data_16230 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16230 _Entry.Title ; Solution Structure of Yeast Prp24-RRM2 Bound to a Fragment of U6 RNA ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-03-27 _Entry.Accession_date 2009-03-27 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Stephen Martin-Tumasz . A . 16230 2 Samuel Butcher . E. . 16230 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'not applicable' 'not applicable' . 16230 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID Protein/RNA . 16230 RRM . 16230 snRNP . 16230 Splicing . 16230 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16230 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 367 16230 '15N chemical shifts' 91 16230 '1H chemical shifts' 642 16230 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 3 . . 2009-11-19 2009-03-27 update author 'add related PDB entry' 16230 2 . . 2009-11-13 2009-03-27 update BMRB 'complete entry citation' 16230 1 . . 2009-09-04 2009-03-27 original author 'original release' 16230 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 7070 'RRMs 1 and 2 of Prp24 from S. cerevisiae' 16230 PDB 2KH9 'BMRB Entry Tracking System' 16230 stop_ save_ ############### # Citations # ############### save_Peak_Assignment _Citation.Sf_category citations _Citation.Sf_framecode Peak_Assignment _Citation.Entry_ID 16230 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 19693704 _Citation.Full_citation . _Citation.Title '(1)H, (13)C and (15)N resonance assignments of a ribonucleoprotein complex consisting of Prp24-RRM2 bound to a fragment of U6 RNA.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol NMR Assign' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 3 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 227 _Citation.Page_last 230 _Citation.Year 2009 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Stephen Martin-Tumasz . . . 16230 1 2 Samuel Butcher . E. . 16230 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16230 _Assembly.ID 1 _Assembly.Name 'U6 snRNP (small fragment)' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 11838.821 _Assembly.Enzyme_commission_number . _Assembly.Details 'Prp24-RRM2 bound to AGAGAU from U6 snRNA' _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 Prp24-RRM2 1 $Prp24-RRM2 A . yes native no yes . . . 16230 1 2 AGAGAU 2 $AGAGAU B . yes native no yes . . . 16230 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 4 4 SG . 1 . 1 CYS 61 61 SG . . . . . . . . . . 16230 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Prp24-RRM2 _Entity.Sf_category entity _Entity.Sf_framecode Prp24-RRM2 _Entity.Entry_ID 16230 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Prp24-RRM2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MTECTLWMTNFPPSYTQRNI RDLLQDINVVALSIRLPSLR FNTSRRFAYIDVTSKEDARY CVEKLNGLKIEGYTLVTKVS NPLELEHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Final 8 residues are non-native due to 6x His tag' _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 92 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not reported' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 10012.586 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 16243 . Prp24-RRM23 . . . . . 91.30 186 100.00 100.00 1.05e-53 . . . . 16230 1 2 no BMRB 16244 . Prp24-RRM23 . . . . . 91.30 186 100.00 100.00 1.05e-53 . . . . 16230 1 3 no BMRB 16246 . Prp24-RRM2 . . . . . 100.00 92 100.00 100.00 2.47e-61 . . . . 16230 1 4 no PDB 2GHP . "Crystal Structure Of The N-Terminal 3 Rna Binding Domains Of The Yeast Splicing Factor Prp24" . . . . . 91.30 292 97.62 98.81 3.23e-51 . . . . 16230 1 5 no PDB 2GO9 . "Rrm Domains 1 And 2 Of Prp24 From S. Cerevisiae" . . . . . 91.30 161 98.81 100.00 2.83e-53 . . . . 16230 1 6 no PDB 2KH9 . "Solution Structure Of Yeast Prp24-Rrm2 Bound To A Fragment Of U6 Rna" . . . . . 100.00 92 100.00 100.00 2.47e-61 . . . . 16230 1 7 no PDB 4N0T . "Core Structure Of The U6 Small Nuclear Ribonucleoprotein At 1.7 Angstrom Resolution" . . . . . 91.30 374 98.81 100.00 2.48e-51 . . . . 16230 1 8 no DBJ GAA25719 . "K7_Prp24p [Saccharomyces cerevisiae Kyokai no. 7]" . . . . . 91.30 444 98.81 100.00 6.98e-51 . . . . 16230 1 9 no EMBL CAA89251 . "U6sNRPp [Saccharomyces cerevisiae]" . . . . . 91.30 444 98.81 100.00 5.72e-51 . . . . 16230 1 10 no EMBL CAY82100 . "Prp24p [Saccharomyces cerevisiae EC1118]" . . . . . 91.30 444 98.81 100.00 5.72e-51 . . . . 16230 1 11 no GB AAU09775 . "YMR268C [Saccharomyces cerevisiae]" . . . . . 90.22 444 98.80 100.00 3.18e-50 . . . . 16230 1 12 no GB AHY76723 . "Prp24p [Saccharomyces cerevisiae YJM993]" . . . . . 91.30 444 98.81 100.00 5.72e-51 . . . . 16230 1 13 no GB AJP40962 . "Prp24p [Saccharomyces cerevisiae YJM1078]" . . . . . 91.30 444 98.81 100.00 5.66e-51 . . . . 16230 1 14 no GB AJS62134 . "Prp24p [Saccharomyces cerevisiae YJM189]" . . . . . 91.30 444 98.81 100.00 5.72e-51 . . . . 16230 1 15 no GB AJS62569 . "Prp24p [Saccharomyces cerevisiae YJM193]" . . . . . 91.30 444 98.81 100.00 5.96e-51 . . . . 16230 1 16 no REF NP_013995 . "U6 snRNP complex subunit PRP24 [Saccharomyces cerevisiae S288c]" . . . . . 91.30 444 98.81 100.00 5.72e-51 . . . . 16230 1 17 no SP P49960 . "RecName: Full=U4/U6 snRNA-associated-splicing factor PRP24; Short=U4/U6 snRNP protein" . . . . . 91.30 444 98.81 100.00 5.72e-51 . . . . 16230 1 18 no TPG DAA10168 . "TPA: U6 snRNP complex subunit PRP24 [Saccharomyces cerevisiae S288c]" . . . . . 91.30 444 98.81 100.00 5.72e-51 . . . . 16230 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 16230 1 2 . THR . 16230 1 3 . GLU . 16230 1 4 . CYS . 16230 1 5 . THR . 16230 1 6 . LEU . 16230 1 7 . TRP . 16230 1 8 . MET . 16230 1 9 . THR . 16230 1 10 . ASN . 16230 1 11 . PHE . 16230 1 12 . PRO . 16230 1 13 . PRO . 16230 1 14 . SER . 16230 1 15 . TYR . 16230 1 16 . THR . 16230 1 17 . GLN . 16230 1 18 . ARG . 16230 1 19 . ASN . 16230 1 20 . ILE . 16230 1 21 . ARG . 16230 1 22 . ASP . 16230 1 23 . LEU . 16230 1 24 . LEU . 16230 1 25 . GLN . 16230 1 26 . ASP . 16230 1 27 . ILE . 16230 1 28 . ASN . 16230 1 29 . VAL . 16230 1 30 . VAL . 16230 1 31 . ALA . 16230 1 32 . LEU . 16230 1 33 . SER . 16230 1 34 . ILE . 16230 1 35 . ARG . 16230 1 36 . LEU . 16230 1 37 . PRO . 16230 1 38 . SER . 16230 1 39 . LEU . 16230 1 40 . ARG . 16230 1 41 . PHE . 16230 1 42 . ASN . 16230 1 43 . THR . 16230 1 44 . SER . 16230 1 45 . ARG . 16230 1 46 . ARG . 16230 1 47 . PHE . 16230 1 48 . ALA . 16230 1 49 . TYR . 16230 1 50 . ILE . 16230 1 51 . ASP . 16230 1 52 . VAL . 16230 1 53 . THR . 16230 1 54 . SER . 16230 1 55 . LYS . 16230 1 56 . GLU . 16230 1 57 . ASP . 16230 1 58 . ALA . 16230 1 59 . ARG . 16230 1 60 . TYR . 16230 1 61 . CYS . 16230 1 62 . VAL . 16230 1 63 . GLU . 16230 1 64 . LYS . 16230 1 65 . LEU . 16230 1 66 . ASN . 16230 1 67 . GLY . 16230 1 68 . LEU . 16230 1 69 . LYS . 16230 1 70 . ILE . 16230 1 71 . GLU . 16230 1 72 . GLY . 16230 1 73 . TYR . 16230 1 74 . THR . 16230 1 75 . LEU . 16230 1 76 . VAL . 16230 1 77 . THR . 16230 1 78 . LYS . 16230 1 79 . VAL . 16230 1 80 . SER . 16230 1 81 . ASN . 16230 1 82 . PRO . 16230 1 83 . LEU . 16230 1 84 . GLU . 16230 1 85 . LEU . 16230 1 86 . GLU . 16230 1 87 . HIS . 16230 1 88 . HIS . 16230 1 89 . HIS . 16230 1 90 . HIS . 16230 1 91 . HIS . 16230 1 92 . HIS . 16230 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 16230 1 . THR 2 2 16230 1 . GLU 3 3 16230 1 . CYS 4 4 16230 1 . THR 5 5 16230 1 . LEU 6 6 16230 1 . TRP 7 7 16230 1 . MET 8 8 16230 1 . THR 9 9 16230 1 . ASN 10 10 16230 1 . PHE 11 11 16230 1 . PRO 12 12 16230 1 . PRO 13 13 16230 1 . SER 14 14 16230 1 . TYR 15 15 16230 1 . THR 16 16 16230 1 . GLN 17 17 16230 1 . ARG 18 18 16230 1 . ASN 19 19 16230 1 . ILE 20 20 16230 1 . ARG 21 21 16230 1 . ASP 22 22 16230 1 . LEU 23 23 16230 1 . LEU 24 24 16230 1 . GLN 25 25 16230 1 . ASP 26 26 16230 1 . ILE 27 27 16230 1 . ASN 28 28 16230 1 . VAL 29 29 16230 1 . VAL 30 30 16230 1 . ALA 31 31 16230 1 . LEU 32 32 16230 1 . SER 33 33 16230 1 . ILE 34 34 16230 1 . ARG 35 35 16230 1 . LEU 36 36 16230 1 . PRO 37 37 16230 1 . SER 38 38 16230 1 . LEU 39 39 16230 1 . ARG 40 40 16230 1 . PHE 41 41 16230 1 . ASN 42 42 16230 1 . THR 43 43 16230 1 . SER 44 44 16230 1 . ARG 45 45 16230 1 . ARG 46 46 16230 1 . PHE 47 47 16230 1 . ALA 48 48 16230 1 . TYR 49 49 16230 1 . ILE 50 50 16230 1 . ASP 51 51 16230 1 . VAL 52 52 16230 1 . THR 53 53 16230 1 . SER 54 54 16230 1 . LYS 55 55 16230 1 . GLU 56 56 16230 1 . ASP 57 57 16230 1 . ALA 58 58 16230 1 . ARG 59 59 16230 1 . TYR 60 60 16230 1 . CYS 61 61 16230 1 . VAL 62 62 16230 1 . GLU 63 63 16230 1 . LYS 64 64 16230 1 . LEU 65 65 16230 1 . ASN 66 66 16230 1 . GLY 67 67 16230 1 . LEU 68 68 16230 1 . LYS 69 69 16230 1 . ILE 70 70 16230 1 . GLU 71 71 16230 1 . GLY 72 72 16230 1 . TYR 73 73 16230 1 . THR 74 74 16230 1 . LEU 75 75 16230 1 . VAL 76 76 16230 1 . THR 77 77 16230 1 . LYS 78 78 16230 1 . VAL 79 79 16230 1 . SER 80 80 16230 1 . ASN 81 81 16230 1 . PRO 82 82 16230 1 . LEU 83 83 16230 1 . GLU 84 84 16230 1 . LEU 85 85 16230 1 . GLU 86 86 16230 1 . HIS 87 87 16230 1 . HIS 88 88 16230 1 . HIS 89 89 16230 1 . HIS 90 90 16230 1 . HIS 91 91 16230 1 . HIS 92 92 16230 1 stop_ save_ save_AGAGAU _Entity.Sf_category entity _Entity.Sf_framecode AGAGAU _Entity.Entry_ID 16230 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name AGAGAU _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code AGAGAU _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 6 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method syn _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 1826.235 _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 . A . 16230 2 2 . G . 16230 2 3 . A . 16230 2 4 . G . 16230 2 5 . A . 16230 2 6 . U . 16230 2 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 . A 1 1 16230 2 . G 2 2 16230 2 . A 3 3 16230 2 . G 4 4 16230 2 . A 5 5 16230 2 . U 6 6 16230 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 16230 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Prp24-RRM2 . 4932 organism . 'Saccharomyces cerevisiae' yeast . . Eukaryota Fungi Saccharomyces cerevisiae . . . . . . . . . . . . . . . . . . . . . 16230 1 2 2 $AGAGAU . 4932 organism . 'Saccharomyces cerevisiae' yeast . . Eukaryota Fungi Saccharomyces cerevisiae . . . . . . . . . . . . . . . . . . . . . 16230 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 16230 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Prp24-RRM2 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 . . . . . . . . . . . . . . . pET21-b . . . . . . 16230 1 2 2 $AGAGAU . 'obtained from a vendor' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 16230 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_Unlabeled _Sample.Sf_category sample _Sample.Sf_framecode Unlabeled _Sample.Entry_ID 16230 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Prp24-RRM2 'natural abundance' . . 1 $Prp24-RRM2 . . 300 . . uM . . . . 16230 1 2 AGAGAU 'natural abundance' . . 2 $AGAGAU . . 3 . . mM . . . . 16230 1 3 TRIS [U-2H] . . . . . . 10 . . mM . . . . 16230 1 4 'potassium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 16230 1 5 D20 'natural abundance' . . . . . . 100 . . % . . . . 16230 1 stop_ save_ save_Fully_Labeled_D2O _Sample.Sf_category sample _Sample.Sf_framecode Fully_Labeled_D2O _Sample.Entry_ID 16230 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Prp24-RRM2 '[U-99% 15N]' . . 1 $Prp24-RRM2 . . 500 . . uM . . . . 16230 2 2 AGAGAU 'natural abundance' . . 2 $AGAGAU . . 5 . . mM . . . . 16230 2 3 TRIS [U-2H] . . . . . . 10 . . mM . . . . 16230 2 4 'potassium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 16230 2 5 D20 'natural abundance' . . . . . . 100 . . % . . . . 16230 2 stop_ save_ save_Fully_Labeled _Sample.Sf_category sample _Sample.Sf_framecode Fully_Labeled _Sample.Entry_ID 16230 _Sample.ID 3 _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 Prp24-RRM2 '[U-99% 13C; U-99% 15N]' . . 1 $Prp24-RRM2 . . 500 . . mM . . . . 16230 3 2 AGAGAU 'natural abundance' . . 2 $AGAGAU . . 5 . . mM . . . . 16230 3 3 TRIS 'natural abundance' . . . . . . 10 . . mM . . . . 16230 3 4 'potassium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 16230 3 5 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 16230 3 6 H20 'natural abundance' . . . . . . 90 . . % . . . . 16230 3 7 D20 'natural abundance' . . . . . . 10 . . % . . . . 16230 3 stop_ save_ save_Referencing _Sample.Sf_category sample _Sample.Sf_framecode Referencing _Sample.Entry_ID 16230 _Sample.ID 4 _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 Prp24-RRM2 '[U-99% 13C; U-99% 15N]' . . 