data_27964 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27964 _Entry.Title ; Delta subunit of RNA polymerase from Bacillus subtilis with mutated lisine strecht to glutamic acid ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2019-06-30 _Entry.Accession_date 2019-06-30 _Entry.Last_release_date 2019-07-01 _Entry.Original_release_date 2019-07-01 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.1.32 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _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.ORCID _Entry_author.Entry_ID 1 Lukas Zidek . . . . 27964 2 Vojtech Kuban . . . . 27964 3 Pavel Srb . . . . 27964 4 Hana Stegnerova . . . . 27964 5 Petr Padrta . . . . 27964 6 Milan Zachrdla . . . . 27964 7 Zuzana Jasenakova . . . . 27964 8 Hana Sanderova . . . . 27964 9 Libor Krasny . . . . 27964 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID RDCs 1 27964 assigned_chemical_shifts 1 27964 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 259 27964 '15N chemical shifts' 87 27964 '1H chemical shifts' 167 27964 'residual dipolar couplings' 663 27964 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 . . 2019-11-22 2019-06-30 update BMRB 'update entry citation' 27964 1 . . 2019-09-30 2019-06-30 original author 'original release' 27964 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 16635 'N-terminal domain of Bacillus subtilis delta subunit of RNA polymerase' 27964 BMRB 16912 'Delta subunit of RNA polymerase from Bacillus subtilis' 27964 BMRB 18903 'Relaxation study of Delta subunit of RNA polymerase from Bacillus subtilis' 27964 BMRB 19284 'Relaxation data of the delta subunit of RNA polymerase from Bacillus subtilis' 27964 BMRB 27245 'Backbone 15N relaxation data for c-teminal domain of delta subunit of RNA polymerase from bacillus subtilis' 27964 BMRB 27963 'RDC of Delta subunit of RNA polymerase from Bacillus subtilis' 27964 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27964 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 31550880 _Citation.Full_citation . _Citation.Title ; Quantitative Conformational Analysis of Functionally Important Electrostatic Interactions in the Intrinsically Disordered Region of Delta Subunit of Bacterial RNA Polymerase ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Am. Chem. Soc.' _Citation.Journal_name_full . _Citation.Journal_volume 141 _Citation.Journal_issue 42 _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 16817 _Citation.Page_last 16828 _Citation.Year 2019 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Vojtech Kuban V. . . . 27964 1 2 Pavel Srb P. . . . 27964 1 3 Hana Stegnerova H. . . . 27964 1 4 Petr Padrta P. . . . 27964 1 5 Milan Zachrdla M. . . . 27964 1 6 Zuzana Jasenakova Z. . . . 27964 1 7 Hana Sanderova H. . . . 27964 1 8 Dragana Vitovska D. . . . 27964 1 9 Libor Krasny L. . . . 27964 1 10 Tomas Koval T. . . . 27964 1 11 Jan Dohnalek J. . . . 27964 1 12 Joanna 'Ziemska-Legi Cka' J. . . . 27964 1 13 Marcin Grynberg M. . . . 27964 1 14 Patryk Jarnot P. . . . 27964 1 15 Aleksandra Gruca A. . . . 27964 1 16 'Malene Ringkjobing' Jensen M. R. . . 27964 1 17 Martin Blackledge M. . . . 27964 1 18 Lukas Zidek L. . . . 27964 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'electrostatic interactions' 27964 1 'intrinsically disordered proteins' 27964 1 'long-range dynamics' 27964 1 'nuclear magnetic resonance' 27964 1 'residual dipolar couplings' 27964 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27964 _Assembly.ID 1 _Assembly.Name Delta-KE _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 Delta-KE 1 $Mutant_of_Delta_Subunit A . yes 'partially disordered' no no . . . 27964 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2KRC . . 'solution NMR' . . . 27964 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Mutant_of_Delta_Subunit _Entity.Sf_category entity _Entity.Sf_framecode Mutant_of_Delta_Subunit _Entity.Entry_ID 27964 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Mutant_of_Delta_Subunit _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 ; MGIKQYSQEELKEMALVEIA HELFEEHKKPVPFQELLNEI ASLLGVKKEELGDRIAQFYT DLNIDGRFLALSDQTWGLRS WYPYDQLDEETQPTVEAEEE EAEEAVEEDLDLDEFEEIDE DDLDLDEVEEELDLEADDFD EEDLDEDDDDLEIEEDIIDE DDEDYDDEEEEIK ; _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 173 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_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 . 27964 1 2 . GLY . 27964 1 3 . ILE . 27964 1 4 . LYS . 27964 1 5 . GLN . 27964 1 6 . TYR . 27964 1 7 . SER . 27964 1 8 . GLN . 27964 1 9 . GLU . 27964 1 10 . GLU . 27964 1 11 . LEU . 27964 1 12 . LYS . 27964 1 13 . GLU . 27964 1 14 . MET . 27964 1 15 . ALA . 27964 1 16 . LEU . 27964 1 17 . VAL . 27964 1 18 . GLU . 27964 1 19 . ILE . 27964 1 20 . ALA . 27964 1 21 . HIS . 27964 1 22 . GLU . 27964 1 23 . LEU . 27964 1 24 . PHE . 27964 1 25 . GLU . 27964 1 26 . GLU . 27964 1 27 . HIS . 27964 1 28 . LYS . 27964 1 29 . LYS . 27964 1 30 . PRO . 27964 1 31 . VAL . 27964 1 32 . PRO . 27964 1 33 . PHE . 27964 1 34 . GLN . 27964 1 35 . GLU . 27964 1 36 . LEU . 27964 1 37 . LEU . 27964 1 38 . ASN . 27964 1 39 . GLU . 27964 1 40 . ILE . 27964 1 41 . ALA . 27964 1 42 . SER . 27964 1 43 . LEU . 27964 1 44 . LEU . 27964 1 45 . GLY . 27964 1 46 . VAL . 27964 1 47 . LYS . 27964 1 48 . LYS . 27964 1 49 . GLU . 27964 1 50 . GLU . 27964 1 51 . LEU . 27964 1 52 . GLY . 27964 1 53 . ASP . 27964 1 54 . ARG . 27964 1 55 . ILE . 27964 1 56 . ALA . 27964 1 57 . GLN . 27964 1 58 . PHE . 27964 1 59 . TYR . 27964 1 60 . THR . 27964 1 61 . ASP . 27964 1 62 . LEU . 27964 1 63 . ASN . 27964 1 64 . ILE . 27964 1 65 . ASP . 27964 1 66 . GLY . 27964 1 67 . ARG . 27964 1 68 . PHE . 27964 1 69 . LEU . 27964 1 70 . ALA . 27964 1 71 . LEU . 27964 1 72 . SER . 27964 1 73 . ASP . 27964 1 74 . GLN . 27964 1 75 . THR . 27964 1 76 . TRP . 27964 1 77 . GLY . 27964 1 78 . LEU . 27964 1 79 . ARG . 27964 1 80 . SER . 27964 1 81 . TRP . 27964 1 82 . TYR . 27964 1 83 . PRO . 27964 1 84 . TYR . 27964 1 85 . ASP . 27964 1 86 . GLN . 27964 1 87 . LEU . 27964 1 88 . ASP . 27964 1 89 . GLU . 27964 1 90 . GLU . 27964 1 91 . THR . 27964 1 92 . GLN . 27964 1 93 . PRO . 27964 1 94 . THR . 27964 1 95 . VAL . 27964 1 96 . GLU . 27964 1 97 . ALA . 27964 1 98 . GLU . 27964 1 99 . GLU . 27964 1 100 . GLU . 27964 1 101 . GLU . 27964 1 102 . ALA . 27964 1 103 . GLU . 27964 1 104 . GLU . 27964 1 105 . ALA . 27964 1 106 . VAL . 27964 1 107 . GLU . 27964 1 108 . GLU . 27964 1 109 . ASP . 27964 1 110 . LEU . 27964 1 111 . ASP . 27964 1 112 . LEU . 27964 1 113 . ASP . 27964 1 114 . GLU . 27964 1 115 . PHE . 27964 1 116 . GLU . 27964 1 117 . GLU . 27964 1 118 . ILE . 27964 1 119 . ASP . 27964 1 120 . GLU . 27964 1 121 . ASP . 27964 1 122 . ASP . 27964 1 123 . LEU . 27964 1 124 . ASP . 27964 1 125 . LEU . 27964 1 126 . ASP . 27964 1 127 . GLU . 27964 1 128 . VAL . 27964 1 129 . GLU . 27964 1 130 . GLU . 27964 1 131 . GLU . 27964 1 132 . LEU . 27964 1 133 . ASP . 27964 1 134 . LEU . 27964 1 135 . GLU . 27964 1 136 . ALA . 27964 1 137 . ASP . 27964 1 138 . ASP . 27964 1 139 . PHE . 27964 1 140 . ASP . 27964 1 141 . GLU . 27964 1 142 . GLU . 27964 1 143 . ASP . 27964 1 144 . LEU . 27964 1 145 . ASP . 27964 1 146 . GLU . 27964 1 147 . ASP . 27964 1 148 . ASP . 27964 1 149 . ASP . 27964 1 150 . ASP . 27964 1 151 . LEU . 27964 1 152 . GLU . 27964 1 153 . ILE . 27964 1 154 . GLU . 27964 1 155 . GLU . 27964 1 156 . ASP . 27964 1 157 . ILE . 27964 1 158 . ILE . 27964 1 159 . ASP . 27964 1 160 . GLU . 27964 1 161 . ASP . 27964 1 162 . ASP . 27964 1 163 . GLU . 27964 1 164 . ASP . 27964 1 165 . TYR . 27964 1 166 . ASP . 27964 1 167 . ASP . 27964 1 168 . GLU . 27964 1 169 . GLU . 27964 1 170 . GLU . 27964 1 171 . GLU . 27964 1 172 . ILE . 27964 1 173 . LYS . 27964 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 27964 1 . GLY 2 2 27964 1 . ILE 3 3 27964 1 . LYS 4 4 27964 1 . GLN 5 5 27964 1 . TYR 6 6 27964 1 . SER 7 7 27964 1 . GLN 8 8 27964 1 . GLU 9 9 27964 1 . GLU 10 10 27964 1 . LEU 11 11 27964 1 . LYS 12 12 27964 1 . GLU 13 13 27964 1 . MET 14 14 27964 1 . ALA 15 15 27964 1 . LEU 16 16 27964 1 . VAL 17 17 27964 1 . GLU 18 18 27964 1 . ILE 19 19 27964 1 . ALA 20 20 27964 1 . HIS 21 21 27964 1 . GLU 22 22 27964 1 . LEU 23 23 27964 1 . PHE 24 24 27964 1 . GLU 25 25 27964 1 . GLU 26 26 27964 1 . HIS 27 27 27964 1 . LYS 28 28 27964 1 . LYS 29 29 27964 1 . PRO 30 30 27964 1 . VAL 31 31 27964 1 . PRO 32 32 27964 1 . PHE 33 33 27964 1 . GLN 34 34 27964 1 . GLU 35 35 27964 1 . LEU 36 36 27964 1 . LEU 37 37 27964 1 . ASN 38 38 27964 1 . GLU 39 39 27964 1 . ILE 40 40 27964 1 . ALA 41 41 27964 1 . SER 42 42 27964 1 . LEU 43 43 27964 1 . LEU 44 44 27964 1 . GLY 45 45 27964 1 . VAL 46 46 27964 1 . LYS 47 47 27964 1 . LYS 48 48 27964 1 . GLU 49 49 27964 1 . GLU 50 50 27964 1 . LEU 51 51 27964 1 . GLY 52 52 27964 1 . ASP 53 53 27964 1 . ARG 54 54 27964 1 . ILE 55 55 27964 1 . ALA 56 56 27964 1 . GLN 57 57 27964 1 . PHE 58 58 27964 1 . TYR 59 59 27964 1 . THR 60 60 27964 1 . ASP 61 61 27964 1 . LEU 62 62 27964 1 . ASN 63 63 27964 1 . ILE 64 64 27964 1 . ASP 65 65 27964 1 . GLY 66 66 27964 1 . ARG 67 67 27964 1 . PHE 68 68 27964 1 . LEU 69 69 27964 1 . ALA 70 70 27964 1 . LEU 71 71 27964 1 . SER 72 72 27964 1 . ASP 73 73 27964 1 . GLN 74 74 27964 1 . THR 75 75 27964 1 . TRP 76 76 27964 1 . GLY 77 77 27964 1 . LEU 78 78 27964 1 . ARG 79 79 27964 1 . SER 80 80 27964 1 . TRP 81 81 27964 1 . TYR 82 82 27964 1 . PRO 83 83 27964 1 . TYR 84 84 27964 1 . ASP 85 85 27964 1 . GLN 86 86 27964 1 . LEU 87 87 27964 1 . ASP 88 88 27964 1 . GLU 89 89 27964 1 . GLU 90 90 27964 1 . THR 91 91 27964 1 . GLN 92 92 27964 1 . PRO 93 93 27964 1 . THR 94 94 27964 1 . VAL 95 95 27964 1 . GLU 96 96 27964 1 . ALA 97 97 27964 1 . GLU 98 98 27964 1 . GLU 99 99 27964 1 . GLU 100 100 27964 1 . GLU 101 101 27964 1 . ALA 102 102 27964 1 . GLU 103 103 27964 1 . GLU 104 104 27964 1 . ALA 105 105 27964 1 . VAL 106 106 27964 1 . GLU 107 107 27964 1 . GLU 108 108 27964 1 . ASP 109 109 27964 1 . LEU 110 110 27964 1 . ASP 111 111 27964 1 . LEU 112 112 27964 1 . ASP 113 113 27964 1 . GLU 114 114 27964 1 . PHE 115 115 27964 1 . GLU 116 116 27964 1 . GLU 117 117 27964 1 . ILE 118 118 27964 1 . ASP 119 119 27964 1 . GLU 120 120 27964 1 . ASP 121 121 27964 1 . ASP 122 122 27964 1 . LEU 123 123 27964 1 . ASP 124 124 27964 1 . LEU 125 125 27964 1 . ASP 126 126 27964 1 . GLU 127 127 27964 1 . VAL 128 128 27964 1 . GLU 129 129 27964 1 . GLU 130 130 27964 1 . GLU 131 131 27964 1 . LEU 132 132 27964 1 . ASP 133 133 27964 1 . LEU 134 134 27964 1 . GLU 135 135 27964 1 . ALA 136 136 27964 1 . ASP 137 137 27964 1 . ASP 138 138 27964 1 . PHE 139 139 27964 1 . ASP 140 140 27964 1 . GLU 141 141 27964 1 . GLU 142 142 27964 1 . ASP 143 143 27964 1 . LEU 144 144 27964 1 . ASP 145 145 27964 1 . GLU 146 146 27964 1 . ASP 147 147 27964 1 . ASP 148 148 27964 1 . ASP 149 149 27964 1 . ASP 150 150 27964 1 . LEU 151 151 27964 1 . GLU 152 152 27964 1 . ILE 153 153 27964 1 . GLU 154 154 27964 1 . GLU 155 155 27964 1 . ASP 156 156 27964 1 . ILE 157 157 27964 1 . ILE 158 158 27964 1 . ASP 159 159 27964 1 . GLU 160 160 27964 1 . ASP 161 161 27964 1 . ASP 162 162 27964 1 . GLU 163 163 27964 1 . ASP 164 164 27964 1 . TYR 165 165 27964 1 . ASP 166 166 27964 1 . ASP 167 167 27964 1 . GLU 168 168 27964 1 . GLU 169 169 27964 1 . GLU 170 170 27964 1 . GLU 171 171 27964 1 . ILE 172 172 27964 1 . LYS 173 173 27964 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 27964 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Mutant_of_Delta_Subunit . 1423 organism . 'Bacillus subtilis' 'Bacillus subtilis' . . Bacteria . Bacillus subtilis . . . . . . . . . . . . . 27964 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 27964 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Mutant_of_Delta_Subunit . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET22b . . . 27964 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27964 _Sample.ID 1 _Sample.Name . _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 'Mutant of Delta Subunit of Bacterial RNA Polymerase' '[U-100% 13C; U-100% 15N]' . . 1 $Mutant_of_Delta_Subunit . . 0.6 . . mM . . . . 27964 1 2 'sodium chloride' 'natural abundance' . . . . . . 10 . . mM . . . . 27964 1 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 27964 1 4 'sodium azide' 'natural abundance' . . . . . . 0.05 . . % . . . . 27964 1 stop_ save_ save_sample_gel _Sample.Sf_category sample _Sample.Sf_framecode sample_gel _Sample.Entry_ID 27964 _Sample.ID 2 _Sample.Name . _Sample.Type 'gel 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 'Mutant of Delta Subunit of Bacterial RNA Polymerase' '[U-100% 13C; U-100% 15N]' . . 1 $Mutant_of_Delta_Subunit . . 0.25 . . mM . . . . 27964 2 2 'sodium chloride' 'natural abundance' . . . . . . 10 . . mM . . . . 27964 2 3 'sodium azide' 'natural abundance' . . . . . . 0.05 . . % . . . . 27964 2 4 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 27964 2 5 'polyacrylamide gel' 'natural abundance' . . . . . . 5 . . % . . . . 27964 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 27964 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.5 . pH 27964 1 pressure 1 . atm 27964 1 temperature 300 . K 27964 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 27964 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 27964 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . processing 27964 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 27964 _Software.ID 2 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 27964 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 27964 2 . 'peak picking' 27964 2 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 27964 _Software.ID 3 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 27964 3 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . collection 27964 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_600 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_600 _NMR_spectrometer.Entry_ID 27964 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_700 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_700 _NMR_spectrometer.Entry_ID 27964 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 27964 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_600 Bruker Avance . 600 . . . 27964 1 2 spectrometer_700 Bruker Avance . 700 . . . 27964 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 27964 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '13C-detected 5D CACONCACO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_700 . . . . . . . . . . . . . . . . 27964 1 2 '13C-detected 5D HC(CC-TOCSY)CACON' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_700 . . . . . . . . . . . . . . . . 27964 1 3 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_600 . . . . . . . . . . . . . . . . 27964 1 4 '3D IPAP HNCO' no . . . . . . . . . . 2 $sample_gel anisotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_600 . . . . . . . . . . . . . . . . 27964 1 5 '3D a/b-HNCO' no . . . . . . . . . . 2 $sample_gel anisotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_600 . . . . . . . . . . . . . . . . 27964 1 6 '4D IPAP (HA)CACONH' no . . . . . . . . . . 2 $sample_gel anisotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_600 . . . . . . . . . . . . . . . . 27964 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 27964 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 27964 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27964 1 N 15 'liquid anhydrous ammonia' nitrogen . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27964 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 27964 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $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 '13C-detected 5D CACONCACO' . . . 