data_16876 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16876 _Entry.Title ; 1HN, 1HA, 13CA, 13CB, 13CO and 15N Chemical Shift Assignments for Intrinsically Disordered Dehydrin ERD14 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-04-16 _Entry.Accession_date 2010-04-16 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details 'Intrinsically disordered dehydrin ERD14 under near-native conditions (10mM MES buffer, pH6.54)' _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Bianka 'Szalaine Agoston' . . . 16876 2 Peter Tompa . . . 16876 3 Andras Perczel . . . 16876 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Protein Modelling Group, HAS and ELU, Budapest' . 16876 2 . 'Institute of Enzymology, BRC, HAS, Budapest' . 16876 3 . 'Laboratory of Structural Chemistry and Biology, Inst. of Chem., ELU, Budapest' . 16876 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16876 heteronucl_NOEs 1 16876 heteronucl_T1_relaxation 1 16876 heteronucl_T1rho_relaxation 1 16876 heteronucl_T2_relaxation 1 16876 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 532 16876 '15N chemical shifts' 182 16876 '1H chemical shifts' 328 16876 'heteronuclear NOE values' 167 16876 'T1 relaxation values' 167 16876 'T1rho relaxation values' 167 16876 'T2 relaxation values' 167 16876 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 . . 2012-03-14 2010-04-16 update BMRB 'update entry citation' 16876 1 . . 2011-05-05 2010-04-16 original author 'original release' 16876 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16876 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21336827 _Citation.Full_citation . _Citation.Title 'Full backbone assignment and dynamics of the intrinsically disordered dehydrin ERD14.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 5 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 189 _Citation.Page_last 193 _Citation.Year 2011 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Bianka 'Szalaine Agoston' . . . 16876 1 2 Denes Kovacs . . . 16876 1 3 Peter Tompa . . . 16876 1 4 Andras Perczel . . . 16876 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID Dehydrin 16876 1 ERD14 16876 1 'intrinsically disordered' 16876 1 IUP 16876 1 NMR 16876 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16876 _Assembly.ID 1 _Assembly.Name ERD14 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 20786.3 _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 ERD14 1 $ERD14 A . yes native no no . . . 16876 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_ERD14 _Entity.Sf_category entity _Entity.Sf_framecode ERD14 _Entity.Entry_ID 16876 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name ERD14 _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 ; MAEEIKNVPEQEVPKVATEE SSAEVTDRGLFDFLGKKKDE TKPEETPIASEFEQKVHISE PEPEVKHESLLEKLHRSDSS SSSSSEEEGSDGEKRKKKKE KKKPTTEVEVKEEEKKGFME KLKEKLPGHKKPEDGSAVAA APVVVPPPVEEAHPVEKKGI LEKIKEKLPGYHPKTTVEEE KKDKE ; _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 185 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 20786.3 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 26636 . ERD14 . . . . . 100.00 185 100.00 100.00 9.12e-118 . . . . 16876 1 2 no DBJ BAA04569 . "ERD14 protein [Arabidopsis thaliana]" . . . . . 100.00 185 100.00 100.00 9.12e-118 . . . . 16876 1 3 no DBJ BAE98985 . "hypothetical protein [Arabidopsis thaliana]" . . . . . 100.00 185 100.00 100.00 9.12e-118 . . . . 16876 1 4 no GB AAF17644 . "T23E18.12 [Arabidopsis thaliana]" . . . . . 100.00 185 100.00 100.00 9.12e-118 . . . . 16876 1 5 no GB AAG40050 . "At1g76180 [Arabidopsis thaliana]" . . . . . 100.00 185 99.46 99.46 2.08e-116 . . . . 16876 1 6 no GB AAG41486 . "putative dehydrin protein [Arabidopsis thaliana]" . . . . . 100.00 185 100.00 100.00 9.12e-118 . . . . 16876 1 7 no GB AAK00404 . "putative dehydrin protein [Arabidopsis thaliana]" . . . . . 100.00 185 100.00 100.00 9.12e-118 . . . . 16876 1 8 no GB AAK62649 . "At1g76180/T23E18_36 [Arabidopsis thaliana]" . . . . . 100.00 185 100.00 100.00 9.12e-118 . . . . 16876 1 9 no REF NP_001185408 . "dehydrin ERD14 [Arabidopsis thaliana]" . . . . . 100.00 185 100.00 100.00 9.12e-118 . . . . 16876 1 10 no REF NP_177745 . "dehydrin ERD14 [Arabidopsis thaliana]" . . . . . 100.00 185 100.00 100.00 9.12e-118 . . . . 16876 1 11 no SP P42763 . "RecName: Full=Dehydrin ERD14" . . . . . 100.00 185 100.00 100.00 9.12e-118 . . . . 16876 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID Chaperone 16876 1 'Stress Response' 16876 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 . MET . 16876 1 2 . ALA . 16876 1 3 . GLU . 16876 1 4 . GLU . 16876 1 5 . ILE . 16876 1 6 . LYS . 16876 1 7 . ASN . 16876 1 8 . VAL . 16876 1 9 . PRO . 16876 1 10 . GLU . 16876 1 11 . GLN . 16876 1 12 . GLU . 16876 1 13 . VAL . 16876 1 14 . PRO . 16876 1 15 . LYS . 16876 1 16 . VAL . 16876 1 17 . ALA . 16876 1 18 . THR . 16876 1 19 . GLU . 16876 1 20 . GLU . 16876 1 21 . SER . 16876 1 22 . SER . 16876 1 23 . ALA . 16876 1 24 . GLU . 16876 1 25 . VAL . 16876 1 26 . THR . 16876 1 27 . ASP . 16876 1 28 . ARG . 16876 1 29 . GLY . 16876 1 30 . LEU . 16876 1 31 . PHE . 16876 1 32 . ASP . 16876 1 33 . PHE . 16876 1 34 . LEU . 16876 1 35 . GLY . 16876 1 36 . LYS . 16876 1 37 . LYS . 16876 1 38 . LYS . 16876 1 39 . ASP . 16876 1 40 . GLU . 16876 1 41 . THR . 16876 1 42 . LYS . 16876 1 43 . PRO . 16876 1 44 . GLU . 16876 1 45 . GLU . 16876 1 46 . THR . 16876 1 47 . PRO . 16876 1 48 . ILE . 16876 1 49 . ALA . 16876 1 50 . SER . 16876 1 51 . GLU . 16876 1 52 . PHE . 16876 1 53 . GLU . 16876 1 54 . GLN . 16876 1 55 . LYS . 16876 1 56 . VAL . 16876 1 57 . HIS . 16876 1 58 . ILE . 16876 1 59 . SER . 16876 1 60 . GLU . 16876 1 61 . PRO . 16876 1 62 . GLU . 16876 1 63 . PRO . 16876 1 64 . GLU . 16876 1 65 . VAL . 16876 1 66 . LYS . 16876 1 67 . HIS . 16876 1 68 . GLU . 16876 1 69 . SER . 16876 1 70 . LEU . 16876 1 71 . LEU . 16876 1 72 . GLU . 16876 1 73 . LYS . 16876 1 74 . LEU . 16876 1 75 . HIS . 16876 1 76 . ARG . 16876 1 77 . SER . 16876 1 78 . ASP . 16876 1 79 . SER . 16876 1 80 . SER . 16876 1 81 . SER . 16876 1 82 . SER . 16876 1 83 . SER . 16876 1 84 . SER . 16876 1 85 . SER . 16876 1 86 . GLU . 16876 1 87 . GLU . 16876 1 88 . GLU . 16876 1 89 . GLY . 16876 1 90 . SER . 16876 1 91 . ASP . 16876 1 92 . GLY . 16876 1 93 . GLU . 16876 1 94 . LYS . 16876 1 95 . ARG . 16876 1 96 . LYS . 16876 1 97 . LYS . 16876 1 98 . LYS . 16876 1 99 . LYS . 16876 1 100 . GLU . 16876 1 101 . LYS . 16876 1 102 . LYS . 16876 1 103 . LYS . 16876 1 104 . PRO . 16876 1 105 . THR . 16876 1 106 . THR . 16876 1 107 . GLU . 16876 1 108 . VAL . 16876 1 109 . GLU . 16876 1 110 . VAL . 16876 1 111 . LYS . 16876 1 112 . GLU . 16876 1 113 . GLU . 16876 1 114 . GLU . 16876 1 115 . LYS . 16876 1 116 . LYS . 16876 1 117 . GLY . 16876 1 118 . PHE . 16876 1 119 . MET . 16876 1 120 . GLU . 16876 1 121 . LYS . 16876 1 122 . LEU . 16876 1 123 . LYS . 16876 1 124 . GLU . 16876 1 125 . LYS . 16876 1 126 . LEU . 16876 1 127 . PRO . 16876 1 128 . GLY . 16876 1 129 . HIS . 16876 1 130 . LYS . 16876 1 131 . LYS . 16876 1 132 . PRO . 16876 1 133 . GLU . 16876 1 134 . ASP . 16876 1 135 . GLY . 16876 1 136 . SER . 16876 1 137 . ALA . 16876 1 138 . VAL . 16876 1 139 . ALA . 16876 1 140 . ALA . 16876 1 141 . ALA . 16876 1 142 . PRO . 16876 1 143 . VAL . 16876 1 144 . VAL . 16876 1 145 . VAL . 16876 1 146 . PRO . 16876 1 147 . PRO . 16876 1 148 . PRO . 16876 1 149 . VAL . 16876 1 150 . GLU . 16876 1 151 . GLU . 16876 1 152 . ALA . 16876 1 153 . HIS . 16876 1 154 . PRO . 16876 1 155 . VAL . 16876 1 156 . GLU . 16876 1 157 . LYS . 16876 1 158 . LYS . 16876 1 159 . GLY . 16876 1 160 . ILE . 16876 1 161 . LEU . 16876 1 162 . GLU . 16876 1 163 . LYS . 16876 1 164 . ILE . 16876 1 165 . LYS . 16876 1 166 . GLU . 16876 1 167 . LYS . 16876 1 168 . LEU . 16876 1 169 . PRO . 16876 1 170 . GLY . 16876 1 171 . TYR . 16876 1 172 . HIS . 16876 1 173 . PRO . 16876 1 174 . LYS . 16876 1 175 . THR . 16876 1 176 . THR . 16876 1 177 . VAL . 16876 1 178 . GLU . 16876 1 179 . GLU . 16876 1 180 . GLU . 16876 1 181 . LYS . 16876 1 182 . LYS . 16876 1 183 . ASP . 16876 1 184 . LYS . 16876 1 185 . GLU . 16876 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 16876 1 . ALA 2 2 16876 1 . GLU 3 3 16876 1 . GLU 4 4 16876 1 . ILE 5 5 16876 1 . LYS 6 6 16876 1 . ASN 7 7 16876 1 . VAL 8 8 16876 1 . PRO 9 9 16876 1 . GLU 10 10 16876 1 . GLN 11 11 16876 1 . GLU 12 12 16876 1 . VAL 13 13 16876 1 . PRO 14 14 16876 1 . LYS 15 15 16876 1 . VAL 16 16 16876 1 . ALA 17 17 16876 1 . THR 18 18 16876 1 . GLU 19 19 16876 1 . GLU 20 20 16876 1 . SER 21 21 16876 1 . SER 22 22 16876 1 . ALA 23 23 16876 1 . GLU 24 24 16876 1 . VAL 25 25 16876 1 . THR 26 26 16876 1 . ASP 27 27 16876 1 . ARG 28 28 16876 1 . GLY 29 29 16876 1 . LEU 30 30 16876 1 . PHE 31 31 16876 1 . ASP 32 32 16876 1 . PHE 33 33 16876 1 . LEU 34 34 16876 1 . GLY 35 35 16876 1 . LYS 36 36 16876 1 . LYS 37 37 16876 1 . LYS 38 38 16876 1 . ASP 39 39 16876 1 . GLU 40 40 16876 1 . THR 41 41 16876 1 . LYS 42 42 16876 1 . PRO 43 43 16876 1 . GLU 44 44 16876 1 . GLU 45 45 16876 1 . THR 46 46 16876 1 . PRO 47 47 16876 1 . ILE 48 48 16876 1 . ALA 49 49 16876 1 . SER 50 50 16876 1 . GLU 51 51 16876 1 . PHE 52 52 16876 1 . GLU 53 53 16876 1 . GLN 54 54 16876 1 . LYS 55 55 16876 1 . VAL 56 56 16876 1 . HIS 57 57 16876 1 . ILE 58 58 16876 1 . SER 59 59 16876 1 . GLU 60 60 16876 1 . PRO 61 61 16876 1 . GLU 62 62 16876 1 . PRO 63 63 16876 1 . GLU 64 64 16876 1 . VAL 65 65 16876 1 . LYS 66 66 16876 1 . HIS 67 67 16876 1 . GLU 68 68 16876 1 . SER 69 69 16876 1 . LEU 70 70 16876 1 . LEU 71 71 16876 1 . GLU 72 72 16876 1 . LYS 73 73 16876 1 . LEU 74 74 16876 1 . HIS 75 75 16876 1 . ARG 76 76 16876 1 . SER 77 77 16876 1 . ASP 78 78 16876 1 . SER 79 79 16876 1 . SER 80 80 16876 1 . SER 81 81 16876 1 . SER 82 82 16876 1 . SER 83 83 16876 1 . SER 84 84 16876 1 . SER 85 85 16876 1 . GLU 86 86 16876 1 . GLU 87 87 16876 1 . GLU 88 88 16876 1 . GLY 89 89 16876 1 . SER 90 90 16876 1 . ASP 91 91 16876 1 . GLY 92 92 16876 1 . GLU 93 93 16876 1 . LYS 94 94 16876 1 . ARG 95 95 16876 1 . LYS 96 96 16876 1 . LYS 97 97 16876 1 . LYS 98 98 16876 1 . LYS 99 99 16876 1 . GLU 100 100 16876 1 . LYS 101 101 16876 1 . LYS 102 102 16876 1 . LYS 103 103 16876 1 . PRO 104 104 16876 1 . THR 105 105 16876 1 . THR 106 106 16876 1 . GLU 107 107 16876 1 . VAL 108 108 16876 1 . GLU 109 109 16876 1 . VAL 110 110 16876 1 . LYS 111 111 16876 1 . GLU 112 112 16876 1 . GLU 113 113 16876 1 . GLU 114 114 16876 1 . LYS 115 115 16876 1 . LYS 116 116 16876 1 . GLY 117 117 16876 1 . PHE 118 118 16876 1 . MET 119 119 16876 1 . GLU 120 120 16876 1 . LYS 121 121 16876 1 . LEU 122 122 16876 1 . LYS 123 123 16876 1 . GLU 124 124 16876 1 . LYS 125 125 16876 1 . LEU 126 126 16876 1 . PRO 127 127 16876 1 . GLY 128 128 16876 1 . HIS 129 129 16876 1 . LYS 130 130 16876 1 . LYS 131 131 16876 1 . PRO 132 132 16876 1 . GLU 133 133 16876 1 . ASP 134 134 16876 1 . GLY 135 135 16876 1 . SER 136 136 16876 1 . ALA 137 137 16876 1 . VAL 138 138 16876 1 . ALA 139 139 16876 1 . ALA 140 140 16876 1 . ALA 141 141 16876 1 . PRO 142 142 16876 1 . VAL 143 143 16876 1 . VAL 144 144 16876 1 . VAL 145 145 16876 1 . PRO 146 146 16876 1 . PRO 147 147 16876 1 . PRO 148 148 16876 1 . VAL 149 149 16876 1 . GLU 150 150 16876 1 . GLU 151 151 16876 1 . ALA 152 152 16876 1 . HIS 153 153 16876 1 . PRO 154 154 16876 1 . VAL 155 155 16876 1 . GLU 156 156 16876 1 . LYS 157 157 16876 1 . LYS 158 158 16876 1 . GLY 159 159 16876 1 . ILE 160 160 16876 1 . LEU 161 161 16876 1 . GLU 162 162 16876 1 . LYS 163 163 16876 1 . ILE 164 164 16876 1 . LYS 165 165 16876 1 . GLU 166 166 16876 1 . LYS 167 167 16876 1 . LEU 168 168 16876 1 . PRO 169 169 16876 1 . GLY 170 170 16876 1 . TYR 171 171 16876 1 . HIS 172 172 16876 1 . PRO 173 173 16876 1 . LYS 174 174 16876 1 . THR 175 175 16876 1 . THR 176 176 16876 1 . VAL 177 177 16876 1 . GLU 178 178 16876 1 . GLU 179 179 16876 1 . GLU 180 180 16876 1 . LYS 181 181 16876 1 . LYS 182 182 16876 1 . ASP 183 183 16876 1 . LYS 184 184 16876 1 . GLU 185 185 16876 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 16876 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $ERD14 . 3702 organism . 'Arabidopsis thaliana' 'Thale cress' . . Eukaryota Viridiplantae Arabidopsis thaliana . . . . . . . . . . . . . . . . . . 'ERD14 is expressed uniformly under stress conditions such as high salinity, dehydration and cold.' . . 16876 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 16876 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $ERD14 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 Star (DE3)pLysS' . . . . . . . . . . . . . . . pET23b . . . 'Vector_name_details: no His-tag because of a stop codon introduced at the end of the protein sequence.' . . 16876 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16876 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 ERD14 '[U-99% 13C; U-99% 15N]' . . 1 $ERD14 . . 1 . . mM . . . . 16876 1 2 MES 'natural abundance' . . . . . . 10 . . mM . . . . 16876 1 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16876 1 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 16876 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 16876 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 ERD14 '[U-99% 15N]' . . 1 $ERD14 . . 1 . . mM . . . . 16876 2 2 MES 'natural abundance' . . . . . . 10 . . mM . . . . 16876 2 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16876 2 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 16876 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 16876 _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' 10 . mM 16876 1 pH 6.54 . pH 16876 1 pressure 1 . atm 16876 1 temperature 288 . K 16876 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 16876 _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 16876 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 16876 1 processing 16876 1 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 16876 _Software.ID 2 _Software.Name CARA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Swiss NMR' . www.nmr.ch 16876 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 16876 2 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 16876 _Software.ID 3 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 16876 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 16876 3 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 16876 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 16876 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 16876 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 16876 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 800 . . . 16876 1 2 spectrometer_2 Bruker Avance . 600 . . . 16876 1 3 spectrometer_3 Bruker DRX . 600 . . . 16876 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 16876 _Experiment_list.ID 1 _Experiment_list.Details 'TROSY versions of all experiments used.' loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16876 1 2 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16876 1 3 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16876 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16876 1 5 '3D HN(CO)CACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16876 1 6 '3D HNN' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16876 1 7 '3D HN(CA)N' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16876 1 8 '3D HNN-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16876 1 9 '13C-det. H(CA)CON' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16876 1 10 R1-measurement no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16876 1 11 'hetNOE measurement' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16876 1 12 'R2 measurement' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 16876 1 13 'R1rho measurement' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 16876 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 16876 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 16876 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 16876 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 16876 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_ERD14 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_ERD14 _Assigned_chem_shift_list.Entry_ID 16876 _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' . . . 16876 1 2 '3D HNCO' . . . 16876 1 3 '3D HN(CA)CO' . . . 16876 1 4 '3D HNCACB' . . . 16876 1 5 '3D HN(CO)CACB' . . . 16876 1 6 '3D HNN' . . . 16876 1 7 '3D HN(CA)N' . . . 16876 1 8 '3D HNN-COSY' . . . 16876 1 9 '13C-det. H(CA)CON' . . . 16876 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $TOPSPIN . . 16876 1 2 $CARA . . 16876 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 GLU H H 1 8.745 . . 1 . . . . 3 GLU H . 16876 1 2 . 1 1 3 3 GLU HA H 1 4.31 . . 1 . . . . 3 GLU HA . 16876 1 3 . 1 1 3 3 GLU N N 15 120.478 . . 1 . . . . 3 GLU N . 16876 1 4 . 1 1 4 4 GLU H H 1 8.686 . . 1 . . . . 4 GLU H . 16876 1 5 . 1 1 4 4 GLU HA H 1 4.275 . . 1 . . . . 4 GLU HA . 16876 1 6 . 1 1 4 4 GLU C C 13 176.21 . . 1 . . . . 4 GLU C . 16876 1 7 . 1 1 4 4 GLU CA C 13 56.284 . . 1 . . . . 4 GLU CA . 16876 1 8 . 1 1 4 4 GLU CB C 13 30.237 . . 1 . . . . 4 GLU CB . 16876 1 9 . 1 1 4 4 GLU N N 15 123.468 . . 1 . . . . 4 GLU N . 16876 1 10 . 1 1 5 5 ILE H H 1 8.441 . . 1 . . . . 5 ILE H . 16876 1 11 . 1 1 5 5 ILE HA H 1 4.118 . . 1 . . . . 5 ILE HA . 16876 1 12 . 1 1 5 5 ILE C C 13 176.16 . . 1 . . . . 5 ILE C . 16876 1 13 . 1 1 5 5 ILE CA C 13 60.904 . . 1 . . . . 5 ILE CA . 16876 1 14 . 1 1 5 5 ILE CB C 13 38.278 . . 1 . . . . 5 ILE CB . 16876 1 15 . 1 1 5 5 ILE N N 15 124.002 . . 1 . . . . 5 ILE N . 