1 $Prp24-RRM2 . . 500 . . uM . . . . 16230 4 2 AGAGAU 'natural abundance' . . 2 $AGAGAU . . 5 . . mM . . . . 16230 4 3 TRIS 'natural abundance' . . . . . . 10 . . mM . . . . 16230 4 4 'potassium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 16230 4 5 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 16230 4 6 DSS 'natural abundance' . . . . . . 10 . . uM . . . . 16230 4 7 H20 'natural abundance' . . . . . . 90 . . % . . . . 16230 4 8 D20 'natural abundance' . . . . . . 10 . . % . . . . 16230 4 stop_ save_ save_Aligned _Sample.Sf_category sample _Sample.Sf_framecode Aligned _Sample.Entry_ID 16230 _Sample.ID 5 _Sample.Type bicelle _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 Prp24-RRM2 '[U-99% 13C; U-99% 15N]' . . 1 $Prp24-RRM2 . . 300 . . uM . . . . 16230 5 2 AGAGAU 'natural abundance' . . 2 $AGAGAU . . 3 . . mM . . . . 16230 5 3 TRIS 'natural abundance' . . . . . . 10 . . mM . . . . 16230 5 4 'potassium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 16230 5 5 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 16230 5 6 'DMPC/DHPC 3:1' 'natural abundance' . . . . . . 6.5 . . % . . . . 16230 5 7 H20 'natural abundance' . . . . . . 90 . . % . . . . 16230 5 8 D20 'natural abundance' . . . . . . 10 . . % . . . . 16230 5 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 16230 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 50 . mM 16230 1 pH 7 . pH 16230 1 pressure 1.0 . atm 16230 1 temperature 298.15 . K 16230 1 stop_ save_ ############################ # Computer software used # ############################ save_AMBER _Software.Sf_category software _Software.Sf_framecode AMBER _Software.Entry_ID 16230 _Software.ID 1 _Software.Name AMBER _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollm' . . 16230 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 16230 1 stop_ save_ save_xwinnmr _Software.Sf_category software _Software.Sf_framecode xwinnmr _Software.Entry_ID 16230 _Software.ID 2 _Software.Name xwinnmr _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 16230 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 16230 2 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 16230 _Software.ID 3 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 16230 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 16230 3 stop_ save_ save_NMRDraw _Software.Sf_category software _Software.Sf_framecode NMRDraw _Software.Entry_ID 16230 _Software.ID 4 _Software.Name NMRDraw _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 16230 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 16230 4 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 16230 _Software.ID 5 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 16230 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 16230 5 'peak picking' 16230 5 stop_ save_ save_AtnosCandid _Software.Sf_category software _Software.Sf_framecode AtnosCandid _Software.Entry_ID 16230 _Software.ID 6 _Software.Name ATHNOS-CANDID _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Herrmann, T; Guentert, P; Wuethrich, K' . . 16230 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 16230 6 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 16230 _Software.ID 7 _Software.Name CNS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 16230 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 16230 7 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 16230 _Software.ID 8 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 16230 8 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 16230 8 stop_ save_ save_HADDOCK _Software.Sf_category software _Software.Sf_framecode HADDOCK _Software.Entry_ID 16230 _Software.ID 9 _Software.Name HADDOCK _Software.Version 2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Dominguez, C; Boelens, R; Bonvin, A M M J' . . 16230 9 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 16230 9 'structure solution' 16230 9 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600 _NMR_spectrometer.Entry_ID 16230 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_750 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 750 _NMR_spectrometer.Entry_ID 16230 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_900 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 900 _NMR_spectrometer.Entry_ID 16230 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_800 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 800 _NMR_spectrometer.Entry_ID 16230 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 16230 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 600 Varian INOVA . 600 . . . 16230 1 2 750 Bruker DMX . 750 . . . 16230 1 3 900 Varian INOVA . 900 . . . 16230 1 4 800 Varian INOVA . 800 . . . 16230 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 16230 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-13C HSQC' no . . . . . . . . . . 4 $Referencing isotropic . . 1 $sample_conditions_1 . . . 2 $750 . . . . . . . . . . . . . . . . 16230 1 2 '2D 1H-15N HSQC' no . . . . . . . . . . 3 $Fully_Labeled isotropic . . 1 $sample_conditions_1 . . . 1 $600 . . . . . . . . . . . . . . . . 16230 1 3 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $Fully_Labeled_D2O isotropic . . 1 $sample_conditions_1 . . . 3 $900 . . . . . . . . . . . . . . . . 16230 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 3 $Fully_Labeled isotropic . . 1 $sample_conditions_1 . . . 1 $600 . . . . . . . . . . . . . . . . 16230 1 5 '3D C(CO)NH' no . . . . . . . . . . 3 $Fully_Labeled isotropic . . 1 $sample_conditions_1 . . . 1 $600 . . . . . . . . . . . . . . . . 16230 1 6 '3D HNCO' no . . . . . . . . . . 3 $Fully_Labeled isotropic . . 1 $sample_conditions_1 . . . 1 $600 . . . . . . . . . . . . . . . . 16230 1 7 '3D HNCACB' no . . . . . . . . . . 3 $Fully_Labeled isotropic . . 1 $sample_conditions_1 . . . 1 $600 . . . . . . . . . . . . . . . . 16230 1 8 '3D HBHA(CO)NH' no . . . . . . . . . . 3 $Fully_Labeled isotropic . . 1 $sample_conditions_1 . . . 1 $600 . . . . . . . . . . . . . . . . 16230 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 3 $Fully_Labeled isotropic . . 1 $sample_conditions_1 . . . 1 $600 . . . . . . . . . . . . . . . . 16230 1 10 '3D 1H-15N NOESY' no . . . . . . . . . . 3 $Fully_Labeled isotropic . . 1 $sample_conditions_1 . . . 3 $900 . . . . . . . . . . . . . . . . 16230 1 11 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $Fully_Labeled_D2O isotropic . . 1 $sample_conditions_1 . . . 3 $900 . . . . . . . . . . . . . . . . 16230 1 12 '2D 1H-1H NOESY' no . . . . . . . . . . 2 $Fully_Labeled_D2O isotropic . . 1 $sample_conditions_1 . . . 3 $900 . . . . . . . . . . . . . . . . 16230 1 13 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $Unlabeled isotropic . . 1 $sample_conditions_1 . . . 3 $900 . . . . . . . . . . . . . . . . 16230 1 14 '2D 1H-15N HSQC-IPAP' no . . . . . . . . . . 3 $Fully_Labeled isotropic . . 1 $sample_conditions_1 . . . 2 $750 . . . . . . . . . . . . . . . . 16230 1 15 '2D 1H-15N HSQC-IPAP' no . . . . . . . . . . 5 $Aligned anisotropic . . 1 $sample_conditions_1 . . . 2 $750 . . . . . . . . . . . . . . . . 16230 1 16 '3D J modulated CHSQC' no . . . . . . . . . . 3 $Fully_Labeled isotropic . . 1 $sample_conditions_1 . . . 2 $750 . . . . . . . . . . . . . . . . 16230 1 17 '3D J modulated CHSQC' no . . . . . . . . . . 5 $Aligned isotropic . . 1 $sample_conditions_1 . . . 2 $750 . . . . . . . . . . . . . . . . 16230 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 16230 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 16230 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 16230 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 16230 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 16230 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.4 _Assigned_chem_shift_list.Chem_shift_15N_err 0.4 _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 2 '2D 1H-15N HSQC' . . . 16230 1 3 '2D 1H-13C HSQC' . . . 16230 1 4 '3D CBCA(CO)NH' . . . 16230 1 5 '3D C(CO)NH' . . . 16230 1 6 '3D HNCO' . . . 16230 1 7 '3D HNCACB' . . . 16230 1 8 '3D HBHA(CO)NH' . . . 16230 1 9 '3D HCCH-TOCSY' . . . 16230 1 10 '3D 1H-15N NOESY' . . . 16230 1 11 '3D 1H-13C NOESY' . . . 16230 1 12 '2D 1H-1H NOESY' . . . 16230 1 13 '2D 1H-1H NOESY' . . . 16230 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 5 $SPARKY . . 16230 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET C C 13 177.466 0.4 . 1 . . . . 114 MET CO . 16230 1 2 . 1 1 2 2 THR H H 1 8.415 0.02 . 1 . . . . 115 THR HN . 16230 1 3 . 1 1 2 2 THR HA H 1 4.465 0.02 . 1 . . . . 115 THR HA . 16230 1 4 . 1 1 2 2 THR HB H 1 4.332 0.02 . 1 . . . . 115 THR HB . 16230 1 5 . 1 1 2 2 THR HG21 H 1 1.293 0.02 . 1 . . . . 115 THR HG . 16230 1 6 . 1 1 2 2 THR HG22 H 1 1.293 0.02 . 1 . . . . 115 THR HG . 16230 1 7 . 1 1 2 2 THR HG23 H 1 1.293 0.02 . 1 . . . . 115 THR HG . 16230 1 8 . 1 1 2 2 THR C C 13 174.437 0.4 . 1 . . . . 115 THR CO . 16230 1 9 . 1 1 2 2 THR CA C 13 62.472 0.4 . 1 . . . . 115 THR CA . 16230 1 10 . 1 1 2 2 THR CB C 13 70.329 0.4 . 1 . . . . 115 THR CB . 16230 1 11 . 1 1 2 2 THR CG2 C 13 22.071 0.4 . 1 . . . . 115 THR CG . 16230 1 12 . 1 1 2 2 THR N N 15 120.586 0.4 . 1 . . . . 115 THR N . 16230 1 13 . 1 1 3 3 GLU H H 1 8.748 0.02 . 1 . . . . 116 GLU HN . 16230 1 14 . 1 1 3 3 GLU HA H 1 4.301 0.02 . 1 . . . . 116 GLU HA . 16230 1 15 . 1 1 3 3 GLU HB2 H 1 2.229 0.02 . 2 . . . . 116 GLU HB . 16230 1 16 . 1 1 3 3 GLU HB3 H 1 2.229 0.02 . 2 . . . . 116 GLU HB . 16230 1 17 . 1 1 3 3 GLU HG2 H 1 2.316 0.02 . 2 . . . . 116 GLU HG . 16230 1 18 . 1 1 3 3 GLU HG3 H 1 2.316 0.02 . 2 . . . . 116 GLU HG . 16230 1 19 . 1 1 3 3 GLU C C 13 175.675 0.4 . 1 . . . . 116 GLU CO . 16230 1 20 . 1 1 3 3 GLU CA C 13 58.073 0.4 . 1 . . . . 116 GLU CA . 16230 1 21 . 1 1 3 3 GLU CB C 13 29.779 0.4 . 1 . . . . 116 GLU CB . 16230 1 22 . 1 1 3 3 GLU CG C 13 37.243 0.4 . 1 . . . . 116 GLU CG . 16230 1 23 . 1 1 3 3 GLU N N 15 120.309 0.4 . 1 . . . . 116 GLU N . 16230 1 24 . 1 1 4 4 CYS H H 1 8.02 0.02 . 1 . . . . 117 CYS HN . 16230 1 25 . 1 1 4 4 CYS HA H 1 4.606 0.02 . 1 . . . . 117 CYS HA . 16230 1 26 . 1 1 4 4 CYS HB2 H 1 2.738 0.02 . 2 . . . . 117 CYS HB2 . 16230 1 27 . 1 1 4 4 CYS HB3 H 1 2.977 0.02 . 2 . . . . 117 CYS HB3 . 16230 1 28 . 1 1 4 4 CYS C C 13 172.966 0.4 . 1 . . . . 117 CYS CO . 16230 1 29 . 1 1 4 4 CYS CA C 13 58.592 0.4 . 1 . . . . 117 CYS CA . 16230 1 30 . 1 1 4 4 CYS CB C 13 29.441 0.4 . 1 . . . . 117 CYS CB . 16230 1 31 . 1 1 4 4 CYS N N 15 115.129 0.4 . 1 . . . . 117 CYS N . 16230 1 32 . 1 1 5 5 THR H H 1 8.328 0.02 . 1 . . . . 118 THR HN . 16230 1 33 . 1 1 5 5 THR HA H 1 5.592 0.02 . 1 . . . . 118 THR HA . 16230 1 34 . 1 1 5 5 THR HB H 1 3.951 0.02 . 1 . . . . 118 THR HB . 16230 1 35 . 1 1 5 5 THR HG21 H 1 1.535 0.02 . 1 . . . . 118 THR HG . 16230 1 36 . 1 1 5 5 THR HG22 H 1 1.535 0.02 . 1 . . . . 118 THR HG . 16230 1 37 . 1 1 5 5 THR HG23 H 1 1.535 0.02 . 1 . . . . 118 THR HG . 16230 1 38 . 1 1 5 5 THR C C 13 173.849 0.4 . 1 . . . . 118 THR CO . 16230 1 39 . 1 1 5 5 THR CA C 13 62.432 0.4 . 1 . . . . 118 THR CA . 16230 1 40 . 1 1 5 5 THR CB C 13 71.829 0.4 . 1 . . . . 118 THR CB . 16230 1 41 . 1 1 5 5 THR CG2 C 13 22.826 0.4 . 1 . . . . 118 THR CG . 16230 1 42 . 1 1 5 5 THR N N 15 119.21 0.4 . 1 . . . . 118 THR N . 16230 1 43 . 1 1 6 6 LEU H H 1 10.076 0.02 . 1 . . . . 119 LEU HN . 16230 1 44 . 1 1 6 6 LEU HA H 1 5.129 0.02 . 1 . . . . 119 LEU HA . 16230 1 45 . 1 1 6 6 LEU HB2 H 1 1.427 0.02 . 2 . . . . 119 LEU HB2 . 16230 1 46 . 1 1 6 6 LEU HB3 H 1 1.869 0.02 . 2 . . . . 119 LEU HB3 . 16230 1 47 . 1 1 6 6 LEU HD11 H 1 0.875 0.02 . 2 . . . . 119 LEU HD1 . 16230 1 48 . 1 1 6 6 LEU HD12 H 1 0.875 0.02 . 2 . . . . 119 LEU HD1 . 16230 1 49 . 1 1 6 6 LEU HD13 H 1 0.875 0.02 . 2 . . . . 119 LEU HD1 . 16230 1 50 . 1 1 6 6 LEU HD21 H 1 0.91 0.02 . 2 . . . . 119 LEU HD2 . 16230 1 51 . 1 1 6 6 LEU HD22 H 1 0.91 0.02 . 2 . . . . 119 LEU HD2 . 16230 1 52 . 1 1 6 6 LEU HD23 H 1 0.91 0.02 . 2 . . . . 119 LEU HD2 . 16230 1 53 . 1 1 6 6 LEU HG H 1 0.885 0.02 . 1 . . . . 119 LEU HG . 16230 1 54 . 1 1 6 6 LEU C C 13 175.211 0.4 . 1 . . . . 119 LEU CO . 16230 1 55 . 1 1 6 6 LEU CA C 13 53.455 0.4 . 1 . . . . 119 LEU CA . 16230 1 56 . 1 1 6 6 LEU CB C 13 45.387 0.4 . 1 . . . . 119 LEU CB . 16230 1 57 . 1 1 6 6 LEU CD1 C 13 25.103 0.4 . 2 . . . . 119 LEU CD1 . 16230 1 58 . 1 1 6 6 LEU CD2 C 13 25.341 0.4 . 2 . . . . 119 LEU CD2 . 