 1 193 193 HIS HD2 H 1 6.979 0.02 . 1 . . . . . 190 HIS HD2 . 17510 1 2184 . 1 1 193 193 HIS HE1 H 1 7.888 0.02 . 1 . . . . . 190 HIS HE1 . 17510 1 2185 . 1 1 193 193 HIS C C 13 174.227 0.40 . 1 . . . . . 190 HIS C . 17510 1 2186 . 1 1 193 193 HIS CA C 13 54.461 0.40 . 1 . . . . . 190 HIS CA . 17510 1 2187 . 1 1 193 193 HIS CB C 13 36.082 0.40 . 1 . . . . . 190 HIS CB . 17510 1 2188 . 1 1 193 193 HIS N N 15 119.717 0.40 . 1 . . . . . 190 HIS N . 17510 1 2189 . 1 1 194 194 SER H H 1 9.296 0.02 . 1 . . . . . 191 SER H . 17510 1 2190 . 1 1 194 194 SER HA H 1 4.473 0.02 . 1 . . . . . 191 SER HA . 17510 1 2191 . 1 1 194 194 SER HB2 H 1 3.651 0.02 . 2 . . . . . 191 SER HB2 . 17510 1 2192 . 1 1 194 194 SER HB3 H 1 3.449 0.02 . 2 . . . . . 191 SER HB3 . 17510 1 2193 . 1 1 194 194 SER C C 13 171.150 0.40 . 1 . . . . . 191 SER C . 17510 1 2194 . 1 1 194 194 SER CA C 13 58.198 0.40 . 1 . . . . . 191 SER CA . 17510 1 2195 . 1 1 194 194 SER CB C 13 67.357 0.40 . 1 . . . . . 191 SER CB . 17510 1 2196 . 1 1 194 194 SER N N 15 122.715 0.40 . 1 . . . . . 191 SER N . 17510 1 2197 . 1 1 195 195 VAL H H 1 8.275 0.02 . 1 . . . . . 192 VAL H . 17510 1 2198 . 1 1 195 195 VAL HA H 1 4.435 0.02 . 1 . . . . . 192 VAL HA . 17510 1 2199 . 1 1 195 195 VAL HB H 1 1.809 0.02 . 1 . . . . . 192 VAL HB . 17510 1 2200 . 1 1 195 195 VAL HG11 H 1 0.437 0.02 . 1 . . . . . 192 VAL HG1 . 17510 1 2201 . 1 1 195 195 VAL HG12 H 1 0.437 0.02 . 1 . . . . . 192 VAL HG1 . 17510 1 2202 . 1 1 195 195 VAL HG13 H 1 0.437 0.02 . 1 . . . . . 192 VAL HG1 . 17510 1 2203 . 1 1 195 195 VAL HG21 H 1 0.786 0.02 . 1 . . . . . 192 VAL HG2 . 17510 1 2204 . 1 1 195 195 VAL HG22 H 1 0.786 0.02 . 1 . . . . . 192 VAL HG2 . 17510 1 2205 . 1 1 195 195 VAL HG23 H 1 0.786 0.02 . 1 . . . . . 192 VAL HG2 . 17510 1 2206 . 1 1 195 195 VAL C C 13 174.553 0.40 . 1 . . . . . 192 VAL C . 17510 1 2207 . 1 1 195 195 VAL CA C 13 61.562 0.40 . 1 . . . . . 192 VAL CA . 17510 1 2208 . 1 1 195 195 VAL CB C 13 32.338 0.40 . 1 . . . . . 192 VAL CB . 17510 1 2209 . 1 1 195 195 VAL CG1 C 13 20.858 0.40 . 1 . . . . . 192 VAL CG1 . 17510 1 2210 . 1 1 195 195 VAL CG2 C 13 21.615 0.40 . 1 . . . . . 192 VAL CG2 . 17510 1 2211 . 1 1 195 195 VAL N N 15 123.302 0.40 . 1 . . . . . 192 VAL N . 17510 1 2212 . 1 1 196 196 LEU H H 1 8.324 0.02 . 1 . . . . . 193 LEU H . 17510 1 2213 . 1 1 196 196 LEU HA H 1 4.583 0.02 . 1 . . . . . 193 LEU HA . 17510 1 2214 . 1 1 196 196 LEU HB2 H 1 1.526 0.02 . 2 . . . . . 193 LEU HB2 . 17510 1 2215 . 1 1 196 196 LEU HB3 H 1 1.185 0.02 . 2 . . . . . 193 LEU HB3 . 17510 1 2216 . 1 1 196 196 LEU HG H 1 1.532 0.02 . 1 . . . . . 193 LEU HG . 17510 1 2217 . 1 1 196 196 LEU HD11 H 1 0.883 0.02 . 1 . . . . . 193 LEU HD1 . 17510 1 2218 . 1 1 196 196 LEU HD12 H 1 0.883 0.02 . 1 . . . . . 193 LEU HD1 . 17510 1 2219 . 1 1 196 196 LEU HD13 H 1 0.883 0.02 . 