27964 1 2 '13C-detected 5D HC(CC-TOCSY)CACON' . . . 27964 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 84 84 TYR HA H 1 4.558 0.0 . 1 . . . . . 84 TYR HA . 27964 1 2 . 1 1 84 84 TYR C C 13 175.664 0.0 . 1 . . . . . 84 TYR C . 27964 1 3 . 1 1 84 84 TYR CA C 13 57.796 0.0 . 1 . . . . . 84 TYR CA . 27964 1 4 . 1 1 84 84 TYR CB C 13 38.576 0.0 . 1 . . . . . 84 TYR CB . 27964 1 5 . 1 1 84 84 TYR N N 15 120.351 0.0 . 1 . . . . . 84 TYR N . 27964 1 6 . 1 1 85 85 ASP H H 1 8.269 0.0 . 1 . . . . . 85 ASP H . 27964 1 7 . 1 1 85 85 ASP HA H 1 4.538 0.0 . 1 . . . . . 85 ASP HA . 27964 1 8 . 1 1 85 85 ASP C C 13 175.743 0.0 . 1 . . . . . 85 ASP C . 27964 1 9 . 1 1 85 85 ASP CA C 13 54.413 0.0 . 1 . . . . . 85 ASP CA . 27964 1 10 . 1 1 85 85 ASP CB C 13 41.076 0.0 . 1 . . . . . 85 ASP CB . 27964 1 11 . 1 1 85 85 ASP N N 15 121.032 0.0 . 1 . . . . . 85 ASP N . 27964 1 12 . 1 1 86 86 GLN H H 1 8.123 0.0 . 1 . . . . . 86 GLN H . 27964 1 13 . 1 1 86 86 GLN HA H 1 4.272 0.0 . 1 . . . . . 86 GLN HA . 27964 1 14 . 1 1 86 86 GLN C C 13 175.656 0.0 . 1 . . . . . 86 GLN C . 27964 1 15 . 1 1 86 86 GLN CA C 13 55.803 0.0 . 1 . . . . . 86 GLN CA . 27964 1 16 . 1 1 86 86 GLN CB C 13 29.386 0.0 . 1 . . . . . 86 GLN CB . 27964 1 17 . 1 1 86 86 GLN N N 15 119.942 0.0 . 1 . . . . . 86 GLN N . 27964 1 18 . 1 1 87 87 LEU H H 1 8.279 0.0 . 1 . . . . . 87 LEU H . 27964 1 19 . 1 1 87 87 LEU HA H 1 4.308 0.0 . 1 . . . . . 87 LEU HA . 27964 1 20 . 1 1 87 87 LEU C C 13 177.074 0.0 . 1 . . . . . 87 LEU C . 27964 1 21 . 1 1 87 87 LEU CA C 13 55.234 0.0 . 1 . . . . . 87 LEU CA . 27964 1 22 . 1 1 87 87 LEU CB C 13 42.406 0.0 . 1 . . . . . 87 LEU CB . 27964 1 23 . 1 1 87 87 LEU N N 15 123.387 0.0 . 1 . . . . . 87 LEU N . 27964 1 24 . 1 1 88 88 ASP H H 1 8.374 0.0 . 1 . . . . . 88 ASP H . 27964 1 25 . 1 1 88 88 ASP HA H 1 4.578 0.0 . 1 . . . . . 88 ASP HA . 27964 1 26 . 1 1 88 88 ASP C C 13 176.183 0.0 . 1 . . . . . 88 ASP C . 27964 1 27 . 1 1 88 88 ASP CA C 13 54.379 0.0 . 1 . . . . . 88 ASP CA . 27964 1 28 . 1 1 88 88 ASP CB C 13 41.136 0.0 . 1 . . . . . 88 ASP CB . 27964 1 29 . 1 1 88 88 ASP N N 15 121.287 0.0 . 1 . . . . . 88 ASP N . 27964 1 30 . 1 1 89 89 GLU H H 1 8.336 0.0 . 1 . . . . . 89 GLU H . 27964 1 31 . 1 1 89 89 GLU HA H 1 4.251 0.0 . 1 . . . . . 89 GLU HA . 27964 1 32 . 1 1 89 89 GLU C C 13 176.516 0.0 . 1 . . . . . 89 GLU C . 27964 1 33 . 1 1 89 89 GLU CA C 13 56.593 0.0 . 1 . . . . . 89 GLU CA . 27964 1 34 . 1 1 89 89 GLU CB C 13 30.196 0.0 . 1 . . . . . 89 GLU CB . 27964 1 35 . 1 1 89 89 GLU N N 15 121.164 0.0 . 1 . . . . . 89 GLU N . 27964 1 36 . 1 1 90 90 GLU H H 1 8.359 0.0 . 1 . . . . . 90 GLU H . 27964 1 37 . 1 1 90 90 GLU HA H 1 4.310 0.0 . 1 . . . . . 90 GLU HA . 27964 1 38 . 1 1 90 90 GLU C C 13 176.661 0.0 . 1 . . . . . 90 GLU C . 27964 1 39 . 1 1 90 90 GLU CA C 13 56.625 0.0 . 1 . . . . . 90 GLU CA . 27964 1 40 . 1 1 90 90 GLU CB C 13 30.136 0.0 . 1 . . . . . 90 GLU CB . 27964 1 41 . 1 1 90 90 GLU N N 15 121.662 0.0 . 1 . . . . . 90 GLU N . 27964 1 42 . 1 1 91 91 THR H H 1 8.182 0.0 . 1 . . . . . 91 THR H . 27964 1 43 . 1 1 91 91 THR HA H 1 4.281 0.0 . 1 . . . . . 91 THR HA . 27964 1 44 . 1 1 91 91 THR C C 13 174.308 0.0 . 1 . . . . . 91 THR C . 27964 1 45 . 1 1 91 91 THR CA C 13 62.022 0.0 . 1 . . . . . 91 THR CA . 27964 1 46 . 1 1 91 91 THR CB C 13 69.826 0.0 . 1 . . . . . 91 THR CB . 27964 1 47 . 1 1 91 91 THR N N 15 116.094 0.0 . 1 . . . . . 91 THR N . 27964 1 48 . 1 1 92 92 GLN H H 1 8.450 0.0 . 1 . . . . . 92 GLN H . 27964 1 49 . 1 1 92 92 GLN HA H 1 4.614 0.0 . 1 . . . . . 92 GLN HA . 27964 1 50 . 1 1 92 92 GLN C C 13 173.864 0.0 . 1 . . . . . 92 GLN C . 27964 1 51 . 1 1 92 92 GLN CA C 13 53.624 0.0 . 1 . . . . . 92 GLN CA . 27964 1 52 . 1 1 92 92 GLN CB C 13 29.006 0.0 . 1 . . . . . 92 GLN CB . 27964 1 53 . 1 1 92 92 GLN N N 15 124.326 0.0 . 1 . . . . . 92 GLN N . 27964 1 54 . 1 1 93 93 PRO HA H 1 4.467 0.0 . 1 . . . . . 93 PRO HA . 27964 1 55 . 1 1 93 93 PRO C C 13 176.950 0.0 . 1 . . . . . 93 PRO C . 27964 1 56 . 1 1 93 93 PRO CA C 13 63.071 0.0 . 1 . . . . . 93 PRO CA . 27964 1 57 . 1 1 93 93 PRO CB C 13 32.166 0.0 . 1 . . . . . 93 PRO CB . 27964 1 58 . 1 1 94 94 THR H H 1 8.368 0.0 . 1 . . . . . 94 THR H . 27964 1 59 . 1 1 94 94 THR HA H 1 4.300 0.0 . 1 . . . . . 94 THR HA . 27964 1 60 . 1 1 94 94 THR C C 13 174.465 0.0 . 1 . . . . . 94 THR C . 27964 1 61 . 1 1 94 94 THR CA C 13 61.997 0.0 . 1 . . . . . 94 THR CA . 27964 1 62 . 1 1 94 94 THR CB C 13 69.876 0.0 . 1 . . . . . 94 THR CB . 27964 1 63 . 1 1 94 94 THR N N 15 116.003 0.0 . 1 . . . . . 94 THR N . 27964 1 64 . 1 1 95 95 VAL H H 1 8.247 0.0 . 1 . . . . . 95 VAL H . 27964 1 65 . 1 1 95 95 VAL HA H 1 4.126 0.0 . 1 . . . . . 95 VAL HA . 27964 1 66 . 1 1 95 95 VAL C C 13 175.890 0.0 . 1 . . . . . 95 VAL C . 27964 1 67 . 1 1 95 95 VAL CA C 13 62.013 0.0 . 1 . . . . . 95 VAL CA . 27964 1 68 . 1 1 95 95 VAL CB C 13 32.976 0.0 . 1 . . . . . 95 VAL CB . 27964 1 69 . 1 1 95 95 VAL N N 15 123.316 0.0 . 1 . . . . . 95 VAL N . 27964 1 70 . 1 1 96 96 GLU H H 1 8.524 0.0 . 1 . . . . . 96 GLU H . 27964 1 71 . 1 1 96 96 GLU HA H 1 4.266 0.0 . 1 . . . . . 96 GLU HA . 27964 1 72 . 1 1 96 96 GLU C C 13 175.922 0.0 . 1 . . . . . 96 GLU C . 27964 1 73 . 1 1 96 96 GLU CA C 13 56.292 0.0 . 1 . . . . . 96 GLU CA . 27964 1 74 . 1 1 96 96 GLU N N 15 125.586 0.0 . 1 . . . . . 96 GLU N . 27964 1 75 . 1 1 97 97 ALA H H 1 8.374 0.0 . 1 . . . . . 97 ALA H . 27964 1 76 . 1 1 97 97 ALA HA H 1 4.296 0.0 . 1 . . . . . 97 ALA HA . 27964 1 77 . 1 1 97 97 ALA C C 13 177.539 0.0 . 1 . . . . . 97 ALA C . 27964 1 78 . 1 1 97 97 ALA CA C 13 52.360 0.0 . 1 . . . . . 97 ALA CA . 27964 1 79 . 1 1 97 97 ALA CB C 13 19.486 0.0 . 1 . . . . . 97 ALA CB . 27964 1 80 . 1 1 97 97 ALA N N 15 125.771 0.0 . 1 . . . . . 97 ALA N . 27964 1 81 . 1 1 98 98 GLU H H 1 8.423 0.0 . 1 . . . . . 98 GLU H . 27964 1 82 . 1 1 98 98 GLU HA H 1 4.264 0.0 . 1 . . . . . 98 GLU HA . 27964 1 83 . 1 1 98 98 GLU C C 13 176.444 0.0 . 1 . . . . . 98 GLU C . 27964 1 84 . 1 1 98 98 GLU CA C 13 56.362 0.0 . 1 . . . . . 98 GLU CA . 27964 1 85 . 1 1 98 98 GLU CB C 13 30.336 0.0 . 1 . . . . . 98 GLU CB . 27964 1 86 . 1 1 98 98 GLU N N 15 120.824 0.0 . 1 . . . . . 98 GLU N . 27964 1 87 . 1 1 99 99 GLU H H 1 8.454 0.0 . 1 . . . . . 99 GLU H . 27964 1 88 . 1 1 99 99 GLU HA H 1 4.273 0.0 . 1 . . . . . 99 GLU HA . 27964 1 89 . 1 1 99 99 GLU C C 13 176.288 0.0 . 1 . . . . . 99 GLU C . 27964 1 90 . 1 1 99 99 GLU CA C 13 56.341 0.0 . 1 . . . . . 99 GLU CA . 27964 1 91 . 1 1 99 99 GLU CB C 13 30.356 0.0 . 1 . . . . . 99 GLU CB . 27964 1 92 . 1 1 99 99 GLU N N 15 122.295 0.0 . 1 . . . . . 99 GLU N . 27964 1 93 . 1 1 100 100 GLU H H 1 8.401 0.0 . 1 . . . . . 100 GLU H . 27964 1 94 . 1 1 100 100 GLU HA H 1 4.269 0.0 . 1 . . . . . 100 GLU HA . 27964 1 95 . 1 1 100 100 GLU C C 13 176.321 0.0 . 1 . . . . . 100 GLU C . 27964 1 96 . 1 1 100 100 GLU CA C 13 56.333 0.0 . 1 . . . . . 100 GLU CA . 27964 1 97 . 1 1 100 100 GLU CB C 13 30.396 0.0 . 1 . . . . . 100 GLU CB . 27964 1 98 . 1 1 100 100 GLU N N 15 122.653 0.0 . 1 . . . . . 100 GLU N . 27964 1 99 . 1 1 101 101 GLU H H 1 8.493 0.0 . 1 . . . . . 101 GLU H . 27964 1 100 . 1 1 101 101 GLU HA H 1 4.260 0.0 . 1 . . . . . 101 GLU HA . 27964 1 101 . 1 1 101 101 GLU C C 13 175.999 0.0 . 1 . . . . . 101 GLU C . 27964 1 102 . 1 1 101 101 GLU CA C 13 56.215 0.0 . 1 . . . . . 101 GLU CA . 27964 1 103 . 1 1 101 101 GLU CB C 13 30.046 0.0 . 1 . . . . . 101 GLU CB . 27964 1 104 . 1 1 101 101 GLU N N 15 122.994 0.0 . 1 . . . . . 101 GLU N . 27964 1 105 . 1 1 102 102 ALA H H 1 8.394 0.0 . 1 . . . . . 102 ALA H . 27964 1 106 . 1 1 102 102 ALA HA H 1 4.309 0.0 . 1 . . . . . 102 ALA HA . 27964 1 107 . 1 1 102 102 ALA C C 13 177.592 0.0 . 1 . . . . . 102 ALA C . 27964 1 108 . 1 1 102 102 ALA CA C 13 52.303 0.0 . 1 . . . . . 102 ALA CA . 27964 1 109 . 1 1 102 102 ALA CB C 13 19.496 0.0 . 1 . . . . . 102 ALA CB . 27964 1 110 . 1 1 102 102 ALA N N 15 126.166 0.0 . 1 . . . . . 102 ALA N . 27964 1 111 . 1 1 103 103 GLU H H 1 8.411 0.0 . 1 . . . . . 103 GLU H . 27964 1 112 . 1 1 103 103 GLU HA H 1 4.260 0.0 . 1 . . . . . 103 GLU HA . 27964 1 113 . 1 1 103 103 GLU C C 13 176.383 0.0 . 1 . . . . . 103 GLU C . 27964 1 114 . 1 1 103 103 GLU CA C 13 56.241 0.0 . 1 . . . . . 103 GLU CA . 27964 1 115 . 1 1 103 103 GLU CB C 13 30.356 0.0 . 1 . . . . . 103 GLU CB . 27964 1 116 . 1 1 103 103 GLU N N 15 121.019 0.0 . 1 . . . . . 103 GLU N . 27964 1 117 . 1 1 104 104 GLU H H 1 8.493 0.0 . 1 . . . . . 104 GLU H . 27964 1 118 . 1 1 104 104 GLU HA H 1 4.247 0.0 . 1 . . . . . 104 GLU HA . 27964 1 119 . 1 1 104 104 GLU C C 13 175.908 0.0 . 1 . . . . . 104 GLU C . 27964 1 120 . 1 1 104 104 GLU CA C 13 56.210 0.0 . 1 . . . . . 104 GLU CA . 27964 1 121 . 1 1 104 104 GLU CB C 13 30.206 0.0 . 1 . . . . . 104 GLU CB . 27964 1 122 . 1 1 104 104 GLU N N 15 122.886 0.0 . 1 . . . . . 104 GLU N . 27964 1 123 . 1 1 105 105 ALA H H 1 8.406 0.0 . 1 . . . . . 105 ALA H . 27964 1 124 . 1 1 105 105 ALA HA H 1 4.343 0.0 . 1 . . . . . 105 ALA HA . 27964 1 125 . 1 1 105 105 ALA C C 13 177.440 0.0 . 1 . . . . . 105 ALA C . 27964 1 126 . 1 1 105 105 ALA CA C 13 52.215 0.0 . 1 . . . . . 105 ALA CA . 27964 1 127 . 1 1 105 105 ALA CB C 13 19.286 0.0 . 1 . . . . . 105 ALA CB . 27964 1 128 . 1 1 105 105 ALA N N 15 126.510 0.0 . 1 . . . . . 105 ALA N . 27964 1 129 . 1 1 106 106 VAL H H 1 8.208 0.0 . 1 . . . . . 106 VAL H . 27964 1 130 . 1 1 106 106 VAL HA H 1 4.098 0.0 . 1 . . . . . 106 VAL HA . 27964 1 131 . 1 1 106 106 VAL C C 13 176.142 0.0 . 1 . . . . . 106 VAL C . 27964 1 132 . 1 1 106 106 VAL CA C 13 62.031 0.0 . 1 . . . . . 106 VAL CA . 27964 1 133 . 1 1 106 106 VAL CB C 13 32.986 0.0 . 1 . . . . . 106 VAL CB . 27964 1 134 . 1 1 106 106 VAL N N 15 120.528 0.0 . 1 . . . . . 106 VAL N . 27964 1 135 . 1 1 107 107 GLU H H 1 8.516 0.0 . 1 . . . . . 107 GLU H . 27964 1 136 . 1 1 107 107 GLU C C 13 176.128 0.0 . 1 . . . . . 107 GLU C . 27964 1 137 . 1 1 107 107 GLU CA C 13 56.223 0.0 . 1 . . . . . 107 GLU CA . 27964 1 138 . 1 1 107 107 GLU N N 15 125.557 0.0 . 1 . . . . . 107 GLU N . 27964 1 139 . 1 1 109 109 ASP HA H 1 4.591 0.0 . 1 . . . . . 109 ASP HA . 27964 1 140 . 1 1 109 109 ASP C C 13 175.917 0.0 . 1 . . . . . 109 ASP C . 27964 1 141 . 1 1 109 109 ASP CA C 13 54.096 0.0 . 1 . . . . . 109 ASP CA . 27964 1 142 . 1 1 109 109 ASP CB C 13 40.706 0.0 . 1 . . . . . 109 ASP CB . 27964 1 143 . 1 1 109 109 ASP N N 15 120.714 0.0 . 1 . . . . . 109 ASP N . 27964 1 144 . 1 1 110 110 LEU H H 1 8.085 0.0 . 1 . . . . . 110 LEU H . 27964 1 145 . 1 1 110 110 LEU HA H 1 4.271 0.0 . 1 . . . . . 110 LEU HA . 27964 1 146 . 1 1 110 110 LEU C C 13 177.008 0.0 . 1 . . . . . 110 LEU C . 27964 1 147 . 1 1 110 110 LEU CA C 13 55.252 0.0 . 1 . . . . . 110 LEU CA . 27964 1 148 . 1 1 110 110 LEU CB C 13 42.546 0.0 . 1 . . . . . 110 LEU CB . 27964 1 149 . 1 1 110 110 LEU N N 15 122.443 0.0 . 1 . . . . . 110 LEU N . 27964 1 150 . 1 1 111 111 ASP H H 1 8.374 0.0 . 1 . . . . . 111 ASP H . 27964 1 151 . 1 1 111 111 ASP HA H 1 4.599 0.0 . 1 . . . . . 111 ASP HA . 27964 1 152 . 1 1 111 111 ASP C C 13 175.935 0.0 . 1 . . . . . 111 ASP C . 27964 1 153 . 1 1 111 111 ASP CA C 13 54.001 0.0 . 1 . . . . . 111 ASP CA . 27964 1 154 . 1 1 111 111 ASP CB C 13 40.586 0.0 . 1 . . . . . 111 ASP CB . 27964 1 155 . 1 1 111 111 ASP N N 15 121.483 0.0 . 1 . . . . . 111 ASP N . 27964 1 156 . 1 1 112 112 LEU H H 1 8.149 0.0 . 1 . . . . . 112 LEU H . 27964 1 157 . 1 1 112 112 LEU HA H 1 4.298 0.0 . 1 . . . . . 112 LEU HA . 27964 1 158 . 1 1 112 112 LEU C C 13 177.247 0.0 . 1 . . . . . 112 LEU C . 27964 1 159 . 1 1 112 112 LEU CA C 13 55.134 0.0 . 1 . . . . . 112 LEU CA . 27964 1 160 . 1 1 112 112 LEU CB C 13 42.476 0.0 . 1 . . . . . 112 LEU CB . 27964 1 161 . 1 1 112 112 LEU N N 15 122.928 0.0 . 1 . . . . . 112 LEU N . 27964 1 162 . 1 1 113 113 ASP H H 1 8.339 0.0 . 1 . . . . . 113 ASP H . 27964 1 163 . 1 1 113 113 ASP HA H 1 4.548 0.0 . 1 . . . . . 113 ASP HA . 27964 1 164 . 1 1 113 113 ASP C C 13 176.016 0.0 . 1 . . . . . 113 ASP C . 27964 1 165 . 1 1 113 113 ASP CA C 13 54.419 0.0 . 1 . . . . . 113 ASP CA . 27964 1 166 . 1 1 113 113 ASP CB C 13 40.996 0.0 . 1 . . . . . 113 ASP CB . 27964 1 167 . 1 1 113 113 ASP N N 15 121.224 0.0 . 1 . . . . . 113 ASP N . 27964 1 168 . 1 1 114 114 GLU H H 1 8.184 0.0 . 1 . . . . . 114 GLU H . 27964 1 169 . 1 1 114 114 GLU HA H 1 4.215 0.0 . 1 . . . . . 114 GLU HA . 27964 1 170 . 1 1 114 114 GLU C C 13 175.887 0.0 . 1 . . . . . 114 GLU C . 27964 1 171 . 1 1 114 114 GLU CA C 13 56.355 0.0 . 1 . . . . . 114 GLU CA . 27964 1 172 . 1 1 114 114 GLU CB C 13 29.396 0.0 . 1 . . . . . 114 GLU CB . 27964 1 173 . 1 1 114 114 GLU N N 15 121.010 0.0 . 1 . . . . . 114 GLU N . 27964 1 174 . 1 1 115 115 PHE H H 1 8.224 0.0 . 1 . . . . . 115 PHE H . 27964 1 175 . 1 1 115 115 PHE HA H 1 4.601 0.0 . 1 . . . . . 115 PHE HA . 27964 1 176 . 1 1 115 115 PHE C C 13 175.313 0.0 . 1 . . . . . 115 PHE C . 27964 1 177 . 1 1 115 115 PHE CA C 13 57.608 0.0 . 1 . . . . . 115 PHE CA . 27964 1 178 . 1 1 115 115 PHE CB C 13 39.756 0.0 . 1 . . . . . 115 PHE CB . 27964 1 179 . 1 1 115 115 PHE N N 15 121.299 0.0 . 1 . . . . . 115 PHE N . 27964 1 180 . 1 1 116 116 GLU H H 1 8.140 0.0 . 1 . . . . . 116 GLU H . 27964 1 181 . 1 1 116 116 GLU HA H 1 4.256 0.0 . 1 . . . . . 116 GLU HA . 27964 1 182 . 1 1 116 116 GLU C C 13 175.506 0.0 . 1 . . . . . 116 GLU C . 27964 1 183 . 1 1 116 116 GLU CA C 13 55.955 0.0 . 1 . . . . . 116 GLU CA . 27964 1 184 . 1 1 116 116 GLU CB C 13 30.526 0.0 . 1 . . . . . 116 GLU CB . 27964 1 185 . 1 1 116 116 GLU N N 15 123.257 0.0 . 1 . . . . . 116 GLU N . 27964 1 186 . 1 1 117 117 GLU H H 1 8.387 0.0 . 1 . . . . . 117 GLU H . 27964 1 187 . 1 1 117 117 GLU HA H 1 4.271 0.0 . 1 . . . . . 117 GLU HA . 27964 1 188 . 1 1 117 117 GLU C C 13 175.912 0.0 . 1 . . . . . 117 GLU C . 27964 1 189 . 1 1 117 117 GLU CA C 13 56.167 0.0 . 1 . . . . . 117 GLU CA . 27964 1 190 . 1 1 117 117 GLU CB C 13 30.096 0.0 . 1 . . . . . 117 GLU CB . 27964 1 191 . 1 1 117 117 GLU N N 15 123.247 0.0 . 1 . . . . . 117 GLU N . 27964 1 192 . 1 1 118 118 ILE HA H 1 4.173 0.0 . 1 . . . . . 118 ILE HA . 27964 1 193 . 1 1 118 118 ILE C C 13 175.667 0.0 . 1 . . . . . 118 ILE C . 27964 1 194 . 1 1 118 118 ILE CA C 13 60.731 0.0 . 1 . . . . . 118 ILE CA . 27964 1 195 . 1 1 118 118 ILE CB C 13 39.306 0.0 . 1 . . . . . 118 ILE CB . 27964 1 196 . 1 1 118 118 ILE N N 15 123.166 0.0 . 1 . . . . . 118 ILE N . 27964 1 197 . 1 1 119 119 ASP H H 1 8.513 0.0 . 1 . . . . . 119 ASP H . 27964 1 198 . 1 1 119 119 ASP HA H 1 4.626 0.0 . 1 . . . . . 119 ASP HA . 27964 1 199 . 1 1 119 119 ASP C C 13 175.950 0.0 . 1 . . . . . 119 ASP C . 27964 1 200 . 1 1 119 119 ASP CA C 13 53.952 0.0 . 1 . . . . . 119 ASP CA . 27964 1 201 . 1 1 119 119 ASP CB C 13 40.906 0.0 . 1 . . . . . 119 ASP CB . 27964 1 202 . 1 1 119 119 ASP N N 15 125.535 0.0 . 1 . . . . . 119 ASP N . 27964 1 203 . 1 1 120 120 GLU H H 1 8.467 0.0 . 1 . . . . . 120 GLU H . 27964 1 204 . 1 1 120 120 GLU HA H 1 4.270 0.0 . 1 . . . . . 120 GLU HA . 27964 1 205 . 1 1 120 120 GLU C C 13 176.144 0.0 . 1 . . . . . 120 GLU C . 27964 1 206 . 1 1 120 120 GLU CA C 13 56.436 0.0 . 1 . . . . . 120 GLU CA . 27964 1 207 . 1 1 120 120 GLU CB C 13 30.266 0.0 . 1 . . . . . 120 GLU CB . 27964 1 208 . 1 1 120 120 GLU N N 15 122.492 0.0 . 1 . . . . . 120 GLU N . 27964 1 209 . 1 1 121 121 ASP H H 1 8.423 0.0 . 1 . . . . . 121 ASP H . 27964 1 210 . 1 1 121 121 ASP HA H 1 4.570 0.0 . 1 . . . . . 121 ASP HA . 27964 1 211 . 1 1 121 121 ASP C C 13 175.884 0.0 . 1 . . . . . 121 ASP C . 27964 1 212 . 1 1 121 121 ASP CA C 13 54.496 0.0 . 1 . . . . . 121 ASP CA . 27964 1 213 . 1 1 121 121 ASP CB C 13 41.086 0.0 . 1 . . . . . 121 ASP CB . 27964 1 214 . 1 1 121 121 ASP N N 15 121.510 0.0 . 1 . . . . . 121 ASP N . 27964 1 215 . 1 1 122 122 ASP H H 1 8.292 0.0 . 