16230 1 59 . 1 1 6 6 LEU CG C 13 26.679 0.4 . 1 . . . . 119 LEU CG . 16230 1 60 . 1 1 6 6 LEU N N 15 126.798 0.4 . 1 . . . . 119 LEU N . 16230 1 61 . 1 1 7 7 TRP H H 1 9.346 0.02 . 1 . . . . 120 TRP HN . 16230 1 62 . 1 1 7 7 TRP HA H 1 5.314 0.02 . 1 . . . . 120 TRP HA . 16230 1 63 . 1 1 7 7 TRP HB2 H 1 2.764 0.02 . 2 . . . . 120 TRP HB . 16230 1 64 . 1 1 7 7 TRP HB3 H 1 2.764 0.02 . 2 . . . . 120 TRP HB . 16230 1 65 . 1 1 7 7 TRP HD1 H 1 6.585 0.02 . 1 . . . . 120 TRP HD1 . 16230 1 66 . 1 1 7 7 TRP HE3 H 1 6.815 0.02 . 1 . . . . 120 TRP HE3 . 16230 1 67 . 1 1 7 7 TRP HZ3 H 1 6.964 0.02 . 1 . . . . 120 TRP HZ3 . 16230 1 68 . 1 1 7 7 TRP C C 13 174.476 0.4 . 1 . . . . 120 TRP CO . 16230 1 69 . 1 1 7 7 TRP CA C 13 56.423 0.4 . 1 . . . . 120 TRP CA . 16230 1 70 . 1 1 7 7 TRP CB C 13 32.344 0.4 . 1 . . . . 120 TRP CB . 16230 1 71 . 1 1 7 7 TRP N N 15 122.304 0.4 . 1 . . . . 120 TRP N . 16230 1 72 . 1 1 8 8 MET H H 1 8.513 0.02 . 1 . . . . 121 MET HN . 16230 1 73 . 1 1 8 8 MET HA H 1 5.418 0.02 . 1 . . . . 121 MET HA . 16230 1 74 . 1 1 8 8 MET HB2 H 1 1.728 0.02 . 2 . . . . 121 MET HB . 16230 1 75 . 1 1 8 8 MET HB3 H 1 1.728 0.02 . 2 . . . . 121 MET HB . 16230 1 76 . 1 1 8 8 MET HG2 H 1 2.324 0.02 . 2 . . . . 121 MET HG2 . 16230 1 77 . 1 1 8 8 MET HG3 H 1 2.451 0.02 . 2 . . . . 121 MET HG3 . 16230 1 78 . 1 1 8 8 MET C C 13 174.442 0.4 . 1 . . . . 121 MET CO . 16230 1 79 . 1 1 8 8 MET CA C 13 53.419 0.4 . 1 . . . . 121 MET CA . 16230 1 80 . 1 1 8 8 MET CB C 13 39.288 0.4 . 1 . . . . 121 MET CB . 16230 1 81 . 1 1 8 8 MET CG C 13 31.904 0.4 . 1 . . . . 121 MET CG . 16230 1 82 . 1 1 8 8 MET N N 15 124.864 0.4 . 1 . . . . 121 MET N . 16230 1 83 . 1 1 9 9 THR H H 1 8.548 0.02 . 1 . . . . 122 THR HN . 16230 1 84 . 1 1 9 9 THR HA H 1 4.259 0.02 . 1 . . . . 122 THR HA . 16230 1 85 . 1 1 9 9 THR HB H 1 3.028 0.02 . 1 . . . . 122 THR HB . 16230 1 86 . 1 1 9 9 THR HG21 H 1 0.623 0.02 . 1 . . . . 122 THR HG . 16230 1 87 . 1 1 9 9 THR HG22 H 1 0.623 0.02 . 1 . . . . 122 THR HG . 16230 1 88 . 1 1 9 9 THR HG23 H 1 0.623 0.02 . 1 . . . . 122 THR HG . 16230 1 89 . 1 1 9 9 THR C C 13 171.239 0.4 . 1 . . . . 122 THR CO . 16230 1 90 . 1 1 9 9 THR CA C 13 60.312 0.4 . 1 . . . . 122 THR CA . 16230 1 91 . 1 1 9 9 THR CB C 13 69.945 0.4 . 1 . . . . 122 THR CB . 16230 1 92 . 1 1 9 9 THR CG2 C 13 19.138 0.4 . 1 . . . . 122 THR CG . 16230 1 93 . 1 1 9 9 THR N N 15 115.676 0.4 . 1 . . . . 122 THR N . 16230 1 94 . 1 1 10 10 ASN H H 1 7.982 0.02 . 1 . . . . 123 ASN HN . 16230 1 95 . 1 1 10 10 ASN HA H 1 4.088 0.02 . 1 . . . . 123 ASN HA . 16230 1 96 . 1 1 10 10 ASN HB2 H 1 2.566 0.02 . 2 . . . . 123 ASN HB2 . 16230 1 97 . 1 1 10 10 ASN HB3 H 1 3.689 0.02 . 2 . . . . 123 ASN HB3 . 16230 1 98 . 1 1 10 10 ASN HD21 H 1 6.996 0.02 . 2 . . . . 123 ASN HD21 . 16230 1 99 . 1 1 10 10 ASN HD22 H 1 7.96 0.02 . 2 . . . . 123 ASN HD22 . 16230 1 100 . 1 1 10 10 ASN C C 13 172.443 0.4 . 1 . . . . 123 ASN CO . 16230 1 101 . 1 1 10 10 ASN CA C 13 54.35 0.4 . 1 . . . . 123 ASN CA . 16230 1 102 . 1 1 10 10 ASN CB C 13 38.34 0.4 . 1 . . . . 123 ASN CB . 16230 1 103 . 1 1 10 10 ASN N N 15 118.728 0.4 . 1 . . . . 123 ASN N . 16230 1 104 . 1 1 10 10 ASN ND2 N 15 112.309 0.4 . 1 . . . . 123 ASN ND . 16230 1 105 . 1 1 11 11 PHE H H 1 6.015 0.02 . 1 . . . . 124 PHE HN . 16230 1 106 . 1 1 11 11 PHE HA H 1 4.512 0.02 . 1 . . . . 124 PHE HA . 16230 1 107 . 1 1 11 11 PHE HB2 H 1 2.368 0.02 . 2 . . . . 124 PHE HB2 . 16230 1 108 . 1 1 11 11 PHE HB3 H 1 2.484 0.02 . 2 . . . . 124 PHE HB3 . 16230 1 109 . 1 1 11 11 PHE HD1 H 1 6.708 0.02 . 3 . . . . 124 PHE HD . 16230 1 110 . 1 1 11 11 PHE HD2 H 1 6.708 0.02 . 3 . . . . 124 PHE HD . 16230 1 111 . 1 1 11 11 PHE HE1 H 1 6.93 0.02 . 3 . . . . 124 PHE HE . 16230 1 112 . 1 1 11 11 PHE HE2 H 1 6.93 0.02 . 3 . . . . 124 PHE HE . 16230 1 113 . 1 1 11 11 PHE CA C 13 52.191 0.4 . 1 . . . . 124 PHE CA . 16230 1 114 . 1 1 11 11 PHE CB C 13 37.409 0.4 . 1 . . . . 124 PHE CB . 16230 1 115 . 1 1 11 11 PHE N N 15 108.331 0.4 . 1 . . . . 124 PHE N . 16230 1 116 . 1 1 12 12 PRO HB2 H 1 1.988 0.02 . 2 . . . . 125 PRO HB2 . 16230 1 117 . 1 1 12 12 PRO HB3 H 1 1.999 0.02 . 2 . . . . 125 PRO HB3 . 16230 1 118 . 1 1 12 12 PRO HD2 H 1 2.018 0.02 . 2 . . . . 125 PRO HD2 . 16230 1 119 . 1 1 12 12 PRO HD3 H 1 3.047 0.02 . 2 . . . . 125 PRO HD3 . 16230 1 120 . 1 1 12 12 PRO HG2 H 1 1.425 0.02 . 2 . . . . 125 PRO HG2 . 16230 1 121 . 1 1 12 12 PRO HG3 H 1 1.496 0.02 . 2 . . . . 125 PRO HG3 . 16230 1 122 . 1 1 12 12 PRO CB C 13 27.685 0.4 . 1 . . . . 125 PRO CB . 16230 1 123 . 1 1 12 12 PRO CD C 13 49.619 0.4 . 1 . . . . 125 PRO CD . 16230 1 124 . 1 1 12 12 PRO CG C 13 27.291 0.4 . 1 . . . . 125 PRO CG . 16230 1 125 . 1 1 13 13 PRO HA H 1 4.232 0.02 . 1 . . . . 126 PRO HA . 16230 1 126 . 1 1 13 13 PRO HB2 H 1 2.002 0.02 . 2 . . . . 126 PRO HB2 . 16230 1 127 . 1 1 13 13 PRO HB3 H 1 2.272 0.02 . 2 . . . . 126 PRO HB3 . 16230 1 128 . 1 1 13 13 PRO HD2 H 1 3.235 0.02 . 2 . . . . 126 PRO HD2 . 16230 1 129 . 1 1 13 13 PRO HD3 H 1 3.585 0.02 . 2 . . . . 126 PRO HD3 . 16230 1 130 . 1 1 13 13 PRO HG2 H 1 2.037 0.02 . 2 . . . . 126 PRO HG2 . 16230 1 131 . 1 1 13 13 PRO HG3 H 1 2.075 0.02 . 2 . . . . 126 PRO HG3 . 16230 1 132 . 1 1 13 13 PRO C C 13 177.033 0.4 . 1 . . . . 126 PRO CO . 16230 1 133 . 1 1 13 13 PRO CA C 13 64.994 0.4 . 1 . . . . 126 PRO CA . 16230 1 134 . 1 1 13 13 PRO CB C 13 32.074 0.4 . 1 . . . . 126 PRO CB . 16230 1 135 . 1 1 13 13 PRO CD C 13 51.855 0.4 . 1 . . . . 126 PRO CD . 16230 1 136 . 1 1 13 13 PRO CG C 13 27.526 0.4 . 1 . . . . 126 PRO CG . 16230 1 137 . 1 1 14 14 SER H H 1 7.569 0.02 . 1 . . . . 127 SER HN . 16230 1 138 . 1 1 14 14 SER HA H 1 4.342 0.02 . 1 . . . . 127 SER HA . 16230 1 139 . 1 1 14 14 SER HB2 H 1 3.892 0.02 . 2 . . . . 127 SER HB2 . 16230 1 140 . 1 1 14 14 SER HB3 H 1 4.134 0.02 . 2 . . . . 127 SER HB3 . 16230 1 141 . 1 1 14 14 SER C C 13 175.662 0.4 . 1 . . . . 127 SER CO . 16230 1 142 . 1 1 14 14 SER CA C 13 58.474 0.4 . 1 . . . . 127 SER CA . 16230 1 143 . 1 1 14 14 SER CB C 13 63.556 0.4 . 1 . . . . 127 SER CB . 16230 1 144 . 1 1 14 14 SER N N 15 108.947 0.4 . 1 . . . . 127 SER N . 16230 1 145 . 1 1 15 15 TYR H H 1 8.03 0.02 . 1 . . . . 128 TYR HN . 16230 1 146 . 1 1 15 15 TYR HA H 1 4.523 0.02 . 1 . . . . 128 TYR HA . 16230 1 147 . 1 1 15 15 TYR HB2 H 1 2.35 0.02 . 2 . . . . 128 TYR HB2 . 16230 1 148 . 1 1 15 15 TYR HB3 H 1 3.588 0.02 . 2 . . . . 128 TYR HB3 . 16230 1 149 . 1 1 15 15 TYR HD1 H 1 6.642 0.02 . 3 . . . . 128 TYR HD . 16230 1 150 . 1 1 15 15 TYR HD2 H 1 6.642 0.02 . 3 . . . . 128 TYR HD . 16230 1 151 . 1 1 15 15 TYR HE1 H 1 7.004 0.02 . 3 . . . . 128 TYR HE . 16230 1 152 . 1 1 15 15 TYR HE2 H 1 7.004 0.02 . 3 . . . . 128 TYR HE . 16230 1 153 . 1 1 15 15 TYR C C 13 177.025 0.4 . 1 . . . . 128 TYR CO . 16230 1 154 . 1 1 15 15 TYR CA C 13 58.877 0.4 . 1 . . . . 128 TYR CA . 16230 1 155 . 1 1 15 15 TYR CB C 13 38.631 0.4 . 1 . . . . 128 TYR CB . 16230 1 156 . 1 1 15 15 TYR N N 15 124.193 0.4 . 1 . . . . 128 TYR N . 16230 1 157 . 1 1 16 16 THR H H 1 8.777 0.02 . 1 . . . . 129 THR HN . 16230 1 158 . 1 1 16 16 THR HA H 1 4.564 0.02 . 1 . . . . 129 THR HA . 16230 1 159 . 1 1 16 16 THR HB H 1 4.638 0.02 . 1 . . . . 129 THR HB . 16230 1 160 . 1 1 16 16 THR HG21 H 1 1.301 0.02 . 1 . . . . 129 THR HG . 16230 1 161 . 1 1 16 16 THR HG22 H 1 1.301 0.02 . 1 . . . . 129 THR HG . 16230 1 162 . 1 1 16 16 THR HG23 H 1 1.301 0.02 . 1 . . . . 129 THR HG . 16230 1 163 . 1 1 16 16 THR C C 13 175.863 0.4 . 1 . . . . 129 THR CO . 16230 1 164 . 1 1 16 16 THR CA C 13 59.619 0.4 . 1 . . . . 129 THR CA . 16230 1 165 . 1 1 16 16 THR CB C 13 72.58 0.4 . 1 . . . . 129 THR CB . 16230 1 166 . 1 1 16 16 THR CG2 C 13 21.485 0.4 . 1 . . . . 129 THR CG . 16230 1 167 . 1 1 16 16 THR N N 15 112.331 0.4 . 1 . . . . 129 THR N . 16230 1 168 . 1 1 17 17 GLN H H 1 9.298 0.02 . 1 . . . . 130 GLN HN . 16230 1 169 . 1 1 17 17 GLN HA H 1 3.596 0.02 . 1 . . . . 130 GLN HA . 16230 1 170 . 1 1 17 17 GLN HB2 H 1 1.967 0.02 . 2 . . . . 130 GLN HB2 . 16230 1 171 . 1 1 17 17 GLN HB3 H 1 2.103 0.02 . 2 . . . . 130 GLN HB3 . 16230 1 172 . 1 1 17 17 GLN HE21 H 1 7.641 0.02 . 2 . . . . 130 GLN HE1 . 16230 1 173 . 1 1 17 17 GLN HE22 H 1 6.916 0.02 . 2 . . . . 130 GLN HE2 . 16230 1 174 . 1 1 17 17 GLN HG2 H 1 2.276 0.02 . 2 . . . . 130 GLN HG2 . 16230 1 175 . 1 1 17 17 GLN HG3 H 1 2.335 0.02 . 2 . . . . 130 GLN HG3 . 16230 1 176 . 1 1 17 17 GLN C C 13 177.294 0.4 . 1 . . . . 130 GLN CO . 16230 1 177 . 1 1 17 17 GLN CA C 13 60.816 0.4 . 1 . . . . 130 GLN CA . 16230 1 178 . 1 1 17 17 GLN CB C 13 28.114 0.4 . 1 . . . . 130 GLN CB . 16230 1 179 . 1 1 17 17 GLN CG C 13 34.318 0.4 . 1 . . . . 130 GLN CG . 16230 1 180 . 1 1 17 17 GLN N N 15 118.5 0.4 . 1 . . . . 130 GLN N . 16230 1 181 . 1 1 17 17 GLN NE2 N 15 112.503 0.4 . 1 . . . . 130 GLN NE . 16230 1 182 . 1 1 18 18 ARG H H 1 7.935 0.02 . 1 . . . . 131 ARG HN . 16230 1 183 . 1 1 18 18 ARG HA H 1 3.856 0.02 . 1 . . . . 131 ARG HA . 16230 1 184 . 1 1 18 18 ARG HB2 H 1 1.564 0.02 . 2 . . . . 131 ARG HB2 . 16230 1 185 . 1 1 18 18 ARG HB3 H 1 1.796 0.02 . 2 . . . . 131 ARG HB3 . 16230 1 186 . 1 1 18 18 ARG HD2 H 1 3.087 0.02 . 2 . . . . 131 ARG HD . 16230 1 187 . 1 1 18 18 ARG HD3 H 1 3.087 0.02 . 2 . . . . 131 ARG HD . 16230 1 188 . 1 1 18 18 ARG HG2 H 1 1.493 0.02 . 2 . . . . 131 ARG HG2 . 16230 1 189 . 1 1 18 18 ARG HG3 H 1 1.554 0.02 . 2 . . . . 131 ARG HG3 . 16230 1 190 . 1 1 18 18 ARG C C 13 177.478 0.4 . 1 . . . . 131 ARG CO . 16230 1 191 . 1 1 18 18 ARG CA C 13 58.982 0.4 . 1 . . . . 131 ARG CA . 16230 1 192 . 1 1 18 18 ARG CB C 13 29.971 0.4 . 1 . . . . 131 ARG CB . 16230 1 193 . 1 1 18 18 ARG CD C 13 43.208 0.4 . 1 . . . . 131 ARG CD . 16230 1 194 . 1 1 18 18 ARG CG C 13 26.751 0.4 . 1 . . . . 131 ARG CG . 16230 1 195 . 1 1 18 18 ARG N N 15 117.98 0.4 . 1 . . . . 131 ARG N . 16230 1 196 . 1 1 19 19 ASN H H 1 7.079 0.02 . 1 . . . . 132 ASN HN . 16230 1 197 . 1 1 19 19 ASN HA H 1 4.17 0.02 . 1 . . . . 132 ASN HA . 16230 1 198 . 1 1 19 19 ASN HB2 H 1 1.352 0.02 . 2 . . . . 132 ASN HB2 . 16230 1 199 . 1 1 19 19 ASN HB3 H 1 1.687 0.02 . 2 . . . . 132 ASN HB3 . 16230 1 200 . 1 1 19 19 ASN HD21 H 1 6.866 0.02 . 2 . . . . 132 ASN HD21 . 16230 1 201 . 1 1 19 19 ASN HD22 H 1 7.918 0.02 . 2 . . . . 132 ASN HD22 . 16230 1 202 . 1 1 19 19 ASN C C 13 177.845 0.4 . 1 . . . . 132 ASN CO . 16230 1 203 . 1 1 19 19 ASN CA C 13 56.873 0.4 . 1 . . . . 132 ASN CA . 16230 1 204 . 1 1 19 19 ASN CB C 13 38.2 0.4 . 1 . . . . 132 ASN CB . 16230 1 205 . 1 1 19 19 ASN N N 15 114.519 0.4 . 1 . . . . 132 ASN N . 16230 1 206 . 1 1 19 19 ASN ND2 N 15 109.863 0.4 . 1 . . . . 132 ASN ND . 16230 1 207 . 1 1 20 20 ILE H H 1 7.234 0.02 . 1 . . . . 133 ILE HN . 16230 1 208 . 1 1 20 20 ILE HA H 1 3.416 0.02 . 1 . . . . 133 ILE HA . 16230 1 209 . 1 1 20 20 ILE HB H 1 1.669 0.02 . 1 . . . . 133 ILE HB . 16230 1 210 . 1 1 20 20 ILE HD11 H 1 -0.027 0.02 . 1 . . . . 133 ILE HD . 16230 1 211 . 1 1 20 20 ILE HD12 H 1 -0.027 0.02 . 1 . . . . 133 ILE HD . 16230 1 212 . 1 1 20 20 ILE HD13 H 1 -0.027 0.02 . 1 . . . . 133 ILE HD . 16230 1 213 . 1 1 20 20 ILE HG12 H 1 1.229 0.02 . 2 . . . . 133 ILE HG11 . 16230 1 214 . 1 1 20 20 ILE HG13 H 1 0.567 0.02 . 2 . . . . 133 ILE HG12 . 16230 1 215 . 1 1 20 20 ILE HG21 H 1 0.638 0.02 . 1 . . . . 133 ILE HG2 . 16230 1 216 . 1 1 20 20 ILE HG22 H 1 0.638 0.02 . 1 . . . . 133 ILE HG2 . 16230 1 217 . 1 1 20 20 ILE HG23 H 1 0.638 0.02 . 1 . . . . 133 ILE HG2 . 16230 1 218 . 1 1 20 20 ILE C C 13 176.655 0.4 . 1 . . . . 133 ILE CO . 16230 1 219 . 1 1 20 20 ILE CA C 13 65.087 0.4 . 1 . . . . 133 ILE CA . 16230 1 220 . 1 1 20 20 ILE CB C 13 37.683 0.4 . 1 . . . . 133 ILE CB . 16230 1 221 . 1 1 20 20 ILE CD1 C 13 12.349 0.4 . 1 . . . . 133 ILE CD . 16230 1 222 . 1 1 20 20 ILE CG1 C 13 29.295 0.4 . 1 . . . . 133 ILE CG1 . 16230 1 223 . 1 1 20 20 ILE CG2 C 13 17.988 0.4 . 1 . . . . 133 ILE CG2 . 16230 1 224 . 1 1 20 20 ILE N N 15 118.821 0.4 . 1 . . . . 133 ILE N . 16230 1 225 . 1 1 21 21 ARG H H 1 8.257 0.02 . 1 . . . . 134 ARG HN . 16230 1 226 . 1 1 21 21 ARG HA H 1 3.616 0.02 . 1 . . . . 134 ARG HA . 16230 1 227 . 1 1 21 21 ARG HB2 H 1 1.776 0.02 . 2 . . . . 134 ARG HB . 16230 1 228 . 1 1 21 21 ARG HB3 H 1 1.776 0.02 . 2 . . . . 134 ARG HB . 16230 1 229 . 1 1 21 21 ARG HD2 H 1 3.12 0.02 . 2 . . . . 134 ARG HD2 . 16230 1 230 . 1 1 21 21 ARG HD3 H 1 3.296 0.02 . 2 . . . . 134 ARG HD3 . 16230 1 231 . 1 1 21 21 ARG HG2 H 1 1.5 0.02 . 2 . . . . 134 ARG HG . 16230 1 232 . 1 1 21 21 ARG HG3 H 1 1.5 0.02 . 2 . . . . 134 ARG HG . 