data_11366 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11366 _Entry.Title ; Assigned chemical shifts of the human spliceosomal protein complex p14-SF3b155 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-09-08 _Entry.Accession_date 2010-09-08 _Entry.Last_release_date 2011-09-07 _Entry.Original_release_date 2011-09-07 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.14 _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 K. Kuwasako . . . 11366 2 N. Dohmae . . . 11366 3 M. Inoue . . . 11366 4 M. Shirouzu . . . 11366 5 P. Guntert . . . 11366 6 B. Seraphin . . . 11366 7 Y. Muto . . . 11366 8 S. Yokoyama . . . 11366 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 . 'Protein 3000' 'RIKEN Structural Genomics/Proteomics Initiative (RSGI)' . 11366 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11366 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 516 11366 '15N chemical shifts' 112 11366 '1H chemical shifts' 804 11366 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2011-09-07 2010-09-08 original author . 11366 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 11367 'Assigned chemical shifts of the human spliceosomal protein SF3b155' 11366 PDB 2FHO 'BMRB Entry Tracking System' 11366 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11366 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'NMR solution structure of the human spliceosomal protein complex p14-SF3b155' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _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 . _Citation.Page_last . _Citation.Year . _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 K. Kuwasako . . . 11366 1 2 N. Dohmae . . . 11366 1 3 M. Inoue . . . 11366 1 4 M. Shirouzu . . . 11366 1 5 P. Guntert . . . 11366 1 6 B. Seraphin . . . 11366 1 7 Y. Muto . . . 11366 1 8 S. Yokoyama . . . 11366 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11366 _Assembly.ID 1 _Assembly.Name 'spliceosomal protein complex p14-SF3b155' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'spliceosomal protein SF3b155, residues in database 379-424' 1 $entity_1 A . yes native no no . . . 11366 1 2 'spliceosomal protein p14, RNA recognition motif' 2 $entity_2 B . yes native no no . . . 11366 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2fho . . . . . . 11366 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11366 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'spliceosomal protein SF3b155, residues in database 379-424' _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 ; GTPEQLQAWRWEREIDERNR PLSDEELDAMFPEGYKVLPP PAGYVPI ; _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 47 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 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 11367 . "spliceosomal protein SF3b155, residues in database 379-424" . . . . . 100.00 47 100.00 100.00 1.86e-24 . . . . 11366 1 2 no PDB 2F9D . "2.5 Angstrom Resolution Structure Of The Spliceosomal Protein P14 Bound To Region Of Sf3b155" . . . . . 78.72 43 97.30 97.30 6.66e-16 . . . . 11366 1 3 no PDB 2F9J . "3.0 Angstrom Resolution Structure Of A Y22m Mutant Of The Spliceosomal Protein P14 Bound To A Region Of Sf3b155" . . . . . 74.47 36 100.00 100.00 3.77e-15 . . . . 11366 1 4 no PDB 2FHO . "Nmr Solution Structure Of The Human Spliceosomal Protein Complex P14-Sf3b155" . . . . . 100.00 47 100.00 100.00 1.86e-24 . . . . 11366 1 5 no PDB 3LQV . "Branch Recognition By Sf3b14" . . . . . 78.72 39 100.00 100.00 6.36e-17 . . . . 11366 1 6 no DBJ BAB28369 . "unnamed protein product [Mus musculus]" . . . . . 97.87 490 100.00 100.00 1.46e-22 . . . . 11366 1 7 no DBJ BAB40140 . "pre-mRNA splicing factor SF3b 155 kDa subunit [Mus musculus]" . . . . . 97.87 1304 100.00 100.00 3.34e-22 . . . . 11366 1 8 no DBJ BAE24537 . "unnamed protein product [Mus musculus]" . . . . . 97.87 781 100.00 100.00 3.55e-22 . . . . 11366 1 9 no DBJ BAE27592 . "unnamed protein product [Mus musculus]" . . . . . 97.87 497 100.00 100.00 1.61e-22 . . . . 11366 1 10 no EMBL CAA70201 . "146kDa nuclear protein [Xenopus laevis]" . . . . . 97.87 1307 100.00 100.00 3.22e-22 . . . . 11366 1 11 no GB AAC97189 . "spliceosomal protein SAP 155 [Homo sapiens]" . . . . . 97.87 1304 100.00 100.00 3.24e-22 . . . . 11366 1 12 no GB AAG01404 . "spliceosomal protein SAP155 [Rattus norvegicus]" . . . . . 97.87 496 97.83 97.83 1.52e-21 . . . . 11366 1 13 no GB AAH03419 . "Sf3b1 protein, partial [Mus musculus]" . . . . . 97.87 496 100.00 100.00 1.45e-22 . . . . 11366 1 14 no GB AAH15530 . "SF3B1 protein, partial [Homo sapiens]" . . . . . 97.87 496 100.00 100.00 1.45e-22 . . . . 11366 1 15 no GB AAH28959 . "Sf3b1 protein, partial [Mus musculus]" . . . . . 97.87 496 100.00 100.00 1.45e-22 . . . . 11366 1 16 no REF NP_001084150 . "splicing factor 3B subunit 1 [Xenopus laevis]" . . . . . 97.87 1307 100.00 100.00 3.22e-22 . . . . 11366 1 17 no REF NP_001179923 . "splicing factor 3B subunit 1 [Bos taurus]" . . . . . 97.87 1304 100.00 100.00 3.37e-22 . . . . 11366 1 18 no REF NP_001252892 . "splicing factor 3B subunit 1 [Macaca mulatta]" . . . . . 97.87 1304 100.00 100.00 3.34e-22 . . . . 11366 1 19 no REF NP_036565 . "splicing factor 3B subunit 1 isoform 1 [Homo sapiens]" . . . . . 97.87 1304 100.00 100.00 3.34e-22 . . . . 11366 1 20 no REF NP_112456 . "splicing factor 3B subunit 1 [Mus musculus]" . . . . . 97.87 1304 100.00 100.00 3.34e-22 . . . . 11366 1 21 no SP O57683 . "RecName: Full=Splicing factor 3B subunit 1; AltName: Full=146 kDa nuclear protein; AltName: Full=Pre-mRNA-splicing factor SF3b " . . . . . 97.87 1307 100.00 100.00 3.22e-22 . . . . 11366 1 22 no SP O75533 . "RecName: Full=Splicing factor 3B subunit 1; AltName: Full=Pre-mRNA-splicing factor SF3b 155 kDa subunit; Short=SF3b155; AltName" . . . . . 97.87 1304 100.00 100.00 3.34e-22 . . . . 11366 1 23 no SP Q99NB9 . "RecName: Full=Splicing factor 3B subunit 1; AltName: Full=Pre-mRNA-splicing factor SF3b 155 kDa subunit; Short=SF3b155; AltName" . . . . . 97.87 1304 100.00 100.00 3.34e-22 . . . . 11366 1 24 no TPG DAA32571 . "TPA: splicing factor 3b, subunit 1, 155kDa [Bos taurus]" . . . . . 97.87 1304 100.00 100.00 3.37e-22 . . . . 11366 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'spliceosomal protein SF3b155, residues in database 379-424' . 11366 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 . GLY . 11366 1 2 . THR . 11366 1 3 . PRO . 11366 1 4 . GLU . 11366 1 5 . GLN . 11366 1 6 . LEU . 11366 1 7 . GLN . 11366 1 8 . ALA . 11366 1 9 . TRP . 11366 1 10 . ARG . 11366 1 11 . TRP . 11366 1 12 . GLU . 11366 1 13 . ARG . 11366 1 14 . GLU . 11366 1 15 . ILE . 11366 1 16 . ASP . 11366 1 17 . GLU . 11366 1 18 . ARG . 11366 1 19 . ASN . 11366 1 20 . ARG . 11366 1 21 . PRO . 11366 1 22 . LEU . 11366 1 23 . SER . 11366 1 24 . ASP . 11366 1 25 . GLU . 11366 1 26 . GLU . 11366 1 27 . LEU . 11366 1 28 . ASP . 11366 1 29 . ALA . 11366 1 30 . MET . 11366 1 31 . PHE . 11366 1 32 . PRO . 11366 1 33 . GLU . 11366 1 34 . GLY . 11366 1 35 . TYR . 11366 1 36 . LYS . 11366 1 37 . VAL . 11366 1 38 . LEU . 11366 1 39 . PRO . 11366 1 40 . PRO . 11366 1 41 . PRO . 11366 1 42 . ALA . 11366 1 43 . GLY . 11366 1 44 . TYR . 11366 1 45 . VAL . 11366 1 46 . PRO . 11366 1 47 . ILE . 11366 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 11366 1 . THR 2 2 11366 1 . PRO 3 3 11366 1 . GLU 4 4 11366 1 . GLN 5 5 11366 1 . LEU 6 6 11366 1 . GLN 7 7 11366 1 . ALA 8 8 11366 1 . TRP 9 9 11366 1 . ARG 10 10 11366 1 . TRP 11 11 11366 1 . GLU 12 12 11366 1 . ARG 13 13 11366 1 . GLU 14 14 11366 1 . ILE 15 15 11366 1 . ASP 16 16 11366 1 . GLU 17 17 11366 1 . ARG 18 18 11366 1 . ASN 19 19 11366 1 . ARG 20 20 11366 1 . PRO 21 21 11366 1 . LEU 22 22 11366 1 . SER 23 23 11366 1 . ASP 24 24 11366 1 . GLU 25 25 11366 1 . GLU 26 26 11366 1 . LEU 27 27 11366 1 . ASP 28 28 11366 1 . ALA 29 29 11366 1 . MET 30 30 11366 1 . PHE 31 31 11366 1 . PRO 32 32 11366 1 . GLU 33 33 11366 1 . GLY 34 34 11366 1 . TYR 35 35 11366 1 . LYS 36 36 11366 1 . VAL 37 37 11366 1 . LEU 38 38 11366 1 . PRO 39 39 11366 1 . PRO 40 40 11366 1 . PRO 41 41 11366 1 . ALA 42 42 11366 1 . GLY 43 43 11366 1 . TYR 44 44 11366 1 . VAL 45 45 11366 1 . PRO 46 46 11366 1 . ILE 47 47 11366 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 11366 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name 'spliceosomal protein p14, RNA recognition motif' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GRANIRLPPEVNRILYIRNL PYKITAEEMYDIFGKYGPIR QIRVGNTPETRGTAYVVYED IFDAKNACDHLSGFNVCNRY LVVLYYN ; _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 87 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-31 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2F9D . "2.5 Angstrom Resolution Structure Of The Spliceosomal Protein P14 Bound To Region Of Sf3b155" . . . . . 98.85 125 100.00 100.00 1.32e-55 . . . . 11366 2 2 no PDB 2F9J . "3.0 Angstrom Resolution Structure Of A Y22m Mutant Of The Spliceosomal Protein P14 Bound To A Region Of Sf3b155" . . . . . 98.85 125 98.84 98.84 1.05e-54 . . . . 11366 2 3 no PDB 2FHO . "Nmr Solution Structure Of The Human Spliceosomal Protein Complex P14-Sf3b155" . . . . . 100.00 87 100.00 100.00 1.60e-55 . . . . 11366 2 4 no PDB 3LQV . "Branch Recognition By Sf3b14" . . . . . 95.40 115 97.59 97.59 7.10e-51 . . . . 11366 2 5 no DBJ BAB22052 . "unnamed protein product [Mus musculus]" . . . . . 98.85 125 100.00 100.00 1.32e-55 . . . . 11366 2 6 no DBJ BAB22936 . "unnamed protein product [Mus musculus]" . . . . . 98.85 125 100.00 100.00 1.32e-55 . . . . 11366 2 7 no DBJ BAE30577 . "unnamed protein product [Mus musculus]" . . . . . 98.85 125 100.00 100.00 1.32e-55 . . . . 11366 2 8 no DBJ BAG34849 . "unnamed protein product [Homo sapiens]" . . . . . 98.85 125 100.00 100.00 1.32e-55 . . . . 11366 2 9 no DBJ BAI45933 . "pre-mRNA branch site protein p14 [synthetic construct]" . . . . . 98.85 125 100.00 100.00 1.32e-55 . . . . 11366 2 10 no EMBL CAG00132 . "unnamed protein product [Tetraodon nigroviridis]" . . . . . 98.85 125 97.67 98.84 7.51e-55 . . . . 11366 2 11 no EMBL CAJ82723 . "splicing factor 3B, 14 kDa subunit (sf3b14) [Xenopus (Silurana) tropicalis]" . . . . . 98.85 125 98.84 98.84 8.28e-55 . . . . 11366 2 12 no EMBL CDQ59950 . "unnamed protein product [Oncorhynchus mykiss]" . . . . . 98.85 125 97.67 98.84 1.28e-54 . . . . 11366 2 13 no EMBL CDQ82948 . "unnamed protein product [Oncorhynchus mykiss]" . . . . . 98.85 125 97.67 98.84 1.28e-54 . . . . 11366 2 14 no GB AAD34105 . "CGI-110 protein [Homo sapiens]" . . . . . 98.85 125 100.00 100.00 1.32e-55 . . . . 11366 2 15 no GB AAF29138 . "HSPC175 [Homo sapiens]" . . . . . 98.85 125 100.00 100.00 1.32e-55 . . . . 11366 2 16 no GB AAG09698 . "ht006 protein [Homo sapiens]" . . . . . 98.85 125 100.00 100.00 1.32e-55 . . . . 11366 2 17 no GB AAH15463 . "Splicing factor 3B, 14 kDa subunit [Homo sapiens]" . . . . . 98.85 125 100.00 100.00 1.32e-55 . . . . 11366 2 18 no GB AAH19535 . "RIKEN cDNA 0610009D07 gene [Mus musculus]" . . . . . 98.85 125 100.00 100.00 1.32e-55 . . . . 11366 2 19 no REF NP_001002067 . "splicing factor 3B subunit 6 [Danio rerio]" . . . . . 98.85 125 100.00 100.00 1.32e-55 . . . . 11366 2 20 no REF NP_001017249 . "splicing factor 3b, subunit 6, 14kDa [Xenopus (Silurana) tropicalis]" . . . . . 98.85 125 98.84 98.84 8.28e-55 . . . . 11366 2 21 no REF NP_001039482 . "splicing factor 3B subunit 6 [Bos taurus]" . . . . . 98.85 125 100.00 100.00 1.32e-55 . . . . 11366 2 22 no REF NP_001079940 . "splicing factor 3b, subunit 6, 14kDa [Xenopus laevis]" . . . . . 98.85 125 97.67 98.84 3.23e-54 . . . . 11366 2 23 no REF NP_001153997 . "Pre-mRNA branch site protein p14 [Oncorhynchus mykiss]" . . . . . 98.85 125 97.67 98.84 1.38e-54 . . . . 11366 2 24 no SP P59708 . "RecName: Full=Splicing factor 3B subunit 6; AltName: Full=Pre-mRNA branch site protein p14; AltName: Full=SF3b 14 kDa subunit [" . . . . . 98.85 125 100.00 100.00 1.32e-55 . . . . 