1 . . . . . 122 ASP H . 27964 1 216 . 1 1 122 122 ASP C C 13 175.927 0.0 . 1 . . . . . 122 ASP C . 27964 1 217 . 1 1 122 122 ASP CA C 13 54.096 0.0 . 1 . . . . . 122 ASP CA . 27964 1 218 . 1 1 122 122 ASP N N 15 120.692 0.0 . 1 . . . . . 122 ASP N . 27964 1 219 . 1 1 123 123 LEU H H 1 8.149 0.0 . 1 . . . . . 123 LEU H . 27964 1 220 . 1 1 123 123 LEU C C 13 177.002 0.0 . 1 . . . . . 123 LEU C . 27964 1 221 . 1 1 123 123 LEU CA C 13 55.256 0.0 . 1 . . . . . 123 LEU CA . 27964 1 222 . 1 1 123 123 LEU CB C 13 43.506 0.0 . 1 . . . . . 123 LEU CB . 27964 1 223 . 1 1 123 123 LEU N N 15 122.440 0.0 . 1 . . . . . 123 LEU N . 27964 1 224 . 1 1 124 124 ASP HA H 1 4.599 0.0 . 1 . . . . . 124 ASP HA . 27964 1 225 . 1 1 124 124 ASP C C 13 175.937 0.0 . 1 . . . . . 124 ASP C . 27964 1 226 . 1 1 124 124 ASP CA C 13 54.046 0.0 . 1 . . . . . 124 ASP CA . 27964 1 227 . 1 1 124 124 ASP CB C 13 40.596 0.0 . 1 . . . . . 124 ASP CB . 27964 1 228 . 1 1 124 124 ASP N N 15 121.462 0.0 . 1 . . . . . 124 ASP N . 27964 1 229 . 1 1 125 125 LEU H H 1 8.149 0.0 . 1 . . . . . 125 LEU H . 27964 1 230 . 1 1 125 125 LEU HA H 1 4.298 0.0 . 1 . . . . . 125 LEU HA . 27964 1 231 . 1 1 125 125 LEU C C 13 177.247 0.0 . 1 . . . . . 125 LEU C . 27964 1 232 . 1 1 125 125 LEU CA C 13 55.134 0.0 . 1 . . . . . 125 LEU CA . 27964 1 233 . 1 1 125 125 LEU CB C 13 42.476 0.0 . 1 . . . . . 125 LEU CB . 27964 1 234 . 1 1 125 125 LEU N N 15 122.928 0.0 . 1 . . . . . 125 LEU N . 27964 1 235 . 1 1 126 126 ASP H H 1 8.332 0.0 . 1 . . . . . 126 ASP H . 27964 1 236 . 1 1 126 126 ASP HA H 1 4.569 0.0 . 1 . . . . . 126 ASP HA . 27964 1 237 . 1 1 126 126 ASP C C 13 176.016 0.0 . 1 . . . . . 126 ASP C . 27964 1 238 . 1 1 126 126 ASP CA C 13 54.419 0.0 . 1 . . . . . 126 ASP CA . 27964 1 239 . 1 1 126 126 ASP CB C 13 40.956 0.0 . 1 . . . . . 126 ASP CB . 27964 1 240 . 1 1 126 126 ASP N N 15 121.224 0.0 . 1 . . . . . 126 ASP N . 27964 1 241 . 1 1 127 127 GLU H H 1 8.233 0.0 . 1 . . . . . 127 GLU H . 27964 1 242 . 1 1 127 127 GLU HA H 1 4.293 0.0 . 1 . . . . . 127 GLU HA . 27964 1 243 . 1 1 127 127 GLU C C 13 176.170 0.0 . 1 . . . . . 127 GLU C . 27964 1 244 . 1 1 127 127 GLU CA C 13 56.253 0.0 . 1 . . . . . 127 GLU CA . 27964 1 245 . 1 1 127 127 GLU CB C 13 30.146 0.0 . 1 . . . . . 127 GLU CB . 27964 1 246 . 1 1 127 127 GLU N N 15 121.325 0.0 . 1 . . . . . 127 GLU N . 27964 1 247 . 1 1 128 128 VAL H H 1 8.191 0.0 . 1 . . . . . 128 VAL H . 27964 1 248 . 1 1 128 128 VAL HA H 1 4.081 0.0 . 1 . . . . . 128 VAL HA . 27964 1 249 . 1 1 128 128 VAL C C 13 176.045 0.0 . 1 . . . . . 128 VAL C . 27964 1 250 . 1 1 128 128 VAL CA C 13 62.205 0.0 . 1 . . . . . 128 VAL CA . 27964 1 251 . 1 1 128 128 VAL CB C 13 32.986 0.0 . 1 . . . . . 128 VAL CB . 27964 1 252 . 1 1 128 128 VAL N N 15 122.045 0.0 . 1 . . . . . 128 VAL N . 27964 1 253 . 1 1 129 129 GLU H H 1 8.498 0.0 . 1 . . . . . 129 GLU H . 27964 1 254 . 1 1 129 129 GLU HA H 1 4.297 0.0 . 1 . . . . . 129 GLU HA . 27964 1 255 . 1 1 129 129 GLU C C 13 176.141 0.0 . 1 . . . . . 129 GLU C . 27964 1 256 . 1 1 129 129 GLU CA C 13 56.221 0.0 . 1 . . . . . 129 GLU CA . 27964 1 257 . 1 1 129 129 GLU CB C 13 30.276 0.0 . 1 . . . . . 129 GLU CB . 27964 1 258 . 1 1 129 129 GLU N N 15 125.554 0.0 . 1 . . . . . 129 GLU N . 27964 1 259 . 1 1 130 130 GLU H H 1 8.465 0.0 . 1 . . . . . 130 GLU H . 27964 1 260 . 1 1 130 130 GLU HA H 1 4.264 0.0 . 1 . . . . . 130 GLU HA . 27964 1 261 . 1 1 130 130 GLU C C 13 176.077 0.0 . 1 . . . . . 130 GLU C . 27964 1 262 . 1 1 130 130 GLU CA C 13 56.336 0.0 . 1 . . . . . 130 GLU CA . 27964 1 263 . 1 1 130 130 GLU CB C 13 30.426 0.0 . 1 . . . . . 130 GLU CB . 27964 1 264 . 1 1 130 130 GLU N N 15 123.074 0.0 . 1 . . . . . 130 GLU N . 27964 1 265 . 1 1 131 131 GLU H H 1 8.465 0.0 . 1 . . . . . 131 GLU H . 27964 1 266 . 1 1 131 131 GLU HA H 1 4.291 0.0 . 1 . . . . . 131 GLU HA . 27964 1 267 . 1 1 131 131 GLU C C 13 176.029 0.0 . 1 . . . . . 131 GLU C . 27964 1 268 . 1 1 131 131 GLU CA C 13 56.233 0.0 . 1 . . . . . 131 GLU CA . 27964 1 269 . 1 1 131 131 GLU CB C 13 30.016 0.0 . 1 . . . . . 131 GLU CB . 27964 1 270 . 1 1 131 131 GLU N N 15 123.025 0.0 . 1 . . . . . 131 GLU N . 27964 1 271 . 1 1 132 132 LEU H H 1 8.320 0.0 . 1 . . . . . 132 LEU H . 27964 1 272 . 1 1 132 132 LEU HA H 1 4.328 0.0 . 1 . . . . . 132 LEU HA . 27964 1 273 . 1 1 132 132 LEU C C 13 176.819 0.0 . 1 . . . . . 132 LEU C . 27964 1 274 . 1 1 132 132 LEU CA C 13 55.017 0.0 . 1 . . . . . 132 LEU CA . 27964 1 275 . 1 1 132 132 LEU CB C 13 42.816 0.0 . 1 . . . . . 132 LEU CB . 27964 1 276 . 1 1 132 132 LEU N N 15 124.352 0.0 . 1 . . . . . 132 LEU N . 27964 1 277 . 1 1 133 133 ASP H H 1 8.447 0.0 . 1 . . . . . 133 ASP H . 27964 1 278 . 1 1 133 133 ASP HA H 1 4.609 0.0 . 1 . . . . . 133 ASP HA . 27964 1 279 . 1 1 133 133 ASP C C 13 175.882 0.0 . 1 . . . . . 133 ASP C . 27964 1 280 . 1 1 133 133 ASP CA C 13 53.916 0.0 . 1 . . . . . 133 ASP CA . 27964 1 281 . 1 1 133 133 ASP CB C 13 40.656 0.0 . 1 . . . . . 133 ASP CB . 27964 1 282 . 1 1 133 133 ASP N N 15 121.943 0.0 . 1 . . . . . 133 ASP N . 27964 1 283 . 1 1 134 134 LEU H H 1 8.213 0.0 . 1 . . . . . 134 LEU H . 27964 1 284 . 1 1 134 134 LEU HA H 1 4.307 0.0 . 1 . . . . . 134 LEU HA . 27964 1 285 . 1 1 134 134 LEU C C 13 177.462 0.0 . 1 . . . . . 134 LEU C . 27964 1 286 . 1 1 134 134 LEU CA C 13 55.168 0.0 . 1 . . . . . 134 LEU CA . 27964 1 287 . 1 1 134 134 LEU CB C 13 42.466 0.0 . 1 . . . . . 134 LEU CB . 27964 1 288 . 1 1 134 134 LEU N N 15 123.354 0.0 . 1 . . . . . 134 LEU N . 27964 1 289 . 1 1 135 135 GLU H H 1 8.384 0.0 . 1 . . . . . 135 GLU H . 27964 1 290 . 1 1 135 135 GLU HA H 1 4.259 0.0 . 1 . . . . . 135 GLU HA . 27964 1 291 . 1 1 135 135 GLU C C 13 175.995 0.0 . 1 . . . . . 135 GLU C . 27964 1 292 . 1 1 135 135 GLU CA C 13 56.208 0.0 . 1 . . . . . 135 GLU CA . 27964 1 293 . 1 1 135 135 GLU CB C 13 29.976 0.0 . 1 . . . . . 135 GLU CB . 27964 1 294 . 1 1 135 135 GLU N N 15 121.672 0.0 . 1 . . . . . 135 GLU N . 27964 1 295 . 1 1 136 136 ALA H H 1 8.214 0.0 . 1 . . . . . 136 ALA H . 27964 1 296 . 1 1 136 136 ALA HA H 1 4.273 0.0 . 1 . . . . . 136 ALA HA . 27964 1 297 . 1 1 136 136 ALA C C 13 177.347 0.0 . 1 . . . . . 136 ALA C . 27964 1 298 . 1 1 136 136 ALA CA C 13 52.392 0.0 . 1 . . . . . 136 ALA CA . 27964 1 299 . 1 1 136 136 ALA CB C 13 19.566 0.0 . 1 . . . . . 136 ALA CB . 27964 1 300 . 1 1 136 136 ALA N N 15 125.427 0.0 . 1 . . . . . 136 ALA N . 27964 1 301 . 1 1 137 137 ASP H H 1 8.296 0.0 . 1 . . . . . 137 ASP H . 27964 1 302 . 1 1 137 137 ASP HA H 1 4.543 0.0 . 1 . . . . . 137 ASP HA . 27964 1 303 . 1 1 137 137 ASP C C 13 175.672 0.0 . 1 . . . . . 137 ASP C . 27964 1 304 . 1 1 137 137 ASP CA C 13 54.121 0.0 . 1 . . . . . 137 ASP CA . 27964 1 305 . 1 1 137 137 ASP CB C 13 41.116 0.0 . 1 . . . . . 137 ASP CB . 27964 1 306 . 1 1 137 137 ASP N N 15 120.114 0.0 . 1 . . . . . 137 ASP N . 27964 1 307 . 1 1 138 138 ASP H H 1 8.181 0.0 . 1 . . . . . 138 ASP H . 27964 1 308 . 1 1 138 138 ASP HA H 1 4.559 0.0 . 1 . . . . . 138 ASP HA . 27964 1 309 . 1 1 138 138 ASP C C 13 175.651 0.0 . 1 . . . . . 138 ASP C . 27964 1 310 . 1 1 138 138 ASP CA C 13 53.917 0.0 . 1 . . . . . 138 ASP CA . 27964 1 311 . 1 1 138 138 ASP CB C 13 40.916 0.0 . 1 . . . . . 138 ASP CB . 27964 1 312 . 1 1 138 138 ASP N N 15 120.526 0.0 . 1 . . . . . 138 ASP N . 27964 1 313 . 1 1 139 139 PHE H H 1 8.126 0.0 . 1 . . . . . 139 PHE H . 27964 1 314 . 1 1 139 139 PHE HA H 1 4.592 0.0 . 1 . . . . . 139 PHE HA . 27964 1 315 . 1 1 139 139 PHE C C 13 175.278 0.0 . 1 . . . . . 139 PHE C . 27964 1 316 . 1 1 139 139 PHE CA C 13 57.568 0.0 . 1 . . . . . 139 PHE CA . 27964 1 317 . 1 1 139 139 PHE CB C 13 39.736 0.0 . 1 . . . . . 139 PHE CB . 27964 1 318 . 1 1 139 139 PHE N N 15 120.682 0.0 . 1 . . . . . 139 PHE N . 27964 1 319 . 1 1 140 140 ASP H H 1 8.305 0.0 . 1 . . . . . 140 ASP H . 27964 1 320 . 1 1 140 140 ASP HA H 1 4.584 0.0 . 1 . . . . . 140 ASP HA . 27964 1 321 . 1 1 140 140 ASP C C 13 175.682 0.0 . 1 . . . . . 140 ASP C . 27964 1 322 . 1 1 140 140 ASP CA C 13 53.984 0.0 . 1 . . . . . 140 ASP CA . 27964 1 323 . 1 1 140 140 ASP CB C 13 41.096 0.0 . 1 . . . . . 140 ASP CB . 27964 1 324 . 1 1 140 140 ASP N N 15 122.680 0.0 . 1 . . . . . 140 ASP N . 27964 1 325 . 1 1 141 141 GLU H H 1 8.277 0.0 . 1 . . . . . 141 GLU H . 27964 1 326 . 1 1 141 141 GLU HA H 1 4.235 0.0 . 1 . . . . . 141 GLU HA . 27964 1 327 . 1 1 141 141 GLU C C 13 176.308 0.0 . 1 . . . . . 141 GLU C . 27964 1 328 . 1 1 141 141 GLU CA C 13 56.446 0.0 . 1 . . . . . 141 GLU CA . 27964 1 329 . 1 1 141 141 GLU CB C 13 30.016 0.0 . 1 . . . . . 141 GLU CB . 27964 1 330 . 1 1 141 141 GLU N N 15 121.867 0.0 . 1 . . . . . 141 GLU N . 27964 1 331 . 1 1 142 142 GLU H H 1 8.408 0.0 . 1 . . . . . 142 GLU H . 27964 1 332 . 1 1 142 142 GLU HA H 1 4.241 0.0 . 1 . . . . . 142 GLU HA . 27964 1 333 . 1 1 142 142 GLU C C 13 175.916 0.0 . 1 . . . . . 142 GLU C . 27964 1 334 . 1 1 142 142 GLU CA C 13 56.415 0.0 . 1 . . . . . 142 GLU CA . 27964 1 335 . 1 1 142 142 GLU CB C 13 30.086 0.0 . 1 . . . . . 142 GLU CB . 27964 1 336 . 1 1 142 142 GLU N N 15 122.021 0.0 . 1 . . . . . 142 GLU N . 27964 1 337 . 1 1 143 143 ASP H H 1 8.429 0.0 . 1 . . . . . 143 ASP H . 27964 1 338 . 1 1 143 143 ASP HA H 1 4.605 0.0 . 1 . . . . . 143 ASP HA . 27964 1 339 . 1 1 143 143 ASP C C 13 175.798 0.0 . 1 . . . . . 143 ASP C . 27964 1 340 . 1 1 143 143 ASP CA C 13 54.071 0.0 . 1 . . . . . 143 ASP CA . 27964 1 341 . 1 1 143 143 ASP CB C 13 40.746 0.0 . 1 . . . . . 143 ASP CB . 27964 1 342 . 1 1 143 143 ASP N N 15 121.975 0.0 . 1 . . . . . 143 ASP N . 27964 1 343 . 1 1 144 144 LEU H H 1 8.226 0.0 . 1 . . . . . 144 LEU H . 27964 1 344 . 1 1 144 144 LEU HA H 1 4.329 0.0 . 1 . . . . . 144 LEU HA . 27964 1 345 . 1 1 144 144 LEU C C 13 177.060 0.0 . 1 . . . . . 144 LEU C . 27964 1 346 . 1 1 144 144 LEU CA C 13 54.992 0.0 . 1 . . . . . 144 LEU CA . 27964 1 347 . 1 1 144 144 LEU CB C 13 42.576 0.0 . 1 . . . . . 144 LEU CB . 27964 1 348 . 1 1 144 144 LEU N N 15 123.225 0.0 . 1 . . . . . 144 LEU N . 27964 1 349 . 1 1 145 145 ASP H H 1 8.385 0.0 . 1 . . . . . 145 ASP H . 27964 1 350 . 1 1 145 145 ASP HA H 1 4.603 0.0 . 1 . . . . . 145 ASP HA . 27964 1 351 . 1 1 145 145 ASP C C 13 175.945 0.0 . 1 . . . . . 145 ASP C . 27964 1 352 . 1 1 145 145 ASP CA C 13 54.196 0.0 . 1 . . . . . 145 ASP CA . 27964 1 353 . 1 1 145 145 ASP CB C 13 40.946 0.0 . 1 . . . . . 145 ASP CB . 27964 1 354 . 1 1 145 145 ASP N N 15 121.718 0.0 . 1 . . . . . 145 ASP N . 27964 1 355 . 1 1 146 146 GLU H H 1 8.335 0.0 . 1 . . . . . 146 GLU H . 27964 1 356 . 1 1 146 146 GLU HA H 1 4.283 0.0 . 1 . . . . . 146 GLU HA . 27964 1 357 . 1 1 146 146 GLU C C 13 175.976 0.0 . 1 . . . . . 146 GLU C . 27964 1 358 . 1 1 146 146 GLU CA C 13 56.208 0.0 . 1 . . . . . 146 GLU CA . 27964 1 359 . 1 1 146 146 GLU CB C 13 30.346 0.0 . 1 . . . . . 146 GLU CB . 27964 1 360 . 1 1 146 146 GLU N N 15 121.678 0.0 . 1 . . . . . 146 GLU N . 27964 1 361 . 1 1 147 147 ASP H H 1 8.429 0.0 . 1 . . . . . 147 ASP H . 27964 1 362 . 1 1 147 147 ASP HA H 1 4.610 0.0 . 1 . . . . . 147 ASP HA . 27964 1 363 . 1 1 147 147 ASP C C 13 175.809 0.0 . 1 . . . . . 147 ASP C . 27964 1 364 . 1 1 147 147 ASP CA C 13 54.196 0.0 . 1 . . . . . 147 ASP CA . 27964 1 365 . 1 1 147 147 ASP CB C 13 41.016 0.0 . 1 . . . . . 147 ASP CB . 27964 1 366 . 1 1 147 147 ASP N N 15 121.831 0.0 . 1 . . . . . 147 ASP N . 27964 1 367 . 1 1 148 148 ASP H H 1 8.358 0.0 . 1 . . . . . 148 ASP H . 27964 1 368 . 1 1 148 148 ASP HA H 1 4.608 0.0 . 1 . . . . . 148 ASP HA . 27964 1 369 . 1 1 148 148 ASP C C 13 175.968 0.0 . 1 . . . . . 148 ASP C . 27964 1 370 . 1 1 148 148 ASP CA C 13 54.101 0.0 . 1 . . . . . 148 ASP CA . 27964 1 371 . 1 1 148 148 ASP CB C 13 40.976 0.0 . 1 . . . . . 148 ASP CB . 27964 1 372 . 1 1 148 148 ASP N N 15 121.406 0.0 . 1 . . . . . 148 ASP N . 27964 1 373 . 1 1 149 149 ASP H H 1 8.350 0.0 . 1 . . . . . 149 ASP H . 27964 1 374 . 1 1 149 149 ASP HA H 1 4.566 0.0 . 1 . . . . . 149 ASP HA . 27964 1 375 . 1 1 149 149 ASP C C 13 175.895 0.0 . 1 . . . . . 149 ASP C . 27964 1 376 . 1 1 149 149 ASP CA C 13 54.496 0.0 . 1 . . . . . 149 ASP CA . 27964 1 377 . 1 1 149 149 ASP CB C 13 40.936 0.0 . 1 . . . . . 149 ASP CB . 27964 1 378 . 1 1 149 149 ASP N N 15 121.502 0.0 . 1 . . . . . 149 ASP N . 27964 1 379 . 1 1 150 150 ASP H H 1 8.330 0.0 . 1 . . . . . 150 ASP H . 27964 1 380 . 1 1 150 150 ASP HA H 1 4.591 0.0 . 1 . . . . . 150 ASP HA . 27964 1 381 . 1 1 150 150 ASP C C 13 175.927 0.0 . 1 . . . . . 150 ASP C . 27964 1 382 . 1 1 150 150 ASP CA C 13 54.114 0.0 . 1 . . . . . 150 ASP CA . 27964 1 383 . 1 1 150 150 ASP CB C 13 40.706 0.0 . 1 . . . . . 150 ASP CB . 27964 1 384 . 1 1 150 150 ASP N N 15 120.676 0.0 . 1 . . . . . 150 ASP N . 27964 1 385 . 1 1 151 151 LEU H H 1 8.085 0.0 . 1 . . . . . 151 LEU H . 27964 1 386 . 1 1 151 151 LEU HA H 1 4.287 0.0 . 1 . . . . . 151 LEU HA . 27964 1 387 . 1 1 151 151 LEU C C 13 177.257 0.0 . 1 . . . . . 151 LEU C . 27964 1 388 . 1 1 151 151 LEU CA C 13 55.223 0.0 . 1 . . . . . 151 LEU CA . 27964 1 389 . 1 1 151 151 LEU CB C 13 42.506 0.0 . 1 . . . . . 151 LEU CB . 27964 1 390 . 1 1 151 151 LEU N N 15 122.474 0.0 . 1 . . . . . 151 LEU N . 27964 1 391 . 1 1 152 152 GLU H H 1 8.359 0.0 . 1 . . . . . 152 GLU H . 27964 1 392 . 1 1 152 152 GLU HA H 1 4.300 0.0 . 1 . . . . . 152 GLU HA . 27964 1 393 . 1 1 152 152 GLU C C 13 176.000 0.0 . 1 . . . . . 152 GLU C . 27964 1 394 . 1 1 152 152 GLU CA C 13 56.169 0.0 . 1 . . . . . 152 GLU CA . 27964 1 395 . 1 1 152 152 GLU CB C 13 30.076 0.0 . 1 . . . . . 152 GLU CB . 27964 1 396 . 1 1 152 152 GLU N N 15 122.511 0.0 . 1 . . . . . 152 GLU N . 27964 1 397 . 1 1 153 153 ILE H H 1 8.187 0.0 . 1 . . . . . 153 ILE H . 27964 1 398 . 1 1 153 153 ILE HA H 1 4.147 0.0 . 1 . . . . . 153 ILE HA . 27964 1 399 . 1 1 153 153 ILE C C 13 176.067 0.0 . 1 . . . . . 153 ILE C . 27964 1 400 . 1 1 153 153 ILE CA C 13 60.807 0.0 . 1 . . . . . 153 ILE CA . 27964 1 401 . 1 1 153 153 ILE CB C 13 38.956 0.0 . 1 . . . . . 153 ILE CB . 27964 1 402 . 1 1 153 153 ILE N N 15 122.836 0.0 . 1 . . . . . 153 ILE N . 27964 1 403 . 1 1 154 154 GLU H H 1 8.493 0.0 . 1 . . . . . 154 GLU H . 27964 1 404 . 1 1 154 154 GLU HA H 1 4.308 0.0 . 1 . . . . . 154 GLU HA . 27964 1 405 . 1 1 154 154 GLU C C 13 176.029 0.0 . 1 . . . . . 154 GLU C . 27964 1 406 . 1 1 154 154 GLU CA C 13 56.153 0.0 . 1 . . . . . 154 GLU CA . 27964 1 407 . 1 1 154 154 GLU CB C 13 30.216 0.0 . 1 . . . . . 154 GLU CB . 27964 1 408 . 1 1 154 154 GLU N N 15 125.995 0.0 . 1 . . . . . 154 GLU N . 27964 1 409 . 1 1 155 155 GLU H H 1 8.455 0.0 . 1 . . . . . 155 GLU H . 27964 1 410 . 1 1 155 155 GLU HA H 1 4.283 0.0 . 1 . . . . . 155 GLU HA . 27964 1 411 . 1 1 155 155 GLU C C 13 175.838 0.0 . 1 . . . . . 155 GLU C . 27964 1 412 . 1 1 155 155 GLU CA C 13 56.237 0.0 . 1 . . . . . 155 GLU CA . 27964 1 413 . 1 1 155 155 GLU CB C 13 30.726 0.0 . 1 . . . . . 155 GLU CB . 27964 1 414 . 1 1 155 155 GLU N N 15 122.944 0.0 . 1 . . . . . 155 GLU N . 27964 1 415 . 1 1 156 156 ASP H H 1 8.469 0.0 . 1 . . . . . 156 ASP H . 27964 1 416 . 1 1 156 156 ASP HA H 1 4.597 0.0 . 1 . . . . . 156 ASP HA . 27964 1 417 . 1 1 156 156 ASP C C 13 175.665 0.0 . 1 . . . . . 156 ASP C . 27964 1 418 . 1 1 156 156 ASP CA C 13 54.184 0.0 . 1 . . . . . 156 ASP CA . 27964 1 419 . 1 1 156 156 ASP CB C 13 40.926 0.0 . 1 . . . . . 156 ASP CB . 27964 1 420 . 1 1 156 156 ASP N N 15 122.394 0.0 . 1 . . . . . 156 ASP N . 27964 1 421 . 1 1 157 157 ILE H H 1 8.184 0.0 . 1 . . . . . 157 ILE H . 27964 1 422 . 1 1 157 157 ILE HA H 1 4.136 0.0 . 1 . . . . . 157 ILE HA . 27964 1 423 . 1 1 157 157 ILE C C 13 176.066 0.0 . 1 . . . . . 157 ILE C . 27964 1 424 . 1 1 157 157 ILE CA C 13 60.942 0.0 . 1 . . . . . 157 ILE CA . 27964 1 425 . 1 1 157 157 ILE CB C 13 38.786 0.0 . 1 . . . . . 157 ILE CB . 27964 1 426 . 