16876 1 16 . 1 1 6 6 LYS H H 1 8.53 . . 1 . . . . 6 LYS H . 16876 1 17 . 1 1 6 6 LYS HA H 1 4.354 . . 1 . . . . 6 LYS HA . 16876 1 18 . 1 1 6 6 LYS C C 13 176.004 . . 1 . . . . 6 LYS C . 16876 1 19 . 1 1 6 6 LYS CA C 13 55.863 . . 1 . . . . 6 LYS CA . 16876 1 20 . 1 1 6 6 LYS CB C 13 33.178 . . 1 . . . . 6 LYS CB . 16876 1 21 . 1 1 6 6 LYS N N 15 126.489 . . 1 . . . . 6 LYS N . 16876 1 22 . 1 1 7 7 ASN H H 1 8.564 . . 1 . . . . 7 ASN H . 16876 1 23 . 1 1 7 7 ASN HA H 1 4.692 . . 1 . . . . 7 ASN HA . 16876 1 24 . 1 1 7 7 ASN C C 13 174.695 . . 1 . . . . 7 ASN C . 16876 1 25 . 1 1 7 7 ASN CA C 13 53.108 . . 1 . . . . 7 ASN CA . 16876 1 26 . 1 1 7 7 ASN CB C 13 38.922 . . 1 . . . . 7 ASN CB . 16876 1 27 . 1 1 7 7 ASN N N 15 120.771 . . 1 . . . . 7 ASN N . 16876 1 28 . 1 1 8 8 VAL H H 1 8.224 . . 1 . . . . 8 VAL H . 16876 1 29 . 1 1 8 8 VAL HA H 1 4.412 . . 1 . . . . 8 VAL HA . 16876 1 30 . 1 1 8 8 VAL C C 13 174.376 . . 1 . . . . 8 VAL C . 16876 1 31 . 1 1 8 8 VAL CA C 13 59.79 . . 1 . . . . 8 VAL CA . 16876 1 32 . 1 1 8 8 VAL CB C 13 32.533 . . 1 . . . . 8 VAL CB . 16876 1 33 . 1 1 8 8 VAL N N 15 122.26 . . 1 . . . . 8 VAL N . 16876 1 34 . 1 1 9 9 PRO HA H 1 4.397 . . 1 . . . . 9 PRO HA . 16876 1 35 . 1 1 9 9 PRO C C 13 177.017 . . 1 . . . . 9 PRO C . 16876 1 36 . 1 1 9 9 PRO CA C 13 63.046 . . 1 . . . . 9 PRO CA . 16876 1 37 . 1 1 9 9 PRO CB C 13 32.07 . . 1 . . . . 9 PRO CB . 16876 1 38 . 1 1 9 9 PRO N N 15 139.429 . . 1 . . . . 9 PRO N . 16876 1 39 . 1 1 10 10 GLU H H 1 8.614 . . 1 . . . . 10 GLU H . 16876 1 40 . 1 1 10 10 GLU HA H 1 4.197 . . 1 . . . . 10 GLU HA . 16876 1 41 . 1 1 10 10 GLU C C 13 176.626 . . 1 . . . . 10 GLU C . 16876 1 42 . 1 1 10 10 GLU CA C 13 56.801 . . 1 . . . . 10 GLU CA . 16876 1 43 . 1 1 10 10 GLU CB C 13 30.071 . . 1 . . . . 10 GLU CB . 16876 1 44 . 1 1 10 10 GLU N N 15 121.277 . . 1 . . . . 10 GLU N . 16876 1 45 . 1 1 11 11 GLN H H 1 8.439 . . 1 . . . . 11 GLN H . 16876 1 46 . 1 1 11 11 GLN HA H 1 4.31 . . 1 . . . . 11 GLN HA . 16876 1 47 . 1 1 11 11 GLN C C 13 175.77 . . 1 . . . . 11 GLN C . 16876 1 48 . 1 1 11 11 GLN CA C 13 55.63 . . 1 . . . . 11 GLN CA . 16876 1 49 . 1 1 11 11 GLN CB C 13 29.658 . . 1 . . . . 11 GLN CB . 16876 1 50 . 1 1 11 11 GLN N N 15 121.01 . . 1 . . . . 11 GLN N . 16876 1 51 . 1 1 12 12 GLU H H 1 8.51 . . 1 . . . . 12 GLU H . 16876 1 52 . 1 1 12 12 GLU HA H 1 4.28 . . 1 . . . . 12 GLU HA . 16876 1 53 . 1 1 12 12 GLU C C 13 176.243 . . 1 . . . . 12 GLU C . 16876 1 54 . 1 1 12 12 GLU CA C 13 56.188 . . 1 . . . . 12 GLU CA . 16876 1 55 . 1 1 12 12 GLU CB C 13 30.306 . . 1 . . . . 12 GLU CB . 16876 1 56 . 1 1 12 12 GLU N N 15 123.017 . . 1 . . . . 12 GLU N . 16876 1 57 . 1 1 13 13 VAL H H 1 8.338 . . 1 . . . . 13 VAL H . 16876 1 58 . 1 1 13 13 VAL HA H 1 4.386 . . 1 . . . . 13 VAL HA . 16876 1 59 . 1 1 13 13 VAL C C 13 174.405 . . 1 . . . . 13 VAL C . 16876 1 60 . 1 1 13 13 VAL CA C 13 59.908 . . 1 . . . . 13 VAL CA . 16876 1 61 . 1 1 13 13 VAL CB C 13 32.416 . . 1 . . . . 13 VAL CB . 16876 1 62 . 1 1 13 13 VAL N N 15 123.956 . . 1 . . . . 13 VAL N . 16876 1 63 . 1 1 14 14 PRO HA H 1 4.389 . . 1 . . . . 14 PRO HA . 16876 1 64 . 1 1 14 14 PRO C C 13 176.754 . . 1 . . . . 14 PRO C . 16876 1 65 . 1 1 14 14 PRO CA C 13 62.965 . . 1 . . . . 14 PRO CA . 16876 1 66 . 1 1 14 14 PRO CB C 13 32.15 . . 1 . . . . 14 PRO CB . 16876 1 67 . 1 1 14 14 PRO N N 15 139.72 . . 1 . . . . 14 PRO N . 16876 1 68 . 1 1 15 15 LYS H H 1 8.51 . . 1 . . . . 15 LYS H . 16876 1 69 . 1 1 15 15 LYS C C 13 176.704 . . 1 . . . . 15 LYS C . 16876 1 70 . 1 1 15 15 LYS CA C 13 56.098 . . 1 . . . . 15 LYS CA . 16876 1 71 . 1 1 15 15 LYS CB C 13 33.087 . . 1 . . . . 15 LYS CB . 16876 1 72 . 1 1 15 15 LYS N N 15 122.686 . . 1 . . . . 15 LYS N . 16876 1 73 . 1 1 16 16 VAL H H 1 8.25 . . 1 . . . . 16 VAL H . 16876 1 74 . 1 1 16 16 VAL HA H 1 4.103 . . 1 . . . . 16 VAL HA . 16876 1 75 . 1 1 16 16 VAL C C 13 175.787 . . 1 . . . . 16 VAL C . 16876 1 76 . 1 1 16 16 VAL CA C 13 61.842 . . 1 . . . . 16 VAL CA . 16876 1 77 . 1 1 16 16 VAL CB C 13 33.03 . . 1 . . . . 16 VAL CB . 16876 1 78 . 1 1 16 16 VAL N N 15 122.16 . . 1 . . . . 16 VAL N . 16876 1 79 . 1 1 17 17 ALA H H 1 8.559 . . 1 . . . . 17 ALA H . 16876 1 80 . 1 1 17 17 ALA HA H 1 4.393 . . 1 . . . . 17 ALA HA . 16876 1 81 . 1 1 17 17 ALA C C 13 177.841 . . 1 . . . . 17 ALA C . 16876 1 82 . 1 1 17 17 ALA CA C 13 52.405 . . 1 . . . . 17 ALA CA . 16876 1 83 . 1 1 17 17 ALA CB C 13 19.227 . . 1 . . . . 17 ALA CB . 16876 1 84 . 1 1 17 17 ALA N N 15 128.722 . . 1 . . . . 17 ALA N . 16876 1 85 . 1 1 18 18 THR H H 1 8.238 . . 1 . . . . 18 THR H . 16876 1 86 . 1 1 18 18 THR HA H 1 4.309 . . 1 . . . . 18 THR HA . 16876 1 87 . 1 1 18 18 THR C C 13 174.701 . . 1 . . . . 18 THR C . 16876 1 88 . 1 1 18 18 THR CA C 13 61.735 . . 1 . . . . 18 THR CA . 16876 1 89 . 1 1 18 18 THR CB C 13 69.766 . . 1 . . . . 18 THR CB . 16876 1 90 . 1 1 18 18 THR N N 15 114.133 . . 1 . . . . 18 THR N . 16876 1 91 . 1 1 19 19 GLU H H 1 8.558 . . 1 . . . . 19 GLU H . 16876 1 92 . 1 1 19 19 GLU C C 13 176.572 . . 1 . . . . 19 GLU C . 16876 1 93 . 1 1 19 19 GLU CA C 13 56.508 . . 1 . . . . 19 GLU CA . 16876 1 94 . 1 1 19 19 GLU CB C 13 30.188 . . 1 . . . . 19 GLU CB . 16876 1 95 . 1 1 19 19 GLU N N 15 123.266 . . 1 . . . . 19 GLU N . 16876 1 96 . 1 1 20 20 GLU H H 1 8.551 . . 1 . . . . 20 GLU H . 16876 1 97 . 1 1 20 20 GLU HA H 1 4.295 . . 1 . . . . 20 GLU HA . 16876 1 98 . 1 1 20 20 GLU C C 13 176.691 . . 1 . . . . 20 GLU C . 16876 1 99 . 1 1 20 20 GLU CA C 13 56.636 . . 1 . . . . 20 GLU CA . 16876 1 100 . 1 1 20 20 GLU CB C 13 30.249 . . 1 . . . . 20 GLU CB . 16876 1 101 . 1 1 20 20 GLU N N 15 122.41 . . 1 . . . . 20 GLU N . 16876 1 102 . 1 1 21 21 SER H H 1 8.475 . . 1 . . . . 21 SER H . 16876 1 103 . 1 1 21 21 SER HA H 1 4.476 . . 1 . . . . 21 SER HA . 16876 1 104 . 1 1 21 21 SER C C 13 174.772 . . 1 . . . . 21 SER C . 16876 1 105 . 1 1 21 21 SER CA C 13 58.306 . . 1 . . . . 21 SER CA . 16876 1 106 . 1 1 21 21 SER CB C 13 63.743 . . 1 . . . . 21 SER CB . 16876 1 107 . 1 1 21 21 SER N N 15 117.289 . . 1 . . . . 21 SER N . 16876 1 108 . 1 1 22 22 SER H H 1 8.461 . . 1 . . . . 22 SER H . 16876 1 109 . 1 1 22 22 SER HA H 1 4.461 . . 1 . . . . 22 SER HA . 16876 1 110 . 1 1 22 22 SER C C 13 174.429 . . 1 . . . . 22 SER C . 16876 1 111 . 1 1 22 22 SER CA C 13 58.306 . . 1 . . . . 22 SER CA . 16876 1 112 . 1 1 22 22 SER CB C 13 63.743 . . 1 . . . . 22 SER CB . 16876 1 113 . 1 1 22 22 SER N N 15 118.309 . . 1 . . . . 22 SER N . 16876 1 114 . 1 1 23 23 ALA H H 1 8.358 . . 1 . . . . 23 ALA H . 16876 1 115 . 1 1 23 23 ALA HA H 1 4.312 . . 1 . . . . 23 ALA HA . 16876 1 116 . 1 1 23 23 ALA C C 13 177.775 . . 1 . . . . 23 ALA C . 16876 1 117 . 1 1 23 23 ALA CA C 13 52.709 . . 1 . . . . 23 ALA CA . 16876 1 118 . 1 1 23 23 ALA CB C 13 19.138 . . 1 . . . . 23 ALA CB . 16876 1 119 . 1 1 23 23 ALA N N 15 126.026 . . 1 . . . . 23 ALA N . 16876 1 120 . 1 1 24 24 GLU H H 1 8.358 . . 1 . . . . 24 GLU H . 16876 1 121 . 1 1 24 24 GLU HA H 1 4.254 . . 1 . . . . 24 GLU HA . 16876 1 122 . 1 1 24 24 GLU C C 13 176.697 . . 1 . . . . 24 GLU C . 16876 1 123 . 1 1 24 24 GLU CA C 13 56.549 . . 1 . . . . 24 GLU CA . 16876 1 124 . 1 1 24 24 GLU CB C 13 30.115 . . 1 . . . . 24 GLU CB . 16876 1 125 . 1 1 24 24 GLU N N 15 120.087 . . 1 . . . . 24 GLU N . 16876 1 126 . 1 1 25 25 VAL H H 1 8.269 . . 1 . . . . 25 VAL H . 16876 1 127 . 1 1 25 25 VAL HA H 1 4.147 . . 1 . . . . 25 VAL HA . 16876 1 128 . 1 1 25 25 VAL C C 13 176.634 . . 1 . . . . 25 VAL C . 16876 1 129 . 1 1 25 25 VAL CA C 13 62.487 . . 1 . . . . 25 VAL CA . 16876 1 130 . 1 1 25 25 VAL CB C 13 32.474 . . 1 . . . . 25 VAL CB . 16876 1 131 . 1 1 25 25 VAL N N 15 121.758 . . 1 . . . . 25 VAL N . 16876 1 132 . 1 1 26 26 THR H H 1 8.301 . . 1 . . . . 26 THR H . 16876 1 133 . 1 1 26 26 THR HA H 1 4.332 . . 1 . . . . 26 THR HA . 16876 1 134 . 1 1 26 26 THR C C 13 174.37 . . 1 . . . . 26 THR C . 16876 1 135 . 1 1 26 26 THR CA C 13 62.07 . . 1 . . . . 26 THR CA . 16876 1 136 . 1 1 26 26 THR CB C 13 69.766 . . 1 . . . . 26 THR CB . 16876 1 137 . 1 1 26 26 THR N N 15 118.04 . . 1 . . . . 26 THR N . 16876 1 138 . 1 1 27 27 ASP H H 1 8.39 . . 1 . . . . 27 ASP H . 16876 1 139 . 1 1 27 27 ASP HA H 1 4.608 . . 1 . . . . 27 ASP HA . 16876 1 140 . 1 1 27 27 ASP C C 13 176.457 . . 1 . . . . 27 ASP C . 16876 1 141 . 1 1 27 27 ASP CA C 13 54.339 . . 1 . . . . 27 ASP CA . 16876 1 142 . 1 1 27 27 ASP CB C 13 40.974 . . 1 . . . . 27 ASP CB . 16876 1 143 . 1 1 27 27 ASP N N 15 122.999 . . 1 . . . . 27 ASP N . 16876 1 144 . 1 1 28 28 ARG H H 1 8.412 . . 1 . . . . 28 ARG H . 16876 1 145 . 1 1 28 28 ARG HA H 1 4.244 . . 1 . . . . 28 ARG HA . 16876 1 146 . 1 1 28 28 ARG C C 13 177.157 . . 1 . . . . 28 ARG C . 16876 1 147 . 1 1 28 28 ARG CA C 13 56.625 . . 1 . . . . 28 ARG CA . 16876 1 148 . 1 1 28 28 ARG CB C 13 30.235 . . 1 . . . . 28 ARG CB . 16876 1 149 . 1 1 28 28 ARG N N 15 122.116 . . 1 . . . . 28 ARG N . 16876 1 150 . 1 1 29 29 GLY H H 1 8.546 . . 1 . . . . 29 GLY H . 16876 1 151 . 1 1 29 29 GLY C C 13 174.536 . . 1 . . . . 29 GLY C . 16876 1 152 . 1 1 29 29 GLY CA C 13 45.436 . . 1 . . . . 29 GLY CA . 16876 1 153 . 1 1 29 29 GLY N N 15 109.242 . . 1 . . . . 29 GLY N . 16876 1 154 . 1 1 30 30 LEU H H 1 7.98 . . 1 . . . . 30 LEU H . 16876 1 155 . 1 1 30 30 LEU HA H 1 4.233 . . 1 . . . . 30 LEU HA . 16876 1 156 . 1 1 30 30 LEU C C 13 177.323 . . 1 . . . . 30 LEU C . 16876 1 157 . 1 1 30 30 LEU CA C 13 55.511 . . 1 . . . . 30 LEU CA . 16876 1 158 . 1 1 30 30 LEU CB C 13 42.146 . . 1 . . . . 30 LEU CB . 16876 1 159 . 1 1 30 30 LEU N N 15 121.097 . . 1 . . . . 30 LEU N . 16876 1 160 . 1 1 31 31 PHE H H 1 8.159 . . 1 . . . . 31 PHE H . 16876 1 161 . 1 1 31 31 PHE HA H 1 4.569 . . 1 . . . . 31 PHE HA . 16876 1 162 . 1 1 31 31 PHE C C 13 175.728 . . 1 . . . . 31 PHE C . 16876 1 163 . 1 1 31 31 PHE CA C 13 57.636 . . 1 . . . . 31 PHE CA . 16876 1 164 . 1 1 31 31 PHE CB C 13 39.568 . . 1 . . . . 31 PHE CB . 16876 1 165 . 1 1 31 31 PHE N N 15 119.297 . . 1 . . . . 31 PHE N . 16876 1 166 . 1 1 32 32 ASP H H 1 8.199 . . 1 . . . . 32 ASP H . 16876 1 167 . 1 1 32 32 ASP HA H 1 4.533 . . 1 . . . . 32 ASP HA . 16876 1 168 . 1 1 32 32 ASP C C 13 176.319 . . 1 . . . . 32 ASP C . 16876 1 169 . 1 1 32 32 ASP CA C 13 54.213 . . 1 . . . . 32 ASP CA . 16876 1 170 . 1 1 32 32 ASP CB C 13 40.865 . . 1 . . . . 32 ASP CB . 16876 1 171 . 1 1 32 32 ASP N N 15 121.477 . . 1 . . . . 32 ASP N . 16876 1 172 . 1 1 33 33 PHE H H 1 8.112 . . 1 . . . . 33 PHE H . 16876 1 173 . 1 1 33 33 PHE HA H 1 4.513 . . 1 . . . . 33 PHE HA . 16876 1 174 . 1 1 33 33 PHE C C 13 176.236 . . 1 . . . . 33 PHE C . 16876 1 175 . 1 1 33 33 PHE CA C 13 58.384 . . 1 . . . . 33 PHE CA . 16876 1 176 . 1 1 33 33 PHE CB C 13 39.098 . . 1 . . . . 33 PHE CB . 16876 1 177 . 1 1 33 33 PHE N N 15 120.163 . . 1 . . . . 33 PHE N . 16876 1 178 . 1 1 34 34 LEU H H 1 8.158 . . 1 . . . . 34 LEU H . 16876 1 179 . 1 1 34 34 LEU HA H 1 4.244 . . 1 . . . . 34 LEU HA . 16876 1 180 . 1 1 34 34 LEU C C 13 177.931 . . 1 . . . . 34 LEU C . 16876 1 181 . 1 1 34 34 LEU CA C 13 55.335 . . 1 . . . . 34 LEU CA . 16876 1 182 . 1 1 34 34 LEU CB C 13 41.912 . . 1 . . . . 34 LEU CB . 16876 1 183 . 1 1 34 34 LEU N N 15 122.302 . . 1 . . . . 34 LEU N . 16876 1 184 . 1 1 35 35 GLY H H 1 8.045 . . 1 . . . . 35 GLY H . 16876 1 185 . 1 1 35 35 GLY HA2 H 1 3.865 . . 2 . . . . 35 GLY HA2 . 16876 1 186 . 1 1 35 35 GLY HA3 H 1 3.865 . . 2 . . . . 35 GLY HA3 . 16876 1 187 . 1 1 35 35 GLY C C 13 174.051 . . 1 . . . . 35 GLY C . 16876 1 188 . 1 1 35 35 GLY CA C 13 45.34 . . 1 . . . . 35 GLY CA . 16876 1 189 . 1 1 35 35 GLY N N 15 108.905 . . 1 . . . . 35 GLY N . 16876 1 190 . 1 1 36 36 LYS H H 1 8.101 . . 1 . . . . 36 LYS H . 16876 1 191 . 1 1 36 36 LYS HA H 1 4.29 . . 1 . . . . 36 LYS HA . 16876 1 192 . 1 1 36 36 LYS C C 13 176.697 . . 1 . . . . 36 LYS C . 16876 1 193 . 1 1 36 36 LYS CA C 13 55.98 . . 1 . . . . 36 LYS CA . 16876 1 194 . 1 1 36 36 LYS CB C 13 33.002 . . 1 . . . . 36 LYS CB . 16876 1 195 . 1 1 36 36 LYS N N 15 120.967 . . 1 . . . . 36 LYS N . 16876 1 196 . 1 1 37 37 LYS H H 1 8.473 . . 1 . . . . 37 LYS H . 16876 1 197 . 1 1 37 37 LYS HA H 1 4.257 . . 1 . . . . 37 LYS HA . 16876 1 198 . 1 1 37 37 LYS C C 13 176.754 . . 1 . . . . 37 LYS C . 16876 1 199 . 1 1 37 37 LYS CA C 13 56.192 . . 1 . . . . 37 LYS CA . 16876 1 200 . 1 1 37 37 LYS CB C 13 32.935 . . 1 . . . . 37 LYS CB . 16876 1 201 . 1 1 37 37 LYS N N 15 123.404 . . 1 . . . . 37 LYS N . 16876 1 202 . 1 1 38 38 LYS H H 1 8.459 . . 1 . . . . 38 LYS H . 16876 1 203 . 1 1 38 38 LYS HA H 1 4.233 . . 1 . . . . 38 LYS HA . 16876 1 204 . 1 1 38 38 LYS C C 13 176.267 . . 1 . . . . 38 LYS C . 16876 1 205 . 1 1 38 38 LYS CA C 13 56.347 . . 1 . . . . 38 LYS CA . 16876 1 206 . 1 1 38 38 LYS CB C 13 32.96 . . 1 . . . . 38 LYS CB . 16876 1 207 . 1 1 38 38 LYS N N 15 123.68 . . 1 . . . . 38 LYS N . 16876 1 208 . 1 1 39 39 ASP H H 1 8.463 . . 1 . . . . 39 ASP H . 16876 1 209 . 1 1 39 39 ASP HA H 1 4.596 . . 1 . . . . 39 ASP HA . 16876 1 210 . 1 1 39 39 ASP C C 13 176.286 . . 1 . . . . 39 ASP C . 16876 1 211 . 1 1 39 39 ASP CA C 13 54.163 . . 1 . . . . 39 ASP CA . 16876 1 212 . 1 1 39 39 ASP CB C 13 40.981 . . 1 . . . . 39 ASP CB . 16876 1 213 . 1 1 39 39 ASP N N 15 121.922 . . 1 . . . . 39 ASP N . 16876 1 214 . 1 1 40 40 GLU H H 1 8.505 . . 1 . . . . 40 GLU H . 16876 1 215 . 1 1 40 40 GLU HA H 1 4.342 . . 1 . . . . 40 GLU HA . 16876 1 216 . 1 1 40 40 GLU C C 13 176.64 . . 1 . . . . 40 GLU C . 16876 1 217 . 1 1 40 40 GLU CA C 13 56.506 . . 1 . . . . 40 GLU CA . 16876 1 218 . 1 1 40 40 GLU CB C 13 30.247 . . 1 . . . . 40 GLU CB . 16876 1 219 . 1 1 40 40 GLU N N 15 122.299 . . 1 . . . . 40 GLU N . 16876 1 220 . 1 1 41 41 THR H H 1 8.365 . . 1 . . . . 41 THR H . 16876 1 221 . 1 1 41 41 THR HA H 1 4.275 . . 1 . . . . 41 THR HA . 16876 1 222 . 1 1 41 41 THR C C 13 174.341 . . 1 . . . . 41 THR C . 16876 1 223 . 1 1 41 41 THR CA C 13 62.154 . . 1 . . . . 41 THR CA . 16876 1 224 . 1 1 41 41 THR CB C 13 69.682 . . 1 . . . . 41 THR CB . 16876 1 225 . 1 1 41 41 THR N N 15 115.964 . . 1 . . . . 41 THR N . 16876 1 226 . 1 1 42 42 LYS H H 1 8.408 . . 1 . . . . 42 LYS H . 16876 1 227 . 1 1 42 42 LYS HA H 1 4.631 . . 1 . . . . 42 LYS HA . 16876 1 228 . 1 1 42 42 LYS C C 13 174.463 . . 1 . . . . 42 LYS C . 16876 1 229 . 1 1 42 42 LYS CA C 13 54.046 . . 1 . . . . 42 LYS CA . 16876 1 230 . 1 1 42 42 LYS CB C 13 32.474 . . 1 . . . . 42 LYS CB . 16876 1 231 . 1 1 42 42 LYS N N 15 125.657 . . 1 . . . . 42 LYS N . 16876 1 232 . 1 1 43 43 PRO HA H 1 4.397 . . 1 . . . . 43 PRO HA . 16876 1 233 . 1 1 43 43 PRO C C 13 177.034 . . 1 . . . . 43 PRO C . 16876 1 234 . 1 1 43 43 PRO CA C 13 63.046 . . 1 . . . . 43 PRO CA . 16876 1 235 . 1 1 43 43 PRO CB C 13 31.989 . . 1 . . . . 43 PRO CB . 16876 1 236 . 1 1 43 43 PRO N N 15 137.479 . . 1 . . . . 43 PRO N . 16876 1 237 . 1 1 44 44 GLU H H 1 8.677 . . 1 . . . . 44 GLU H . 16876 1 238 . 1 1 44 44 GLU HA H 1 4.229 . . 1 . . . . 44 GLU HA . 16876 1 239 . 1 1 44 44 GLU C C 13 176.543 . . 1 . . . . 44 GLU C . 16876 1 240 . 1 1 44 44 GLU CA C 13 56.508 . . 1 . . . . 44 GLU CA . 16876 1 241 . 1 1 44 44 GLU CB C 13 30.13 . . 1 . . . . 44 GLU CB . 16876 1 242 . 1 1 44 44 GLU N N 15 121.176 . . 1 . . . . 44 GLU N . 16876 1 243 . 1 1 45 45 GLU H H 1 8.476 . . 1 . . . . 45 GLU H . 16876 1 244 . 1 1 45 45 GLU HA H 1 4.346 . . 1 . . . . 45 GLU HA . 16876 1 245 . 1 1 45 45 GLU C C 13 176.292 . . 1 . . . . 45 GLU C . 16876 1 246 . 1 1 45 45 GLU CA C 13 56.488 . . 1 . . . . 45 GLU CA . 16876 1 247 . 1 1 45 45 GLU CB C 13 30.229 . . 1 . . . . 45 GLU CB . 16876 1 248 . 1 1 45 45 GLU N N 15 122.469 . . 1 . . . . 45 GLU N . 16876 1 249 . 1 1 46 46 THR H H 1 8.378 . . 1 . . . . 46 THR H . 16876 1 250 . 1 1 46 46 THR HA H 1 4.554 . . 1 . . . . 46 THR HA . 16876 1 251 . 1 1 46 46 THR C C 13 172.703 . . 1 . . . . 46 THR C . 16876 1 252 . 1 1 46 46 THR CA C 13 59.895 . . 1 . . . . 46 THR CA . 16876 1 253 . 1 1 46 46 THR CB C 13 69.682 . . 1 . . . . 46 THR CB . 16876 1 254 . 1 1 46 46 THR N N 15 119.118 . . 1 . . . . 46 THR N . 16876 1 255 . 1 1 47 47 PRO HA H 1 4.442 . . 1 . . . . 47 PRO HA . 16876 1 256 . 1 1 47 47 PRO C C 13 176.844 . . 1 . . . . 47 PRO C . 16876 1 257 . 1 1 47 47 PRO CA C 13 62.885 . . 1 . . . . 47 PRO CA . 16876 1 258 . 1 1 47 47 PRO CB C 13 32.07 . . 1 . . . . 47 PRO CB . 16876 1 259 . 1 1 47 47 PRO N N 15 139.399 . . 1 . . . . 47 PRO N . 16876 1 260 . 1 1 48 48 ILE H H 1 8.356 . . 1 . . . . 48 ILE H . 16876 1 261 . 1 1 48 48 ILE HA H 1 4.103 . . 1 . . . . 48 ILE HA . 16876 1 262 . 1 1 48 48 ILE C C 13 176.189 . . 1 . . . . 48 ILE C . 16876 1 263 . 1 1 48 48 ILE CA C 13 60.982 . . 1 . . . . 48 ILE CA . 16876 1 264 . 1 1 48 48 ILE CB C 13 38.629 . . 1 . . . . 48 ILE CB . 16876 1 265 . 1 1 48 48 ILE N N 15 121.992 . . 1 . . . . 48 ILE N . 16876 1 266 . 1 1 49 49 ALA H H 1 8.484 . . 1 . . . . 49 ALA H . 16876 1 267 . 1 1 49 49 ALA HA H 1 4.325 . . 1 . . . . 49 ALA HA . 16876 1 268 . 1 1 49 49 ALA C C 13 177.816 . . 1 . . . . 49 ALA C . 16876 1 269 . 1 1 49 49 ALA CA C 13 52.463 . . 1 . . . . 49 ALA CA . 16876 1 270 . 1 1 49 49 ALA CB C 13 19.168 . . 1 . . . . 49 ALA CB . 16876 1 271 . 1 1 49 49 ALA N N 15 128.867 . . 1 . . . . 49 ALA N . 16876 1 272 . 1 1 50 50 SER H H 1 8.395 . . 1 . . . . 50 SER H . 16876 1 273 . 1 1 50 50 SER HA H 1 4.385 . . 1 . . . . 50 SER HA . 16876 1 274 . 1 1 50 50 SER C C 13 174.943 . . 1 . . . . 50 SER C . 16876 1 275 . 1 1 50 50 SER CA C 13 58.473 . . 1 . . . . 50 SER CA . 16876 1 276 . 1 1 50 50 SER CB C 13 63.743 . . 1 . . . . 50 SER CB . 16876 1 277 . 1 1 50 50 SER N N 15 115.741 . . 1 . . . . 50 SER N . 16876 1 278 . 1 1 51 51 GLU H H 1 8.568 . . 1 . . . . 51 GLU H . 