11366 2 25 no SP Q9Y3B4 . "RecName: Full=Splicing factor 3B subunit 6; AltName: Full=Pre-mRNA branch site protein p14; AltName: Full=SF3b 14 kDa subunit; " . . . . . 98.85 125 100.00 100.00 1.32e-55 . . . . 11366 2 26 no TPG DAA21891 . "TPA: splicing factor 3B, 14 kDa subunit-like [Bos taurus]" . . . . . 98.85 125 97.67 100.00 7.04e-55 . . . . 11366 2 27 no TPG DAA24388 . "TPA: splicing factor 3B, 14 kDa subunit [Bos taurus]" . . . . . 98.85 125 100.00 100.00 1.32e-55 . . . . 11366 2 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 11366 2 2 . ARG . 11366 2 3 . ALA . 11366 2 4 . ASN . 11366 2 5 . ILE . 11366 2 6 . ARG . 11366 2 7 . LEU . 11366 2 8 . PRO . 11366 2 9 . PRO . 11366 2 10 . GLU . 11366 2 11 . VAL . 11366 2 12 . ASN . 11366 2 13 . ARG . 11366 2 14 . ILE . 11366 2 15 . LEU . 11366 2 16 . TYR . 11366 2 17 . ILE . 11366 2 18 . ARG . 11366 2 19 . ASN . 11366 2 20 . LEU . 11366 2 21 . PRO . 11366 2 22 . TYR . 11366 2 23 . LYS . 11366 2 24 . ILE . 11366 2 25 . THR . 11366 2 26 . ALA . 11366 2 27 . GLU . 11366 2 28 . GLU . 11366 2 29 . MET . 11366 2 30 . TYR . 11366 2 31 . ASP . 11366 2 32 . ILE . 11366 2 33 . PHE . 11366 2 34 . GLY . 11366 2 35 . LYS . 11366 2 36 . TYR . 11366 2 37 . GLY . 11366 2 38 . PRO . 11366 2 39 . ILE . 11366 2 40 . ARG . 11366 2 41 . GLN . 11366 2 42 . ILE . 11366 2 43 . ARG . 11366 2 44 . VAL . 11366 2 45 . GLY . 11366 2 46 . ASN . 11366 2 47 . THR . 11366 2 48 . PRO . 11366 2 49 . GLU . 11366 2 50 . THR . 11366 2 51 . ARG . 11366 2 52 . GLY . 11366 2 53 . THR . 11366 2 54 . ALA . 11366 2 55 . TYR . 11366 2 56 . VAL . 11366 2 57 . VAL . 11366 2 58 . TYR . 11366 2 59 . GLU . 11366 2 60 . ASP . 11366 2 61 . ILE . 11366 2 62 . PHE . 11366 2 63 . ASP . 11366 2 64 . ALA . 11366 2 65 . LYS . 11366 2 66 . ASN . 11366 2 67 . ALA . 11366 2 68 . CYS . 11366 2 69 . ASP . 11366 2 70 . HIS . 11366 2 71 . LEU . 11366 2 72 . SER . 11366 2 73 . GLY . 11366 2 74 . PHE . 11366 2 75 . ASN . 11366 2 76 . VAL . 11366 2 77 . CYS . 11366 2 78 . ASN . 11366 2 79 . ARG . 11366 2 80 . TYR . 11366 2 81 . LEU . 11366 2 82 . VAL . 11366 2 83 . VAL . 11366 2 84 . LEU . 11366 2 85 . TYR . 11366 2 86 . TYR . 11366 2 87 . ASN . 11366 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 . GLY 1 1 11366 2 . ARG 2 2 11366 2 . ALA 3 3 11366 2 . ASN 4 4 11366 2 . ILE 5 5 11366 2 . ARG 6 6 11366 2 . LEU 7 7 11366 2 . PRO 8 8 11366 2 . PRO 9 9 11366 2 . GLU 10 10 11366 2 . VAL 11 11 11366 2 . ASN 12 12 11366 2 . ARG 13 13 11366 2 . ILE 14 14 11366 2 . LEU 15 15 11366 2 . TYR 16 16 11366 2 . ILE 17 17 11366 2 . ARG 18 18 11366 2 . ASN 19 19 11366 2 . LEU 20 20 11366 2 . PRO 21 21 11366 2 . TYR 22 22 11366 2 . LYS 23 23 11366 2 . ILE 24 24 11366 2 . THR 25 25 11366 2 . ALA 26 26 11366 2 . GLU 27 27 11366 2 . GLU 28 28 11366 2 . MET 29 29 11366 2 . TYR 30 30 11366 2 . ASP 31 31 11366 2 . ILE 32 32 11366 2 . PHE 33 33 11366 2 . GLY 34 34 11366 2 . LYS 35 35 11366 2 . TYR 36 36 11366 2 . GLY 37 37 11366 2 . PRO 38 38 11366 2 . ILE 39 39 11366 2 . ARG 40 40 11366 2 . GLN 41 41 11366 2 . ILE 42 42 11366 2 . ARG 43 43 11366 2 . VAL 44 44 11366 2 . GLY 45 45 11366 2 . ASN 46 46 11366 2 . THR 47 47 11366 2 . PRO 48 48 11366 2 . GLU 49 49 11366 2 . THR 50 50 11366 2 . ARG 51 51 11366 2 . GLY 52 52 11366 2 . THR 53 53 11366 2 . ALA 54 54 11366 2 . TYR 55 55 11366 2 . VAL 56 56 11366 2 . VAL 57 57 11366 2 . TYR 58 58 11366 2 . GLU 59 59 11366 2 . ASP 60 60 11366 2 . ILE 61 61 11366 2 . PHE 62 62 11366 2 . ASP 63 63 11366 2 . ALA 64 64 11366 2 . LYS 65 65 11366 2 . ASN 66 66 11366 2 . ALA 67 67 11366 2 . CYS 68 68 11366 2 . ASP 69 69 11366 2 . HIS 70 70 11366 2 . LEU 71 71 11366 2 . SER 72 72 11366 2 . GLY 73 73 11366 2 . PHE 74 74 11366 2 . ASN 75 75 11366 2 . VAL 76 76 11366 2 . CYS 77 77 11366 2 . ASN 78 78 11366 2 . ARG 79 79 11366 2 . TYR 80 80 11366 2 . LEU 81 81 11366 2 . VAL 82 82 11366 2 . VAL 83 83 11366 2 . LEU 84 84 11366 2 . TYR 85 85 11366 2 . TYR 86 86 11366 2 . ASN 87 87 11366 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 11366 _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 $entity_1 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11366 1 2 2 $entity_2 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11366 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 11366 _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 $entity_1 . 'cell free synthesis' 'Escherichia coli' 'E. coli' . . Escherichia coli . . . . . . . . . . . . . plasmid . . PGEX6P-1-SF3B155(379-424)-HIS6-P14(8-93) . . . . . . 11366 1 2 2 $entity_2 . 'cell free synthesis' 'Escherichia coli' 'E. coli' . . Escherichia coli . . . . . . . . . . . . . plasmid . . PGEX6P-1-SF3B155(379-424)-HIS6-P14(8-93) . . . . . . 11366 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11366 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 20mM Sodium Phosphate buffer (pH 6.5), 100mM NaCl, 1mM {d-DTT;} 90% H2O, 10% D2O ; _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 'spliceosomal protein SF3b155, residues in database 379-424' . . . 1 $entity_1 . protein 300 . . mM . . . . 11366 1 2 'spliceosomal protein p14, RNA recognition motif' . . . 2 $entity_2 . protein 300 . . mM . . . . 11366 1 3 'Sodium Phosphate' 'natural abundance' . . . . . buffer 20 . . mM . . . . 11366 1 4 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11366 1 5 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11366 1 6 H2O . . . . . . solvent 90 . . % . . . . 11366 1 7 D2O . . . . . . solvent 10 . . % . . . . 11366 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 11366 _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' 100 0.1 mM 11366 1 pH 6.5 0.05 pH 11366 1 pressure 1 0.001 atm 11366 1 temperature 308 0.1 K 11366 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 11366 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 11366 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11366 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11366 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20030801 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F' . . 11366 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11366 2 stop_ save_ save_NMRview _Software.Sf_category software _Software.Sf_framecode NMRview _Software.Entry_ID 11366 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, B.A' . . 11366 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11366 3 stop_ save_ save_kujira _Software.Sf_category software _Software.Sf_framecode kujira _Software.Entry_ID 11366 _Software.ID 4 _Software.Name Kujira _Software.Version 0.8995 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N' . . 11366 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11366 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11366 _Software.ID 5 _Software.Name CYANA _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P' . . 11366 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11366 5 'structure solution' 11366 5 stop_ save_ save_OPALP _Software.Sf_category software _Software.Sf_framecode OPALP _Software.Entry_ID 11366 _Software.ID 6 _Software.Name OPALP _Software.Version 1.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Koradi, R.' . . 11366 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11366 6 'structure solution' 11366 6 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 11366 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 11366 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker AVANCE . 800 . . . 11366 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 11366 _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 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11366 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11366 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 11366 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; 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 0.0 . indirect 0.251449530 . . . . . . . . . 11366 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11366 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11366 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 11366 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11366 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11366 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $XWINNMR . . 11366 1 2 $NMRPipe . . 11366 1 3 $NMRview . . 11366 1 4 $kujira . . 11366 1 5 $CYANA . . 11366 1 6 $OPALP . . 11366 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 PRO CA C 13 63.326 0.300 . 1 . . . . 3 PRO CA . 11366 1 2 . 1 1 3 3 PRO CB C 13 32.105 0.300 . 1 . . . . 3 PRO CB . 11366 1 3 . 1 1 3 3 PRO CD C 13 51.112 0.300 . 1 . . . . 3 PRO CD . 11366 1 4 . 1 1 3 3 PRO CG C 13 27.414 0.300 . 1 . . . . 3 PRO CG . 11366 1 5 . 1 1 4 4 GLU H H 1 8.491 0.030 . 1 . . . . 4 GLU H . 11366 1 6 . 1 1 4 4 GLU CA C 13 56.871 0.300 . 1 . . . . 4 GLU CA . 11366 1 7 . 1 1 4 4 GLU CB C 13 30.069 0.300 . 1 . . . . 4 GLU CB . 11366 1 8 . 1 1 4 4 GLU N N 15 121.423 0.300 . 1 . . . . 4 GLU N . 11366 1 9 . 1 1 17 17 GLU H H 1 8.492 0.030 . 1 . . . . 17 GLU H . 11366 1 10 . 1 1 17 17 GLU HA H 1 4.170 0.030 . 1 . . . . 17 GLU HA . 11366 1 11 . 1 1 17 17 GLU HB2 H 1 2.117 0.030 . 2 . . . . 17 GLU HB2 . 11366 1 12 . 1 1 17 17 GLU HB3 H 1 2.048 0.030 . 2 . . . . 17 GLU HB3 . 11366 1 13 . 1 1 17 17 GLU CA C 13 58.082 0.300 . 1 . . . . 17 GLU CA . 11366 1 14 . 1 1 17 17 GLU CB C 13 29.768 0.300 . 1 . . . . 17 GLU CB . 11366 1 15 . 1 1 17 17 GLU CG C 13 36.269 0.300 . 1 . . . . 17 GLU CG . 11366 1 16 . 1 1 17 17 GLU N N 15 122.430 0.300 . 1 . . . . 17 GLU N . 11366 1 17 . 1 1 18 18 ARG H H 1 8.321 0.030 . 1 . . . . 18 ARG H . 11366 1 18 . 1 1 18 18 ARG N N 15 118.770 0.300 . 1 . . . . 18 ARG N . 11366 1 19 . 1 1 19 19 ASN H H 1 7.958 0.030 . 1 . . . . 19 ASN H . 11366 1 20 . 1 1 19 19 ASN HA H 1 5.036 0.030 . 1 . . . . 19 ASN HA . 11366 1 21 . 1 1 19 19 ASN HB2 H 1 3.045 0.030 . 2 . . . . 19 ASN HB2 . 11366 1 22 . 1 1 19 19 ASN HB3 H 1 2.633 0.030 . 2 . . . . 19 ASN HB3 . 11366 1 23 . 1 1 19 19 ASN HD21 H 1 7.598 0.030 . 2 . . . . 19 ASN HD21 . 11366 1 24 . 1 1 19 19 ASN HD22 H 1 7.007 0.030 . 2 . . . . 19 ASN HD22 . 11366 1 25 . 1 1 19 19 ASN C C 13 175.447 0.300 . 1 . . . . 19 ASN C . 11366 1 26 . 1 1 19 19 ASN CA C 13 51.968 0.300 . 1 . . . . 19 ASN CA . 11366 1 27 . 1 1 19 19 ASN CB C 13 39.976 0.300 . 1 . . . . 19 ASN CB . 11366 1 28 . 1 1 19 19 ASN N N 15 116.892 0.300 . 1 . . . . 19 ASN N . 11366 1 29 . 1 1 19 19 ASN ND2 N 15 110.252 0.300 . 1 . . . . 19 ASN ND2 . 11366 1 30 . 1 1 20 20 ARG H H 1 7.502 0.030 . 1 . . . . 20 ARG H . 11366 1 31 . 1 1 20 20 ARG HA H 1 4.571 0.030 . 1 . . . . 20 ARG HA . 11366 1 32 . 1 1 20 20 ARG HB2 H 1 1.876 0.030 . 1 . . . . 20 ARG HB2 . 11366 1 33 . 1 1 20 20 ARG HB3 H 1 1.876 0.030 . 1 . . . . 20 ARG HB3 . 11366 1 34 . 1 1 20 20 ARG HD2 H 1 3.240 0.030 . 2 . . . . 20 ARG HD2 . 11366 1 35 . 1 1 20 20 ARG HD3 H 1 3.170 0.030 . 2 . . . . 20 ARG HD3 . 11366 1 36 . 1 1 20 20 ARG HG2 H 1 1.692 0.030 . 2 . . . . 20 ARG HG2 . 11366 1 37 . 1 1 20 20 ARG HG3 H 1 1.599 0.030 . 2 . . . . 20 ARG HG3 . 11366 1 38 . 1 1 20 20 ARG CA C 13 54.830 0.300 . 1 . . . . 20 ARG CA . 11366 1 39 . 1 1 20 20 ARG CB C 13 29.322 0.300 . 1 . . . . 20 ARG CB . 11366 1 40 . 1 1 20 20 ARG CD C 13 43.492 0.300 . 1 . . . . 20 ARG CD . 11366 1 41 . 1 1 20 20 ARG CG C 13 26.347 0.300 . 1 . . . . 20 ARG CG . 11366 1 42 . 1 1 20 20 ARG N N 15 122.021 0.300 . 1 . . . . 20 ARG N . 11366 1 43 . 1 1 21 21 PRO HA H 1 4.515 0.030 . 1 . . . . 21 PRO HA . 11366 1 44 . 1 1 21 21 PRO HB2 H 1 2.331 0.030 . 2 . . . . 21 PRO HB2 . 11366 1 45 . 1 1 21 21 PRO HB3 H 1 1.853 0.030 . 2 . . . . 21 PRO HB3 . 11366 1 46 . 1 1 21 21 PRO HD2 H 1 3.904 0.030 . 2 . . . . 21 PRO HD2 . 11366 1 47 . 1 1 21 21 PRO HD3 H 1 3.666 0.030 . 2 . . . . 21 PRO HD3 . 11366 1 48 . 1 1 21 21 PRO HG2 H 1 2.122 0.030 . 2 . . . . 21 PRO HG2 . 11366 1 49 . 1 1 21 21 PRO HG3 H 1 2.064 0.030 . 2 . . . . 21 PRO HG3 . 11366 1 50 . 1 1 21 21 PRO C C 13 176.416 0.300 . 