1 1 157 157 ILE N N 15 122.099 0.0 . 1 . . . . . 157 ILE N . 27964 1 427 . 1 1 158 158 ILE H H 1 8.288 0.0 . 1 . . . . . 158 ILE H . 27964 1 428 . 1 1 158 158 ILE HA H 1 4.171 0.0 . 1 . . . . . 158 ILE HA . 27964 1 429 . 1 1 158 158 ILE C C 13 175.637 0.0 . 1 . . . . . 158 ILE C . 27964 1 430 . 1 1 158 158 ILE CA C 13 60.675 0.0 . 1 . . . . . 158 ILE CA . 27964 1 431 . 1 1 158 158 ILE CB C 13 38.896 0.0 . 1 . . . . . 158 ILE CB . 27964 1 432 . 1 1 158 158 ILE N N 15 126.307 0.0 . 1 . . . . . 158 ILE N . 27964 1 433 . 1 1 159 159 ASP H H 1 8.466 0.0 . 1 . . . . . 159 ASP H . 27964 1 434 . 1 1 159 159 ASP HA H 1 4.611 0.0 . 1 . . . . . 159 ASP HA . 27964 1 435 . 1 1 159 159 ASP C C 13 175.837 0.0 . 1 . . . . . 159 ASP C . 27964 1 436 . 1 1 159 159 ASP CA C 13 54.021 0.0 . 1 . . . . . 159 ASP CA . 27964 1 437 . 1 1 159 159 ASP CB C 13 41.006 0.0 . 1 . . . . . 159 ASP CB . 27964 1 438 . 1 1 159 159 ASP N N 15 125.684 0.0 . 1 . . . . . 159 ASP N . 27964 1 439 . 1 1 160 160 GLU H H 1 8.412 0.0 . 1 . . . . . 160 GLU H . 27964 1 440 . 1 1 160 160 GLU HA H 1 4.276 0.0 . 1 . . . . . 160 GLU HA . 27964 1 441 . 1 1 160 160 GLU C C 13 175.962 0.0 . 1 . . . . . 160 GLU C . 27964 1 442 . 1 1 160 160 GLU CA C 13 56.296 0.0 . 1 . . . . . 160 GLU CA . 27964 1 443 . 1 1 160 160 GLU N N 15 122.260 0.0 . 1 . . . . . 160 GLU N . 27964 1 444 . 1 1 161 161 ASP H H 1 8.429 0.0 . 1 . . . . . 161 ASP H . 27964 1 445 . 1 1 161 161 ASP HA H 1 4.608 0.0 . 1 . . . . . 161 ASP HA . 27964 1 446 . 1 1 161 161 ASP C C 13 175.801 0.0 . 1 . . . . . 161 ASP C . 27964 1 447 . 1 1 161 161 ASP CA C 13 54.183 0.0 . 1 . . . . . 161 ASP CA . 27964 1 448 . 1 1 161 161 ASP CB C 13 41.016 0.0 . 1 . . . . . 161 ASP CB . 27964 1 449 . 1 1 161 161 ASP N N 15 121.816 0.0 . 1 . . . . . 161 ASP N . 27964 1 450 . 1 1 162 162 ASP H H 1 8.326 0.0 . 1 . . . . . 162 ASP H . 27964 1 451 . 1 1 162 162 ASP HA H 1 4.563 0.0 . 1 . . . . . 162 ASP HA . 27964 1 452 . 1 1 162 162 ASP C C 13 176.138 0.0 . 1 . . . . . 162 ASP C . 27964 1 453 . 1 1 162 162 ASP CA C 13 54.163 0.0 . 1 . . . . . 162 ASP CA . 27964 1 454 . 1 1 162 162 ASP CB C 13 40.956 0.0 . 1 . . . . . 162 ASP CB . 27964 1 455 . 1 1 162 162 ASP N N 15 121.483 0.0 . 1 . . . . . 162 ASP N . 27964 1 456 . 1 1 163 163 GLU H H 1 8.287 0.0 . 1 . . . . . 163 GLU H . 27964 1 457 . 1 1 163 163 GLU HA H 1 4.204 0.0 . 1 . . . . . 163 GLU HA . 27964 1 458 . 1 1 163 163 GLU C C 13 175.726 0.0 . 1 . . . . . 163 GLU C . 27964 1 459 . 1 1 163 163 GLU CA C 13 56.332 0.0 . 1 . . . . . 163 GLU CA . 27964 1 460 . 1 1 163 163 GLU CB C 13 29.956 0.0 . 1 . . . . . 163 GLU CB . 27964 1 461 . 1 1 163 163 GLU N N 15 121.204 0.0 . 1 . . . . . 163 GLU N . 27964 1 462 . 1 1 164 164 ASP H H 1 8.288 0.0 . 1 . . . . . 164 ASP H . 27964 1 463 . 1 1 164 164 ASP HA H 1 4.587 0.0 . 1 . . . . . 164 ASP HA . 27964 1 464 . 1 1 164 164 ASP C C 13 175.542 0.0 . 1 . . . . . 164 ASP C . 27964 1 465 . 1 1 164 164 ASP CA C 13 53.845 0.0 . 1 . . . . . 164 ASP CA . 27964 1 466 . 1 1 164 164 ASP CB C 13 40.896 0.0 . 1 . . . . . 164 ASP CB . 27964 1 467 . 1 1 164 164 ASP N N 15 121.354 0.0 . 1 . . . . . 164 ASP N . 27964 1 468 . 1 1 165 165 TYR H H 1 8.099 0.0 . 1 . . . . . 165 TYR H . 27964 1 469 . 1 1 165 165 TYR HA H 1 4.531 0.0 . 1 . . . . . 165 TYR HA . 27964 1 470 . 1 1 165 165 TYR C C 13 175.401 0.0 . 1 . . . . . 165 TYR C . 27964 1 471 . 1 1 165 165 TYR CA C 13 57.753 0.0 . 1 . . . . . 165 TYR CA . 27964 1 472 . 1 1 165 165 TYR CB C 13 39.006 0.0 . 1 . . . . . 165 TYR CB . 27964 1 473 . 1 1 165 165 TYR N N 15 121.324 0.0 . 1 . . . . . 165 TYR N . 27964 1 474 . 1 1 166 166 ASP H H 1 8.296 0.0 . 1 . . . . . 166 ASP H . 27964 1 475 . 1 1 166 166 ASP HA H 1 4.590 0.0 . 1 . . . . . 166 ASP HA . 27964 1 476 . 1 1 166 166 ASP C C 13 175.462 0.0 . 1 . . . . . 166 ASP C . 27964 1 477 . 1 1 166 166 ASP CA C 13 53.960 0.0 . 1 . . . . . 166 ASP CA . 27964 1 478 . 1 1 166 166 ASP CB C 13 41.086 0.0 . 1 . . . . . 166 ASP CB . 27964 1 479 . 1 1 166 166 ASP N N 15 122.706 0.0 . 1 . . . . . 166 ASP N . 27964 1 480 . 1 1 167 167 ASP H H 1 8.234 0.0 . 1 . . . . . 167 ASP H . 27964 1 481 . 1 1 167 167 ASP HA H 1 4.558 0.0 . 1 . . . . . 167 ASP HA . 27964 1 482 . 1 1 167 167 ASP C C 13 176.183 0.0 . 1 . . . . . 167 ASP C . 27964 1 483 . 1 1 167 167 ASP CA C 13 54.206 0.0 . 1 . . . . . 167 ASP CA . 27964 1 484 . 1 1 167 167 ASP CB C 13 40.966 0.0 . 1 . . . . . 167 ASP CB . 27964 1 485 . 1 1 167 167 ASP N N 15 121.523 0.0 . 1 . . . . . 167 ASP N . 27964 1 486 . 1 1 168 168 GLU H H 1 8.287 0.0 . 1 . . . . . 168 GLU H . 27964 1 487 . 1 1 168 168 GLU HA H 1 4.253 0.0 . 1 . . . . . 168 GLU HA . 27964 1 488 . 1 1 168 168 GLU C C 13 176.516 0.0 . 1 . . . . . 168 GLU C . 27964 1 489 . 1 1 168 168 GLU CA C 13 56.593 0.0 . 1 . . . . . 168 GLU CA . 27964 1 490 . 1 1 168 168 GLU CB C 13 30.036 0.0 . 1 . . . . . 168 GLU CB . 27964 1 491 . 1 1 168 168 GLU N N 15 121.164 0.0 . 1 . . . . . 168 GLU N . 27964 1 492 . 1 1 169 169 GLU H H 1 8.359 0.0 . 1 . . . . . 169 GLU H . 27964 1 493 . 1 1 169 169 GLU HA H 1 4.248 0.0 . 1 . . . . . 169 GLU HA . 27964 1 494 . 1 1 169 169 GLU C C 13 176.394 0.0 . 1 . . . . . 169 GLU C . 27964 1 495 . 1 1 169 169 GLU CA C 13 56.473 0.0 . 1 . . . . . 169 GLU CA . 27964 1 496 . 1 1 169 169 GLU CB C 13 30.136 0.0 . 1 . . . . . 169 GLU CB . 27964 1 497 . 1 1 169 169 GLU N N 15 121.772 0.0 . 1 . . . . . 169 GLU N . 27964 1 498 . 1 1 170 170 GLU H H 1 8.358 0.0 . 1 . . . . . 170 GLU H . 27964 1 499 . 1 1 170 170 GLU HA H 1 4.244 0.0 . 1 . . . . . 170 GLU HA . 27964 1 500 . 1 1 170 170 GLU C C 13 176.250 0.0 . 1 . . . . . 170 GLU C . 27964 1 501 . 1 1 170 170 GLU CA C 13 56.432 0.0 . 1 . . . . . 170 GLU CA . 27964 1 502 . 1 1 170 170 GLU CB C 13 30.376 0.0 . 1 . . . . . 170 GLU CB . 27964 1 503 . 1 1 170 170 GLU N N 15 122.188 0.0 . 1 . . . . . 170 GLU N . 27964 1 504 . 1 1 171 171 GLU H H 1 8.401 0.0 . 1 . . . . . 171 GLU H . 27964 1 505 . 1 1 171 171 GLU HA H 1 4.251 0.0 . 1 . . . . . 171 GLU HA . 27964 1 506 . 1 1 171 171 GLU C C 13 176.040 0.0 . 1 . . . . . 171 GLU C . 27964 1 507 . 1 1 171 171 GLU CA C 13 56.437 0.0 . 1 . . . . . 171 GLU CA . 27964 1 508 . 1 1 171 171 GLU CB C 13 30.346 0.0 . 1 . . . . . 171 GLU CB . 27964 1 509 . 1 1 171 171 GLU N N 15 122.721 0.0 . 1 . . . . . 171 GLU N . 27964 1 510 . 1 1 172 172 ILE H H 1 8.284 0.0 . 1 . . . . . 172 ILE H . 27964 1 511 . 1 1 172 172 ILE C C 13 175.380 0.0 . 1 . . . . . 172 ILE C . 27964 1 512 . 1 1 172 172 ILE CA C 13 61.273 0.0 . 1 . . . . . 172 ILE CA . 27964 1 513 . 1 1 172 172 ILE N N 15 124.015 0.0 . 1 . . . . . 172 ILE N . 27964 1 stop_ save_ ################################ # Residual dipolar couplings # ################################ save_RDC_list_1 _RDC_list.Sf_category RDCs _RDC_list.Sf_framecode RDC_list_1 _RDC_list.Entry_ID 27964 _RDC_list.ID 1 _RDC_list.Name . _RDC_list.Sample_condition_list_ID 1 _RDC_list.Sample_condition_list_label $sample_conditions_1 _RDC_list.Spectrometer_frequency_1H 600 _RDC_list.Bond_length_usage_flag . _RDC_list.Dipolar_constraint_calib_method . _RDC_list.Mol_align_tensor_axial_sym_mol . _RDC_list.Mol_align_tensor_rhombic_mol . _RDC_list.General_order_param_int_motions . _RDC_list.Assumed_H_N_bond_length . _RDC_list.Assumed_H_C_bond_length . _RDC_list.Assumed_C_N_bond_length . _RDC_list.Details . _RDC_list.Text_data_format . _RDC_list.Text_data . loop_ _RDC_experiment.Experiment_ID _RDC_experiment.Experiment_name _RDC_experiment.Sample_ID _RDC_experiment.Sample_label _RDC_experiment.Sample_state _RDC_experiment.Entry_ID _RDC_experiment.RDC_list_ID 4 '3D IPAP HNCO' . . . 27964 1 5 '3D a/b-HNCO' . . . 27964 1 6 '4D IPAP (HA)CACONH' . . . 27964 1 stop_ loop_ _RDC.ID _RDC.RDC_code _RDC.Assembly_atom_ID_1 _RDC.Entity_assembly_ID_1 _RDC.Entity_ID_1 _RDC.Comp_index_ID_1 _RDC.Seq_ID_1 _RDC.Comp_ID_1 _RDC.Atom_ID_1 _RDC.Atom_type_1 _RDC.Atom_isotope_number_1 _RDC.Ambiguity_code_1 _RDC.Assembly_atom_ID_2 _RDC.Entity_assembly_ID_2 _RDC.Entity_ID_2 _RDC.Comp_index_ID_2 _RDC.Seq_ID_2 _RDC.Comp_ID_2 _RDC.Atom_ID_2 _RDC.Atom_type_2 _RDC.Atom_isotope_number_2 _RDC.Ambiguity_code_2 _RDC.Val _RDC.Val_min _RDC.Val_max _RDC.Val_err _RDC.Val_bond_length _RDC.Resonance_ID_1 _RDC.Resonance_ID_2 _RDC.Auth_entity_assembly_ID_1 _RDC.Auth_seq_ID_1 _RDC.Auth_comp_ID_1 _RDC.Auth_atom_ID_1 _RDC.Auth_entity_assembly_ID_2 _RDC.Auth_seq_ID_2 _RDC.Auth_comp_ID_2 _RDC.Auth_atom_ID_2 _RDC.Entry_ID _RDC.RDC_list_ID 1 DNH . 1 1 3 3 ILE N N 15 . . 1 1 3 3 ILE H H 1 . 1.648 . . 2.798 . . . . . . . . . . . 27964 1 2 DNH . 1 1 4 4 LYS N N 15 . . 1 1 4 4 LYS H H 1 . 4.178 . . 2.319 . . . . . . . . . . . 27964 1 3 DNH . 1 1 5 5 GLN N N 15 . . 1 1 5 5 GLN H H 1 . 5.459 . . 1.994 . . . . . . . . . . . 27964 1 4 DNH . 1 1 6 6 TYR N N 15 . . 1 1 6 6 TYR H H 1 . -1.236 . . 2.053 . . . . . . . . . . . 27964 1 5 DNH . 1 1 7 7 SER N N 15 . . 1 1 7 7 SER H H 1 . -5.16 . . 4.118 . . . . . . . . . . . 27964 1 6 DNH . 1 1 8 8 GLN N N 15 . . 1 1 8 8 GLN H H 1 . 0.473 . . 2.460 . . . . . . . . . . . 27964 1 7 DNH . 1 1 10 10 GLU N N 15 . . 1 1 10 10 GLU H H 1 . -5.373 . . 3.380 . . . . . . . . . . . 27964 1 8 DNH . 1 1 11 11 LEU N N 15 . . 1 1 11 11 LEU H H 1 . 0.548 . . 2.829 . . . . . . . . . . . 27964 1 9 DNH . 1 1 12 12 LYS N N 15 . . 1 1 12 12 LYS H H 1 . 1.546 . . 3.047 . . . . . . . . . . . 27964 1 10 DNH . 1 1 13 13 GLU N N 15 . . 1 1 13 13 GLU H H 1 . -3.504 . . 2.921 . . . . . . . . . . . 27964 1 11 DNH . 1 1 14 14 MET N N 15 . . 1 1 14 14 MET H H 1 . -2.476 . . 2.424 . . . . . . . . . . . 27964 1 12 DNH . 1 1 15 15 ALA N N 15 . . 1 1 15 15 ALA H H 1 . -0.77 . . 2.717 . . . . . . . . . . . 27964 1 13 DNH . 1 1 18 18 GLU N N 15 . . 1 1 18 18 GLU H H 1 . 4.744 . . 5.615 . . . . . . . . . . . 27964 1 14 DNH . 1 1 19 19 ILE N N 15 . . 1 1 19 19 ILE H H 1 . -0.687 . . 5.914 . . . . . . . . . . . 27964 1 15 DNH . 1 1 20 20 ALA N N 15 . . 1 1 20 20 ALA H H 1 . -6.438 . . 4.488 . . . . . . . . . . . 27964 1 16 DNH . 1 1 21 21 HIS N N 15 . . 1 1 21 21 HIS H H 1 . -3.619 . . 4.573 . . . . . . . . . . . 27964 1 17 DNH . 1 1 24 24 PHE N N 15 . . 1 1 24 24 PHE H H 1 . -5.819 . . 7.992 . . . . . . . . . . . 27964 1 18 DNH . 1 1 25 25 GLU N N 15 . . 1 1 25 25 GLU H H 1 . -0.801 . . 4.586 . . . . . . . . . . . 27964 1 19 DNH . 1 1 26 26 GLU N N 15 . . 1 1 26 26 GLU H H 1 . 0.094 . . 3.055 . . . . . . . . . . . 27964 1 20 DNH . 1 1 27 27 HIS N N 15 . . 1 1 27 27 HIS H H 1 . -5.106 . . 4.872 . . . . . . . . . . . 27964 1 21 DNH . 1 1 28 28 LYS N N 15 . . 1 1 28 28 LYS H H 1 . -3.95 . . 9.717 . . . . . . . . . . . 27964 1 22 DNH . 1 1 29 29 LYS N N 15 . . 1 1 29 29 LYS H H 1 . 5.587 . . 3.723 . . . . . . . . . . . 27964 1 23 DNH . 1 1 31 31 VAL N N 15 . . 1 1 31 31 VAL H H 1 . -5.148 . . 6.706 . . . . . . . . . . . 27964 1 24 DNH . 1 1 33 33 PHE N N 15 . . 1 1 33 33 PHE H H 1 . 3.642 . . 7.382 . . . . . . . . . . . 27964 1 25 DNH . 1 1 34 34 GLN N N 15 . . 1 1 34 34 GLN H H 1 . 0.971 . . 4.917 . . . . . . . . . . . 27964 1 26 DNH . 1 1 35 35 GLU N N 15 . . 1 1 35 35 GLU H H 1 . 10.82 . . 5.242 . . . . . . . . . . . 27964 1 27 DNH . 1 1 36 36 LEU N N 15 . . 1 1 36 36 LEU H H 1 . 4.071 . . 4.679 . . . . . . . . . . . 27964 1 28 DNH . 1 1 37 37 LEU N N 15 . . 1 1 37 37 LEU H H 1 . -0.202 . . 4.572 . . . . . . . . . . . 27964 1 29 DNH . 1 1 38 38 ASN N N 15 . . 1 1 38 38 ASN H H 1 . 3.256 . . 3.775 . . . . . . . . . . . 27964 1 30 DNH . 1 1 39 39 GLU N N 15 . . 1 1 39 39 GLU H H 1 . 7.012 . . 3.267 . . . . . . . . . . . 27964 1 31 DNH . 1 1 40 40 ILE N N 15 . . 1 1 40 40 ILE H H 1 . 1.248 . . 4.474 . . . . . . . . . . . 27964 1 32 DNH . 1 1 41 41 ALA N N 15 . . 1 1 41 41 ALA H H 1 . 2.31 . . 4.061 . . . . . . . . . . . 27964 1 33 DNH . 1 1 42 42 SER N N 15 . . 1 1 42 42 SER H H 1 . 6.92 . . 2.878 . . . . . . . . . . . 27964 1 34 DNH . 1 1 43 43 LEU N N 15 . . 1 1 43 43 LEU H H 1 . 4.17 . . 3.839 . . . . . . . . . . . 27964 1 35 DNH . 1 1 44 44 LEU N N 15 . . 1 1 44 44 LEU H H 1 . 0.328 . . 4.916 . . . . . . . . . . . 27964 1 36 DNH . 1 1 45 45 GLY N N 15 . . 1 1 45 45 GLY H H 1 . 4.768 . . 3.511 . . . . . . . . . . . 27964 1 37 DNH . 1 1 46 46 VAL N N 15 . . 1 1 46 46 VAL H H 1 . 10.748 . . 2.407 . . . . . . . . . . . 27964 1 38 DNH . 1 1 47 47 LYS N N 15 . . 1 1 47 47 LYS H H 1 . 4.162 . . 2.418 . . . . . . . . . . . 27964 1 39 DNH . 1 1 48 48 LYS N N 15 . . 1 1 48 48 LYS H H 1 . -5.386 . . 3.155 . . . . . . . . . . . 27964 1 40 DNH . 1 1 49 49 GLU N N 15 . . 1 1 49 49 GLU H H 1 . -3.939 . . 2.800 . . . . . . . . . . . 27964 1 41 DNH . 1 1 50 50 GLU N N 15 . . 1 1 50 50 GLU H H 1 . -4.784 . . 3.176 . . . . . . . . . . . 27964 1 42 DNH . 1 1 51 51 LEU N N 15 . . 1 1 51 51 LEU H H 1 . -4.351 . . 2.931 . . . . . . . . . . . 27964 1 43 DNH . 1 1 52 52 GLY N N 15 . . 1 1 52 52 GLY H H 1 . 0.15 . . 1.596 . . . . . . . . . . . 27964 1 44 DNH . 1 1 53 53 ASP N N 15 . . 1 1 53 53 ASP H H 1 . 5.650 . . 3.736 . . . . . . . . . . . 27964 1 45 DNH . 1 1 54 54 ARG N N 15 . . 1 1 54 54 ARG H H 1 . 3.721 . . 2.397 . . . . . . . . . . . 27964 1 46 DNH . 1 1 55 55 ILE N N 15 . . 1 1 55 55 ILE H H 1 . 5.363 . . 4.073 . . . . . . . . . . . 27964 1 47 DNH . 1 1 56 56 ALA N N 15 . . 1 1 56 56 ALA H H 1 . 7.422 . . 3.317 . . . . . . . . . . . 27964 1 48 DNH . 1 1 57 57 GLN N N 15 . . 1 1 57 57 GLN H H 1 . 9.282 . . 3.853 . . . . . . . . . . . 27964 1 49 DNH . 1 1 58 58 PHE N N 15 . . 1 1 58 58 PHE H H 1 . 5.940 . . 4.313 . . . . . . . . . . . 27964 1 50 DNH . 1 1 59 59 TYR N N 15 . . 1 1 59 59 TYR H H 1 . 10.04 . . 4.285 . . . . . . . . . . . 27964 1 51 DNH . 1 1 60 60 THR N N 15 . . 1 1 60 60 THR H H 1 . 8.719 . . 5.031 . . . . . . . . . . . 27964 1 52 DNH . 1 1 61 61 ASP N N 15 . . 1 1 61 61 ASP H H 1 . 9.678 . . 6.806 . . . . . . . . . . . 27964 1 53 DNH . 1 1 62 62 LEU N N 15 . . 1 1 62 62 LEU H H 1 . 7.485 . . 6.842 . . . . . . . . . . . 27964 1 54 DNH . 1 1 67 67 ARG N N 15 . . 1 1 67 67 ARG H H 1 . 5.531 . . 13.803 . . . . . . . . . . . 27964 1 55 DNH . 1 1 69 69 LEU N N 15 . . 1 1 69 69 LEU H H 1 . -0.887 . . 5.273 . . . . . . . . . . . 27964 1 56 DNH . 1 1 73 73 ASP N N 15 . . 1 1 73 73 ASP H H 1 . -3.015 . . 6.057 . . . . . . . . . . . 27964 1 57 DNH . 1 1 74 74 GLN N N 15 . . 1 1 74 74 GLN H H 1 . 4.336 . . 6.269 . . . . . . . . . . . 27964 1 58 DNH . 1 1 75 75 THR N N 15 . . 1 1 75 75 THR H H 1 . 7.676 . . 6.461 . . . . . . . . . . . 27964 1 59 DNH . 1 1 76 76 TRP N N 15 . . 1 1 76 76 TRP H H 1 . 4.614 . . 9.043 . . . . . . . . . . . 27964 1 60 DNH . 1 1 79 79 ARG N N 15 . . 1 1 79 79 ARG H H 1 . 0.675 . . 8.463 . . . . . . . . . . . 27964 1 61 DNH . 1 1 81 81 TRP N N 15 . . 1 1 81 81 TRP H H 1 . 2.378 . . 5.194 . . . . . . . . . . . 27964 1 62 DNH . 1 1 82 82 TYR N N 15 . . 1 1 82 82 TYR H H 1 . -3.47 . . 4.104 . . . . . . . . . . . 27964 1 63 DNH . 1 1 84 84 TYR N N 15 . . 1 1 84 84 TYR H H 1 . -2.182 . . 0.906 . . . . . . . . . . . 27964 1 64 DNH . 1 1 85 85 ASP N N 15 . . 1 1 85 85 ASP H H 1 . -0.44 . . 0.642 . . . . . . . . . . . 27964 1 65 DNH . 1 1 86 86 GLN N N 15 . . 1 1 86 86 GLN H H 1 . -1.326 . . 0.455 . . . . . . . . . . . 27964 1 66 DNH . 1 1 87 87 LEU N N 15 . . 1 1 87 87 LEU H H 1 . -1.926 . . 0.358 . . . . . . . . . . . 27964 1 67 DNH . 1 1 88 88 ASP N N 15 . . 1 1 88 88 ASP H H 1 . -1.682 . . 0.313 . . . . . . . . . . . 27964 1 68 DNH . 1 1 89 89 GLU N N 15 . . 1 1 89 89 GLU H H 1 . -1.714 . . 0.326 . . . . . . . . . . . 27964 1 69 DNH . 1 1 90 90 GLU N N 15 . . 1 1 90 90 GLU H H 1 . -1.964 . . 0.339 . . . . . . . . . . . 27964 1 70 DNH . 1 1 91 91 THR N N 15 . . 1 1 91 91 THR H H 1 . -2.106 . . 0.268 . . . . . . . . . . . 27964 1 71 DNH . 1 1 92 92 GLN N N 15 . . 1 1 92 92 GLN H H 1 . -4.092 . . 0.312 . . . . . . . . . . . 27964 1 72 DNH . 1 1 94 94 THR N N 15 . . 1 1 94 94 THR H H 1 . -3.49 . . 0.240 . . . . . . . . . . . 27964 1 73 DNH . 