16876 1 279 . 1 1 51 51 GLU HA H 1 4.188 . . 1 . . . . 51 GLU HA . 16876 1 280 . 1 1 51 51 GLU C C 13 176.399 . . 1 . . . . 51 GLU C . 16876 1 281 . 1 1 51 51 GLU CA C 13 57.035 . . 1 . . . . 51 GLU CA . 16876 1 282 . 1 1 51 51 GLU CB C 13 29.778 . . 1 . . . . 51 GLU CB . 16876 1 283 . 1 1 51 51 GLU N N 15 122.75 . . 1 . . . . 51 GLU N . 16876 1 284 . 1 1 52 52 PHE H H 1 8.158 . . 1 . . . . 52 PHE H . 16876 1 285 . 1 1 52 52 PHE HA H 1 4.589 . . 1 . . . . 52 PHE HA . 16876 1 286 . 1 1 52 52 PHE C C 13 175.787 . . 1 . . . . 52 PHE C . 16876 1 287 . 1 1 52 52 PHE CA C 13 57.887 . . 1 . . . . 52 PHE CA . 16876 1 288 . 1 1 52 52 PHE CB C 13 39.484 . . 1 . . . . 52 PHE CB . 16876 1 289 . 1 1 52 52 PHE N N 15 119.934 . . 1 . . . . 52 PHE N . 16876 1 290 . 1 1 53 53 GLU H H 1 8.173 . . 1 . . . . 53 GLU H . 16876 1 291 . 1 1 53 53 GLU HA H 1 4.205 . . 1 . . . . 53 GLU HA . 16876 1 292 . 1 1 53 53 GLU C C 13 176.136 . . 1 . . . . 53 GLU C . 16876 1 293 . 1 1 53 53 GLU CA C 13 56.454 . . 1 . . . . 53 GLU CA . 16876 1 294 . 1 1 53 53 GLU CB C 13 30.364 . . 1 . . . . 53 GLU CB . 16876 1 295 . 1 1 53 53 GLU N N 15 122.151 . . 1 . . . . 53 GLU N . 16876 1 296 . 1 1 54 54 GLN H H 1 8.39 . . 1 . . . . 54 GLN H . 16876 1 297 . 1 1 54 54 GLN C C 13 175.906 . . 1 . . . . 54 GLN C . 16876 1 298 . 1 1 54 54 GLN CA C 13 55.712 . . 1 . . . . 54 GLN CA . 16876 1 299 . 1 1 54 54 GLN CB C 13 29.274 . . 1 . . . . 54 GLN CB . 16876 1 300 . 1 1 54 54 GLN N N 15 121.801 . . 1 . . . . 54 GLN N . 16876 1 301 . 1 1 55 55 LYS H H 1 8.392 . . 1 . . . . 55 LYS H . 16876 1 302 . 1 1 55 55 LYS C C 13 176.432 . . 1 . . . . 55 LYS C . 16876 1 303 . 1 1 55 55 LYS CA C 13 55.903 . . 1 . . . . 55 LYS CA . 16876 1 304 . 1 1 55 55 LYS CB C 13 32.984 . . 1 . . . . 55 LYS CB . 16876 1 305 . 1 1 55 55 LYS N N 15 123.174 . . 1 . . . . 55 LYS N . 16876 1 306 . 1 1 56 56 VAL H H 1 8.175 . . 1 . . . . 56 VAL H . 16876 1 307 . 1 1 56 56 VAL HA H 1 4.043 . . 1 . . . . 56 VAL HA . 16876 1 308 . 1 1 56 56 VAL C C 13 175.77 . . 1 . . . . 56 VAL C . 16876 1 309 . 1 1 56 56 VAL CA C 13 62.135 . . 1 . . . . 56 VAL CA . 16876 1 310 . 1 1 56 56 VAL CB C 13 32.95 . . 1 . . . . 56 VAL CB . 16876 1 311 . 1 1 56 56 VAL N N 15 121.477 . . 1 . . . . 56 VAL N . 16876 1 312 . 1 1 57 57 HIS H H 1 8.646 . . 1 . . . . 57 HIS H . 16876 1 313 . 1 1 57 57 HIS HA H 1 4.695 . . 1 . . . . 57 HIS HA . 16876 1 314 . 1 1 57 57 HIS C C 13 174.496 . . 1 . . . . 57 HIS C . 16876 1 315 . 1 1 57 57 HIS CA C 13 55.453 . . 1 . . . . 57 HIS CA . 16876 1 316 . 1 1 57 57 HIS CB C 13 29.661 . . 1 . . . . 57 HIS CB . 16876 1 317 . 1 1 57 57 HIS N N 15 123.938 . . 1 . . . . 57 HIS N . 16876 1 318 . 1 1 58 58 ILE H H 1 8.344 . . 1 . . . . 58 ILE H . 16876 1 319 . 1 1 58 58 ILE HA H 1 4.174 . . 1 . . . . 58 ILE HA . 16876 1 320 . 1 1 58 58 ILE C C 13 175.946 . . 1 . . . . 58 ILE C . 16876 1 321 . 1 1 58 58 ILE CA C 13 60.728 . . 1 . . . . 58 ILE CA . 16876 1 322 . 1 1 58 58 ILE CB C 13 38.747 . . 1 . . . . 58 ILE CB . 16876 1 323 . 1 1 58 58 ILE N N 15 124.391 . . 1 . . . . 58 ILE N . 16876 1 324 . 1 1 59 59 SER H H 1 8.5 . . 1 . . . . 59 SER H . 16876 1 325 . 1 1 59 59 SER HA H 1 4.448 . . 1 . . . . 59 SER HA . 16876 1 326 . 1 1 59 59 SER C C 13 173.951 . . 1 . . . . 59 SER C . 16876 1 327 . 1 1 59 59 SER CA C 13 58.091 . . 1 . . . . 59 SER CA . 16876 1 328 . 1 1 59 59 SER CB C 13 63.718 . . 1 . . . . 59 SER CB . 16876 1 329 . 1 1 59 59 SER N N 15 120.835 . . 1 . . . . 59 SER N . 16876 1 330 . 1 1 60 60 GLU H H 1 8.485 . . 1 . . . . 60 GLU H . 16876 1 331 . 1 1 60 60 GLU HA H 1 4.591 . . 1 . . . . 60 GLU HA . 16876 1 332 . 1 1 60 60 GLU C C 13 174.323 . . 1 . . . . 60 GLU C . 16876 1 333 . 1 1 60 60 GLU CA C 13 54.222 . . 1 . . . . 60 GLU CA . 16876 1 334 . 1 1 60 60 GLU CB C 13 29.719 . . 1 . . . . 60 GLU CB . 16876 1 335 . 1 1 60 60 GLU N N 15 124.492 . . 1 . . . . 60 GLU N . 16876 1 336 . 1 1 61 61 PRO HA H 1 4.404 . . 1 . . . . 61 PRO HA . 16876 1 337 . 1 1 61 61 PRO C C 13 176.679 . . 1 . . . . 61 PRO C . 16876 1 338 . 1 1 61 61 PRO CA C 13 62.725 . . 1 . . . . 61 PRO CA . 16876 1 339 . 1 1 61 61 PRO CB C 13 32.07 . . 1 . . . . 61 PRO CB . 16876 1 340 . 1 1 61 61 PRO N N 15 137.236 . . 1 . . . . 61 PRO N . 16876 1 341 . 1 1 62 62 GLU H H 1 8.585 . . 1 . . . . 62 GLU H . 16876 1 342 . 1 1 62 62 GLU HA H 1 4.52 . . 1 . . . . 62 GLU HA . 16876 1 343 . 1 1 62 62 GLU C C 13 174.694 . . 1 . . . . 62 GLU C . 16876 1 344 . 1 1 62 62 GLU CA C 13 54.339 . . 1 . . . . 62 GLU CA . 16876 1 345 . 1 1 62 62 GLU CB C 13 29.485 . . 1 . . . . 62 GLU CB . 16876 1 346 . 1 1 62 62 GLU N N 15 122.787 . . 1 . . . . 62 GLU N . 16876 1 347 . 1 1 63 63 PRO HA H 1 4.382 . . 1 . . . . 63 PRO HA . 16876 1 348 . 1 1 63 63 PRO C C 13 176.795 . . 1 . . . . 63 PRO C . 16876 1 349 . 1 1 63 63 PRO CA C 13 62.965 . . 1 . . . . 63 PRO CA . 16876 1 350 . 1 1 63 63 PRO CB C 13 32.07 . . 1 . . . . 63 PRO CB . 16876 1 351 . 1 1 63 63 PRO N N 15 137.293 . . 1 . . . . 63 PRO N . 16876 1 352 . 1 1 64 64 GLU H H 1 8.569 . . 1 . . . . 64 GLU H . 16876 1 353 . 1 1 64 64 GLU C C 13 176.502 . . 1 . . . . 64 GLU C . 16876 1 354 . 1 1 64 64 GLU CA C 13 56.508 . . 1 . . . . 64 GLU CA . 16876 1 355 . 1 1 64 64 GLU CB C 13 30.306 . . 1 . . . . 64 GLU CB . 16876 1 356 . 1 1 64 64 GLU N N 15 121.728 . . 1 . . . . 64 GLU N . 16876 1 357 . 1 1 65 65 VAL H H 1 8.292 . . 1 . . . . 65 VAL H . 16876 1 358 . 1 1 65 65 VAL HA H 1 4.035 . . 1 . . . . 65 VAL HA . 16876 1 359 . 1 1 65 65 VAL C C 13 175.882 . . 1 . . . . 65 VAL C . 16876 1 360 . 1 1 65 65 VAL CA C 13 62.164 . . 1 . . . . 65 VAL CA . 16876 1 361 . 1 1 65 65 VAL CB C 13 32.614 . . 1 . . . . 65 VAL CB . 16876 1 362 . 1 1 65 65 VAL N N 15 122.851 . . 1 . . . . 65 VAL N . 16876 1 363 . 1 1 66 66 LYS H H 1 8.474 . . 1 . . . . 66 LYS H . 16876 1 364 . 1 1 66 66 LYS HA H 1 4.284 . . 1 . . . . 66 LYS HA . 16876 1 365 . 1 1 66 66 LYS C C 13 176.317 . . 1 . . . . 66 LYS C . 16876 1 366 . 1 1 66 66 LYS CA C 13 55.98 . . 1 . . . . 66 LYS CA . 16876 1 367 . 1 1 66 66 LYS CB C 13 32.978 . . 1 . . . . 66 LYS CB . 16876 1 368 . 1 1 66 66 LYS N N 15 125.867 . . 1 . . . . 66 LYS N . 16876 1 369 . 1 1 67 67 HIS H H 1 8.635 . . 1 . . . . 67 HIS H . 16876 1 370 . 1 1 67 67 HIS HA H 1 4.645 . . 1 . . . . 67 HIS HA . 16876 1 371 . 1 1 67 67 HIS C C 13 174.949 . . 1 . . . . 67 HIS C . 16876 1 372 . 1 1 67 67 HIS CA C 13 55.778 . . 1 . . . . 67 HIS CA . 16876 1 373 . 1 1 67 67 HIS CB C 13 29.712 . . 1 . . . . 67 HIS CB . 16876 1 374 . 1 1 67 67 HIS N N 15 121.443 . . 1 . . . . 67 HIS N . 16876 1 375 . 1 1 68 68 GLU H H 1 8.679 . . 1 . . . . 68 GLU H . 16876 1 376 . 1 1 68 68 GLU HA H 1 4.288 . . 1 . . . . 68 GLU HA . 16876 1 377 . 1 1 68 68 GLU C C 13 176.548 . . 1 . . . . 68 GLU C . 16876 1 378 . 1 1 68 68 GLU CA C 13 56.684 . . 1 . . . . 68 GLU CA . 16876 1 379 . 1 1 68 68 GLU CB C 13 30.364 . . 1 . . . . 68 GLU CB . 16876 1 380 . 1 1 68 68 GLU N N 15 123.017 . . 1 . . . . 68 GLU N . 16876 1 381 . 1 1 69 69 SER H H 1 8.627 . . 1 . . . . 69 SER H . 16876 1 382 . 1 1 69 69 SER HA H 1 4.444 . . 1 . . . . 69 SER HA . 16876 1 383 . 1 1 69 69 SER C C 13 174.925 . . 1 . . . . 69 SER C . 16876 1 384 . 1 1 69 69 SER CA C 13 58.389 . . 1 . . . . 69 SER CA . 16876 1 385 . 1 1 69 69 SER CB C 13 63.743 . . 1 . . . . 69 SER CB . 16876 1 386 . 1 1 69 69 SER N N 15 117.951 . . 1 . . . . 69 SER N . 16876 1 387 . 1 1 70 70 LEU H H 1 8.441 . . 1 . . . . 70 LEU H . 16876 1 388 . 1 1 70 70 LEU HA H 1 4.275 . . 1 . . . . 70 LEU HA . 16876 1 389 . 1 1 70 70 LEU C C 13 177.932 . . 1 . . . . 70 LEU C . 16876 1 390 . 1 1 70 70 LEU CA C 13 56.006 . . 1 . . . . 70 LEU CA . 16876 1 391 . 1 1 70 70 LEU CB C 13 41.853 . . 1 . . . . 70 LEU CB . 16876 1 392 . 1 1 70 70 LEU N N 15 124.268 . . 1 . . . . 70 LEU N . 16876 1 393 . 1 1 71 71 LEU H H 1 8.105 . . 1 . . . . 71 LEU H . 16876 1 394 . 1 1 71 71 LEU HA H 1 4.214 . . 1 . . . . 71 LEU HA . 16876 1 395 . 1 1 71 71 LEU C C 13 178.009 . . 1 . . . . 71 LEU C . 16876 1 396 . 1 1 71 71 LEU CA C 13 55.912 . . 1 . . . . 71 LEU CA . 16876 1 397 . 1 1 71 71 LEU CB C 13 41.968 . . 1 . . . . 71 LEU CB . 16876 1 398 . 1 1 71 71 LEU N N 15 121.046 . . 1 . . . . 71 LEU N . 16876 1 399 . 1 1 72 72 GLU H H 1 8.144 . . 1 . . . . 72 GLU H . 16876 1 400 . 1 1 72 72 GLU HA H 1 4.169 . . 1 . . . . 72 GLU HA . 16876 1 401 . 1 1 72 72 GLU C C 13 177.098 . . 1 . . . . 72 GLU C . 16876 1 402 . 1 1 72 72 GLU CA C 13 57.153 . . 1 . . . . 72 GLU CA . 16876 1 403 . 1 1 72 72 GLU CB C 13 30.012 . . 1 . . . . 72 GLU CB . 16876 1 404 . 1 1 72 72 GLU N N 15 120.817 . . 1 . . . . 72 GLU N . 16876 1 405 . 1 1 73 73 LYS H H 1 8.198 . . 1 . . . . 73 LYS H . 16876 1 406 . 1 1 73 73 LYS HA H 1 4.184 . . 1 . . . . 73 LYS HA . 16876 1 407 . 1 1 73 73 LYS C C 13 177.062 . . 1 . . . . 73 LYS C . 16876 1 408 . 1 1 73 73 LYS CA C 13 56.949 . . 1 . . . . 73 LYS CA . 16876 1 409 . 1 1 73 73 LYS CB C 13 32.734 . . 1 . . . . 73 LYS CB . 16876 1 410 . 1 1 73 73 LYS N N 15 121.504 . . 1 . . . . 73 LYS N . 16876 1 411 . 1 1 74 74 LEU H H 1 8.14 . . 1 . . . . 74 LEU H . 16876 1 412 . 1 1 74 74 LEU HA H 1 4.244 . . 1 . . . . 74 LEU HA . 16876 1 413 . 1 1 74 74 LEU C C 13 177.482 . . 1 . . . . 74 LEU C . 16876 1 414 . 1 1 74 74 LEU CA C 13 55.453 . . 1 . . . . 74 LEU CA . 16876 1 415 . 1 1 74 74 LEU CB C 13 42.146 . . 1 . . . . 74 LEU CB . 16876 1 416 . 1 1 74 74 LEU N N 15 121.902 . . 1 . . . . 74 LEU N . 16876 1 417 . 1 1 75 75 HIS H H 1 8.371 . . 1 . . . . 75 HIS H . 16876 1 418 . 1 1 75 75 HIS HA H 1 4.664 . . 1 . . . . 75 HIS HA . 16876 1 419 . 1 1 75 75 HIS C C 13 175.002 . . 1 . . . . 75 HIS C . 16876 1 420 . 1 1 75 75 HIS CA C 13 55.712 . . 1 . . . . 75 HIS CA . 16876 1 421 . 1 1 75 75 HIS CB C 13 29.278 . . 1 . . . . 75 HIS CB . 16876 1 422 . 1 1 75 75 HIS N N 15 119.254 . . 1 . . . . 75 HIS N . 16876 1 423 . 1 1 76 76 ARG H H 1 8.424 . . 1 . . . . 76 ARG H . 16876 1 424 . 1 1 76 76 ARG HA H 1 4.339 . . 1 . . . . 76 ARG HA . 16876 1 425 . 1 1 76 76 ARG C C 13 176.589 . . 1 . . . . 76 ARG C . 16876 1 426 . 1 1 76 76 ARG CA C 13 56.391 . . 1 . . . . 76 ARG CA . 16876 1 427 . 1 1 76 76 ARG CB C 13 30.833 . . 1 . . . . 76 ARG CB . 16876 1 428 . 1 1 76 76 ARG N N 15 122.741 . . 1 . . . . 76 ARG N . 16876 1 429 . 1 1 77 77 SER H H 1 8.549 . . 1 . . . . 77 SER H . 16876 1 430 . 1 1 77 77 SER HA H 1 4.457 . . 1 . . . . 77 SER HA . 16876 1 431 . 1 1 77 77 SER C C 13 174.453 . . 1 . . . . 77 SER C . 16876 1 432 . 1 1 77 77 SER CA C 13 58.473 . . 1 . . . . 77 SER CA . 16876 1 433 . 1 1 77 77 SER CB C 13 63.659 . . 1 . . . . 77 SER CB . 16876 1 434 . 1 1 77 77 SER N N 15 117.208 . . 1 . . . . 77 SER N . 16876 1 435 . 1 1 78 78 ASP H H 1 8.454 . . 1 . . . . 78 ASP H . 16876 1 436 . 1 1 78 78 ASP HA H 1 4.676 . . 1 . . . . 78 ASP HA . 16876 1 437 . 1 1 78 78 ASP C C 13 176.548 . . 1 . . . . 78 ASP C . 16876 1 438 . 1 1 78 78 ASP CA C 13 54.28 . . 1 . . . . 78 ASP CA . 16876 1 439 . 1 1 78 78 ASP CB C 13 41.033 . . 1 . . . . 78 ASP CB . 16876 1 440 . 1 1 78 78 ASP N N 15 122.548 . . 1 . . . . 78 ASP N . 16876 1 441 . 1 1 79 79 SER H H 1 8.378 . . 1 . . . . 79 SER H . 16876 1 442 . 1 1 79 79 SER HA H 1 4.483 . . 1 . . . . 79 SER HA . 16876 1 443 . 1 1 79 79 SER C C 13 174.99 . . 1 . . . . 79 SER C . 16876 1 444 . 1 1 79 79 SER CA C 13 58.557 . . 1 . . . . 79 SER CA . 16876 1 445 . 1 1 79 79 SER CB C 13 63.659 . . 1 . . . . 79 SER CB . 16876 1 446 . 1 1 79 79 SER N N 15 116.389 . . 1 . . . . 79 SER N . 16876 1 447 . 1 1 80 80 SER H H 1 8.492 . . 1 . . . . 80 SER H . 16876 1 448 . 1 1 80 80 SER HA H 1 4.494 . . 1 . . . . 80 SER HA . 16876 1 449 . 1 1 80 80 SER C C 13 174.866 . . 1 . . . . 80 SER C . 16876 1 450 . 1 1 80 80 SER CA C 13 58.706 . . 1 . . . . 80 SER CA . 16876 1 451 . 1 1 80 80 SER CB C 13 63.672 . . 1 . . . . 80 SER CB . 16876 1 452 . 1 1 80 80 SER N N 15 118.174 . . 1 . . . . 80 SER N . 16876 1 453 . 1 1 81 81 SER H H 1 8.412 . . 1 . . . . 81 SER H . 16876 1 454 . 1 1 81 81 SER HA H 1 4.529 . . 1 . . . . 81 SER HA . 16876 1 455 . 1 1 81 81 SER C C 13 174.76 . . 1 . . . . 81 SER C . 16876 1 456 . 1 1 81 81 SER CA C 13 58.473 . . 1 . . . . 81 SER CA . 16876 1 457 . 1 1 81 81 SER CB C 13 63.743 . . 1 . . . . 81 SER CB . 16876 1 458 . 1 1 81 81 SER N N 15 117.825 . . 1 . . . . 81 SER N . 16876 1 459 . 1 1 82 82 SER H H 1 8.439 . . 1 . . . . 82 SER H . 16876 1 460 . 1 1 82 82 SER HA H 1 4.529 . . 1 . . . . 82 SER HA . 16876 1 461 . 1 1 82 82 SER C C 13 174.75 . . 1 . . . . 82 SER C . 16876 1 462 . 1 1 82 82 SER CA C 13 58.389 . . 1 . . . . 82 SER CA . 16876 1 463 . 1 1 82 82 SER CB C 13 63.743 . . 1 . . . . 82 SER CB . 16876 1 464 . 1 1 82 82 SER N N 15 118.013 . . 1 . . . . 82 SER N . 16876 1 465 . 1 1 83 83 SER H H 1 8.465 . . 1 . . . . 83 SER H . 16876 1 466 . 1 1 83 83 SER HA H 1 4.529 . . 1 . . . . 83 SER HA . 16876 1 467 . 1 1 83 83 SER C C 13 174.772 . . 1 . . . . 83 SER C . 16876 1 468 . 1 1 83 83 SER CA C 13 58.445 . . 1 . . . . 83 SER CA . 16876 1 469 . 1 1 83 83 SER CB C 13 63.639 . . 1 . . . . 83 SER CB . 16876 1 470 . 1 1 83 83 SER N N 15 118.085 . . 1 . . . . 83 SER N . 16876 1 471 . 1 1 84 84 SER H H 1 8.469 . . 1 . . . . 84 SER H . 16876 1 472 . 1 1 84 84 SER HA H 1 4.529 . . 1 . . . . 84 SER HA . 16876 1 473 . 1 1 84 84 SER C C 13 174.779 . . 1 . . . . 84 SER C . 16876 1 474 . 1 1 84 84 SER CA C 13 58.407 . . 1 . . . . 84 SER CA . 16876 1 475 . 1 1 84 84 SER CB C 13 63.69 . . 1 . . . . 84 SER CB . 16876 1 476 . 1 1 84 84 SER N N 15 118.088 . . 1 . . . . 84 SER N . 16876 1 477 . 1 1 85 85 SER H H 1 8.467 . . 1 . . . . 85 SER H . 16876 1 478 . 1 1 85 85 SER HA H 1 4.476 . . 1 . . . . 85 SER HA . 16876 1 479 . 1 1 85 85 SER C C 13 174.808 . . 1 . . . . 85 SER C . 16876 1 480 . 1 1 85 85 SER CA C 13 58.521 . . 1 . . . . 85 SER CA . 16876 1 481 . 1 1 85 85 SER CB C 13 63.665 . . 1 . . . . 85 SER CB . 16876 1 482 . 1 1 85 85 SER N N 15 118.111 . . 1 . . . . 85 SER N . 16876 1 483 . 1 1 86 86 GLU H H 1 8.476 . . 1 . . . . 86 GLU H . 16876 1 484 . 1 1 86 86 GLU HA H 1 4.302 . . 1 . . . . 86 GLU HA . 16876 1 485 . 1 1 86 86 GLU C C 13 176.671 . . 1 . . . . 86 GLU C . 16876 1 486 . 1 1 86 86 GLU CA C 13 56.653 . . 1 . . . . 86 GLU CA . 16876 1 487 . 1 1 86 86 GLU CB C 13 30.071 . . 1 . . . . 86 GLU CB . 16876 1 488 . 1 1 86 86 GLU N N 15 122.612 . . 1 . . . . 86 GLU N . 16876 1 489 . 1 1 87 87 GLU H H 1 8.402 . . 1 . . . . 87 GLU H . 16876 1 490 . 1 1 87 87 GLU C C 13 176.701 . . 1 . . . . 87 GLU C . 16876 1 491 . 1 1 87 87 GLU CA C 13 56.43 . . 1 . . . . 87 GLU CA . 16876 1 492 . 1 1 87 87 GLU CB C 13 30.236 . . 1 . . . . 87 GLU CB . 16876 1 493 . 1 1 87 87 GLU N N 15 121.379 . . 1 . . . . 87 GLU N . 16876 1 494 . 1 1 88 88 GLU H H 1 8.499 . . 1 . . . . 88 GLU H . 16876 1 495 . 1 1 88 88 GLU HA H 1 4.279 . . 1 . . . . 88 GLU HA . 16876 1 496 . 1 1 88 88 GLU C C 13 177.215 . . 1 . . . . 88 GLU C . 16876 1 497 . 1 1 88 88 GLU CA C 13 56.732 . . 1 . . . . 88 GLU CA . 16876 1 498 . 1 1 88 88 GLU CB C 13 30.229 . . 1 . . . . 88 GLU CB . 16876 1 499 . 1 1 88 88 GLU N N 15 122.382 . . 1 . . . . 88 GLU N . 16876 1 500 . 1 1 89 89 GLY H H 1 8.548 . . 1 . . . . 89 GLY H . 16876 1 501 . 1 1 89 89 GLY HA2 H 1 3.988 . . 2 . . . . 89 GLY HA2 . 16876 1 502 . 1 1 89 89 GLY HA3 H 1 3.988 . . 2 . . . . 89 GLY HA3 . 16876 1 503 . 1 1 89 89 GLY C C 13 174.577 . . 1 . . . . 89 GLY C . 16876 1 504 . 1 1 89 89 GLY CA C 13 45.172 . . 1 . . . . 89 GLY CA . 16876 1 505 . 1 1 89 89 GLY N N 15 110.238 . . 1 . . . . 89 GLY N . 16876 1 506 . 1 1 90 90 SER H H 1 8.385 . . 1 . . . . 90 SER H . 16876 1 507 . 1 1 90 90 SER HA H 1 4.465 . . 1 . . . . 90 SER HA . 16876 1 508 . 1 1 90 90 SER C C 13 174.831 . . 1 . . . . 90 SER C . 16876 1 509 . 1 1 90 90 SER CA C 13 58.557 . . 1 . . . . 90 SER CA . 16876 1 510 . 1 1 90 90 SER CB C 13 63.827 . . 1 . . . . 90 SER CB . 16876 1 511 . 1 1 90 90 SER N N 15 115.954 . . 1 . . . . 90 SER N . 16876 1 512 . 1 1 91 91 ASP H H 1 8.608 . . 1 . . . . 91 ASP H . 16876 1 513 . 1 1 91 91 ASP HA H 1 4.606 . . 1 . . . . 91 ASP HA . 16876 1 514 . 1 1 91 91 ASP C C 13 177.163 . . 1 . . . . 91 ASP C . 16876 1 515 . 1 1 91 91 ASP CA C 13 54.749 . . 1 . . . . 91 ASP CA . 16876 1 516 . 1 1 91 91 ASP CB C 13 40.915 . . 1 . . . . 91 ASP CB . 16876 1 517 . 1 1 91 91 ASP N N 15 122.161 . . 1 . . . . 91 ASP N . 16876 1 518 . 1 1 92 92 GLY H H 1 8.411 . . 1 . . . . 92 GLY H . 16876 1 519 . 1 1 92 92 GLY C C 13 174.925 . . 1 . . . . 92 GLY C . 16876 1 520 . 1 1 92 92 GLY CA C 13 45.758 . . 1 . . . . 92 GLY CA . 16876 1 521 . 1 1 92 92 GLY N N 15 108.973 . . 1 . . . . 92 GLY N . 16876 1 522 . 1 1 93 93 GLU H H 1 8.263 . . 1 . . . . 93 GLU H . 16876 1 523 . 1 1 93 93 GLU HA H 1 4.214 . . 1 . . . . 93 GLU HA . 16876 1 524 . 1 1 93 93 GLU C C 13 177.269 . . 1 . . . . 93 GLU C . 16876 1 525 . 1 1 93 93 GLU CA C 13 56.977 . . 1 . . . . 93 GLU CA . 16876 1 526 . 1 1 93 93 GLU CB C 13 29.895 . . 1 . . . . 93 GLU CB . 16876 1 527 . 1 1 93 93 GLU N N 15 120.95 . . 1 . . . . 93 GLU N . 16876 1 528 . 1 1 94 94 LYS H H 1 8.324 . . 1 . . . . 94 LYS H . 16876 1 529 . 1 1 94 94 LYS HA H 1 4.225 . . 1 . . . . 94 LYS HA . 16876 1 530 . 1 1 94 94 LYS C C 13 177.28 . . 1 . . . . 94 LYS C . 16876 1 531 . 1 1 94 94 LYS CA C 13 56.986 . . 1 . . . . 94 LYS CA . 16876 1 532 . 1 1 94 94 LYS CB C 13 32.571 . . 1 . . . . 94 LYS CB . 16876 1 533 . 1 1 94 94 LYS N N 15 121.562 . . 1 . . . . 94 LYS N . 16876 1 534 . 1 1 95 95 ARG H H 1 8.26 . . 1 . . . . 95 ARG H . 16876 1 535 . 1 1 95 95 ARG C C 13 176.685 . . 1 . . . . 95 ARG C . 16876 1 536 . 1 1 95 95 ARG CA C 13 56.904 . . 1 . . . . 95 ARG CA . 16876 1 537 . 1 1 95 95 ARG CB C 13 30.599 . . 1 . . . . 95 ARG CB . 16876 1 538 . 1 1 95 95 ARG N N 15 121.056 . . 1 . . . . 95 ARG N . 16876 1 539 . 1 1 96 96 LYS H H 1 8.258 . . 