16230 1 233 . 1 1 21 21 ARG C C 13 179.566 0.4 . 1 . . . . 134 ARG CO . 16230 1 234 . 1 1 21 21 ARG CA C 13 60.933 0.4 . 1 . . . . 134 ARG CA . 16230 1 235 . 1 1 21 21 ARG CB C 13 29.875 0.4 . 1 . . . . 134 ARG CB . 16230 1 236 . 1 1 21 21 ARG CD C 13 43.446 0.4 . 1 . . . . 134 ARG CD . 16230 1 237 . 1 1 21 21 ARG CG C 13 27.683 0.4 . 1 . . . . 134 ARG CG . 16230 1 238 . 1 1 21 21 ARG N N 15 120.527 0.4 . 1 . . . . 134 ARG N . 16230 1 239 . 1 1 22 22 ASP H H 1 8.17 0.02 . 1 . . . . 135 ASP HN . 16230 1 240 . 1 1 22 22 ASP HA H 1 4.324 0.02 . 1 . . . . 135 ASP HA . 16230 1 241 . 1 1 22 22 ASP HB2 H 1 2.682 0.02 . 2 . . . . 135 ASP HB . 16230 1 242 . 1 1 22 22 ASP HB3 H 1 2.682 0.02 . 2 . . . . 135 ASP HB . 16230 1 243 . 1 1 22 22 ASP C C 13 177.914 0.4 . 1 . . . . 135 ASP CO . 16230 1 244 . 1 1 22 22 ASP CA C 13 57.733 0.4 . 1 . . . . 135 ASP CA . 16230 1 245 . 1 1 22 22 ASP CB C 13 40.068 0.4 . 1 . . . . 135 ASP CB . 16230 1 246 . 1 1 22 22 ASP N N 15 119.563 0.4 . 1 . . . . 135 ASP N . 16230 1 247 . 1 1 23 23 LEU H H 1 7.454 0.02 . 1 . . . . 136 LEU HN . 16230 1 248 . 1 1 23 23 LEU HA H 1 4.121 0.02 . 1 . . . . 136 LEU HA . 16230 1 249 . 1 1 23 23 LEU HB2 H 1 1.693 0.02 . 2 . . . . 136 LEU HB2 . 16230 1 250 . 1 1 23 23 LEU HB3 H 1 1.953 0.02 . 2 . . . . 136 LEU HB3 . 16230 1 251 . 1 1 23 23 LEU HD11 H 1 0.912 0.02 . 2 . . . . 136 LEU HD1 . 16230 1 252 . 1 1 23 23 LEU HD12 H 1 0.912 0.02 . 2 . . . . 136 LEU HD1 . 16230 1 253 . 1 1 23 23 LEU HD13 H 1 0.912 0.02 . 2 . . . . 136 LEU HD1 . 16230 1 254 . 1 1 23 23 LEU HD21 H 1 0.929 0.02 . 2 . . . . 136 LEU HD2 . 16230 1 255 . 1 1 23 23 LEU HD22 H 1 0.929 0.02 . 2 . . . . 136 LEU HD2 . 16230 1 256 . 1 1 23 23 LEU HD23 H 1 0.929 0.02 . 2 . . . . 136 LEU HD2 . 16230 1 257 . 1 1 23 23 LEU HG H 1 1.744 0.02 . 1 . . . . 136 LEU HG . 16230 1 258 . 1 1 23 23 LEU C C 13 179.028 0.4 . 1 . . . . 136 LEU CO . 16230 1 259 . 1 1 23 23 LEU CA C 13 58.104 0.4 . 1 . . . . 136 LEU CA . 16230 1 260 . 1 1 23 23 LEU CB C 13 42.506 0.4 . 1 . . . . 136 LEU CB . 16230 1 261 . 1 1 23 23 LEU CD1 C 13 25.035 0.4 . 2 . . . . 136 LEU CD1 . 16230 1 262 . 1 1 23 23 LEU CD2 C 13 25.733 0.4 . 2 . . . . 136 LEU CD2 . 16230 1 263 . 1 1 23 23 LEU CG C 13 30.322 0.4 . 1 . . . . 136 LEU CG . 16230 1 264 . 1 1 23 23 LEU N N 15 120.956 0.4 . 1 . . . . 136 LEU N . 16230 1 265 . 1 1 24 24 LEU H H 1 7.361 0.02 . 1 . . . . 137 LEU HN . 16230 1 266 . 1 1 24 24 LEU HA H 1 4.021 0.02 . 1 . . . . 137 LEU HA . 16230 1 267 . 1 1 24 24 LEU HB2 H 1 1.588 0.02 . 2 . . . . 137 LEU HB2 . 16230 1 268 . 1 1 24 24 LEU HB3 H 1 1.935 0.02 . 2 . . . . 137 LEU HB3 . 16230 1 269 . 1 1 24 24 LEU HD11 H 1 0.715 0.02 . 2 . . . . 137 LEU HD1 . 16230 1 270 . 1 1 24 24 LEU HD12 H 1 0.715 0.02 . 2 . . . . 137 LEU HD1 . 16230 1 271 . 1 1 24 24 LEU HD13 H 1 0.715 0.02 . 2 . . . . 137 LEU HD1 . 16230 1 272 . 1 1 24 24 LEU HD21 H 1 0.749 0.02 . 2 . . . . 137 LEU HD2 . 16230 1 273 . 1 1 24 24 LEU HD22 H 1 0.749 0.02 . 2 . . . . 137 LEU HD2 . 16230 1 274 . 1 1 24 24 LEU HD23 H 1 0.749 0.02 . 2 . . . . 137 LEU HD2 . 16230 1 275 . 1 1 24 24 LEU HG H 1 1.677 0.02 . 1 . . . . 137 LEU HG . 16230 1 276 . 1 1 24 24 LEU C C 13 179.719 0.4 . 1 . . . . 137 LEU CO . 16230 1 277 . 1 1 24 24 LEU CA C 13 58.626 0.4 . 1 . . . . 137 LEU CA . 16230 1 278 . 1 1 24 24 LEU CB C 13 40.547 0.4 . 1 . . . . 137 LEU CB . 16230 1 279 . 1 1 24 24 LEU CD1 C 13 26.025 0.4 . 2 . . . . 137 LEU CD1 . 16230 1 280 . 1 1 24 24 LEU CD2 C 13 25.859 0.4 . 2 . . . . 137 LEU CD2 . 16230 1 281 . 1 1 24 24 LEU CG C 13 30.716 0.4 . 1 . . . . 137 LEU CG . 16230 1 282 . 1 1 24 24 LEU N N 15 117.328 0.4 . 1 . . . . 137 LEU N . 16230 1 283 . 1 1 25 25 GLN H H 1 8.568 0.02 . 1 . . . . 138 GLN HN . 16230 1 284 . 1 1 25 25 GLN HA H 1 4.069 0.02 . 1 . . . . 138 GLN HA . 16230 1 285 . 1 1 25 25 GLN HB2 H 1 2.268 0.02 . 2 . . . . 138 GLN HB . 16230 1 286 . 1 1 25 25 GLN HB3 H 1 2.268 0.02 . 2 . . . . 138 GLN HB . 16230 1 287 . 1 1 25 25 GLN HE21 H 1 7.515 0.02 . 2 . . . . 138 GLN HE1 . 16230 1 288 . 1 1 25 25 GLN HE22 H 1 6.804 0.02 . 2 . . . . 138 GLN HE2 . 16230 1 289 . 1 1 25 25 GLN HG2 H 1 2.469 0.02 . 2 . . . . 138 GLN HG . 16230 1 290 . 1 1 25 25 GLN HG3 H 1 2.469 0.02 . 2 . . . . 138 GLN HG . 16230 1 291 . 1 1 25 25 GLN C C 13 180.538 0.4 . 1 . . . . 138 GLN CO . 16230 1 292 . 1 1 25 25 GLN CA C 13 59.331 0.4 . 1 . . . . 138 GLN CA . 16230 1 293 . 1 1 25 25 GLN CB C 13 28.781 0.4 . 1 . . . . 138 GLN CB . 16230 1 294 . 1 1 25 25 GLN CG C 13 34.681 0.4 . 1 . . . . 138 GLN CG . 16230 1 295 . 1 1 25 25 GLN N N 15 121.124 0.4 . 1 . . . . 138 GLN N . 16230 1 296 . 1 1 25 25 GLN NE2 N 15 111.686 0.4 . 1 . . . . 138 GLN NE . 16230 1 297 . 1 1 26 26 ASP H H 1 8.111 0.02 . 1 . . . . 139 ASP HN . 16230 1 298 . 1 1 26 26 ASP HA H 1 4.544 0.02 . 1 . . . . 139 ASP HA . 16230 1 299 . 1 1 26 26 ASP HB2 H 1 2.734 0.02 . 2 . . . . 139 ASP HB2 . 16230 1 300 . 1 1 26 26 ASP HB3 H 1 3.004 0.02 . 2 . . . . 139 ASP HB3 . 16230 1 301 . 1 1 26 26 ASP C C 13 178.195 0.4 . 1 . . . . 139 ASP CO . 16230 1 302 . 1 1 26 26 ASP CA C 13 57.284 0.4 . 1 . . . . 139 ASP CA . 16230 1 303 . 1 1 26 26 ASP CB C 13 41.121 0.4 . 1 . . . . 139 ASP CB . 16230 1 304 . 1 1 26 26 ASP N N 15 120.271 0.4 . 1 . . . . 139 ASP N . 16230 1 305 . 1 1 27 27 ILE H H 1 7.282 0.02 . 1 . . . . 140 ILE HN . 16230 1 306 . 1 1 27 27 ILE HA H 1 4.745 0.02 . 1 . . . . 140 ILE HA . 16230 1 307 . 1 1 27 27 ILE HB H 1 2.363 0.02 . 1 . . . . 140 ILE HB . 16230 1 308 . 1 1 27 27 ILE HD11 H 1 0.866 0.02 . 1 . . . . 140 ILE HD . 16230 1 309 . 1 1 27 27 ILE HD12 H 1 0.866 0.02 . 1 . . . . 140 ILE HD . 16230 1 310 . 1 1 27 27 ILE HD13 H 1 0.866 0.02 . 1 . . . . 140 ILE HD . 16230 1 311 . 1 1 27 27 ILE HG12 H 1 1.683 0.02 . 2 . . . . 140 ILE HG11 . 16230 1 312 . 1 1 27 27 ILE HG13 H 1 1.467 0.02 . 2 . . . . 140 ILE HG12 . 16230 1 313 . 1 1 27 27 ILE HG21 H 1 0.884 0.02 . 1 . . . . 140 ILE HG2 . 16230 1 314 . 1 1 27 27 ILE HG22 H 1 0.884 0.02 . 1 . . . . 140 ILE HG2 . 16230 1 315 . 1 1 27 27 ILE HG23 H 1 0.884 0.02 . 1 . . . . 140 ILE HG2 . 16230 1 316 . 1 1 27 27 ILE C C 13 175.309 0.4 . 1 . . . . 140 ILE CO . 16230 1 317 . 1 1 27 27 ILE CA C 13 61.225 0.4 . 1 . . . . 140 ILE CA . 16230 1 318 . 1 1 27 27 ILE CB C 13 38.134 0.4 . 1 . . . . 140 ILE CB . 16230 1 319 . 1 1 27 27 ILE CD1 C 13 15.863 0.4 . 1 . . . . 140 ILE CD . 16230 1 320 . 1 1 27 27 ILE CG1 C 13 27.007 0.4 . 1 . . . . 140 ILE CG1 . 16230 1 321 . 1 1 27 27 ILE CG2 C 13 17.942 0.4 . 1 . . . . 140 ILE CG2 . 16230 1 322 . 1 1 27 27 ILE N N 15 109.951 0.4 . 1 . . . . 140 ILE N . 16230 1 323 . 1 1 28 28 ASN H H 1 8.188 0.02 . 1 . . . . 141 ASN HN . 16230 1 324 . 1 1 28 28 ASN HA H 1 4.336 0.02 . 1 . . . . 141 ASN HA . 16230 1 325 . 1 1 28 28 ASN HB2 H 1 2.877 0.02 . 2 . . . . 141 ASN HB2 . 16230 1 326 . 1 1 28 28 ASN HB3 H 1 3.186 0.02 . 2 . . . . 141 ASN HB3 . 16230 1 327 . 1 1 28 28 ASN HD21 H 1 6.841 0.02 . 2 . . . . 141 ASN HD21 . 16230 1 328 . 1 1 28 28 ASN HD22 H 1 7.539 0.02 . 2 . . . . 141 ASN HD22 . 16230 1 329 . 1 1 28 28 ASN C C 13 174.186 0.4 . 1 . . . . 141 ASN CO . 16230 1 330 . 1 1 28 28 ASN CA C 13 54.772 0.4 . 1 . . . . 141 ASN CA . 16230 1 331 . 1 1 28 28 ASN CB C 13 37.4 0.4 . 1 . . . . 141 ASN CB . 16230 1 332 . 1 1 28 28 ASN N N 15 116.515 0.4 . 1 . . . . 141 ASN N . 16230 1 333 . 1 1 28 28 ASN ND2 N 15 112.084 0.4 . 1 . . . . 141 ASN ND . 16230 1 334 . 1 1 29 29 VAL H H 1 8.141 0.02 . 1 . . . . 142 VAL HN . 16230 1 335 . 1 1 29 29 VAL HA H 1 4.281 0.02 . 1 . . . . 142 VAL HA . 16230 1 336 . 1 1 29 29 VAL HB H 1 1.7 0.02 . 1 . . . . 142 VAL HB . 16230 1 337 . 1 1 29 29 VAL HG11 H 1 1.068 0.02 . 2 . . . . 142 VAL HG1 . 16230 1 338 . 1 1 29 29 VAL HG12 H 1 1.068 0.02 . 2 . . . . 142 VAL HG1 . 16230 1 339 . 1 1 29 29 VAL HG13 H 1 1.068 0.02 . 2 . . . . 142 VAL HG1 . 16230 1 340 . 1 1 29 29 VAL HG21 H 1 0.77 0.02 . 2 . . . . 142 VAL HG2 . 16230 1 341 . 1 1 29 29 VAL HG22 H 1 0.77 0.02 . 2 . . . . 142 VAL HG2 . 16230 1 342 . 1 1 29 29 VAL HG23 H 1 0.77 0.02 . 2 . . . . 142 VAL HG2 . 16230 1 343 . 1 1 29 29 VAL C C 13 174.921 0.4 . 1 . . . . 142 VAL CO . 16230 1 344 . 1 1 29 29 VAL CA C 13 61.913 0.4 . 1 . . . . 142 VAL CA . 16230 1 345 . 1 1 29 29 VAL CB C 13 34.548 0.4 . 1 . . . . 142 VAL CB . 16230 1 346 . 1 1 29 29 VAL CG1 C 13 22.288 0.4 . 2 . . . . 142 VAL CG1 . 16230 1 347 . 1 1 29 29 VAL CG2 C 13 22.185 0.4 . 2 . . . . 142 VAL CG2 . 16230 1 348 . 1 1 29 29 VAL N N 15 119.288 0.4 . 1 . . . . 142 VAL N . 16230 1 349 . 1 1 30 30 VAL H H 1 8.513 0.02 . 1 . . . . 143 VAL HN . 16230 1 350 . 1 1 30 30 VAL HA H 1 3.846 0.02 . 1 . . . . 143 VAL HA . 16230 1 351 . 1 1 30 30 VAL HB H 1 1.972 0.02 . 1 . . . . 143 VAL HB . 16230 1 352 . 1 1 30 30 VAL HG11 H 1 0.834 0.02 . 2 . . . . 143 VAL HG1 . 16230 1 353 . 1 1 30 30 VAL HG12 H 1 0.834 0.02 . 2 . . . . 143 VAL HG1 . 16230 1 354 . 1 1 30 30 VAL HG13 H 1 0.834 0.02 . 2 . . . . 143 VAL HG1 . 16230 1 355 . 1 1 30 30 VAL HG21 H 1 0.938 0.02 . 2 . . . . 143 VAL HG2 . 16230 1 356 . 1 1 30 30 VAL HG22 H 1 0.938 0.02 . 2 . . . . 143 VAL HG2 . 16230 1 357 . 1 1 30 30 VAL HG23 H 1 0.938 0.02 . 2 . . . . 143 VAL HG2 . 16230 1 358 . 1 1 30 30 VAL C C 13 175.545 0.4 . 1 . . . . 143 VAL CO . 16230 1 359 . 1 1 30 30 VAL CA C 13 62.468 0.4 . 1 . . . . 143 VAL CA . 16230 1 360 . 1 1 30 30 VAL CB C 13 32.862 0.4 . 1 . . . . 143 VAL CB . 16230 1 361 . 1 1 30 30 VAL CG1 C 13 21.528 0.4 . 2 . . . . 143 VAL CG1 . 16230 1 362 . 1 1 30 30 VAL CG2 C 13 21.25 0.4 . 2 . . . . 143 VAL CG2 . 16230 1 363 . 1 1 30 30 VAL N N 15 127.244 0.4 . 1 . . . . 143 VAL N . 16230 1 364 . 1 1 31 31 ALA H H 1 8.424 0.02 . 1 . . . . 144 ALA HN . 16230 1 365 . 1 1 31 31 ALA HA H 1 4.562 0.02 . 1 . . . . 144 ALA HA . 16230 1 366 . 1 1 31 31 ALA HB1 H 1 1.215 0.02 . 1 . . . . 144 ALA HB . 16230 1 367 . 1 1 31 31 ALA HB2 H 1 1.215 0.02 . 1 . . . . 144 ALA HB . 16230 1 368 . 1 1 31 31 ALA HB3 H 1 1.215 0.02 . 1 . . . . 144 ALA HB . 16230 1 369 . 1 1 31 31 ALA C C 13 177.379 0.4 . 1 . . . . 144 ALA CO . 16230 1 370 . 1 1 31 31 ALA CA C 13 50.92 0.4 . 1 . . . . 144 ALA CA . 16230 1 371 . 1 1 31 31 ALA CB C 13 19.924 0.4 . 1 . . . . 144 ALA CB . 16230 1 372 . 1 1 31 31 ALA N N 15 128.491 0.4 . 1 . . . . 144 ALA N . 16230 1 373 . 1 1 32 32 LEU H H 1 8.884 0.02 . 1 . . . . 145 LEU HN . 16230 1 374 . 1 1 32 32 LEU HA H 1 4.277 0.02 . 1 . . . . 145 LEU HA . 16230 1 375 . 1 1 32 32 LEU HB2 H 1 1.54 0.02 . 2 . . . . 145 LEU HB . 16230 1 376 . 1 1 32 32 LEU HB3 H 1 1.54 0.02 . 2 . . . . 145 LEU HB . 16230 1 377 . 1 1 32 32 LEU HD11 H 1 0.831 0.02 . 1 . . . . 145 LEU HD . 16230 1 378 . 1 1 32 32 LEU HD12 H 1 0.831 0.02 . 1 . . . . 145 LEU HD . 16230 1 379 . 1 1 32 32 LEU HD13 H 1 0.831 0.02 . 1 . . . . 145 LEU HD . 16230 1 380 . 1 1 32 32 LEU HD21 H 1 0.831 0.02 . 1 . . . . 145 LEU HD . 16230 1 381 . 1 1 32 32 LEU HD22 H 1 0.831 0.02 . 1 . . . . 145 LEU HD . 16230 1 382 . 1 1 32 32 LEU HD23 H 1 0.831 0.02 . 1 . . . . 145 LEU HD . 16230 1 383 . 1 1 32 32 LEU HG H 1 0.813 0.02 . 1 . . . . 145 LEU HG . 16230 1 384 . 1 1 32 32 LEU C C 13 177.938 0.4 . 1 . . . . 145 LEU CO . 16230 1 385 . 1 1 32 32 LEU CA C 13 56.253 0.4 . 1 . . . . 145 LEU CA . 16230 1 386 . 1 1 32 32 LEU CB C 13 42.272 0.4 . 1 . . . . 145 LEU CB . 16230 1 387 . 1 1 32 32 LEU CD1 C 13 22.462 0.4 . 1 . . . . 145 LEU CD . 16230 1 388 . 1 1 32 32 LEU CD2 C 13 22.462 0.4 . 1 . . . . 145 LEU CD . 16230 1 389 . 1 1 32 32 LEU CG C 13 25.55 0.4 . 1 . . . . 145 LEU CG . 16230 1 390 . 1 1 32 32 LEU N N 15 123.674 0.4 . 1 . . . . 145 LEU N . 16230 1 391 . 1 1 33 33 SER H H 1 7.263 0.02 . 1 . . . . 146 SER HN . 16230 1 392 . 1 1 33 33 SER HA H 1 4.487 0.02 . 1 . . . . 146 SER HA . 16230 1 393 . 1 1 33 33 SER HB2 H 1 3.635 0.02 . 2 . . . . 146 SER HB2 . 16230 1 394 . 1 1 33 33 SER HB3 H 1 3.914 0.02 . 2 . . . . 146 SER HB3 . 16230 1 395 . 1 1 33 33 SER C C 13 173.04 0.4 . 1 . . . . 146 SER CO . 16230 1 396 . 1 1 33 33 SER CA C 13 58.305 0.4 . 1 . . . . 146 SER CA . 16230 1 397 . 1 1 33 33 SER CB C 13 64.612 0.4 . 1 . . . . 146 SER CB . 16230 1 398 . 1 1 33 33 SER N N 15 110.149 0.4 . 1 . . . . 146 SER N . 16230 1 399 . 1 1 34 34 ILE H H 1 8.43 0.02 . 1 . . . . 147 ILE HN . 16230 1 400 . 1 1 34 34 ILE HA H 1 4.778 0.02 . 1 . . . . 147 ILE HA . 16230 1 401 . 1 1 34 34 ILE HB H 1 1.567 0.02 . 1 . . . . 147 ILE HB . 16230 1 402 . 1 1 34 34 ILE HD11 H 1 0.745 0.02 . 1 . . . . 147 ILE HD . 16230 1 403 . 1 1 34 34 ILE HD12 H 1 0.745 0.02 . 1 . . . . 147 ILE HD . 16230 1 404 . 1 1 34 34 ILE HD13 H 1 0.745 0.02 . 1 . . . . 147 ILE HD . 16230 1 405 . 