1 1 95 95 VAL N N 15 . . 1 1 95 95 VAL H H 1 . -4.006 . . 0.272 . . . . . . . . . . . 27964 1 74 DNH . 1 1 96 96 GLU N N 15 . . 1 1 96 96 GLU H H 1 . -3.615 . . 0.293 . . . . . . . . . . . 27964 1 75 DNH . 1 1 97 97 ALA N N 15 . . 1 1 97 97 ALA H H 1 . -3.714 . . 0.272 . . . . . . . . . . . 27964 1 76 DNH . 1 1 98 98 GLU N N 15 . . 1 1 98 98 GLU H H 1 . -3.648 . . 0.214 . . . . . . . . . . . 27964 1 77 DNH . 1 1 99 99 GLU N N 15 . . 1 1 99 99 GLU H H 1 . -4.105 . . 0.240 . . . . . . . . . . . 27964 1 78 DNH . 1 1 100 100 GLU N N 15 . . 1 1 100 100 GLU H H 1 . -3.924 . . 0.232 . . . . . . . . . . . 27964 1 79 DNH . 1 1 101 101 GLU N N 15 . . 1 1 101 101 GLU H H 1 . -3.797 . . 0.235 . . . . . . . . . . . 27964 1 80 DNH . 1 1 102 102 ALA N N 15 . . 1 1 102 102 ALA H H 1 . -3.975 . . 0.263 . . . . . . . . . . . 27964 1 81 DNH . 1 1 103 103 GLU N N 15 . . 1 1 103 103 GLU H H 1 . -4.096 . . 0.202 . . . . . . . . . . . 27964 1 82 DNH . 1 1 104 104 GLU N N 15 . . 1 1 104 104 GLU H H 1 . -4.258 . . 0.211 . . . . . . . . . . . 27964 1 83 DNH . 1 1 105 105 ALA N N 15 . . 1 1 105 105 ALA H H 1 . -3.605 . . 0.246 . . . . . . . . . . . 27964 1 84 DNH . 1 1 106 106 VAL N N 15 . . 1 1 106 106 VAL H H 1 . -4.423 . . 0.195 . . . . . . . . . . . 27964 1 85 DNH . 1 1 107 107 GLU N N 15 . . 1 1 107 107 GLU H H 1 . -4.64 . . 0.276 . . . . . . . . . . . 27964 1 86 DNH . 1 1 110 110 LEU N N 15 . . 1 1 110 110 LEU H H 1 . -1.764 . . 0.309 . . . . . . . . . . . 27964 1 87 DNH . 1 1 111 111 ASP N N 15 . . 1 1 111 111 ASP H H 1 . -2.36 . . 0.259 . . . . . . . . . . . 27964 1 88 DNH . 1 1 112 112 LEU N N 15 . . 1 1 112 112 LEU H H 1 . -1.710 . . 0.282 . . . . . . . . . . . 27964 1 89 DNH . 1 1 113 113 ASP N N 15 . . 1 1 113 113 ASP H H 1 . -2.253 . . 0.276 . . . . . . . . . . . 27964 1 90 DNH . 1 1 114 114 GLU N N 15 . . 1 1 114 114 GLU H H 1 . -1.268 . . 0.438 . . . . . . . . . . . 27964 1 91 DNH . 1 1 115 115 PHE N N 15 . . 1 1 115 115 PHE H H 1 . -1.977 . . 0.634 . . . . . . . . . . . 27964 1 92 DNH . 1 1 116 116 GLU N N 15 . . 1 1 116 116 GLU H H 1 . -1.621 . . 0.605 . . . . . . . . . . . 27964 1 93 DNH . 1 1 117 117 GLU N N 15 . . 1 1 117 117 GLU H H 1 . -3.593 . . 0.912 . . . . . . . . . . . 27964 1 94 DNH . 1 1 118 118 ILE N N 15 . . 1 1 118 118 ILE H H 1 . -3.854 . . 0.748 . . . . . . . . . . . 27964 1 95 DNH . 1 1 119 119 ASP N N 15 . . 1 1 119 119 ASP H H 1 . -4.034 . . 1.211 . . . . . . . . . . . 27964 1 96 DNH . 1 1 120 120 GLU N N 15 . . 1 1 120 120 GLU H H 1 . -2.934 . . 1.149 . . . . . . . . . . . 27964 1 97 DNH . 1 1 121 121 ASP N N 15 . . 1 1 121 121 ASP H H 1 . -1.154 . . 0.781 . . . . . . . . . . . 27964 1 98 DNH . 1 1 122 122 ASP N N 15 . . 1 1 122 122 ASP H H 1 . -1.08 . . 0.868 . . . . . . . . . . . 27964 1 99 DNH . 1 1 123 123 LEU N N 15 . . 1 1 123 123 LEU H H 1 . -1.88 . . 0.287 . . . . . . . . . . . 27964 1 100 DNH . 1 1 124 124 ASP N N 15 . . 1 1 124 124 ASP H H 1 . -1.656 . . 0.385 . . . . . . . . . . . 27964 1 101 DNH . 1 1 125 125 LEU N N 15 . . 1 1 125 125 LEU H H 1 . -2.025 . . 0.260 . . . . . . . . . . . 27964 1 102 DNH . 1 1 126 126 ASP N N 15 . . 1 1 126 126 ASP H H 1 . -2.044 . . 0.281 . . . . . . . . . . . 27964 1 103 DNH . 1 1 127 127 GLU N N 15 . . 1 1 127 127 GLU H H 1 . -1.943 . . 0.249 . . . . . . . . . . . 27964 1 104 DNH . 1 1 128 128 VAL N N 15 . . 1 1 128 128 VAL H H 1 . -3.435 . . 0.245 . . . . . . . . . . . 27964 1 105 DNH . 1 1 129 129 GLU N N 15 . . 1 1 129 129 GLU H H 1 . -3.753 . . 0.349 . . . . . . . . . . . 27964 1 106 DNH . 1 1 130 130 GLU N N 15 . . 1 1 130 130 GLU H H 1 . -4.054 . . 0.240 . . . . . . . . . . . 27964 1 107 DNH . 1 1 131 131 GLU N N 15 . . 1 1 131 131 GLU H H 1 . -3.5 . . 0.284 . . . . . . . . . . . 27964 1 108 DNH . 1 1 132 132 LEU N N 15 . . 1 1 132 132 LEU H H 1 . -3.347 . . 0.273 . . . . . . . . . . . 27964 1 109 DNH . 1 1 133 133 ASP N N 15 . . 1 1 133 133 ASP H H 1 . -3.140 . . 0.246 . . . . . . . . . . . 27964 1 110 DNH . 1 1 134 134 LEU N N 15 . . 1 1 134 134 LEU H H 1 . -2.220 . . 0.235 . . . . . . . . . . . 27964 1 111 DNH . 1 1 135 135 GLU N N 15 . . 1 1 135 135 GLU H H 1 . -2.186 . . 0.324 . . . . . . . . . . . 27964 1 112 DNH . 1 1 136 136 ALA N N 15 . . 1 1 136 136 ALA H H 1 . -2.142 . . 0.335 . . . . . . . . . . . 27964 1 113 DNH . 1 1 137 137 ASP N N 15 . . 1 1 137 137 ASP H H 1 . -2.648 . . 0.297 . . . . . . . . . . . 27964 1 114 DNH . 1 1 138 138 ASP N N 15 . . 1 1 138 138 ASP H H 1 . -2.386 . . 0.373 . . . . . . . . . . . 27964 1 115 DNH . 1 1 139 139 PHE N N 15 . . 1 1 139 139 PHE H H 1 . -1.364 . . 0.310 . . . . . . . . . . . 27964 1 116 DNH . 1 1 140 140 ASP N N 15 . . 1 1 140 140 ASP H H 1 . -2.068 . . 0.486 . . . . . . . . . . . 27964 1 117 DNH . 1 1 141 141 GLU N N 15 . . 1 1 141 141 GLU H H 1 . -2.148 . . 0.408 . . . . . . . . . . . 27964 1 118 DNH . 1 1 142 142 GLU N N 15 . . 1 1 142 142 GLU H H 1 . -1.817 . . 0.371 . . . . . . . . . . . 27964 1 119 DNH . 1 1 143 143 ASP N N 15 . . 1 1 143 143 ASP H H 1 . -2.494 . . 0.416 . . . . . . . . . . . 27964 1 120 DNH . 1 1 144 144 LEU N N 15 . . 1 1 144 144 LEU H H 1 . -2.758 . . 0.199 . . . . . . . . . . . 27964 1 121 DNH . 1 1 145 145 ASP N N 15 . . 1 1 145 145 ASP H H 1 . -2.308 . . 0.671 . . . . . . . . . . . 27964 1 122 DNH . 1 1 146 146 GLU N N 15 . . 1 1 146 146 GLU H H 1 . -2.116 . . 1.007 . . . . . . . . . . . 27964 1 123 DNH . 1 1 147 147 ASP N N 15 . . 1 1 147 147 ASP H H 1 . -2.494 . . 0.416 . . . . . . . . . . . 27964 1 124 DNH . 1 1 148 148 ASP N N 15 . . 1 1 148 148 ASP H H 1 . -1.530 . . 1.316 . . . . . . . . . . . 27964 1 125 DNH . 1 1 149 149 ASP N N 15 . . 1 1 149 149 ASP H H 1 . -1.481 . . 0.873 . . . . . . . . . . . 27964 1 126 DNH . 1 1 150 150 ASP N N 15 . . 1 1 150 150 ASP H H 1 . -0.606 . . 0.649 . . . . . . . . . . . 27964 1 127 DNH . 1 1 151 151 LEU N N 15 . . 1 1 151 151 LEU H H 1 . -1.764 . . 0.309 . . . . . . . . . . . 27964 1 128 DNH . 1 1 152 152 GLU N N 15 . . 1 1 152 152 GLU H H 1 . -1.758 . . 0.394 . . . . . . . . . . . 27964 1 129 DNH . 1 1 153 153 ILE N N 15 . . 1 1 153 153 ILE H H 1 . -3.042 . . 0.287 . . . . . . . . . . . 27964 1 130 DNH . 1 1 154 154 GLU N N 15 . . 1 1 154 154 GLU H H 1 . -2.845 . . 0.268 . . . . . . . . . . . 27964 1 131 DNH . 1 1 155 155 GLU N N 15 . . 1 1 155 155 GLU H H 1 . -3.064 . . 0.243 . . . . . . . . . . . 27964 1 132 DNH . 1 1 156 156 ASP N N 15 . . 1 1 156 156 ASP H H 1 . -2.621 . . 0.240 . . . . . . . . . . . 27964 1 133 DNH . 1 1 157 157 ILE N N 15 . . 1 1 157 157 ILE H H 1 . -2.670 . . 0.228 . . . . . . . . . . . 27964 1 134 DNH . 1 1 158 158 ILE N N 15 . . 1 1 158 158 ILE H H 1 . -2.912 . . 0.276 . . . . . . . . . . . 27964 1 135 DNH . 1 1 159 159 ASP N N 15 . . 1 1 159 159 ASP H H 1 . -2.984 . . 0.423 . . . . . . . . . . . 27964 1 136 DNH . 1 1 160 160 GLU N N 15 . . 1 1 160 160 GLU H H 1 . -2.112 . . 0.352 . . . . . . . . . . . 27964 1 137 DNH . 1 1 161 161 ASP N N 15 . . 1 1 161 161 ASP H H 1 . -1.670 . . 0.585 . . . . . . . . . . . 27964 1 138 DNH . 1 1 162 162 ASP N N 15 . . 1 1 162 162 ASP H H 1 . -1.454 . . 0.558 . . . . . . . . . . . 27964 1 139 DNH . 1 1 163 163 GLU N N 15 . . 1 1 163 163 GLU H H 1 . -1.074 . . 0.497 . . . . . . . . . . . 27964 1 140 DNH . 1 1 164 164 ASP N N 15 . . 1 1 164 164 ASP H H 1 . -0.868 . . 0.751 . . . . . . . . . . . 27964 1 141 DNH . 1 1 165 165 TYR N N 15 . . 1 1 165 165 TYR H H 1 . -0.906 . . 0.538 . . . . . . . . . . . 27964 1 142 DNH . 1 1 166 166 ASP N N 15 . . 1 1 166 166 ASP H H 1 . -0.860 . . 0.393 . . . . . . . . . . . 27964 1 143 DNH . 1 1 167 167 ASP N N 15 . . 1 1 167 167 ASP H H 1 . -0.708 . . 0.433 . . . . . . . . . . . 27964 1 144 DNH . 1 1 168 168 GLU N N 15 . . 1 1 168 168 GLU H H 1 . -0.392 . . 0.275 . . . . . . . . . . . 27964 1 145 DNH . 1 1 169 169 GLU N N 15 . . 1 1 169 169 GLU H H 1 . -0.497 . . 0.273 . . . . . . . . . . . 27964 1 146 DNH . 1 1 170 170 GLU N N 15 . . 1 1 170 170 GLU H H 1 . -0.795 . . 0.196 . . . . . . . . . . . 27964 1 147 DNH . 1 1 171 171 GLU N N 15 . . 1 1 171 171 GLU H H 1 . -0.844 . . 0.140 . . . . . . . . . . . 27964 1 148 DNH . 1 1 172 172 ILE N N 15 . . 1 1 172 172 ILE H H 1 . -0.882 . . 0.110 . . . . . . . . . . . 27964 1 149 DNH . 1 1 173 173 LYS N N 15 . . 1 1 173 173 LYS H H 1 . -0.758 . . 0.145 . . . . . . . . . . . 27964 1 150 DHC . 1 1 5 5 GLN H H 1 . . 1 1 4 4 LYS C C 13 . 0.955537 . . 0.3 . . . . . . . . . . . 27964 1 151 DHC . 1 1 6 6 TYR H H 1 . . 1 1 5 5 GLN C C 13 . 2.28271 . . 0.3 . . . . . . . . . . . 27964 1 152 DHC . 1 1 7 7 SER H H 1 . . 1 1 6 6 TYR C C 13 . 2.03216 . . 0.3 . . . . . . . . . . . 27964 1 153 DHC . 1 1 8 8 GLN H H 1 . . 1 1 7 7 SER C C 13 . 0.671302 . . 0.3 . . . . . . . . . . . 27964 1 154 DHC . 1 1 9 9 GLU H H 1 . . 1 1 8 8 GLN C C 13 . 1.86019 . . 0.3 . . . . . . . . . . . 27964 1 155 DHC . 1 1 9 9 GLU H H 1 . . 1 1 10 10 GLU C C 13 . 1.70838 . . 0.3 . . . . . . . . . . . 27964 1 156 DHC . 1 1 12 12 LYS H H 1 . . 1 1 11 11 LEU C C 13 . 0.147061 . . 0.3 . . . . . . . . . . . 27964 1 157 DHC . 1 1 13 13 GLU H H 1 . . 1 1 12 12 LYS C C 13 . 1.88943 . . 0.3 . . . . . . . . . . . 27964 1 158 DHC . 1 1 14 14 MET H H 1 . . 1 1 13 13 GLU C C 13 . 2.61114 . . 0.3 . . . . . . . . . . . 27964 1 159 DHC . 1 1 15 15 ALA H H 1 . . 1 1 14 14 MET C C 13 . 0.196483 . . 0.3 . . . . . . . . . . . 27964 1 160 DHC . 1 1 16 16 LEU H H 1 . . 1 1 15 15 ALA C C 13 . 5.50018 . . 0.3 . . . . . . . . . . . 27964 1 161 DHC . 1 1 17 17 VAL H H 1 . . 1 1 16 16 LEU C C 13 . 2.03999 . . 0.3 . . . . . . . . . . . 27964 1 162 DHC . 1 1 19 19 ILE H H 1 . . 1 1 18 18 GLU C C 13 . -0.289446 . . 0.3 . . . . . . . . . . . 27964 1 163 DHC . 1 1 20 20 ALA H H 1 . . 1 1 19 19 ILE C C 13 . 1.47629 . . 0.3 . . . . . . . . . . . 27964 1 164 DHC . 1 1 21 21 HIS H H 1 . . 1 1 20 20 ALA C C 13 . 1.75375 . . 0.3 . . . . . . . . . . . 27964 1 165 DHC . 1 1 24 24 PHE H H 1 . . 1 1 23 23 LEU C C 13 . 1.83992 . . 0.3 . . . . . . . . . . . 27964 1 166 DHC . 1 1 25 25 GLU H H 1 . . 1 1 24 24 PHE C C 13 . 3.15049 . . 0.3 . . . . . . . . . . . 27964 1 167 DHC . 1 1 26 26 GLU H H 1 . . 1 1 25 25 GLU C C 13 . 0.0130204 . . 0.3 . . . . . . . . . . . 27964 1 168 DHC . 1 1 27 27 HIS H H 1 . . 1 1 26 26 GLU C C 13 . 1.46283 . . 0.3 . . . . . . . . . . . 27964 1 169 DHC . 1 1 29 29 LYS H H 1 . . 1 1 28 28 LYS C C 13 . 0.721191 . . 0.3 . . . . . . . . . . . 27964 1 170 DHC . 1 1 34 34 GLN H H 1 . . 1 1 33 33 PHE C C 13 . 2.75771 . . 0.3 . . . . . . . . . . . 27964 1 171 DHC . 1 1 35 35 GLU H H 1 . . 1 1 34 34 GLN C C 13 . 0.264134 . . 0.3 . . . . . . . . . . . 27964 1 172 DHC . 1 1 36 36 LEU H H 1 . . 1 1 35 35 GLU C C 13 . 1.03883 . . 0.3 . . . . . . . . . . . 27964 1 173 DHC . 1 1 37 37 LEU H H 1 . . 1 1 36 36 LEU C C 13 . 3.94219 . . 0.3 . . . . . . . . . . . 27964 1 174 DHC . 1 1 38 38 ASN H H 1 . . 1 1 37 37 LEU C C 13 . 1.82625 . . 0.3 . . . . . . . . . . . 27964 1 175 DHC . 1 1 41 41 ALA H H 1 . . 1 1 40 40 ILE C C 13 . 3.29883 . . 0.3 . . . . . . . . . . . 27964 1 176 DHC . 1 1 42 42 SER H H 1 . . 1 1 41 41 ALA C C 13 . 1.11892 . . 0.3 . . . . . . . . . . . 27964 1 177 DHC . 1 1 43 43 LEU H H 1 . . 1 1 42 42 SER C C 13 . -0.310358 . . 0.3 . . . . . . . . . . . 27964 1 178 DHC . 1 1 44 44 LEU H H 1 . . 1 1 43 43 LEU C C 13 . 1.80124 . . 0.3 . . . . . . . . . . . 27964 1 179 DHC . 1 1 45 45 GLY H H 1 . . 1 1 44 44 LEU C C 13 . 1.92845 . . 0.3 . . . . . . . . . . . 27964 1 180 DHC . 1 1 46 46 VAL H H 1 . . 1 1 45 45 GLY C C 13 . 0.325714 . . 0.3 . . . . . . . . . . . 27964 1 181 DHC . 1 1 48 48 LYS H H 1 . . 1 1 47 47 LYS C C 13 . 1.4819 . . 0.3 . . . . . . . . . . . 27964 1 182 DHC . 1 1 49 49 GLU H H 1 . . 1 1 48 48 LYS C C 13 . 1.33739 . . 0.3 . . . . . . . . . . . 27964 1 183 DHC . 1 1 50 50 GLU H H 1 . . 1 1 49 49 GLU C C 13 . 2.3099 . . 0.3 . . . . . . . . . . . 27964 1 184 DHC . 1 1 51 51 LEU H H 1 . . 1 1 50 50 GLU C C 13 . -0.612309 . . 0.3 . . . . . . . . . . . 27964 1 185 DHC . 1 1 52 52 GLY H H 1 . . 1 1 51 51 LEU C C 13 . 2.01077 . . 0.3 . . . . . . . . . . . 27964 1 186 DHC . 1 1 53 53 ASP H H 1 . . 1 1 52 52 GLY C C 13 . 1.84139 . . 0.3 . . . . . . . . . . . 27964 1 187 DHC . 1 1 54 54 ARG H H 1 . . 1 1 53 53 ASP C C 13 . 3.09905 . . 0.3 . . . . . . . . . . . 27964 1 188 DHC . 1 1 55 55 ILE H H 1 . . 1 1 54 54 ARG C C 13 . 1.15471 . . 0.3 . . . . . . . . . . . 27964 1 189 DHC . 1 1 56 56 ALA H H 1 . . 1 1 55 55 ILE C C 13 . 2.61011 . . 0.3 . . . . . . . . . . . 27964 1 190 DHC . 1 1 57 57 GLN H H 1 . . 1 1 56 56 ALA C C 13 . 0.534977 . . 0.3 . . . . . . . . . . . 27964 1 191 DHC . 1 1 58 58 PHE H H 1 . . 1 1 57 57 GLN C C 13 . 3.35029 . . 0.3 . . . . . . . . . . . 27964 1 192 DHC . 1 1 60 60 THR H H 1 . . 1 1 59 59 TYR C C 13 . 1.47477 . . 0.3 . . . . . . . . . . . 27964 1 193 DHC . 1 1 61 61 ASP H H 1 . . 1 1 60 60 THR C C 13 . 0.0386846 . . 0.3 . . . . . . . . . . . 27964 1 194 DHC . 1 1 67 67 ARG H H 1 . . 1 1 66 66 GLY C C 13 . 0.357682 . . 0.3 . . . . . . . . . . . 27964 1 195 DHC . 1 1 70 70 ALA H H 1 . . 1 1 69 69 LEU C C 13 . 2.22917 . . 0.3 . . . . . . . . . . . 27964 1 196 DHC . 1 1 73 73 ASP H H 1 . . 1 1 72 72 SER C C 13 . 0.406047 . . 0.3 . . . . . . . . . . . 27964 1 197 DHC . 1 1 75 75 THR H H 1 . . 1 1 74 74 GLN C C 13 . 0.174833 . . 0.3 . . . . . . . . . . . 27964 1 198 DHC . 1 1 76 76 TRP H H 1 . . 1 1 75 75 THR C C 13 . -0.0940866 . . 0.3 . . . . . . . . . . . 27964 1 199 DHC . 1 1 77 77 GLY H H 1 . . 1 1 76 76 TRP C C 13 . 2.58173 . . 0.3 . . . . . . . . . . . 27964 1 200 DHC . 1 1 79 79 ARG H H 1 . . 1 1 78 78 LEU C C 13 . 2.73341 . . 0.3 . . . . . . . . . . . 27964 1 201 DHC . 1 1 81 81 TRP H H 1 . . 1 1 80 80 SER C C 13 . 1.15493 . . 0.3 . . . . . . . . . . . 27964 1 202 DHC . 1 1 82 82 TYR H H 1 . . 1 1 81 81 TRP C C 13 . 2.66641 . . 0.3 . . . . . . . . . . . 27964 1 203 DHC . 1 1 85 85 ASP H H 1 . . 1 1 84 84 TYR C C 13 . 1.97565 . . 0.3 . . . . . . . . . . . 27964 1 204 DHC . 1 1 86 86 GLN H H 1 . . 1 1 85 85 ASP C C 13 . 1.97287 . . 0.3 . . . . . . . . . . . 27964 1 205 DHC . 1 1 87 87 LEU H H 1 . . 1 1 86 86 GLN C C 13 . 2.50414 . . 0.3 . . . . . . . . . . . 27964 1 206 DHC . 1 1 88 88 ASP H H 1 . . 1 1 87 87 LEU C C 13 . 2.69436 . . 0.3 . . . . . . . . . . . 27964 1 207 DHC . 1 1 89 89 GLU H H 1 . . 1 1 88 88 ASP C C 13 . 2.16555 . . 0.3 . . . . . . . . . . . 27964 1 208 DHC . 1 1 90 90 GLU H H 1 . . 1 1 89 89 GLU C C 13 . 1.84699 . . 0.3 . . . . . . . . . . . 27964 1 209 DHC . 1 1 91 91 THR H H 1 . . 1 1 90 90 GLU C C 13 . 2.39065 . . 0.3 . . . . . . . . . . . 27964 1 210 DHC . 1 1 92 92 GLN H H 1 . . 1 1 91 91 THR C C 13 . 2.09696 . . 0.3 . . . . . . . . . . . 27964 1 211 DHC . 1 1 94 94 THR H H 1 . . 1 1 93 93 PRO C C 13 . 2.87372 . . 0.3 . . . . . . . . . . . 27964 1 212 DHC . 1 1 95 95 VAL H H 1 . . 1 1 94 94 THR C C 13 . 2.63745 . . 0.3 . . . . . . . . . . . 27964 1 213 DHC . 1 1 96 96 GLU H H 1 . . 1 1 95 95 VAL C C 13 . 2.1157 . . 0.3 . . . . . . . . . . . 27964 1 214 DHC . 1 1 97 97 ALA H H 1 . . 1 1 96 96 GLU C C 13 . 2.61548 . . 0.3 . . . . . . . . . . . 27964 1 215 DHC . 1 1 98 98 GLU H H 1 . . 1 1 97 97 ALA C C 13 . 2.48399 . . 0.3 . . . . . . . . . . . 27964 1 216 DHC . 1 1 99 99 GLU H H 1 . . 1 1 98 98 GLU C C 13 . 2.45248 . . 0.3 . . . . . . . . . . . 27964 1 217 DHC . 1 1 100 100 GLU H H 1 . . 1 1 99 99 GLU C C 13 . 1.82599 . . 0.3 . . . . . . . . . . . 27964 1 218 DHC . 1 1 101 101 GLU H H 1 . . 1 1 100 100 GLU C C 13 . 2.51622 . . 0.3 . . . . . . . . . . . 27964 1 219 DHC . 1 1 102 102 ALA H H 1 . . 1 1 101 101 GLU C C 13 . 2.21439 . . 0.3 . . . . . . . . . . . 27964 1 220 DHC . 1 1 103 103 GLU H H 1 . . 1 1 102 102 ALA C C 13 . 2.52257 . . 0.3 . . . . . . . . . . . 27964 1 221 DHC . 1 1 104 104 GLU H H 1 . . 1 1 103 103 GLU C C 13 . 2.51622 . . 0.3 . . . . . . . . . . . 27964 1 222 DHC . 1 1 105 105 ALA H H 1 . . 1 1 104 104 GLU C C 13 . 