1 . . . . 96 LYS H . 16876 1 540 . 1 1 96 96 LYS HA H 1 4.244 . . 1 . . . . 96 LYS HA . 16876 1 541 . 1 1 96 96 LYS C C 13 176.85 . . 1 . . . . 96 LYS C . 16876 1 542 . 1 1 96 96 LYS CA C 13 56.589 . . 1 . . . . 96 LYS CA . 16876 1 543 . 1 1 96 96 LYS CB C 13 32.885 . . 1 . . . . 96 LYS CB . 16876 1 544 . 1 1 96 96 LYS N N 15 122.311 . . 1 . . . . 96 LYS N . 16876 1 545 . 1 1 97 97 LYS H H 1 8.331 . . 1 . . . . 97 LYS H . 16876 1 546 . 1 1 97 97 LYS HA H 1 4.26 . . 1 . . . . 97 LYS HA . 16876 1 547 . 1 1 97 97 LYS C C 13 176.773 . . 1 . . . . 97 LYS C . 16876 1 548 . 1 1 97 97 LYS CA C 13 56.408 . . 1 . . . . 97 LYS CA . 16876 1 549 . 1 1 97 97 LYS CB C 13 32.95 . . 1 . . . . 97 LYS CB . 16876 1 550 . 1 1 97 97 LYS N N 15 122.682 . . 1 . . . . 97 LYS N . 16876 1 551 . 1 1 98 98 LYS H H 1 8.387 . . 1 . . . . 98 LYS H . 16876 1 552 . 1 1 98 98 LYS HA H 1 4.254 . . 1 . . . . 98 LYS HA . 16876 1 553 . 1 1 98 98 LYS C C 13 176.671 . . 1 . . . . 98 LYS C . 16876 1 554 . 1 1 98 98 LYS CA C 13 56.455 . . 1 . . . . 98 LYS CA . 16876 1 555 . 1 1 98 98 LYS CB C 13 32.992 . . 1 . . . . 98 LYS CB . 16876 1 556 . 1 1 98 98 LYS N N 15 123.303 . . 1 . . . . 98 LYS N . 16876 1 557 . 1 1 99 99 LYS H H 1 8.436 . . 1 . . . . 99 LYS H . 16876 1 558 . 1 1 99 99 LYS C C 13 176.55 . . 1 . . . . 99 LYS C . 16876 1 559 . 1 1 99 99 LYS CA C 13 56.207 . . 1 . . . . 99 LYS CA . 16876 1 560 . 1 1 99 99 LYS CB C 13 32.948 . . 1 . . . . 99 LYS CB . 16876 1 561 . 1 1 99 99 LYS N N 15 123.349 . . 1 . . . . 99 LYS N . 16876 1 562 . 1 1 100 100 GLU H H 1 8.489 . . 1 . . . . 100 GLU H . 16876 1 563 . 1 1 100 100 GLU HA H 1 4.283 . . 1 . . . . 100 GLU HA . 16876 1 564 . 1 1 100 100 GLU C C 13 176.292 . . 1 . . . . 100 GLU C . 16876 1 565 . 1 1 100 100 GLU CA C 13 56.162 . . 1 . . . . 100 GLU CA . 16876 1 566 . 1 1 100 100 GLU CB C 13 30.46 . . 1 . . . . 100 GLU CB . 16876 1 567 . 1 1 100 100 GLU N N 15 123.174 . . 1 . . . . 100 GLU N . 16876 1 568 . 1 1 101 101 LYS H H 1 8.498 . . 1 . . . . 101 LYS H . 16876 1 569 . 1 1 101 101 LYS HA H 1 4.288 . . 1 . . . . 101 LYS HA . 16876 1 570 . 1 1 101 101 LYS C C 13 176.439 . . 1 . . . . 101 LYS C . 16876 1 571 . 1 1 101 101 LYS CA C 13 56.196 . . 1 . . . . 101 LYS CA . 16876 1 572 . 1 1 101 101 LYS CB C 13 32.989 . . 1 . . . . 101 LYS CB . 16876 1 573 . 1 1 101 101 LYS N N 15 123.792 . . 1 . . . . 101 LYS N . 16876 1 574 . 1 1 102 102 LYS H H 1 8.469 . . 1 . . . . 102 LYS H . 16876 1 575 . 1 1 102 102 LYS HA H 1 4.286 . . 1 . . . . 102 LYS HA . 16876 1 576 . 1 1 102 102 LYS C C 13 176.391 . . 1 . . . . 102 LYS C . 16876 1 577 . 1 1 102 102 LYS CA C 13 55.981 . . 1 . . . . 102 LYS CA . 16876 1 578 . 1 1 102 102 LYS CB C 13 33.069 . . 1 . . . . 102 LYS CB . 16876 1 579 . 1 1 102 102 LYS N N 15 123.809 . . 1 . . . . 102 LYS N . 16876 1 580 . 1 1 103 103 LYS H H 1 8.528 . . 1 . . . . 103 LYS H . 16876 1 581 . 1 1 103 103 LYS HA H 1 4.577 . . 1 . . . . 103 LYS HA . 16876 1 582 . 1 1 103 103 LYS C C 13 174.636 . . 1 . . . . 103 LYS C . 16876 1 583 . 1 1 103 103 LYS CA C 13 54.261 . . 1 . . . . 103 LYS CA . 16876 1 584 . 1 1 103 103 LYS CB C 13 32.326 . . 1 . . . . 103 LYS CB . 16876 1 585 . 1 1 103 103 LYS N N 15 125.136 . . 1 . . . . 103 LYS N . 16876 1 586 . 1 1 104 104 PRO HA H 1 4.513 . . 1 . . . . 104 PRO HA . 16876 1 587 . 1 1 104 104 PRO C C 13 177.134 . . 1 . . . . 104 PRO C . 16876 1 588 . 1 1 104 104 PRO CA C 13 62.99 . . 1 . . . . 104 PRO CA . 16876 1 589 . 1 1 104 104 PRO CB C 13 32.206 . . 1 . . . . 104 PRO CB . 16876 1 590 . 1 1 104 104 PRO N N 15 137.293 . . 1 . . . . 104 PRO N . 16876 1 591 . 1 1 105 105 THR H H 1 8.466 . . 1 . . . . 105 THR H . 16876 1 592 . 1 1 105 105 THR HA H 1 4.381 . . 1 . . . . 105 THR HA . 16876 1 593 . 1 1 105 105 THR C C 13 174.801 . . 1 . . . . 105 THR C . 16876 1 594 . 1 1 105 105 THR CA C 13 61.903 . . 1 . . . . 105 THR CA . 16876 1 595 . 1 1 105 105 THR CB C 13 69.682 . . 1 . . . . 105 THR CB . 16876 1 596 . 1 1 105 105 THR N N 15 115.236 . . 1 . . . . 105 THR N . 16876 1 597 . 1 1 106 106 THR H H 1 8.2 . . 1 . . . . 106 THR H . 16876 1 598 . 1 1 106 106 THR HA H 1 4.361 . . 1 . . . . 106 THR HA . 16876 1 599 . 1 1 106 106 THR C C 13 174.423 . . 1 . . . . 106 THR C . 16876 1 600 . 1 1 106 106 THR CA C 13 61.735 . . 1 . . . . 106 THR CA . 16876 1 601 . 1 1 106 106 THR CB C 13 69.766 . . 1 . . . . 106 THR CB . 16876 1 602 . 1 1 106 106 THR N N 15 116.156 . . 1 . . . . 106 THR N . 16876 1 603 . 1 1 107 107 GLU H H 1 8.516 . . 1 . . . . 107 GLU H . 16876 1 604 . 1 1 107 107 GLU C C 13 176.457 . . 1 . . . . 107 GLU C . 16876 1 605 . 1 1 107 107 GLU CA C 13 56.418 . . 1 . . . . 107 GLU CA . 16876 1 606 . 1 1 107 107 GLU CB C 13 30.248 . . 1 . . . . 107 GLU CB . 16876 1 607 . 1 1 107 107 GLU N N 15 123.781 . . 1 . . . . 107 GLU N . 16876 1 608 . 1 1 108 108 VAL H H 1 8.219 . . 1 . . . . 108 VAL H . 16876 1 609 . 1 1 108 108 VAL HA H 1 4.061 . . 1 . . . . 108 VAL HA . 16876 1 610 . 1 1 108 108 VAL C C 13 176.089 . . 1 . . . . 108 VAL C . 16876 1 611 . 1 1 108 108 VAL CA C 13 62.365 . . 1 . . . . 108 VAL CA . 16876 1 612 . 1 1 108 108 VAL CB C 13 32.704 . . 1 . . . . 108 VAL CB . 16876 1 613 . 1 1 108 108 VAL N N 15 121.395 . . 1 . . . . 108 VAL N . 16876 1 614 . 1 1 109 109 GLU H H 1 8.481 . . 1 . . . . 109 GLU H . 16876 1 615 . 1 1 109 109 GLU HA H 1 4.283 . . 1 . . . . 109 GLU HA . 16876 1 616 . 1 1 109 109 GLU C C 13 176.416 . . 1 . . . . 109 GLU C . 16876 1 617 . 1 1 109 109 GLU CA C 13 56.508 . . 1 . . . . 109 GLU CA . 16876 1 618 . 1 1 109 109 GLU CB C 13 30.364 . . 1 . . . . 109 GLU CB . 16876 1 619 . 1 1 109 109 GLU N N 15 125.317 . . 1 . . . . 109 GLU N . 16876 1 620 . 1 1 110 110 VAL H H 1 8.374 . . 1 . . . . 110 VAL H . 16876 1 621 . 1 1 110 110 VAL HA H 1 4.034 . . 1 . . . . 110 VAL HA . 16876 1 622 . 1 1 110 110 VAL C C 13 176.218 . . 1 . . . . 110 VAL C . 16876 1 623 . 1 1 110 110 VAL CA C 13 62.487 . . 1 . . . . 110 VAL CA . 16876 1 624 . 1 1 110 110 VAL CB C 13 32.65 . . 1 . . . . 110 VAL CB . 16876 1 625 . 1 1 110 110 VAL N N 15 123.533 . . 1 . . . . 110 VAL N . 16876 1 626 . 1 1 111 111 LYS H H 1 8.524 . . 1 . . . . 111 LYS H . 16876 1 627 . 1 1 111 111 LYS HA H 1 4.32 . . 1 . . . . 111 LYS HA . 16876 1 628 . 1 1 111 111 LYS C C 13 176.935 . . 1 . . . . 111 LYS C . 16876 1 629 . 1 1 111 111 LYS CA C 13 56.156 . . 1 . . . . 111 LYS CA . 16876 1 630 . 1 1 111 111 LYS CB C 13 32.896 . . 1 . . . . 111 LYS CB . 16876 1 631 . 1 1 111 111 LYS N N 15 126.012 . . 1 . . . . 111 LYS N . 16876 1 632 . 1 1 112 112 GLU H H 1 8.578 . . 1 . . . . 112 GLU H . 16876 1 633 . 1 1 112 112 GLU HA H 1 4.173 . . 1 . . . . 112 GLU HA . 16876 1 634 . 1 1 112 112 GLU C C 13 177.025 . . 1 . . . . 112 GLU C . 16876 1 635 . 1 1 112 112 GLU CA C 13 57.121 . . 1 . . . . 112 GLU CA . 16876 1 636 . 1 1 112 112 GLU CB C 13 30.071 . . 1 . . . . 112 GLU CB . 16876 1 637 . 1 1 112 112 GLU N N 15 123.082 . . 1 . . . . 112 GLU N . 16876 1 638 . 1 1 113 113 GLU H H 1 8.651 . . 1 . . . . 113 GLU H . 16876 1 639 . 1 1 113 113 GLU C C 13 176.933 . . 1 . . . . 113 GLU C . 16876 1 640 . 1 1 113 113 GLU CA C 13 57.013 . . 1 . . . . 113 GLU CA . 16876 1 641 . 1 1 113 113 GLU CB C 13 29.988 . . 1 . . . . 113 GLU CB . 16876 1 642 . 1 1 113 113 GLU N N 15 121.489 . . 1 . . . . 113 GLU N . 16876 1 643 . 1 1 114 114 GLU H H 1 8.384 . . 1 . . . . 114 GLU H . 16876 1 644 . 1 1 114 114 GLU HA H 1 4.211 . . 1 . . . . 114 GLU HA . 16876 1 645 . 1 1 114 114 GLU C C 13 176.874 . . 1 . . . . 114 GLU C . 16876 1 646 . 1 1 114 114 GLU CA C 13 56.757 . . 1 . . . . 114 GLU CA . 16876 1 647 . 1 1 114 114 GLU CB C 13 30.089 . . 1 . . . . 114 GLU CB . 16876 1 648 . 1 1 114 114 GLU N N 15 121.907 . . 1 . . . . 114 GLU N . 16876 1 649 . 1 1 115 115 LYS H H 1 8.279 . . 1 . . . . 115 LYS H . 16876 1 650 . 1 1 115 115 LYS HA H 1 4.249 . . 1 . . . . 115 LYS HA . 16876 1 651 . 1 1 115 115 LYS C C 13 176.972 . . 1 . . . . 115 LYS C . 16876 1 652 . 1 1 115 115 LYS CA C 13 56.59 . . 1 . . . . 115 LYS CA . 16876 1 653 . 1 1 115 115 LYS CB C 13 32.709 . . 1 . . . . 115 LYS CB . 16876 1 654 . 1 1 115 115 LYS N N 15 122.467 . . 1 . . . . 115 LYS N . 16876 1 655 . 1 1 116 116 LYS H H 1 8.36 . . 1 . . . . 116 LYS H . 16876 1 656 . 1 1 116 116 LYS HA H 1 4.254 . . 1 . . . . 116 LYS HA . 16876 1 657 . 1 1 116 116 LYS C C 13 177.488 . . 1 . . . . 116 LYS C . 16876 1 658 . 1 1 116 116 LYS CA C 13 56.918 . . 1 . . . . 116 LYS CA . 16876 1 659 . 1 1 116 116 LYS CB C 13 32.845 . . 1 . . . . 116 LYS CB . 16876 1 660 . 1 1 116 116 LYS N N 15 122.343 . . 1 . . . . 116 LYS N . 16876 1 661 . 1 1 117 117 GLY H H 1 8.502 . . 1 . . . . 117 GLY H . 16876 1 662 . 1 1 117 117 GLY HA2 H 1 3.924 . . 2 . . . . 117 GLY HA2 . 16876 1 663 . 1 1 117 117 GLY HA3 H 1 3.924 . . 2 . . . . 117 GLY HA3 . 16876 1 664 . 1 1 117 117 GLY C C 13 174.358 . . 1 . . . . 117 GLY C . 16876 1 665 . 1 1 117 117 GLY CA C 13 45.34 . . 1 . . . . 117 GLY CA . 16876 1 666 . 1 1 117 117 GLY N N 15 109.808 . . 1 . . . . 117 GLY N . 16876 1 667 . 1 1 118 118 PHE H H 1 8.128 . . 1 . . . . 118 PHE H . 16876 1 668 . 1 1 118 118 PHE HA H 1 4.508 . . 1 . . . . 118 PHE HA . 16876 1 669 . 1 1 118 118 PHE C C 13 176.26 . . 1 . . . . 118 PHE C . 16876 1 670 . 1 1 118 118 PHE CA C 13 58.618 . . 1 . . . . 118 PHE CA . 16876 1 671 . 1 1 118 118 PHE CB C 13 39.333 . . 1 . . . . 118 PHE CB . 16876 1 672 . 1 1 118 118 PHE N N 15 120.503 . . 1 . . . . 118 PHE N . 16876 1 673 . 1 1 119 119 MET H H 1 8.284 . . 1 . . . . 119 MET H . 16876 1 674 . 1 1 119 119 MET C C 13 176.478 . . 1 . . . . 119 MET C . 16876 1 675 . 1 1 119 119 MET CA C 13 55.687 . . 1 . . . . 119 MET CA . 16876 1 676 . 1 1 119 119 MET CB C 13 32.474 . . 1 . . . . 119 MET CB . 16876 1 677 . 1 1 119 119 MET N N 15 121.397 . . 1 . . . . 119 MET N . 16876 1 678 . 1 1 120 120 GLU H H 1 8.289 . . 1 . . . . 120 GLU H . 16876 1 679 . 1 1 120 120 GLU C C 13 176.939 . . 1 . . . . 120 GLU C . 16876 1 680 . 1 1 120 120 GLU CA C 13 57.131 . . 1 . . . . 120 GLU CA . 16876 1 681 . 1 1 120 120 GLU CB C 13 30.012 . . 1 . . . . 120 GLU CB . 16876 1 682 . 1 1 120 120 GLU N N 15 121.888 . . 1 . . . . 120 GLU N . 16876 1 683 . 1 1 121 121 LYS H H 1 8.249 . . 1 . . . . 121 LYS H . 16876 1 684 . 1 1 121 121 LYS HA H 1 4.225 . . 1 . . . . 121 LYS HA . 16876 1 685 . 1 1 121 121 LYS C C 13 176.998 . . 1 . . . . 121 LYS C . 16876 1 686 . 1 1 121 121 LYS CA C 13 56.747 . . 1 . . . . 121 LYS CA . 16876 1 687 . 1 1 121 121 LYS CB C 13 32.546 . . 1 . . . . 121 LYS CB . 16876 1 688 . 1 1 121 121 LYS N N 15 121.853 . . 1 . . . . 121 LYS N . 16876 1 689 . 1 1 122 122 LEU H H 1 8.138 . . 1 . . . . 122 LEU H . 16876 1 690 . 1 1 122 122 LEU HA H 1 4.248 . . 1 . . . . 122 LEU HA . 16876 1 691 . 1 1 122 122 LEU C C 13 177.724 . . 1 . . . . 122 LEU C . 16876 1 692 . 1 1 122 122 LEU CA C 13 55.511 . . 1 . . . . 122 LEU CA . 16876 1 693 . 1 1 122 122 LEU CB C 13 42.088 . . 1 . . . . 122 LEU CB . 16876 1 694 . 1 1 122 122 LEU N N 15 122.752 . . 1 . . . . 122 LEU N . 16876 1 695 . 1 1 123 123 LYS H H 1 8.207 . . 1 . . . . 123 LYS H . 16876 1 696 . 1 1 123 123 LYS HA H 1 4.223 . . 1 . . . . 123 LYS HA . 16876 1 697 . 1 1 123 123 LYS C C 13 176.72 . . 1 . . . . 123 LYS C . 16876 1 698 . 1 1 123 123 LYS CA C 13 56.566 . . 1 . . . . 123 LYS CA . 16876 1 699 . 1 1 123 123 LYS CB C 13 32.767 . . 1 . . . . 123 LYS CB . 16876 1 700 . 1 1 123 123 LYS N N 15 121.676 . . 1 . . . . 123 LYS N . 16876 1 701 . 1 1 124 124 GLU H H 1 8.243 . . 1 . . . . 124 GLU H . 16876 1 702 . 1 1 124 124 GLU HA H 1 4.193 . . 1 . . . . 124 GLU HA . 16876 1 703 . 1 1 124 124 GLU C C 13 176.213 . . 1 . . . . 124 GLU C . 16876 1 704 . 1 1 124 124 GLU CA C 13 56.482 . . 1 . . . . 124 GLU CA . 16876 1 705 . 1 1 124 124 GLU CB C 13 30.306 . . 1 . . . . 124 GLU CB . 16876 1 706 . 1 1 124 124 GLU N N 15 121.49 . . 1 . . . . 124 GLU N . 16876 1 707 . 1 1 125 125 LYS H H 1 8.314 . . 1 . . . . 125 LYS H . 16876 1 708 . 1 1 125 125 LYS HA H 1 4.283 . . 1 . . . . 125 LYS HA . 16876 1 709 . 1 1 125 125 LYS C C 13 176.283 . . 1 . . . . 125 LYS C . 16876 1 710 . 1 1 125 125 LYS CA C 13 55.987 . . 1 . . . . 125 LYS CA . 16876 1 711 . 1 1 125 125 LYS CB C 13 32.885 . . 1 . . . . 125 LYS CB . 16876 1 712 . 1 1 125 125 LYS N N 15 122.402 . . 1 . . . . 125 LYS N . 16876 1 713 . 1 1 126 126 LEU H H 1 8.344 . . 1 . . . . 126 LEU H . 16876 1 714 . 1 1 126 126 LEU HA H 1 4.606 . . 1 . . . . 126 LEU HA . 16876 1 715 . 1 1 126 126 LEU C C 13 175.312 . . 1 . . . . 126 LEU C . 16876 1 716 . 1 1 126 126 LEU CA C 13 52.874 . . 1 . . . . 126 LEU CA . 16876 1 717 . 1 1 126 126 LEU CB C 13 41.384 . . 1 . . . . 126 LEU CB . 16876 1 718 . 1 1 126 126 LEU N N 15 125.071 . . 1 . . . . 126 LEU N . 16876 1 719 . 1 1 127 127 PRO HA H 1 4.412 . . 1 . . . . 127 PRO HA . 16876 1 720 . 1 1 127 127 PRO C C 13 177.653 . . 1 . . . . 127 PRO C . 16876 1 721 . 1 1 127 127 PRO CA C 13 63.325 . . 1 . . . . 127 PRO CA . 16876 1 722 . 1 1 127 127 PRO CB C 13 31.955 . . 1 . . . . 127 PRO CB . 16876 1 723 . 1 1 127 127 PRO N N 15 136.24 . . 1 . . . . 127 PRO N . 16876 1 724 . 1 1 128 128 GLY H H 1 8.558 . . 1 . . . . 128 GLY H . 16876 1 725 . 1 1 128 128 GLY HA2 H 1 3.914 . . 2 . . . . 128 GLY HA2 . 16876 1 726 . 1 1 128 128 GLY HA3 H 1 3.914 . . 2 . . . . 128 GLY HA3 . 16876 1 727 . 1 1 128 128 GLY C C 13 174.028 . . 1 . . . . 128 GLY C . 16876 1 728 . 1 1 128 128 GLY CA C 13 45.196 . . 1 . . . . 128 GLY CA . 16876 1 729 . 1 1 128 128 GLY N N 15 109.324 . . 1 . . . . 128 GLY N . 16876 1 730 . 1 1 129 129 HIS H H 1 8.305 . . 1 . . . . 129 HIS H . 16876 1 731 . 1 1 129 129 HIS HA H 1 4.64 . . 1 . . . . 129 HIS HA . 16876 1 732 . 1 1 129 129 HIS C C 13 174.843 . . 1 . . . . 129 HIS C . 16876 1 733 . 1 1 129 129 HIS CA C 13 55.712 . . 1 . . . . 129 HIS CA . 16876 1 734 . 1 1 129 129 HIS CB C 13 29.864 . . 1 . . . . 129 HIS CB . 16876 1 735 . 1 1 129 129 HIS N N 15 118.821 . . 1 . . . . 129 HIS N . 16876 1 736 . 1 1 130 130 LYS H H 1 8.436 . . 1 . . . . 130 LYS H . 16876 1 737 . 1 1 130 130 LYS HA H 1 4.303 . . 1 . . . . 130 LYS HA . 16876 1 738 . 1 1 130 130 LYS C C 13 176.218 . . 1 . . . . 130 LYS C . 16876 1 739 . 1 1 130 130 LYS CA C 13 56.066 . . 1 . . . . 130 LYS CA . 16876 1 740 . 1 1 130 130 LYS CB C 13 33.176 . . 1 . . . . 130 LYS CB . 16876 1 741 . 1 1 130 130 LYS N N 15 123.385 . . 1 . . . . 130 LYS N . 16876 1 742 . 1 1 131 131 LYS H H 1 8.587 . . 1 . . . . 131 LYS H . 16876 1 743 . 1 1 131 131 LYS HA H 1 4.576 . . 1 . . . . 131 LYS HA . 16876 1 744 . 1 1 131 131 LYS C C 13 174.776 . . 1 . . . . 131 LYS C . 16876 1 745 . 1 1 131 131 LYS CA C 13 54.296 . . 1 . . . . 131 LYS CA . 16876 1 746 . 1 1 131 131 LYS CB C 13 32.24 . . 1 . . . . 131 LYS CB . 16876 1 747 . 1 1 131 131 LYS N N 15 125.071 . . 1 . . . . 131 LYS N . 16876 1 748 . 1 1 132 132 PRO HA H 1 4.389 . . 1 . . . . 132 PRO HA . 16876 1 749 . 1 1 132 132 PRO C C 13 177.256 . . 1 . . . . 132 PRO C . 16876 1 750 . 1 1 132 132 PRO CA C 13 63.206 . . 1 . . . . 132 PRO CA . 16876 1 751 . 1 1 132 132 PRO CB C 13 31.989 . . 1 . . . . 132 PRO CB . 16876 1 752 . 1 1 132 132 PRO N N 15 137.606 . . 1 . . . . 132 PRO N . 16876 1 753 . 1 1 133 133 GLU H H 1 8.764 . . 1 . . . . 133 GLU H . 16876 1 754 . 1 1 133 133 GLU HA H 1 4.259 . . 1 . . . . 133 GLU HA . 16876 1 755 . 1 1 133 133 GLU C C 13 176.502 . . 1 . . . . 133 GLU C . 16876 1 756 . 1 1 133 133 GLU CA C 13 56.566 . . 1 . . . . 133 GLU CA . 16876 1 757 . 1 1 133 133 GLU CB C 13 29.895 . . 1 . . . . 133 GLU CB . 16876 1 758 . 1 1 133 133 GLU N N 15 121.204 . . 1 . . . . 133 GLU N . 16876 1 759 . 1 1 134 134 ASP H H 1 8.367 . . 1 . . . . 134 ASP H . 16876 1 760 . 1 1 134 134 ASP HA H 1 4.6 . . 1 . . . . 134 ASP HA . 16876 1 761 . 1 1 134 134 ASP C C 13 177.057 . . 1 . . . . 134 ASP C . 16876 1 762 . 1 1 134 134 ASP CA C 13 54.276 . . 1 . . . . 134 ASP CA . 16876 1 763 . 1 1 134 134 ASP CB C 13 41.091 . . 1 . . . . 134 ASP CB . 16876 1 764 . 1 1 134 134 ASP N N 15 121.582 . . 1 . . . . 134 ASP N . 16876 1 765 . 1 1 135 135 GLY H H 1 8.486 . . 1 . . . . 135 GLY H . 16876 1 766 . 1 1 135 135 GLY HA2 H 1 4.022 . . 2 . . . . 135 GLY HA2 . 16876 1 767 . 1 1 135 135 GLY HA3 H 1 4.022 . . 2 . . . . 135 GLY HA3 . 16876 1 768 . 1 1 135 135 GLY C C 13 174.606 . . 1 . . . . 135 GLY C . 16876 1 769 . 1 1 135 135 GLY CA C 13 45.423 . . 1 . . . . 135 GLY CA . 16876 1 770 . 1 1 135 135 GLY N N 15 110.093 . . 1 . . . . 135 GLY N . 16876 1 771 . 1 1 136 136 SER H H 1 8.279 . . 1 . . . . 136 SER H . 16876 1 772 . 1 1 136 136 SER HA H 1 4.399 . . 1 . . . . 136 SER HA . 16876 1 773 . 1 1 136 136 SER C C 13 174.447 . . 1 . . . . 136 SER C . 16876 1 774 . 1 1 136 136 SER CA C 13 58.64 . . 1 . . . . 136 SER CA . 16876 1 775 . 1 1 136 136 SER CB C 13 63.743 . . 1 . . . . 136 SER CB . 16876 1 776 . 1 1 136 136 SER N N 15 115.984 . . 1 . . . . 136 SER N . 16876 1 777 . 1 1 137 137 ALA H H 1 8.352 . . 1 . . . . 137 ALA H . 16876 1 778 . 1 1 137 137 ALA HA H 1 4.355 . . 1 . . . . 137 ALA HA . 16876 1 779 . 1 1 137 137 ALA C C 13 177.755 . . 1 . . . . 137 ALA C . 16876 1 780 . 1 1 137 137 ALA CA C 13 52.304 . . 1 . . . . 137 ALA CA . 16876 1 781 . 1 1 137 137 ALA CB C 13 19.138 . . 1 . . . . 137 ALA CB . 16876 1 782 . 1 1 137 137 ALA N N 15 125.853 . . 1 . . . . 137 ALA N . 16876 1 783 . 1 1 138 138 VAL H H 1 8.082 . . 1 . . . . 138 VAL H . 16876 1 784 . 1 1 138 138 VAL HA H 1 4.054 . . 1 . . . . 138 VAL HA . 16876 1 785 . 1 1 138 138 VAL C C 13 175.941 . . 1 . . . . 138 VAL C . 16876 1 786 . 1 1 138 138 VAL CA C 13 62.07 . . 1 . . . . 138 VAL CA . 16876 1 787 . 1 1 138 138 VAL CB C 13 32.708 . . 1 . . . . 138 VAL CB . 16876 1 788 . 1 1 138 138 VAL N N 15 119.518 . . 1 . . . . 138 VAL N . 16876 1 789 . 1 1 139 139 ALA H H 1 8.38 . . 1 . . . . 