1 1 34 34 ILE HG12 H 1 1.594 0.02 . 2 . . . . 147 ILE HG11 . 16230 1 406 . 1 1 34 34 ILE HG13 H 1 1.55 0.02 . 2 . . . . 147 ILE HG12 . 16230 1 407 . 1 1 34 34 ILE HG21 H 1 0.866 0.02 . 1 . . . . 147 ILE HG2 . 16230 1 408 . 1 1 34 34 ILE HG22 H 1 0.866 0.02 . 1 . . . . 147 ILE HG2 . 16230 1 409 . 1 1 34 34 ILE HG23 H 1 0.866 0.02 . 1 . . . . 147 ILE HG2 . 16230 1 410 . 1 1 34 34 ILE C C 13 174.793 0.4 . 1 . . . . 147 ILE CO . 16230 1 411 . 1 1 34 34 ILE CA C 13 61.374 0.4 . 1 . . . . 147 ILE CA . 16230 1 412 . 1 1 34 34 ILE CB C 13 41.442 0.4 . 1 . . . . 147 ILE CB . 16230 1 413 . 1 1 34 34 ILE CD1 C 13 14.653 0.4 . 1 . . . . 147 ILE CD . 16230 1 414 . 1 1 34 34 ILE CG1 C 13 28.796 0.4 . 1 . . . . 147 ILE CG1 . 16230 1 415 . 1 1 34 34 ILE CG2 C 13 17.501 0.4 . 1 . . . . 147 ILE CG2 . 16230 1 416 . 1 1 34 34 ILE N N 15 125.048 0.4 . 1 . . . . 147 ILE N . 16230 1 417 . 1 1 35 35 ARG H H 1 9.487 0.02 . 1 . . . . 148 ARG HN . 16230 1 418 . 1 1 35 35 ARG HA H 1 4.722 0.02 . 1 . . . . 148 ARG HA . 16230 1 419 . 1 1 35 35 ARG HB2 H 1 1.862 0.02 . 2 . . . . 148 ARG HB2 . 16230 1 420 . 1 1 35 35 ARG HB3 H 1 2.036 0.02 . 2 . . . . 148 ARG HB3 . 16230 1 421 . 1 1 35 35 ARG HD2 H 1 3.341 0.02 . 2 . . . . 148 ARG HD2 . 16230 1 422 . 1 1 35 35 ARG HD3 H 1 3.351 0.02 . 2 . . . . 148 ARG HD3 . 16230 1 423 . 1 1 35 35 ARG C C 13 174.663 0.4 . 1 . . . . 148 ARG CO . 16230 1 424 . 1 1 35 35 ARG CA C 13 55.677 0.4 . 1 . . . . 148 ARG CA . 16230 1 425 . 1 1 35 35 ARG CB C 13 33.203 0.4 . 1 . . . . 148 ARG CB . 16230 1 426 . 1 1 35 35 ARG CD C 13 42.075 0.4 . 1 . . . . 148 ARG CD . 16230 1 427 . 1 1 35 35 ARG N N 15 127.041 0.4 . 1 . . . . 148 ARG N . 16230 1 428 . 1 1 36 36 LEU H H 1 8.726 0.02 . 1 . . . . 149 LEU HN . 16230 1 429 . 1 1 36 36 LEU HA H 1 5.161 0.02 . 1 . . . . 149 LEU HA . 16230 1 430 . 1 1 36 36 LEU CA C 13 52.782 0.4 . 1 . . . . 149 LEU CA . 16230 1 431 . 1 1 36 36 LEU CB C 13 43.278 0.4 . 1 . . . . 149 LEU CB . 16230 1 432 . 1 1 36 36 LEU N N 15 125.993 0.4 . 1 . . . . 149 LEU N . 16230 1 433 . 1 1 37 37 PRO HA H 1 4.472 0.02 . 1 . . . . 150 PRO HA . 16230 1 434 . 1 1 37 37 PRO HB2 H 1 1.882 0.02 . 2 . . . . 150 PRO HB . 16230 1 435 . 1 1 37 37 PRO HB3 H 1 1.882 0.02 . 2 . . . . 150 PRO HB . 16230 1 436 . 1 1 37 37 PRO HD2 H 1 3.73 0.02 . 2 . . . . 150 PRO HD . 16230 1 437 . 1 1 37 37 PRO HD3 H 1 3.73 0.02 . 2 . . . . 150 PRO HD . 16230 1 438 . 1 1 37 37 PRO HG2 H 1 2.03 0.02 . 2 . . . . 150 PRO HG . 16230 1 439 . 1 1 37 37 PRO HG3 H 1 2.03 0.02 . 2 . . . . 150 PRO HG . 16230 1 440 . 1 1 37 37 PRO C C 13 176.611 0.4 . 1 . . . . 150 PRO CO . 16230 1 441 . 1 1 37 37 PRO CA C 13 62.977 0.4 . 1 . . . . 150 PRO CA . 16230 1 442 . 1 1 37 37 PRO CB C 13 32.836 0.4 . 1 . . . . 150 PRO CB . 16230 1 443 . 1 1 37 37 PRO CD C 13 50.952 0.4 . 1 . . . . 150 PRO CD . 16230 1 444 . 1 1 37 37 PRO CG C 13 27.835 0.4 . 1 . . . . 150 PRO CG . 16230 1 445 . 1 1 38 38 SER H H 1 8.541 0.02 . 1 . . . . 151 SER HN . 16230 1 446 . 1 1 38 38 SER HA H 1 4.336 0.02 . 1 . . . . 151 SER HA . 16230 1 447 . 1 1 38 38 SER HB2 H 1 3.865 0.02 . 2 . . . . 151 SER HB . 16230 1 448 . 1 1 38 38 SER HB3 H 1 3.865 0.02 . 2 . . . . 151 SER HB . 16230 1 449 . 1 1 38 38 SER C C 13 174.701 0.4 . 1 . . . . 151 SER CO . 16230 1 450 . 1 1 38 38 SER CA C 13 58.941 0.4 . 1 . . . . 151 SER CA . 16230 1 451 . 1 1 38 38 SER CB C 13 63.825 0.4 . 1 . . . . 151 SER CB . 16230 1 452 . 1 1 38 38 SER N N 15 116.242 0.4 . 1 . . . . 151 SER N . 16230 1 453 . 1 1 39 39 LEU H H 1 8.401 0.02 . 1 . . . . 152 LEU HN . 16230 1 454 . 1 1 39 39 LEU HA H 1 4.416 0.02 . 1 . . . . 152 LEU HA . 16230 1 455 . 1 1 39 39 LEU HB2 H 1 1.577 0.02 . 2 . . . . 152 LEU HB . 16230 1 456 . 1 1 39 39 LEU HB3 H 1 1.577 0.02 . 2 . . . . 152 LEU HB . 16230 1 457 . 1 1 39 39 LEU HD11 H 1 0.862 0.02 . 2 . . . . 152 LEU HD1 . 16230 1 458 . 1 1 39 39 LEU HD12 H 1 0.862 0.02 . 2 . . . . 152 LEU HD1 . 16230 1 459 . 1 1 39 39 LEU HD13 H 1 0.862 0.02 . 2 . . . . 152 LEU HD1 . 16230 1 460 . 1 1 39 39 LEU HD21 H 1 0.873 0.02 . 2 . . . . 152 LEU HD2 . 16230 1 461 . 1 1 39 39 LEU HD22 H 1 0.873 0.02 . 2 . . . . 152 LEU HD2 . 16230 1 462 . 1 1 39 39 LEU HD23 H 1 0.873 0.02 . 2 . . . . 152 LEU HD2 . 16230 1 463 . 1 1 39 39 LEU HG H 1 1.656 0.02 . 1 . . . . 152 LEU HG . 16230 1 464 . 1 1 39 39 LEU C C 13 177.971 0.4 . 1 . . . . 152 LEU CO . 16230 1 465 . 1 1 39 39 LEU CA C 13 55.382 0.4 . 1 . . . . 152 LEU CA . 16230 1 466 . 1 1 39 39 LEU CB C 13 42.432 0.4 . 1 . . . . 152 LEU CB . 16230 1 467 . 1 1 39 39 LEU CD1 C 13 25.624 0.4 . 2 . . . . 152 LEU CD1 . 16230 1 468 . 1 1 39 39 LEU CD2 C 13 23.935 0.4 . 2 . . . . 152 LEU CD2 . 16230 1 469 . 1 1 39 39 LEU CG C 13 27.04 0.4 . 1 . . . . 152 LEU CG . 16230 1 470 . 1 1 39 39 LEU N N 15 123.867 0.4 . 1 . . . . 152 LEU N . 16230 1 471 . 1 1 40 40 ARG H H 1 8.569 0.02 . 1 . . . . 153 ARG HN . 16230 1 472 . 1 1 40 40 ARG HA H 1 4.077 0.02 . 1 . . . . 153 ARG HA . 16230 1 473 . 1 1 40 40 ARG HB2 H 1 1.491 0.02 . 2 . . . . 153 ARG HB2 . 16230 1 474 . 1 1 40 40 ARG HB3 H 1 1.559 0.02 . 2 . . . . 153 ARG HB3 . 16230 1 475 . 1 1 40 40 ARG HD2 H 1 2.97 0.02 . 2 . . . . 153 ARG HD . 16230 1 476 . 1 1 40 40 ARG HD3 H 1 2.97 0.02 . 2 . . . . 153 ARG HD . 16230 1 477 . 1 1 40 40 ARG HG2 H 1 1.183 0.02 . 2 . . . . 153 ARG HG2 . 16230 1 478 . 1 1 40 40 ARG HG3 H 1 1.36 0.02 . 2 . . . . 153 ARG HG3 . 16230 1 479 . 1 1 40 40 ARG C C 13 176.351 0.4 . 1 . . . . 153 ARG CO . 16230 1 480 . 1 1 40 40 ARG CA C 13 57.383 0.4 . 1 . . . . 153 ARG CA . 16230 1 481 . 1 1 40 40 ARG CB C 13 31.199 0.4 . 1 . . . . 153 ARG CB . 16230 1 482 . 1 1 40 40 ARG CD C 13 43.45 0.4 . 1 . . . . 153 ARG CD . 16230 1 483 . 1 1 40 40 ARG CG C 13 27.313 0.4 . 1 . . . . 153 ARG CG . 16230 1 484 . 1 1 40 40 ARG N N 15 121.564 0.4 . 1 . . . . 153 ARG N . 16230 1 485 . 1 1 41 41 PHE H H 1 8.019 0.02 . 1 . . . . 154 PHE HN . 16230 1 486 . 1 1 41 41 PHE HA H 1 4.759 0.02 . 1 . . . . 154 PHE HA . 16230 1 487 . 1 1 41 41 PHE HB2 H 1 3.202 0.02 . 2 . . . . 154 PHE HB2 . 16230 1 488 . 1 1 41 41 PHE HB3 H 1 2.941 0.02 . 2 . . . . 154 PHE HB3 . 16230 1 489 . 1 1 41 41 PHE HD1 H 1 7.13 0.02 . 3 . . . . 154 PHE HD . 16230 1 490 . 1 1 41 41 PHE HD2 H 1 7.13 0.02 . 3 . . . . 154 PHE HD . 16230 1 491 . 1 1 41 41 PHE HE1 H 1 7.19 0.02 . 3 . . . . 154 PHE HE . 16230 1 492 . 1 1 41 41 PHE HE2 H 1 7.19 0.02 . 3 . . . . 154 PHE HE . 16230 1 493 . 1 1 41 41 PHE C C 13 176.296 0.4 . 1 . . . . 154 PHE CO . 16230 1 494 . 1 1 41 41 PHE CA C 13 57.05 0.4 . 1 . . . . 154 PHE CA . 16230 1 495 . 1 1 41 41 PHE CB C 13 40.443 0.4 . 1 . . . . 154 PHE CB . 16230 1 496 . 1 1 41 41 PHE N N 15 116.718 0.4 . 1 . . . . 154 PHE N . 16230 1 497 . 1 1 42 42 ASN H H 1 8.727 0.02 . 1 . . . . 155 ASN HN . 16230 1 498 . 1 1 42 42 ASN HA H 1 4.619 0.02 . 1 . . . . 155 ASN HA . 16230 1 499 . 1 1 42 42 ASN HB2 H 1 2.888 0.02 . 2 . . . . 155 ASN HB . 16230 1 500 . 1 1 42 42 ASN HB3 H 1 2.888 0.02 . 2 . . . . 155 ASN HB . 16230 1 501 . 1 1 42 42 ASN HD21 H 1 6.98 0.02 . 2 . . . . 155 ASN HD21 . 16230 1 502 . 1 1 42 42 ASN HD22 H 1 7.685 0.02 . 2 . . . . 155 ASN HD22 . 16230 1 503 . 1 1 42 42 ASN C C 13 175.853 0.4 . 1 . . . . 155 ASN CO . 16230 1 504 . 1 1 42 42 ASN CA C 13 54.621 0.4 . 1 . . . . 155 ASN CA . 16230 1 505 . 1 1 42 42 ASN CB C 13 38.263 0.4 . 1 . . . . 155 ASN CB . 16230 1 506 . 1 1 42 42 ASN N N 15 118.985 0.4 . 1 . . . . 155 ASN N . 16230 1 507 . 1 1 42 42 ASN ND2 N 15 112.214 0.4 . 1 . . . . 155 ASN ND . 16230 1 508 . 1 1 43 43 THR H H 1 7.763 0.02 . 1 . . . . 156 THR HN . 16230 1 509 . 1 1 43 43 THR HA H 1 4.431 0.02 . 1 . . . . 156 THR HA . 16230 1 510 . 1 1 43 43 THR HB H 1 4.473 0.02 . 1 . . . . 156 THR HB . 16230 1 511 . 1 1 43 43 THR HG21 H 1 1.252 0.02 . 1 . . . . 156 THR HG . 16230 1 512 . 1 1 43 43 THR HG22 H 1 1.252 0.02 . 1 . . . . 156 THR HG . 16230 1 513 . 1 1 43 43 THR HG23 H 1 1.252 0.02 . 1 . . . . 156 THR HG . 16230 1 514 . 1 1 43 43 THR C C 13 175.043 0.4 . 1 . . . . 156 THR CO . 16230 1 515 . 1 1 43 43 THR CA C 13 61.842 0.4 . 1 . . . . 156 THR CA . 16230 1 516 . 1 1 43 43 THR CB C 13 69.639 0.4 . 1 . . . . 156 THR CB . 16230 1 517 . 1 1 43 43 THR CG2 C 13 22.009 0.4 . 1 . . . . 156 THR CG . 16230 1 518 . 1 1 43 43 THR N N 15 109.745 0.4 . 1 . . . . 156 THR N . 16230 1 519 . 1 1 44 44 SER H H 1 8.148 0.02 . 1 . . . . 157 SER HN . 16230 1 520 . 1 1 44 44 SER HA H 1 4.535 0.02 . 1 . . . . 157 SER HA . 16230 1 521 . 1 1 44 44 SER HB2 H 1 4.002 0.02 . 2 . . . . 157 SER HB2 . 16230 1 522 . 1 1 44 44 SER HB3 H 1 4.047 0.02 . 2 . . . . 157 SER HB3 . 16230 1 523 . 1 1 44 44 SER C C 13 174.038 0.4 . 1 . . . . 157 SER CO . 16230 1 524 . 1 1 44 44 SER CA C 13 59.741 0.4 . 1 . . . . 157 SER CA . 16230 1 525 . 1 1 44 44 SER CB C 13 64.388 0.4 . 1 . . . . 157 SER CB . 16230 1 526 . 1 1 44 44 SER N N 15 118.028 0.4 . 1 . . . . 157 SER N . 16230 1 527 . 1 1 45 45 ARG H H 1 8.274 0.02 . 1 . . . . 158 ARG HN . 16230 1 528 . 1 1 45 45 ARG HA H 1 4.411 0.02 . 1 . . . . 158 ARG HA . 16230 1 529 . 1 1 45 45 ARG HB2 H 1 1.813 0.02 . 2 . . . . 158 ARG HB . 16230 1 530 . 1 1 45 45 ARG HB3 H 1 1.813 0.02 . 2 . . . . 158 ARG HB . 16230 1 531 . 1 1 45 45 ARG HD2 H 1 3.208 0.02 . 2 . . . . 158 ARG HD . 16230 1 532 . 1 1 45 45 ARG HD3 H 1 3.208 0.02 . 2 . . . . 158 ARG HD . 16230 1 533 . 1 1 45 45 ARG HG2 H 1 1.652 0.02 . 2 . . . . 158 ARG HG . 16230 1 534 . 1 1 45 45 ARG HG3 H 1 1.652 0.02 . 2 . . . . 158 ARG HG . 16230 1 535 . 1 1 45 45 ARG C C 13 175.641 0.4 . 1 . . . . 158 ARG CO . 16230 1 536 . 1 1 45 45 ARG CA C 13 55.808 0.4 . 1 . . . . 158 ARG CA . 16230 1 537 . 1 1 45 45 ARG CB C 13 31.177 0.4 . 1 . . . . 158 ARG CB . 16230 1 538 . 1 1 45 45 ARG CD C 13 44.001 0.4 . 1 . . . . 158 ARG CD . 16230 1 539 . 1 1 45 45 ARG CG C 13 27.105 0.4 . 1 . . . . 158 ARG CG . 16230 1 540 . 1 1 45 45 ARG N N 15 122.361 0.4 . 1 . . . . 158 ARG N . 16230 1 541 . 1 1 46 46 ARG H H 1 8.247 0.02 . 1 . . . . 159 ARG HN . 16230 1 542 . 1 1 46 46 ARG HA H 1 4.237 0.02 . 1 . . . . 159 ARG HA . 16230 1 543 . 1 1 46 46 ARG HB2 H 1 1.427 0.02 . 2 . . . . 159 ARG HB2 . 16230 1 544 . 1 1 46 46 ARG HB3 H 1 1.577 0.02 . 2 . . . . 159 ARG HB3 . 16230 1 545 . 1 1 46 46 ARG HD2 H 1 3.193 0.02 . 2 . . . . 159 ARG HD . 16230 1 546 . 1 1 46 46 ARG HD3 H 1 3.193 0.02 . 2 . . . . 159 ARG HD . 16230 1 547 . 1 1 46 46 ARG C C 13 175.381 0.4 . 1 . . . . 159 ARG CO . 16230 1 548 . 1 1 46 46 ARG CA C 13 56.588 0.4 . 1 . . . . 159 ARG CA . 16230 1 549 . 1 1 46 46 ARG CB C 13 31.625 0.4 . 1 . . . . 159 ARG CB . 16230 1 550 . 1 1 46 46 ARG CD C 13 43.966 0.4 . 1 . . . . 159 ARG CD . 16230 1 551 . 1 1 46 46 ARG N N 15 121.619 0.4 . 1 . . . . 159 ARG N . 16230 1 552 . 1 1 47 47 PHE H H 1 7.738 0.02 . 1 . . . . 160 PHE HN . 16230 1 553 . 1 1 47 47 PHE HA H 1 5.173 0.02 . 1 . . . . 160 PHE HA . 16230 1 554 . 1 1 47 47 PHE HB2 H 1 2.561 0.02 . 2 . . . . 160 PHE HB2 . 16230 1 555 . 1 1 47 47 PHE HB3 H 1 2.594 0.02 . 2 . . . . 160 PHE HB3 . 16230 1 556 . 1 1 47 47 PHE HD1 H 1 6.925 0.02 . 3 . . . . 160 PHE HD . 16230 1 557 . 1 1 47 47 PHE HD2 H 1 6.925 0.02 . 3 . . . . 160 PHE HD . 16230 1 558 . 1 1 47 47 PHE HE1 H 1 6.605 0.02 . 3 . . . . 160 PHE HE . 16230 1 559 . 1 1 47 47 PHE HE2 H 1 6.605 0.02 . 3 . . . . 160 PHE HE . 16230 1 560 . 1 1 47 47 PHE C C 13 172.415 0.4 . 1 . . . . 160 PHE CO . 16230 1 561 . 1 1 47 47 PHE CA C 13 55.875 0.4 . 1 . . . . 160 PHE CA . 16230 1 562 . 1 1 47 47 PHE CB C 13 41.685 0.4 . 1 . . . . 160 PHE CB . 16230 1 563 . 1 1 47 47 PHE N N 15 119.925 0.4 . 1 . . . . 160 PHE N . 16230 1 564 . 1 1 48 48 ALA H H 1 8.895 0.02 . 1 . . . . 161 ALA HN . 16230 1 565 . 1 1 48 48 ALA HA H 1 5.309 0.02 . 1 . . . . 161 ALA HA . 16230 1 566 . 1 1 48 48 ALA HB1 H 1 1.062 0.02 . 1 . . . . 161 ALA HB . 16230 1 567 . 1 1 48 48 ALA HB2 H 1 1.062 0.02 . 1 . . . . 161 ALA HB . 16230 1 568 . 1 1 48 48 ALA HB3 H 1 1.062 0.02 . 1 . . . . 161 ALA HB . 16230 1 569 . 1 1 48 48 ALA C C 13 175.442 0.4 . 1 . . . . 161 ALA CO . 16230 1 570 . 1 1 48 48 ALA CA C 13 50.394 0.4 . 1 . . . . 161 ALA CA . 16230 1 571 . 1 1 48 48 ALA CB C 13 23.664 0.4 . 1 . . . . 161 ALA CB . 16230 1 572 . 1 1 48 48 ALA N N 15 119.619 0.4 . 1 . . . . 161 ALA N . 16230 1 573 . 1 1 49 49 TYR H H 1 8.817 0.02 . 1 . . . . 162 TYR HN . 16230 1 574 . 1 1 49 49 TYR HA H 1 5.754 0.02 . 1 . . . . 162 TYR HA . 16230 1 575 . 1 1 49 49 TYR HB2 H 1 2.659 0.02 . 2 . . . . 162 TYR HB2 . 16230 1 576 . 1 1 49 49 TYR HB3 H 1 2.962 0.02 . 2 . . . . 162 TYR HB3 . 16230 1 577 . 1 1 49 49 TYR HD1 H 1 6.902 0.02 . 3 . . . . 162 TYR HD . 16230 1 578 . 