1 . . . . 21 PRO C . 11366 1 51 . 1 1 21 21 PRO CA C 13 63.470 0.300 . 1 . . . . 21 PRO CA . 11366 1 52 . 1 1 21 21 PRO CB C 13 31.980 0.300 . 1 . . . . 21 PRO CB . 11366 1 53 . 1 1 21 21 PRO CD C 13 50.702 0.300 . 1 . . . . 21 PRO CD . 11366 1 54 . 1 1 21 21 PRO CG C 13 27.890 0.300 . 1 . . . . 21 PRO CG . 11366 1 55 . 1 1 22 22 LEU H H 1 8.837 0.030 . 1 . . . . 22 LEU H . 11366 1 56 . 1 1 22 22 LEU HA H 1 4.727 0.030 . 1 . . . . 22 LEU HA . 11366 1 57 . 1 1 22 22 LEU HB2 H 1 1.580 0.030 . 2 . . . . 22 LEU HB2 . 11366 1 58 . 1 1 22 22 LEU HB3 H 1 1.213 0.030 . 2 . . . . 22 LEU HB3 . 11366 1 59 . 1 1 22 22 LEU HD11 H 1 0.760 0.030 . 1 . . . . 22 LEU HD1 . 11366 1 60 . 1 1 22 22 LEU HD12 H 1 0.760 0.030 . 1 . . . . 22 LEU HD1 . 11366 1 61 . 1 1 22 22 LEU HD13 H 1 0.760 0.030 . 1 . . . . 22 LEU HD1 . 11366 1 62 . 1 1 22 22 LEU HD21 H 1 0.746 0.030 . 1 . . . . 22 LEU HD2 . 11366 1 63 . 1 1 22 22 LEU HD22 H 1 0.746 0.030 . 1 . . . . 22 LEU HD2 . 11366 1 64 . 1 1 22 22 LEU HD23 H 1 0.746 0.030 . 1 . . . . 22 LEU HD2 . 11366 1 65 . 1 1 22 22 LEU HG H 1 1.664 0.030 . 1 . . . . 22 LEU HG . 11366 1 66 . 1 1 22 22 LEU C C 13 177.393 0.300 . 1 . . . . 22 LEU C . 11366 1 67 . 1 1 22 22 LEU CA C 13 53.425 0.300 . 1 . . . . 22 LEU CA . 11366 1 68 . 1 1 22 22 LEU CB C 13 44.568 0.300 . 1 . . . . 22 LEU CB . 11366 1 69 . 1 1 22 22 LEU CD1 C 13 25.806 0.300 . 2 . . . . 22 LEU CD1 . 11366 1 70 . 1 1 22 22 LEU CD2 C 13 23.392 0.300 . 2 . . . . 22 LEU CD2 . 11366 1 71 . 1 1 22 22 LEU CG C 13 26.730 0.300 . 1 . . . . 22 LEU CG . 11366 1 72 . 1 1 22 22 LEU N N 15 123.902 0.300 . 1 . . . . 22 LEU N . 11366 1 73 . 1 1 23 23 SER H H 1 9.533 0.030 . 1 . . . . 23 SER H . 11366 1 74 . 1 1 23 23 SER HA H 1 4.574 0.030 . 1 . . . . 23 SER HA . 11366 1 75 . 1 1 23 23 SER HB2 H 1 4.410 0.030 . 2 . . . . 23 SER HB2 . 11366 1 76 . 1 1 23 23 SER HB3 H 1 4.052 0.030 . 2 . . . . 23 SER HB3 . 11366 1 77 . 1 1 23 23 SER C C 13 174.649 0.300 . 1 . . . . 23 SER C . 11366 1 78 . 1 1 23 23 SER CA C 13 56.980 0.300 . 1 . . . . 23 SER CA . 11366 1 79 . 1 1 23 23 SER CB C 13 65.636 0.300 . 1 . . . . 23 SER CB . 11366 1 80 . 1 1 23 23 SER N N 15 121.987 0.300 . 1 . . . . 23 SER N . 11366 1 81 . 1 1 24 24 ASP H H 1 9.106 0.030 . 1 . . . . 24 ASP H . 11366 1 82 . 1 1 24 24 ASP HA H 1 4.287 0.030 . 1 . . . . 24 ASP HA . 11366 1 83 . 1 1 24 24 ASP HB2 H 1 2.759 0.030 . 2 . . . . 24 ASP HB2 . 11366 1 84 . 1 1 24 24 ASP HB3 H 1 2.599 0.030 . 2 . . . . 24 ASP HB3 . 11366 1 85 . 1 1 24 24 ASP C C 13 178.850 0.300 . 1 . . . . 24 ASP C . 11366 1 86 . 1 1 24 24 ASP CA C 13 57.817 0.300 . 1 . . . . 24 ASP CA . 11366 1 87 . 1 1 24 24 ASP CB C 13 39.644 0.300 . 1 . . . . 24 ASP CB . 11366 1 88 . 1 1 24 24 ASP N N 15 121.910 0.300 . 1 . . . . 24 ASP N . 11366 1 89 . 1 1 25 25 GLU H H 1 8.809 0.030 . 1 . . . . 25 GLU H . 11366 1 90 . 1 1 25 25 GLU HA H 1 4.076 0.030 . 1 . . . . 25 GLU HA . 11366 1 91 . 1 1 25 25 GLU HB2 H 1 2.040 0.030 . 2 . . . . 25 GLU HB2 . 11366 1 92 . 1 1 25 25 GLU HB3 H 1 1.929 0.030 . 2 . . . . 25 GLU HB3 . 11366 1 93 . 1 1 25 25 GLU HG2 H 1 2.380 0.030 . 2 . . . . 25 GLU HG2 . 11366 1 94 . 1 1 25 25 GLU HG3 H 1 2.307 0.030 . 2 . . . . 25 GLU HG3 . 11366 1 95 . 1 1 25 25 GLU C C 13 179.481 0.300 . 1 . . . . 25 GLU C . 11366 1 96 . 1 1 25 25 GLU CA C 13 60.122 0.300 . 1 . . . . 25 GLU CA . 11366 1 97 . 1 1 25 25 GLU CB C 13 29.067 0.300 . 1 . . . . 25 GLU CB . 11366 1 98 . 1 1 25 25 GLU CG C 13 36.860 0.300 . 1 . . . . 25 GLU CG . 11366 1 99 . 1 1 25 25 GLU N N 15 119.218 0.300 . 1 . . . . 25 GLU N . 11366 1 100 . 1 1 26 26 GLU H H 1 7.848 0.030 . 1 . . . . 26 GLU H . 11366 1 101 . 1 1 26 26 GLU HA H 1 3.943 0.030 . 1 . . . . 26 GLU HA . 11366 1 102 . 1 1 26 26 GLU HB2 H 1 2.256 0.030 . 2 . . . . 26 GLU HB2 . 11366 1 103 . 1 1 26 26 GLU HB3 H 1 1.845 0.030 . 2 . . . . 26 GLU HB3 . 11366 1 104 . 1 1 26 26 GLU HG2 H 1 2.246 0.030 . 1 . . . . 26 GLU HG2 . 11366 1 105 . 1 1 26 26 GLU HG3 H 1 2.246 0.030 . 1 . . . . 26 GLU HG3 . 11366 1 106 . 1 1 26 26 GLU C C 13 179.582 0.300 . 1 . . . . 26 GLU C . 11366 1 107 . 1 1 26 26 GLU CA C 13 59.136 0.300 . 1 . . . . 26 GLU CA . 11366 1 108 . 1 1 26 26 GLU CB C 13 29.986 0.300 . 1 . . . . 26 GLU CB . 11366 1 109 . 1 1 26 26 GLU CG C 13 37.524 0.300 . 1 . . . . 26 GLU CG . 11366 1 110 . 1 1 26 26 GLU N N 15 121.061 0.300 . 1 . . . . 26 GLU N . 11366 1 111 . 1 1 27 27 LEU H H 1 7.868 0.030 . 1 . . . . 27 LEU H . 11366 1 112 . 1 1 27 27 LEU HA H 1 3.906 0.030 . 1 . . . . 27 LEU HA . 11366 1 113 . 1 1 27 27 LEU HB2 H 1 1.893 0.030 . 2 . . . . 27 LEU HB2 . 11366 1 114 . 1 1 27 27 LEU HB3 H 1 1.530 0.030 . 2 . . . . 27 LEU HB3 . 11366 1 115 . 1 1 27 27 LEU HD11 H 1 0.860 0.030 . 1 . . . . 27 LEU HD1 . 11366 1 116 . 1 1 27 27 LEU HD12 H 1 0.860 0.030 . 1 . . . . 27 LEU HD1 . 11366 1 117 . 1 1 27 27 LEU HD13 H 1 0.860 0.030 . 1 . . . . 27 LEU HD1 . 11366 1 118 . 1 1 27 27 LEU HD21 H 1 0.726 0.030 . 1 . . . . 27 LEU HD2 . 11366 1 119 . 1 1 27 27 LEU HD22 H 1 0.726 0.030 . 1 . . . . 27 LEU HD2 . 11366 1 120 . 1 1 27 27 LEU HD23 H 1 0.726 0.030 . 1 . . . . 27 LEU HD2 . 11366 1 121 . 1 1 27 27 LEU HG H 1 1.626 0.030 . 1 . . . . 27 LEU HG . 11366 1 122 . 1 1 27 27 LEU C C 13 178.286 0.300 . 1 . . . . 27 LEU C . 11366 1 123 . 1 1 27 27 LEU CA C 13 58.014 0.300 . 1 . . . . 27 LEU CA . 11366 1 124 . 1 1 27 27 LEU CB C 13 41.431 0.300 . 1 . . . . 27 LEU CB . 11366 1 125 . 1 1 27 27 LEU CD1 C 13 24.623 0.300 . 2 . . . . 27 LEU CD1 . 11366 1 126 . 1 1 27 27 LEU CD2 C 13 25.159 0.300 . 2 . . . . 27 LEU CD2 . 11366 1 127 . 1 1 27 27 LEU CG C 13 27.480 0.300 . 1 . . . . 27 LEU CG . 11366 1 128 . 1 1 27 27 LEU N N 15 120.072 0.300 . 1 . . . . 27 LEU N . 11366 1 129 . 1 1 28 28 ASP H H 1 7.970 0.030 . 1 . . . . 28 ASP H . 11366 1 130 . 1 1 28 28 ASP HA H 1 4.427 0.030 . 1 . . . . 28 ASP HA . 11366 1 131 . 1 1 28 28 ASP HB2 H 1 2.759 0.030 . 2 . . . . 28 ASP HB2 . 11366 1 132 . 1 1 28 28 ASP HB3 H 1 2.680 0.030 . 2 . . . . 28 ASP HB3 . 11366 1 133 . 1 1 28 28 ASP C C 13 177.983 0.300 . 1 . . . . 28 ASP C . 11366 1 134 . 1 1 28 28 ASP CA C 13 57.203 0.300 . 1 . . . . 28 ASP CA . 11366 1 135 . 1 1 28 28 ASP CB C 13 40.594 0.300 . 1 . . . . 28 ASP CB . 11366 1 136 . 1 1 28 28 ASP N N 15 116.684 0.300 . 1 . . . . 28 ASP N . 11366 1 137 . 1 1 29 29 ALA H H 1 7.135 0.030 . 1 . . . . 29 ALA H . 11366 1 138 . 1 1 29 29 ALA HA H 1 4.329 0.030 . 1 . . . . 29 ALA HA . 11366 1 139 . 1 1 29 29 ALA HB1 H 1 1.403 0.030 . 1 . . . . 29 ALA HB . 11366 1 140 . 1 1 29 29 ALA HB2 H 1 1.403 0.030 . 1 . . . . 29 ALA HB . 11366 1 141 . 1 1 29 29 ALA HB3 H 1 1.403 0.030 . 1 . . . . 29 ALA HB . 11366 1 142 . 1 1 29 29 ALA C C 13 178.500 0.300 . 1 . . . . 29 ALA C . 11366 1 143 . 1 1 29 29 ALA CA C 13 52.782 0.300 . 1 . . . . 29 ALA CA . 11366 1 144 . 1 1 29 29 ALA CB C 13 18.960 0.300 . 1 . . . . 29 ALA CB . 11366 1 145 . 1 1 29 29 ALA N N 15 118.034 0.300 . 1 . . . . 29 ALA N . 11366 1 146 . 1 1 30 30 MET H H 1 7.383 0.030 . 1 . . . . 30 MET H . 11366 1 147 . 1 1 30 30 MET HA H 1 3.994 0.030 . 1 . . . . 30 MET HA . 11366 1 148 . 1 1 30 30 MET HB2 H 1 1.360 0.030 . 2 . . . . 30 MET HB2 . 11366 1 149 . 1 1 30 30 MET HB3 H 1 1.226 0.030 . 2 . . . . 30 MET HB3 . 11366 1 150 . 1 1 30 30 MET HE1 H 1 1.664 0.030 . 1 . . . . 30 MET HE . 11366 1 151 . 1 1 30 30 MET HE2 H 1 1.664 0.030 . 1 . . . . 30 MET HE . 11366 1 152 . 1 1 30 30 MET HE3 H 1 1.664 0.030 . 1 . . . . 30 MET HE . 11366 1 153 . 1 1 30 30 MET HG2 H 1 2.129 0.030 . 1 . . . . 30 MET HG2 . 11366 1 154 . 1 1 30 30 MET HG3 H 1 2.129 0.030 . 1 . . . . 30 MET HG3 . 11366 1 155 . 1 1 30 30 MET C C 13 175.879 0.300 . 1 . . . . 30 MET C . 11366 1 156 . 1 1 30 30 MET CA C 13 57.031 0.300 . 1 . . . . 30 MET CA . 11366 1 157 . 1 1 30 30 MET CB C 13 33.575 0.300 . 1 . . . . 30 MET CB . 11366 1 158 . 1 1 30 30 MET CE C 13 16.703 0.300 . 1 . . . . 30 MET CE . 11366 1 159 . 1 1 30 30 MET CG C 13 31.556 0.300 . 1 . . . . 30 MET CG . 11366 1 160 . 1 1 30 30 MET N N 15 115.526 0.300 . 1 . . . . 30 MET N . 11366 1 161 . 1 1 31 31 PHE H H 1 6.954 0.030 . 1 . . . . 31 PHE H . 11366 1 162 . 1 1 31 31 PHE HA H 1 4.720 0.030 . 1 . . . . 31 PHE HA . 11366 1 163 . 1 1 31 31 PHE HB2 H 1 2.570 0.030 . 2 . . . . 31 PHE HB2 . 11366 1 164 . 1 1 31 31 PHE HB3 H 1 2.472 0.030 . 2 . . . . 31 PHE HB3 . 11366 1 165 . 1 1 31 31 PHE HD1 H 1 6.190 0.030 . 1 . . . . 31 PHE HD1 . 11366 1 166 . 1 1 31 31 PHE HD2 H 1 6.190 0.030 . 1 . . . . 31 PHE HD2 . 11366 1 167 . 1 1 31 31 PHE HE1 H 1 6.524 0.030 . 1 . . . . 31 PHE HE1 . 11366 1 168 . 1 1 31 31 PHE HE2 H 1 6.524 0.030 . 1 . . . . 31 PHE HE2 . 11366 1 169 . 1 1 31 31 PHE HZ H 1 6.566 0.030 . 1 . . . . 31 PHE HZ . 11366 1 170 . 1 1 31 31 PHE C C 13 172.964 0.300 . 1 . . . . 31 PHE C . 11366 1 171 . 1 1 31 31 PHE CA C 13 55.693 0.300 . 1 . . . . 31 PHE CA . 11366 1 172 . 1 1 31 31 PHE CB C 13 39.313 0.300 . 1 . . . . 31 PHE CB . 11366 1 173 . 1 1 31 31 PHE CD1 C 13 131.450 0.300 . 1 . . . . 31 PHE CD1 . 11366 1 174 . 1 1 31 31 PHE CD2 C 13 131.450 0.300 . 1 . . . . 31 PHE CD2 . 11366 1 175 . 1 1 31 31 PHE CE1 C 13 130.466 0.300 . 1 . . . . 31 PHE CE1 . 11366 1 176 . 1 1 31 31 PHE CE2 C 13 130.466 0.300 . 1 . . . . 31 PHE CE2 . 11366 1 177 . 1 1 31 31 PHE CZ C 13 127.486 0.300 . 1 . . . . 31 PHE CZ . 11366 1 178 . 1 1 31 31 PHE N N 15 116.963 0.300 . 1 . . . . 31 PHE N . 11366 1 179 . 1 1 32 32 PRO HA H 1 4.653 0.030 . 1 . . . . 32 PRO HA . 11366 1 180 . 1 1 32 32 PRO HB2 H 1 2.479 0.030 . 2 . . . . 32 PRO HB2 . 11366 1 181 . 1 1 32 32 PRO HB3 H 1 2.241 0.030 . 2 . . . . 32 PRO HB3 . 11366 1 182 . 1 1 32 32 PRO HD2 H 1 3.757 0.030 . 2 . . . . 32 PRO HD2 . 11366 1 183 . 1 1 32 32 PRO HD3 H 1 3.296 0.030 . 2 . . . . 32 PRO HD3 . 11366 1 184 . 1 1 32 32 PRO HG2 H 1 2.202 0.030 . 2 . . . . 32 PRO HG2 . 11366 1 185 . 1 1 32 32 PRO HG3 H 1 2.139 0.030 . 2 . . . . 32 PRO HG3 . 11366 1 186 . 1 1 32 32 PRO C C 13 175.711 0.300 . 1 . . . . 32 PRO C . 11366 1 187 . 1 1 32 32 PRO CA C 13 62.287 0.300 . 1 . . . . 32 PRO CA . 11366 1 188 . 1 1 32 32 PRO CB C 13 32.784 0.300 . 1 . . . . 32 PRO CB . 11366 1 189 . 1 1 32 32 PRO CD C 13 50.724 0.300 . 1 . . . . 32 PRO CD . 11366 1 190 . 1 1 32 32 PRO CG C 13 27.499 0.300 . 1 . . . . 32 PRO CG . 11366 1 191 . 1 1 33 33 GLU H H 1 8.318 0.030 . 1 . . . . 33 GLU H . 11366 1 192 . 1 1 33 33 GLU HA H 1 4.326 0.030 . 1 . . . . 33 GLU HA . 11366 1 193 . 1 1 33 33 GLU HB2 H 1 2.094 0.030 . 2 . . . . 33 GLU HB2 . 11366 1 194 . 1 1 33 33 GLU HB3 H 1 2.029 0.030 . 2 . . . . 33 GLU HB3 . 11366 1 195 . 1 1 33 33 GLU HG2 H 1 2.359 0.030 . 1 . . . . 33 GLU HG2 . 11366 1 196 . 1 1 33 33 GLU HG3 H 1 2.359 0.030 . 1 . . . . 33 GLU HG3 . 11366 1 197 . 1 1 33 33 GLU C C 13 176.678 0.300 . 1 . . . . 33 GLU C . 11366 1 198 . 1 1 33 33 GLU CA C 13 57.285 0.300 . 1 . . . . 33 GLU CA . 11366 1 199 . 1 1 33 33 GLU CB C 13 30.416 0.300 . 1 . . . . 33 GLU CB . 11366 1 200 . 1 1 33 33 GLU CG C 13 36.486 0.300 . 1 . . . . 33 GLU CG . 11366 1 201 . 1 1 33 33 GLU N N 15 117.674 0.300 . 1 . . . . 33 GLU N . 11366 1 202 . 1 1 34 34 GLY H H 1 8.572 0.030 . 1 . . . . 34 GLY H . 11366 1 203 . 1 1 34 34 GLY HA2 H 1 4.105 0.030 . 2 . . . . 34 GLY HA2 . 11366 1 204 . 1 1 34 34 GLY HA3 H 1 3.685 0.030 . 2 . . . . 34 GLY HA3 . 11366 1 205 . 1 1 34 34 GLY C C 13 173.709 0.300 . 1 . . . . 34 GLY C . 11366 1 206 . 1 1 34 34 GLY CA C 13 45.959 0.300 . 1 . . . . 34 GLY CA . 11366 1 207 . 1 1 34 34 GLY N N 15 106.778 0.300 . 1 . . . . 34 GLY N . 11366 1 208 . 1 1 35 35 TYR H H 1 7.711 0.030 . 1 . . . . 35 TYR H . 11366 1 209 . 1 1 35 35 TYR HA H 1 4.767 0.030 . 1 . . . . 35 TYR HA . 11366 1 210 . 1 1 35 35 TYR HB2 H 1 2.936 0.030 . 2 . . . . 35 TYR HB2 . 11366 1 211 . 1 1 35 35 TYR HB3 H 1 2.369 0.030 . 2 . . . . 35 TYR HB3 . 11366 1 212 . 1 1 35 35 TYR HD1 H 1 6.813 0.030 . 1 . . . . 35 TYR HD1 . 11366 1 213 . 1 1 35 35 TYR HD2 H 1 6.813 0.030 . 1 . . . . 35 TYR HD2 . 11366 1 214 . 1 1 35 35 TYR HE1 H 1 6.740 0.030 . 1 . . . . 35 TYR HE1 . 11366 1 215 . 1 1 35 35 TYR HE2 H 1 6.740 0.030 . 