139 ALA H . 16876 1 790 . 1 1 139 139 ALA HA H 1 4.286 . . 1 . . . . 139 ALA HA . 16876 1 791 . 1 1 139 139 ALA C C 13 177.198 . . 1 . . . . 139 ALA C . 16876 1 792 . 1 1 139 139 ALA CA C 13 52.17 . . 1 . . . . 139 ALA CA . 16876 1 793 . 1 1 139 139 ALA CB C 13 19.168 . . 1 . . . . 139 ALA CB . 16876 1 794 . 1 1 139 139 ALA N N 15 128.29 . . 1 . . . . 139 ALA N . 16876 1 795 . 1 1 140 140 ALA H H 1 8.292 . . 1 . . . . 140 ALA H . 16876 1 796 . 1 1 140 140 ALA HA H 1 4.275 . . 1 . . . . 140 ALA HA . 16876 1 797 . 1 1 140 140 ALA C C 13 177.058 . . 1 . . . . 140 ALA C . 16876 1 798 . 1 1 140 140 ALA CA C 13 51.925 . . 1 . . . . 140 ALA CA . 16876 1 799 . 1 1 140 140 ALA CB C 13 19.312 . . 1 . . . . 140 ALA CB . 16876 1 800 . 1 1 140 140 ALA N N 15 123.975 . . 1 . . . . 140 ALA N . 16876 1 801 . 1 1 141 141 ALA H H 1 8.301 . . 1 . . . . 141 ALA H . 16876 1 802 . 1 1 141 141 ALA HA H 1 4.567 . . 1 . . . . 141 ALA HA . 16876 1 803 . 1 1 141 141 ALA C C 13 175.501 . . 1 . . . . 141 ALA C . 16876 1 804 . 1 1 141 141 ALA CA C 13 50.294 . . 1 . . . . 141 ALA CA . 16876 1 805 . 1 1 141 141 ALA CB C 13 17.937 . . 1 . . . . 141 ALA CB . 16876 1 806 . 1 1 141 141 ALA N N 15 125.209 . . 1 . . . . 141 ALA N . 16876 1 807 . 1 1 142 142 PRO C C 13 176.747 . . 1 . . . . 142 PRO C . 16876 1 808 . 1 1 142 142 PRO CA C 13 62.645 . . 1 . . . . 142 PRO CA . 16876 1 809 . 1 1 142 142 PRO CB C 13 31.989 . . 1 . . . . 142 PRO CB . 16876 1 810 . 1 1 142 142 PRO N N 15 135.842 . . 1 . . . . 142 PRO N . 16876 1 811 . 1 1 143 143 VAL H H 1 8.338 . . 1 . . . . 143 VAL H . 16876 1 812 . 1 1 143 143 VAL HA H 1 4.045 . . 1 . . . . 143 VAL HA . 16876 1 813 . 1 1 143 143 VAL C C 13 176.136 . . 1 . . . . 143 VAL C . 16876 1 814 . 1 1 143 143 VAL CA C 13 62.339 . . 1 . . . . 143 VAL CA . 16876 1 815 . 1 1 143 143 VAL CB C 13 32.642 . . 1 . . . . 143 VAL CB . 16876 1 816 . 1 1 143 143 VAL N N 15 121.65 . . 1 . . . . 143 VAL N . 16876 1 817 . 1 1 144 144 VAL H H 1 8.385 . . 1 . . . . 144 VAL H . 16876 1 818 . 1 1 144 144 VAL HA H 1 4.097 . . 1 . . . . 144 VAL HA . 16876 1 819 . 1 1 144 144 VAL C C 13 175.831 . . 1 . . . . 144 VAL C . 16876 1 820 . 1 1 144 144 VAL CA C 13 62.055 . . 1 . . . . 144 VAL CA . 16876 1 821 . 1 1 144 144 VAL CB C 13 32.748 . . 1 . . . . 144 VAL CB . 16876 1 822 . 1 1 144 144 VAL N N 15 126.214 . . 1 . . . . 144 VAL N . 16876 1 823 . 1 1 145 145 VAL H H 1 8.47 . . 1 . . . . 145 VAL H . 16876 1 824 . 1 1 145 145 VAL HA H 1 4.401 . . 1 . . . . 145 VAL HA . 16876 1 825 . 1 1 145 145 VAL C C 13 173.927 . . 1 . . . . 145 VAL C . 16876 1 826 . 1 1 145 145 VAL CA C 13 59.615 . . 1 . . . . 145 VAL CA . 16876 1 827 . 1 1 145 145 VAL CB C 13 32.58 . . 1 . . . . 145 VAL CB . 16876 1 828 . 1 1 145 145 VAL N N 15 128.01 . . 1 . . . . 145 VAL N . 16876 1 829 . 1 1 146 146 PRO N N 15 141.167 . . 1 . . . . 146 PRO N . 16876 1 830 . 1 1 147 147 PRO HA H 1 4.708 . . 1 . . . . 147 PRO HA . 16876 1 831 . 1 1 147 147 PRO C C 13 174.722 . . 1 . . . . 147 PRO C . 16876 1 832 . 1 1 148 148 PRO HA H 1 4.442 . . 1 . . . . 148 PRO HA . 16876 1 833 . 1 1 148 148 PRO C C 13 177.009 . . 1 . . . . 148 PRO C . 16876 1 834 . 1 1 148 148 PRO CA C 13 62.645 . . 1 . . . . 148 PRO CA . 16876 1 835 . 1 1 148 148 PRO CB C 13 31.989 . . 1 . . . . 148 PRO CB . 16876 1 836 . 1 1 148 148 PRO N N 15 135.273 . . 1 . . . . 148 PRO N . 16876 1 837 . 1 1 149 149 VAL H H 1 8.294 . . 1 . . . . 149 VAL H . 16876 1 838 . 1 1 149 149 VAL C C 13 176.26 . . 1 . . . . 149 VAL C . 16876 1 839 . 1 1 149 149 VAL CA C 13 62.413 . . 1 . . . . 149 VAL CA . 16876 1 840 . 1 1 149 149 VAL CB C 13 32.767 . . 1 . . . . 149 VAL CB . 16876 1 841 . 1 1 149 149 VAL N N 15 120.863 . . 1 . . . . 149 VAL N . 16876 1 842 . 1 1 150 150 GLU H H 1 8.565 . . 1 . . . . 150 GLU H . 16876 1 843 . 1 1 150 150 GLU HA H 1 4.29 . . 1 . . . . 150 GLU HA . 16876 1 844 . 1 1 150 150 GLU C C 13 176.201 . . 1 . . . . 150 GLU C . 16876 1 845 . 1 1 150 150 GLU CA C 13 56.215 . . 1 . . . . 150 GLU CA . 16876 1 846 . 1 1 150 150 GLU CB C 13 30.381 . . 1 . . . . 150 GLU CB . 16876 1 847 . 1 1 150 150 GLU N N 15 125.115 . . 1 . . . . 150 GLU N . 16876 1 848 . 1 1 151 151 GLU H H 1 8.49 . . 1 . . . . 151 GLU H . 16876 1 849 . 1 1 151 151 GLU HA H 1 4.212 . . 1 . . . . 151 GLU HA . 16876 1 850 . 1 1 151 151 GLU C C 13 175.864 . . 1 . . . . 151 GLU C . 16876 1 851 . 1 1 151 151 GLU CA C 13 56.125 . . 1 . . . . 151 GLU CA . 16876 1 852 . 1 1 151 151 GLU CB C 13 30.477 . . 1 . . . . 151 GLU CB . 16876 1 853 . 1 1 151 151 GLU N N 15 123.238 . . 1 . . . . 151 GLU N . 16876 1 854 . 1 1 152 152 ALA H H 1 8.405 . . 1 . . . . 152 ALA H . 16876 1 855 . 1 1 152 152 ALA HA H 1 4.214 . . 1 . . . . 152 ALA HA . 16876 1 856 . 1 1 152 152 ALA C C 13 177.289 . . 1 . . . . 152 ALA C . 16876 1 857 . 1 1 152 152 ALA CA C 13 52.405 . . 1 . . . . 152 ALA CA . 16876 1 858 . 1 1 152 152 ALA CB C 13 19.168 . . 1 . . . . 152 ALA CB . 16876 1 859 . 1 1 152 152 ALA N N 15 125.585 . . 1 . . . . 152 ALA N . 16876 1 860 . 1 1 153 153 HIS H H 1 8.524 . . 1 . . . . 153 HIS H . 16876 1 861 . 1 1 153 153 HIS HA H 1 4.957 . . 1 . . . . 153 HIS HA . 16876 1 862 . 1 1 153 153 HIS C C 13 172.553 . . 1 . . . . 153 HIS C . 16876 1 863 . 1 1 153 153 HIS CA C 13 53.203 . . 1 . . . . 153 HIS CA . 16876 1 864 . 1 1 153 153 HIS CB C 13 28.944 . . 1 . . . . 153 HIS CB . 16876 1 865 . 1 1 153 153 HIS N N 15 118.774 . . 1 . . . . 153 HIS N . 16876 1 866 . 1 1 154 154 PRO HA H 1 4.459 . . 1 . . . . 154 PRO HA . 16876 1 867 . 1 1 154 154 PRO C C 13 176.976 . . 1 . . . . 154 PRO C . 16876 1 868 . 1 1 154 154 PRO CA C 13 63.046 . . 1 . . . . 154 PRO CA . 16876 1 869 . 1 1 154 154 PRO CB C 13 32.07 . . 1 . . . . 154 PRO CB . 16876 1 870 . 1 1 154 154 PRO N N 15 137.508 . . 1 . . . . 154 PRO N . 16876 1 871 . 1 1 155 155 VAL H H 1 8.452 . . 1 . . . . 155 VAL H . 16876 1 872 . 1 1 155 155 VAL HA H 1 4.075 . . 1 . . . . 155 VAL HA . 16876 1 873 . 1 1 155 155 VAL C C 13 176.295 . . 1 . . . . 155 VAL C . 16876 1 874 . 1 1 155 155 VAL CA C 13 62.35 . . 1 . . . . 155 VAL CA . 16876 1 875 . 1 1 155 155 VAL CB C 13 32.711 . . 1 . . . . 155 VAL CB . 16876 1 876 . 1 1 155 155 VAL N N 15 121.259 . . 1 . . . . 155 VAL N . 16876 1 877 . 1 1 156 156 GLU H H 1 8.589 . . 1 . . . . 156 GLU H . 16876 1 878 . 1 1 156 156 GLU HA H 1 4.279 . . 1 . . . . 156 GLU HA . 16876 1 879 . 1 1 156 156 GLU C C 13 176.305 . . 1 . . . . 156 GLU C . 16876 1 880 . 1 1 156 156 GLU CA C 13 56.28 . . 1 . . . . 156 GLU CA . 16876 1 881 . 1 1 156 156 GLU CB C 13 30.364 . . 1 . . . . 156 GLU CB . 16876 1 882 . 1 1 156 156 GLU N N 15 125.462 . . 1 . . . . 156 GLU N . 16876 1 883 . 1 1 157 157 LYS H H 1 8.515 . . 1 . . . . 157 LYS H . 16876 1 884 . 1 1 157 157 LYS C C 13 176.446 . . 1 . . . . 157 LYS C . 16876 1 885 . 1 1 157 157 LYS CA C 13 56.207 . . 1 . . . . 157 LYS CA . 16876 1 886 . 1 1 157 157 LYS CB C 13 32.906 . . 1 . . . . 157 LYS CB . 16876 1 887 . 1 1 157 157 LYS N N 15 123.816 . . 1 . . . . 157 LYS N . 16876 1 888 . 1 1 158 158 LYS H H 1 8.487 . . 1 . . . . 158 LYS H . 16876 1 889 . 1 1 158 158 LYS HA H 1 4.294 . . 1 . . . . 158 LYS HA . 16876 1 890 . 1 1 158 158 LYS C C 13 177.149 . . 1 . . . . 158 LYS C . 16876 1 891 . 1 1 158 158 LYS CA C 13 56.443 . . 1 . . . . 158 LYS CA . 16876 1 892 . 1 1 158 158 LYS CB C 13 33.027 . . 1 . . . . 158 LYS CB . 16876 1 893 . 1 1 158 158 LYS N N 15 123.106 . . 1 . . . . 158 LYS N . 16876 1 894 . 1 1 159 159 GLY H H 1 8.57 . . 1 . . . . 159 GLY H . 16876 1 895 . 1 1 159 159 GLY C C 13 174.258 . . 1 . . . . 159 GLY C . 16876 1 896 . 1 1 159 159 GLY CA C 13 45.235 . . 1 . . . . 159 GLY CA . 16876 1 897 . 1 1 159 159 GLY N N 15 110.327 . . 1 . . . . 159 GLY N . 16876 1 898 . 1 1 160 160 ILE H H 1 8.056 . . 1 . . . . 160 ILE H . 16876 1 899 . 1 1 160 160 ILE HA H 1 4.112 . . 1 . . . . 160 ILE HA . 16876 1 900 . 1 1 160 160 ILE C C 13 176.59 . . 1 . . . . 160 ILE C . 16876 1 901 . 1 1 160 160 ILE CA C 13 61.555 . . 1 . . . . 160 ILE CA . 16876 1 902 . 1 1 160 160 ILE CB C 13 38.512 . . 1 . . . . 160 ILE CB . 16876 1 903 . 1 1 160 160 ILE N N 15 120.257 . . 1 . . . . 160 ILE N . 16876 1 904 . 1 1 161 161 LEU H H 1 8.363 . . 1 . . . . 161 LEU H . 16876 1 905 . 1 1 161 161 LEU HA H 1 4.323 . . 1 . . . . 161 LEU HA . 16876 1 906 . 1 1 161 161 LEU C C 13 177.523 . . 1 . . . . 161 LEU C . 16876 1 907 . 1 1 161 161 LEU CA C 13 55.349 . . 1 . . . . 161 LEU CA . 16876 1 908 . 1 1 161 161 LEU CB C 13 41.985 . . 1 . . . . 161 LEU CB . 16876 1 909 . 1 1 161 161 LEU N N 15 125.268 . . 1 . . . . 161 LEU N . 16876 1 910 . 1 1 162 162 GLU H H 1 8.321 . . 1 . . . . 162 GLU H . 16876 1 911 . 1 1 162 162 GLU C C 13 176.543 . . 1 . . . . 162 GLU C . 16876 1 912 . 1 1 162 162 GLU CA C 13 56.742 . . 1 . . . . 162 GLU CA . 16876 1 913 . 1 1 162 162 GLU CB C 13 30.188 . . 1 . . . . 162 GLU CB . 16876 1 914 . 1 1 162 162 GLU N N 15 121.934 . . 1 . . . . 162 GLU N . 16876 1 915 . 1 1 163 163 LYS H H 1 8.289 . . 1 . . . . 163 LYS H . 16876 1 916 . 1 1 163 163 LYS HA H 1 4.244 . . 1 . . . . 163 LYS HA . 16876 1 917 . 1 1 163 163 LYS C C 13 176.876 . . 1 . . . . 163 LYS C . 16876 1 918 . 1 1 163 163 LYS CA C 13 56.59 . . 1 . . . . 163 LYS CA . 16876 1 919 . 1 1 163 163 LYS CB C 13 32.709 . . 1 . . . . 163 LYS CB . 16876 1 920 . 1 1 163 163 LYS N N 15 122.337 . . 1 . . . . 163 LYS N . 16876 1 921 . 1 1 164 164 ILE H H 1 8.162 . . 1 . . . . 164 ILE H . 16876 1 922 . 1 1 164 164 ILE HA H 1 4.075 . . 1 . . . . 164 ILE HA . 16876 1 923 . 1 1 164 164 ILE C C 13 176.614 . . 1 . . . . 164 ILE C . 16876 1 924 . 1 1 164 164 ILE CA C 13 61.49 . . 1 . . . . 164 ILE CA . 16876 1 925 . 1 1 164 164 ILE CB C 13 38.336 . . 1 . . . . 164 ILE CB . 16876 1 926 . 1 1 164 164 ILE N N 15 122.268 . . 1 . . . . 164 ILE N . 16876 1 927 . 1 1 165 165 LYS H H 1 8.363 . . 1 . . . . 165 LYS H . 16876 1 928 . 1 1 165 165 LYS HA H 1 4.211 . . 1 . . . . 165 LYS HA . 16876 1 929 . 1 1 165 165 LYS C C 13 176.663 . . 1 . . . . 165 LYS C . 16876 1 930 . 1 1 165 165 LYS CA C 13 56.742 . . 1 . . . . 165 LYS CA . 16876 1 931 . 1 1 165 165 LYS CB C 13 32.767 . . 1 . . . . 165 LYS CB . 16876 1 932 . 1 1 165 165 LYS N N 15 125.317 . . 1 . . . . 165 LYS N . 16876 1 933 . 1 1 166 166 GLU H H 1 8.319 . . 1 . . . . 166 GLU H . 16876 1 934 . 1 1 166 166 GLU HA H 1 4.061 . . 1 . . . . 166 GLU HA . 16876 1 935 . 1 1 166 166 GLU C C 13 176.213 . . 1 . . . . 166 GLU C . 16876 1 936 . 1 1 166 166 GLU CA C 13 56.587 . . 1 . . . . 166 GLU CA . 16876 1 937 . 1 1 166 166 GLU CB C 13 30.38 . . 1 . . . . 166 GLU CB . 16876 1 938 . 1 1 166 166 GLU N N 15 121.609 . . 1 . . . . 166 GLU N . 16876 1 939 . 1 1 167 167 LYS H H 1 8.259 . . 1 . . . . 167 LYS H . 16876 1 940 . 1 1 167 167 LYS HA H 1 4.261 . . 1 . . . . 167 LYS HA . 16876 1 941 . 1 1 167 167 LYS C C 13 176.289 . . 1 . . . . 167 LYS C . 16876 1 942 . 1 1 167 167 LYS CA C 13 55.864 . . 1 . . . . 167 LYS CA . 16876 1 943 . 1 1 167 167 LYS CB C 13 32.86 . . 1 . . . . 167 LYS CB . 16876 1 944 . 1 1 167 167 LYS N N 15 122.031 . . 1 . . . . 167 LYS N . 16876 1 945 . 1 1 168 168 LEU H H 1 8.267 . . 1 . . . . 168 LEU H . 16876 1 946 . 1 1 168 168 LEU HA H 1 4.61 . . 1 . . . . 168 LEU HA . 16876 1 947 . 1 1 168 168 LEU C C 13 175.27 . . 1 . . . . 168 LEU C . 16876 1 948 . 1 1 168 168 LEU CA C 13 52.932 . . 1 . . . . 168 LEU CA . 16876 1 949 . 1 1 168 168 LEU CB C 13 41.443 . . 1 . . . . 168 LEU CB . 16876 1 950 . 1 1 168 168 LEU N N 15 124.934 . . 1 . . . . 168 LEU N . 16876 1 951 . 1 1 169 169 PRO HA H 1 4.418 . . 1 . . . . 169 PRO HA . 16876 1 952 . 1 1 169 169 PRO C C 13 177.659 . . 1 . . . . 169 PRO C . 16876 1 953 . 1 1 169 169 PRO CA C 13 63.492 . . 1 . . . . 169 PRO CA . 16876 1 954 . 1 1 169 169 PRO CB C 13 31.872 . . 1 . . . . 169 PRO CB . 16876 1 955 . 1 1 169 169 PRO N N 15 136.354 . . 1 . . . . 169 PRO N . 16876 1 956 . 1 1 170 170 GLY H H 1 8.608 . . 1 . . . . 170 GLY H . 16876 1 957 . 1 1 170 170 GLY C C 13 173.585 . . 1 . . . . 170 GLY C . 16876 1 958 . 1 1 170 170 GLY CA C 13 44.921 . . 1 . . . . 170 GLY CA . 16876 1 959 . 1 1 170 170 GLY N N 15 109.598 . . 1 . . . . 170 GLY N . 16876 1 960 . 1 1 171 171 TYR H H 1 7.974 . . 1 . . . . 171 TYR H . 16876 1 961 . 1 1 171 171 TYR HA H 1 4.464 . . 1 . . . . 171 TYR HA . 16876 1 962 . 1 1 171 171 TYR C C 13 175.102 . . 1 . . . . 171 TYR C . 16876 1 963 . 1 1 171 171 TYR CA C 13 57.973 . . 1 . . . . 171 TYR CA . 16876 1 964 . 1 1 171 171 TYR CB C 13 38.864 . . 1 . . . . 171 TYR CB . 16876 1 965 . 1 1 171 171 TYR N N 15 120.724 . . 1 . . . . 171 TYR N . 16876 1 966 . 1 1 172 172 HIS H H 1 8.244 . . 1 . . . . 172 HIS H . 16876 1 967 . 1 1 172 172 HIS HA H 1 4.793 . . 1 . . . . 172 HIS HA . 16876 1 968 . 1 1 172 172 HIS C C 13 171.733 . . 1 . . . . 172 HIS C . 16876 1 969 . 1 1 172 172 HIS CA C 13 52.815 . . 1 . . . . 172 HIS CA . 16876 1 970 . 1 1 172 172 HIS CB C 13 29.426 . . 1 . . . . 172 HIS CB . 16876 1 971 . 1 1 172 172 HIS N N 15 124.377 . . 1 . . . . 172 HIS N . 16876 1 972 . 1 1 173 173 PRO C C 13 176.778 . . 1 . . . . 173 PRO C . 16876 1 973 . 1 1 173 173 PRO CA C 13 62.725 . . 1 . . . . 173 PRO CA . 16876 1 974 . 1 1 173 173 PRO CB C 13 32.07 . . 1 . . . . 173 PRO CB . 16876 1 975 . 1 1 173 173 PRO N N 15 136.724 . . 1 . . . . 173 PRO N . 16876 1 976 . 1 1 174 174 LYS H H 1 8.628 . . 1 . . . . 174 LYS H . 16876 1 977 . 1 1 174 174 LYS HA H 1 4.357 . . 1 . . . . 174 LYS HA . 16876 1 978 . 1 1 174 174 LYS C C 13 176.986 . . 1 . . . . 174 LYS C . 16876 1 979 . 1 1 174 174 LYS CA C 13 56.332 . . 1 . . . . 174 LYS CA . 16876 1 980 . 1 1 174 174 LYS CB C 13 32.949 . . 1 . . . . 174 LYS CB . 16876 1 981 . 1 1 174 174 LYS N N 15 122.06 . . 1 . . . . 174 LYS N . 16876 1 982 . 1 1 175 175 THR H H 1 8.339 . . 1 . . . . 175 THR H . 16876 1 983 . 1 1 175 175 THR HA H 1 4.422 . . 1 . . . . 175 THR HA . 16876 1 984 . 1 1 175 175 THR C C 13 174.618 . . 1 . . . . 175 THR C . 16876 1 985 . 1 1 175 175 THR CA C 13 61.568 . . 1 . . . . 175 THR CA . 16876 1 986 . 1 1 175 175 THR CB C 13 69.766 . . 1 . . . . 175 THR CB . 16876 1 987 . 1 1 175 175 THR N N 15 115.984 . . 1 . . . . 175 THR N . 16876 1 988 . 1 1 176 176 THR H H 1 8.313 . . 1 . . . . 176 THR H . 16876 1 989 . 1 1 176 176 THR HA H 1 4.386 . . 1 . . . . 176 THR HA . 16876 1 990 . 1 1 176 176 THR C C 13 174.536 . . 1 . . . . 176 THR C . 16876 1 991 . 1 1 176 176 THR CA C 13 61.735 . . 1 . . . . 176 THR CA . 16876 1 992 . 1 1 176 176 THR CB C 13 69.85 . . 1 . . . . 176 THR CB . 16876 1 993 . 1 1 176 176 THR N N 15 117.181 . . 1 . . . . 176 THR N . 16876 1 994 . 1 1 177 177 VAL H H 1 8.294 . . 1 . . . . 177 VAL H . 16876 1 995 . 1 1 177 177 VAL C C 13 176.301 . . 1 . . . . 177 VAL C . 16876 1 996 . 1 1 177 177 VAL CA C 13 62.43 . . 1 . . . . 177 VAL CA . 16876 1 997 . 1 1 177 177 VAL CB C 13 32.709 . . 1 . . . . 177 VAL CB . 16876 1 998 . 1 1 177 177 VAL N N 15 122.766 . . 1 . . . . 177 VAL N . 16876 1 999 . 1 1 178 178 GLU H H 1 8.535 . . 1 . . . . 178 GLU H . 16876 1 1000 . 1 1 178 178 GLU C C 13 176.646 . . 1 . . . . 178 GLU C . 16876 1 1001 . 1 1 178 178 GLU CA C 13 56.625 . . 1 . . . . 178 GLU CA . 16876 1 1002 . 1 1 178 178 GLU CB C 13 30.13 . . 1 . . . . 178 GLU CB . 16876 1 1003 . 1 1 178 178 GLU N N 15 124.76 . . 1 . . . . 178 GLU N . 16876 1 1004 . 1 1 179 179 GLU H H 1 8.464 . . 1 . . . . 179 GLU H . 16876 1 1005 . 1 1 179 179 GLU C C 13 176.58 . . 1 . . . . 179 GLU C . 16876 1 1006 . 1 1 179 179 GLU CA C 13 56.611 . . 1 . . . . 179 GLU CA . 16876 1 1007 . 1 1 179 179 GLU CB C 13 30.309 . . 1 . . . . 179 GLU CB . 16876 1 1008 . 1 1 179 179 GLU N N 15 122.382 . . 1 . . . . 179 GLU N . 16876 1 1009 . 1 1 180 180 GLU H H 1 8.481 . . 1 . . . . 180 GLU H . 16876 1 1010 . 1 1 180 180 GLU C C 13 176.493 . . 1 . . . . 180 GLU C . 16876 1 1011 . 1 1 180 180 GLU CA C 13 56.356 . . 1 . . . . 180 GLU CA . 16876 1 1012 . 1 1 180 180 GLU CB C 13 30.2 . . 1 . . . . 180 GLU CB . 16876 1 1013 . 1 1 180 180 GLU N N 15 122.458 . . 1 . . . . 180 GLU N . 16876 1 1014 . 1 1 181 181 LYS H H 1 8.413 . . 1 . . . . 181 LYS H . 16876 1 1015 . 1 1 181 181 LYS HA H 1 4.287 . . 1 . . . . 181 LYS HA . 16876 1 1016 . 1 1 181 181 LYS C C 13 176.587 . . 1 . . . . 181 LYS C . 16876 1 1017 . 1 1 181 181 LYS CA C 13 56.247 . . 1 . . . . 181 LYS CA . 16876 1 1018 . 1 1 181 181 LYS CB C 13 32.841 . . 1 . . . . 181 LYS CB . 16876 1 1019 . 1 1 181 181 LYS N N 15 123.238 . . 1 . . . . 181 LYS N . 16876 1 1020 . 1 1 182 182 LYS H H 1 8.414 . . 1 . . . . 182 LYS H . 16876 1 1021 . 1 1 182 182 LYS HA H 1 4.317 . . 1 . . . . 182 LYS HA . 16876 1 1022 . 1 1 182 182 LYS C C 13 176.416 . . 1 . . . . 182 LYS C . 16876 1 1023 . 1 1 182 182 LYS CA C 13 56.194 . . 1 . . . . 182 LYS CA . 16876 1 1024 . 1 1 182 182 LYS CB C 13 32.968 . . 1 . . . . 182 LYS CB . 16876 1 1025 . 1 1 182 182 LYS N N 15 123.183 . . 1 . . . . 182 LYS N . 16876 1 1026 . 1 1 183 183 ASP H H 1 8.435 . . 1 . . . . 183 ASP H . 16876 1 1027 . 1 1 183 183 ASP HA H 1 4.578 . . 1 . . . . 183 ASP HA . 16876 1 1028 . 1 1 183 183 ASP C C 13 175.97 . . 1 . . . . 183 ASP C . 16876 1 1029 . 1 1 183 183 ASP CA C 13 54.456 . . 1 . . . . 183 ASP CA . 16876 1 1030 . 1 1 183 183 ASP CB C 13 41.033 . . 1 . . . . 183 ASP CB . 16876 1 1031 . 1 1 183 183 ASP N N 15 121.471 . . 1 . . . . 183 ASP N . 16876 1 1032 . 1 1 184 184 LYS H H 1 8.239 . . 1 . . . . 184 LYS H . 16876 1 1033 . 1 1 184 184 LYS HA H 1 4.316 . . 1 . . . . 184 LYS HA . 16876 1 1034 . 1 1 184 184 LYS C C 13 175.687 . . 1 . . . . 184 LYS C . 16876 1 1035 . 1 1 184 184 LYS CA C 13 56.156 . . 1 . . . . 184 LYS CA . 16876 1 1036 . 1 1 184 184 LYS CB C 13 33.061 . . 1 . . . . 184 LYS CB . 16876 1 1037 . 1 1 184 184 LYS N N 15 121.198 . . 1 . . . . 184 LYS N . 16876 1 1038 . 1 1 185 185 GLU H H 1 8.094 . . 1 . . . . 