1 . . . . . 193 LEU HD1 . 17510 1 2220 . 1 1 196 196 LEU HD21 H 1 0.911 0.02 . 1 . . . . . 193 LEU HD2 . 17510 1 2221 . 1 1 196 196 LEU HD22 H 1 0.911 0.02 . 1 . . . . . 193 LEU HD2 . 17510 1 2222 . 1 1 196 196 LEU HD23 H 1 0.911 0.02 . 1 . . . . . 193 LEU HD2 . 17510 1 2223 . 1 1 196 196 LEU C C 13 173.739 0.40 . 1 . . . . . 193 LEU C . 17510 1 2224 . 1 1 196 196 LEU CA C 13 52.317 0.40 . 1 . . . . . 193 LEU CA . 17510 1 2225 . 1 1 196 196 LEU CB C 13 44.116 0.40 . 1 . . . . . 193 LEU CB . 17510 1 2226 . 1 1 196 196 LEU CG C 13 28.112 0.40 . 1 . . . . . 193 LEU CG . 17510 1 2227 . 1 1 196 196 LEU CD1 C 13 26.851 0.40 . 1 . . . . . 193 LEU CD1 . 17510 1 2228 . 1 1 196 196 LEU CD2 C 13 24.313 0.40 . 1 . . . . . 193 LEU CD2 . 17510 1 2229 . 1 1 196 196 LEU N N 15 130.177 0.40 . 1 . . . . . 193 LEU N . 17510 1 2230 . 1 1 197 197 PHE H H 1 7.978 0.02 . 1 . . . . . 194 PHE H . 17510 1 2231 . 1 1 197 197 PHE HA H 1 5.296 0.02 . 1 . . . . . 194 PHE HA . 17510 1 2232 . 1 1 197 197 PHE HB2 H 1 2.921 0.02 . 2 . . . . . 194 PHE HB2 . 17510 1 2233 . 1 1 197 197 PHE HB3 H 1 2.731 0.02 . 2 . . . . . 194 PHE HB3 . 17510 1 2234 . 1 1 197 197 PHE HD1 H 1 6.921 0.02 . 3 . . . . . 194 PHE HD . 17510 1 2235 . 1 1 197 197 PHE HD2 H 1 6.921 0.02 . 3 . . . . . 194 PHE HD . 17510 1 2236 . 1 1 197 197 PHE HE1 H 1 7.225 0.02 . 3 . . . . . 194 PHE HE . 17510 1 2237 . 1 1 197 197 PHE HE2 H 1 7.225 0.02 . 3 . . . . . 194 PHE HE . 17510 1 2238 . 1 1 197 197 PHE C C 13 176.914 0.40 . 1 . . . . . 194 PHE C . 17510 1 2239 . 1 1 197 197 PHE CA C 13 57.197 0.40 . 1 . . . . . 194 PHE CA . 17510 1 2240 . 1 1 197 197 PHE CB C 13 42.336 0.40 . 1 . . . . . 194 PHE CB . 17510 1 2241 . 1 1 197 197 PHE CD1 C 13 131.729 0.40 . 3 . . . . . 194 PHE CD1 . 17510 1 2242 . 1 1 197 197 PHE N N 15 114.277 0.40 . 1 . . . . . 194 PHE N . 17510 1 2243 . 1 1 198 198 TYR H H 1 9.018 0.02 . 1 . . . . . 195 TYR H . 17510 1 2244 . 1 1 198 198 TYR HA H 1 4.521 0.02 . 1 . . . . . 195 TYR HA . 17510 1 2245 . 1 1 198 198 TYR HB2 H 1 3.479 0.02 . 2 . . . . . 195 TYR HB2 . 17510 1 2246 . 1 1 198 198 TYR HB3 H 1 2.717 0.02 . 2 . . . . . 195 TYR HB3 . 17510 1 2247 . 1 1 198 198 TYR HD1 H 1 7.145 0.02 . 3 . . . . . 195 TYR HD . 17510 1 2248 . 1 1 198 198 TYR HD2 H 1 7.145 0.02 . 3 . . . . . 195 TYR HD . 17510 1 2249 . 1 1 198 198 TYR HE1 H 1 7.287 0.02 . 3 . . . . . 195 TYR HE . 17510 1 2250 . 1 1 198 198 TYR HE2 H 1 7.287 0.02 . 3 . . . . . 195 TYR HE . 17510 1 2251 . 1 1 198 198 TYR C C 13 182.190 0.40 . 1 . . . . . 195 TYR C . 17510 1 2252 . 1 1 198 198 TYR CA C 13 60.430 0.40 . 1 . . . . . 195 TYR CA . 17510 1 2253 . 1 1 198 198 TYR CB C 13 40.481 0.40 . 1 . . . . . 195 TYR CB . 17510 1 2254 . 1 1 198 198 TYR CD1 C 13 133.390 0.40 . 3 . . . . . 195 TYR CD1 . 17510 1 2255 . 1 1 198 198 TYR N N 15 128.898 0.40 . 1 . . . . . 195 TYR N . 17510 1 stop_ save_