1 1 49 49 TYR HD2 H 1 6.902 0.02 . 3 . . . . 162 TYR HD . 16230 1 579 . 1 1 49 49 TYR HE1 H 1 6.871 0.02 . 3 . . . . 162 TYR HE . 16230 1 580 . 1 1 49 49 TYR HE2 H 1 6.871 0.02 . 3 . . . . 162 TYR HE . 16230 1 581 . 1 1 49 49 TYR C C 13 176.214 0.4 . 1 . . . . 162 TYR CO . 16230 1 582 . 1 1 49 49 TYR CA C 13 57.181 0.4 . 1 . . . . 162 TYR CA . 16230 1 583 . 1 1 49 49 TYR CB C 13 41.741 0.4 . 1 . . . . 162 TYR CB . 16230 1 584 . 1 1 49 49 TYR N N 15 117.031 0.4 . 1 . . . . 162 TYR N . 16230 1 585 . 1 1 50 50 ILE H H 1 9.166 0.02 . 1 . . . . 163 ILE HN . 16230 1 586 . 1 1 50 50 ILE HA H 1 4.983 0.02 . 1 . . . . 163 ILE HA . 16230 1 587 . 1 1 50 50 ILE HB H 1 1.754 0.02 . 1 . . . . 163 ILE HB . 16230 1 588 . 1 1 50 50 ILE HD11 H 1 0.795 0.02 . 1 . . . . 163 ILE HD . 16230 1 589 . 1 1 50 50 ILE HD12 H 1 0.795 0.02 . 1 . . . . 163 ILE HD . 16230 1 590 . 1 1 50 50 ILE HD13 H 1 0.795 0.02 . 1 . . . . 163 ILE HD . 16230 1 591 . 1 1 50 50 ILE HG12 H 1 0.839 0.02 . 1 . . . . 163 ILE HG12 . 16230 1 592 . 1 1 50 50 ILE HG13 H 1 1.446 0.02 . 2 . . . . 163 ILE HG13 . 16230 1 593 . 1 1 50 50 ILE C C 13 175.107 0.4 . 1 . . . . 163 ILE CO . 16230 1 594 . 1 1 50 50 ILE CA C 13 60.053 0.4 . 1 . . . . 163 ILE CA . 16230 1 595 . 1 1 50 50 ILE CB C 13 43.408 0.4 . 1 . . . . 163 ILE CB . 16230 1 596 . 1 1 50 50 ILE CD1 C 13 16.464 0.4 . 1 . . . . 163 ILE CD . 16230 1 597 . 1 1 50 50 ILE CG1 C 13 28.899 0.4 . 1 . . . . 163 ILE CG1 . 16230 1 598 . 1 1 50 50 ILE CG2 C 13 19.678 0.4 . 1 . . . . 163 ILE CG2 . 16230 1 599 . 1 1 50 50 ILE N N 15 121.568 0.4 . 1 . . . . 163 ILE N . 16230 1 600 . 1 1 51 51 ASP H H 1 8.821 0.02 . 1 . . . . 164 ASP HN . 16230 1 601 . 1 1 51 51 ASP HA H 1 5.624 0.02 . 1 . . . . 164 ASP HA . 16230 1 602 . 1 1 51 51 ASP HB2 H 1 2.672 0.02 . 2 . . . . 164 ASP HB2 . 16230 1 603 . 1 1 51 51 ASP HB3 H 1 2.811 0.02 . 2 . . . . 164 ASP HB3 . 16230 1 604 . 1 1 51 51 ASP C C 13 175.983 0.4 . 1 . . . . 164 ASP CO . 16230 1 605 . 1 1 51 51 ASP CA C 13 53.913 0.4 . 1 . . . . 164 ASP CA . 16230 1 606 . 1 1 51 51 ASP CB C 13 42.334 0.4 . 1 . . . . 164 ASP CB . 16230 1 607 . 1 1 51 51 ASP N N 15 127.282 0.4 . 1 . . . . 164 ASP N . 16230 1 608 . 1 1 52 52 VAL H H 1 9.014 0.02 . 1 . . . . 165 VAL HN . 16230 1 609 . 1 1 52 52 VAL HA H 1 4.966 0.02 . 1 . . . . 165 VAL HA . 16230 1 610 . 1 1 52 52 VAL HB H 1 2.742 0.02 . 1 . . . . 165 VAL HB . 16230 1 611 . 1 1 52 52 VAL HG11 H 1 0.901 0.02 . 2 . . . . 165 VAL HG1 . 16230 1 612 . 1 1 52 52 VAL HG12 H 1 0.901 0.02 . 2 . . . . 165 VAL HG1 . 16230 1 613 . 1 1 52 52 VAL HG13 H 1 0.901 0.02 . 2 . . . . 165 VAL HG1 . 16230 1 614 . 1 1 52 52 VAL HG21 H 1 0.892 0.02 . 2 . . . . 165 VAL HG2 . 16230 1 615 . 1 1 52 52 VAL HG22 H 1 0.892 0.02 . 2 . . . . 165 VAL HG2 . 16230 1 616 . 1 1 52 52 VAL HG23 H 1 0.892 0.02 . 2 . . . . 165 VAL HG2 . 16230 1 617 . 1 1 52 52 VAL C C 13 176.41 0.4 . 1 . . . . 165 VAL CO . 16230 1 618 . 1 1 52 52 VAL CA C 13 59.783 0.4 . 1 . . . . 165 VAL CA . 16230 1 619 . 1 1 52 52 VAL CB C 13 34.496 0.4 . 1 . . . . 165 VAL CB . 16230 1 620 . 1 1 52 52 VAL CG1 C 13 22.863 0.4 . 2 . . . . 165 VAL CG1 . 16230 1 621 . 1 1 52 52 VAL CG2 C 13 19.188 0.4 . 2 . . . . 165 VAL CG2 . 16230 1 622 . 1 1 52 52 VAL N N 15 115.078 0.4 . 1 . . . . 165 VAL N . 16230 1 623 . 1 1 53 53 THR H H 1 9.351 0.02 . 1 . . . . 166 THR HN . 16230 1 624 . 1 1 53 53 THR HA H 1 4.101 0.02 . 1 . . . . 166 THR HA . 16230 1 625 . 1 1 53 53 THR HB H 1 4.383 0.02 . 1 . . . . 166 THR HB . 16230 1 626 . 1 1 53 53 THR HG21 H 1 1.318 0.02 . 1 . . . . 166 THR HG . 16230 1 627 . 1 1 53 53 THR HG22 H 1 1.318 0.02 . 1 . . . . 166 THR HG . 16230 1 628 . 1 1 53 53 THR HG23 H 1 1.318 0.02 . 1 . . . . 166 THR HG . 16230 1 629 . 1 1 53 53 THR C C 13 174.497 0.4 . 1 . . . . 166 THR CO . 16230 1 630 . 1 1 53 53 THR CA C 13 65.992 0.4 . 1 . . . . 166 THR CA . 16230 1 631 . 1 1 53 53 THR CB C 13 70.223 0.4 . 1 . . . . 166 THR CB . 16230 1 632 . 1 1 53 53 THR CG2 C 13 22.105 0.4 . 1 . . . . 166 THR CG . 16230 1 633 . 1 1 53 53 THR N N 15 111.211 0.4 . 1 . . . . 166 THR N . 16230 1 634 . 1 1 54 54 SER H H 1 7.477 0.02 . 1 . . . . 167 SER HN . 16230 1 635 . 1 1 54 54 SER HA H 1 5.053 0.02 . 1 . . . . 167 SER HA . 16230 1 636 . 1 1 54 54 SER HB2 H 1 3.985 0.02 . 2 . . . . 167 SER HB2 . 16230 1 637 . 1 1 54 54 SER HB3 H 1 4.378 0.02 . 2 . . . . 167 SER HB3 . 16230 1 638 . 1 1 54 54 SER C C 13 174.932 0.4 . 1 . . . . 167 SER CO . 16230 1 639 . 1 1 54 54 SER CA C 13 57.099 0.4 . 1 . . . . 167 SER CA . 16230 1 640 . 1 1 54 54 SER CB C 13 67.9 0.4 . 1 . . . . 167 SER CB . 16230 1 641 . 1 1 54 54 SER N N 15 110.431 0.4 . 1 . . . . 167 SER N . 16230 1 642 . 1 1 55 55 LYS H H 1 9.159 0.02 . 1 . . . . 168 LYS HN . 16230 1 643 . 1 1 55 55 LYS HA H 1 4.256 0.02 . 1 . . . . 168 LYS HA . 16230 1 644 . 1 1 55 55 LYS HB2 H 1 1.896 0.02 . 2 . . . . 168 LYS HB . 16230 1 645 . 1 1 55 55 LYS HB3 H 1 1.896 0.02 . 2 . . . . 168 LYS HB . 16230 1 646 . 1 1 55 55 LYS HD2 H 1 1.767 0.02 . 2 . . . . 168 LYS HD . 16230 1 647 . 1 1 55 55 LYS HD3 H 1 1.767 0.02 . 2 . . . . 168 LYS HD . 16230 1 648 . 1 1 55 55 LYS HE2 H 1 3.057 0.02 . 2 . . . . 168 LYS HE . 16230 1 649 . 1 1 55 55 LYS HE3 H 1 3.057 0.02 . 2 . . . . 168 LYS HE . 16230 1 650 . 1 1 55 55 LYS HG2 H 1 1.542 0.02 . 2 . . . . 168 LYS HG . 16230 1 651 . 1 1 55 55 LYS HG3 H 1 1.542 0.02 . 2 . . . . 168 LYS HG . 16230 1 652 . 1 1 55 55 LYS CA C 13 59.133 0.4 . 1 . . . . 168 LYS CA . 16230 1 653 . 1 1 55 55 LYS CB C 13 32.509 0.4 . 1 . . . . 168 LYS CB . 16230 1 654 . 1 1 55 55 LYS CD C 13 29.741 0.4 . 1 . . . . 168 LYS CD . 16230 1 655 . 1 1 55 55 LYS CE C 13 42.387 0.4 . 1 . . . . 168 LYS CE . 16230 1 656 . 1 1 55 55 LYS CG C 13 25.251 0.4 . 1 . . . . 168 LYS CG . 16230 1 657 . 1 1 55 55 LYS N N 15 122.312 0.4 . 1 . . . . 168 LYS N . 16230 1 658 . 1 1 56 56 GLU H H 1 8.813 0.02 . 1 . . . . 169 GLU HN . 16230 1 659 . 1 1 56 56 GLU HA H 1 4.091 0.02 . 1 . . . . 169 GLU HA . 16230 1 660 . 1 1 56 56 GLU HB2 H 1 1.963 0.02 . 2 . . . . 169 GLU HB2 . 16230 1 661 . 1 1 56 56 GLU HB3 H 1 2.162 0.02 . 2 . . . . 169 GLU HB3 . 16230 1 662 . 1 1 56 56 GLU HG2 H 1 2.263 0.02 . 2 . . . . 169 GLU HG2 . 16230 1 663 . 1 1 56 56 GLU HG3 H 1 2.55 0.02 . 2 . . . . 169 GLU HG3 . 16230 1 664 . 1 1 56 56 GLU C C 13 179.574 0.4 . 1 . . . . 169 GLU CO . 16230 1 665 . 1 1 56 56 GLU CA C 13 60.963 0.4 . 1 . . . . 169 GLU CA . 16230 1 666 . 1 1 56 56 GLU CB C 13 28.661 0.4 . 1 . . . . 169 GLU CB . 16230 1 667 . 1 1 56 56 GLU CG C 13 37.498 0.4 . 1 . . . . 169 GLU CG . 16230 1 668 . 1 1 56 56 GLU N N 15 121.144 0.4 . 1 . . . . 169 GLU N . 16230 1 669 . 1 1 57 57 ASP H H 1 8.154 0.02 . 1 . . . . 170 ASP HN . 16230 1 670 . 1 1 57 57 ASP HA H 1 4.612 0.02 . 1 . . . . 170 ASP HA . 16230 1 671 . 1 1 57 57 ASP HB2 H 1 2.528 0.02 . 2 . . . . 170 ASP HB2 . 16230 1 672 . 1 1 57 57 ASP HB3 H 1 2.898 0.02 . 2 . . . . 170 ASP HB3 . 16230 1 673 . 1 1 57 57 ASP C C 13 179.147 0.4 . 1 . . . . 170 ASP CO . 16230 1 674 . 1 1 57 57 ASP CA C 13 57.774 0.4 . 1 . . . . 170 ASP CA . 16230 1 675 . 1 1 57 57 ASP CB C 13 40.8 0.4 . 1 . . . . 170 ASP CB . 16230 1 676 . 1 1 57 57 ASP N N 15 121.159 0.4 . 1 . . . . 170 ASP N . 16230 1 677 . 1 1 58 58 ALA H H 1 7.965 0.02 . 1 . . . . 171 ALA HN . 16230 1 678 . 1 1 58 58 ALA HA H 1 3.995 0.02 . 1 . . . . 171 ALA HA . 16230 1 679 . 1 1 58 58 ALA HB1 H 1 1.532 0.02 . 1 . . . . 171 ALA HB . 16230 1 680 . 1 1 58 58 ALA HB2 H 1 1.532 0.02 . 1 . . . . 171 ALA HB . 16230 1 681 . 1 1 58 58 ALA HB3 H 1 1.532 0.02 . 1 . . . . 171 ALA HB . 16230 1 682 . 1 1 58 58 ALA C C 13 178.592 0.4 . 1 . . . . 171 ALA CO . 16230 1 683 . 1 1 58 58 ALA CA C 13 56.4 0.4 . 1 . . . . 171 ALA CA . 16230 1 684 . 1 1 58 58 ALA CB C 13 18.521 0.4 . 1 . . . . 171 ALA CB . 16230 1 685 . 1 1 58 58 ALA N N 15 122.705 0.4 . 1 . . . . 171 ALA N . 16230 1 686 . 1 1 59 59 ARG H H 1 8.174 0.02 . 1 . . . . 172 ARG HN . 16230 1 687 . 1 1 59 59 ARG HA H 1 3.915 0.02 . 1 . . . . 172 ARG HA . 16230 1 688 . 1 1 59 59 ARG HB2 H 1 2.014 0.02 . 2 . . . . 172 ARG HB . 16230 1 689 . 1 1 59 59 ARG HB3 H 1 2.014 0.02 . 2 . . . . 172 ARG HB . 16230 1 690 . 1 1 59 59 ARG HD2 H 1 3.269 0.02 . 2 . . . . 172 ARG HD . 16230 1 691 . 1 1 59 59 ARG HD3 H 1 3.269 0.02 . 2 . . . . 172 ARG HD . 16230 1 692 . 1 1 59 59 ARG HG2 H 1 1.71 0.02 . 2 . . . . 172 ARG HG2 . 16230 1 693 . 1 1 59 59 ARG HG3 H 1 1.877 0.02 . 2 . . . . 172 ARG HG3 . 16230 1 694 . 1 1 59 59 ARG C C 13 179.157 0.4 . 1 . . . . 172 ARG CO . 16230 1 695 . 1 1 59 59 ARG CA C 13 59.887 0.4 . 1 . . . . 172 ARG CA . 16230 1 696 . 1 1 59 59 ARG CB C 13 30.208 0.4 . 1 . . . . 172 ARG CB . 16230 1 697 . 1 1 59 59 ARG CD C 13 43.582 0.4 . 1 . . . . 172 ARG CD . 16230 1 698 . 1 1 59 59 ARG CG C 13 27.527 0.4 . 1 . . . . 172 ARG CG . 16230 1 699 . 1 1 59 59 ARG N N 15 116.838 0.4 . 1 . . . . 172 ARG N . 16230 1 700 . 1 1 60 60 TYR H H 1 8.213 0.02 . 1 . . . . 173 TYR HN . 16230 1 701 . 1 1 60 60 TYR HA H 1 4.414 0.02 . 1 . . . . 173 TYR HA . 16230 1 702 . 1 1 60 60 TYR HB2 H 1 3.207 0.02 . 2 . . . . 173 TYR HB2 . 16230 1 703 . 1 1 60 60 TYR HB3 H 1 3.296 0.02 . 2 . . . . 173 TYR HB3 . 16230 1 704 . 1 1 60 60 TYR HD1 H 1 7.144 0.02 . 3 . . . . 173 TYR HD . 16230 1 705 . 1 1 60 60 TYR HD2 H 1 7.144 0.02 . 3 . . . . 173 TYR HD . 16230 1 706 . 1 1 60 60 TYR HE1 H 1 7.009 0.02 . 3 . . . . 173 TYR HE . 16230 1 707 . 1 1 60 60 TYR HE2 H 1 7.009 0.02 . 3 . . . . 173 TYR HE . 16230 1 708 . 1 1 60 60 TYR C C 13 177.436 0.4 . 1 . . . . 173 TYR CO . 16230 1 709 . 1 1 60 60 TYR CA C 13 61.291 0.4 . 1 . . . . 173 TYR CA . 16230 1 710 . 1 1 60 60 TYR CB C 13 39.008 0.4 . 1 . . . . 173 TYR CB . 16230 1 711 . 1 1 60 60 TYR N N 15 121.199 0.4 . 1 . . . . 173 TYR N . 16230 1 712 . 1 1 61 61 CYS H H 1 8.346 0.02 . 1 . . . . 174 CYS HN . 16230 1 713 . 1 1 61 61 CYS HA H 1 3.826 0.02 . 1 . . . . 174 CYS HA . 16230 1 714 . 1 1 61 61 CYS HB2 H 1 2.289 0.02 . 2 . . . . 174 CYS HB2 . 16230 1 715 . 1 1 61 61 CYS HB3 H 1 3.416 0.02 . 2 . . . . 174 CYS HB3 . 16230 1 716 . 1 1 61 61 CYS C C 13 177.196 0.4 . 1 . . . . 174 CYS CO . 16230 1 717 . 1 1 61 61 CYS CA C 13 64.521 0.4 . 1 . . . . 174 CYS CA . 16230 1 718 . 1 1 61 61 CYS CB C 13 28.564 0.4 . 1 . . . . 174 CYS CB . 16230 1 719 . 1 1 61 61 CYS N N 15 115.377 0.4 . 1 . . . . 174 CYS N . 16230 1 720 . 1 1 62 62 VAL H H 1 7.885 0.02 . 1 . . . . 175 VAL HN . 16230 1 721 . 1 1 62 62 VAL HA H 1 3.355 0.02 . 1 . . . . 175 VAL HA . 16230 1 722 . 1 1 62 62 VAL HB H 1 2.232 0.02 . 1 . . . . 175 VAL HB . 16230 1 723 . 1 1 62 62 VAL HG11 H 1 1.054 0.02 . 2 . . . . 175 VAL HG1 . 16230 1 724 . 1 1 62 62 VAL HG12 H 1 1.054 0.02 . 2 . . . . 175 VAL HG1 . 16230 1 725 . 1 1 62 62 VAL HG13 H 1 1.054 0.02 . 2 . . . . 175 VAL HG1 . 16230 1 726 . 1 1 62 62 VAL HG21 H 1 1.03 0.02 . 2 . . . . 175 VAL HG2 . 16230 1 727 . 1 1 62 62 VAL HG22 H 1 1.03 0.02 . 2 . . . . 175 VAL HG2 . 16230 1 728 . 1 1 62 62 VAL HG23 H 1 1.03 0.02 . 2 . . . . 175 VAL HG2 . 16230 1 729 . 1 1 62 62 VAL C C 13 178.162 0.4 . 1 . . . . 175 VAL CO . 16230 1 730 . 1 1 62 62 VAL CA C 13 67.623 0.4 . 1 . . . . 175 VAL CA . 16230 1 731 . 1 1 62 62 VAL CB C 13 31.97 0.4 . 1 . . . . 175 VAL CB . 16230 1 732 . 1 1 62 62 VAL CG1 C 13 23.807 0.4 . 2 . . . . 175 VAL CG1 . 16230 1 733 . 1 1 62 62 VAL CG2 C 13 21.644 0.4 . 2 . . . . 175 VAL CG2 . 16230 1 734 . 1 1 62 62 VAL N N 15 118.953 0.4 . 1 . . . . 175 VAL N . 16230 1 735 . 1 1 63 63 GLU H H 1 7.999 0.02 . 1 . . . . 176 GLU HN . 16230 1 736 . 1 1 63 63 GLU HA H 1 3.971 0.02 . 1 . . . . 176 GLU HA . 16230 1 737 . 1 1 63 63 GLU HB2 H 1 2.091 0.02 . 2 . . . . 176 GLU HB2 . 16230 1 738 . 1 1 63 63 GLU HB3 H 1 2.206 0.02 . 2 . . . . 176 GLU HB3 . 16230 1 739 . 1 1 63 63 GLU HG2 H 1 2.218 0.02 . 2 . . . . 176 GLU HG2 . 16230 1 740 . 1 1 63 63 GLU HG3 H 1 2.428 0.02 . 2 . . . . 176 GLU HG3 . 16230 1 741 . 1 1 63 63 GLU C C 13 179.419 0.4 . 1 . . . . 176 GLU CO . 16230 1 742 . 1 1 63 63 GLU CA C 13 59.684 0.4 . 1 . . . . 176 GLU CA . 16230 1 743 . 1 1 63 63 GLU CB C 13 29.855 0.4 . 1 . . . . 176 GLU CB . 16230 1 744 . 1 1 63 63 GLU CG C 13 36.67 0.4 . 1 . . . . 176 GLU CG . 16230 1 745 . 1 1 63 63 GLU N N 15 118.07 0.4 . 1 . . . . 176 GLU N . 16230 1 746 . 1 1 64 64 LYS H H 1 8.003 0.02 . 1 . . . . 177 LYS HN . 16230 1 747 . 1 1 64 64 LYS HA H 1 4.201 0.02 . 1 . . . . 177 LYS HA . 16230 1 748 . 1 1 64 64 LYS HB2 H 1 1.641 0.02 . 2 . . . . 177 LYS HB . 16230 1 749 . 1 1 64 64 LYS HB3 H 1 1.641 0.02 . 2 . . . . 177 LYS HB . 16230 1 750 . 1 1 64 64 LYS HD2 H 1 1.467 0.02 . 2 . . . . 177 LYS HD2 . 16230 1 751 . 