1 . . . . 35 TYR HE2 . 11366 1 216 . 1 1 35 35 TYR C C 13 174.520 0.300 . 1 . . . . 35 TYR C . 11366 1 217 . 1 1 35 35 TYR CA C 13 57.976 0.300 . 1 . . . . 35 TYR CA . 11366 1 218 . 1 1 35 35 TYR CB C 13 41.990 0.300 . 1 . . . . 35 TYR CB . 11366 1 219 . 1 1 35 35 TYR CD1 C 13 132.719 0.300 . 1 . . . . 35 TYR CD1 . 11366 1 220 . 1 1 35 35 TYR CD2 C 13 132.719 0.300 . 1 . . . . 35 TYR CD2 . 11366 1 221 . 1 1 35 35 TYR CE1 C 13 118.748 0.300 . 1 . . . . 35 TYR CE1 . 11366 1 222 . 1 1 35 35 TYR CE2 C 13 118.748 0.300 . 1 . . . . 35 TYR CE2 . 11366 1 223 . 1 1 35 35 TYR N N 15 118.211 0.300 . 1 . . . . 35 TYR N . 11366 1 224 . 1 1 36 36 LYS H H 1 8.947 0.030 . 1 . . . . 36 LYS H . 11366 1 225 . 1 1 36 36 LYS HA H 1 4.760 0.030 . 1 . . . . 36 LYS HA . 11366 1 226 . 1 1 36 36 LYS HB2 H 1 1.718 0.030 . 1 . . . . 36 LYS HB2 . 11366 1 227 . 1 1 36 36 LYS HB3 H 1 1.718 0.030 . 1 . . . . 36 LYS HB3 . 11366 1 228 . 1 1 36 36 LYS HD2 H 1 1.624 0.030 . 1 . . . . 36 LYS HD2 . 11366 1 229 . 1 1 36 36 LYS HD3 H 1 1.624 0.030 . 1 . . . . 36 LYS HD3 . 11366 1 230 . 1 1 36 36 LYS HE2 H 1 2.949 0.030 . 1 . . . . 36 LYS HE2 . 11366 1 231 . 1 1 36 36 LYS HE3 H 1 2.949 0.030 . 1 . . . . 36 LYS HE3 . 11366 1 232 . 1 1 36 36 LYS HG2 H 1 1.358 0.030 . 1 . . . . 36 LYS HG2 . 11366 1 233 . 1 1 36 36 LYS HG3 H 1 1.358 0.030 . 1 . . . . 36 LYS HG3 . 11366 1 234 . 1 1 36 36 LYS C C 13 175.569 0.300 . 1 . . . . 36 LYS C . 11366 1 235 . 1 1 36 36 LYS CA C 13 53.989 0.300 . 1 . . . . 36 LYS CA . 11366 1 236 . 1 1 36 36 LYS CB C 13 35.975 0.300 . 1 . . . . 36 LYS CB . 11366 1 237 . 1 1 36 36 LYS CD C 13 29.458 0.300 . 1 . . . . 36 LYS CD . 11366 1 238 . 1 1 36 36 LYS CE C 13 42.317 0.300 . 1 . . . . 36 LYS CE . 11366 1 239 . 1 1 36 36 LYS CG C 13 24.428 0.300 . 1 . . . . 36 LYS CG . 11366 1 240 . 1 1 36 36 LYS N N 15 122.467 0.300 . 1 . . . . 36 LYS N . 11366 1 241 . 1 1 37 37 VAL H H 1 8.835 0.030 . 1 . . . . 37 VAL H . 11366 1 242 . 1 1 37 37 VAL HA H 1 4.039 0.030 . 1 . . . . 37 VAL HA . 11366 1 243 . 1 1 37 37 VAL HB H 1 1.942 0.030 . 1 . . . . 37 VAL HB . 11366 1 244 . 1 1 37 37 VAL HG11 H 1 0.872 0.030 . 1 . . . . 37 VAL HG1 . 11366 1 245 . 1 1 37 37 VAL HG12 H 1 0.872 0.030 . 1 . . . . 37 VAL HG1 . 11366 1 246 . 1 1 37 37 VAL HG13 H 1 0.872 0.030 . 1 . . . . 37 VAL HG1 . 11366 1 247 . 1 1 37 37 VAL HG21 H 1 0.893 0.030 . 1 . . . . 37 VAL HG2 . 11366 1 248 . 1 1 37 37 VAL HG22 H 1 0.893 0.030 . 1 . . . . 37 VAL HG2 . 11366 1 249 . 1 1 37 37 VAL HG23 H 1 0.893 0.030 . 1 . . . . 37 VAL HG2 . 11366 1 250 . 1 1 37 37 VAL C C 13 175.696 0.300 . 1 . . . . 37 VAL C . 11366 1 251 . 1 1 37 37 VAL CA C 13 63.970 0.300 . 1 . . . . 37 VAL CA . 11366 1 252 . 1 1 37 37 VAL CB C 13 32.051 0.300 . 1 . . . . 37 VAL CB . 11366 1 253 . 1 1 37 37 VAL CG1 C 13 21.281 0.300 . 2 . . . . 37 VAL CG1 . 11366 1 254 . 1 1 37 37 VAL CG2 C 13 22.165 0.300 . 2 . . . . 37 VAL CG2 . 11366 1 255 . 1 1 37 37 VAL N N 15 125.886 0.300 . 1 . . . . 37 VAL N . 11366 1 256 . 1 1 38 38 LEU H H 1 8.684 0.030 . 1 . . . . 38 LEU H . 11366 1 257 . 1 1 38 38 LEU HA H 1 4.913 0.030 . 1 . . . . 38 LEU HA . 11366 1 258 . 1 1 38 38 LEU HB2 H 1 1.723 0.030 . 2 . . . . 38 LEU HB2 . 11366 1 259 . 1 1 38 38 LEU HB3 H 1 1.462 0.030 . 2 . . . . 38 LEU HB3 . 11366 1 260 . 1 1 38 38 LEU HD11 H 1 0.936 0.030 . 1 . . . . 38 LEU HD1 . 11366 1 261 . 1 1 38 38 LEU HD12 H 1 0.936 0.030 . 1 . . . . 38 LEU HD1 . 11366 1 262 . 1 1 38 38 LEU HD13 H 1 0.936 0.030 . 1 . . . . 38 LEU HD1 . 11366 1 263 . 1 1 38 38 LEU HD21 H 1 0.891 0.030 . 1 . . . . 38 LEU HD2 . 11366 1 264 . 1 1 38 38 LEU HD22 H 1 0.891 0.030 . 1 . . . . 38 LEU HD2 . 11366 1 265 . 1 1 38 38 LEU HD23 H 1 0.891 0.030 . 1 . . . . 38 LEU HD2 . 11366 1 266 . 1 1 38 38 LEU HG H 1 1.648 0.030 . 1 . . . . 38 LEU HG . 11366 1 267 . 1 1 38 38 LEU CA C 13 51.125 0.300 . 1 . . . . 38 LEU CA . 11366 1 268 . 1 1 38 38 LEU CB C 13 43.305 0.300 . 1 . . . . 38 LEU CB . 11366 1 269 . 1 1 38 38 LEU CD1 C 13 25.001 0.300 . 2 . . . . 38 LEU CD1 . 11366 1 270 . 1 1 38 38 LEU CD2 C 13 25.140 0.300 . 2 . . . . 38 LEU CD2 . 11366 1 271 . 1 1 38 38 LEU CG C 13 26.556 0.300 . 1 . . . . 38 LEU CG . 11366 1 272 . 1 1 38 38 LEU N N 15 130.894 0.300 . 1 . . . . 38 LEU N . 11366 1 273 . 1 1 39 39 PRO HA H 1 4.707 0.030 . 1 . . . . 39 PRO HA . 11366 1 274 . 1 1 39 39 PRO HB2 H 1 2.359 0.030 . 2 . . . . 39 PRO HB2 . 11366 1 275 . 1 1 39 39 PRO HB3 H 1 1.839 0.030 . 2 . . . . 39 PRO HB3 . 11366 1 276 . 1 1 39 39 PRO HD2 H 1 4.135 0.030 . 2 . . . . 39 PRO HD2 . 11366 1 277 . 1 1 39 39 PRO HD3 H 1 3.702 0.030 . 2 . . . . 39 PRO HD3 . 11366 1 278 . 1 1 39 39 PRO HG2 H 1 2.111 0.030 . 2 . . . . 39 PRO HG2 . 11366 1 279 . 1 1 39 39 PRO HG3 H 1 1.984 0.030 . 2 . . . . 39 PRO HG3 . 11366 1 280 . 1 1 39 39 PRO CA C 13 61.188 0.300 . 1 . . . . 39 PRO CA . 11366 1 281 . 1 1 39 39 PRO CB C 13 32.020 0.300 . 1 . . . . 39 PRO CB . 11366 1 282 . 1 1 39 39 PRO CD C 13 51.032 0.300 . 1 . . . . 39 PRO CD . 11366 1 283 . 1 1 39 39 PRO CG C 13 27.414 0.300 . 1 . . . . 39 PRO CG . 11366 1 284 . 1 1 40 40 PRO HA H 1 3.786 0.030 . 1 . . . . 40 PRO HA . 11366 1 285 . 1 1 40 40 PRO HB2 H 1 1.637 0.030 . 1 . . . . 40 PRO HB2 . 11366 1 286 . 1 1 40 40 PRO HB3 H 1 1.637 0.030 . 1 . . . . 40 PRO HB3 . 11366 1 287 . 1 1 40 40 PRO HD2 H 1 3.822 0.030 . 2 . . . . 40 PRO HD2 . 11366 1 288 . 1 1 40 40 PRO HD3 H 1 3.601 0.030 . 2 . . . . 40 PRO HD3 . 11366 1 289 . 1 1 40 40 PRO HG2 H 1 2.020 0.030 . 1 . . . . 40 PRO HG2 . 11366 1 290 . 1 1 40 40 PRO HG3 H 1 2.020 0.030 . 1 . . . . 40 PRO HG3 . 11366 1 291 . 1 1 40 40 PRO CA C 13 60.566 0.300 . 1 . . . . 40 PRO CA . 11366 1 292 . 1 1 40 40 PRO CB C 13 30.201 0.300 . 1 . . . . 40 PRO CB . 11366 1 293 . 1 1 40 40 PRO CD C 13 50.161 0.300 . 1 . . . . 40 PRO CD . 11366 1 294 . 1 1 40 40 PRO CG C 13 27.475 0.300 . 1 . . . . 40 PRO CG . 11366 1 295 . 1 1 41 41 PRO HA H 1 4.296 0.030 . 1 . . . . 41 PRO HA . 11366 1 296 . 1 1 41 41 PRO HB2 H 1 2.111 0.030 . 2 . . . . 41 PRO HB2 . 11366 1 297 . 1 1 41 41 PRO HB3 H 1 1.878 0.030 . 2 . . . . 41 PRO HB3 . 11366 1 298 . 1 1 41 41 PRO HD2 H 1 2.766 0.030 . 2 . . . . 41 PRO HD2 . 11366 1 299 . 1 1 41 41 PRO HD3 H 1 2.368 0.030 . 2 . . . . 41 PRO HD3 . 11366 1 300 . 1 1 41 41 PRO HG2 H 1 1.756 0.030 . 2 . . . . 41 PRO HG2 . 11366 1 301 . 1 1 41 41 PRO HG3 H 1 1.530 0.030 . 2 . . . . 41 PRO HG3 . 11366 1 302 . 1 1 41 41 PRO C C 13 176.561 0.300 . 1 . . . . 41 PRO C . 11366 1 303 . 1 1 41 41 PRO CA C 13 62.049 0.300 . 1 . . . . 41 PRO CA . 11366 1 304 . 1 1 41 41 PRO CB C 13 32.060 0.300 . 1 . . . . 41 PRO CB . 11366 1 305 . 1 1 41 41 PRO CD C 13 49.629 0.300 . 1 . . . . 41 PRO CD . 11366 1 306 . 1 1 41 41 PRO CG C 13 27.151 0.300 . 1 . . . . 41 PRO CG . 11366 1 307 . 1 1 42 42 ALA H H 1 8.530 0.030 . 1 . . . . 42 ALA H . 11366 1 308 . 1 1 42 42 ALA HA H 1 4.115 0.030 . 1 . . . . 42 ALA HA . 11366 1 309 . 1 1 42 42 ALA HB1 H 1 1.371 0.030 . 1 . . . . 42 ALA HB . 11366 1 310 . 1 1 42 42 ALA HB2 H 1 1.371 0.030 . 1 . . . . 42 ALA HB . 11366 1 311 . 1 1 42 42 ALA HB3 H 1 1.371 0.030 . 1 . . . . 42 ALA HB . 11366 1 312 . 1 1 42 42 ALA C C 13 179.041 0.300 . 1 . . . . 42 ALA C . 11366 1 313 . 1 1 42 42 ALA CA C 13 53.858 0.300 . 1 . . . . 42 ALA CA . 11366 1 314 . 1 1 42 42 ALA CB C 13 18.347 0.300 . 1 . . . . 42 ALA CB . 11366 1 315 . 1 1 42 42 ALA N N 15 124.748 0.300 . 1 . . . . 42 ALA N . 11366 1 316 . 1 1 43 43 GLY H H 1 8.578 0.030 . 1 . . . . 43 GLY H . 11366 1 317 . 1 1 43 43 GLY HA2 H 1 3.945 0.030 . 2 . . . . 43 GLY HA2 . 11366 1 318 . 1 1 43 43 GLY HA3 H 1 3.825 0.030 . 2 . . . . 43 GLY HA3 . 11366 1 319 . 1 1 43 43 GLY C C 13 174.051 0.300 . 1 . . . . 43 GLY C . 11366 1 320 . 1 1 43 43 GLY CA C 13 45.174 0.300 . 1 . . . . 43 GLY CA . 11366 1 321 . 1 1 43 43 GLY N N 15 108.158 0.300 . 1 . . . . 43 GLY N . 11366 1 322 . 1 1 44 44 TYR H H 1 7.690 0.030 . 1 . . . . 44 TYR H . 11366 1 323 . 1 1 44 44 TYR HA H 1 4.384 0.030 . 1 . . . . 44 TYR HA . 11366 1 324 . 1 1 44 44 TYR HB2 H 1 2.802 0.030 . 1 . . . . 44 TYR HB2 . 11366 1 325 . 1 1 44 44 TYR HB3 H 1 2.802 0.030 . 1 . . . . 44 TYR HB3 . 11366 1 326 . 1 1 44 44 TYR HD1 H 1 7.046 0.030 . 1 . . . . 44 TYR HD1 . 11366 1 327 . 1 1 44 44 TYR HD2 H 1 7.046 0.030 . 1 . . . . 44 TYR HD2 . 11366 1 328 . 1 1 44 44 TYR HE1 H 1 6.953 0.030 . 1 . . . . 44 TYR HE1 . 11366 1 329 . 1 1 44 44 TYR HE2 H 1 6.953 0.030 . 1 . . . . 44 TYR HE2 . 11366 1 330 . 1 1 44 44 TYR C C 13 174.877 0.300 . 1 . . . . 44 TYR C . 11366 1 331 . 1 1 44 44 TYR CA C 13 59.151 0.300 . 1 . . . . 44 TYR CA . 11366 1 332 . 1 1 44 44 TYR CB C 13 38.919 0.300 . 1 . . . . 44 TYR CB . 11366 1 333 . 1 1 44 44 TYR CD1 C 13 133.093 0.300 . 1 . . . . 44 TYR CD1 . 11366 1 334 . 1 1 44 44 TYR CD2 C 13 133.093 0.300 . 1 . . . . 44 TYR CD2 . 11366 1 335 . 1 1 44 44 TYR CE1 C 13 118.319 0.300 . 1 . . . . 44 TYR CE1 . 11366 1 336 . 1 1 44 44 TYR CE2 C 13 118.319 0.300 . 1 . . . . 44 TYR CE2 . 11366 1 337 . 1 1 44 44 TYR N N 15 120.736 0.300 . 1 . . . . 44 TYR N . 11366 1 338 . 1 1 45 45 VAL H H 1 7.762 0.030 . 1 . . . . 45 VAL H . 11366 1 339 . 1 1 45 45 VAL HA H 1 4.263 0.030 . 1 . . . . 45 VAL HA . 11366 1 340 . 1 1 45 45 VAL HB H 1 1.950 0.030 . 1 . . . . 45 VAL HB . 11366 1 341 . 1 1 45 45 VAL HG11 H 1 0.915 0.030 . 1 . . . . 45 VAL HG1 . 11366 1 342 . 1 1 45 45 VAL HG12 H 1 0.915 0.030 . 1 . . . . 45 VAL HG1 . 11366 1 343 . 1 1 45 45 VAL HG13 H 1 0.915 0.030 . 1 . . . . 45 VAL HG1 . 11366 1 344 . 1 1 45 45 VAL HG21 H 1 0.861 0.030 . 1 . . . . 45 VAL HG2 . 11366 1 345 . 1 1 45 45 VAL HG22 H 1 0.861 0.030 . 1 . . . . 45 VAL HG2 . 11366 1 346 . 1 1 45 45 VAL HG23 H 1 0.861 0.030 . 1 . . . . 45 VAL HG2 . 11366 1 347 . 1 1 45 45 VAL C C 13 172.623 0.300 . 1 . . . . 45 VAL C . 11366 1 348 . 1 1 45 45 VAL CA C 13 59.131 0.300 . 1 . . . . 45 VAL CA . 11366 1 349 . 1 1 45 45 VAL CB C 13 33.589 0.300 . 1 . . . . 45 VAL CB . 11366 1 350 . 1 1 45 45 VAL CG1 C 13 21.137 0.300 . 2 . . . . 45 VAL CG1 . 11366 1 351 . 1 1 45 45 VAL CG2 C 13 20.345 0.300 . 2 . . . . 45 VAL CG2 . 11366 1 352 . 1 1 45 45 VAL N N 15 127.376 0.300 . 1 . . . . 45 VAL N . 11366 1 353 . 1 1 46 46 PRO HA H 1 4.085 0.030 . 1 . . . . 46 PRO HA . 11366 1 354 . 1 1 46 46 PRO HB2 H 1 2.269 0.030 . 2 . . . . 46 PRO HB2 . 11366 1 355 . 1 1 46 46 PRO HB3 H 1 1.918 0.030 . 2 . . . . 46 PRO HB3 . 11366 1 356 . 1 1 46 46 PRO HD2 H 1 3.627 0.030 . 2 . . . . 46 PRO HD2 . 11366 1 357 . 1 1 46 46 PRO HD3 H 1 3.440 0.030 . 2 . . . . 46 PRO HD3 . 11366 1 358 . 1 1 46 46 PRO HG2 H 1 2.005 0.030 . 1 . . . . 46 PRO HG2 . 11366 1 359 . 1 1 46 46 PRO HG3 H 1 2.005 0.030 . 1 . . . . 46 PRO HG3 . 11366 1 360 . 1 1 46 46 PRO CA C 13 64.578 0.300 . 1 . . . . 46 PRO CA . 11366 1 361 . 1 1 46 46 PRO CB C 13 32.020 0.300 . 1 . . . . 46 PRO CB . 11366 1 362 . 1 1 46 46 PRO CD C 13 50.603 0.300 . 1 . . . . 46 PRO CD . 11366 1 363 . 1 1 46 46 PRO CG C 13 27.041 0.300 . 1 . . . . 46 PRO CG . 11366 1 364 . 2 2 5 5 ILE HA H 1 4.217 0.030 . 1 . . . . 52 ILE HA . 11366 1 365 . 2 2 5 5 ILE HB H 1 1.881 0.030 . 1 . . . . 52 ILE HB . 11366 1 366 . 2 2 5 5 ILE HD11 H 1 0.918 0.030 . 1 . . . . 52 ILE HD1 . 11366 1 367 . 2 2 5 5 ILE HD12 H 1 0.918 0.030 . 1 . . . . 52 ILE HD1 . 11366 1 368 . 2 2 5 5 ILE HD13 H 1 0.918 0.030 . 1 . . . . 52 ILE HD1 . 11366 1 369 . 2 2 5 5 ILE HG21 H 1 0.921 0.030 . 1 . . . . 52 ILE HG2 . 11366 1 370 . 2 2 5 5 ILE HG22 H 1 0.921 0.030 . 1 . . . . 52 ILE HG2 . 11366 1 371 . 2 2 5 5 ILE HG23 H 1 0.921 0.030 . 1 . . . . 52 ILE HG2 . 11366 1 372 . 2 2 5 5 ILE CA C 13 61.288 0.300 . 1 . . . . 52 ILE CA . 11366 1 373 . 2 2 5 5 ILE CB C 13 38.842 0.300 . 1 . . . . 52 ILE CB . 11366 1 374 . 2 2 5 5 ILE CD1 C 13 13.257 0.300 . 1 . . . . 52 ILE CD1 . 11366 1 375 . 2 2 5 5 ILE CG1 C 13 27.202 0.300 . 1 . . . . 52 ILE CG1 . 11366 1 376 . 2 2 5 5 ILE CG2 C 13 17.585 0.300 . 1 . . . . 52 ILE CG2 . 11366 1 377 . 2 2 7 7 LEU HA H 1 4.172 0.030 . 1 . . . . 54 LEU HA . 11366 1 378 . 2 2 8 8 PRO HA H 1 4.736 0.030 . 1 . . . . 55 PRO HA . 11366 1 379 . 