185 GLU H . 16876 1 1039 . 1 1 185 185 GLU C C 13 181.268 . . 1 . . . . 185 GLU C . 16876 1 1040 . 1 1 185 185 GLU CA C 13 58.032 . . 1 . . . . 185 GLU CA . 16876 1 1041 . 1 1 185 185 GLU CB C 13 30.892 . . 1 . . . . 185 GLU CB . 16876 1 1042 . 1 1 185 185 GLU N N 15 127.333 . . 1 . . . . 185 GLU N . 16876 1 stop_ save_ ############################## # Heteronuclear NOE values # ############################## save_heteronuclear_noe_list_1 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronuclear_noe_list_1 _Heteronucl_NOE_list.Entry_ID 16876 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 600 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak height' _Heteronucl_NOE_list.NOE_ref_val 1 _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 11 'hetNOE measurement' . . . 16876 1 stop_ loop_ _Heteronucl_NOE_software.Software_ID _Heteronucl_NOE_software.Software_label _Heteronucl_NOE_software.Method_ID _Heteronucl_NOE_software.Method_label _Heteronucl_NOE_software.Entry_ID _Heteronucl_NOE_software.Heteronucl_NOE_list_ID 1 $TOPSPIN . . 16876 1 3 $SPARKY . . 16876 1 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 3 3 GLU N N 15 . 1 1 3 3 GLU H H 1 -1.031 0.052 . . 1 3 GLU N 1 3 GLU H 16876 1 2 . 1 1 4 4 GLU N N 15 . 1 1 4 4 GLU H H 1 -0.749 0.001 . . 1 4 GLU N 1 4 GLU H 16876 1 3 . 1 1 5 5 ILE N N 15 . 1 1 5 5 ILE H H 1 -0.419 0.003 . . 1 5 ILE N 1 5 ILE H 16876 1 4 . 1 1 6 6 LYS N N 15 . 1 1 6 6 LYS H H 1 -0.342 0.010 . . 1 6 LYS N 1 6 LYS H 16876 1 5 . 1 1 7 7 ASN N N 15 . 1 1 7 7 ASN H H 1 -0.126 0.012 . . 1 7 ASN N 1 7 ASN H 16876 1 6 . 1 1 8 8 VAL N N 15 . 1 1 8 8 VAL H H 1 0.064 0.001 . . 1 8 VAL N 1 8 VAL H 16876 1 7 . 1 1 10 10 GLU N N 15 . 1 1 10 10 GLU H H 1 -0.032 0.002 . . 1 10 GLU N 1 10 GLU H 16876 1 8 . 1 1 11 11 GLN N N 15 . 1 1 11 11 GLN H H 1 0.002 0.000 . . 1 11 GLN N 1 11 GLN H 16876 1 9 . 1 1 12 12 GLU N N 15 . 1 1 12 12 GLU H H 1 0.009 0.005 . . 1 12 GLU N 1 12 GLU H 16876 1 10 . 1 1 13 13 VAL N N 15 . 1 1 13 13 VAL H H 1 -0.046 0.002 . . 1 13 VAL N 1 13 VAL H 16876 1 11 . 1 1 15 15 LYS N N 15 . 1 1 15 15 LYS H H 1 -0.043 0.001 . . 1 15 LYS N 1 15 LYS H 16876 1 12 . 1 1 16 16 VAL N N 15 . 1 1 16 16 VAL H H 1 0.050 0.002 . . 1 16 VAL N 1 16 VAL H 16876 1 13 . 1 1 17 17 ALA N N 15 . 1 1 17 17 ALA H H 1 -0.074 0.004 . . 1 17 ALA N 1 17 ALA H 16876 1 14 . 1 1 18 18 THR N N 15 . 1 1 18 18 THR H H 1 -0.098 0.002 . . 1 18 THR N 1 18 THR H 16876 1 15 . 1 1 19 19 GLU N N 15 . 1 1 19 19 GLU H H 1 -0.044 0.005 . . 1 19 GLU N 1 19 GLU H 16876 1 16 . 1 1 20 20 GLU N N 15 . 1 1 20 20 GLU H H 1 -0.046 0.001 . . 1 20 GLU N 1 20 GLU H 16876 1 17 . 1 1 21 21 SER N N 15 . 1 1 21 21 SER H H 1 -0.080 0.001 . . 1 21 SER N 1 21 SER H 16876 1 18 . 1 1 22 22 SER N N 15 . 1 1 22 22 SER H H 1 -0.058 0.003 . . 1 22 SER N 1 22 SER H 16876 1 19 . 1 1 23 23 ALA N N 15 . 1 1 23 23 ALA H H 1 -0.016 0.005 . . 1 23 ALA N 1 23 ALA H 16876 1 20 . 1 1 24 24 GLU N N 15 . 1 1 24 24 GLU H H 1 0.010 0.003 . . 1 24 GLU N 1 24 GLU H 16876 1 21 . 1 1 25 25 VAL N N 15 . 1 1 25 25 VAL H H 1 0.077 0.002 . . 1 25 VAL N 1 25 VAL H 16876 1 22 . 1 1 26 26 THR N N 15 . 1 1 26 26 THR H H 1 0.071 0.001 . . 1 26 THR N 1 26 THR H 16876 1 23 . 1 1 27 27 ASP N N 15 . 1 1 27 27 ASP H H 1 0.123 0.005 . . 1 27 ASP N 1 27 ASP H 16876 1 24 . 1 1 28 28 ARG N N 15 . 1 1 28 28 ARG H H 1 0.219 0.005 . . 1 28 ARG N 1 28 ARG H 16876 1 25 . 1 1 29 29 GLY N N 15 . 1 1 29 29 GLY H H 1 0.235 0.003 . . 1 29 GLY N 1 29 GLY H 16876 1 26 . 1 1 30 30 LEU N N 15 . 1 1 30 30 LEU H H 1 0.283 0.008 . . 1 30 LEU N 1 30 LEU H 16876 1 27 . 1 1 31 31 PHE N N 15 . 1 1 31 31 PHE H H 1 0.247 0.009 . . 1 31 PHE N 1 31 PHE H 16876 1 28 . 1 1 32 32 ASP N N 15 . 1 1 32 32 ASP H H 1 0.202 0.008 . . 1 32 ASP N 1 32 ASP H 16876 1 29 . 1 1 33 33 PHE N N 15 . 1 1 33 33 PHE H H 1 0.266 0.008 . . 1 33 PHE N 1 33 PHE H 16876 1 30 . 1 1 34 34 LEU N N 15 . 1 1 34 34 LEU H H 1 0.235 0.019 . . 1 34 LEU N 1 34 LEU H 16876 1 31 . 1 1 35 35 GLY N N 15 . 1 1 35 35 GLY H H 1 0.243 0.009 . . 1 35 GLY N 1 35 GLY H 16876 1 32 . 1 1 36 36 LYS N N 15 . 1 1 36 36 LYS H H 1 0.233 0.014 . . 1 36 LYS N 1 36 LYS H 16876 1 33 . 1 1 37 37 LYS N N 15 . 1 1 37 37 LYS H H 1 0.184 0.007 . . 1 37 LYS N 1 37 LYS H 16876 1 34 . 1 1 38 38 LYS N N 15 . 1 1 38 38 LYS H H 1 0.177 0.012 . . 1 38 LYS N 1 38 LYS H 16876 1 35 . 1 1 39 39 ASP N N 15 . 1 1 39 39 ASP H H 1 0.160 0.002 . . 1 39 ASP N 1 39 ASP H 16876 1 36 . 1 1 40 40 GLU N N 15 . 1 1 40 40 GLU H H 1 0.120 0.002 . . 1 40 GLU N 1 40 GLU H 16876 1 37 . 1 1 41 41 THR N N 15 . 1 1 41 41 THR H H 1 0.135 0.002 . . 1 41 THR N 1 41 THR H 16876 1 38 . 1 1 42 42 LYS N N 15 . 1 1 42 42 LYS H H 1 0.015 0.004 . . 1 42 LYS N 1 42 LYS H 16876 1 39 . 1 1 44 44 GLU N N 15 . 1 1 44 44 GLU H H 1 0.011 0.005 . . 1 44 GLU N 1 44 GLU H 16876 1 40 . 1 1 45 45 GLU N N 15 . 1 1 45 45 GLU H H 1 0.069 0.002 . . 1 45 GLU N 1 45 GLU H 16876 1 41 . 1 1 46 46 THR N N 15 . 1 1 46 46 THR H H 1 0.037 0.003 . . 1 46 THR N 1 46 THR H 16876 1 42 . 1 1 48 48 ILE N N 15 . 1 1 48 48 ILE H H 1 -0.003 0.001 . . 1 48 ILE N 1 48 ILE H 16876 1 43 . 1 1 49 49 ALA N N 15 . 1 1 49 49 ALA H H 1 0.003 0.002 . . 1 49 ALA N 1 49 ALA H 16876 1 44 . 1 1 50 50 SER N N 15 . 1 1 50 50 SER H H 1 0.041 0.006 . . 1 50 SER N 1 50 SER H 16876 1 45 . 1 1 51 51 GLU N N 15 . 1 1 51 51 GLU H H 1 0.054 0.003 . . 1 51 GLU N 1 51 GLU H 16876 1 46 . 1 1 52 52 PHE N N 15 . 1 1 52 52 PHE H H 1 0.107 0.004 . . 1 52 PHE N 1 52 PHE H 16876 1 47 . 1 1 53 53 GLU N N 15 . 1 1 53 53 GLU H H 1 0.112 0.005 . . 1 53 GLU N 1 53 GLU H 16876 1 48 . 1 1 54 54 GLN N N 15 . 1 1 54 54 GLN H H 1 0.094 0.003 . . 1 54 GLN N 1 54 GLN H 16876 1 49 . 1 1 55 55 LYS N N 15 . 1 1 55 55 LYS H H 1 0.097 0.003 . . 1 55 LYS N 1 55 LYS H 16876 1 50 . 1 1 56 56 VAL N N 15 . 1 1 56 56 VAL H H 1 0.081 0.005 . . 1 56 VAL N 1 56 VAL H 16876 1 51 . 1 1 57 57 HIS N N 15 . 1 1 57 57 HIS H H 1 0.032 0.006 . . 1 57 HIS N 1 57 HIS H 16876 1 52 . 1 1 58 58 ILE N N 15 . 1 1 58 58 ILE H H 1 -0.032 0.002 . . 1 58 ILE N 1 58 ILE H 16876 1 53 . 1 1 59 59 SER N N 15 . 1 1 59 59 SER H H 1 -0.079 0.003 . . 1 59 SER N 1 59 SER H 16876 1 54 . 1 1 60 60 GLU N N 15 . 1 1 60 60 GLU H H 1 -0.051 0.003 . . 1 60 GLU N 1 60 GLU H 16876 1 55 . 1 1 62 62 GLU N N 15 . 1 1 62 62 GLU H H 1 0.032 0.005 . . 1 62 GLU N 1 62 GLU H 16876 1 56 . 1 1 64 64 GLU N N 15 . 1 1 64 64 GLU H H 1 0.035 0.006 . . 1 64 GLU N 1 64 GLU H 16876 1 57 . 1 1 65 65 VAL N N 15 . 1 1 65 65 VAL H H 1 0.057 0.003 . . 1 65 VAL N 1 65 VAL H 16876 1 58 . 1 1 66 66 LYS N N 15 . 1 1 66 66 LYS H H 1 0.057 0.005 . . 1 66 LYS N 1 66 LYS H 16876 1 59 . 1 1 67 67 HIS N N 15 . 1 1 67 67 HIS H H 1 0.134 0.005 . . 1 67 HIS N 1 67 HIS H 16876 1 60 . 1 1 68 68 GLU N N 15 . 1 1 68 68 GLU H H 1 0.147 0.003 . . 1 68 GLU N 1 68 GLU H 16876 1 61 . 1 1 69 69 SER N N 15 . 1 1 69 69 SER H H 1 0.192 0.011 . . 1 69 SER N 1 69 SER H 16876 1 62 . 1 1 70 70 LEU N N 15 . 1 1 70 70 LEU H H 1 0.223 0.016 . . 1 70 LEU N 1 70 LEU H 16876 1 63 . 1 1 71 71 LEU N N 15 . 1 1 71 71 LEU H H 1 0.244 0.019 . . 1 71 LEU N 1 71 LEU H 16876 1 64 . 1 1 72 72 GLU N N 15 . 1 1 72 72 GLU H H 1 0.243 0.012 . . 1 72 GLU N 1 72 GLU H 16876 1 65 . 1 1 73 73 LYS N N 15 . 1 1 73 73 LYS H H 1 0.216 0.010 . . 1 73 LYS N 1 73 LYS H 16876 1 66 . 1 1 74 74 LEU N N 15 . 1 1 74 74 LEU H H 1 0.250 0.033 . . 1 74 LEU N 1 74 LEU H 16876 1 67 . 1 1 75 75 HIS N N 15 . 1 1 75 75 HIS H H 1 0.099 0.011 . . 1 75 HIS N 1 75 HIS H 16876 1 68 . 1 1 76 76 ARG N N 15 . 1 1 76 76 ARG H H 1 0.218 0.001 . . 1 76 ARG N 1 76 ARG H 16876 1 69 . 1 1 77 77 SER N N 15 . 1 1 77 77 SER H H 1 0.186 0.003 . . 1 77 SER N 1 77 SER H 16876 1 70 . 1 1 78 78 ASP N N 15 . 1 1 78 78 ASP H H 1 0.123 0.002 . . 1 78 ASP N 1 78 ASP H 16876 1 71 . 1 1 79 79 SER N N 15 . 1 1 79 79 SER H H 1 0.044 0.008 . . 1 79 SER N 1 79 SER H 16876 1 72 . 1 1 80 80 SER N N 15 . 1 1 80 80 SER H H 1 0.018 0.001 . . 1 80 SER N 1 80 SER H 16876 1 73 . 1 1 81 81 SER N N 15 . 1 1 81 81 SER H H 1 -0.018 0.001 . . 1 81 SER N 1 81 SER H 16876 1 74 . 1 1 82 82 SER N N 15 . 1 1 82 82 SER H H 1 -0.076 0.008 . . 1 82 SER N 1 82 SER H 16876 1 75 . 1 1 83 83 SER N N 15 . 1 1 83 83 SER H H 1 -0.035 0.000 . . 1 83 SER N 1 83 SER H 16876 1 76 . 1 1 84 84 SER N N 15 . 1 1 84 84 SER H H 1 -0.017 0.001 . . 1 84 SER N 1 84 SER H 16876 1 77 . 1 1 85 85 SER N N 15 . 1 1 85 85 SER H H 1 -0.019 0.002 . . 1 85 SER N 1 85 SER H 16876 1 78 . 1 1 86 86 GLU N N 15 . 1 1 86 86 GLU H H 1 0.087 0.001 . . 1 86 GLU N 1 86 GLU H 16876 1 79 . 1 1 87 87 GLU N N 15 . 1 1 87 87 GLU H H 1 0.084 0.003 . . 1 87 GLU N 1 87 GLU H 16876 1 80 . 1 1 88 88 GLU N N 15 . 1 1 88 88 GLU H H 1 0.104 0.001 . . 1 88 GLU N 1 88 GLU H 16876 1 81 . 1 1 89 89 GLY N N 15 . 1 1 89 89 GLY H H 1 0.111 0.007 . . 1 89 GLY N 1 89 GLY H 16876 1 82 . 1 1 90 90 SER N N 15 . 1 1 90 90 SER H H 1 0.164 0.005 . . 1 90 SER N 1 90 SER H 16876 1 83 . 1 1 91 91 ASP N N 15 . 1 1 91 91 ASP H H 1 0.201 0.001 . . 1 91 ASP N 1 91 ASP H 16876 1 84 . 1 1 92 92 GLY N N 15 . 1 1 92 92 GLY H H 1 0.235 0.007 . . 1 92 GLY N 1 92 GLY H 16876 1 85 . 1 1 93 93 GLU N N 15 . 1 1 93 93 GLU H H 1 0.276 0.015 . . 1 93 GLU N 1 93 GLU H 16876 1 86 . 1 1 94 94 LYS N N 15 . 1 1 94 94 LYS H H 1 0.224 0.004 . . 1 94 LYS N 1 94 LYS H 16876 1 87 . 1 1 95 95 ARG N N 15 . 1 1 95 95 ARG H H 1 0.289 0.001 . . 1 95 ARG N 1 95 ARG H 16876 1 88 . 1 1 96 96 LYS N N 15 . 1 1 96 96 LYS H H 1 0.022 0.004 . . 1 96 LYS N 1 96 LYS H 16876 1 89 . 1 1 97 97 LYS N N 15 . 1 1 97 97 LYS H H 1 0.260 0.007 . . 1 97 LYS N 1 97 LYS H 16876 1 90 . 1 1 98 98 LYS N N 15 . 1 1 98 98 LYS H H 1 0.178 0.006 . . 1 98 LYS N 1 98 LYS H 16876 1 91 . 1 1 99 99 LYS N N 15 . 1 1 99 99 LYS H H 1 0.109 0.002 . . 1 99 LYS N 1 99 LYS H 16876 1 92 . 1 1 100 100 GLU N N 15 . 1 1 100 100 GLU H H 1 0.073 0.002 . . 1 100 GLU N 1 100 GLU H 16876 1 93 . 1 1 101 101 LYS N N 15 . 1 1 101 101 LYS H H 1 0.109 0.003 . . 1 101 LYS N 1 101 LYS H 16876 1 94 . 1 1 102 102 LYS N N 15 . 1 1 102 102 LYS H H 1 0.143 0.004 . . 1 102 LYS N 1 102 LYS H 16876 1 95 . 1 1 103 103 LYS N N 15 . 1 1 103 103 LYS H H 1 0.087 0.003 . . 1 103 LYS N 1 103 LYS H 16876 1 96 . 1 1 105 105 THR N N 15 . 1 1 105 105 THR H H 1 0.080 0.003 . . 1 105 THR N 1 105 THR H 16876 1 97 . 1 1 106 106 THR N N 15 . 1 1 106 106 THR H H 1 0.092 0.002 . . 1 106 THR N 1 106 THR H 16876 1 98 . 1 1 107 107 GLU N N 15 . 1 1 107 107 GLU H H 1 0.082 0.001 . . 1 107 GLU N 1 107 GLU H 16876 1 99 . 1 1 108 108 VAL N N 15 . 1 1 108 108 VAL H H 1 0.119 0.002 . . 1 108 VAL N 1 108 VAL H 16876 1 100 . 1 1 109 109 GLU N N 15 . 1 1 109 109 GLU H H 1 0.029 0.012 . . 1 109 GLU N 1 109 GLU H 16876 1 101 . 1 1 110 110 VAL N N 15 . 1 1 110 110 VAL H H 1 0.063 0.006 . . 1 110 VAL N 1 110 VAL H 16876 1 102 . 1 1 111 111 LYS N N 15 . 1 1 111 111 LYS H H 1 0.073 0.006 . . 1 111 LYS N 1 111 LYS H 16876 1 103 . 1 1 112 112 GLU N N 15 . 1 1 112 112 GLU H H 1 0.175 0.004 . . 1 112 GLU N 1 112 GLU H 16876 1 104 . 1 1 113 113 GLU N N 15 . 1 1 113 113 GLU H H 1 0.163 0.005 . . 1 113 GLU N 1 113 GLU H 16876 1 105 . 1 1 114 114 GLU N N 15 . 1 1 114 114 GLU H H 1 0.149 0.010 . . 1 114 GLU N 1 114 GLU H 16876 1 106 . 1 1 115 115 LYS N N 15 . 1 1 115 115 LYS H H 1 0.189 0.004 . . 1 115 LYS N 1 115 LYS H 16876 1 107 . 1 1 116 116 LYS N N 15 . 1 1 116 116 LYS H H 1 0.197 0.008 . . 1 116 LYS N 1 116 LYS H 16876 1 108 . 1 1 117 117 GLY N N 15 . 1 1 117 117 GLY H H 1 0.214 0.002 . . 1 117 GLY N 1 117 GLY H 16876 1 109 . 1 1 118 118 PHE N N 15 . 1 1 118 118 PHE H H 1 0.269 0.005 . . 1 118 PHE N 1 118 PHE H 16876 1 110 . 1 1 119 119 MET N N 15 . 1 1 119 119 MET H H 1 0.205 0.008 . . 1 119 MET N 1 119 MET H 16876 1 111 . 1 1 120 120 GLU N N 15 . 1 1 120 120 GLU H H 1 0.159 0.007 . . 1 120 GLU N 1 120 GLU H 16876 1 112 . 1 1 121 121 LYS N N 15 . 1 1 121 121 LYS H H 1 0.166 0.008 . . 1 121 LYS N 1 121 LYS H 16876 1 113 . 1 1 122 122 LEU N N 15 . 1 1 122 122 LEU H H 1 0.209 0.008 . . 1 122 LEU N 1 122 LEU H 16876 1 114 . 1 1 123 123 LYS N N 15 . 1 1 123 123 LYS H H 1 0.215 0.009 . . 1 123 LYS N 1 123 LYS H 16876 1 115 . 1 1 124 124 GLU N N 15 . 1 1 124 124 GLU H H 1 0.175 0.004 . . 1 124 GLU N 1 124 GLU H 16876 1 116 . 1 1 125 125 LYS N N 15 . 1 1 125 125 LYS H H 1 0.157 0.014 . . 1 125 LYS N 1 125 LYS H 16876 1 117 . 1 1 126 126 LEU N N 15 . 1 1 126 126 LEU H H 1 0.110 0.011 . . 1 126 LEU N 1 126 LEU H 16876 1 118 . 1 1 128 128 GLY N N 15 . 1 1 128 128 GLY H H 1 0.174 0.004 . . 1 128 GLY N 1 128 GLY H 16876 1 119 . 1 1 129 129 HIS N N 15 . 1 1 129 129 HIS H H 1 0.171 0.007 . . 1 129 HIS N 1 129 HIS H 16876 1 120 . 1 1 130 130 LYS N N 15 . 1 1 130 130 LYS H H 1 0.140 0.007 . . 1 130 LYS N 1 130 LYS H 16876 1 121 . 1 1 131 131 LYS N N 15 . 1 1 131 131 LYS H H 1 0.050 0.010 . . 1 131 LYS N 1 131 LYS H 16876 1 122 . 1 1 133 133 GLU N N 15 . 1 1 133 133 GLU H H 1 0.076 0.008 . . 1 133 GLU N 1 133 GLU H 16876 1 123 . 1 1 134 134 ASP N N 15 . 1 1 134 134 ASP H H 1 0.023 0.005 . . 1 134 ASP N 1 134 ASP H 16876 1 124 . 1 1 135 135 GLY N N 15 . 1 1 135 135 GLY H H 1 -0.034 0.006 . . 1 135 GLY N 1 135 GLY H 16876 1 125 . 1 1 136 136 SER N N 15 . 1 1 136 136 SER H H 1 0.055 0.002 . . 1 136 SER N 1 136 SER H 16876 1 126 . 1 1 137 137 ALA N N 15 . 1 1 137 137 ALA H H 1 -0.101 0.004 . . 1 137 ALA N 1 137 ALA H 16876 1 127 . 1 1 138 138 VAL N N 15 . 1 1 138 138 VAL H H 1 -0.290 0.000 . . 1 138 VAL N 1 138 VAL H 16876 1 128 . 1 1 139 139 ALA N N 15 . 1 1 139 139 ALA H H 1 -0.329 0.001 . . 1 139 ALA N 1 139 ALA H 16876 1 129 . 1 1 140 140 ALA N N 15 . 1 1 140 140 ALA H H 1 -0.317 0.000 . . 1 140 ALA N 1 140 ALA H 16876 1 130 . 1 1 141 141 ALA N N 15 . 1 1 141 141 ALA H H 1 -0.308 -0.001 . . 1 141 ALA N 1 141 ALA H 16876 1 131 . 1 1 143 143 VAL N N 15 . 1 1 143 143 VAL H H 1 -0.153 -0.001 . . 1 143 VAL N 1 143 VAL H 16876 1 132 . 1 1 144 144 VAL N N 15 . 1 1 144 144 VAL H H 1 -0.146 0.001 . . 1 144 VAL N 1 144 VAL H 16876 1 133 . 1 1 145 145 VAL N N 15 . 1 1 145 145 VAL H H 1 -0.100 0.001 . . 1 145 VAL N 1 145 VAL H 16876 1 134 . 1 1 149 149 VAL N N 15 . 1 1 149 149 VAL H H 1 -0.009 0.006 . . 1 149 VAL N 1 149 VAL H 16876 1 135 . 1 1 150 150 GLU N N 15 . 1 1 150 150 GLU H H 1 -0.026 0.007 . . 1 150 GLU N 1 150 GLU H 16876 1 136 . 1 1 151 151 GLU N N 15 . 1 1 151 151 GLU H H 1 0.040 0.001 . . 1 151 GLU N 1 151 GLU H 16876 1 137 . 1 1 152 152 ALA N N 15 . 1 1 152 152 ALA H H 1 0.004 0.003 . . 1 152 ALA N 1 152 ALA H 16876 1 138 . 1 1 153 153 HIS N N 15 . 1 1 153 153 HIS H H 1 -0.084 -0.002 . . 1 153 HIS N 1 153 HIS H 16876 1 139 . 1 1 155 155 VAL N N 15 . 1 1 155 155 VAL H H 1 -0.026 0.008 . . 1 155 VAL N 1 155 VAL H 16876 1 140 . 1 1 156 156 GLU N N 15 . 1 1 156 156 GLU H H 1 0.014 0.003 . . 1 156 GLU N 1 156 GLU H 16876 1 141 . 1 1 157 157 LYS N N 15 . 1 1 157 157 LYS H H 1 0.093 0.001 . . 1 157 LYS N 1 157 LYS H 16876 1 142 . 1 1 158 158 LYS N N 15 . 1 1 158 158 LYS H H 1 0.088 0.003 . . 1 158 LYS N 1 158 LYS H 16876 1 143 . 1 1 159 159 GLY N N 15 . 1 1 159 159 GLY H H 1 0.079 0.001 . . 1 159 GLY N 1 159 GLY H 16876 1 144 . 1 1 160 160 ILE N N 15 . 1 1 160 160 ILE H H 1 0.152 0.005 . . 1 160 ILE N 1 160 ILE H 16876 1 145 . 1 1 161 161 LEU N N 15 . 1 1 161 161 LEU H H 1 0.128 0.013 . . 1 161 LEU N 1 161 LEU H 16876 1 146 . 1 1 162 162 GLU N N 15 . 1 1 162 162 GLU H H 1 0.134 0.012 . . 1 162 GLU N 1 162 GLU H 16876 1 147 . 1 1 163 163 LYS N N 15 . 1 1 163 163 LYS H H 1 0.162 0.010 . . 1 163 LYS N 1 163 LYS H 16876 1 148 . 1 1 164 164 ILE N N 15 . 1 1 164 164 ILE H H 1 0.206 0.011 . . 1 164 ILE N 1 164 ILE H 16876 1 149 . 1 1 165 165 LYS N N 15 . 1 1 165 165 LYS H H 1 0.130 0.013 . . 1 165 LYS N 1 165 LYS H 16876 1 150 . 1 1 166 166 GLU N N 15 . 1 1 166 166 GLU H H 1 0.050 0.007 . . 1 166 GLU N 1 166 GLU H 16876 1 151 . 1 1 167 167 LYS N N 15 . 1 1 167 167 LYS H H 1 0.174 0.003 . . 1 167 LYS N 1 167 LYS H 16876 1 152 . 1 1 168 168 LEU N N 15 . 1 1 168 168 LEU H H 1 0.160 0.021 . . 1 168 LEU N 1 168 LEU H 16876 1 153 . 1 1 170 170 GLY N N 15 . 1 1 170 170 GLY H H 1 0.142 0.016 . . 1 170 GLY N 1 170 GLY H 16876 1 154 . 1 1 171 171 TYR N N 15 . 1 1 171 171 TYR H H 1 0.270 0.023 . . 1 171 TYR N 1 171 TYR H 16876 1 155 . 1 1 172 172 HIS N N 15 . 1 1 172 172 HIS H H 1 0.166 0.009 . . 1 172 HIS N 1 172 HIS H 16876 1 156 . 1 1 174 174 LYS N N 15 . 1 1 174 174 LYS H H 1 0.174 0.011 . . 1 174 LYS N 1 174 LYS H 16876 1 157 . 1 1 175 175 THR N N 15 . 1 1 175 175 THR H H 1 0.124 0.010 . . 1 175 THR N 1 175 THR H 16876 1 158 . 1 1 176 176 THR N N 15 . 1 1 176 176 THR H H 1 0.110 0.008 . . 1 176 THR N 1 176 THR H 16876 1 159 . 1 1 177 177 VAL N N 15 . 1 1 177 177 VAL H H 1 0.070 0.006 . . 1 177 VAL N 1 177 VAL H 16876 1 160 . 1 1 178 178 GLU N N 15 . 1 1 178 178 GLU H H 1 0.067 0.005 . . 1 178 GLU N 1 178 GLU H 16876 1 161 . 1 1 179 179 GLU N N 15 . 1 1 179 179 GLU H H 1 0.085 0.002 . . 1 179 GLU N 1 179 GLU H 16876 1 162 . 1 1 180 180 GLU N N 15 . 1 1 180 180 GLU H H 1 0.074 0.001 . . 1 180 GLU N 1 180 GLU H 16876 1 163 . 1 1 181 181 LYS N N 15 . 1 1 181 181 LYS H H 1 0.029 0.003 . . 1 181 LYS N 1 181 LYS H 16876 1 164 . 1 1 182 182 LYS N N 15 . 1 1 182 182 LYS H H 1 0.028 0.004 . . 1 182 LYS N 1 182 LYS H 16876 1 165 . 1 1 183 183 ASP N N 15 . 1 1 183 183 ASP H H 1 -0.130 0.006 . . 1 183 ASP N 1 183 ASP H 16876 1 166 . 1 1 184 184 LYS N N 15 . 1 1 184 184 LYS H H 1 -0.320 0.001 . . 1 184 LYS N 1 184 LYS H 16876 1 167 . 1 1 185 185 GLU N N 15 . 1 1 185 185 GLU H H 1 -0.762 0.010 . . 1 185 GLU N 1 185 GLU H 16876 1 stop_ save_ ######################################## # Heteronuclear T1 relaxation values # ######################################## save_heteronuclear_T1_list_1 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronuclear_T1_list_1 _Heteronucl_T1_list.Entry_ID 16876 _Heteronucl_T1_list.ID 1 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 600 _Heteronucl_T1_list.T1_coherence_type Nz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 10 R1-measurement . . . 