2.39568 . . 0.3 . . . . . . . . . . . 27964 1 223 DHC . 1 1 106 106 VAL H H 1 . . 1 1 105 105 ALA C C 13 . 2.65062 . . 0.3 . . . . . . . . . . . 27964 1 224 DHC . 1 1 107 107 GLU H H 1 . . 1 1 106 106 VAL C C 13 . 5.23328 . . 0.3 . . . . . . . . . . . 27964 1 225 DHC . 1 1 110 110 LEU H H 1 . . 1 1 109 109 ASP C C 13 . 0.906506 . . 0.3 . . . . . . . . . . . 27964 1 226 DHC . 1 1 111 111 ASP H H 1 . . 1 1 110 110 LEU C C 13 . 2.69436 . . 0.3 . . . . . . . . . . . 27964 1 227 DHC . 1 1 113 113 ASP H H 1 . . 1 1 112 112 LEU C C 13 . 2.83912 . . 0.3 . . . . . . . . . . . 27964 1 228 DHC . 1 1 114 114 GLU H H 1 . . 1 1 113 113 ASP C C 13 . 2.29325 . . 0.3 . . . . . . . . . . . 27964 1 229 DHC . 1 1 115 115 PHE H H 1 . . 1 1 114 114 GLU C C 13 . 2.79094 . . 0.3 . . . . . . . . . . . 27964 1 230 DHC . 1 1 116 116 GLU H H 1 . . 1 1 115 115 PHE C C 13 . 1.86856 . . 0.3 . . . . . . . . . . . 27964 1 231 DHC . 1 1 117 117 GLU H H 1 . . 1 1 116 116 GLU C C 13 . 2.50591 . . 0.3 . . . . . . . . . . . 27964 1 232 DHC . 1 1 119 119 ASP H H 1 . . 1 1 118 118 ILE C C 13 . 2.28803 . . 0.3 . . . . . . . . . . . 27964 1 233 DHC . 1 1 120 120 GLU H H 1 . . 1 1 119 119 ASP C C 13 . 2.42606 . . 0.3 . . . . . . . . . . . 27964 1 234 DHC . 1 1 121 121 ASP H H 1 . . 1 1 120 120 GLU C C 13 . 2.55106 . . 0.3 . . . . . . . . . . . 27964 1 235 DHC . 1 1 122 122 ASP H H 1 . . 1 1 121 121 ASP C C 13 . 2.00476 . . 0.3 . . . . . . . . . . . 27964 1 236 DHC . 1 1 123 123 LEU H H 1 . . 1 1 122 122 ASP C C 13 . 2.14843 . . 0.3 . . . . . . . . . . . 27964 1 237 DHC . 1 1 126 126 ASP H H 1 . . 1 1 125 125 LEU C C 13 . 3.2406 . . 0.3 . . . . . . . . . . . 27964 1 238 DHC . 1 1 127 127 GLU H H 1 . . 1 1 126 126 ASP C C 13 . 1.36501 . . 0.3 . . . . . . . . . . . 27964 1 239 DHC . 1 1 128 128 VAL H H 1 . . 1 1 127 127 GLU C C 13 . 2.32075 . . 0.3 . . . . . . . . . . . 27964 1 240 DHC . 1 1 129 129 GLU H H 1 . . 1 1 128 128 VAL C C 13 . 2.26318 . . 0.3 . . . . . . . . . . . 27964 1 241 DHC . 1 1 130 130 GLU H H 1 . . 1 1 129 129 GLU C C 13 . 2.67087 . . 0.3 . . . . . . . . . . . 27964 1 242 DHC . 1 1 131 131 GLU H H 1 . . 1 1 130 130 GLU C C 13 . 1.9388 . . 0.3 . . . . . . . . . . . 27964 1 243 DHC . 1 1 132 132 LEU H H 1 . . 1 1 131 131 GLU C C 13 . 2.13066 . . 0.3 . . . . . . . . . . . 27964 1 244 DHC . 1 1 133 133 ASP H H 1 . . 1 1 132 132 LEU C C 13 . 2.47849 . . 0.3 . . . . . . . . . . . 27964 1 245 DHC . 1 1 135 135 GLU H H 1 . . 1 1 134 134 LEU C C 13 . 2.49606 . . 0.3 . . . . . . . . . . . 27964 1 246 DHC . 1 1 136 136 ALA H H 1 . . 1 1 135 135 GLU C C 13 . 2.07858 . . 0.3 . . . . . . . . . . . 27964 1 247 DHC . 1 1 137 137 ASP H H 1 . . 1 1 136 136 ALA C C 13 . 2.53939 . . 0.3 . . . . . . . . . . . 27964 1 248 DHC . 1 1 138 138 ASP H H 1 . . 1 1 137 137 ASP C C 13 . 2.4825 . . 0.3 . . . . . . . . . . . 27964 1 249 DHC . 1 1 139 139 PHE H H 1 . . 1 1 138 138 ASP C C 13 . 2.15739 . . 0.3 . . . . . . . . . . . 27964 1 250 DHC . 1 1 140 140 ASP H H 1 . . 1 1 139 139 PHE C C 13 . 2.31922 . . 0.3 . . . . . . . . . . . 27964 1 251 DHC . 1 1 141 141 GLU H H 1 . . 1 1 140 140 ASP C C 13 . 2.32369 . . 0.3 . . . . . . . . . . . 27964 1 252 DHC . 1 1 142 142 GLU H H 1 . . 1 1 141 141 GLU C C 13 . 2.36693 . . 0.3 . . . . . . . . . . . 27964 1 253 DHC . 1 1 143 143 ASP H H 1 . . 1 1 142 142 GLU C C 13 . 2.15843 . . 0.3 . . . . . . . . . . . 27964 1 254 DHC . 1 1 144 144 LEU H H 1 . . 1 1 143 143 ASP C C 13 . 1.95564 . . 0.3 . . . . . . . . . . . 27964 1 255 DHC . 1 1 145 145 ASP H H 1 . . 1 1 144 144 LEU C C 13 . 2.9604 . . 0.3 . . . . . . . . . . . 27964 1 256 DHC . 1 1 147 147 ASP H H 1 . . 1 1 146 146 GLU C C 13 . 2.15843 . . 0.3 . . . . . . . . . . . 27964 1 257 DHC . 1 1 148 148 ASP H H 1 . . 1 1 147 147 ASP C C 13 . 1.30434 . . 0.3 . . . . . . . . . . . 27964 1 258 DHC . 1 1 150 150 ASP H H 1 . . 1 1 149 149 ASP C C 13 . 2.30679 . . 0.3 . . . . . . . . . . . 27964 1 259 DHC . 1 1 151 151 LEU H H 1 . . 1 1 150 150 ASP C C 13 . -1.48938 . . 0.3 . . . . . . . . . . . 27964 1 260 DHC . 1 1 152 152 GLU H H 1 . . 1 1 151 151 LEU C C 13 . 2.5432 . . 0.3 . . . . . . . . . . . 27964 1 261 DHC . 1 1 153 153 ILE H H 1 . . 1 1 152 152 GLU C C 13 . -8.59168 . . 0.3 . . . . . . . . . . . 27964 1 262 DHC . 1 1 154 154 GLU H H 1 . . 1 1 153 153 ILE C C 13 . 2.22598 . . 0.3 . . . . . . . . . . . 27964 1 263 DHC . 1 1 155 155 GLU H H 1 . . 1 1 154 154 GLU C C 13 . 3.15603 . . 0.3 . . . . . . . . . . . 27964 1 264 DHC . 1 1 156 156 ASP H H 1 . . 1 1 155 155 GLU C C 13 . 2.54334 . . 0.3 . . . . . . . . . . . 27964 1 265 DHC . 1 1 157 157 ILE H H 1 . . 1 1 156 156 ASP C C 13 . 2.36457 . . 0.3 . . . . . . . . . . . 27964 1 266 DHC . 1 1 158 158 ILE H H 1 . . 1 1 157 157 ILE C C 13 . 2.42095 . . 0.3 . . . . . . . . . . . 27964 1 267 DHC . 1 1 159 159 ASP H H 1 . . 1 1 158 158 ILE C C 13 . 2.05618 . . 0.3 . . . . . . . . . . . 27964 1 268 DHC . 1 1 160 160 GLU H H 1 . . 1 1 159 159 ASP C C 13 . 2.40878 . . 0.3 . . . . . . . . . . . 27964 1 269 DHC . 1 1 161 161 ASP H H 1 . . 1 1 160 160 GLU C C 13 . 2.15843 . . 0.3 . . . . . . . . . . . 27964 1 270 DHC . 1 1 162 162 ASP H H 1 . . 1 1 161 161 ASP C C 13 . 2.02168 . . 0.3 . . . . . . . . . . . 27964 1 271 DHC . 1 1 163 163 GLU H H 1 . . 1 1 162 162 ASP C C 13 . 2.32082 . . 0.3 . . . . . . . . . . . 27964 1 272 DHC . 1 1 164 164 ASP H H 1 . . 1 1 163 163 GLU C C 13 . 2.00349 . . 0.3 . . . . . . . . . . . 27964 1 273 DHC . 1 1 165 165 TYR H H 1 . . 1 1 164 164 ASP C C 13 . 2.04413 . . 0.3 . . . . . . . . . . . 27964 1 274 DHC . 1 1 166 166 ASP H H 1 . . 1 1 165 165 TYR C C 13 . 2.20723 . . 0.3 . . . . . . . . . . . 27964 1 275 DHC . 1 1 167 167 ASP H H 1 . . 1 1 166 166 ASP C C 13 . 2.07037 . . 0.3 . . . . . . . . . . . 27964 1 276 DHC . 1 1 168 168 GLU H H 1 . . 1 1 167 167 ASP C C 13 . 2.32082 . . 0.3 . . . . . . . . . . . 27964 1 277 DHC . 1 1 169 169 GLU H H 1 . . 1 1 168 168 GLU C C 13 . 1.84699 . . 0.3 . . . . . . . . . . . 27964 1 278 DHC . 1 1 170 170 GLU H H 1 . . 1 1 169 169 GLU C C 13 . 1.92576 . . 0.3 . . . . . . . . . . . 27964 1 279 DHC . 1 1 171 171 GLU H H 1 . . 1 1 170 170 GLU C C 13 . 1.82599 . . 0.3 . . . . . . . . . . . 27964 1 280 DHC . 1 1 172 172 ILE H H 1 . . 1 1 171 171 GLU C C 13 . 1.79365 . . 0.3 . . . . . . . . . . . 27964 1 281 DNC . 1 1 5 5 GLN N N 15 . . 1 1 4 4 LYS C C 13 . 0.955537 . . 0.3 . . . . . . . . . . . 27964 1 282 DNC . 1 1 6 6 TYR N N 15 . . 1 1 5 5 GLN C C 13 . 2.28271 . . 0.3 . . . . . . . . . . . 27964 1 283 DNC . 1 1 7 7 SER N N 15 . . 1 1 6 6 TYR C C 13 . 2.03216 . . 0.3 . . . . . . . . . . . 27964 1 284 DNC . 1 1 8 8 GLN N N 15 . . 1 1 7 7 SER C C 13 . 0.671302 . . 0.3 . . . . . . . . . . . 27964 1 285 DNC . 1 1 9 9 GLU N N 15 . . 1 1 8 8 GLN C C 13 . 1.86019 . . 0.3 . . . . . . . . . . . 27964 1 286 DNC . 1 1 9 9 GLU N N 15 . . 1 1 10 10 GLU C C 13 . 1.70838 . . 0.3 . . . . . . . . . . . 27964 1 287 DNC . 1 1 12 12 LYS N N 15 . . 1 1 11 11 LEU C C 13 . 0.147061 . . 0.3 . . . . . . . . . . . 27964 1 288 DNC . 1 1 13 13 GLU N N 15 . . 1 1 12 12 LYS C C 13 . 1.88943 . . 0.3 . . . . . . . . . . . 27964 1 289 DNC . 1 1 14 14 MET N N 15 . . 1 1 13 13 GLU C C 13 . 2.61114 . . 0.3 . . . . . . . . . . . 27964 1 290 DNC . 1 1 15 15 ALA N N 15 . . 1 1 14 14 MET C C 13 . 0.196483 . . 0.3 . . . . . . . . . . . 27964 1 291 DNC . 1 1 16 16 LEU N N 15 . . 1 1 15 15 ALA C C 13 . 5.50018 . . 0.3 . . . . . . . . . . . 27964 1 292 DNC . 1 1 17 17 VAL N N 15 . . 1 1 16 16 LEU C C 13 . 2.03999 . . 0.3 . . . . . . . . . . . 27964 1 293 DNC . 1 1 19 19 ILE N N 15 . . 1 1 18 18 GLU C C 13 . -0.289446 . . 0.3 . . . . . . . . . . . 27964 1 294 DNC . 1 1 20 20 ALA N N 15 . . 1 1 19 19 ILE C C 13 . 1.47629 . . 0.3 . . . . . . . . . . . 27964 1 295 DNC . 1 1 21 21 HIS N N 15 . . 1 1 20 20 ALA C C 13 . 1.75375 . . 0.3 . . . . . . . . . . . 27964 1 296 DNC . 1 1 24 24 PHE N N 15 . . 1 1 23 23 LEU C C 13 . 1.83992 . . 0.3 . . . . . . . . . . . 27964 1 297 DNC . 1 1 25 25 GLU N N 15 . . 1 1 24 24 PHE C C 13 . 3.15049 . . 0.3 . . . . . . . . . . . 27964 1 298 DNC . 1 1 26 26 GLU N N 15 . . 1 1 25 25 GLU C C 13 . 0.0130204 . . 0.3 . . . . . . . . . . . 27964 1 299 DNC . 1 1 27 27 HIS N N 15 . . 1 1 26 26 GLU C C 13 . 1.46283 . . 0.3 . . . . . . . . . . . 27964 1 300 DNC . 1 1 29 29 LYS N N 15 . . 1 1 28 28 LYS C C 13 . 0.721191 . . 0.3 . . . . . . . . . . . 27964 1 301 DNC . 1 1 34 34 GLN N N 15 . . 1 1 33 33 PHE C C 13 . 2.75771 . . 0.3 . . . . . . . . . . . 27964 1 302 DNC . 1 1 35 35 GLU N N 15 . . 1 1 34 34 GLN C C 13 . 0.264134 . . 0.3 . . . . . . . . . . . 27964 1 303 DNC . 1 1 36 36 LEU N N 15 . . 1 1 35 35 GLU C C 13 . 1.03883 . . 0.3 . . . . . . . . . . . 27964 1 304 DNC . 1 1 37 37 LEU N N 15 . . 1 1 36 36 LEU C C 13 . 3.94219 . . 0.3 . . . . . . . . . . . 27964 1 305 DNC . 1 1 38 38 ASN N N 15 . . 1 1 37 37 LEU C C 13 . 1.82625 . . 0.3 . . . . . . . . . . . 27964 1 306 DNC . 1 1 41 41 ALA N N 15 . . 1 1 40 40 ILE C C 13 . 3.29883 . . 0.3 . . . . . . . . . . . 27964 1 307 DNC . 1 1 42 42 SER N N 15 . . 1 1 41 41 ALA C C 13 . 1.11892 . . 0.3 . . . . . . . . . . . 27964 1 308 DNC . 1 1 43 43 LEU N N 15 . . 1 1 42 42 SER C C 13 . -0.310358 . . 0.3 . . . . . . . . . . . 27964 1 309 DNC . 1 1 44 44 LEU N N 15 . . 1 1 43 43 LEU C C 13 . 1.80124 . . 0.3 . . . . . . . . . . . 27964 1 310 DNC . 1 1 45 45 GLY N N 15 . . 1 1 44 44 LEU C C 13 . 1.92845 . . 0.3 . . . . . . . . . . . 27964 1 311 DNC . 1 1 46 46 VAL N N 15 . . 1 1 45 45 GLY C C 13 . 0.325714 . . 0.3 . . . . . . . . . . . 27964 1 312 DNC . 1 1 48 48 LYS N N 15 . . 1 1 47 47 LYS C C 13 . 1.4819 . . 0.3 . . . . . . . . . . . 27964 1 313 DNC . 1 1 49 49 GLU N N 15 . . 1 1 48 48 LYS C C 13 . 1.33739 . . 0.3 . . . . . . . . . . . 27964 1 314 DNC . 1 1 50 50 GLU N N 15 . . 1 1 49 49 GLU C C 13 . 2.3099 . . 0.3 . . . . . . . . . . . 27964 1 315 DNC . 1 1 51 51 LEU N N 15 . . 1 1 50 50 GLU C C 13 . -0.612309 . . 0.3 . . . . . . . . . . . 27964 1 316 DNC . 1 1 52 52 GLY N N 15 . . 1 1 51 51 LEU C C 13 . 2.01077 . . 0.3 . . . . . . . . . . . 27964 1 317 DNC . 1 1 53 53 ASP N N 15 . . 1 1 52 52 GLY C C 13 . 1.84139 . . 0.3 . . . . . . . . . . . 27964 1 318 DNC . 1 1 54 54 ARG N N 15 . . 1 1 53 53 ASP C C 13 . 3.09905 . . 0.3 . . . . . . . . . . . 27964 1 319 DNC . 1 1 55 55 ILE N N 15 . . 1 1 54 54 ARG C C 13 . 1.15471 . . 0.3 . . . . . . . . . . . 27964 1 320 DNC . 1 1 56 56 ALA N N 15 . . 1 1 55 55 ILE C C 13 . 2.61011 . . 0.3 . . . . . . . . . . . 27964 1 321 DNC . 1 1 57 57 GLN N N 15 . . 1 1 56 56 ALA C C 13 . 0.534977 . . 0.3 . . . . . . . . . . . 27964 1 322 DNC . 1 1 58 58 PHE N N 15 . . 1 1 57 57 GLN C C 13 . 3.35029 . . 0.3 . . . . . . . . . . . 27964 1 323 DNC . 1 1 60 60 THR N N 15 . . 1 1 59 59 TYR C C 13 . 1.47477 . . 0.3 . . . . . . . . . . . 27964 1 324 DNC . 1 1 61 61 ASP N N 15 . . 1 1 60 60 THR C C 13 . 0.0386846 . . 0.3 . . . . . . . . . . . 27964 1 325 DNC . 1 1 67 67 ARG N N 15 . . 1 1 66 66 GLY C C 13 . 0.357682 . . 0.3 . . . . . . . . . . . 27964 1 326 DNC . 1 1 70 70 ALA N N 15 . . 1 1 69 69 LEU C C 13 . 2.22917 . . 0.3 . . . . . . . . . . . 27964 1 327 DNC . 1 1 73 73 ASP N N 15 . . 1 1 72 72 SER C C 13 . 0.406047 . . 0.3 . . . . . . . . . . . 27964 1 328 DNC . 1 1 75 75 THR N N 15 . . 1 1 74 74 GLN C C 13 . 0.174833 . . 0.3 . . . . . . . . . . . 27964 1 329 DNC . 1 1 76 76 TRP N N 15 . . 1 1 75 75 THR C C 13 . -0.0940866 . . 0.3 . . . . . . . . . . . 27964 1 330 DNC . 1 1 77 77 GLY N N 15 . . 1 1 76 76 TRP C C 13 . 2.58173 . . 0.3 . . . . . . . . . . . 27964 1 331 DNC . 1 1 79 79 ARG N N 15 . . 1 1 78 78 LEU C C 13 . 2.73341 . . 0.3 . . . . . . . . . . . 27964 1 332 DNC . 1 1 81 81 TRP N N 15 . . 1 1 80 80 SER C C 13 . 1.15493 . . 0.3 . . . . . . . . . . . 27964 1 333 DNC . 1 1 82 82 TYR N N 15 . . 1 1 81 81 TRP C C 13 . 2.66641 . . 0.3 . . . . . . . . . . . 27964 1 334 DNC . 1 1 85 85 ASP N N 15 . . 1 1 84 84 TYR C C 13 . 1.97565 . . 0.3 . . . . . . . . . . . 27964 1 335 DNC . 1 1 86 86 GLN N N 15 . . 1 1 85 85 ASP C C 13 . 1.97287 . . 0.3 . . . . . . . . . . . 27964 1 336 DNC . 1 1 87 87 LEU N N 15 . . 1 1 86 86 GLN C C 13 . 2.50414 . . 0.3 . . . . . . . . . . . 27964 1 337 DNC . 1 1 88 88 ASP N N 15 . . 1 1 87 87 LEU C C 13 . 2.69436 . . 0.3 . . . . . . . . . . . 27964 1 338 DNC . 1 1 89 89 GLU N N 15 . . 1 1 88 88 ASP C C 13 . 2.16555 . . 0.3 . . . . . . . . . . . 27964 1 339 DNC . 1 1 90 90 GLU N N 15 . . 1 1 89 89 GLU C C 13 . 1.84699 . . 0.3 . . . . . . . . . . . 27964 1 340 DNC . 1 1 91 91 THR N N 15 . . 1 1 90 90 GLU C C 13 . 2.39065 . . 0.3 . . . . . . . . . . . 27964 1 341 DNC . 1 1 92 92 GLN N N 15 . . 1 1 91 91 THR C C 13 . 2.09696 . . 0.3 . . . . . . . . . . . 27964 1 342 DNC . 1 1 94 94 THR N N 15 . . 1 1 93 93 PRO C C 13 . 2.87372 . . 0.3 . . . . . . . . . . . 27964 1 343 DNC . 1 1 95 95 VAL N N 15 . . 1 1 94 94 THR C C 13 . 2.63745 . . 0.3 . . . . . . . . . . . 27964 1 344 DNC . 1 1 96 96 GLU N N 15 . . 1 1 95 95 VAL C C 13 . 2.1157 . . 0.3 . . . . . . . . . . . 27964 1 345 DNC . 1 1 97 97 ALA N N 15 . . 1 1 96 96 GLU C C 13 . 2.61548 . . 0.3 . . . . . . . . . . . 27964 1 346 DNC . 1 1 98 98 GLU N N 15 . . 1 1 97 97 ALA C C 13 . 2.48399 . . 0.3 . . . . . . . . . . . 27964 1 347 DNC . 1 1 99 99 GLU N N 15 . . 1 1 98 98 GLU C C 13 . 2.45248 . . 0.3 . . . . . . . . . . . 27964 1 348 DNC . 1 1 100 100 GLU N N 15 . . 1 1 99 99 GLU C C 13 . 1.82599 . . 0.3 . . . . . . . . . . . 27964 1 349 DNC . 1 1 101 101 GLU N N 15 . . 1 1 100 100 GLU C C 13 . 2.51622 . . 0.3 . . . . . . . . . . . 27964 1 350 DNC . 1 1 102 102 ALA N N 15 . . 1 1 101 101 GLU C C 13 . 2.21439 . . 0.3 . . . . . . . . . . . 27964 1 351 DNC . 1 1 103 103 GLU N N 15 . . 1 1 102 102 ALA C C 13 . 2.52257 . . 0.3 . . . . . . . . . . . 27964 1 352 DNC . 1 1 104 104 GLU N N 15 . . 1 1 103 103 GLU C C 13 . 2.51622 . . 0.3 . . . . . . . . . . . 27964 1 353 DNC . 1 1 105 105 ALA N N 15 . . 1 1 104 104 GLU C C 13 . 2.39568 . . 0.3 . . . . . . . . . . . 27964 1 354 DNC . 1 1 106 106 VAL N N 15 . . 1 1 105 105 ALA C C 13 . 2.65062 . . 0.3 . . . . . . . . . . . 27964 1 355 DNC . 1 1 107 107 GLU N N 15 . . 1 1 106 106 VAL C C 13 . 5.23328 . . 0.3 . . . . . . . . . . . 27964 1 356 DNC . 1 1 110 110 LEU N N 15 . . 1 1 109 109 ASP C C 13 . 0.906506 . . 0.3 . . . . . . . . . . . 27964 1 357 DNC . 1 1 111 111 ASP N N 15 . . 1 1 110 110 LEU C C 13 . 2.69436 . . 0.3 . . . . . . . . . . . 27964 1 358 DNC . 1 1 113 113 ASP N N 15 . . 1 1 112 112 LEU C C 13 . 2.83912 . . 0.3 . . . . . . . . . . . 27964 1 359 DNC . 1 1 114 114 GLU N N 15 . . 1 1 113 113 ASP C C 13 . 2.29325 . . 0.3 . . . . . . . . . . . 27964 1 360 DNC . 1 1 115 115 PHE N N 15 . . 1 1 114 114 GLU C C 13 . 2.79094 . . 0.3 . . . . . . . . . . . 27964 1 361 DNC . 1 1 116 116 GLU N N 15 . . 1 1 115 115 PHE C C 13 . 1.86856 . . 0.3 . . . . . . . . . . . 27964 1 362 DNC . 1 1 117 117 GLU N N 15 . . 1 1 116 116 GLU C C 13 . 2.50591 . . 0.3 . . . . . . . . . . . 27964 1 363 DNC . 1 1 119 119 ASP N N 15 . . 1 1 118 118 ILE C C 13 . 2.28803 . . 0.3 . . . . . . . . . . . 27964 1 364 DNC . 1 1 120 120 GLU N N 15 . . 1 1 119 119 ASP C C 13 . 2.42606 . . 0.3 . . . . . . . . . . . 27964 1 365 DNC . 1 1 121 121 ASP N N 15 . . 1 1 120 120 GLU C C 13 . 2.55106 . . 0.3 . . . . . . . . . . . 27964 1 366 DNC . 1 1 122 122 ASP N N 15 . . 1 1 121 121 ASP C C 13 . 2.00476 . . 0.3 . . . . . . . . . . . 27964 1 367 DNC . 1 1 123 123 LEU N N 15 . . 1 1 122 122 ASP C C 13 . 2.14843 . . 0.3 . . . . . . . . . . . 27964 1 368 DNC . 1 1 126 126 ASP N N 15 . . 1 1 125 125 LEU C C 13 . 3.2406 . . 0.3 . . . . . . . . . . . 27964 1 369 DNC . 1 1 127 127 GLU N N 15 . . 1 1 126 126 ASP C C 13 . 1.36501 . . 0.3 . . . . . . . . . . . 27964 1 370 DNC . 1 1 128 128 VAL N N 15 . . 1 1 127 127 GLU C C 13 . 2.32075 . . 0.3 . . . . . . . . . . . 27964 1 371 DNC . 1 1 129 129 GLU N N 15 . . 