2 2 8 8 PRO HB2 H 1 2.544 0.030 . 2 . . . . 55 PRO HB2 . 11366 1 380 . 2 2 8 8 PRO HB3 H 1 1.986 0.030 . 2 . . . . 55 PRO HB3 . 11366 1 381 . 2 2 8 8 PRO HD2 H 1 3.890 0.030 . 2 . . . . 55 PRO HD2 . 11366 1 382 . 2 2 8 8 PRO HD3 H 1 3.375 0.030 . 2 . . . . 55 PRO HD3 . 11366 1 383 . 2 2 8 8 PRO HG2 H 1 2.074 0.030 . 1 . . . . 55 PRO HG2 . 11366 1 384 . 2 2 8 8 PRO HG3 H 1 2.074 0.030 . 1 . . . . 55 PRO HG3 . 11366 1 385 . 2 2 8 8 PRO CA C 13 62.142 0.300 . 1 . . . . 55 PRO CA . 11366 1 386 . 2 2 8 8 PRO CB C 13 31.189 0.300 . 1 . . . . 55 PRO CB . 11366 1 387 . 2 2 8 8 PRO CD C 13 50.708 0.300 . 1 . . . . 55 PRO CD . 11366 1 388 . 2 2 8 8 PRO CG C 13 27.890 0.300 . 1 . . . . 55 PRO CG . 11366 1 389 . 2 2 9 9 PRO HA H 1 4.233 0.030 . 1 . . . . 56 PRO HA . 11366 1 390 . 2 2 9 9 PRO HB2 H 1 2.331 0.030 . 2 . . . . 56 PRO HB2 . 11366 1 391 . 2 2 9 9 PRO HB3 H 1 1.956 0.030 . 2 . . . . 56 PRO HB3 . 11366 1 392 . 2 2 9 9 PRO HD2 H 1 3.797 0.030 . 1 . . . . 56 PRO HD2 . 11366 1 393 . 2 2 9 9 PRO HD3 H 1 3.797 0.030 . 1 . . . . 56 PRO HD3 . 11366 1 394 . 2 2 9 9 PRO HG2 H 1 2.082 0.030 . 1 . . . . 56 PRO HG2 . 11366 1 395 . 2 2 9 9 PRO HG3 H 1 2.082 0.030 . 1 . . . . 56 PRO HG3 . 11366 1 396 . 2 2 9 9 PRO C C 13 176.723 0.300 . 1 . . . . 56 PRO C . 11366 1 397 . 2 2 9 9 PRO CA C 13 64.659 0.300 . 1 . . . . 56 PRO CA . 11366 1 398 . 2 2 9 9 PRO CB C 13 32.097 0.300 . 1 . . . . 56 PRO CB . 11366 1 399 . 2 2 9 9 PRO CD C 13 50.713 0.300 . 1 . . . . 56 PRO CD . 11366 1 400 . 2 2 9 9 PRO CG C 13 27.140 0.300 . 1 . . . . 56 PRO CG . 11366 1 401 . 2 2 10 10 GLU H H 1 9.155 0.030 . 1 . . . . 57 GLU H . 11366 1 402 . 2 2 10 10 GLU HA H 1 4.052 0.030 . 1 . . . . 57 GLU HA . 11366 1 403 . 2 2 10 10 GLU HB2 H 1 2.005 0.030 . 1 . . . . 57 GLU HB2 . 11366 1 404 . 2 2 10 10 GLU HB3 H 1 2.005 0.030 . 1 . . . . 57 GLU HB3 . 11366 1 405 . 2 2 10 10 GLU HG2 H 1 2.346 0.030 . 2 . . . . 57 GLU HG2 . 11366 1 406 . 2 2 10 10 GLU HG3 H 1 2.192 0.030 . 2 . . . . 57 GLU HG3 . 11366 1 407 . 2 2 10 10 GLU C C 13 175.895 0.300 . 1 . . . . 57 GLU C . 11366 1 408 . 2 2 10 10 GLU CA C 13 57.498 0.300 . 1 . . . . 57 GLU CA . 11366 1 409 . 2 2 10 10 GLU CB C 13 28.890 0.300 . 1 . . . . 57 GLU CB . 11366 1 410 . 2 2 10 10 GLU CG C 13 35.807 0.300 . 1 . . . . 57 GLU CG . 11366 1 411 . 2 2 10 10 GLU N N 15 117.196 0.300 . 1 . . . . 57 GLU N . 11366 1 412 . 2 2 11 11 VAL H H 1 6.908 0.030 . 1 . . . . 58 VAL H . 11366 1 413 . 2 2 11 11 VAL HA H 1 4.829 0.030 . 1 . . . . 58 VAL HA . 11366 1 414 . 2 2 11 11 VAL HB H 1 1.534 0.030 . 1 . . . . 58 VAL HB . 11366 1 415 . 2 2 11 11 VAL HG11 H 1 0.603 0.030 . 1 . . . . 58 VAL HG1 . 11366 1 416 . 2 2 11 11 VAL HG12 H 1 0.603 0.030 . 1 . . . . 58 VAL HG1 . 11366 1 417 . 2 2 11 11 VAL HG13 H 1 0.603 0.030 . 1 . . . . 58 VAL HG1 . 11366 1 418 . 2 2 11 11 VAL HG21 H 1 0.757 0.030 . 1 . . . . 58 VAL HG2 . 11366 1 419 . 2 2 11 11 VAL HG22 H 1 0.757 0.030 . 1 . . . . 58 VAL HG2 . 11366 1 420 . 2 2 11 11 VAL HG23 H 1 0.757 0.030 . 1 . . . . 58 VAL HG2 . 11366 1 421 . 2 2 11 11 VAL C C 13 174.410 0.300 . 1 . . . . 58 VAL C . 11366 1 422 . 2 2 11 11 VAL CA C 13 63.136 0.300 . 1 . . . . 58 VAL CA . 11366 1 423 . 2 2 11 11 VAL CB C 13 30.948 0.300 . 1 . . . . 58 VAL CB . 11366 1 424 . 2 2 11 11 VAL CG1 C 13 21.487 0.300 . 2 . . . . 58 VAL CG1 . 11366 1 425 . 2 2 11 11 VAL CG2 C 13 22.051 0.300 . 2 . . . . 58 VAL CG2 . 11366 1 426 . 2 2 11 11 VAL N N 15 117.807 0.300 . 1 . . . . 58 VAL N . 11366 1 427 . 2 2 12 12 ASN H H 1 6.739 0.030 . 1 . . . . 59 ASN H . 11366 1 428 . 2 2 12 12 ASN HA H 1 4.682 0.030 . 1 . . . . 59 ASN HA . 11366 1 429 . 2 2 12 12 ASN HB2 H 1 3.053 0.030 . 2 . . . . 59 ASN HB2 . 11366 1 430 . 2 2 12 12 ASN HB3 H 1 2.874 0.030 . 2 . . . . 59 ASN HB3 . 11366 1 431 . 2 2 12 12 ASN HD21 H 1 7.092 0.030 . 2 . . . . 59 ASN HD21 . 11366 1 432 . 2 2 12 12 ASN HD22 H 1 7.867 0.030 . 2 . . . . 59 ASN HD22 . 11366 1 433 . 2 2 12 12 ASN C C 13 172.381 0.300 . 1 . . . . 59 ASN C . 11366 1 434 . 2 2 12 12 ASN CA C 13 51.845 0.300 . 1 . . . . 59 ASN CA . 11366 1 435 . 2 2 12 12 ASN CB C 13 42.581 0.300 . 1 . . . . 59 ASN CB . 11366 1 436 . 2 2 12 12 ASN N N 15 124.416 0.300 . 1 . . . . 59 ASN N . 11366 1 437 . 2 2 12 12 ASN ND2 N 15 113.241 0.300 . 1 . . . . 59 ASN ND2 . 11366 1 438 . 2 2 13 13 ARG H H 1 8.025 0.030 . 1 . . . . 60 ARG H . 11366 1 439 . 2 2 13 13 ARG HA H 1 4.211 0.030 . 1 . . . . 60 ARG HA . 11366 1 440 . 2 2 13 13 ARG HB2 H 1 1.952 0.030 . 2 . . . . 60 ARG HB2 . 11366 1 441 . 2 2 13 13 ARG HB3 H 1 1.749 0.030 . 2 . . . . 60 ARG HB3 . 11366 1 442 . 2 2 13 13 ARG HD2 H 1 3.354 0.030 . 2 . . . . 60 ARG HD2 . 11366 1 443 . 2 2 13 13 ARG HD3 H 1 3.265 0.030 . 2 . . . . 60 ARG HD3 . 11366 1 444 . 2 2 13 13 ARG HE H 1 7.169 0.030 . 1 . . . . 60 ARG HE . 11366 1 445 . 2 2 13 13 ARG HG2 H 1 1.651 0.030 . 2 . . . . 60 ARG HG2 . 11366 1 446 . 2 2 13 13 ARG HG3 H 1 1.477 0.030 . 2 . . . . 60 ARG HG3 . 11366 1 447 . 2 2 13 13 ARG C C 13 173.641 0.300 . 1 . . . . 60 ARG C . 11366 1 448 . 2 2 13 13 ARG CA C 13 57.740 0.300 . 1 . . . . 60 ARG CA . 11366 1 449 . 2 2 13 13 ARG CB C 13 30.865 0.300 . 1 . . . . 60 ARG CB . 11366 1 450 . 2 2 13 13 ARG CD C 13 44.236 0.300 . 1 . . . . 60 ARG CD . 11366 1 451 . 2 2 13 13 ARG CG C 13 27.890 0.300 . 1 . . . . 60 ARG CG . 11366 1 452 . 2 2 13 13 ARG N N 15 116.207 0.300 . 1 . . . . 60 ARG N . 11366 1 453 . 2 2 13 13 ARG NE N 15 84.077 0.300 . 1 . . . . 60 ARG NE . 11366 1 454 . 2 2 14 14 ILE H H 1 8.199 0.030 . 1 . . . . 61 ILE H . 11366 1 455 . 2 2 14 14 ILE HA H 1 5.031 0.030 . 1 . . . . 61 ILE HA . 11366 1 456 . 2 2 14 14 ILE HB H 1 2.111 0.030 . 1 . . . . 61 ILE HB . 11366 1 457 . 2 2 14 14 ILE HD11 H 1 0.725 0.030 . 1 . . . . 61 ILE HD1 . 11366 1 458 . 2 2 14 14 ILE HD12 H 1 0.725 0.030 . 1 . . . . 61 ILE HD1 . 11366 1 459 . 2 2 14 14 ILE HD13 H 1 0.725 0.030 . 1 . . . . 61 ILE HD1 . 11366 1 460 . 2 2 14 14 ILE HG12 H 1 1.736 0.030 . 2 . . . . 61 ILE HG12 . 11366 1 461 . 2 2 14 14 ILE HG13 H 1 1.051 0.030 . 2 . . . . 61 ILE HG13 . 11366 1 462 . 2 2 14 14 ILE HG21 H 1 1.055 0.030 . 1 . . . . 61 ILE HG2 . 11366 1 463 . 2 2 14 14 ILE HG22 H 1 1.055 0.030 . 1 . . . . 61 ILE HG2 . 11366 1 464 . 2 2 14 14 ILE HG23 H 1 1.055 0.030 . 1 . . . . 61 ILE HG2 . 11366 1 465 . 2 2 14 14 ILE C C 13 174.248 0.300 . 1 . . . . 61 ILE C . 11366 1 466 . 2 2 14 14 ILE CA C 13 60.873 0.300 . 1 . . . . 61 ILE CA . 11366 1 467 . 2 2 14 14 ILE CB C 13 38.600 0.300 . 1 . . . . 61 ILE CB . 11366 1 468 . 2 2 14 14 ILE CD1 C 13 14.287 0.300 . 1 . . . . 61 ILE CD1 . 11366 1 469 . 2 2 14 14 ILE CG1 C 13 28.448 0.300 . 1 . . . . 61 ILE CG1 . 11366 1 470 . 2 2 14 14 ILE CG2 C 13 19.069 0.300 . 1 . . . . 61 ILE CG2 . 11366 1 471 . 2 2 14 14 ILE N N 15 117.906 0.300 . 1 . . . . 61 ILE N . 11366 1 472 . 2 2 15 15 LEU H H 1 9.440 0.030 . 1 . . . . 62 LEU H . 11366 1 473 . 2 2 15 15 LEU HA H 1 5.298 0.030 . 1 . . . . 62 LEU HA . 11366 1 474 . 2 2 15 15 LEU HB2 H 1 1.767 0.030 . 2 . . . . 62 LEU HB2 . 11366 1 475 . 2 2 15 15 LEU HB3 H 1 1.331 0.030 . 2 . . . . 62 LEU HB3 . 11366 1 476 . 2 2 15 15 LEU HD11 H 1 1.038 0.030 . 1 . . . . 62 LEU HD1 . 11366 1 477 . 2 2 15 15 LEU HD12 H 1 1.038 0.030 . 1 . . . . 62 LEU HD1 . 11366 1 478 . 2 2 15 15 LEU HD13 H 1 1.038 0.030 . 1 . . . . 62 LEU HD1 . 11366 1 479 . 2 2 15 15 LEU HD21 H 1 0.879 0.030 . 1 . . . . 62 LEU HD2 . 11366 1 480 . 2 2 15 15 LEU HD22 H 1 0.879 0.030 . 1 . . . . 62 LEU HD2 . 11366 1 481 . 2 2 15 15 LEU HD23 H 1 0.879 0.030 . 1 . . . . 62 LEU HD2 . 11366 1 482 . 2 2 15 15 LEU HG H 1 1.948 0.030 . 1 . . . . 62 LEU HG . 11366 1 483 . 2 2 15 15 LEU C C 13 175.634 0.300 . 1 . . . . 62 LEU C . 11366 1 484 . 2 2 15 15 LEU CA C 13 52.883 0.300 . 1 . . . . 62 LEU CA . 11366 1 485 . 2 2 15 15 LEU CB C 13 44.291 0.300 . 1 . . . . 62 LEU CB . 11366 1 486 . 2 2 15 15 LEU CD1 C 13 26.426 0.300 . 2 . . . . 62 LEU CD1 . 11366 1 487 . 2 2 15 15 LEU CD2 C 13 23.784 0.300 . 2 . . . . 62 LEU CD2 . 11366 1 488 . 2 2 15 15 LEU CG C 13 27.640 0.300 . 1 . . . . 62 LEU CG . 11366 1 489 . 2 2 15 15 LEU N N 15 125.492 0.300 . 1 . . . . 62 LEU N . 11366 1 490 . 2 2 16 16 TYR H H 1 9.580 0.030 . 1 . . . . 63 TYR H . 11366 1 491 . 2 2 16 16 TYR HA H 1 5.103 0.030 . 1 . . . . 63 TYR HA . 11366 1 492 . 2 2 16 16 TYR HB2 H 1 2.790 0.030 . 1 . . . . 63 TYR HB2 . 11366 1 493 . 2 2 16 16 TYR HB3 H 1 2.790 0.030 . 1 . . . . 63 TYR HB3 . 11366 1 494 . 2 2 16 16 TYR HD1 H 1 6.418 0.030 . 1 . . . . 63 TYR HD1 . 11366 1 495 . 2 2 16 16 TYR HD2 H 1 6.418 0.030 . 1 . . . . 63 TYR HD2 . 11366 1 496 . 2 2 16 16 TYR HE1 H 1 6.489 0.030 . 1 . . . . 63 TYR HE1 . 11366 1 497 . 2 2 16 16 TYR HE2 H 1 6.489 0.030 . 1 . . . . 63 TYR HE2 . 11366 1 498 . 2 2 16 16 TYR C C 13 173.143 0.300 . 1 . . . . 63 TYR C . 11366 1 499 . 2 2 16 16 TYR CA C 13 55.082 0.300 . 1 . . . . 63 TYR CA . 11366 1 500 . 2 2 16 16 TYR CB C 13 40.839 0.300 . 1 . . . . 63 TYR CB . 11366 1 501 . 2 2 16 16 TYR CD1 C 13 133.130 0.300 . 1 . . . . 63 TYR CD1 . 11366 1 502 . 2 2 16 16 TYR CD2 C 13 133.130 0.300 . 1 . . . . 63 TYR CD2 . 11366 1 503 . 2 2 16 16 TYR CE1 C 13 117.331 0.300 . 1 . . . . 63 TYR CE1 . 11366 1 504 . 2 2 16 16 TYR CE2 C 13 117.331 0.300 . 1 . . . . 63 TYR CE2 . 11366 1 505 . 2 2 16 16 TYR N N 15 124.047 0.300 . 1 . . . . 63 TYR N . 11366 1 506 . 2 2 17 17 ILE H H 1 8.723 0.030 . 1 . . . . 64 ILE H . 11366 1 507 . 2 2 17 17 ILE HA H 1 4.990 0.030 . 1 . . . . 64 ILE HA . 11366 1 508 . 2 2 17 17 ILE HB H 1 1.589 0.030 . 1 . . . . 64 ILE HB . 11366 1 509 . 2 2 17 17 ILE HD11 H 1 0.626 0.030 . 1 . . . . 64 ILE HD1 . 11366 1 510 . 2 2 17 17 ILE HD12 H 1 0.626 0.030 . 1 . . . . 64 ILE HD1 . 11366 1 511 . 2 2 17 17 ILE HD13 H 1 0.626 0.030 . 1 . . . . 64 ILE HD1 . 11366 1 512 . 2 2 17 17 ILE HG12 H 1 1.316 0.030 . 2 . . . . 64 ILE HG12 . 11366 1 513 . 2 2 17 17 ILE HG13 H 1 1.062 0.030 . 2 . . . . 64 ILE HG13 . 11366 1 514 . 2 2 17 17 ILE HG21 H 1 1.004 0.030 . 1 . . . . 64 ILE HG2 . 11366 1 515 . 2 2 17 17 ILE HG22 H 1 1.004 0.030 . 1 . . . . 64 ILE HG2 . 11366 1 516 . 2 2 17 17 ILE HG23 H 1 1.004 0.030 . 1 . . . . 64 ILE HG2 . 11366 1 517 . 2 2 17 17 ILE C C 13 174.887 0.300 . 1 . . . . 64 ILE C . 11366 1 518 . 2 2 17 17 ILE CA C 13 57.974 0.300 . 1 . . . . 64 ILE CA . 11366 1 519 . 2 2 17 17 ILE CB C 13 40.051 0.300 . 1 . . . . 64 ILE CB . 11366 1 520 . 2 2 17 17 ILE CD1 C 13 14.977 0.300 . 1 . . . . 64 ILE CD1 . 11366 1 521 . 2 2 17 17 ILE CG1 C 13 28.576 0.300 . 1 . . . . 64 ILE CG1 . 11366 1 522 . 2 2 17 17 ILE CG2 C 13 20.555 0.300 . 1 . . . . 64 ILE CG2 . 11366 1 523 . 2 2 17 17 ILE N N 15 127.382 0.300 . 1 . . . . 64 ILE N . 11366 1 524 . 2 2 18 18 ARG H H 1 8.712 0.030 . 1 . . . . 65 ARG H . 11366 1 525 . 2 2 18 18 ARG HA H 1 4.787 0.030 . 1 . . . . 65 ARG HA . 11366 1 526 . 2 2 18 18 ARG HB2 H 1 1.861 0.030 . 2 . . . . 65 ARG HB2 . 11366 1 527 . 2 2 18 18 ARG HB3 H 1 1.435 0.030 . 2 . . . . 65 ARG HB3 . 11366 1 528 . 2 2 18 18 ARG HD2 H 1 3.292 0.030 . 2 . . . . 65 ARG HD2 . 11366 1 529 . 2 2 18 18 ARG HD3 H 1 3.101 0.030 . 2 . . . . 65 ARG HD3 . 11366 1 530 . 2 2 18 18 ARG HG2 H 1 1.351 0.030 . 2 . . . . 65 ARG HG2 . 11366 1 531 . 2 2 18 18 ARG HG3 H 1 1.111 0.030 . 2 . . . . 65 ARG HG3 . 11366 1 532 . 2 2 18 18 ARG C C 13 174.933 0.300 . 1 . . . . 65 ARG C . 11366 1 533 . 2 2 18 18 ARG CA C 13 54.155 0.300 . 1 . . . . 65 ARG CA . 11366 1 534 . 2 2 18 18 ARG CB C 13 34.189 0.300 . 1 . . . . 65 ARG CB . 11366 1 535 . 2 2 18 18 ARG CD C 13 43.810 0.300 . 1 . . . . 65 ARG CD . 11366 1 536 . 2 2 18 18 ARG CG C 13 27.165 0.300 . 1 . . . . 65 ARG CG . 11366 1 537 . 2 2 18 18 ARG N N 15 120.261 0.300 . 1 . . . . 65 ARG N . 11366 1 538 . 2 2 19 19 ASN H H 1 8.213 0.030 . 1 . . . . 66 ASN H . 11366 1 539 . 2 2 19 19 ASN HA H 1 4.430 0.030 . 1 . . . . 66 ASN HA . 11366 1 540 . 2 2 19 19 ASN HB2 H 1 3.285 0.030 . 2 . . . . 66 ASN HB2 . 11366 1 541 . 2 2 19 19 ASN HB3 H 1 3.117 0.030 . 2 . . . . 66 ASN HB3 . 11366 1 542 . 2 2 19 19 ASN HD21 H 1 7.772 0.030 . 2 . . . . 66 ASN HD21 . 11366 1 543 . 