16876 1 stop_ loop_ _Heteronucl_T1_software.Software_ID _Heteronucl_T1_software.Software_label _Heteronucl_T1_software.Method_ID _Heteronucl_T1_software.Method_label _Heteronucl_T1_software.Entry_ID _Heteronucl_T1_software.Heteronucl_T1_list_ID 1 $TOPSPIN . . 16876 1 3 $SPARKY . . 16876 1 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 3 3 GLU N N 15 0.831 0.079 . . 3 GLU N 16876 1 2 . 1 1 4 4 GLU N N 15 1.255 0.040 . . 4 GLU N 16876 1 3 . 1 1 5 5 ILE N N 15 1.425 0.014 . . 5 ILE N 16876 1 4 . 1 1 6 6 LYS N N 15 1.476 0.036 . . 6 LYS N 16876 1 5 . 1 1 7 7 ASN N N 15 1.444 0.083 . . 7 ASN N 16876 1 6 . 1 1 8 8 VAL N N 15 1.554 0.026 . . 8 VAL N 16876 1 7 . 1 1 10 10 GLU N N 15 1.559 0.016 . . 10 GLU N 16876 1 8 . 1 1 11 11 GLN N N 15 1.553 0.033 . . 11 GLN N 16876 1 9 . 1 1 12 12 GLU N N 15 1.541 0.040 . . 12 GLU N 16876 1 10 . 1 1 13 13 VAL N N 15 1.509 0.003 . . 13 VAL N 16876 1 11 . 1 1 15 15 LYS N N 15 1.528 0.017 . . 15 LYS N 16876 1 12 . 1 1 16 16 VAL N N 15 1.536 0.021 . . 16 VAL N 16876 1 13 . 1 1 17 17 ALA N N 15 1.478 0.030 . . 17 ALA N 16876 1 14 . 1 1 18 18 THR N N 15 1.404 0.045 . . 18 THR N 16876 1 15 . 1 1 19 19 GLU N N 15 1.510 0.038 . . 19 GLU N 16876 1 16 . 1 1 20 20 GLU N N 15 1.522 0.049 . . 20 GLU N 16876 1 17 . 1 1 21 21 SER N N 15 1.449 0.081 . . 21 SER N 16876 1 18 . 1 1 22 22 SER N N 15 1.405 0.066 . . 22 SER N 16876 1 19 . 1 1 23 23 ALA N N 15 1.493 0.052 . . 23 ALA N 16876 1 20 . 1 1 24 24 GLU N N 15 1.514 0.032 . . 24 GLU N 16876 1 21 . 1 1 25 25 VAL N N 15 1.564 0.018 . . 25 VAL N 16876 1 22 . 1 1 26 26 THR N N 15 1.569 0.054 . . 26 THR N 16876 1 23 . 1 1 27 27 ASP N N 15 1.622 0.057 . . 27 ASP N 16876 1 24 . 1 1 28 28 ARG N N 15 1.654 0.054 . . 28 ARG N 16876 1 25 . 1 1 29 29 GLY N N 15 1.619 0.053 . . 29 GLY N 16876 1 26 . 1 1 30 30 LEU N N 15 1.685 0.029 . . 30 LEU N 16876 1 27 . 1 1 31 31 PHE N N 15 1.662 0.034 . . 31 PHE N 16876 1 28 . 1 1 32 32 ASP N N 15 1.638 0.035 . . 32 ASP N 16876 1 29 . 1 1 33 33 PHE N N 15 1.647 0.043 . . 33 PHE N 16876 1 30 . 1 1 34 34 LEU N N 15 1.646 0.028 . . 34 LEU N 16876 1 31 . 1 1 35 35 GLY N N 15 1.629 0.048 . . 35 GLY N 16876 1 32 . 1 1 36 36 LYS N N 15 1.637 0.032 . . 36 LYS N 16876 1 33 . 1 1 37 37 LYS N N 15 1.633 0.038 . . 37 LYS N 16876 1 34 . 1 1 38 38 LYS N N 15 1.609 0.043 . . 38 LYS N 16876 1 35 . 1 1 39 39 ASP N N 15 1.606 0.048 . . 39 ASP N 16876 1 36 . 1 1 40 40 GLU N N 15 1.591 0.042 . . 40 GLU N 16876 1 37 . 1 1 41 41 THR N N 15 1.544 0.068 . . 41 THR N 16876 1 38 . 1 1 42 42 LYS N N 15 1.512 0.036 . . 42 LYS N 16876 1 39 . 1 1 44 44 GLU N N 15 1.522 0.017 . . 44 GLU N 16876 1 40 . 1 1 45 45 GLU N N 15 1.603 0.027 . . 45 GLU N 16876 1 41 . 1 1 46 46 THR N N 15 1.448 0.041 . . 46 THR N 16876 1 42 . 1 1 48 48 ILE N N 15 1.502 0.006 . . 48 ILE N 16876 1 43 . 1 1 49 49 ALA N N 15 1.519 0.024 . . 49 ALA N 16876 1 44 . 1 1 50 50 SER N N 15 1.420 0.054 . . 50 SER N 16876 1 45 . 1 1 51 51 GLU N N 15 1.519 0.025 . . 51 GLU N 16876 1 46 . 1 1 52 52 PHE N N 15 1.591 0.038 . . 52 PHE N 16876 1 47 . 1 1 53 53 GLU N N 15 1.603 0.030 . . 53 GLU N 16876 1 48 . 1 1 54 54 GLN N N 15 1.559 0.043 . . 54 GLN N 16876 1 49 . 1 1 55 55 LYS N N 15 1.584 0.055 . . 55 LYS N 16876 1 50 . 1 1 56 56 VAL N N 15 1.545 0.029 . . 56 VAL N 16876 1 51 . 1 1 57 57 HIS N N 15 1.481 0.077 . . 57 HIS N 16876 1 52 . 1 1 58 58 ILE N N 15 1.453 0.050 . . 58 ILE N 16876 1 53 . 1 1 59 59 SER N N 15 1.417 0.046 . . 59 SER N 16876 1 54 . 1 1 60 60 GLU N N 15 1.389 0.030 . . 60 GLU N 16876 1 55 . 1 1 62 62 GLU N N 15 1.508 0.031 . . 62 GLU N 16876 1 56 . 1 1 64 64 GLU N N 15 1.483 0.014 . . 64 GLU N 16876 1 57 . 1 1 65 65 VAL N N 15 1.486 0.014 . . 65 VAL N 16876 1 58 . 1 1 66 66 LYS N N 15 1.528 0.028 . . 66 LYS N 16876 1 59 . 1 1 67 67 HIS N N 15 1.495 0.051 . . 67 HIS N 16876 1 60 . 1 1 68 68 GLU N N 15 1.486 0.068 . . 68 GLU N 16876 1 61 . 1 1 69 69 SER N N 15 1.519 0.062 . . 69 SER N 16876 1 62 . 1 1 70 70 LEU N N 15 1.608 0.056 . . 70 LEU N 16876 1 63 . 1 1 71 71 LEU N N 15 1.629 0.034 . . 71 LEU N 16876 1 64 . 1 1 72 72 GLU N N 15 1.616 0.024 . . 72 GLU N 16876 1 65 . 1 1 73 73 LYS N N 15 1.638 0.039 . . 73 LYS N 16876 1 66 . 1 1 74 74 LEU N N 15 1.668 0.031 . . 74 LEU N 16876 1 67 . 1 1 75 75 HIS N N 15 1.465 0.043 . . 75 HIS N 16876 1 68 . 1 1 76 76 ARG N N 15 1.587 0.084 . . 76 ARG N 16876 1 69 . 1 1 77 77 SER N N 15 1.506 0.097 . . 77 SER N 16876 1 70 . 1 1 78 78 ASP N N 15 1.531 0.087 . . 78 ASP N 16876 1 71 . 1 1 79 79 SER N N 15 1.447 0.097 . . 79 SER N 16876 1 72 . 1 1 80 80 SER N N 15 1.447 0.096 . . 80 SER N 16876 1 73 . 1 1 81 81 SER N N 15 1.413 0.072 . . 81 SER N 16876 1 74 . 1 1 82 82 SER N N 15 1.380 0.080 . . 82 SER N 16876 1 75 . 1 1 83 83 SER N N 15 1.422 0.076 . . 83 SER N 16876 1 76 . 1 1 84 84 SER N N 15 1.443 0.097 . . 84 SER N 16876 1 77 . 1 1 85 85 SER N N 15 1.435 0.087 . . 85 SER N 16876 1 78 . 1 1 86 86 GLU N N 15 1.587 0.071 . . 86 GLU N 16876 1 79 . 1 1 87 87 GLU N N 15 1.633 0.035 . . 87 GLU N 16876 1 80 . 1 1 88 88 GLU N N 15 1.612 0.037 . . 88 GLU N 16876 1 81 . 1 1 89 89 GLY N N 15 1.590 0.050 . . 89 GLY N 16876 1 82 . 1 1 90 90 SER N N 15 1.544 0.075 . . 90 SER N 16876 1 83 . 1 1 91 91 ASP N N 15 1.595 0.079 . . 91 ASP N 16876 1 84 . 1 1 92 92 GLY N N 15 1.614 0.060 . . 92 GLY N 16876 1 85 . 1 1 93 93 GLU N N 15 1.671 0.039 . . 93 GLU N 16876 1 86 . 1 1 94 94 LYS N N 15 1.663 0.038 . . 94 LYS N 16876 1 87 . 1 1 95 95 ARG N N 15 1.675 0.060 . . 95 ARG N 16876 1 88 . 1 1 96 96 LYS N N 15 1.536 0.031 . . 96 LYS N 16876 1 89 . 1 1 97 97 LYS N N 15 1.649 0.039 . . 97 LYS N 16876 1 90 . 1 1 98 98 LYS N N 15 1.609 0.049 . . 98 LYS N 16876 1 91 . 1 1 99 99 LYS N N 15 1.601 0.051 . . 99 LYS N 16876 1 92 . 1 1 100 100 GLU N N 15 1.521 0.036 . . 100 GLU N 16876 1 93 . 1 1 101 101 LYS N N 15 1.530 0.046 . . 101 LYS N 16876 1 94 . 1 1 102 102 LYS N N 15 1.582 0.053 . . 102 LYS N 16876 1 95 . 1 1 103 103 LYS N N 15 1.532 0.034 . . 103 LYS N 16876 1 96 . 1 1 105 105 THR N N 15 1.480 0.058 . . 105 THR N 16876 1 97 . 1 1 106 106 THR N N 15 1.470 0.062 . . 106 THR N 16876 1 98 . 1 1 107 107 GLU N N 15 1.534 0.038 . . 107 GLU N 16876 1 99 . 1 1 108 108 VAL N N 15 1.502 0.019 . . 108 VAL N 16876 1 100 . 1 1 109 109 GLU N N 15 1.513 0.012 . . 109 GLU N 16876 1 101 . 1 1 110 110 VAL N N 15 1.497 0.010 . . 110 VAL N 16876 1 102 . 1 1 111 111 LYS N N 15 1.538 0.010 . . 111 LYS N 16876 1 103 . 1 1 112 112 GLU N N 15 1.549 0.022 . . 112 GLU N 16876 1 104 . 1 1 113 113 GLU N N 15 1.547 0.028 . . 113 GLU N 16876 1 105 . 1 1 114 114 GLU N N 15 1.581 0.031 . . 114 GLU N 16876 1 106 . 1 1 115 115 LYS N N 15 1.606 0.032 . . 115 LYS N 16876 1 107 . 1 1 116 116 LYS N N 15 1.558 0.038 . . 116 LYS N 16876 1 108 . 1 1 117 117 GLY N N 15 1.545 0.056 . . 117 GLY N 16876 1 109 . 1 1 118 118 PHE N N 15 1.564 0.047 . . 118 PHE N 16876 1 110 . 1 1 119 119 MET N N 15 1.572 0.039 . . 119 MET N 16876 1 111 . 1 1 120 120 GLU N N 15 1.573 0.029 . . 120 GLU N 16876 1 112 . 1 1 121 121 LYS N N 15 1.593 0.024 . . 121 LYS N 16876 1 113 . 1 1 122 122 LEU N N 15 1.621 0.020 . . 122 LEU N 16876 1 114 . 1 1 123 123 LYS N N 15 1.597 0.029 . . 123 LYS N 16876 1 115 . 1 1 124 124 GLU N N 15 1.579 0.029 . . 124 GLU N 16876 1 116 . 1 1 125 125 LYS N N 15 1.611 0.024 . . 125 LYS N 16876 1 117 . 1 1 126 126 LEU N N 15 1.573 0.016 . . 126 LEU N 16876 1 118 . 1 1 128 128 GLY N N 15 1.563 0.056 . . 128 GLY N 16876 1 119 . 1 1 129 129 HIS N N 15 1.458 0.084 . . 129 HIS N 16876 1 120 . 1 1 130 130 LYS N N 15 1.565 0.055 . . 130 LYS N 16876 1 121 . 1 1 131 131 LYS N N 15 1.574 0.035 . . 131 LYS N 16876 1 122 . 1 1 133 133 GLU N N 15 1.605 0.038 . . 133 GLU N 16876 1 123 . 1 1 134 134 ASP N N 15 1.501 0.053 . . 134 ASP N 16876 1 124 . 1 1 135 135 GLY N N 15 1.470 0.071 . . 135 GLY N 16876 1 125 . 1 1 136 136 SER N N 15 1.479 0.072 . . 136 SER N 16876 1 126 . 1 1 137 137 ALA N N 15 1.432 0.072 . . 137 ALA N 16876 1 127 . 1 1 138 138 VAL N N 15 1.317 0.024 . . 138 VAL N 16876 1 128 . 1 1 139 139 ALA N N 15 1.345 0.033 . . 139 ALA N 16876 1 129 . 1 1 140 140 ALA N N 15 1.255 0.030 . . 140 ALA N 16876 1 130 . 1 1 141 141 ALA N N 15 1.219 0.018 . . 141 ALA N 16876 1 131 . 1 1 143 143 VAL N N 15 1.414 0.015 . . 143 VAL N 16876 1 132 . 1 1 144 144 VAL N N 15 1.399 0.003 . . 144 VAL N 16876 1 133 . 1 1 145 145 VAL N N 15 1.403 0.006 . . 145 VAL N 16876 1 134 . 1 1 149 149 VAL N N 15 1.423 0.002 . . 149 VAL N 16876 1 135 . 1 1 150 150 GLU N N 15 1.469 0.014 . . 150 GLU N 16876 1 136 . 1 1 151 151 GLU N N 15 1.490 0.030 . . 151 GLU N 16876 1 137 . 1 1 152 152 ALA N N 15 1.493 0.030 . . 152 ALA N 16876 1 138 . 1 1 153 153 HIS N N 15 1.358 0.060 . . 153 HIS N 16876 1 139 . 1 1 155 155 VAL N N 15 1.472 0.016 . . 155 VAL N 16876 1 140 . 1 1 156 156 GLU N N 15 1.545 0.026 . . 156 GLU N 16876 1 141 . 1 1 157 157 LYS N N 15 1.538 0.047 . . 157 LYS N 16876 1 142 . 1 1 158 158 LYS N N 15 1.542 0.046 . . 158 LYS N 16876 1 143 . 1 1 159 159 GLY N N 15 1.521 0.055 . . 159 GLY N 16876 1 144 . 1 1 160 160 ILE N N 15 1.532 0.025 . . 160 ILE N 16876 1 145 . 1 1 161 161 LEU N N 15 1.612 0.020 . . 161 LEU N 16876 1 146 . 1 1 162 162 GLU N N 15 1.575 0.026 . . 162 GLU N 16876 1 147 . 1 1 163 163 LYS N N 15 1.605 0.032 . . 163 LYS N 16876 1 148 . 1 1 164 164 ILE N N 15 1.644 0.025 . . 164 ILE N 16876 1 149 . 1 1 165 165 LYS N N 15 1.613 0.021 . . 165 LYS N 16876 1 150 . 1 1 166 166 GLU N N 15 1.463 0.017 . . 166 GLU N 16876 1 151 . 1 1 167 167 LYS N N 15 1.598 0.030 . . 167 LYS N 16876 1 152 . 1 1 168 168 LEU N N 15 1.585 0.016 . . 168 LEU N 16876 1 153 . 1 1 170 170 GLY N N 15 1.492 0.075 . . 170 GLY N 16876 1 154 . 1 1 171 171 TYR N N 15 1.560 0.056 . . 171 TYR N 16876 1 155 . 1 1 172 172 HIS N N 15 1.554 0.068 . . 172 HIS N 16876 1 156 . 1 1 174 174 LYS N N 15 1.577 0.091 . . 174 LYS N 16876 1 157 . 1 1 175 175 THR N N 15 1.530 0.073 . . 175 THR N 16876 1 158 . 1 1 176 176 THR N N 15 1.540 0.091 . . 176 THR N 16876 1 159 . 1 1 177 177 VAL N N 15 1.577 0.029 . . 177 VAL N 16876 1 160 . 1 1 178 178 GLU N N 15 1.637 0.022 . . 178 GLU N 16876 1 161 . 1 1 179 179 GLU N N 15 1.623 0.030 . . 179 GLU N 16876 1 162 . 1 1 180 180 GLU N N 15 1.603 0.027 . . 180 GLU N 16876 1 163 . 1 1 181 181 LYS N N 15 1.611 0.049 . . 181 LYS N 16876 1 164 . 1 1 182 182 LYS N N 15 1.601 0.042 . . 182 LYS N 16876 1 165 . 1 1 183 183 ASP N N 15 1.539 0.048 . . 183 ASP N 16876 1 166 . 1 1 184 184 LYS N N 15 1.422 0.035 . . 184 LYS N 16876 1 167 . 1 1 185 185 GLU N N 15 1.224 0.008 . . 185 GLU N 16876 1 stop_ save_ ########################################### # Heteronuclear T1rho relaxation values # ########################################### save_heteronuclear_T1rho_list_1 _Heteronucl_T1rho_list.Sf_category heteronucl_T1rho_relaxation _Heteronucl_T1rho_list.Sf_framecode heteronuclear_T1rho_list_1 _Heteronucl_T1rho_list.Entry_ID 16876 _Heteronucl_T1rho_list.ID 1 _Heteronucl_T1rho_list.Sample_condition_list_ID 1 _Heteronucl_T1rho_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1rho_list.Spectrometer_frequency_1H 600 _Heteronucl_T1rho_list.Temp_calibration_method methanol _Heteronucl_T1rho_list.Temp_control_method 'single scan interleaving' _Heteronucl_T1rho_list.T1rho_coherence_type Nz _Heteronucl_T1rho_list.T1rho_val_units s-1 _Heteronucl_T1rho_list.Rex_units s-1 _Heteronucl_T1rho_list.Details . _Heteronucl_T1rho_list.Text_data_format . _Heteronucl_T1rho_list.Text_data . loop_ _Heteronucl_T1rho_experiment.Experiment_ID _Heteronucl_T1rho_experiment.Experiment_name _Heteronucl_T1rho_experiment.Sample_ID _Heteronucl_T1rho_experiment.Sample_label _Heteronucl_T1rho_experiment.Sample_state _Heteronucl_T1rho_experiment.Entry_ID _Heteronucl_T1rho_experiment.Heteronucl_T1rho_list_ID 13 'R1rho measurement' . . . 16876 1 stop_ loop_ _Heteronucl_T1rho_software.Software_ID _Heteronucl_T1rho_software.Software_label _Heteronucl_T1rho_software.Method_ID _Heteronucl_T1rho_software.Method_label _Heteronucl_T1rho_software.Entry_ID _Heteronucl_T1rho_software.Heteronucl_T1rho_list_ID 1 $TOPSPIN . . 16876 1 3 $SPARKY . . 16876 1 stop_ loop_ _T1rho.ID _T1rho.Assembly_atom_ID _T1rho.Entity_assembly_ID _T1rho.Entity_ID _T1rho.Comp_index_ID _T1rho.Seq_ID _T1rho.Comp_ID _T1rho.Atom_ID _T1rho.Atom_type _T1rho.Atom_isotope_number _T1rho.T1rho_val _T1rho.T1rho_val_err _T1rho.Rex_val _T1rho.Rex_val_err _T1rho.Resonance_ID _T1rho.Auth_entity_assembly_ID _T1rho.Auth_seq_ID _T1rho.Auth_comp_ID _T1rho.Auth_atom_ID _T1rho.Entry_ID _T1rho.Heteronucl_T1rho_list_ID 1 . 1 1 3 3 GLU N N 15 1.339 0.129 . . . . 3 GLU N 16876 1 2 . 1 1 4 4 GLU N N 15 1.731 0.009 . . . . 4 GLU N 16876 1 3 . 1 1 5 5 ILE N N 15 2.016 0.023 . . . . 5 ILE N 16876 1 4 . 1 1 6 6 LYS N N 15 2.247 0.013 . . . . 6 LYS N 16876 1 5 . 1 1 7 7 ASN N N 15 2.514 0.017 . . . . 7 ASN N 16876 1 6 . 1 1 8 8 VAL N N 15 3.634 0.020 . . . . 8 VAL N 16876 1 7 . 1 1 10 10 GLU N N 15 2.990 0.021 . . . . 10 GLU N 16876 1 8 . 1 1 11 11 GLN N N 15 3.115 0.010 . . . . 11 GLN N 16876 1 9 . 1 1 12 12 GLU N N 15 3.244 0.011 . . . . 12 GLU N 16876 1 10 . 1 1 13 13 VAL N N 15 3.215 0.020 . . . . 13 VAL N 16876 1 11 . 1 1 15 15 LYS N N 15 3.215 0.015 . . . . 15 LYS N 16876 1 12 . 1 1 16 16 VAL N N 15 3.672 0.013 . . . . 16 VAL N 16876 1 13 . 1 1 17 17 ALA N N 15 3.033 0.011 . . . . 17 ALA N 16876 1 14 . 1 1 18 18 THR N N 15 2.934 0.023 . . . . 18 THR N 16876 1 15 . 1 1 19 19 GLU N N 15 3.141 0.015 . . . . 19 GLU N 16876 1 16 . 1 1 20 20 GLU N N 15 3.079 0.012 . . . . 20 GLU N 16876 1 17 . 1 1 21 21 SER N N 15 2.925 0.018 . . . . 21 SER N 16876 1 18 . 1 1 22 22 SER N N 15 2.927 0.018 . . . . 22 SER N 16876 1 19 . 1 1 23 23 ALA N N 15 3.169 0.008 . . . . 23 ALA N 16876 1 20 . 1 1 24 24 GLU N N 15 3.151 0.021 . . . . 24 GLU N 16876 1 21 . 1 1 25 25 VAL N N 15 3.772 0.022 . . . . 25 VAL N 16876 1 22 . 1 1 26 26 THR N N 15 3.691 0.012 . . . . 26 THR N 16876 1 23 . 1 1 27 27 ASP N N 15 3.709 0.014 . . . . 27 ASP N 16876 1 24 . 1 1 28 28 ARG N N 15 4.148 0.011 . . . . 28 ARG N 16876 1 25 . 1 1 29 29 GLY N N 15 3.923 0.029 . . . . 29 GLY N 16876 1 26 . 1 1 30 30 LEU N N 15 4.713 0.011 . . . . 30 LEU N 16876 1 27 . 1 1 31 31 PHE N N 15 4.604 0.012 . . . . 31 PHE N 16876 1 28 . 1 1 32 32 ASP N N 15 4.794 0.015 . . . . 32 ASP N 16876 1 29 . 1 1 33 33 PHE N N 15 4.735 0.014 . . . . 33 PHE N 16876 1 30 . 1 1 34 34 LEU N N 15 4.695 0.057 . . . . 34 LEU N 16876 1 31 . 1 1 35 35 GLY N N 15 4.039 0.012 . . . . 35 GLY N 16876 1 32 . 1 1 36 36 LYS N N 15 4.878 0.013 . . . . 36 LYS N 16876 1 33 . 1 1 37 37 LYS N N 15 4.092 0.009 . . . . 37 LYS N 16876 1 34 . 1 1 38 38 LYS N N 15 4.294 0.018 . . . . 38 LYS N 16876 1 35 . 1 1 39 39 ASP N N 15 4.067 0.015 . . . . 39 ASP N 16876 1 36 . 1 1 40 40 GLU N N 15 3.675 0.010 . . . . 40 GLU N 16876 1 37 . 1 1 41 41 THR N N 15 3.698 0.011 . . . . 41 THR N 16876 1 38 . 1 1 42 42 LYS N N 15 3.923 0.013 . . . . 42 LYS N 16876 1 39 . 1 1 44 44 GLU N N 15 3.978 0.011 . . . . 44 GLU N 16876 1 40 . 1 1 45 45 GLU N N 15 3.428 0.017 . . . . 45 GLU N 16876 1 41 . 1 1 46 46 THR N N 15 4.102 0.030 . . . . 46 THR N 16876 1 42 . 1 1 48 48 ILE N N 15 3.815 0.016 . . . . 48 ILE N 16876 1 43 . 1 1 49 49 ALA N N 15 3.690 0.016 . . . . 49 ALA N 16876 1 44 . 1 1 50 50 SER N N 15 3.727 0.016 . . . . 50 SER N 16876 1 45 . 1 1 51 51 GLU N N 15 4.340 0.012 . . . . 51 GLU N 16876 1 46 . 1 1 52 52 PHE N N 15 4.108 0.009 . . . . 52 PHE N 16876 1 47 . 1 1 53 53 GLU N N 15 4.244 0.010 . . . . 53 GLU N 16876 1 48 . 1 1 54 54 GLN N N 15 4.286 0.015 . . . . 54 GLN N 16876 1 49 . 1 1 55 55 LYS N N 15 3.655 0.018 . . . . 55 LYS N 16876 1 50 . 1 1 56 56 VAL N N 15 4.490 0.016 . . . . 56 VAL N 16876 1 51 . 1 1 57 57 HIS N N 15 4.396 0.024 . . . . 57 HIS N 16876 1 52 . 1 1 58 58 ILE N N 15 4.241 0.012 . . . . 58 ILE N 16876 1 53 . 1 1 59 59 SER N N 15 4.662 0.014 . . . . 59 SER N 16876 1 54 . 1 1 60 60 GLU N N 15 4.697 0.022 . . . . 60 GLU N 16876 1 55 . 1 1 62 62 GLU N N 15 4.558 0.024 . . . . 62 GLU N 16876 1 56 . 1 1 64 64 GLU N N 15 4.721 0.009 . . . . 64 GLU N 16876 1 57 . 1 1 65 65 VAL N N 15 4.308 0.007 . . . . 65 VAL N 16876 1 58 . 1 1 66 66 LYS N N 15 4.836 0.014 . . . . 66 LYS N 16876 1 59 . 1 1 67 67 HIS N N 15 5.308 0.026 . . . . 67 HIS N 16876 1 60 . 1 1 68 68 GLU N N 15 4.845 0.031 . . . . 68 GLU N 16876 1 61 . 1 1 69 69 SER N N 15 5.200 0.022 . . . . 69 SER N 16876 1 62 . 1 1 70 70 LEU N N 15 4.926 0.008 . . . . 70 LEU N 16876 1 63 . 1 1 71 71 LEU N N 15 4.638 0.021 . . . . 71 LEU N 16876 1 64 . 1 1 72 72 GLU N N 15 5.482 0.035 . . . . 72 GLU N 16876 1 65 . 1 1 73 73 LYS N N 15 4.805 0.027 . . . . 73 LYS N 16876 1 66 . 1 1 74 74 LEU N N 15 5.033 0.009 . . . . 74 LEU N 16876 1 67 . 1 1 75 75 HIS N N 15 4.120 0.027 . . . . 75 HIS N 16876 1 68 . 1 1 76 76 ARG N N 15 4.478 0.026 . . . . 76 ARG N 16876 1 69 . 1 1 77 77 SER N N 15 3.867 0.038 . . . . 77 SER N 16876 1 70 . 1 1 78 78 ASP N N 15 3.544 0.031 . . . . 78 ASP N 16876 1 71 . 1 1 79 79 SER N N 15 3.145 0.028 . . . . 79 SER N 16876 1 72 . 1 1 80 80 SER N N 15 3.056 0.048 . . . . 80 SER N 16876 1 73 . 1 1 81 81 SER N N 15 2.775 0.034 . . . . 81 SER N 16876 1 74 . 1 1 82 82 SER N N 15 2.577 0.026 . . . . 82 SER N 16876 1 75 . 1 1 83 83 SER N N 15 2.729 0.023 . . . . 83 SER N 16876 1 76 . 1 1 84 84 SER N N 15 2.870 0.030 . . . . 84 SER N 16876 1 77 . 1 1 85 85 SER N N 15 2.894 0.028 . . . . 85 SER N 16876 1 78 . 1 1 86 86 GLU N N 15 3.255 0.016 . . . . 86 GLU N 16876 1 79 . 1 1 87 87 GLU N N 15 3.173 0.010 . . . . 87 GLU N 16876 1 80 . 1 1 88 88 GLU N N 15 3.481 0.011 . . . . 