1 1 64 64 LYS HD3 H 1 1.52 0.02 . 2 . . . . 177 LYS HD3 . 16230 1 752 . 1 1 64 64 LYS HE2 H 1 2.809 0.02 . 2 . . . . 177 LYS HE . 16230 1 753 . 1 1 64 64 LYS HE3 H 1 2.809 0.02 . 2 . . . . 177 LYS HE . 16230 1 754 . 1 1 64 64 LYS HG2 H 1 0.8 0.02 . 2 . . . . 177 LYS HG2 . 16230 1 755 . 1 1 64 64 LYS HG3 H 1 1.023 0.02 . 2 . . . . 177 LYS HG3 . 16230 1 756 . 1 1 64 64 LYS C C 13 178.845 0.4 . 1 . . . . 177 LYS CO . 16230 1 757 . 1 1 64 64 LYS CA C 13 56.415 0.4 . 1 . . . . 177 LYS CA . 16230 1 758 . 1 1 64 64 LYS CB C 13 33.278 0.4 . 1 . . . . 177 LYS CB . 16230 1 759 . 1 1 64 64 LYS CD C 13 27.486 0.4 . 1 . . . . 177 LYS CD . 16230 1 760 . 1 1 64 64 LYS CE C 13 42.324 0.4 . 1 . . . . 177 LYS CE . 16230 1 761 . 1 1 64 64 LYS CG C 13 23.771 0.4 . 1 . . . . 177 LYS CG . 16230 1 762 . 1 1 64 64 LYS N N 15 113.685 0.4 . 1 . . . . 177 LYS N . 16230 1 763 . 1 1 65 65 LEU H H 1 8.438 0.02 . 1 . . . . 178 LEU HN . 16230 1 764 . 1 1 65 65 LEU HA H 1 4.565 0.02 . 1 . . . . 178 LEU HA . 16230 1 765 . 1 1 65 65 LEU HB2 H 1 1.899 0.02 . 2 . . . . 178 LEU HB . 16230 1 766 . 1 1 65 65 LEU HB3 H 1 1.899 0.02 . 2 . . . . 178 LEU HB . 16230 1 767 . 1 1 65 65 LEU HD11 H 1 0.684 0.02 . 2 . . . . 178 LEU HD1 . 16230 1 768 . 1 1 65 65 LEU HD12 H 1 0.684 0.02 . 2 . . . . 178 LEU HD1 . 16230 1 769 . 1 1 65 65 LEU HD13 H 1 0.684 0.02 . 2 . . . . 178 LEU HD1 . 16230 1 770 . 1 1 65 65 LEU HD21 H 1 0.734 0.02 . 2 . . . . 178 LEU HD2 . 16230 1 771 . 1 1 65 65 LEU HD22 H 1 0.734 0.02 . 2 . . . . 178 LEU HD2 . 16230 1 772 . 1 1 65 65 LEU HD23 H 1 0.734 0.02 . 2 . . . . 178 LEU HD2 . 16230 1 773 . 1 1 65 65 LEU HG H 1 1.42 0.02 . 1 . . . . 178 LEU HG . 16230 1 774 . 1 1 65 65 LEU C C 13 178.214 0.4 . 1 . . . . 178 LEU CO . 16230 1 775 . 1 1 65 65 LEU CA C 13 55.622 0.4 . 1 . . . . 178 LEU CA . 16230 1 776 . 1 1 65 65 LEU CB C 13 43.024 0.4 . 1 . . . . 178 LEU CB . 16230 1 777 . 1 1 65 65 LEU CD1 C 13 23.256 0.4 . 2 . . . . 178 LEU CD1 . 16230 1 778 . 1 1 65 65 LEU CD2 C 13 26.438 0.4 . 2 . . . . 178 LEU CD2 . 16230 1 779 . 1 1 65 65 LEU N N 15 115.284 0.4 . 1 . . . . 178 LEU N . 16230 1 780 . 1 1 66 66 ASN H H 1 8.025 0.02 . 1 . . . . 179 ASN HN . 16230 1 781 . 1 1 66 66 ASN HA H 1 4.44 0.02 . 1 . . . . 179 ASN HA . 16230 1 782 . 1 1 66 66 ASN HB2 H 1 3.147 0.02 . 2 . . . . 179 ASN HB . 16230 1 783 . 1 1 66 66 ASN HB3 H 1 3.147 0.02 . 2 . . . . 179 ASN HB . 16230 1 784 . 1 1 66 66 ASN HD21 H 1 6.912 0.02 . 2 . . . . 179 ASN HD21 . 16230 1 785 . 1 1 66 66 ASN HD22 H 1 7.78 0.02 . 2 . . . . 179 ASN HD22 . 16230 1 786 . 1 1 66 66 ASN C C 13 176.989 0.4 . 1 . . . . 179 ASN CO . 16230 1 787 . 1 1 66 66 ASN CA C 13 56.766 0.4 . 1 . . . . 179 ASN CA . 16230 1 788 . 1 1 66 66 ASN CB C 13 39.402 0.4 . 1 . . . . 179 ASN CB . 16230 1 789 . 1 1 66 66 ASN N N 15 116.06 0.4 . 1 . . . . 179 ASN N . 16230 1 790 . 1 1 66 66 ASN ND2 N 15 114.04 0.4 . 1 . . . . 179 ASN ND . 16230 1 791 . 1 1 67 67 GLY H H 1 9.004 0.02 . 1 . . . . 180 GLY HN . 16230 1 792 . 1 1 67 67 GLY HA2 H 1 3.522 0.02 . 2 . . . . 180 GLY HA2 . 16230 1 793 . 1 1 67 67 GLY HA3 H 1 4.296 0.02 . 2 . . . . 180 GLY HA3 . 16230 1 794 . 1 1 67 67 GLY C C 13 173.733 0.4 . 1 . . . . 180 GLY CO . 16230 1 795 . 1 1 67 67 GLY CA C 13 45.619 0.4 . 1 . . . . 180 GLY CA . 16230 1 796 . 1 1 67 67 GLY N N 15 116.738 0.4 . 1 . . . . 180 GLY N . 16230 1 797 . 1 1 68 68 LEU H H 1 7.492 0.02 . 1 . . . . 181 LEU HN . 16230 1 798 . 1 1 68 68 LEU HA H 1 4.136 0.02 . 1 . . . . 181 LEU HA . 16230 1 799 . 1 1 68 68 LEU HB2 H 1 1.626 0.02 . 2 . . . . 181 LEU HB2 . 16230 1 800 . 1 1 68 68 LEU HB3 H 1 1.857 0.02 . 2 . . . . 181 LEU HB3 . 16230 1 801 . 1 1 68 68 LEU HD11 H 1 0.961 0.02 . 2 . . . . 181 LEU HD1 . 16230 1 802 . 1 1 68 68 LEU HD12 H 1 0.961 0.02 . 2 . . . . 181 LEU HD1 . 16230 1 803 . 1 1 68 68 LEU HD13 H 1 0.961 0.02 . 2 . . . . 181 LEU HD1 . 16230 1 804 . 1 1 68 68 LEU HD21 H 1 1.028 0.02 . 2 . . . . 181 LEU HD2 . 16230 1 805 . 1 1 68 68 LEU HD22 H 1 1.028 0.02 . 2 . . . . 181 LEU HD2 . 16230 1 806 . 1 1 68 68 LEU HD23 H 1 1.028 0.02 . 2 . . . . 181 LEU HD2 . 16230 1 807 . 1 1 68 68 LEU HG H 1 1.581 0.02 . 1 . . . . 181 LEU HG . 16230 1 808 . 1 1 68 68 LEU C C 13 175.679 0.4 . 1 . . . . 181 LEU CO . 16230 1 809 . 1 1 68 68 LEU CA C 13 56.243 0.4 . 1 . . . . 181 LEU CA . 16230 1 810 . 1 1 68 68 LEU CB C 13 43.975 0.4 . 1 . . . . 181 LEU CB . 16230 1 811 . 1 1 68 68 LEU CD1 C 13 24.119 0.4 . 2 . . . . 181 LEU CD1 . 16230 1 812 . 1 1 68 68 LEU CD2 C 13 26.634 0.4 . 2 . . . . 181 LEU CD2 . 16230 1 813 . 1 1 68 68 LEU CG C 13 30 0.4 . 1 . . . . 181 LEU CG . 16230 1 814 . 1 1 68 68 LEU N N 15 123.471 0.4 . 1 . . . . 181 LEU N . 16230 1 815 . 1 1 69 69 LYS H H 1 8.3 0.02 . 1 . . . . 182 LYS HN . 16230 1 816 . 1 1 69 69 LYS HA H 1 5.156 0.02 . 1 . . . . 182 LYS HA . 16230 1 817 . 1 1 69 69 LYS HB2 H 1 1.659 0.02 . 2 . . . . 182 LYS HB2 . 16230 1 818 . 1 1 69 69 LYS HB3 H 1 1.757 0.02 . 2 . . . . 182 LYS HB3 . 16230 1 819 . 1 1 69 69 LYS HD2 H 1 1.62 0.02 . 2 . . . . 182 LYS HD . 16230 1 820 . 1 1 69 69 LYS HD3 H 1 1.62 0.02 . 2 . . . . 182 LYS HD . 16230 1 821 . 1 1 69 69 LYS HE2 H 1 2.943 0.02 . 2 . . . . 182 LYS HE . 16230 1 822 . 1 1 69 69 LYS HE3 H 1 2.943 0.02 . 2 . . . . 182 LYS HE . 16230 1 823 . 1 1 69 69 LYS HG2 H 1 1.382 0.02 . 2 . . . . 182 LYS HG . 16230 1 824 . 1 1 69 69 LYS HG3 H 1 1.382 0.02 . 2 . . . . 182 LYS HG . 16230 1 825 . 1 1 69 69 LYS C C 13 176.994 0.4 . 1 . . . . 182 LYS CO . 16230 1 826 . 1 1 69 69 LYS CA C 13 55.535 0.4 . 1 . . . . 182 LYS CA . 16230 1 827 . 1 1 69 69 LYS CB C 13 32.806 0.4 . 1 . . . . 182 LYS CB . 16230 1 828 . 1 1 69 69 LYS CD C 13 29.381 0.4 . 1 . . . . 182 LYS CD . 16230 1 829 . 1 1 69 69 LYS CE C 13 42.223 0.4 . 1 . . . . 182 LYS CE . 16230 1 830 . 1 1 69 69 LYS CG C 13 25.179 0.4 . 1 . . . . 182 LYS CG . 16230 1 831 . 1 1 69 69 LYS N N 15 125.409 0.4 . 1 . . . . 182 LYS N . 16230 1 832 . 1 1 70 70 ILE H H 1 9.083 0.02 . 1 . . . . 183 ILE HN . 16230 1 833 . 1 1 70 70 ILE HA H 1 4.332 0.02 . 1 . . . . 183 ILE HA . 16230 1 834 . 1 1 70 70 ILE HB H 1 1.743 0.02 . 1 . . . . 183 ILE HB . 16230 1 835 . 1 1 70 70 ILE HD11 H 1 0.947 0.02 . 1 . . . . 183 ILE HD . 16230 1 836 . 1 1 70 70 ILE HD12 H 1 0.947 0.02 . 1 . . . . 183 ILE HD . 16230 1 837 . 1 1 70 70 ILE HD13 H 1 0.947 0.02 . 1 . . . . 183 ILE HD . 16230 1 838 . 1 1 70 70 ILE HG12 H 1 1.098 0.02 . 2 . . . . 183 ILE HG12 . 16230 1 839 . 1 1 70 70 ILE HG13 H 1 1.537 0.02 . 2 . . . . 183 ILE HG13 . 16230 1 840 . 1 1 70 70 ILE HG21 H 1 0.935 0.02 . 1 . . . . 183 ILE HG2 . 16230 1 841 . 1 1 70 70 ILE HG22 H 1 0.935 0.02 . 1 . . . . 183 ILE HG2 . 16230 1 842 . 1 1 70 70 ILE HG23 H 1 0.935 0.02 . 1 . . . . 183 ILE HG2 . 16230 1 843 . 1 1 70 70 ILE C C 13 175.251 0.4 . 1 . . . . 183 ILE CO . 16230 1 844 . 1 1 70 70 ILE CA C 13 60.351 0.4 . 1 . . . . 183 ILE CA . 16230 1 845 . 1 1 70 70 ILE CB C 13 40.818 0.4 . 1 . . . . 183 ILE CB . 16230 1 846 . 1 1 70 70 ILE CD1 C 13 14.534 0.4 . 1 . . . . 183 ILE CD . 16230 1 847 . 1 1 70 70 ILE CG1 C 13 26.841 0.4 . 1 . . . . 183 ILE CG1 . 16230 1 848 . 1 1 70 70 ILE CG2 C 13 18.457 0.4 . 1 . . . . 183 ILE CG2 . 16230 1 849 . 1 1 70 70 ILE N N 15 126.04 0.4 . 1 . . . . 183 ILE N . 16230 1 850 . 1 1 71 71 GLU H H 1 9.258 0.02 . 1 . . . . 184 GLU HN . 16230 1 851 . 1 1 71 71 GLU HA H 1 3.879 0.02 . 1 . . . . 184 GLU HA . 16230 1 852 . 1 1 71 71 GLU HB2 H 1 2.188 0.02 . 2 . . . . 184 GLU HB2 . 16230 1 853 . 1 1 71 71 GLU HB3 H 1 2.378 0.02 . 2 . . . . 184 GLU HB3 . 16230 1 854 . 1 1 71 71 GLU HG2 H 1 2.358 0.02 . 2 . . . . 184 GLU HG . 16230 1 855 . 1 1 71 71 GLU HG3 H 1 2.358 0.02 . 2 . . . . 184 GLU HG . 16230 1 856 . 1 1 71 71 GLU C C 13 176.075 0.4 . 1 . . . . 184 GLU CO . 16230 1 857 . 1 1 71 71 GLU CA C 13 57.665 0.4 . 1 . . . . 184 GLU CA . 16230 1 858 . 1 1 71 71 GLU CB C 13 28.127 0.4 . 1 . . . . 184 GLU CB . 16230 1 859 . 1 1 71 71 GLU CG C 13 36.918 0.4 . 1 . . . . 184 GLU CG . 16230 1 860 . 1 1 71 71 GLU N N 15 123.643 0.4 . 1 . . . . 184 GLU N . 16230 1 861 . 1 1 72 72 GLY H H 1 8.324 0.02 . 1 . . . . 185 GLY HN . 16230 1 862 . 1 1 72 72 GLY HA2 H 1 3.515 0.02 . 2 . . . . 185 GLY HA2 . 16230 1 863 . 1 1 72 72 GLY HA3 H 1 4.055 0.02 . 2 . . . . 185 GLY HA3 . 16230 1 864 . 1 1 72 72 GLY C C 13 174.599 0.4 . 1 . . . . 185 GLY CO . 16230 1 865 . 1 1 72 72 GLY CA C 13 45.5 0.4 . 1 . . . . 185 GLY CA . 16230 1 866 . 1 1 72 72 GLY N N 15 103.337 0.4 . 1 . . . . 185 GLY N . 16230 1 867 . 1 1 73 73 TYR H H 1 8.499 0.02 . 1 . . . . 186 TYR HN . 16230 1 868 . 1 1 73 73 TYR HA H 1 4.278 0.02 . 1 . . . . 186 TYR HA . 16230 1 869 . 1 1 73 73 TYR HB2 H 1 3.005 0.02 . 2 . . . . 186 TYR HB2 . 16230 1 870 . 1 1 73 73 TYR HB3 H 1 3.107 0.02 . 2 . . . . 186 TYR HB3 . 16230 1 871 . 1 1 73 73 TYR HD1 H 1 7.032 0.02 . 3 . . . . 186 TYR HD . 16230 1 872 . 1 1 73 73 TYR HD2 H 1 7.032 0.02 . 3 . . . . 186 TYR HD . 16230 1 873 . 1 1 73 73 TYR HE1 H 1 6.8 0.02 . 3 . . . . 186 TYR HE . 16230 1 874 . 1 1 73 73 TYR HE2 H 1 6.8 0.02 . 3 . . . . 186 TYR HE . 16230 1 875 . 1 1 73 73 TYR C C 13 175.557 0.4 . 1 . . . . 186 TYR CO . 16230 1 876 . 1 1 73 73 TYR CA C 13 58.604 0.4 . 1 . . . . 186 TYR CA . 16230 1 877 . 1 1 73 73 TYR CB C 13 38.975 0.4 . 1 . . . . 186 TYR CB . 16230 1 878 . 1 1 73 73 TYR N N 15 122.901 0.4 . 1 . . . . 186 TYR N . 16230 1 879 . 1 1 74 74 THR H H 1 8.334 0.02 . 1 . . . . 187 THR HN . 16230 1 880 . 1 1 74 74 THR HA H 1 4.556 0.02 . 1 . . . . 187 THR HA . 16230 1 881 . 1 1 74 74 THR HB H 1 4.017 0.02 . 1 . . . . 187 THR HB . 16230 1 882 . 1 1 74 74 THR HG21 H 1 1.097 0.02 . 1 . . . . 187 THR HG . 16230 1 883 . 1 1 74 74 THR HG22 H 1 1.097 0.02 . 1 . . . . 187 THR HG . 16230 1 884 . 1 1 74 74 THR HG23 H 1 1.097 0.02 . 1 . . . . 187 THR HG . 16230 1 885 . 1 1 74 74 THR CA C 13 62.508 0.4 . 1 . . . . 187 THR CA . 16230 1 886 . 1 1 74 74 THR CB C 13 68.989 0.4 . 1 . . . . 187 THR CB . 16230 1 887 . 1 1 74 74 THR CG2 C 13 21.859 0.4 . 1 . . . . 187 THR CG . 16230 1 888 . 1 1 74 74 THR N N 15 118.748 0.4 . 1 . . . . 187 THR N . 16230 1 889 . 1 1 75 75 LEU H H 1 9.141 0.02 . 1 . . . . 188 LEU HN . 16230 1 890 . 1 1 75 75 LEU HA H 1 4.149 0.02 . 1 . . . . 188 LEU HA . 16230 1 891 . 1 1 75 75 LEU HB2 H 1 1.844 0.02 . 2 . . . . 188 LEU HB . 16230 1 892 . 1 1 75 75 LEU HB3 H 1 1.844 0.02 . 2 . . . . 188 LEU HB . 16230 1 893 . 1 1 75 75 LEU C C 13 175.606 0.4 . 1 . . . . 188 LEU CO . 16230 1 894 . 1 1 75 75 LEU CA C 13 56.837 0.4 . 1 . . . . 188 LEU CA . 16230 1 895 . 1 1 75 75 LEU CB C 13 44.134 0.4 . 1 . . . . 188 LEU CB . 16230 1 896 . 1 1 75 75 LEU N N 15 130.891 0.4 . 1 . . . . 188 LEU N . 16230 1 897 . 1 1 76 76 VAL H H 1 8.087 0.02 . 1 . . . . 189 VAL HN . 16230 1 898 . 1 1 76 76 VAL HA H 1 4.673 0.02 . 1 . . . . 189 VAL HA . 16230 1 899 . 1 1 76 76 VAL HB H 1 1.707 0.02 . 1 . . . . 189 VAL HB . 16230 1 900 . 1 1 76 76 VAL HG11 H 1 0.943 0.02 . 2 . . . . 189 VAL HG1 . 16230 1 901 . 1 1 76 76 VAL HG12 H 1 0.943 0.02 . 2 . . . . 189 VAL HG1 . 16230 1 902 . 1 1 76 76 VAL HG13 H 1 0.943 0.02 . 2 . . . . 189 VAL HG1 . 16230 1 903 . 1 1 76 76 VAL HG21 H 1 0.968 0.02 . 2 . . . . 189 VAL HG2 . 16230 1 904 . 1 1 76 76 VAL HG22 H 1 0.968 0.02 . 2 . . . . 189 VAL HG2 . 16230 1 905 . 1 1 76 76 VAL HG23 H 1 0.968 0.02 . 2 . . . . 189 VAL HG2 . 16230 1 906 . 1 1 76 76 VAL CA C 13 61.431 0.4 . 1 . . . . 189 VAL CA . 16230 1 907 . 1 1 76 76 VAL CB C 13 34.174 0.4 . 1 . . . . 189 VAL CB . 16230 1 908 . 1 1 76 76 VAL CG1 C 13 21.274 0.4 . 2 . . . . 189 VAL CG1 . 16230 1 909 . 1 1 76 76 VAL CG2 C 13 20.979 0.4 . 2 . . . . 189 VAL CG2 . 16230 1 910 . 1 1 76 76 VAL N N 15 125.014 0.4 . 1 . . . . 189 VAL N . 16230 1 911 . 1 1 77 77 THR H H 1 8.811 0.02 . 1 . . . . 190 THR HN . 16230 1 912 . 1 1 77 77 THR HA H 1 5.188 0.02 . 1 . . . . 190 THR HA . 16230 1 913 . 1 1 77 77 THR HB H 1 3.699 0.02 . 1 . . . . 190 THR HB . 16230 1 914 . 1 1 77 77 THR HG21 H 1 1.005 0.02 . 1 . . . . 190 THR HG . 16230 1 915 . 1 1 77 77 THR HG22 H 1 1.005 0.02 . 1 . . . . 190 THR HG . 16230 1 916 . 1 1 77 77 THR HG23 H 1 1.005 0.02 . 1 . . . . 190 THR HG . 16230 1 917 . 1 1 77 77 THR C C 13 172.333 0.4 . 1 . . . . 190 THR CO . 16230 1 918 . 1 1 77 77 THR CA C 13 62.006 0.4 . 1 . . . . 190 THR CA . 16230 1 919 . 1 1 77 77 THR CB C 13 72.325 0.4 . 1 . . . . 190 THR CB . 16230 1 920 . 1 1 77 77 THR CG2 C 13 22.354 0.4 . 1 . . . . 190 THR CG . 16230 1 921 . 1 1 77 77 THR N N 15 121.167 0.4 . 1 . . . . 190 THR N . 16230 1 922 . 1 1 78 78 LYS H H 1 9.094 0.02 . 1 . . . . 191 LYS HN . 16230 1 923 . 1 1 78 78 LYS HA H 1 4.793 0.02 . 