2 2 19 19 ASN HD22 H 1 6.979 0.030 . 2 . . . . 66 ASN HD22 . 11366 1 544 . 2 2 19 19 ASN C C 13 174.824 0.300 . 1 . . . . 66 ASN C . 11366 1 545 . 2 2 19 19 ASN CA C 13 54.095 0.300 . 1 . . . . 66 ASN CA . 11366 1 546 . 2 2 19 19 ASN CB C 13 37.022 0.300 . 1 . . . . 66 ASN CB . 11366 1 547 . 2 2 19 19 ASN N N 15 114.130 0.300 . 1 . . . . 66 ASN N . 11366 1 548 . 2 2 19 19 ASN ND2 N 15 111.352 0.300 . 1 . . . . 66 ASN ND2 . 11366 1 549 . 2 2 20 20 LEU H H 1 8.196 0.030 . 1 . . . . 67 LEU H . 11366 1 550 . 2 2 20 20 LEU HA H 1 4.161 0.030 . 1 . . . . 67 LEU HA . 11366 1 551 . 2 2 20 20 LEU HB2 H 1 1.257 0.030 . 1 . . . . 67 LEU HB2 . 11366 1 552 . 2 2 20 20 LEU HB3 H 1 1.257 0.030 . 1 . . . . 67 LEU HB3 . 11366 1 553 . 2 2 20 20 LEU HD11 H 1 0.665 0.030 . 1 . . . . 67 LEU HD1 . 11366 1 554 . 2 2 20 20 LEU HD12 H 1 0.665 0.030 . 1 . . . . 67 LEU HD1 . 11366 1 555 . 2 2 20 20 LEU HD13 H 1 0.665 0.030 . 1 . . . . 67 LEU HD1 . 11366 1 556 . 2 2 20 20 LEU HD21 H 1 0.926 0.030 . 1 . . . . 67 LEU HD2 . 11366 1 557 . 2 2 20 20 LEU HD22 H 1 0.926 0.030 . 1 . . . . 67 LEU HD2 . 11366 1 558 . 2 2 20 20 LEU HD23 H 1 0.926 0.030 . 1 . . . . 67 LEU HD2 . 11366 1 559 . 2 2 20 20 LEU HG H 1 1.464 0.030 . 1 . . . . 67 LEU HG . 11366 1 560 . 2 2 20 20 LEU CA C 13 53.608 0.300 . 1 . . . . 67 LEU CA . 11366 1 561 . 2 2 20 20 LEU CB C 13 41.727 0.300 . 1 . . . . 67 LEU CB . 11366 1 562 . 2 2 20 20 LEU CD1 C 13 26.993 0.300 . 2 . . . . 67 LEU CD1 . 11366 1 563 . 2 2 20 20 LEU CD2 C 13 24.405 0.300 . 2 . . . . 67 LEU CD2 . 11366 1 564 . 2 2 20 20 LEU CG C 13 27.027 0.300 . 1 . . . . 67 LEU CG . 11366 1 565 . 2 2 20 20 LEU N N 15 116.840 0.300 . 1 . . . . 67 LEU N . 11366 1 566 . 2 2 21 21 PRO HA H 1 4.279 0.030 . 1 . . . . 68 PRO HA . 11366 1 567 . 2 2 21 21 PRO HB2 H 1 2.353 0.030 . 2 . . . . 68 PRO HB2 . 11366 1 568 . 2 2 21 21 PRO HB3 H 1 1.816 0.030 . 2 . . . . 68 PRO HB3 . 11366 1 569 . 2 2 21 21 PRO HD2 H 1 3.698 0.030 . 2 . . . . 68 PRO HD2 . 11366 1 570 . 2 2 21 21 PRO HD3 H 1 3.328 0.030 . 2 . . . . 68 PRO HD3 . 11366 1 571 . 2 2 21 21 PRO HG2 H 1 2.073 0.030 . 2 . . . . 68 PRO HG2 . 11366 1 572 . 2 2 21 21 PRO HG3 H 1 1.923 0.030 . 2 . . . . 68 PRO HG3 . 11366 1 573 . 2 2 21 21 PRO C C 13 177.205 0.300 . 1 . . . . 68 PRO C . 11366 1 574 . 2 2 21 21 PRO CA C 13 62.408 0.300 . 1 . . . . 68 PRO CA . 11366 1 575 . 2 2 21 21 PRO CB C 13 31.890 0.300 . 1 . . . . 68 PRO CB . 11366 1 576 . 2 2 21 21 PRO CD C 13 49.961 0.300 . 1 . . . . 68 PRO CD . 11366 1 577 . 2 2 21 21 PRO CG C 13 28.157 0.300 . 1 . . . . 68 PRO CG . 11366 1 578 . 2 2 22 22 TYR H H 1 8.262 0.030 . 1 . . . . 69 TYR H . 11366 1 579 . 2 2 22 22 TYR HA H 1 4.328 0.030 . 1 . . . . 69 TYR HA . 11366 1 580 . 2 2 22 22 TYR HB2 H 1 3.108 0.030 . 2 . . . . 69 TYR HB2 . 11366 1 581 . 2 2 22 22 TYR HB3 H 1 3.039 0.030 . 2 . . . . 69 TYR HB3 . 11366 1 582 . 2 2 22 22 TYR HD1 H 1 7.056 0.030 . 1 . . . . 69 TYR HD1 . 11366 1 583 . 2 2 22 22 TYR HD2 H 1 7.056 0.030 . 1 . . . . 69 TYR HD2 . 11366 1 584 . 2 2 22 22 TYR HE1 H 1 6.836 0.030 . 1 . . . . 69 TYR HE1 . 11366 1 585 . 2 2 22 22 TYR HE2 H 1 6.836 0.030 . 1 . . . . 69 TYR HE2 . 11366 1 586 . 2 2 22 22 TYR C C 13 177.492 0.300 . 1 . . . . 69 TYR C . 11366 1 587 . 2 2 22 22 TYR CA C 13 58.537 0.300 . 1 . . . . 69 TYR CA . 11366 1 588 . 2 2 22 22 TYR CB C 13 37.254 0.300 . 1 . . . . 69 TYR CB . 11366 1 589 . 2 2 22 22 TYR CD1 C 13 131.907 0.300 . 1 . . . . 69 TYR CD1 . 11366 1 590 . 2 2 22 22 TYR CD2 C 13 131.907 0.300 . 1 . . . . 69 TYR CD2 . 11366 1 591 . 2 2 22 22 TYR CE1 C 13 118.496 0.300 . 1 . . . . 69 TYR CE1 . 11366 1 592 . 2 2 22 22 TYR CE2 C 13 118.496 0.300 . 1 . . . . 69 TYR CE2 . 11366 1 593 . 2 2 22 22 TYR N N 15 121.605 0.300 . 1 . . . . 69 TYR N . 11366 1 594 . 2 2 23 23 LYS H H 1 8.073 0.030 . 1 . . . . 70 LYS H . 11366 1 595 . 2 2 23 23 LYS HA H 1 4.489 0.030 . 1 . . . . 70 LYS HA . 11366 1 596 . 2 2 23 23 LYS HB2 H 1 1.923 0.030 . 2 . . . . 70 LYS HB2 . 11366 1 597 . 2 2 23 23 LYS HB3 H 1 1.674 0.030 . 2 . . . . 70 LYS HB3 . 11366 1 598 . 2 2 23 23 LYS HD2 H 1 1.668 0.030 . 1 . . . . 70 LYS HD2 . 11366 1 599 . 2 2 23 23 LYS HD3 H 1 1.668 0.030 . 1 . . . . 70 LYS HD3 . 11366 1 600 . 2 2 23 23 LYS HE2 H 1 2.981 0.030 . 1 . . . . 70 LYS HE2 . 11366 1 601 . 2 2 23 23 LYS HE3 H 1 2.981 0.030 . 1 . . . . 70 LYS HE3 . 11366 1 602 . 2 2 23 23 LYS HG2 H 1 1.309 0.030 . 1 . . . . 70 LYS HG2 . 11366 1 603 . 2 2 23 23 LYS HG3 H 1 1.309 0.030 . 1 . . . . 70 LYS HG3 . 11366 1 604 . 2 2 23 23 LYS C C 13 175.440 0.300 . 1 . . . . 70 LYS C . 11366 1 605 . 2 2 23 23 LYS CA C 13 55.195 0.300 . 1 . . . . 70 LYS CA . 11366 1 606 . 2 2 23 23 LYS CB C 13 31.900 0.300 . 1 . . . . 70 LYS CB . 11366 1 607 . 2 2 23 23 LYS CD C 13 29.159 0.300 . 1 . . . . 70 LYS CD . 11366 1 608 . 2 2 23 23 LYS CE C 13 42.071 0.300 . 1 . . . . 70 LYS CE . 11366 1 609 . 2 2 23 23 LYS CG C 13 24.776 0.300 . 1 . . . . 70 LYS CG . 11366 1 610 . 2 2 23 23 LYS N N 15 116.988 0.300 . 1 . . . . 70 LYS N . 11366 1 611 . 2 2 24 24 ILE H H 1 7.354 0.030 . 1 . . . . 71 ILE H . 11366 1 612 . 2 2 24 24 ILE HA H 1 4.383 0.030 . 1 . . . . 71 ILE HA . 11366 1 613 . 2 2 24 24 ILE HB H 1 1.741 0.030 . 1 . . . . 71 ILE HB . 11366 1 614 . 2 2 24 24 ILE HD11 H 1 0.860 0.030 . 1 . . . . 71 ILE HD1 . 11366 1 615 . 2 2 24 24 ILE HD12 H 1 0.860 0.030 . 1 . . . . 71 ILE HD1 . 11366 1 616 . 2 2 24 24 ILE HD13 H 1 0.860 0.030 . 1 . . . . 71 ILE HD1 . 11366 1 617 . 2 2 24 24 ILE HG12 H 1 1.778 0.030 . 2 . . . . 71 ILE HG12 . 11366 1 618 . 2 2 24 24 ILE HG13 H 1 1.428 0.030 . 2 . . . . 71 ILE HG13 . 11366 1 619 . 2 2 24 24 ILE HG21 H 1 0.899 0.030 . 1 . . . . 71 ILE HG2 . 11366 1 620 . 2 2 24 24 ILE HG22 H 1 0.899 0.030 . 1 . . . . 71 ILE HG2 . 11366 1 621 . 2 2 24 24 ILE HG23 H 1 0.899 0.030 . 1 . . . . 71 ILE HG2 . 11366 1 622 . 2 2 24 24 ILE C C 13 174.017 0.300 . 1 . . . . 71 ILE C . 11366 1 623 . 2 2 24 24 ILE CA C 13 61.340 0.300 . 1 . . . . 71 ILE CA . 11366 1 624 . 2 2 24 24 ILE CB C 13 40.053 0.300 . 1 . . . . 71 ILE CB . 11366 1 625 . 2 2 24 24 ILE CD1 C 13 14.425 0.300 . 1 . . . . 71 ILE CD1 . 11366 1 626 . 2 2 24 24 ILE CG1 C 13 29.818 0.300 . 1 . . . . 71 ILE CG1 . 11366 1 627 . 2 2 24 24 ILE CG2 C 13 16.216 0.300 . 1 . . . . 71 ILE CG2 . 11366 1 628 . 2 2 24 24 ILE N N 15 122.244 0.300 . 1 . . . . 71 ILE N . 11366 1 629 . 2 2 25 25 THR H H 1 8.253 0.030 . 1 . . . . 72 THR H . 11366 1 630 . 2 2 25 25 THR HA H 1 4.621 0.030 . 1 . . . . 72 THR HA . 11366 1 631 . 2 2 25 25 THR HB H 1 4.816 0.030 . 1 . . . . 72 THR HB . 11366 1 632 . 2 2 25 25 THR HG21 H 1 1.389 0.030 . 1 . . . . 72 THR HG2 . 11366 1 633 . 2 2 25 25 THR HG22 H 1 1.389 0.030 . 1 . . . . 72 THR HG2 . 11366 1 634 . 2 2 25 25 THR HG23 H 1 1.389 0.030 . 1 . . . . 72 THR HG2 . 11366 1 635 . 2 2 25 25 THR C C 13 175.809 0.300 . 1 . . . . 72 THR C . 11366 1 636 . 2 2 25 25 THR CA C 13 60.780 0.300 . 1 . . . . 72 THR CA . 11366 1 637 . 2 2 25 25 THR CB C 13 72.638 0.300 . 1 . . . . 72 THR CB . 11366 1 638 . 2 2 25 25 THR CG2 C 13 21.975 0.300 . 1 . . . . 72 THR CG2 . 11366 1 639 . 2 2 25 25 THR N N 15 116.968 0.300 . 1 . . . . 72 THR N . 11366 1 640 . 2 2 26 26 ALA H H 1 9.176 0.030 . 1 . . . . 73 ALA H . 11366 1 641 . 2 2 26 26 ALA HA H 1 4.040 0.030 . 1 . . . . 73 ALA HA . 11366 1 642 . 2 2 26 26 ALA HB1 H 1 1.514 0.030 . 1 . . . . 73 ALA HB . 11366 1 643 . 2 2 26 26 ALA HB2 H 1 1.514 0.030 . 1 . . . . 73 ALA HB . 11366 1 644 . 2 2 26 26 ALA HB3 H 1 1.514 0.030 . 1 . . . . 73 ALA HB . 11366 1 645 . 2 2 26 26 ALA C C 13 179.404 0.300 . 1 . . . . 73 ALA C . 11366 1 646 . 2 2 26 26 ALA CA C 13 55.852 0.300 . 1 . . . . 73 ALA CA . 11366 1 647 . 2 2 26 26 ALA CB C 13 18.847 0.300 . 1 . . . . 73 ALA CB . 11366 1 648 . 2 2 26 26 ALA N N 15 123.168 0.300 . 1 . . . . 73 ALA N . 11366 1 649 . 2 2 27 27 GLU H H 1 9.377 0.030 . 1 . . . . 74 GLU H . 11366 1 650 . 2 2 27 27 GLU HA H 1 3.823 0.030 . 1 . . . . 74 GLU HA . 11366 1 651 . 2 2 27 27 GLU HB2 H 1 2.128 0.030 . 2 . . . . 74 GLU HB2 . 11366 1 652 . 2 2 27 27 GLU HB3 H 1 1.977 0.030 . 2 . . . . 74 GLU HB3 . 11366 1 653 . 2 2 27 27 GLU HG2 H 1 2.547 0.030 . 2 . . . . 74 GLU HG2 . 11366 1 654 . 2 2 27 27 GLU HG3 H 1 2.246 0.030 . 2 . . . . 74 GLU HG3 . 11366 1 655 . 2 2 27 27 GLU C C 13 179.000 0.300 . 1 . . . . 74 GLU C . 11366 1 656 . 2 2 27 27 GLU CA C 13 61.327 0.300 . 1 . . . . 74 GLU CA . 11366 1 657 . 2 2 27 27 GLU CB C 13 28.892 0.300 . 1 . . . . 74 GLU CB . 11366 1 658 . 2 2 27 27 GLU CG C 13 37.664 0.300 . 1 . . . . 74 GLU CG . 11366 1 659 . 2 2 27 27 GLU N N 15 117.317 0.300 . 1 . . . . 74 GLU N . 11366 1 660 . 2 2 28 28 GLU H H 1 7.654 0.030 . 1 . . . . 75 GLU H . 11366 1 661 . 2 2 28 28 GLU HA H 1 4.132 0.030 . 1 . . . . 75 GLU HA . 11366 1 662 . 2 2 28 28 GLU HB2 H 1 2.292 0.030 . 2 . . . . 75 GLU HB2 . 11366 1 663 . 2 2 28 28 GLU HB3 H 1 1.941 0.030 . 2 . . . . 75 GLU HB3 . 11366 1 664 . 2 2 28 28 GLU HG2 H 1 2.295 0.030 . 1 . . . . 75 GLU HG2 . 11366 1 665 . 2 2 28 28 GLU HG3 H 1 2.295 0.030 . 1 . . . . 75 GLU HG3 . 11366 1 666 . 2 2 28 28 GLU C C 13 179.153 0.300 . 1 . . . . 75 GLU C . 11366 1 667 . 2 2 28 28 GLU CA C 13 59.290 0.300 . 1 . . . . 75 GLU CA . 11366 1 668 . 2 2 28 28 GLU CB C 13 30.597 0.300 . 1 . . . . 75 GLU CB . 11366 1 669 . 2 2 28 28 GLU CG C 13 37.730 0.300 . 1 . . . . 75 GLU CG . 11366 1 670 . 2 2 28 28 GLU N N 15 118.668 0.300 . 1 . . . . 75 GLU N . 11366 1 671 . 2 2 29 29 MET H H 1 8.335 0.030 . 1 . . . . 76 MET H . 11366 1 672 . 2 2 29 29 MET HA H 1 4.353 0.030 . 1 . . . . 76 MET HA . 11366 1 673 . 2 2 29 29 MET HB2 H 1 2.258 0.030 . 2 . . . . 76 MET HB2 . 11366 1 674 . 2 2 29 29 MET HB3 H 1 1.792 0.030 . 2 . . . . 76 MET HB3 . 11366 1 675 . 2 2 29 29 MET HE1 H 1 1.536 0.030 . 1 . . . . 76 MET HE . 11366 1 676 . 2 2 29 29 MET HE2 H 1 1.536 0.030 . 1 . . . . 76 MET HE . 11366 1 677 . 2 2 29 29 MET HE3 H 1 1.536 0.030 . 1 . . . . 76 MET HE . 11366 1 678 . 2 2 29 29 MET HG2 H 1 2.513 0.030 . 2 . . . . 76 MET HG2 . 11366 1 679 . 2 2 29 29 MET HG3 H 1 2.360 0.030 . 2 . . . . 76 MET HG3 . 11366 1 680 . 2 2 29 29 MET C C 13 178.819 0.300 . 1 . . . . 76 MET C . 11366 1 681 . 2 2 29 29 MET CA C 13 57.903 0.300 . 1 . . . . 76 MET CA . 11366 1 682 . 2 2 29 29 MET CB C 13 31.889 0.300 . 1 . . . . 76 MET CB . 11366 1 683 . 2 2 29 29 MET CE C 13 17.629 0.300 . 1 . . . . 76 MET CE . 11366 1 684 . 2 2 29 29 MET CG C 13 33.540 0.300 . 1 . . . . 76 MET CG . 11366 1 685 . 2 2 29 29 MET N N 15 116.693 0.300 . 1 . . . . 76 MET N . 11366 1 686 . 2 2 30 30 TYR H H 1 8.789 0.030 . 1 . . . . 77 TYR H . 11366 1 687 . 2 2 30 30 TYR HA H 1 3.723 0.030 . 1 . . . . 77 TYR HA . 11366 1 688 . 2 2 30 30 TYR HB2 H 1 2.823 0.030 . 2 . . . . 77 TYR HB2 . 11366 1 689 . 2 2 30 30 TYR HB3 H 1 2.600 0.030 . 2 . . . . 77 TYR HB3 . 11366 1 690 . 2 2 30 30 TYR HD1 H 1 6.898 0.030 . 1 . . . . 77 TYR HD1 . 11366 1 691 . 2 2 30 30 TYR HD2 H 1 6.898 0.030 . 1 . . . . 77 TYR HD2 . 11366 1 692 . 2 2 30 30 TYR HE1 H 1 6.418 0.030 . 1 . . . . 77 TYR HE1 . 11366 1 693 . 2 2 30 30 TYR HE2 H 1 6.418 0.030 . 1 . . . . 77 TYR HE2 . 11366 1 694 . 2 2 30 30 TYR C C 13 179.175 0.300 . 1 . . . . 77 TYR C . 11366 1 695 . 2 2 30 30 TYR CA C 13 63.738 0.300 . 1 . . . . 77 TYR CA . 11366 1 696 . 2 2 30 30 TYR CB C 13 37.298 0.300 . 1 . . . . 77 TYR CB . 11366 1 697 . 2 2 30 30 TYR CD1 C 13 132.711 0.300 . 1 . . . . 77 TYR CD1 . 11366 1 698 . 2 2 30 30 TYR CD2 C 13 132.711 0.300 . 1 . . . . 77 TYR CD2 . 11366 1 699 . 2 2 30 30 TYR CE1 C 13 117.651 0.300 . 1 . . . . 77 TYR CE1 . 11366 1 700 . 2 2 30 30 TYR CE2 C 13 117.651 0.300 . 1 . . . . 77 TYR CE2 . 11366 1 701 . 2 2 30 30 TYR N N 15 118.005 0.300 . 1 . . . . 77 TYR N . 11366 1 702 . 2 2 31 31 ASP H H 1 8.075 0.030 . 1 . . . . 78 ASP H . 11366 1 703 . 2 2 31 31 ASP HA H 1 4.501 0.030 . 1 . . . . 78 ASP HA . 11366 1 704 . 2 2 31 31 ASP HB2 H 1 2.914 0.030 . 2 . . . . 78 ASP HB2 . 11366 1 705 . 2 2 31 31 ASP HB3 H 1 2.764 0.030 . 2 . . . . 78 ASP HB3 . 11366 1 706 . 2 2 31 31 ASP C C 13 178.021 0.300 . 1 . . . . 