88 GLU N 16876 1 81 . 1 1 89 89 GLY N N 15 3.159 0.017 . . . . 89 GLY N 16876 1 82 . 1 1 90 90 SER N N 15 3.674 0.018 . . . . 90 SER N 16876 1 83 . 1 1 91 91 ASP N N 15 4.087 0.020 . . . . 91 ASP N 16876 1 84 . 1 1 92 92 GLY N N 15 4.023 0.014 . . . . 92 GLY N 16876 1 85 . 1 1 93 93 GLU N N 15 5.092 0.015 . . . . 93 GLU N 16876 1 86 . 1 1 94 94 LYS N N 15 5.008 0.015 . . . . 94 LYS N 16876 1 87 . 1 1 95 95 ARG N N 15 4.831 0.011 . . . . 95 ARG N 16876 1 88 . 1 1 96 96 LYS N N 15 3.664 0.014 . . . . 96 LYS N 16876 1 89 . 1 1 97 97 LYS N N 15 4.792 0.017 . . . . 97 LYS N 16876 1 90 . 1 1 98 98 LYS N N 15 4.401 0.029 . . . . 98 LYS N 16876 1 91 . 1 1 99 99 LYS N N 15 3.303 0.012 . . . . 99 LYS N 16876 1 92 . 1 1 100 100 GLU N N 15 4.390 0.015 . . . . 100 GLU N 16876 1 93 . 1 1 101 101 LYS N N 15 4.409 0.013 . . . . 101 LYS N 16876 1 94 . 1 1 102 102 LYS N N 15 4.460 0.021 . . . . 102 LYS N 16876 1 95 . 1 1 103 103 LYS N N 15 4.706 0.021 . . . . 103 LYS N 16876 1 96 . 1 1 105 105 THR N N 15 4.643 0.010 . . . . 105 THR N 16876 1 97 . 1 1 106 106 THR N N 15 4.733 0.014 . . . . 106 THR N 16876 1 98 . 1 1 107 107 GLU N N 15 4.496 0.019 . . . . 107 GLU N 16876 1 99 . 1 1 108 108 VAL N N 15 5.013 0.011 . . . . 108 VAL N 16876 1 100 . 1 1 109 109 GLU N N 15 5.097 0.020 . . . . 109 GLU N 16876 1 101 . 1 1 110 110 VAL N N 15 4.869 0.027 . . . . 110 VAL N 16876 1 102 . 1 1 111 111 LYS N N 15 5.903 0.016 . . . . 111 LYS N 16876 1 103 . 1 1 112 112 GLU N N 15 5.507 0.019 . . . . 112 GLU N 16876 1 104 . 1 1 113 113 GLU N N 15 5.631 0.024 . . . . 113 GLU N 16876 1 105 . 1 1 114 114 GLU N N 15 4.484 0.036 . . . . 114 GLU N 16876 1 106 . 1 1 115 115 LYS N N 15 5.280 0.020 . . . . 115 LYS N 16876 1 107 . 1 1 116 116 LYS N N 15 5.464 0.015 . . . . 116 LYS N 16876 1 108 . 1 1 117 117 GLY N N 15 5.203 0.022 . . . . 117 GLY N 16876 1 109 . 1 1 118 118 PHE N N 15 5.718 0.017 . . . . 118 PHE N 16876 1 110 . 1 1 119 119 MET N N 15 5.643 0.020 . . . . 119 MET N 16876 1 111 . 1 1 120 120 GLU N N 15 4.955 0.031 . . . . 120 GLU N 16876 1 112 . 1 1 121 121 LYS N N 15 4.990 0.021 . . . . 121 LYS N 16876 1 113 . 1 1 122 122 LEU N N 15 5.577 0.011 . . . . 122 LEU N 16876 1 114 . 1 1 123 123 LYS N N 15 5.008 0.031 . . . . 123 LYS N 16876 1 115 . 1 1 124 124 GLU N N 15 4.990 0.007 . . . . 124 GLU N 16876 1 116 . 1 1 125 125 LYS N N 15 4.792 0.019 . . . . 125 LYS N 16876 1 117 . 1 1 126 126 LEU N N 15 4.263 0.017 . . . . 126 LEU N 16876 1 118 . 1 1 128 128 GLY N N 15 4.156 0.043 . . . . 128 GLY N 16876 1 119 . 1 1 129 129 HIS N N 15 3.717 0.061 . . . . 129 HIS N 16876 1 120 . 1 1 130 130 LYS N N 15 4.042 0.024 . . . . 130 LYS N 16876 1 121 . 1 1 131 131 LYS N N 15 3.716 0.009 . . . . 131 LYS N 16876 1 122 . 1 1 133 133 GLU N N 15 3.509 0.010 . . . . 133 GLU N 16876 1 123 . 1 1 134 134 ASP N N 15 3.598 0.017 . . . . 134 ASP N 16876 1 124 . 1 1 135 135 GLY N N 15 2.898 0.013 . . . . 135 GLY N 16876 1 125 . 1 1 136 136 SER N N 15 3.205 0.014 . . . . 136 SER N 16876 1 126 . 1 1 137 137 ALA N N 15 2.731 0.020 . . . . 137 ALA N 16876 1 127 . 1 1 138 138 VAL N N 15 2.558 0.028 . . . . 138 VAL N 16876 1 128 . 1 1 139 139 ALA N N 15 2.804 0.013 . . . . 139 ALA N 16876 1 129 . 1 1 140 140 ALA N N 15 2.996 0.018 . . . . 140 ALA N 16876 1 130 . 1 1 141 141 ALA N N 15 3.814 0.018 . . . . 141 ALA N 16876 1 131 . 1 1 143 143 VAL N N 15 4.143 0.013 . . . . 143 VAL N 16876 1 132 . 1 1 144 144 VAL N N 15 3.788 0.015 . . . . 144 VAL N 16876 1 133 . 1 1 145 145 VAL N N 15 4.615 0.036 . . . . 145 VAL N 16876 1 134 . 1 1 149 149 VAL N N 15 4.409 0.017 . . . . 149 VAL N 16876 1 135 . 1 1 150 150 GLU N N 15 4.129 0.011 . . . . 150 GLU N 16876 1 136 . 1 1 151 151 GLU N N 15 4.407 0.015 . . . . 151 GLU N 16876 1 137 . 1 1 152 152 ALA N N 15 3.685 0.011 . . . . 152 ALA N 16876 1 138 . 1 1 153 153 HIS N N 15 4.036 0.020 . . . . 153 HIS N 16876 1 139 . 1 1 155 155 VAL N N 15 3.814 0.031 . . . . 155 VAL N 16876 1 140 . 1 1 156 156 GLU N N 15 4.049 0.015 . . . . 156 GLU N 16876 1 141 . 1 1 157 157 LYS N N 15 4.423 0.012 . . . . 157 LYS N 16876 1 142 . 1 1 158 158 LYS N N 15 3.833 0.011 . . . . 158 LYS N 16876 1 143 . 1 1 159 159 GLY N N 15 3.561 0.017 . . . . 159 GLY N 16876 1 144 . 1 1 160 160 ILE N N 15 4.241 0.014 . . . . 160 ILE N 16876 1 145 . 1 1 161 161 LEU N N 15 4.900 0.012 . . . . 161 LEU N 16876 1 146 . 1 1 162 162 GLU N N 15 4.666 0.009 . . . . 162 GLU N 16876 1 147 . 1 1 163 163 LYS N N 15 4.836 0.012 . . . . 163 LYS N 16876 1 148 . 1 1 164 164 ILE N N 15 4.535 0.022 . . . . 164 ILE N 16876 1 149 . 1 1 165 165 LYS N N 15 4.900 0.012 . . . . 165 LYS N 16876 1 150 . 1 1 166 166 GLU N N 15 4.572 0.024 . . . . 166 GLU N 16876 1 151 . 1 1 167 167 LYS N N 15 4.638 0.026 . . . . 167 LYS N 16876 1 152 . 1 1 168 168 LEU N N 15 4.297 0.009 . . . . 168 LEU N 16876 1 153 . 1 1 170 170 GLY N N 15 3.823 0.015 . . . . 170 GLY N 16876 1 154 . 1 1 171 171 TYR N N 15 4.294 0.012 . . . . 171 TYR N 16876 1 155 . 1 1 172 172 HIS N N 15 4.068 0.031 . . . . 172 HIS N 16876 1 156 . 1 1 174 174 LYS N N 15 4.141 0.021 . . . . 174 LYS N 16876 1 157 . 1 1 175 175 THR N N 15 3.663 0.015 . . . . 175 THR N 16876 1 158 . 1 1 176 176 THR N N 15 3.592 0.016 . . . . 176 THR N 16876 1 159 . 1 1 177 177 VAL N N 15 3.587 0.014 . . . . 177 VAL N 16876 1 160 . 1 1 178 178 GLU N N 15 3.461 0.012 . . . . 178 GLU N 16876 1 161 . 1 1 179 179 GLU N N 15 3.237 0.015 . . . . 179 GLU N 16876 1 162 . 1 1 180 180 GLU N N 15 3.388 0.007 . . . . 180 GLU N 16876 1 163 . 1 1 181 181 LYS N N 15 2.920 0.010 . . . . 181 LYS N 16876 1 164 . 1 1 182 182 LYS N N 15 2.999 0.017 . . . . 182 LYS N 16876 1 165 . 1 1 183 183 ASP N N 15 2.417 0.007 . . . . 183 ASP N 16876 1 166 . 1 1 184 184 LYS N N 15 2.050 0.013 . . . . 184 LYS N 16876 1 167 . 1 1 185 185 GLU N N 15 1.510 0.009 . . . . 185 GLU N 16876 1 stop_ save_ ######################################## # Heteronuclear T2 relaxation values # ######################################## save_heteronuclear_T2_list_1 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronuclear_T2_list_1 _Heteronucl_T2_list.Entry_ID 16876 _Heteronucl_T2_list.ID 1 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method methanol _Heteronucl_T2_list.Temp_control_method 'single scan interleaving' _Heteronucl_T2_list.Spectrometer_frequency_1H 600 _Heteronucl_T2_list.T2_coherence_type Nz _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units s-1 _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 12 'R2 measurement' . . . 16876 1 stop_ loop_ _Heteronucl_T2_software.Software_ID _Heteronucl_T2_software.Software_label _Heteronucl_T2_software.Method_ID _Heteronucl_T2_software.Method_label _Heteronucl_T2_software.Entry_ID _Heteronucl_T2_software.Heteronucl_T2_list_ID 1 $TOPSPIN . . 16876 1 3 $SPARKY . . 16876 1 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 3 3 GLU N N 15 2.036 0.090 . . . . 3 GLU N 16876 1 2 . 1 1 4 4 GLU N N 15 1.674 0.038 . . . . 4 GLU N 16876 1 3 . 1 1 5 5 ILE N N 15 1.957 0.017 . . . . 5 ILE N 16876 1 4 . 1 1 6 6 LYS N N 15 2.208 0.038 . . . . 6 LYS N 16876 1 5 . 1 1 7 7 ASN N N 15 2.435 0.079 . . . . 7 ASN N 16876 1 6 . 1 1 8 8 VAL N N 15 3.305 0.039 . . . . 8 VAL N 16876 1 7 . 1 1 10 10 GLU N N 15 2.966 0.019 . . . . 10 GLU N 16876 1 8 . 1 1 11 11 GLN N N 15 3.118 0.041 . . . . 11 GLN N 16876 1 9 . 1 1 12 12 GLU N N 15 3.138 0.043 . . . . 12 GLU N 16876 1 10 . 1 1 13 13 VAL N N 15 3.205 0.012 . . . . 13 VAL N 16876 1 11 . 1 1 15 15 LYS N N 15 3.117 0.042 . . . . 15 LYS N 16876 1 12 . 1 1 16 16 VAL N N 15 3.621 0.045 . . . . 16 VAL N 16876 1 13 . 1 1 17 17 ALA N N 15 3.113 0.042 . . . . 17 ALA N 16876 1 14 . 1 1 18 18 THR N N 15 2.912 0.061 . . . . 18 THR N 16876 1 15 . 1 1 19 19 GLU N N 15 3.096 0.068 . . . . 19 GLU N 16876 1 16 . 1 1 20 20 GLU N N 15 3.017 0.057 . . . . 20 GLU N 16876 1 17 . 1 1 21 21 SER N N 15 2.888 0.061 . . . . 21 SER N 16876 1 18 . 1 1 22 22 SER N N 15 2.939 0.099 . . . . 22 SER N 16876 1 19 . 1 1 23 23 ALA N N 15 3.085 0.068 . . . . 23 ALA N 16876 1 20 . 1 1 24 24 GLU N N 15 3.150 0.042 . . . . 24 GLU N 16876 1 21 . 1 1 25 25 VAL N N 15 3.757 0.035 . . . . 25 VAL N 16876 1 22 . 1 1 26 26 THR N N 15 3.628 0.065 . . . . 26 THR N 16876 1 23 . 1 1 27 27 ASP N N 15 3.737 0.078 . . . . 27 ASP N 16876 1 24 . 1 1 28 28 ARG N N 15 4.114 0.055 . . . . 28 ARG N 16876 1 25 . 1 1 29 29 GLY N N 15 4.044 0.084 . . . . 29 GLY N 16876 1 26 . 1 1 30 30 LEU N N 15 4.655 0.050 . . . . 30 LEU N 16876 1 27 . 1 1 31 31 PHE N N 15 4.554 0.052 . . . . 31 PHE N 16876 1 28 . 1 1 32 32 ASP N N 15 4.815 0.056 . . . . 32 ASP N 16876 1 29 . 1 1 33 33 PHE N N 15 4.697 0.061 . . . . 33 PHE N 16876 1 30 . 1 1 34 34 LEU N N 15 4.600 0.040 . . . . 34 LEU N 16876 1 31 . 1 1 35 35 GLY N N 15 4.198 0.074 . . . . 35 GLY N 16876 1 32 . 1 1 36 36 LYS N N 15 4.789 0.054 . . . . 36 LYS N 16876 1 33 . 1 1 37 37 LYS N N 15 4.026 0.070 . . . . 37 LYS N 16876 1 34 . 1 1 38 38 LYS N N 15 4.292 0.061 . . . . 38 LYS N 16876 1 35 . 1 1 39 39 ASP N N 15 4.026 0.089 . . . . 39 ASP N 16876 1 36 . 1 1 40 40 GLU N N 15 3.617 0.051 . . . . 40 GLU N 16876 1 37 . 1 1 41 41 THR N N 15 3.672 0.090 . . . . 41 THR N 16876 1 38 . 1 1 42 42 LYS N N 15 3.782 0.053 . . . . 42 LYS N 16876 1 39 . 1 1 44 44 GLU N N 15 3.971 0.027 . . . . 44 GLU N 16876 1 40 . 1 1 45 45 GLU N N 15 3.398 0.037 . . . . 45 GLU N 16876 1 41 . 1 1 46 46 THR N N 15 3.987 0.052 . . . . 46 THR N 16876 1 42 . 1 1 48 48 ILE N N 15 3.647 0.018 . . . . 48 ILE N 16876 1 43 . 1 1 49 49 ALA N N 15 3.750 0.036 . . . . 49 ALA N 16876 1 44 . 1 1 50 50 SER N N 15 3.691 0.069 . . . . 50 SER N 16876 1 45 . 1 1 51 51 GLU N N 15 4.294 0.049 . . . . 51 GLU N 16876 1 46 . 1 1 52 52 PHE N N 15 4.042 0.048 . . . . 52 PHE N 16876 1 47 . 1 1 53 53 GLU N N 15 4.137 0.048 . . . . 53 GLU N 16876 1 48 . 1 1 54 54 GLN N N 15 4.207 0.065 . . . . 54 GLN N 16876 1 49 . 1 1 55 55 LYS N N 15 3.596 0.063 . . . . 55 LYS N 16876 1 50 . 1 1 56 56 VAL N N 15 4.529 0.039 . . . . 56 VAL N 16876 1 51 . 1 1 57 57 HIS N N 15 4.243 0.117 . . . . 57 HIS N 16876 1 52 . 1 1 58 58 ILE N N 15 4.179 0.123 . . . . 58 ILE N 16876 1 53 . 1 1 59 59 SER N N 15 4.704 0.086 . . . . 59 SER N 16876 1 54 . 1 1 60 60 GLU N N 15 4.615 0.089 . . . . 60 GLU N 16876 1 55 . 1 1 62 62 GLU N N 15 4.405 0.055 . . . . 62 GLU N 16876 1 56 . 1 1 64 64 GLU N N 15 4.742 0.040 . . . . 64 GLU N 16876 1 57 . 1 1 65 65 VAL N N 15 4.098 0.056 . . . . 65 VAL N 16876 1 58 . 1 1 66 66 LYS N N 15 4.833 0.071 . . . . 66 LYS N 16876 1 59 . 1 1 67 67 HIS N N 15 5.402 0.066 . . . . 67 HIS N 16876 1 60 . 1 1 68 68 GLU N N 15 4.771 0.111 . . . . 68 GLU N 16876 1 61 . 1 1 69 69 SER N N 15 5.184 0.103 . . . . 69 SER N 16876 1 62 . 1 1 70 70 LEU N N 15 4.776 0.100 . . . . 70 LEU N 16876 1 63 . 1 1 71 71 LEU N N 15 4.651 0.039 . . . . 71 LEU N 16876 1 64 . 1 1 72 72 GLU N N 15 5.552 0.038 . . . . 72 GLU N 16876 1 65 . 1 1 73 73 LYS N N 15 4.817 0.052 . . . . 73 LYS N 16876 1 66 . 1 1 74 74 LEU N N 15 5.015 0.055 . . . . 74 LEU N 16876 1 67 . 1 1 75 75 HIS N N 15 4.119 0.068 . . . . 75 HIS N 16876 1 68 . 1 1 76 76 ARG N N 15 4.492 0.115 . . . . 76 ARG N 16876 1 69 . 1 1 77 77 SER N N 15 3.798 0.126 . . . . 77 SER N 16876 1 70 . 1 1 78 78 ASP N N 15 3.530 0.084 . . . . 78 ASP N 16876 1 71 . 1 1 79 79 SER N N 15 3.161 0.094 . . . . 79 SER N 16876 1 72 . 1 1 80 80 SER N N 15 2.964 0.089 . . . . 80 SER N 16876 1 73 . 1 1 81 81 SER N N 15 2.762 0.110 . . . . 81 SER N 16876 1 74 . 1 1 82 82 SER N N 15 2.656 0.087 . . . . 82 SER N 16876 1 75 . 1 1 83 83 SER N N 15 2.755 0.107 . . . . 83 SER N 16876 1 76 . 1 1 84 84 SER N N 15 2.844 0.091 . . . . 84 SER N 16876 1 77 . 1 1 85 85 SER N N 15 2.874 0.107 . . . . 85 SER N 16876 1 78 . 1 1 86 86 GLU N N 15 3.203 0.092 . . . . 86 GLU N 16876 1 79 . 1 1 87 87 GLU N N 15 3.166 0.045 . . . . 87 GLU N 16876 1 80 . 1 1 88 88 GLU N N 15 3.441 0.047 . . . . 88 GLU N 16876 1 81 . 1 1 89 89 GLY N N 15 3.301 0.079 . . . . 89 GLY N 16876 1 82 . 1 1 90 90 SER N N 15 3.592 0.079 . . . . 90 SER N 16876 1 83 . 1 1 91 91 ASP N N 15 3.997 0.102 . . . . 91 ASP N 16876 1 84 . 1 1 92 92 GLY N N 15 4.158 0.096 . . . . 92 GLY N 16876 1 85 . 1 1 93 93 GLU N N 15 4.993 0.080 . . . . 93 GLU N 16876 1 86 . 1 1 94 94 LYS N N 15 4.941 0.068 . . . . 94 LYS N 16876 1 87 . 1 1 95 95 ARG N N 15 4.850 0.068 . . . . 95 ARG N 16876 1 88 . 1 1 96 96 LYS N N 15 3.501 0.038 . . . . 96 LYS N 16876 1 89 . 1 1 97 97 LYS N N 15 4.713 0.075 . . . . 97 LYS N 16876 1 90 . 1 1 98 98 LYS N N 15 4.472 0.054 . . . . 98 LYS N 16876 1 91 . 1 1 99 99 LYS N N 15 3.146 0.069 . . . . 99 LYS N 16876 1 92 . 1 1 100 100 GLU N N 15 4.369 0.055 . . . . 100 GLU N 16876 1 93 . 1 1 101 101 LYS N N 15 4.348 0.055 . . . . 101 LYS N 16876 1 94 . 1 1 102 102 LYS N N 15 4.352 0.116 . . . . 102 LYS N 16876 1 95 . 1 1 103 103 LYS N N 15 4.621 0.084 . . . . 103 LYS N 16876 1 96 . 1 1 105 105 THR N N 15 4.502 0.085 . . . . 105 THR N 16876 1 97 . 1 1 106 106 THR N N 15 4.572 0.116 . . . . 106 THR N 16876 1 98 . 1 1 107 107 GLU N N 15 4.388 0.091 . . . . 107 GLU N 16876 1 99 . 1 1 108 108 VAL N N 15 5.003 0.040 . . . . 108 VAL N 16876 1 100 . 1 1 109 109 GLU N N 15 4.998 0.075 . . . . 109 GLU N 16876 1 101 . 1 1 110 110 VAL N N 15 4.780 0.043 . . . . 110 VAL N 16876 1 102 . 1 1 111 111 LYS N N 15 5.841 0.073 . . . . 111 LYS N 16876 1 103 . 1 1 112 112 GLU N N 15 5.444 0.060 . . . . 112 GLU N 16876 1 104 . 1 1 113 113 GLU N N 15 5.705 0.065 . . . . 113 GLU N 16876 1 105 . 1 1 114 114 GLU N N 15 4.492 0.075 . . . . 114 GLU N 16876 1 106 . 1 1 115 115 LYS N N 15 5.214 0.066 . . . . 115 LYS N 16876 1 107 . 1 1 116 116 LYS N N 15 5.453 0.072 . . . . 116 LYS N 16876 1 108 . 1 1 117 117 GLY N N 15 5.280 0.129 . . . . 117 GLY N 16876 1 109 . 1 1 118 118 PHE N N 15 5.663 0.079 . . . . 118 PHE N 16876 1 110 . 1 1 119 119 MET N N 15 5.688 0.092 . . . . 119 MET N 16876 1 111 . 1 1 120 120 GLU N N 15 4.933 0.079 . . . . 120 GLU N 16876 1 112 . 1 1 121 121 LYS N N 15 4.885 0.079 . . . . 121 LYS N 16876 1 113 . 1 1 122 122 LEU N N 15 5.580 0.058 . . . . 122 LEU N 16876 1 114 . 1 1 123 123 LYS N N 15 4.985 0.062 . . . . 123 LYS N 16876 1 115 . 1 1 124 124 GLU N N 15 5.058 0.056 . . . . 124 GLU N 16876 1 116 . 1 1 125 125 LYS N N 15 4.669 0.048 . . . . 125 LYS N 16876 1 117 . 1 1 126 126 LEU N N 15 4.235 0.063 . . . . 126 LEU N 16876 1 118 . 1 1 128 128 GLY N N 15 4.072 0.085 . . . . 128 GLY N 16876 1 119 . 1 1 129 129 HIS N N 15 3.755 0.134 . . . . 129 HIS N 16876 1 120 . 1 1 130 130 LYS N N 15 3.935 0.112 . . . . 130 LYS N 16876 1 121 . 1 1 131 131 LYS N N 15 3.666 0.062 . . . . 131 LYS N 16876 1 122 . 1 1 133 133 GLU N N 15 3.510 0.059 . . . . 133 GLU N 16876 1 123 . 1 1 134 134 ASP N N 15 3.415 0.049 . . . . 134 ASP N 16876 1 124 . 1 1 135 135 GLY N N 15 2.889 0.080 . . . . 135 GLY N 16876 1 125 . 1 1 136 136 SER N N 15 3.208 0.096 . . . . 136 SER N 16876 1 126 . 1 1 137 137 ALA N N 15 2.591 0.091 . . . . 137 ALA N 16876 1 127 . 1 1 138 138 VAL N N 15 2.618 0.031 . . . . 138 VAL N 16876 1 128 . 1 1 139 139 ALA N N 15 2.820 0.047 . . . . 139 ALA N 16876 1 129 . 1 1 140 140 ALA N N 15 2.957 0.043 . . . . 140 ALA N 16876 1 130 . 1 1 141 141 ALA N N 15 3.782 0.049 . . . . 141 ALA N 16876 1 131 . 1 1 143 143 VAL N N 15 4.016 0.016 . . . . 143 VAL N 16876 1 132 . 1 1 144 144 VAL N N 15 3.795 0.040 . . . . 144 VAL N 16876 1 133 . 1 1 145 145 VAL N N 15 4.888 0.063 . . . . 145 VAL N 16876 1 134 . 1 1 149 149 VAL N N 15 4.382 0.019 . . . . 149 VAL N 16876 1 135 . 1 1 150 150 GLU N N 15 4.149 0.034 . . . . 150 GLU N 16876 1 136 . 1 1 151 151 GLU N N 15 4.374 0.060 . . . . 151 GLU N 16876 1 137 . 1 1 152 152 ALA N N 15 3.720 0.059 . . . . 152 ALA N 16876 1 138 . 1 1 153 153 HIS N N 15 3.954 0.098 . . . . 153 HIS N 16876 1 139 . 1 1 155 155 VAL N N 15 3.870 0.030 . . . . 155 VAL N 16876 1 140 . 1 1 156 156 GLU N N 15 3.954 0.058 . . . . 156 GLU N 16876 1 141 . 1 1 157 157 LYS N N 15 4.323 0.096 . . . . 157 LYS N 16876 1 142 . 1 1 158 158 LYS N N 15 4.003 0.065 . . . . 158 LYS N 16876 1 143 . 1 1 159 159 GLY N N 15 3.740 0.107 . . . . 159 GLY N 16876 1 144 . 1 1 160 160 ILE N N 15 4.268 0.036 . . . . 160 ILE N 16876 1 145 . 1 1 161 161 LEU N N 15 4.888 0.059 . . . . 161 LEU N 16876 1 146 . 1 1 162 162 GLU N N 15 4.619 0.043 . . . . 162 GLU N 16876 1 147 . 1 1 163 163 LYS N N 15 4.907 0.065 . . . . 163 LYS N 16876 1 148 . 1 1 164 164 ILE N N 15 4.359 0.038 . . . . 164 ILE N 16876 1 149 . 1 1 165 165 LYS N N 15 4.798 0.059 . . . . 165 LYS N 16876 1 150 . 1 1 166 166 GLU N N 15 4.448 0.042 . . . . 166 GLU N 16876 1 151 . 1 1 167 167 LYS N N 15 4.421 0.079 . . . . 167 LYS N 16876 1 152 . 1 1 168 168 LEU N N 15 4.274 0.025 . . . . 168 LEU N 16876 1 153 . 1 1 170 170 GLY N N 15 3.925 0.101 . . . . 170 GLY N 16876 1 154 . 1 1 171 171 TYR N N 15 4.314 0.087 . . . . 171 TYR N 16876 1 155 . 1 1 172 172 HIS N N 15 3.997 0.113 . . . . 172 HIS N 16876 1 156 . 1 1 174 174 LYS N N 15 4.085 0.103 . . . . 174 LYS N 16876 1 157 . 1 1 175 175 THR N N 15 3.678 0.104 . . . . 175 THR N 16876 1 158 . 1 1 176 176 THR N N 15 3.524 0.089 . . . . 176 THR N 16876 1 159 . 1 1 177 177 VAL N N 15 3.514 0.034 . . . . 177 VAL N 16876 1 160 . 1 1 178 178 GLU N N 15 3.401 0.047 . . . . 178 GLU N 16876 1 161 . 1 1 179 179 GLU N N 15 3.256 0.035 . . . . 179 GLU N 16876 1 162 . 1 1 180 180 GLU N N 15 3.398 0.040 . . . . 180 GLU N 16876 1 163 . 1 1 181 181 LYS N N 15 2.833 0.048 . . . . 181 LYS N 16876 1 164 . 1 1 182 182 LYS N N 15 2.894 0.044 . . . . 182 LYS N 16876 1 165 . 1 1 183 183 ASP N N 15 2.279 0.047 . . . . 183 ASP N 16876 1 166 . 1 1 184 184 LYS N N 15 2.073 0.032 . . . . 184 LYS N 16876 1 167 . 1 1 185 185 GLU N N 15 1.468 0.010 . . . . 185 GLU N 16876 1 stop_ save_