1 1 128 128 VAL C C 13 . 2.26318 . . 0.3 . . . . . . . . . . . 27964 1 372 DNC . 1 1 130 130 GLU N N 15 . . 1 1 129 129 GLU C C 13 . 2.67087 . . 0.3 . . . . . . . . . . . 27964 1 373 DNC . 1 1 131 131 GLU N N 15 . . 1 1 130 130 GLU C C 13 . 1.9388 . . 0.3 . . . . . . . . . . . 27964 1 374 DNC . 1 1 132 132 LEU N N 15 . . 1 1 131 131 GLU C C 13 . 2.13066 . . 0.3 . . . . . . . . . . . 27964 1 375 DNC . 1 1 133 133 ASP N N 15 . . 1 1 132 132 LEU C C 13 . 2.47849 . . 0.3 . . . . . . . . . . . 27964 1 376 DNC . 1 1 135 135 GLU N N 15 . . 1 1 134 134 LEU C C 13 . 2.49606 . . 0.3 . . . . . . . . . . . 27964 1 377 DNC . 1 1 136 136 ALA N N 15 . . 1 1 135 135 GLU C C 13 . 2.07858 . . 0.3 . . . . . . . . . . . 27964 1 378 DNC . 1 1 137 137 ASP N N 15 . . 1 1 136 136 ALA C C 13 . 2.53939 . . 0.3 . . . . . . . . . . . 27964 1 379 DNC . 1 1 138 138 ASP N N 15 . . 1 1 137 137 ASP C C 13 . 2.4825 . . 0.3 . . . . . . . . . . . 27964 1 380 DNC . 1 1 139 139 PHE N N 15 . . 1 1 138 138 ASP C C 13 . 2.15739 . . 0.3 . . . . . . . . . . . 27964 1 381 DNC . 1 1 140 140 ASP N N 15 . . 1 1 139 139 PHE C C 13 . 2.31922 . . 0.3 . . . . . . . . . . . 27964 1 382 DNC . 1 1 141 141 GLU N N 15 . . 1 1 140 140 ASP C C 13 . 2.32369 . . 0.3 . . . . . . . . . . . 27964 1 383 DNC . 1 1 142 142 GLU N N 15 . . 1 1 141 141 GLU C C 13 . 2.36693 . . 0.3 . . . . . . . . . . . 27964 1 384 DNC . 1 1 143 143 ASP N N 15 . . 1 1 142 142 GLU C C 13 . 2.15843 . . 0.3 . . . . . . . . . . . 27964 1 385 DNC . 1 1 144 144 LEU N N 15 . . 1 1 143 143 ASP C C 13 . 1.95564 . . 0.3 . . . . . . . . . . . 27964 1 386 DNC . 1 1 145 145 ASP N N 15 . . 1 1 144 144 LEU C C 13 . 2.9604 . . 0.3 . . . . . . . . . . . 27964 1 387 DNC . 1 1 147 147 ASP N N 15 . . 1 1 146 146 GLU C C 13 . 2.15843 . . 0.3 . . . . . . . . . . . 27964 1 388 DNC . 1 1 148 148 ASP N N 15 . . 1 1 147 147 ASP C C 13 . 1.30434 . . 0.3 . . . . . . . . . . . 27964 1 389 DNC . 1 1 150 150 ASP N N 15 . . 1 1 149 149 ASP C C 13 . 2.30679 . . 0.3 . . . . . . . . . . . 27964 1 390 DNC . 1 1 151 151 LEU N N 15 . . 1 1 150 150 ASP C C 13 . -1.48938 . . 0.3 . . . . . . . . . . . 27964 1 391 DNC . 1 1 152 152 GLU N N 15 . . 1 1 151 151 LEU C C 13 . 2.5432 . . 0.3 . . . . . . . . . . . 27964 1 392 DNC . 1 1 153 153 ILE N N 15 . . 1 1 152 152 GLU C C 13 . -8.59168 . . 0.3 . . . . . . . . . . . 27964 1 393 DNC . 1 1 154 154 GLU N N 15 . . 1 1 153 153 ILE C C 13 . 2.22598 . . 0.3 . . . . . . . . . . . 27964 1 394 DNC . 1 1 155 155 GLU N N 15 . . 1 1 154 154 GLU C C 13 . 3.15603 . . 0.3 . . . . . . . . . . . 27964 1 395 DNC . 1 1 156 156 ASP N N 15 . . 1 1 155 155 GLU C C 13 . 2.54334 . . 0.3 . . . . . . . . . . . 27964 1 396 DNC . 1 1 157 157 ILE N N 15 . . 1 1 156 156 ASP C C 13 . 2.36457 . . 0.3 . . . . . . . . . . . 27964 1 397 DNC . 1 1 158 158 ILE N N 15 . . 1 1 157 157 ILE C C 13 . 2.42095 . . 0.3 . . . . . . . . . . . 27964 1 398 DNC . 1 1 159 159 ASP N N 15 . . 1 1 158 158 ILE C C 13 . 2.05618 . . 0.3 . . . . . . . . . . . 27964 1 399 DNC . 1 1 160 160 GLU N N 15 . . 1 1 159 159 ASP C C 13 . 2.40878 . . 0.3 . . . . . . . . . . . 27964 1 400 DNC . 1 1 161 161 ASP N N 15 . . 1 1 160 160 GLU C C 13 . 2.15843 . . 0.3 . . . . . . . . . . . 27964 1 401 DNC . 1 1 162 162 ASP N N 15 . . 1 1 161 161 ASP C C 13 . 2.02168 . . 0.3 . . . . . . . . . . . 27964 1 402 DNC . 1 1 163 163 GLU N N 15 . . 1 1 162 162 ASP C C 13 . 2.32082 . . 0.3 . . . . . . . . . . . 27964 1 403 DNC . 1 1 164 164 ASP N N 15 . . 1 1 163 163 GLU C C 13 . 2.00349 . . 0.3 . . . . . . . . . . . 27964 1 404 DNC . 1 1 165 165 TYR N N 15 . . 1 1 164 164 ASP C C 13 . 2.04413 . . 0.3 . . . . . . . . . . . 27964 1 405 DNC . 1 1 166 166 ASP N N 15 . . 1 1 165 165 TYR C C 13 . 2.20723 . . 0.3 . . . . . . . . . . . 27964 1 406 DNC . 1 1 167 167 ASP N N 15 . . 1 1 166 166 ASP C C 13 . 2.07037 . . 0.3 . . . . . . . . . . . 27964 1 407 DNC . 1 1 168 168 GLU N N 15 . . 1 1 167 167 ASP C C 13 . 2.32082 . . 0.3 . . . . . . . . . . . 27964 1 408 DNC . 1 1 169 169 GLU N N 15 . . 1 1 168 168 GLU C C 13 . 1.84699 . . 0.3 . . . . . . . . . . . 27964 1 409 DNC . 1 1 170 170 GLU N N 15 . . 1 1 169 169 GLU C C 13 . 1.92576 . . 0.3 . . . . . . . . . . . 27964 1 410 DNC . 1 1 171 171 GLU N N 15 . . 1 1 170 170 GLU C C 13 . 1.82599 . . 0.3 . . . . . . . . . . . 27964 1 411 DNC . 1 1 172 172 ILE N N 15 . . 1 1 171 171 GLU C C 13 . 1.79365 . . 0.3 . . . . . . . . . . . 27964 1 412 DCAHA . 1 1 3 3 ILE CA C 13 . . 1 1 3 3 ILE HA H 1 . 9.294 . . 0.51 . . . . . . . . . . . 27964 1 413 DCAHA . 1 1 4 4 LYS CA C 13 . . 1 1 4 4 LYS HA H 1 . -5.638 . . 0.51 . . . . . . . . . . . 27964 1 414 DCAHA . 1 1 5 5 GLN CA C 13 . . 1 1 5 5 GLN HA H 1 . 0.47 . . 0.51 . . . . . . . . . . . 27964 1 415 DCAHA . 1 1 6 6 TYR CA C 13 . . 1 1 6 6 TYR HA H 1 . 13.017 . . 0.51 . . . . . . . . . . . 27964 1 416 DCAHA . 1 1 7 7 SER CA C 13 . . 1 1 7 7 SER HA H 1 . 8.446 . . 0.51 . . . . . . . . . . . 27964 1 417 DCAHA . 1 1 8 8 GLN CA C 13 . . 1 1 8 8 GLN HA H 1 . -8.789 . . 0.51 . . . . . . . . . . . 27964 1 418 DCAHA . 1 1 9 9 GLU CA C 13 . . 1 1 9 9 GLU HA H 1 . 3.598 . . 0.51 . . . . . . . . . . . 27964 1 419 DCAHA . 1 1 10 10 GLU CA C 13 . . 1 1 10 10 GLU HA H 1 . 16.304 . . 0.51 . . . . . . . . . . . 27964 1 420 DCAHA . 1 1 11 11 LEU CA C 13 . . 1 1 11 11 LEU HA H 1 . -20.332 . . 0.51 . . . . . . . . . . . 27964 1 421 DCAHA . 1 1 12 12 LYS CA C 13 . . 1 1 12 12 LYS HA H 1 . 6.037 . . 0.51 . . . . . . . . . . . 27964 1 422 DCAHA . 1 1 13 13 GLU CA C 13 . . 1 1 13 13 GLU HA H 1 . 3.955 . . 0.51 . . . . . . . . . . . 27964 1 423 DCAHA . 1 1 14 14 MET CA C 13 . . 1 1 14 14 MET HA H 1 . 7.216 . . 0.51 . . . . . . . . . . . 27964 1 424 DCAHA . 1 1 17 17 VAL CA C 13 . . 1 1 17 17 VAL HA H 1 . 10.759 . . 0.51 . . . . . . . . . . . 27964 1 425 DCAHA . 1 1 19 19 ILE CA C 13 . . 1 1 19 19 ILE HA H 1 . 20.307 . . 0.51 . . . . . . . . . . . 27964 1 426 DCAHA . 1 1 20 20 ALA CA C 13 . . 1 1 20 20 ALA HA H 1 . 2.619 . . 0.51 . . . . . . . . . . . 27964 1 427 DCAHA . 1 1 23 23 LEU CA C 13 . . 1 1 23 23 LEU HA H 1 . 4.476 . . 0.51 . . . . . . . . . . . 27964 1 428 DCAHA . 1 1 25 25 GLU CA C 13 . . 1 1 25 25 GLU HA H 1 . -21.722 . . 0.51 . . . . . . . . . . . 27964 1 429 DCAHA . 1 1 26 26 GLU CA C 13 . . 1 1 26 26 GLU HA H 1 . 4.786 . . 0.51 . . . . . . . . . . . 27964 1 430 DCAHA . 1 1 28 28 LYS CA C 13 . . 1 1 28 28 LYS HA H 1 . 13.909 . . 0.51 . . . . . . . . . . . 27964 1 431 DCAHA . 1 1 33 33 PHE CA C 13 . . 1 1 33 33 PHE HA H 1 . 4.272 . . 0.51 . . . . . . . . . . . 27964 1 432 DCAHA . 1 1 34 34 GLN CA C 13 . . 1 1 34 34 GLN HA H 1 . -4.877 . . 0.51 . . . . . . . . . . . 27964 1 433 DCAHA . 1 1 36 36 LEU CA C 13 . . 1 1 36 36 LEU HA H 1 . 2.637 . . 0.51 . . . . . . . . . . . 27964 1 434 DCAHA . 1 1 37 37 LEU CA C 13 . . 1 1 37 37 LEU HA H 1 . 11.039 . . 0.51 . . . . . . . . . . . 27964 1 435 DCAHA . 1 1 40 40 ILE CA C 13 . . 1 1 40 40 ILE HA H 1 . 14.87 . . 0.51 . . . . . . . . . . . 27964 1 436 DCAHA . 1 1 41 41 ALA CA C 13 . . 1 1 41 41 ALA HA H 1 . 7.694 . . 0.51 . . . . . . . . . . . 27964 1 437 DCAHA . 1 1 43 43 LEU CA C 13 . . 1 1 43 43 LEU HA H 1 . 9.408 . . 0.51 . . . . . . . . . . . 27964 1 438 DCAHA . 1 1 44 44 LEU CA C 13 . . 1 1 44 44 LEU HA H 1 . 3.951 . . 0.51 . . . . . . . . . . . 27964 1 439 DCAHA . 1 1 47 47 LYS CA C 13 . . 1 1 47 47 LYS HA H 1 . 10.265 . . 0.51 . . . . . . . . . . . 27964 1 440 DCAHA . 1 1 48 48 LYS CA C 13 . . 1 1 48 48 LYS HA H 1 . 4.904 . . 0.51 . . . . . . . . . . . 27964 1 441 DCAHA . 1 1 49 49 GLU CA C 13 . . 1 1 49 49 GLU HA H 1 . -6.286 . . 0.51 . . . . . . . . . . . 27964 1 442 DCAHA . 1 1 50 50 GLU CA C 13 . . 1 1 50 50 GLU HA H 1 . -0.569 . . 0.51 . . . . . . . . . . . 27964 1 443 DCAHA . 1 1 51 51 LEU CA C 13 . . 1 1 51 51 LEU HA H 1 . 9.271 . . 0.51 . . . . . . . . . . . 27964 1 444 DCAHA . 1 1 53 53 ASP CA C 13 . . 1 1 53 53 ASP HA H 1 . 5.866 . . 0.51 . . . . . . . . . . . 27964 1 445 DCAHA . 1 1 54 54 ARG CA C 13 . . 1 1 54 54 ARG HA H 1 . 9.975 . . 0.51 . . . . . . . . . . . 27964 1 446 DCAHA . 1 1 56 56 ALA CA C 13 . . 1 1 56 56 ALA HA H 1 . -4.936 . . 0.51 . . . . . . . . . . . 27964 1 447 DCAHA . 1 1 59 59 TYR CA C 13 . . 1 1 59 59 TYR HA H 1 . 5.12 . . 0.51 . . . . . . . . . . . 27964 1 448 DCAHA . 1 1 60 60 THR CA C 13 . . 1 1 60 60 THR HA H 1 . -11.31 . . 0.51 . . . . . . . . . . . 27964 1 449 DCAHA . 1 1 69 69 LEU CA C 13 . . 1 1 69 69 LEU HA H 1 . -0.145 . . 0.51 . . . . . . . . . . . 27964 1 450 DCAHA . 1 1 70 70 ALA CA C 13 . . 1 1 70 70 ALA HA H 1 . 9.301 . . 0.51 . . . . . . . . . . . 27964 1 451 DCAHA . 1 1 74 74 GLN CA C 13 . . 1 1 74 74 GLN HA H 1 . 8.363 . . 0.51 . . . . . . . . . . . 27964 1 452 DCAHA . 1 1 75 75 THR CA C 13 . . 1 1 75 75 THR HA H 1 . 0.658 . . 0.51 . . . . . . . . . . . 27964 1 453 DCAHA . 1 1 78 78 LEU CA C 13 . . 1 1 78 78 LEU HA H 1 . 3.646 . . 0.51 . . . . . . . . . . . 27964 1 454 DCAHA . 1 1 79 79 ARG CA C 13 . . 1 1 79 79 ARG HA H 1 . 10.847 . . 0.51 . . . . . . . . . . . 27964 1 455 DCAHA . 1 1 81 81 TRP CA C 13 . . 1 1 81 81 TRP HA H 1 . 10.59 . . 0.51 . . . . . . . . . . . 27964 1 456 DCAHA . 1 1 83 83 PRO CA C 13 . . 1 1 83 83 PRO HA H 1 . 11.492 . . 0.51 . . . . . . . . . . . 27964 1 457 DCAHA . 1 1 84 84 TYR CA C 13 . . 1 1 84 84 TYR HA H 1 . 3.165 . . 0.51 . . . . . . . . . . . 27964 1 458 DCAHA . 1 1 85 85 ASP CA C 13 . . 1 1 85 85 ASP HA H 1 . 4.979 . . 0.51 . . . . . . . . . . . 27964 1 459 DCAHA . 1 1 86 86 GLN CA C 13 . . 1 1 86 86 GLN HA H 1 . 5.445 . . 0.51 . . . . . . . . . . . 27964 1 460 DCAHA . 1 1 87 87 LEU CA C 13 . . 1 1 87 87 LEU HA H 1 . 14.38 . . 0.51 . . . . . . . . . . . 27964 1 461 DCAHA . 1 1 88 88 ASP CA C 13 . . 1 1 88 88 ASP HA H 1 . 0.841 . . 0.51 . . . . . . . . . . . 27964 1 462 DCAHA . 1 1 89 89 GLU CA C 13 . . 1 1 89 89 GLU HA H 1 . 2.743 . . 0.51 . . . . . . . . . . . 27964 1 463 DCAHA . 1 1 90 90 GLU CA C 13 . . 1 1 90 90 GLU HA H 1 . 8.054 . . 0.51 . . . . . . . . . . . 27964 1 464 DCAHA . 1 1 91 91 THR CA C 13 . . 1 1 91 91 THR HA H 1 . 8.624 . . 0.51 . . . . . . . . . . . 27964 1 465 DCAHA . 1 1 93 93 PRO CA C 13 . . 1 1 93 93 PRO HA H 1 . 6.914 . . 0.51 . . . . . . . . . . . 27964 1 466 DCAHA . 1 1 94 94 THR CA C 13 . . 1 1 94 94 THR HA H 1 . 10.205 . . 0.51 . . . . . . . . . . . 27964 1 467 DCAHA . 1 1 95 95 VAL CA C 13 . . 1 1 95 95 VAL HA H 1 . 11.743 . . 0.51 . . . . . . . . . . . 27964 1 468 DCAHA . 1 1 96 96 GLU CA C 13 . . 1 1 96 96 GLU HA H 1 . 9.169 . . 0.51 . . . . . . . . . . . 27964 1 469 DCAHA . 1 1 97 97 ALA CA C 13 . . 1 1 97 97 ALA HA H 1 . 8.743 . . 0.51 . . . . . . . . . . . 27964 1 470 DCAHA . 1 1 98 98 GLU CA C 13 . . 1 1 98 98 GLU HA H 1 . 9.207 . . 0.51 . . . . . . . . . . . 27964 1 471 DCAHA . 1 1 100 100 GLU CA C 13 . . 1 1 100 100 GLU HA H 1 . 10.107 . . 0.51 . . . . . . . . . . . 27964 1 472 DCAHA . 1 1 101 101 GLU CA C 13 . . 1 1 101 101 GLU HA H 1 . 10.87 . . 0.51 . . . . . . . . . . . 27964 1 473 DCAHA . 1 1 102 102 ALA CA C 13 . . 1 1 102 102 ALA HA H 1 . 9.159 . . 0.51 . . . . . . . . . . . 27964 1 474 DCAHA . 1 1 103 103 GLU CA C 13 . . 1 1 103 103 GLU HA H 1 . 10.906 . . 0.51 . . . . . . . . . . . 27964 1 475 DCAHA . 1 1 104 104 GLU CA C 13 . . 1 1 104 104 GLU HA H 1 . 10.174 . . 0.51 . . . . . . . . . . . 27964 1 476 DCAHA . 1 1 105 105 ALA CA C 13 . . 1 1 105 105 ALA HA H 1 . 11.187 . . 0.51 . . . . . . . . . . . 27964 1 477 DCAHA . 1 1 106 106 VAL CA C 13 . . 1 1 106 106 VAL HA H 1 . 12.163 . . 0.51 . . . . . . . . . . . 27964 1 478 DCAHA . 1 1 108 108 GLU CA C 13 . . 1 1 108 108 GLU HA H 1 . 5.423 . . 0.51 . . . . . . . . . . . 27964 1 479 DCAHA . 1 1 109 109 ASP CA C 13 . . 1 1 109 109 ASP HA H 1 . 4.665 . . 0.51 . . . . . . . . . . . 27964 1 480 DCAHA . 1 1 110 110 LEU CA C 13 . . 1 1 110 110 LEU HA H 1 . 14.38 . . 0.51 . . . . . . . . . . . 27964 1 481 DCAHA . 1 1 111 111 ASP CA C 13 . . 1 1 111 111 ASP HA H 1 . 9.966 . . 0.51 . . . . . . . . . . . 27964 1 482 DCAHA . 1 1 112 112 LEU CA C 13 . . 1 1 112 112 LEU HA H 1 . 9.419 . . 0.51 . . . . . . . . . . . 27964 1 483 DCAHA . 1 1 113 113 ASP CA C 13 . . 1 1 113 113 ASP HA H 1 . 9.245 . . 0.51 . . . . . . . . . . . 27964 1 484 DCAHA . 1 1 114 114 GLU CA C 13 . . 1 1 114 114 GLU HA H 1 . 9.118 . . 0.51 . . . . . . . . . . . 27964 1 485 DCAHA . 1 1 115 115 PHE CA C 13 . . 1 1 115 115 PHE HA H 1 . 8.176 . . 0.51 . . . . . . . . . . . 27964 1 486 DCAHA . 1 1 116 116 GLU CA C 13 . . 1 1 116 116 GLU HA H 1 . 10.362 . . 0.51 . . . . . . . . . . . 27964 1 487 DCAHA . 1 1 118 118 ILE CA C 13 . . 1 1 118 118 ILE HA H 1 . 12.243 . . 0.51 . . . . . . . . . . . 27964 1 488 DCAHA . 1 1 119 119 ASP CA C 13 . . 1 1 119 119 ASP HA H 1 . 9.783 . . 0.51 . . . . . . . . . . . 27964 1 489 DCAHA . 1 1 120 120 GLU CA C 13 . . 1 1 120 120 GLU HA H 1 . 8.512 . . 0.51 . . . . . . . . . . . 27964 1 490 DCAHA . 1 1 122 122 ASP CA C 13 . . 1 1 122 122 ASP HA H 1 . 9.966 . . 0.51 . . . . . . . . . . . 27964 1 491 DCAHA . 1 1 123 123 LEU CA C 13 . . 1 1 123 123 LEU HA H 1 . 11.401 . . 0.51 . . . . . . . . . . . 27964 1 492 DCAHA . 1 1 124 124 ASP CA C 13 . . 1 1 124 124 ASP HA H 1 . 9.966 . . 0.51 . . . . . . . . . . . 27964 1 493 DCAHA . 1 1 125 125 LEU CA C 13 . . 1 1 125 125 LEU HA H 1 . 8.909 . . 0.51 . . . . . . . . . . . 27964 1 494 DCAHA . 1 1 126 126 ASP CA C 13 . . 1 1 126 126 ASP HA H 1 . 9.534 . . 0.51 . . . . . . . . . . . 27964 1 495 DCAHA . 1 1 127 127 GLU CA C 13 . . 1 1 127 127 GLU HA H 1 . 9.452 . . 0.51 . . . . . . . . . . . 27964 1 496 DCAHA . 1 1 128 128 VAL CA C 13 . . 1 1 128 128 VAL HA H 1 . 8.868 . . 0.51 . . . . . . . . . . . 27964 1 497 DCAHA . 1 1 129 129 GLU CA C 13 . . 1 1 129 129 GLU HA H 1 . 11.314 . . 0.51 . . . . . . . . . . . 27964 1 498 DCAHA . 1 1 130 130 GLU CA C 13 . . 1 1 130 130 GLU HA H 1 . 11.314 . . 0.51 . . . . . . . . . . . 27964 1 499 DCAHA . 1 1 131 131 GLU CA C 13 . . 1 1 131 131 GLU HA H 1 . 11.08 . . 0.51 . . . . . . . . . . . 27964 1 500 DCAHA . 1 1 132 132 LEU CA C 13 . . 1 1 132 132 LEU HA H 1 . 10.141 . . 0.51 . . . . . . . . . . . 27964 1 501 DCAHA . 1 1 133 133 ASP CA C 13 . . 1 1 133 133 ASP HA H 1 . 9.444 . . 0.51 . . . . . . . . . . . 27964 1 502 DCAHA . 1 1 134 134 LEU CA C 13 . . 1 1 134 134 LEU HA H 1 . 11.042 . . 0.51 . . . . . . . . . . . 27964 1 503 DCAHA . 1 1 135 135 GLU CA C 13 . . 1 1 135 135 GLU HA H 1 . 6.37 . . 0.51 . . . . . . . . . . . 27964 1 504 DCAHA . 1 1 136 136 ALA CA C 13 . . 1 1 136 136 ALA HA H 1 . 6.755 . . 0.51 . . . . . . . . . . . 27964 1 505 DCAHA . 1 1 137 137 ASP CA C 13 . . 1 1 137 137 ASP HA H 1 . 8.111 . . 0.51 . . . . . . . . . . . 27964 1 506 DCAHA . 1 1 138 138 ASP CA C 13 . . 1 1 138 138 ASP HA H 1 . 8.256 . . 0.51 . . . . . . . . . . . 27964 1 507 DCAHA . 1 1 139 139 PHE CA C 13 . . 1 1 139 139 PHE HA H 1 . 9.36 . . 0.51 . . . . . . . . . . . 27964 1 508 DCAHA . 1 1 140 140 ASP CA C 13 . . 1 1 140 140 ASP HA H 1 . 7.45 . . 0.51 . . . . . . . . . . . 27964 1 509 DCAHA . 1 1 141 141 GLU CA C 13 . . 1 1 141 141 GLU HA H 1 . 8.002 . . 0.51 . . . . . . . . . . . 27964 1 510 DCAHA . 1 1 142 142 GLU CA C 13 . . 1 1 142 142 GLU HA H 1 . 9.786 . . 0.51 . . . . . . . . . . . 27964 1 511 DCAHA . 1 1 143 143 ASP CA C 13 . . 1 1 143 143 ASP HA H 1 . 8.311 . . 0.51 . . . . . . . . . . . 27964 1 512 DCAHA . 1 1 144 144 LEU CA C 13 . . 1 1 144 144 LEU HA H 1 . 9.16 . . 0.51 . . . . . . . . . . . 27964 1 513 DCAHA . 1 1 146 146 GLU CA C 13 . . 1 1 146 146 GLU HA H 1 . 8.316 . . 0.51 . . . . . . . . . . . 27964 1 514 DCAHA . 1 1 148 148 ASP CA C 13 . . 1 1 148 148 ASP HA H 1 . 6.152 . . 0.51 . . . . . . . . . . . 27964 1 515 DCAHA . 1 1 149 149 ASP CA C 13 . . 1 1 149 149 ASP HA H 1 . 5.423 . . 0.51 . . . . . . . . . . . 27964 1 516 DCAHA . 1 1 150 150 ASP CA C 13 . . 1 1 150 150 ASP HA H 1 . 4.665 . . 0.51 . . . . . . . . . . . 27964 1 517 DCAHA . 