78 ASP C . 11366 1 707 . 2 2 31 31 ASP CA C 13 57.707 0.300 . 1 . . . . 78 ASP CA . 11366 1 708 . 2 2 31 31 ASP CB C 13 41.539 0.300 . 1 . . . . 78 ASP CB . 11366 1 709 . 2 2 31 31 ASP N N 15 121.451 0.300 . 1 . . . . 78 ASP N . 11366 1 710 . 2 2 32 32 ILE H H 1 7.884 0.030 . 1 . . . . 79 ILE H . 11366 1 711 . 2 2 32 32 ILE HA H 1 3.554 0.030 . 1 . . . . 79 ILE HA . 11366 1 712 . 2 2 32 32 ILE HB H 1 1.503 0.030 . 1 . . . . 79 ILE HB . 11366 1 713 . 2 2 32 32 ILE HD11 H 1 0.805 0.030 . 1 . . . . 79 ILE HD1 . 11366 1 714 . 2 2 32 32 ILE HD12 H 1 0.805 0.030 . 1 . . . . 79 ILE HD1 . 11366 1 715 . 2 2 32 32 ILE HD13 H 1 0.805 0.030 . 1 . . . . 79 ILE HD1 . 11366 1 716 . 2 2 32 32 ILE HG12 H 1 1.909 0.030 . 2 . . . . 79 ILE HG12 . 11366 1 717 . 2 2 32 32 ILE HG13 H 1 0.923 0.030 . 2 . . . . 79 ILE HG13 . 11366 1 718 . 2 2 32 32 ILE HG21 H 1 -0.063 0.030 . 1 . . . . 79 ILE HG2 . 11366 1 719 . 2 2 32 32 ILE HG22 H 1 -0.063 0.030 . 1 . . . . 79 ILE HG2 . 11366 1 720 . 2 2 32 32 ILE HG23 H 1 -0.063 0.030 . 1 . . . . 79 ILE HG2 . 11366 1 721 . 2 2 32 32 ILE C C 13 177.835 0.300 . 1 . . . . 79 ILE C . 11366 1 722 . 2 2 32 32 ILE CA C 13 64.828 0.300 . 1 . . . . 79 ILE CA . 11366 1 723 . 2 2 32 32 ILE CB C 13 39.320 0.300 . 1 . . . . 79 ILE CB . 11366 1 724 . 2 2 32 32 ILE CD1 C 13 13.933 0.300 . 1 . . . . 79 ILE CD1 . 11366 1 725 . 2 2 32 32 ILE CG1 C 13 28.577 0.300 . 1 . . . . 79 ILE CG1 . 11366 1 726 . 2 2 32 32 ILE CG2 C 13 16.562 0.300 . 1 . . . . 79 ILE CG2 . 11366 1 727 . 2 2 32 32 ILE N N 15 117.274 0.300 . 1 . . . . 79 ILE N . 11366 1 728 . 2 2 33 33 PHE H H 1 8.018 0.030 . 1 . . . . 80 PHE H . 11366 1 729 . 2 2 33 33 PHE HA H 1 4.298 0.030 . 1 . . . . 80 PHE HA . 11366 1 730 . 2 2 33 33 PHE HB2 H 1 3.240 0.030 . 2 . . . . 80 PHE HB2 . 11366 1 731 . 2 2 33 33 PHE HB3 H 1 2.493 0.030 . 2 . . . . 80 PHE HB3 . 11366 1 732 . 2 2 33 33 PHE HD1 H 1 7.699 0.030 . 1 . . . . 80 PHE HD1 . 11366 1 733 . 2 2 33 33 PHE HD2 H 1 7.699 0.030 . 1 . . . . 80 PHE HD2 . 11366 1 734 . 2 2 33 33 PHE HE1 H 1 7.059 0.030 . 1 . . . . 80 PHE HE1 . 11366 1 735 . 2 2 33 33 PHE HE2 H 1 7.059 0.030 . 1 . . . . 80 PHE HE2 . 11366 1 736 . 2 2 33 33 PHE HZ H 1 6.947 0.030 . 1 . . . . 80 PHE HZ . 11366 1 737 . 2 2 33 33 PHE C C 13 180.341 0.300 . 1 . . . . 80 PHE C . 11366 1 738 . 2 2 33 33 PHE CA C 13 61.749 0.300 . 1 . . . . 80 PHE CA . 11366 1 739 . 2 2 33 33 PHE CB C 13 38.336 0.300 . 1 . . . . 80 PHE CB . 11366 1 740 . 2 2 33 33 PHE CD1 C 13 132.130 0.300 . 1 . . . . 80 PHE CD1 . 11366 1 741 . 2 2 33 33 PHE CD2 C 13 132.130 0.300 . 1 . . . . 80 PHE CD2 . 11366 1 742 . 2 2 33 33 PHE CE1 C 13 130.758 0.300 . 1 . . . . 80 PHE CE1 . 11366 1 743 . 2 2 33 33 PHE CE2 C 13 130.758 0.300 . 1 . . . . 80 PHE CE2 . 11366 1 744 . 2 2 33 33 PHE CZ C 13 128.640 0.300 . 1 . . . . 80 PHE CZ . 11366 1 745 . 2 2 33 33 PHE N N 15 111.747 0.300 . 1 . . . . 80 PHE N . 11366 1 746 . 2 2 34 34 GLY H H 1 8.760 0.030 . 1 . . . . 81 GLY H . 11366 1 747 . 2 2 34 34 GLY HA2 H 1 4.504 0.030 . 2 . . . . 81 GLY HA2 . 11366 1 748 . 2 2 34 34 GLY HA3 H 1 4.271 0.030 . 2 . . . . 81 GLY HA3 . 11366 1 749 . 2 2 34 34 GLY C C 13 174.871 0.300 . 1 . . . . 81 GLY C . 11366 1 750 . 2 2 34 34 GLY CA C 13 46.368 0.300 . 1 . . . . 81 GLY CA . 11366 1 751 . 2 2 34 34 GLY N N 15 111.828 0.300 . 1 . . . . 81 GLY N . 11366 1 752 . 2 2 35 35 LYS H H 1 6.684 0.030 . 1 . . . . 82 LYS H . 11366 1 753 . 2 2 35 35 LYS HA H 1 3.967 0.030 . 1 . . . . 82 LYS HA . 11366 1 754 . 2 2 35 35 LYS HB2 H 1 1.438 0.030 . 2 . . . . 82 LYS HB2 . 11366 1 755 . 2 2 35 35 LYS HB3 H 1 1.246 0.030 . 2 . . . . 82 LYS HB3 . 11366 1 756 . 2 2 35 35 LYS HD2 H 1 1.476 0.030 . 2 . . . . 82 LYS HD2 . 11366 1 757 . 2 2 35 35 LYS HD3 H 1 1.423 0.030 . 2 . . . . 82 LYS HD3 . 11366 1 758 . 2 2 35 35 LYS HE2 H 1 2.855 0.030 . 1 . . . . 82 LYS HE2 . 11366 1 759 . 2 2 35 35 LYS HE3 H 1 2.855 0.030 . 1 . . . . 82 LYS HE3 . 11366 1 760 . 2 2 35 35 LYS HG2 H 1 0.999 0.030 . 2 . . . . 82 LYS HG2 . 11366 1 761 . 2 2 35 35 LYS HG3 H 1 0.931 0.030 . 2 . . . . 82 LYS HG3 . 11366 1 762 . 2 2 35 35 LYS C C 13 176.879 0.300 . 1 . . . . 82 LYS C . 11366 1 763 . 2 2 35 35 LYS CA C 13 57.689 0.300 . 1 . . . . 82 LYS CA . 11366 1 764 . 2 2 35 35 LYS CB C 13 32.047 0.300 . 1 . . . . 82 LYS CB . 11366 1 765 . 2 2 35 35 LYS CD C 13 28.580 0.300 . 1 . . . . 82 LYS CD . 11366 1 766 . 2 2 35 35 LYS CE C 13 42.091 0.300 . 1 . . . . 82 LYS CE . 11366 1 767 . 2 2 35 35 LYS CG C 13 23.939 0.300 . 1 . . . . 82 LYS CG . 11366 1 768 . 2 2 35 35 LYS N N 15 117.632 0.300 . 1 . . . . 82 LYS N . 11366 1 769 . 2 2 36 36 TYR H H 1 6.882 0.030 . 1 . . . . 83 TYR H . 11366 1 770 . 2 2 36 36 TYR HA H 1 4.199 0.030 . 1 . . . . 83 TYR HA . 11366 1 771 . 2 2 36 36 TYR HB2 H 1 3.339 0.030 . 2 . . . . 83 TYR HB2 . 11366 1 772 . 2 2 36 36 TYR HB3 H 1 2.599 0.030 . 2 . . . . 83 TYR HB3 . 11366 1 773 . 2 2 36 36 TYR HD1 H 1 7.059 0.030 . 1 . . . . 83 TYR HD1 . 11366 1 774 . 2 2 36 36 TYR HD2 H 1 7.059 0.030 . 1 . . . . 83 TYR HD2 . 11366 1 775 . 2 2 36 36 TYR HE1 H 1 6.389 0.030 . 1 . . . . 83 TYR HE1 . 11366 1 776 . 2 2 36 36 TYR HE2 H 1 6.389 0.030 . 1 . . . . 83 TYR HE2 . 11366 1 777 . 2 2 36 36 TYR C C 13 173.706 0.300 . 1 . . . . 83 TYR C . 11366 1 778 . 2 2 36 36 TYR CA C 13 59.673 0.300 . 1 . . . . 83 TYR CA . 11366 1 779 . 2 2 36 36 TYR CB C 13 39.379 0.300 . 1 . . . . 83 TYR CB . 11366 1 780 . 2 2 36 36 TYR CD1 C 13 132.480 0.300 . 1 . . . . 83 TYR CD1 . 11366 1 781 . 2 2 36 36 TYR CD2 C 13 132.480 0.300 . 1 . . . . 83 TYR CD2 . 11366 1 782 . 2 2 36 36 TYR CE1 C 13 118.404 0.300 . 1 . . . . 83 TYR CE1 . 11366 1 783 . 2 2 36 36 TYR CE2 C 13 118.404 0.300 . 1 . . . . 83 TYR CE2 . 11366 1 784 . 2 2 36 36 TYR N N 15 113.345 0.300 . 1 . . . . 83 TYR N . 11366 1 785 . 2 2 37 37 GLY H H 1 7.289 0.030 . 1 . . . . 84 GLY H . 11366 1 786 . 2 2 37 37 GLY HA2 H 1 4.957 0.030 . 2 . . . . 84 GLY HA2 . 11366 1 787 . 2 2 37 37 GLY HA3 H 1 3.932 0.030 . 2 . . . . 84 GLY HA3 . 11366 1 788 . 2 2 37 37 GLY C C 13 173.859 0.300 . 1 . . . . 84 GLY C . 11366 1 789 . 2 2 37 37 GLY CA C 13 44.840 0.300 . 1 . . . . 84 GLY CA . 11366 1 790 . 2 2 37 37 GLY N N 15 106.224 0.300 . 1 . . . . 84 GLY N . 11366 1 791 . 2 2 38 38 PRO HA H 1 4.512 0.030 . 1 . . . . 85 PRO HA . 11366 1 792 . 2 2 38 38 PRO HB2 H 1 2.406 0.030 . 2 . . . . 85 PRO HB2 . 11366 1 793 . 2 2 38 38 PRO HB3 H 1 1.972 0.030 . 2 . . . . 85 PRO HB3 . 11366 1 794 . 2 2 38 38 PRO HD2 H 1 4.025 0.030 . 2 . . . . 85 PRO HD2 . 11366 1 795 . 2 2 38 38 PRO HD3 H 1 3.647 0.030 . 2 . . . . 85 PRO HD3 . 11366 1 796 . 2 2 38 38 PRO HG2 H 1 2.272 0.030 . 2 . . . . 85 PRO HG2 . 11366 1 797 . 2 2 38 38 PRO HG3 H 1 2.110 0.030 . 2 . . . . 85 PRO HG3 . 11366 1 798 . 2 2 38 38 PRO C C 13 177.373 0.300 . 1 . . . . 85 PRO C . 11366 1 799 . 2 2 38 38 PRO CA C 13 63.460 0.300 . 1 . . . . 85 PRO CA . 11366 1 800 . 2 2 38 38 PRO CB C 13 32.587 0.300 . 1 . . . . 85 PRO CB . 11366 1 801 . 2 2 38 38 PRO CD C 13 49.827 0.300 . 1 . . . . 85 PRO CD . 11366 1 802 . 2 2 38 38 PRO CG C 13 27.829 0.300 . 1 . . . . 85 PRO CG . 11366 1 803 . 2 2 39 39 ILE H H 1 8.531 0.030 . 1 . . . . 86 ILE H . 11366 1 804 . 2 2 39 39 ILE HA H 1 3.967 0.030 . 1 . . . . 86 ILE HA . 11366 1 805 . 2 2 39 39 ILE HB H 1 1.825 0.030 . 1 . . . . 86 ILE HB . 11366 1 806 . 2 2 39 39 ILE HD11 H 1 0.245 0.030 . 1 . . . . 86 ILE HD1 . 11366 1 807 . 2 2 39 39 ILE HD12 H 1 0.245 0.030 . 1 . . . . 86 ILE HD1 . 11366 1 808 . 2 2 39 39 ILE HD13 H 1 0.245 0.030 . 1 . . . . 86 ILE HD1 . 11366 1 809 . 2 2 39 39 ILE HG12 H 1 1.588 0.030 . 2 . . . . 86 ILE HG12 . 11366 1 810 . 2 2 39 39 ILE HG13 H 1 0.673 0.030 . 2 . . . . 86 ILE HG13 . 11366 1 811 . 2 2 39 39 ILE HG21 H 1 0.406 0.030 . 1 . . . . 86 ILE HG2 . 11366 1 812 . 2 2 39 39 ILE HG22 H 1 0.406 0.030 . 1 . . . . 86 ILE HG2 . 11366 1 813 . 2 2 39 39 ILE HG23 H 1 0.406 0.030 . 1 . . . . 86 ILE HG2 . 11366 1 814 . 2 2 39 39 ILE C C 13 176.613 0.300 . 1 . . . . 86 ILE C . 11366 1 815 . 2 2 39 39 ILE CA C 13 60.095 0.300 . 1 . . . . 86 ILE CA . 11366 1 816 . 2 2 39 39 ILE CB C 13 40.156 0.300 . 1 . . . . 86 ILE CB . 11366 1 817 . 2 2 39 39 ILE CD1 C 13 12.819 0.300 . 1 . . . . 86 ILE CD1 . 11366 1 818 . 2 2 39 39 ILE CG1 C 13 27.381 0.300 . 1 . . . . 86 ILE CG1 . 11366 1 819 . 2 2 39 39 ILE CG2 C 13 17.740 0.300 . 1 . . . . 86 ILE CG2 . 11366 1 820 . 2 2 39 39 ILE N N 15 125.460 0.300 . 1 . . . . 86 ILE N . 11366 1 821 . 2 2 40 40 ARG H H 1 9.218 0.030 . 1 . . . . 87 ARG H . 11366 1 822 . 2 2 40 40 ARG HA H 1 4.533 0.030 . 1 . . . . 87 ARG HA . 11366 1 823 . 2 2 40 40 ARG HB2 H 1 1.601 0.030 . 2 . . . . 87 ARG HB2 . 11366 1 824 . 2 2 40 40 ARG HB3 H 1 1.513 0.030 . 2 . . . . 87 ARG HB3 . 11366 1 825 . 2 2 40 40 ARG HD2 H 1 3.486 0.030 . 2 . . . . 87 ARG HD2 . 11366 1 826 . 2 2 40 40 ARG HD3 H 1 3.366 0.030 . 2 . . . . 87 ARG HD3 . 11366 1 827 . 2 2 40 40 ARG HE H 1 7.129 0.030 . 1 . . . . 87 ARG HE . 11366 1 828 . 2 2 40 40 ARG HG2 H 1 1.624 0.030 . 2 . . . . 87 ARG HG2 . 11366 1 829 . 2 2 40 40 ARG HG3 H 1 1.253 0.030 . 2 . . . . 87 ARG HG3 . 11366 1 830 . 2 2 40 40 ARG C C 13 176.112 0.300 . 1 . . . . 87 ARG C . 11366 1 831 . 2 2 40 40 ARG CA C 13 56.303 0.300 . 1 . . . . 87 ARG CA . 11366 1 832 . 2 2 40 40 ARG CB C 13 30.084 0.300 . 1 . . . . 87 ARG CB . 11366 1 833 . 2 2 40 40 ARG CD C 13 41.798 0.300 . 1 . . . . 87 ARG CD . 11366 1 834 . 2 2 40 40 ARG CG C 13 27.674 0.300 . 1 . . . . 87 ARG CG . 11366 1 835 . 2 2 40 40 ARG N N 15 130.435 0.300 . 1 . . . . 87 ARG N . 11366 1 836 . 2 2 40 40 ARG NE N 15 83.790 0.300 . 1 . . . . 87 ARG NE . 11366 1 837 . 2 2 41 41 GLN H H 1 7.670 0.030 . 1 . . . . 88 GLN H . 11366 1 838 . 2 2 41 41 GLN HA H 1 4.380 0.030 . 1 . . . . 88 GLN HA . 11366 1 839 . 2 2 41 41 GLN HB2 H 1 2.079 0.030 . 2 . . . . 88 GLN HB2 . 11366 1 840 . 2 2 41 41 GLN HB3 H 1 1.699 0.030 . 2 . . . . 88 GLN HB3 . 11366 1 841 . 2 2 41 41 GLN HE21 H 1 7.792 0.030 . 2 . . . . 88 GLN HE21 . 11366 1 842 . 2 2 41 41 GLN HE22 H 1 7.571 0.030 . 2 . . . . 88 GLN HE22 . 11366 1 843 . 2 2 41 41 GLN HG2 H 1 2.403 0.030 . 2 . . . . 88 GLN HG2 . 11366 1 844 . 2 2 41 41 GLN HG3 H 1 1.838 0.030 . 2 . . . . 88 GLN HG3 . 11366 1 845 . 2 2 41 41 GLN C C 13 172.036 0.300 . 1 . . . . 88 GLN C . 11366 1 846 . 2 2 41 41 GLN CA C 13 56.640 0.300 . 1 . . . . 88 GLN CA . 11366 1 847 . 2 2 41 41 GLN CB C 13 34.370 0.300 . 1 . . . . 88 GLN CB . 11366 1 848 . 2 2 41 41 GLN CG C 13 37.186 0.300 . 1 . . . . 88 GLN CG . 11366 1 849 . 2 2 41 41 GLN N N 15 117.439 0.300 . 1 . . . . 88 GLN N . 11366 1 850 . 2 2 41 41 GLN NE2 N 15 112.562 0.300 . 1 . . . . 88 GLN NE2 . 11366 1 851 . 2 2 42 42 ILE H H 1 8.782 0.030 . 1 . . . . 89 ILE H . 11366 1 852 . 2 2 42 42 ILE HA H 1 4.705 0.030 . 1 . . . . 89 ILE HA . 11366 1 853 . 2 2 42 42 ILE HB H 1 1.579 0.030 . 1 . . . . 89 ILE HB . 11366 1 854 . 2 2 42 42 ILE HD11 H 1 -0.008 0.030 . 1 . . . . 89 ILE HD1 . 11366 1 855 . 2 2 42 42 ILE HD12 H 1 -0.008 0.030 . 1 . . . . 89 ILE HD1 . 11366 1 856 . 2 2 42 42 ILE HD13 H 1 -0.008 0.030 . 1 . . . . 89 ILE HD1 . 11366 1 857 . 2 2 42 42 ILE HG12 H 1 1.368 0.030 . 2 . . . . 89 ILE HG12 . 11366 1 858 . 2 2 42 42 ILE HG13 H 1 0.670 0.030 . 2 . . . . 89 ILE HG13 . 11366 1 859 . 2 2 42 42 ILE HG21 H 1 0.565 0.030 . 1 . . . . 89 ILE HG2 . 11366 1 860 . 2 2 42 42 ILE HG22 H 1 0.565 0.030 . 1 . . . . 89 ILE HG2 . 11366 1 861 . 2 2 42 42 ILE HG23 H 1 0.565 0.030 . 1 . . . . 89 ILE HG2 . 11366 1 862 . 2 2 42 42 ILE C C 13 174.669 0.300 . 1 . . . . 89 ILE C . 11366 1 863 . 2 2 42 42 ILE CA C 13 61.006 0.300 . 1 . . . . 89 ILE CA . 11366 1 864 . 2 2 42 42 ILE CB C 13 40.865 0.300 . 1 . . . . 89 ILE CB . 11366 1 865 . 2 2 42 42 ILE CD1 C 13 12.536 0.300 . 1 . . . . 89 ILE CD1 . 11366 1 866 . 2 2 42 42 ILE CG1 C 13 28.017 0.300 . 1 . . . . 89 ILE CG1 . 11366 1 867 . 2 2 42 42 ILE CG2 C 13 17.530 0.300 . 1 . . . . 89 ILE CG2 . 11366 1 868 . 2 2 42 42 ILE N N 15 123.702 0.300 . 1 . . . . 89 ILE N . 11366 1 869 . 2 2 43 43 ARG H H 1 8.989 0.030 . 1 . . . . 90 ARG H . 