1 . . . . 191 LYS HA . 16230 1 924 . 1 1 78 78 LYS HB2 H 1 1.637 0.02 . 2 . . . . 191 LYS HB2 . 16230 1 925 . 1 1 78 78 LYS HB3 H 1 1.963 0.02 . 2 . . . . 191 LYS HB3 . 16230 1 926 . 1 1 78 78 LYS HD2 H 1 1.626 0.02 . 2 . . . . 191 LYS HD2 . 16230 1 927 . 1 1 78 78 LYS HD3 H 1 1.775 0.02 . 2 . . . . 191 LYS HD3 . 16230 1 928 . 1 1 78 78 LYS HE2 H 1 2.992 0.02 . 2 . . . . 191 LYS HE . 16230 1 929 . 1 1 78 78 LYS HE3 H 1 2.992 0.02 . 2 . . . . 191 LYS HE . 16230 1 930 . 1 1 78 78 LYS HG2 H 1 1.379 0.02 . 2 . . . . 191 LYS HG2 . 16230 1 931 . 1 1 78 78 LYS HG3 H 1 1.538 0.02 . 2 . . . . 191 LYS HG3 . 16230 1 932 . 1 1 78 78 LYS C C 13 175.4 0.4 . 1 . . . . 191 LYS CO . 16230 1 933 . 1 1 78 78 LYS CA C 13 54.856 0.4 . 1 . . . . 191 LYS CA . 16230 1 934 . 1 1 78 78 LYS CB C 13 37.592 0.4 . 1 . . . . 191 LYS CB . 16230 1 935 . 1 1 78 78 LYS CD C 13 29.764 0.4 . 1 . . . . 191 LYS CD . 16230 1 936 . 1 1 78 78 LYS CE C 13 42.301 0.4 . 1 . . . . 191 LYS CE . 16230 1 937 . 1 1 78 78 LYS CG C 13 25.037 0.4 . 1 . . . . 191 LYS CG . 16230 1 938 . 1 1 78 78 LYS N N 15 123.094 0.4 . 1 . . . . 191 LYS N . 16230 1 939 . 1 1 79 79 VAL H H 1 8.669 0.02 . 1 . . . . 192 VAL HN . 16230 1 940 . 1 1 79 79 VAL HA H 1 4.116 0.02 . 1 . . . . 192 VAL HA . 16230 1 941 . 1 1 79 79 VAL HB H 1 2.06 0.02 . 1 . . . . 192 VAL HB . 16230 1 942 . 1 1 79 79 VAL HG11 H 1 1.001 0.02 . 2 . . . . 192 VAL HG1 . 16230 1 943 . 1 1 79 79 VAL HG12 H 1 1.001 0.02 . 2 . . . . 192 VAL HG1 . 16230 1 944 . 1 1 79 79 VAL HG13 H 1 1.001 0.02 . 2 . . . . 192 VAL HG1 . 16230 1 945 . 1 1 79 79 VAL HG21 H 1 1.069 0.02 . 2 . . . . 192 VAL HG2 . 16230 1 946 . 1 1 79 79 VAL HG22 H 1 1.069 0.02 . 2 . . . . 192 VAL HG2 . 16230 1 947 . 1 1 79 79 VAL HG23 H 1 1.069 0.02 . 2 . . . . 192 VAL HG2 . 16230 1 948 . 1 1 79 79 VAL C C 13 176.73 0.4 . 1 . . . . 192 VAL CO . 16230 1 949 . 1 1 79 79 VAL CA C 13 64.644 0.4 . 1 . . . . 192 VAL CA . 16230 1 950 . 1 1 79 79 VAL CB C 13 32.167 0.4 . 1 . . . . 192 VAL CB . 16230 1 951 . 1 1 79 79 VAL CG1 C 13 22.196 0.4 . 1 . . . . 192 VAL CG1 . 16230 1 952 . 1 1 79 79 VAL N N 15 121.137 0.4 . 1 . . . . 192 VAL N . 16230 1 953 . 1 1 80 80 SER H H 1 8.991 0.02 . 1 . . . . 193 SER HN . 16230 1 954 . 1 1 80 80 SER CA C 13 58.845 0.4 . 1 . . . . 193 SER CA . 16230 1 955 . 1 1 80 80 SER CB C 13 64.43 0.4 . 1 . . . . 193 SER CB . 16230 1 956 . 1 1 80 80 SER N N 15 122.498 0.4 . 1 . . . . 193 SER N . 16230 1 957 . 1 1 81 81 ASN H H 1 9.145 0.02 . 1 . . . . 194 ASN HN . 16230 1 958 . 1 1 81 81 ASN HD21 H 1 7.086 0.02 . 2 . . . . 194 ASN HD21 . 16230 1 959 . 1 1 81 81 ASN HD22 H 1 7.628 0.02 . 2 . . . . 194 ASN HD22 . 16230 1 960 . 1 1 81 81 ASN N N 15 123.884 0.4 . 1 . . . . 194 ASN N . 16230 1 961 . 1 1 81 81 ASN ND2 N 15 111.961 0.4 . 1 . . . . 194 ASN ND . 16230 1 962 . 1 1 82 82 PRO HA H 1 4.262 0.02 . 1 . . . . 195 PRO HA . 16230 1 963 . 1 1 82 82 PRO HB2 H 1 2.264 0.02 . 2 . . . . 195 PRO HB . 16230 1 964 . 1 1 82 82 PRO HB3 H 1 2.264 0.02 . 2 . . . . 195 PRO HB . 16230 1 965 . 1 1 82 82 PRO HD2 H 1 3.785 0.02 . 2 . . . . 195 PRO HD2 . 16230 1 966 . 1 1 82 82 PRO HD3 H 1 3.865 0.02 . 2 . . . . 195 PRO HD3 . 16230 1 967 . 1 1 82 82 PRO HG2 H 1 1.923 0.02 . 2 . . . . 195 PRO HG2 . 16230 1 968 . 1 1 82 82 PRO HG3 H 1 2.013 0.02 . 2 . . . . 195 PRO HG3 . 16230 1 969 . 1 1 82 82 PRO C C 13 177.163 0.4 . 1 . . . . 195 PRO CO . 16230 1 970 . 1 1 82 82 PRO CA C 13 63.91 0.4 . 1 . . . . 195 PRO CA . 16230 1 971 . 1 1 82 82 PRO CB C 13 32.426 0.4 . 1 . . . . 195 PRO CB . 16230 1 972 . 1 1 82 82 PRO CD C 13 50.909 0.4 . 1 . . . . 195 PRO CD . 16230 1 973 . 1 1 82 82 PRO CG C 13 27.494 0.4 . 1 . . . . 195 PRO CG . 16230 1 974 . 1 1 83 83 LEU H H 1 8.067 0.02 . 1 . . . . 196 LEU HN . 16230 1 975 . 1 1 83 83 LEU HA H 1 4.183 0.02 . 1 . . . . 196 LEU HA . 16230 1 976 . 1 1 83 83 LEU HB2 H 1 1.49 0.02 . 2 . . . . 196 LEU HB . 16230 1 977 . 1 1 83 83 LEU HB3 H 1 1.49 0.02 . 2 . . . . 196 LEU HB . 16230 1 978 . 1 1 83 83 LEU HD11 H 1 0.704 0.02 . 2 . . . . 196 LEU HD1 . 16230 1 979 . 1 1 83 83 LEU HD12 H 1 0.704 0.02 . 2 . . . . 196 LEU HD1 . 16230 1 980 . 1 1 83 83 LEU HD13 H 1 0.704 0.02 . 2 . . . . 196 LEU HD1 . 16230 1 981 . 1 1 83 83 LEU HD21 H 1 0.762 0.02 . 2 . . . . 196 LEU HD2 . 16230 1 982 . 1 1 83 83 LEU HD22 H 1 0.762 0.02 . 2 . . . . 196 LEU HD2 . 16230 1 983 . 1 1 83 83 LEU HD23 H 1 0.762 0.02 . 2 . . . . 196 LEU HD2 . 16230 1 984 . 1 1 83 83 LEU C C 13 177.863 0.4 . 1 . . . . 196 LEU CO . 16230 1 985 . 1 1 83 83 LEU CA C 13 55.792 0.4 . 1 . . . . 196 LEU CA . 16230 1 986 . 1 1 83 83 LEU CB C 13 42.215 0.4 . 1 . . . . 196 LEU CB . 16230 1 987 . 1 1 83 83 LEU CD1 C 13 25.123 0.4 . 2 . . . . 196 LEU CD1 . 16230 1 988 . 1 1 83 83 LEU CD2 C 13 23.443 0.4 . 2 . . . . 196 LEU CD2 . 16230 1 989 . 1 1 83 83 LEU N N 15 119.735 0.4 . 1 . . . . 196 LEU N . 16230 1 990 . 1 1 84 84 GLU H H 1 8.1 0.02 . 1 . . . . 197 GLU HN . 16230 1 991 . 1 1 84 84 GLU HA H 1 4.207 0.02 . 1 . . . . 197 GLU HA . 16230 1 992 . 1 1 84 84 GLU HB2 H 1 1.912 0.02 . 2 . . . . 197 GLU HB . 16230 1 993 . 1 1 84 84 GLU HB3 H 1 1.912 0.02 . 2 . . . . 197 GLU HB . 16230 1 994 . 1 1 84 84 GLU HG2 H 1 2.184 0.02 . 2 . . . . 197 GLU HG . 16230 1 995 . 1 1 84 84 GLU HG3 H 1 2.184 0.02 . 2 . . . . 197 GLU HG . 16230 1 996 . 1 1 84 84 GLU C C 13 176.553 0.4 . 1 . . . . 197 GLU CO . 16230 1 997 . 1 1 84 84 GLU CA C 13 56.798 0.4 . 1 . . . . 197 GLU CA . 16230 1 998 . 1 1 84 84 GLU CB C 13 30.221 0.4 . 1 . . . . 197 GLU CB . 16230 1 999 . 1 1 84 84 GLU CG C 13 36.43 0.4 . 1 . . . . 197 GLU CG . 16230 1 1000 . 1 1 84 84 GLU N N 15 120.386 0.4 . 1 . . . . 197 GLU N . 16230 1 1001 . 1 1 85 85 LEU H H 1 7.942 0.02 . 1 . . . . 198 LEU HN . 16230 1 1002 . 1 1 85 85 LEU HA H 1 4.16 0.02 . 1 . . . . 198 LEU HA . 16230 1 1003 . 1 1 85 85 LEU HB2 H 1 1.469 0.02 . 2 . . . . 198 LEU HB . 16230 1 1004 . 1 1 85 85 LEU HB3 H 1 1.469 0.02 . 2 . . . . 198 LEU HB . 16230 1 1005 . 1 1 85 85 LEU HD21 H 1 23.453 0.4 . 2 . . . . 198 LEU HD2 . 16230 1 1006 . 1 1 85 85 LEU HD22 H 1 23.453 0.4 . 2 . . . . 198 LEU HD2 . 16230 1 1007 . 1 1 85 85 LEU HD23 H 1 23.453 0.4 . 2 . . . . 198 LEU HD2 . 16230 1 1008 . 1 1 85 85 LEU HG H 1 1.484 0.02 . 1 . . . . 198 LEU HG . 16230 1 1009 . 1 1 85 85 LEU C C 13 177.697 0.4 . 1 . . . . 198 LEU CO . 16230 1 1010 . 1 1 85 85 LEU CA C 13 55.728 0.4 . 1 . . . . 198 LEU CA . 16230 1 1011 . 1 1 85 85 LEU CB C 13 42.515 0.4 . 1 . . . . 198 LEU CB . 16230 1 1012 . 1 1 85 85 LEU CD1 C 13 25.053 0.4 . 2 . . . . 198 LEU CD1 . 16230 1 1013 . 1 1 85 85 LEU CG C 13 27.202 0.4 . 1 . . . . 198 LEU CG . 16230 1 1014 . 1 1 85 85 LEU N N 15 121.63 0.4 . 1 . . . . 198 LEU N . 16230 1 1015 . 1 1 86 86 GLU H H 1 8.222 0.02 . 1 . . . . 199 GLU HN . 16230 1 1016 . 1 1 86 86 GLU HA H 1 4.101 0.02 . 1 . . . . 199 GLU HA . 16230 1 1017 . 1 1 86 86 GLU HB2 H 1 1.846 0.02 . 2 . . . . 199 GLU HB . 16230 1 1018 . 1 1 86 86 GLU HB3 H 1 1.846 0.02 . 2 . . . . 199 GLU HB . 16230 1 1019 . 1 1 86 86 GLU HG2 H 1 2.077 0.02 . 2 . . . . 199 GLU HG2 . 16230 1 1020 . 1 1 86 86 GLU HG3 H 1 2.147 0.02 . 2 . . . . 199 GLU HG3 . 16230 1 1021 . 1 1 86 86 GLU C C 13 176.588 0.4 . 1 . . . . 199 GLU CO . 16230 1 1022 . 1 1 86 86 GLU CA C 13 57.17 0.4 . 1 . . . . 199 GLU CA . 16230 1 1023 . 1 1 86 86 GLU CB C 13 30.269 0.4 . 1 . . . . 199 GLU CB . 16230 1 1024 . 1 1 86 86 GLU CG C 13 36.395 0.4 . 1 . . . . 199 GLU CG . 16230 1 1025 . 1 1 86 86 GLU N N 15 119.94 0.4 . 1 . . . . 199 GLU N . 16230 1 1026 . 1 1 87 87 HIS H H 1 8.15 0.02 . 1 . . . . 200 HIS HN . 16230 1 1027 . 1 1 87 87 HIS HA H 1 4.718 0.02 . 1 . . . . 200 HIS HA . 16230 1 1028 . 1 1 87 87 HIS HB2 H 1 3.056 0.02 . 2 . . . . 200 HIS HB . 16230 1 1029 . 1 1 87 87 HIS HB3 H 1 3.056 0.02 . 2 . . . . 200 HIS HB . 16230 1 1030 . 1 1 87 87 HIS C C 13 174.249 0.4 . 1 . . . . 200 HIS CO . 16230 1 1031 . 1 1 87 87 HIS CA C 13 56.29 0.4 . 1 . . . . 200 HIS CA . 16230 1 1032 . 1 1 87 87 HIS CB C 13 30.458 0.4 . 1 . . . . 200 HIS CB . 16230 1 1033 . 1 1 87 87 HIS N N 15 118.579 0.4 . 1 . . . . 200 HIS N . 16230 1 1034 . 1 1 88 88 HIS H H 1 8.066 0.02 . 1 . . . . 201 HIS HN . 16230 1 1035 . 1 1 88 88 HIS N N 15 125.056 0.4 . 1 . . . . 201 HIS N . 16230 1 1036 . 2 2 1 1 A H1' H 1 5.909 0.02 . 1 . . . . 1 A H1' . 16230 1 1037 . 2 2 1 1 A H2 H 1 8.028 0.02 . 1 . . . . 1 A H2 . 16230 1 1038 . 2 2 1 1 A H2' H 1 4.765 0.02 . 1 . . . . 1 A H2' . 16230 1 1039 . 2 2 1 1 A H3' H 1 4.723 0.02 . 1 . . . . 1 A H3' . 16230 1 1040 . 2 2 1 1 A H4' H 1 4.721 0.02 . 1 . . . . 1 A H4' . 16230 1 1041 . 2 2 1 1 A H5' H 1 3.839 0.02 . 2 . . . . 1 A H5' . 16230 1 1042 . 2 2 1 1 A H5'' H 1 3.8 0.02 . 2 . . . . 1 A H5'' . 16230 1 1043 . 2 2 1 1 A H8 H 1 8.157 0.02 . 1 . . . . 1 A H8 . 16230 1 1044 . 2 2 1 1 A C1' C 13 88.308 0.4 . 1 . . . . 1 A C1' . 16230 1 1045 . 2 2 1 1 A C2' C 13 80.350 0.4 . 1 . . . . 1 A C2' . 16230 1 1046 . 2 2 1 1 A C5' C 13 74.811 0.4 . 1 . . . . 1 A C5' . 16230 1 1047 . 2 2 2 2 G H1' H 1 5.69 0.02 . 1 . . . . 2 G H1' . 16230 1 1048 . 2 2 2 2 G H2' H 1 4.723 0.02 . 1 . . . . 2 G H2' . 16230 1 1049 . 2 2 2 2 G H3' H 1 4.425 0.02 . 1 . . . . 2 G H3' . 16230 1 1050 . 2 2 2 2 G H4' H 1 4.666 0.02 . 1 . . . . 2 G H4' . 16230 1 1051 . 2 2 2 2 G H5' H 1 4.277 0.02 . 2 . . . . 2 G H5' . 16230 1 1052 . 2 2 2 2 G H5'' H 1 4.193 0.02 . 2 . . . . 2 G H5'' . 16230 1 1053 . 2 2 2 2 G H8 H 1 7.889 0.02 . 1 . . . . 2 G H8 . 16230 1 1054 . 2 2 2 2 G C1' C 13 87.546 0.4 . 1 . . . . 2 G C1' . 16230 1 1055 . 2 2 2 2 G C2' C 13 81.078 0.4 . 1 . . . . 2 G C2' . 16230 1 1056 . 2 2 2 2 G C4' C 13 85.039 0.4 . 1 . . . . 2 G C4' . 16230 1 1057 . 2 2 2 2 G C5' C 13 76.336 0.4 . 1 . . . . 2 G C5' . 16230 1 1058 . 2 2 3 3 A H1' H 1 5.86 0.02 . 1 . . . . 3 A H1' . 16230 1 1059 . 2 2 3 3 A H2 H 1 7.965 0.02 . 1 . . . . 3 A H2 . 16230 1 1060 . 2 2 3 3 A H2' H 1 4.701 0.02 . 1 . . . . 3 A H2' . 16230 1 1061 . 2 2 3 3 A H5' H 1 3.839 0.02 . 2 . . . . 3 A H5' . 16230 1 1062 . 2 2 3 3 A H5'' H 1 3.81 0.02 . 2 . . . . 3 A H5'' . 16230 1 1063 . 2 2 3 3 A H8 H 1 8.171 0.02 . 1 . . . . 3 A H8 . 16230 1 1064 . 2 2 3 3 A C1' C 13 87.678 0.4 . 1 . . . . 3 A C1' . 16230 1 1065 . 2 2 3 3 A C2' C 13 80.581 0.4 . 1 . . . . 3 A C2' . 16230 1 1066 . 2 2 3 3 A C5' C 13 74.457 0.4 . 1 . . . . 3 A C5' . 16230 1 1067 . 2 2 4 4 G H1' H 1 5.65 0.02 . 1 . . . . 4 G H1' . 16230 1 1068 . 2 2 4 4 G H2' H 1 4.712 0.02 . 1 . . . . 4 G H2' . 16230 1 1069 . 2 2 4 4 G H3' H 1 4.757 0.02 . 1 . . . . 4 G H3' . 16230 1 1070 . 2 2 4 4 G H4' H 1 4.509 0.02 . 1 . . . . 4 G H4' . 16230 1 1071 . 2 2 4 4 G H5' H 1 4.325 0.02 . 2 . . . . 4 G H5' . 16230 1 1072 . 2 2 4 4 G H5'' H 1 4.224 0.02 . 2 . . . . 4 G H5'' . 16230 1 1073 . 2 2 4 4 G H8 H 1 7.827 0.02 . 1 . . . . 4 G H8 . 16230 1 1074 . 2 2 4 4 G C1' C 13 87.814 0.4 . 1 . . . . 4 G C1' . 16230 1 1075 . 2 2 4 4 G C2' C 13 80.222 0.4 . 1 . . . . 4 G C2' . 16230 1 1076 . 2 2 4 4 G C3' C 13 80.746 0.4 . 1 . . . . 4 G C3' . 16230 1 1077 . 2 2 4 4 G C4' C 13 84.848 0.4 . 1 . . . . 4 G C4' . 16230 1 1078 . 2 2 4 4 G C5' C 13 76.291 0.4 . 1 . . . . 4 G C5' . 16230 1 1079 . 2 2 5 5 A H1' H 1 6.017 0.02 . 1 . . . . 5 A H1' . 16230 1 1080 . 2 2 5 5 A H2 H 1 8.094 0.02 . 1 . . . . 5 A H2 . 16230 1 1081 . 2 2 5 5 A H2' H 1 4.678 0.02 . 1 . . . . 5 A H2' . 16230 1 1082 . 2 2 5 5 A H3' H 1 4.748 0.02 . 1 . . . . 5 A H3' . 16230 1 1083 . 2 2 5 5 A H4' H 1 4.56 0.02 . 1 . . . . 5 A H4' . 16230 1 1084 . 2 2 5 5 A H5' H 1 4.408 0.02 . 2 . . . . 5 A H5' . 16230 1 1085 . 2 2 5 5 A H5'' H 1 4.228 0.02 . 2 . . . . 5 A H5'' . 16230 1 1086 . 2 2 5 5 A H8 H 1 8.259 0.02 . 1 . . . . 5 A H8 . 16230 1 1087 . 2 2 5 5 A C1' C 13 87.844 0.4 . 1 . . . . 5 A C1' . 16230 1 1088 . 2 2 5 5 A C3' C 13 80.335 0.4 . 1 . . . . 5 A C3' . 16230 1 1089 . 2 2 5 5 A C4' C 13 84.791 0.4 . 1 . . . . 5 A C4' . 16230 1 1090 . 2 2 5 5 A C5' C 13 76.039 0.4 . 1 . . . . 5 A C5' . 16230 1 1091 . 2 2 6 6 U H1' H 1 5.797 0.02 . 1 . . . . 6 U H1' . 16230 1 1092 . 2 2 6 6 U H2' H 1 4.209 0.02 . 1 . . . . 6 U H2' . 16230 1 1093 . 2 2 6 6 U H4' H 1 4.206 0.02 . 1 . . . . 6 U H4' . 16230 1 1094 . 2 2 6 6 U H5 H 1 5.598 0.02 . 1 . . . . 6 U H5 . 16230 1 1095 . 2 2 6 6 U H5' H 1 4.093 0.02 . 2 . . . . 6 U H5' . 16230 1 1096 . 2 2 6 6 U H5'' H 1 4.093 0.02 . 2 . . . . 6 U H5'' . 16230 1 1097 . 2 2 6 6 U H6 H 1 7.719 0.02 . 1 . . . . 6 U H6 . 16230 1 1098 . 2 2 6 6 U C1' C 13 88.288 0.4 . 1 . . . . 6 U C1' . 16230 1 1099 . 2 2 6 6 U C4' C 13 85.151 0.4 . 1 . . . . 6 U C4' . 16230 1 1100 . 2 2 6 6 U C5' C 13 75.965 0.4 . 1 . . . . 6 U C5' . 16230 1 stop_ save_