1 1 151 151 LEU CA C 13 . . 1 1 151 151 LEU HA H 1 . 11.036 . . 0.51 . . . . . . . . . . . 27964 1 518 DCAHA . 1 1 152 152 GLU CA C 13 . . 1 1 152 152 GLU HA H 1 . 8.224 . . 0.51 . . . . . . . . . . . 27964 1 519 DCAHA . 1 1 153 153 ILE CA C 13 . . 1 1 153 153 ILE HA H 1 . 7.177 . . 0.51 . . . . . . . . . . . 27964 1 520 DCAHA . 1 1 154 154 GLU CA C 13 . . 1 1 154 154 GLU HA H 1 . 7.537 . . 0.51 . . . . . . . . . . . 27964 1 521 DCAHA . 1 1 155 155 GLU CA C 13 . . 1 1 155 155 GLU HA H 1 . 7.178 . . 0.51 . . . . . . . . . . . 27964 1 522 DCAHA . 1 1 156 156 ASP CA C 13 . . 1 1 156 156 ASP HA H 1 . 6.908 . . 0.51 . . . . . . . . . . . 27964 1 523 DCAHA . 1 1 157 157 ILE CA C 13 . . 1 1 157 157 ILE HA H 1 . 6.961 . . 0.51 . . . . . . . . . . . 27964 1 524 DCAHA . 1 1 158 158 ILE CA C 13 . . 1 1 158 158 ILE HA H 1 . 8.623 . . 0.51 . . . . . . . . . . . 27964 1 525 DCAHA . 1 1 159 159 ASP CA C 13 . . 1 1 159 159 ASP HA H 1 . 6.246 . . 0.51 . . . . . . . . . . . 27964 1 526 DCAHA . 1 1 161 161 ASP CA C 13 . . 1 1 161 161 ASP HA H 1 . 4.72 . . 0.51 . . . . . . . . . . . 27964 1 527 DCAHA . 1 1 162 162 ASP CA C 13 . . 1 1 162 162 ASP HA H 1 . 5.814 . . 0.51 . . . . . . . . . . . 27964 1 528 DCAHA . 1 1 163 163 GLU CA C 13 . . 1 1 163 163 GLU HA H 1 . 6.721 . . 0.51 . . . . . . . . . . . 27964 1 529 DCAHA . 1 1 164 164 ASP CA C 13 . . 1 1 164 164 ASP HA H 1 . 2.93 . . 0.51 . . . . . . . . . . . 27964 1 530 DCAHA . 1 1 165 165 TYR CA C 13 . . 1 1 165 165 TYR HA H 1 . 1.732 . . 0.51 . . . . . . . . . . . 27964 1 531 DCAHA . 1 1 166 166 ASP CA C 13 . . 1 1 166 166 ASP HA H 1 . 4.227 . . 0.51 . . . . . . . . . . . 27964 1 532 DCAHA . 1 1 167 167 ASP CA C 13 . . 1 1 167 167 ASP HA H 1 . 5.814 . . 0.51 . . . . . . . . . . . 27964 1 533 DCAHA . 1 1 168 168 GLU CA C 13 . . 1 1 168 168 GLU HA H 1 . 2.766 . . 0.51 . . . . . . . . . . . 27964 1 534 DCAHA . 1 1 169 169 GLU CA C 13 . . 1 1 169 169 GLU HA H 1 . 2.861 . . 0.51 . . . . . . . . . . . 27964 1 535 DCAHA . 1 1 170 170 GLU CA C 13 . . 1 1 170 170 GLU HA H 1 . 1.295 . . 0.51 . . . . . . . . . . . 27964 1 536 DCAHA . 1 1 171 171 GLU CA C 13 . . 1 1 171 171 GLU HA H 1 . 2.511 . . 0.51 . . . . . . . . . . . 27964 1 537 DCAHA . 1 1 172 172 ILE CA C 13 . . 1 1 172 172 ILE HA H 1 . 1.917 . . 0.51 . . . . . . . . . . . 27964 1 538 DCAC . 1 1 3 3 ILE CA C 13 . . 1 1 3 3 ILE C C 13 . -1.15 . . 0.50 . . . . . . . . . . . 27964 1 539 DCAC . 1 1 4 4 LYS CA C 13 . . 1 1 4 4 LYS C C 13 . 0.56 . . 0.50 . . . . . . . . . . . 27964 1 540 DCAC . 1 1 5 5 GLN CA C 13 . . 1 1 5 5 GLN C C 13 . -0.12 . . 0.50 . . . . . . . . . . . 27964 1 541 DCAC . 1 1 6 6 TYR CA C 13 . . 1 1 6 6 TYR C C 13 . -2.33 . . 0.50 . . . . . . . . . . . 27964 1 542 DCAC . 1 1 7 7 SER CA C 13 . . 1 1 7 7 SER C C 13 . 0.39 . . 0.50 . . . . . . . . . . . 27964 1 543 DCAC . 1 1 8 8 GLN CA C 13 . . 1 1 8 8 GLN C C 13 . 0.63 . . 0.50 . . . . . . . . . . . 27964 1 544 DCAC . 1 1 9 9 GLU CA C 13 . . 1 1 9 9 GLU C C 13 . -0.98 . . 0.50 . . . . . . . . . . . 27964 1 545 DCAC . 1 1 10 10 GLU CA C 13 . . 1 1 10 10 GLU C C 13 . 0.91 . . 0.50 . . . . . . . . . . . 27964 1 546 DCAC . 1 1 11 11 LEU CA C 13 . . 1 1 11 11 LEU C C 13 . -0.44 . . 0.50 . . . . . . . . . . . 27964 1 547 DCAC . 1 1 12 12 LYS CA C 13 . . 1 1 12 12 LYS C C 13 . 1.14 . . 0.50 . . . . . . . . . . . 27964 1 548 DCAC . 1 1 13 13 GLU CA C 13 . . 1 1 13 13 GLU C C 13 . -1.57 . . 0.50 . . . . . . . . . . . 27964 1 549 DCAC . 1 1 14 14 MET CA C 13 . . 1 1 14 14 MET C C 13 . 0.42 . . 0.50 . . . . . . . . . . . 27964 1 550 DCAC . 1 1 17 17 VAL CA C 13 . . 1 1 17 17 VAL C C 13 . -0.82 . . 0.50 . . . . . . . . . . . 27964 1 551 DCAC . 1 1 19 19 ILE CA C 13 . . 1 1 19 19 ILE C C 13 . -0.52 . . 0.50 . . . . . . . . . . . 27964 1 552 DCAC . 1 1 20 20 ALA CA C 13 . . 1 1 20 20 ALA C C 13 . 1.49 . . 0.50 . . . . . . . . . . . 27964 1 553 DCAC . 1 1 23 23 LEU CA C 13 . . 1 1 23 23 LEU C C 13 . -5.08 . . 0.50 . . . . . . . . . . . 27964 1 554 DCAC . 1 1 25 25 GLU CA C 13 . . 1 1 25 25 GLU C C 13 . 1.58 . . 0.50 . . . . . . . . . . . 27964 1 555 DCAC . 1 1 26 26 GLU CA C 13 . . 1 1 26 26 GLU C C 13 . 0.66 . . 0.50 . . . . . . . . . . . 27964 1 556 DCAC . 1 1 28 28 LYS CA C 13 . . 1 1 28 28 LYS C C 13 . 2.21 . . 0.50 . . . . . . . . . . . 27964 1 557 DCAC . 1 1 33 33 PHE CA C 13 . . 1 1 33 33 PHE C C 13 . -3.37 . . 0.50 . . . . . . . . . . . 27964 1 558 DCAC . 1 1 34 34 GLN CA C 13 . . 1 1 34 34 GLN C C 13 . -1.95 . . 0.50 . . . . . . . . . . . 27964 1 559 DCAC . 1 1 36 36 LEU CA C 13 . . 1 1 36 36 LEU C C 13 . -0.07 . . 0.50 . . . . . . . . . . . 27964 1 560 DCAC . 1 1 37 37 LEU CA C 13 . . 1 1 37 37 LEU C C 13 . -0.74 . . 0.50 . . . . . . . . . . . 27964 1 561 DCAC . 1 1 40 40 ILE CA C 13 . . 1 1 40 40 ILE C C 13 . -2.59 . . 0.50 . . . . . . . . . . . 27964 1 562 DCAC . 1 1 41 41 ALA CA C 13 . . 1 1 41 41 ALA C C 13 . 0.1 . . 0.50 . . . . . . . . . . . 27964 1 563 DCAC . 1 1 43 43 LEU CA C 13 . . 1 1 43 43 LEU C C 13 . 0.32 . . 0.50 . . . . . . . . . . . 27964 1 564 DCAC . 1 1 44 44 LEU CA C 13 . . 1 1 44 44 LEU C C 13 . -0.98 . . 0.50 . . . . . . . . . . . 27964 1 565 DCAC . 1 1 47 47 LYS CA C 13 . . 1 1 47 47 LYS C C 13 . -0.02 . . 0.50 . . . . . . . . . . . 27964 1 566 DCAC . 1 1 48 48 LYS CA C 13 . . 1 1 48 48 LYS C C 13 . -0.54 . . 0.50 . . . . . . . . . . . 27964 1 567 DCAC . 1 1 49 49 GLU CA C 13 . . 1 1 49 49 GLU C C 13 . 1.55 . . 0.50 . . . . . . . . . . . 27964 1 568 DCAC . 1 1 50 50 GLU CA C 13 . . 1 1 50 50 GLU C C 13 . 0.24 . . 0.50 . . . . . . . . . . . 27964 1 569 DCAC . 1 1 51 51 LEU CA C 13 . . 1 1 51 51 LEU C C 13 . 0.88 . . 0.50 . . . . . . . . . . . 27964 1 570 DCAC . 1 1 53 53 ASP CA C 13 . . 1 1 53 53 ASP C C 13 . 1.41 . . 0.50 . . . . . . . . . . . 27964 1 571 DCAC . 1 1 54 54 ARG CA C 13 . . 1 1 54 54 ARG C C 13 . 1.1 . . 0.50 . . . . . . . . . . . 27964 1 572 DCAC . 1 1 56 56 ALA CA C 13 . . 1 1 56 56 ALA C C 13 . -0.57 . . 0.50 . . . . . . . . . . . 27964 1 573 DCAC . 1 1 59 59 TYR CA C 13 . . 1 1 59 59 TYR C C 13 . -0.88 . . 0.50 . . . . . . . . . . . 27964 1 574 DCAC . 1 1 60 60 THR CA C 13 . . 1 1 60 60 THR C C 13 . 0.85 . . 0.50 . . . . . . . . . . . 27964 1 575 DCAC . 1 1 69 69 LEU CA C 13 . . 1 1 69 69 LEU C C 13 . -0.02 . . 0.50 . . . . . . . . . . . 27964 1 576 DCAC . 1 1 70 70 ALA CA C 13 . . 1 1 70 70 ALA C C 13 . -0.29 . . 0.50 . . . . . . . . . . . 27964 1 577 DCAC . 1 1 74 74 GLN CA C 13 . . 1 1 74 74 GLN C C 13 . -0.15 . . 0.50 . . . . . . . . . . . 27964 1 578 DCAC . 1 1 75 75 THR CA C 13 . . 1 1 75 75 THR C C 13 . 0.08 . . 0.50 . . . . . . . . . . . 27964 1 579 DCAC . 1 1 78 78 LEU CA C 13 . . 1 1 78 78 LEU C C 13 . -1.46 . . 0.50 . . . . . . . . . . . 27964 1 580 DCAC . 1 1 79 79 ARG CA C 13 . . 1 1 79 79 ARG C C 13 . -1.87 . . 0.50 . . . . . . . . . . . 27964 1 581 DCAC . 1 1 81 81 TRP CA C 13 . . 1 1 81 81 TRP C C 13 . -1.78 . . 0.50 . . . . . . . . . . . 27964 1 582 DCAC . 1 1 83 83 PRO CA C 13 . . 1 1 83 83 PRO C C 13 . -0.69 . . 0.50 . . . . . . . . . . . 27964 1 583 DCAC . 1 1 84 84 TYR CA C 13 . . 1 1 84 84 TYR C C 13 . -0.32 . . 0.50 . . . . . . . . . . . 27964 1 584 DCAC . 1 1 85 85 ASP CA C 13 . . 1 1 85 85 ASP C C 13 . -0.07 . . 0.50 . . . . . . . . . . . 27964 1 585 DCAC . 1 1 86 86 GLN CA C 13 . . 1 1 86 86 GLN C C 13 . -0.22 . . 0.50 . . . . . . . . . . . 27964 1 586 DCAC . 1 1 87 87 LEU CA C 13 . . 1 1 87 87 LEU C C 13 . -1.76 . . 0.50 . . . . . . . . . . . 27964 1 587 DCAC . 1 1 88 88 ASP CA C 13 . . 1 1 88 88 ASP C C 13 . -0.65 . . 0.50 . . . . . . . . . . . 27964 1 588 DCAC . 1 1 89 89 GLU CA C 13 . . 1 1 89 89 GLU C C 13 . -0.01 . . 0.50 . . . . . . . . . . . 27964 1 589 DCAC . 1 1 90 90 GLU CA C 13 . . 1 1 90 90 GLU C C 13 . -0.97 . . 0.50 . . . . . . . . . . . 27964 1 590 DCAC . 1 1 91 91 THR CA C 13 . . 1 1 91 91 THR C C 13 . -0.78 . . 0.50 . . . . . . . . . . . 27964 1 591 DCAC . 1 1 93 93 PRO CA C 13 . . 1 1 93 93 PRO C C 13 . -0.43 . . 0.50 . . . . . . . . . . . 27964 1 592 DCAC . 1 1 94 94 THR CA C 13 . . 1 1 94 94 THR C C 13 . -0.86 . . 0.50 . . . . . . . . . . . 27964 1 593 DCAC . 1 1 95 95 VAL CA C 13 . . 1 1 95 95 VAL C C 13 . -0.98 . . 0.50 . . . . . . . . . . . 27964 1 594 DCAC . 1 1 96 96 GLU CA C 13 . . 1 1 96 96 GLU C C 13 . -0.73 . . 0.50 . . . . . . . . . . . 27964 1 595 DCAC . 1 1 97 97 ALA CA C 13 . . 1 1 97 97 ALA C C 13 . -0.86 . . 0.50 . . . . . . . . . . . 27964 1 596 DCAC . 1 1 98 98 GLU CA C 13 . . 1 1 98 98 GLU C C 13 . -0.32 . . 0.50 . . . . . . . . . . . 27964 1 597 DCAC . 1 1 100 100 GLU CA C 13 . . 1 1 100 100 GLU C C 13 . -0.61 . . 0.50 . . . . . . . . . . . 27964 1 598 DCAC . 1 1 101 101 GLU CA C 13 . . 1 1 101 101 GLU C C 13 . -1.01 . . 0.50 . . . . . . . . . . . 27964 1 599 DCAC . 1 1 102 102 ALA CA C 13 . . 1 1 102 102 ALA C C 13 . -0.26 . . 0.50 . . . . . . . . . . . 27964 1 600 DCAC . 1 1 103 103 GLU CA C 13 . . 1 1 103 103 GLU C C 13 . -0.89 . . 0.50 . . . . . . . . . . . 27964 1 601 DCAC . 1 1 104 104 GLU CA C 13 . . 1 1 104 104 GLU C C 13 . -0.44 . . 0.50 . . . . . . . . . . . 27964 1 602 DCAC . 1 1 105 105 ALA CA C 13 . . 1 1 105 105 ALA C C 13 . -0.87 . . 0.50 . . . . . . . . . . . 27964 1 603 DCAC . 1 1 106 106 VAL CA C 13 . . 1 1 106 106 VAL C C 13 . -0.91 . . 0.50 . . . . . . . . . . . 27964 1 604 DCAC . 1 1 108 108 GLU CA C 13 . . 1 1 108 108 GLU C C 13 . -1.5 . . 0.50 . . . . . . . . . . . 27964 1 605 DCAC . 1 1 109 109 ASP CA C 13 . . 1 1 109 109 ASP C C 13 . -0.75 . . 0.50 . . . . . . . . . . . 27964 1 606 DCAC . 1 1 110 110 LEU CA C 13 . . 1 1 110 110 LEU C C 13 . -1.76 . . 0.50 . . . . . . . . . . . 27964 1 607 DCAC . 1 1 111 111 ASP CA C 13 . . 1 1 111 111 ASP C C 13 . -0.31 . . 0.50 . . . . . . . . . . . 27964 1 608 DCAC . 1 1 112 112 LEU CA C 13 . . 1 1 112 112 LEU C C 13 . -0.87 . . 0.50 . . . . . . . . . . . 27964 1 609 DCAC . 1 1 113 113 ASP CA C 13 . . 1 1 113 113 ASP C C 13 . -0.22 . . 0.50 . . . . . . . . . . . 27964 1 610 DCAC . 1 1 114 114 GLU CA C 13 . . 1 1 114 114 GLU C C 13 . -1.2 . . 0.50 . . . . . . . . . . . 27964 1 611 DCAC . 1 1 115 115 PHE CA C 13 . . 1 1 115 115 PHE C C 13 . -0.07 . . 0.50 . . . . . . . . . . . 27964 1 612 DCAC . 1 1 116 116 GLU CA C 13 . . 1 1 116 116 GLU C C 13 . -1.29 . . 0.50 . . . . . . . . . . . 27964 1 613 DCAC . 1 1 118 118 ILE CA C 13 . . 1 1 118 118 ILE C C 13 . -1.14 . . 0.50 . . . . . . . . . . . 27964 1 614 DCAC . 1 1 119 119 ASP CA C 13 . . 1 1 119 119 ASP C C 13 . -0.64 . . 0.50 . . . . . . . . . . . 27964 1 615 DCAC . 1 1 120 120 GLU CA C 13 . . 1 1 120 120 GLU C C 13 . -0.05 . . 0.50 . . . . . . . . . . . 27964 1 616 DCAC . 1 1 122 122 ASP CA C 13 . . 1 1 122 122 ASP C C 13 . -0.31 . . 0.50 . . . . . . . . . . . 27964 1 617 DCAC . 1 1 123 123 LEU CA C 13 . . 1 1 123 123 LEU C C 13 . -0.74 . . 0.50 . . . . . . . . . . . 27964 1 618 DCAC . 1 1 124 124 ASP CA C 13 . . 1 1 124 124 ASP C C 13 . -0.31 . . 0.50 . . . . . . . . . . . 27964 1 619 DCAC . 1 1 125 125 LEU CA C 13 . . 1 1 125 125 LEU C C 13 . -0.49 . . 0.50 . . . . . . . . . . . 27964 1 620 DCAC . 1 1 126 126 ASP CA C 13 . . 1 1 126 126 ASP C C 13 . -0.55 . . 0.50 . . . . . . . . . . . 27964 1 621 DCAC . 1 1 127 127 GLU CA C 13 . . 1 1 127 127 GLU C C 13 . -0.96 . . 0.50 . . . . . . . . . . . 27964 1 622 DCAC . 1 1 128 128 VAL CA C 13 . . 1 1 128 128 VAL C C 13 . -0.16 . . 0.50 . . . . . . . . . . . 27964 1 623 DCAC . 1 1 129 129 GLU CA C 13 . . 1 1 129 129 GLU C C 13 . -1.36 . . 0.50 . . . . . . . . . . . 27964 1 624 DCAC . 1 1 130 130 GLU CA C 13 . . 1 1 130 130 GLU C C 13 . -1.36 . . 0.50 . . . . . . . . . . . 27964 1 625 DCAC . 1 1 131 131 GLU CA C 13 . . 1 1 131 131 GLU C C 13 . -0.79 . . 0.50 . . . . . . . . . . . 27964 1 626 DCAC . 1 1 132 132 LEU CA C 13 . . 1 1 132 132 LEU C C 13 . -0.32 . . 0.50 . . . . . . . . . . . 27964 1 627 DCAC . 1 1 133 133 ASP CA C 13 . . 1 1 133 133 ASP C C 13 . -0.4 . . 0.50 . . . . . . . . . . . 27964 1 628 DCAC . 1 1 134 134 LEU CA C 13 . . 1 1 134 134 LEU C C 13 . -0.63 . . 0.50 . . . . . . . . . . . 27964 1 629 DCAC . 1 1 135 135 GLU CA C 13 . . 1 1 135 135 GLU C C 13 . -1.78 . . 0.50 . . . . . . . . . . . 27964 1 630 DCAC . 1 1 136 136 ALA CA C 13 . . 1 1 136 136 ALA C C 13 . -0.4 . . 0.50 . . . . . . . . . . . 27964 1 631 DCAC . 1 1 137 137 ASP CA C 13 . . 1 1 137 137 ASP C C 13 . -0.84 . . 0.50 . . . . . . . . . . . 27964 1 632 DCAC . 1 1 138 138 ASP CA C 13 . . 1 1 138 138 ASP C C 13 . -0.81 . . 0.50 . . . . . . . . . . . 27964 1 633 DCAC . 1 1 139 139 PHE CA C 13 . . 1 1 139 139 PHE C C 13 . -1.86 . . 0.50 . . . . . . . . . . . 27964 1 634 DCAC . 1 1 140 140 ASP CA C 13 . . 1 1 140 140 ASP C C 13 . -0.7 . . 0.50 . . . . . . . . . . . 27964 1 635 DCAC . 1 1 141 141 GLU CA C 13 . . 1 1 141 141 GLU C C 13 . -0.74 . . 0.50 . . . . . . . . . . . 27964 1 636 DCAC . 1 1 142 142 GLU CA C 13 . . 1 1 142 142 GLU C C 13 . -0.38 . . 0.50 . . . . . . . . . . . 27964 1 637 DCAC . 1 1 143 143 ASP CA C 13 . . 1 1 143 143 ASP C C 13 . -0.19 . . 0.50 . . . . . . . . . . . 27964 1 638 DCAC . 1 1 144 144 LEU CA C 13 . . 1 1 144 144 LEU C C 13 . -1.61 . . 0.50 . . . . . . . . . . . 27964 1 639 DCAC . 1 1 146 146 GLU CA C 13 . . 1 1 146 146 GLU C C 13 . -0.47 . . 0.50 . . . . . . . . . . . 27964 1 640 DCAC . 1 1 148 148 ASP CA C 13 . . 1 1 148 148 ASP C C 13 . -0.38 . . 0.50 . . . . . . . . . . . 27964 1 641 DCAC . 1 1 149 149 ASP CA C 13 . . 1 1 149 149 ASP C C 13 . -1.5 . . 0.50 . . . . . . . . . . . 27964 1 642 DCAC . 1 1 150 150 ASP CA C 13 . . 1 1 150 150 ASP C C 13 . -0.75 . . 0.50 . . . . . . . . . . . 27964 1 643 DCAC . 1 1 151 151 LEU CA C 13 . . 1 1 151 151 LEU C C 13 . -1.54 . . 0.50 . . . . . . . . . . . 27964 1 644 DCAC . 1 1 152 152 GLU CA C 13 . . 1 1 152 152 GLU C C 13 . -0.19 . . 0.50 . . . . . . . . . . . 27964 1 645 DCAC . 1 1 153 153 ILE CA C 13 . . 1 1 153 153 ILE C C 13 . -0.79 . . 0.50 . . . . . . . . . . . 27964 1 646 DCAC . 1 1 154 154 GLU CA C 13 . . 1 1 154 154 GLU C C 13 . 0.16 . . 0.50 . . . . . . . . . . . 27964 1 647 DCAC . 1 1 155 155 GLU CA C 13 . . 1 1 155 155 GLU C C 13 . -0.68 . . 0.50 . . . . . . . . . . . 27964 1 648 DCAC . 1 1 156 156 ASP CA C 13 . . 1 1 156 156 ASP C C 13 . -0.22 . . 0.50 . . . . . . . . . . . 27964 1 649 DCAC . 1 1 157 157 ILE CA C 13 . . 1 1 157 157 ILE C C 13 . -0.78 . . 0.50 . . . . . . . . . . . 27964 1 650 DCAC . 1 1 158 158 ILE CA C 13 . . 1 1 158 158 ILE C C 13 . -1.24 . . 0.50 . . . . . . . . . . . 27964 1 651 DCAC . 1 1 159 159 ASP CA C 13 . . 1 1 159 159 ASP C C 13 . -0.28 . . 0.50 . . . . . . . . . . . 27964 1 652 DCAC . 1 1 161 161 ASP CA C 13 . . 1 1 161 161 ASP C C 13 . -0.45 . . 0.50 . . . . . . . . . . . 27964 1 653 DCAC . 1 1 162 162 ASP CA C 13 . . 1 1 162 162 ASP C C 13 . -0.4 . . 0.50 . . . . . . . . . . . 27964 1 654 DCAC . 1 1 163 163 GLU CA C 13 . . 1 1 163 163 GLU C C 13 . -2.86 . . 0.50 . . . . . . . . . . . 27964 1 655 DCAC . 1 1 164 164 ASP CA C 13 . . 1 1 164 164 ASP C C 13 . 0.8 . . 0.50 . . . . . . . . . . . 27964 1 656 DCAC . 1 1 165 165 TYR CA C 13 . . 1 1 165 165 TYR C C 13 . -0.6 . . 0.50 . . . . . . . . . . . 27964 1 657 DCAC . 1 1 166 166 ASP CA C 13 . . 1 1 166 166 ASP C C 13 . -0.54 . . 0.50 . . . . . . . . . . . 27964 1 658 DCAC . 1 1 167 167 ASP CA C 13 . . 1 1 167 167 ASP C C 13 . -0.4 . . 0.50 . . . . . . . . . . . 27964 1 659 DCAC . 1 1 168 168 GLU CA C 13 . . 1 1 168 168 GLU C C 13 . 0 . . 0.50 . . . . . . . . . . . 27964 1 660 DCAC . 1 1 169 169 GLU CA C 13 . . 1 1 169 169 GLU C C 13 . -0.17 . . 0.50 . . . . . . . . . . . 27964 1 661 DCAC . 1 1 170 170 GLU CA C 13 . . 1 1 170 170 GLU C C 13 . 0.09 . . 0.50 . . . . . . . . . . . 27964 1 662 DCAC . 1 1 171 171 GLU CA C 13 . . 1 1 171 171 GLU C C 13 . -0.26 . . 0.50 . . . . . . . . . . . 27964 1 663 DCAC . 1 1 172 172 ILE CA C 13 . . 1 1 172 172 ILE C C 13 . 0.12 . . 0.50 . . . . . . . . . . . 27964 1 stop_ save_