11366 1 870 . 2 2 43 43 ARG HA H 1 5.379 0.030 . 1 . . . . 90 ARG HA . 11366 1 871 . 2 2 43 43 ARG HB2 H 1 1.410 0.030 . 2 . . . . 90 ARG HB2 . 11366 1 872 . 2 2 43 43 ARG HB3 H 1 1.267 0.030 . 2 . . . . 90 ARG HB3 . 11366 1 873 . 2 2 43 43 ARG HD2 H 1 2.450 0.030 . 2 . . . . 90 ARG HD2 . 11366 1 874 . 2 2 43 43 ARG HD3 H 1 2.021 0.030 . 2 . . . . 90 ARG HD3 . 11366 1 875 . 2 2 43 43 ARG HE H 1 6.423 0.030 . 1 . . . . 90 ARG HE . 11366 1 876 . 2 2 43 43 ARG HG2 H 1 1.146 0.030 . 2 . . . . 90 ARG HG2 . 11366 1 877 . 2 2 43 43 ARG HG3 H 1 1.027 0.030 . 2 . . . . 90 ARG HG3 . 11366 1 878 . 2 2 43 43 ARG C C 13 174.890 0.300 . 1 . . . . 90 ARG C . 11366 1 879 . 2 2 43 43 ARG CA C 13 53.907 0.300 . 1 . . . . 90 ARG CA . 11366 1 880 . 2 2 43 43 ARG CB C 13 33.572 0.300 . 1 . . . . 90 ARG CB . 11366 1 881 . 2 2 43 43 ARG CD C 13 43.105 0.300 . 1 . . . . 90 ARG CD . 11366 1 882 . 2 2 43 43 ARG CG C 13 27.358 0.300 . 1 . . . . 90 ARG CG . 11366 1 883 . 2 2 43 43 ARG N N 15 123.585 0.300 . 1 . . . . 90 ARG N . 11366 1 884 . 2 2 43 43 ARG NE N 15 83.783 0.300 . 1 . . . . 90 ARG NE . 11366 1 885 . 2 2 44 44 VAL H H 1 9.071 0.030 . 1 . . . . 91 VAL H . 11366 1 886 . 2 2 44 44 VAL HA H 1 4.990 0.030 . 1 . . . . 91 VAL HA . 11366 1 887 . 2 2 44 44 VAL HB H 1 2.155 0.030 . 1 . . . . 91 VAL HB . 11366 1 888 . 2 2 44 44 VAL HG11 H 1 0.980 0.030 . 1 . . . . 91 VAL HG1 . 11366 1 889 . 2 2 44 44 VAL HG12 H 1 0.980 0.030 . 1 . . . . 91 VAL HG1 . 11366 1 890 . 2 2 44 44 VAL HG13 H 1 0.980 0.030 . 1 . . . . 91 VAL HG1 . 11366 1 891 . 2 2 44 44 VAL HG21 H 1 0.960 0.030 . 1 . . . . 91 VAL HG2 . 11366 1 892 . 2 2 44 44 VAL HG22 H 1 0.960 0.030 . 1 . . . . 91 VAL HG2 . 11366 1 893 . 2 2 44 44 VAL HG23 H 1 0.960 0.030 . 1 . . . . 91 VAL HG2 . 11366 1 894 . 2 2 44 44 VAL C C 13 175.914 0.300 . 1 . . . . 91 VAL C . 11366 1 895 . 2 2 44 44 VAL CA C 13 59.654 0.300 . 1 . . . . 91 VAL CA . 11366 1 896 . 2 2 44 44 VAL CB C 13 35.438 0.300 . 1 . . . . 91 VAL CB . 11366 1 897 . 2 2 44 44 VAL CG1 C 13 22.154 0.300 . 2 . . . . 91 VAL CG1 . 11366 1 898 . 2 2 44 44 VAL CG2 C 13 20.308 0.300 . 2 . . . . 91 VAL CG2 . 11366 1 899 . 2 2 44 44 VAL N N 15 116.739 0.300 . 1 . . . . 91 VAL N . 11366 1 900 . 2 2 45 45 GLY H H 1 8.837 0.030 . 1 . . . . 92 GLY H . 11366 1 901 . 2 2 45 45 GLY HA2 H 1 3.407 0.030 . 2 . . . . 92 GLY HA2 . 11366 1 902 . 2 2 45 45 GLY HA3 H 1 3.347 0.030 . 2 . . . . 92 GLY HA3 . 11366 1 903 . 2 2 45 45 GLY C C 13 175.169 0.300 . 1 . . . . 92 GLY C . 11366 1 904 . 2 2 45 45 GLY CA C 13 47.019 0.300 . 1 . . . . 92 GLY CA . 11366 1 905 . 2 2 45 45 GLY N N 15 113.734 0.300 . 1 . . . . 92 GLY N . 11366 1 906 . 2 2 46 46 ASN H H 1 8.362 0.030 . 1 . . . . 93 ASN H . 11366 1 907 . 2 2 46 46 ASN HA H 1 4.952 0.030 . 1 . . . . 93 ASN HA . 11366 1 908 . 2 2 46 46 ASN HB2 H 1 2.718 0.030 . 2 . . . . 93 ASN HB2 . 11366 1 909 . 2 2 46 46 ASN HB3 H 1 2.416 0.030 . 2 . . . . 93 ASN HB3 . 11366 1 910 . 2 2 46 46 ASN HD21 H 1 7.499 0.030 . 2 . . . . 93 ASN HD21 . 11366 1 911 . 2 2 46 46 ASN HD22 H 1 6.658 0.030 . 2 . . . . 93 ASN HD22 . 11366 1 912 . 2 2 46 46 ASN C C 13 174.078 0.300 . 1 . . . . 93 ASN C . 11366 1 913 . 2 2 46 46 ASN CA C 13 51.998 0.300 . 1 . . . . 93 ASN CA . 11366 1 914 . 2 2 46 46 ASN CB C 13 40.026 0.300 . 1 . . . . 93 ASN CB . 11366 1 915 . 2 2 46 46 ASN N N 15 124.066 0.300 . 1 . . . . 93 ASN N . 11366 1 916 . 2 2 46 46 ASN ND2 N 15 110.389 0.300 . 1 . . . . 93 ASN ND2 . 11366 1 917 . 2 2 47 47 THR H H 1 7.331 0.030 . 1 . . . . 94 THR H . 11366 1 918 . 2 2 47 47 THR HA H 1 4.950 0.030 . 1 . . . . 94 THR HA . 11366 1 919 . 2 2 47 47 THR HB H 1 4.603 0.030 . 1 . . . . 94 THR HB . 11366 1 920 . 2 2 47 47 THR HG21 H 1 1.166 0.030 . 1 . . . . 94 THR HG2 . 11366 1 921 . 2 2 47 47 THR HG22 H 1 1.166 0.030 . 1 . . . . 94 THR HG2 . 11366 1 922 . 2 2 47 47 THR HG23 H 1 1.166 0.030 . 1 . . . . 94 THR HG2 . 11366 1 923 . 2 2 47 47 THR C C 13 173.065 0.300 . 1 . . . . 94 THR C . 11366 1 924 . 2 2 47 47 THR CA C 13 58.547 0.300 . 1 . . . . 94 THR CA . 11366 1 925 . 2 2 47 47 THR CB C 13 70.041 0.300 . 1 . . . . 94 THR CB . 11366 1 926 . 2 2 47 47 THR CG2 C 13 22.479 0.300 . 1 . . . . 94 THR CG2 . 11366 1 927 . 2 2 47 47 THR N N 15 109.853 0.300 . 1 . . . . 94 THR N . 11366 1 928 . 2 2 48 48 PRO HA H 1 4.063 0.030 . 1 . . . . 95 PRO HA . 11366 1 929 . 2 2 48 48 PRO HB2 H 1 2.374 0.030 . 2 . . . . 95 PRO HB2 . 11366 1 930 . 2 2 48 48 PRO HB3 H 1 1.920 0.030 . 2 . . . . 95 PRO HB3 . 11366 1 931 . 2 2 48 48 PRO HD2 H 1 3.867 0.030 . 1 . . . . 95 PRO HD2 . 11366 1 932 . 2 2 48 48 PRO HD3 H 1 3.867 0.030 . 1 . . . . 95 PRO HD3 . 11366 1 933 . 2 2 48 48 PRO HG2 H 1 2.232 0.030 . 2 . . . . 95 PRO HG2 . 11366 1 934 . 2 2 48 48 PRO HG3 H 1 1.945 0.030 . 2 . . . . 95 PRO HG3 . 11366 1 935 . 2 2 48 48 PRO C C 13 178.196 0.300 . 1 . . . . 95 PRO C . 11366 1 936 . 2 2 48 48 PRO CA C 13 66.129 0.300 . 1 . . . . 95 PRO CA . 11366 1 937 . 2 2 48 48 PRO CB C 13 31.711 0.300 . 1 . . . . 95 PRO CB . 11366 1 938 . 2 2 48 48 PRO CD C 13 50.301 0.300 . 1 . . . . 95 PRO CD . 11366 1 939 . 2 2 48 48 PRO CG C 13 28.195 0.300 . 1 . . . . 95 PRO CG . 11366 1 940 . 2 2 49 49 GLU H H 1 8.395 0.030 . 1 . . . . 96 GLU H . 11366 1 941 . 2 2 49 49 GLU HA H 1 4.222 0.030 . 1 . . . . 96 GLU HA . 11366 1 942 . 2 2 49 49 GLU HB2 H 1 2.062 0.030 . 1 . . . . 96 GLU HB2 . 11366 1 943 . 2 2 49 49 GLU HB3 H 1 2.062 0.030 . 1 . . . . 96 GLU HB3 . 11366 1 944 . 2 2 49 49 GLU HG2 H 1 2.446 0.030 . 2 . . . . 96 GLU HG2 . 11366 1 945 . 2 2 49 49 GLU HG3 H 1 2.283 0.030 . 2 . . . . 96 GLU HG3 . 11366 1 946 . 2 2 49 49 GLU C C 13 177.526 0.300 . 1 . . . . 96 GLU C . 11366 1 947 . 2 2 49 49 GLU CA C 13 58.939 0.300 . 1 . . . . 96 GLU CA . 11366 1 948 . 2 2 49 49 GLU CB C 13 29.890 0.300 . 1 . . . . 96 GLU CB . 11366 1 949 . 2 2 49 49 GLU CG C 13 37.242 0.300 . 1 . . . . 96 GLU CG . 11366 1 950 . 2 2 49 49 GLU N N 15 113.130 0.300 . 1 . . . . 96 GLU N . 11366 1 951 . 2 2 50 50 THR H H 1 7.538 0.030 . 1 . . . . 97 THR H . 11366 1 952 . 2 2 50 50 THR HA H 1 4.457 0.030 . 1 . . . . 97 THR HA . 11366 1 953 . 2 2 50 50 THR HB H 1 3.776 0.030 . 1 . . . . 97 THR HB . 11366 1 954 . 2 2 50 50 THR HG21 H 1 1.075 0.030 . 1 . . . . 97 THR HG2 . 11366 1 955 . 2 2 50 50 THR HG22 H 1 1.075 0.030 . 1 . . . . 97 THR HG2 . 11366 1 956 . 2 2 50 50 THR HG23 H 1 1.075 0.030 . 1 . . . . 97 THR HG2 . 11366 1 957 . 2 2 50 50 THR C C 13 176.046 0.300 . 1 . . . . 97 THR C . 11366 1 958 . 2 2 50 50 THR CA C 13 60.579 0.300 . 1 . . . . 97 THR CA . 11366 1 959 . 2 2 50 50 THR CB C 13 70.276 0.300 . 1 . . . . 97 THR CB . 11366 1 960 . 2 2 50 50 THR CG2 C 13 22.173 0.300 . 1 . . . . 97 THR CG2 . 11366 1 961 . 2 2 50 50 THR N N 15 106.613 0.300 . 1 . . . . 97 THR N . 11366 1 962 . 2 2 51 51 ARG H H 1 7.915 0.030 . 1 . . . . 98 ARG H . 11366 1 963 . 2 2 51 51 ARG HA H 1 4.010 0.030 . 1 . . . . 98 ARG HA . 11366 1 964 . 2 2 51 51 ARG HB2 H 1 1.576 0.030 . 2 . . . . 98 ARG HB2 . 11366 1 965 . 2 2 51 51 ARG HB3 H 1 1.447 0.030 . 2 . . . . 98 ARG HB3 . 11366 1 966 . 2 2 51 51 ARG HD2 H 1 2.787 0.030 . 2 . . . . 98 ARG HD2 . 11366 1 967 . 2 2 51 51 ARG HD3 H 1 2.589 0.030 . 2 . . . . 98 ARG HD3 . 11366 1 968 . 2 2 51 51 ARG HG2 H 1 1.468 0.030 . 2 . . . . 98 ARG HG2 . 11366 1 969 . 2 2 51 51 ARG HG3 H 1 1.394 0.030 . 2 . . . . 98 ARG HG3 . 11366 1 970 . 2 2 51 51 ARG C C 13 176.536 0.300 . 1 . . . . 98 ARG C . 11366 1 971 . 2 2 51 51 ARG CA C 13 57.890 0.300 . 1 . . . . 98 ARG CA . 11366 1 972 . 2 2 51 51 ARG CB C 13 29.773 0.300 . 1 . . . . 98 ARG CB . 11366 1 973 . 2 2 51 51 ARG CD C 13 43.571 0.300 . 1 . . . . 98 ARG CD . 11366 1 974 . 2 2 51 51 ARG CG C 13 26.520 0.300 . 1 . . . . 98 ARG CG . 11366 1 975 . 2 2 51 51 ARG N N 15 126.231 0.300 . 1 . . . . 98 ARG N . 11366 1 976 . 2 2 52 52 GLY H H 1 9.399 0.030 . 1 . . . . 99 GLY H . 11366 1 977 . 2 2 52 52 GLY HA2 H 1 4.422 0.030 . 2 . . . . 99 GLY HA2 . 11366 1 978 . 2 2 52 52 GLY HA3 H 1 3.805 0.030 . 2 . . . . 99 GLY HA3 . 11366 1 979 . 2 2 52 52 GLY C C 13 172.726 0.300 . 1 . . . . 99 GLY C . 11366 1 980 . 2 2 52 52 GLY CA C 13 45.663 0.300 . 1 . . . . 99 GLY CA . 11366 1 981 . 2 2 52 52 GLY N N 15 111.725 0.300 . 1 . . . . 99 GLY N . 11366 1 982 . 2 2 53 53 THR H H 1 7.827 0.030 . 1 . . . . 100 THR H . 11366 1 983 . 2 2 53 53 THR HA H 1 5.621 0.030 . 1 . . . . 100 THR HA . 11366 1 984 . 2 2 53 53 THR HB H 1 4.378 0.030 . 1 . . . . 100 THR HB . 11366 1 985 . 2 2 53 53 THR HG21 H 1 1.253 0.030 . 1 . . . . 100 THR HG2 . 11366 1 986 . 2 2 53 53 THR HG22 H 1 1.253 0.030 . 1 . . . . 100 THR HG2 . 11366 1 987 . 2 2 53 53 THR HG23 H 1 1.253 0.030 . 1 . . . . 100 THR HG2 . 11366 1 988 . 2 2 53 53 THR C C 13 173.721 0.300 . 1 . . . . 100 THR C . 11366 1 989 . 2 2 53 53 THR CA C 13 59.358 0.300 . 1 . . . . 100 THR CA . 11366 1 990 . 2 2 53 53 THR CB C 13 73.703 0.300 . 1 . . . . 100 THR CB . 11366 1 991 . 2 2 53 53 THR CG2 C 13 22.189 0.300 . 1 . . . . 100 THR CG2 . 11366 1 992 . 2 2 53 53 THR N N 15 108.301 0.300 . 1 . . . . 100 THR N . 11366 1 993 . 2 2 54 54 ALA H H 1 8.809 0.030 . 1 . . . . 101 ALA H . 11366 1 994 . 2 2 54 54 ALA HA H 1 5.083 0.030 . 1 . . . . 101 ALA HA . 11366 1 995 . 2 2 54 54 ALA HB1 H 1 1.122 0.030 . 1 . . . . 101 ALA HB . 11366 1 996 . 2 2 54 54 ALA HB2 H 1 1.122 0.030 . 1 . . . . 101 ALA HB . 11366 1 997 . 2 2 54 54 ALA HB3 H 1 1.122 0.030 . 1 . . . . 101 ALA HB . 11366 1 998 . 2 2 54 54 ALA C C 13 173.762 0.300 . 1 . . . . 101 ALA C . 11366 1 999 . 2 2 54 54 ALA CA C 13 51.421 0.300 . 1 . . . . 101 ALA CA . 11366 1 1000 . 2 2 54 54 ALA CB C 13 24.154 0.300 . 1 . . . . 101 ALA CB . 11366 1 1001 . 2 2 54 54 ALA N N 15 120.421 0.300 . 1 . . . . 101 ALA N . 11366 1 1002 . 2 2 55 55 TYR H H 1 8.815 0.030 . 1 . . . . 102 TYR H . 11366 1 1003 . 2 2 55 55 TYR HA H 1 5.565 0.030 . 1 . . . . 102 TYR HA . 11366 1 1004 . 2 2 55 55 TYR HB2 H 1 2.268 0.030 . 2 . . . . 102 TYR HB2 . 11366 1 1005 . 2 2 55 55 TYR HB3 H 1 1.674 0.030 . 2 . . . . 102 TYR HB3 . 11366 1 1006 . 2 2 55 55 TYR HD1 H 1 6.138 0.030 . 1 . . . . 102 TYR HD1 . 11366 1 1007 . 2 2 55 55 TYR HD2 H 1 6.138 0.030 . 1 . . . . 102 TYR HD2 . 11366 1 1008 . 2 2 55 55 TYR HE1 H 1 5.593 0.030 . 1 . . . . 102 TYR HE1 . 11366 1 1009 . 2 2 55 55 TYR HE2 H 1 5.593 0.030 . 1 . . . . 102 TYR HE2 . 11366 1 1010 . 2 2 55 55 TYR C C 13 174.859 0.300 . 1 . . . . 102 TYR C . 11366 1 1011 . 2 2 55 55 TYR CA C 13 56.875 0.300 . 1 . . . . 102 TYR CA . 11366 1 1012 . 2 2 55 55 TYR CB C 13 42.171 0.300 . 1 . . . . 102 TYR CB . 11366 1 1013 . 2 2 55 55 TYR CD1 C 13 132.380 0.300 . 1 . . . . 102 TYR CD1 . 11366 1 1014 . 2 2 55 55 TYR CD2 C 13 132.380 0.300 . 1 . . . . 102 TYR CD2 . 11366 1 1015 . 2 2 55 55 TYR CE1 C 13 117.868 0.300 . 1 . . . . 102 TYR CE1 . 11366 1 1016 . 2 2 55 55 TYR CE2 C 13 117.868 0.300 . 1 . . . . 102 TYR CE2 . 11366 1 1017 . 2 2 55 55 TYR N N 15 114.882 0.300 . 1 . . . . 102 TYR N . 11366 1 1018 . 2 2 56 56 VAL H H 1 9.011 0.030 . 1 . . . . 103 VAL H . 11366 1 1019 . 2 2 56 56 VAL HA H 1 4.027 0.030 . 1 . . . . 103 VAL HA . 11366 1 1020 . 2 2 56 56 VAL HB H 1 1.427 0.030 . 1 . . . . 103 VAL HB . 11366 1 1021 . 2 2 56 56 VAL HG11 H 1 0.179 0.030 . 1 . . . . 103 VAL HG1 . 11366 1 1022 . 2 2 56 56 VAL HG12 H 1 0.179 0.030 . 1 . . . . 103 VAL HG1 . 11366 1 1023 . 2 2 56 56 VAL HG13 H 1 0.179 0.030 . 1 . . . . 103 VAL HG1 . 11366 1 1024 . 2 2 56 56 VAL HG21 H 1 -0.344 0.030 . 1 . . . . 103 VAL HG2 . 11366 1 1025 . 2 2 56 56 VAL HG22 H 1 -0.344 0.030 . 1 . . . . 103 VAL HG2 . 11366 1 1026 . 2 2 56 56 VAL HG23 H 1 -0.344 0.030 . 1 . . . . 103 VAL HG2 . 11366 1 1027 . 2 2 56 56 VAL C C 13 173.121 0.300 . 1 . . . . 103 VAL C . 11366 1 1028 . 2 2 56 56 VAL CA C 13 61.372 0.300 . 1 . . . . 103 VAL CA . 11366 1 1029 . 2 2 56 56 VAL CB C 13 34.513 0.300 . 1 . . . . 103 VAL CB . 11366 1 1030 . 2 2 56 56 VAL CG1 C 13 20.833 0.300 . 2 . . . . 103 VAL CG1 . 11366 1 1031 . 2 2 56 56 VAL CG2 C 13 19.279 0.300 . 2 . . . . 103 VAL CG2 . 11366 1 1032 . 2 2 56 56 VAL N N 15 122.222 0.300 . 1 . . . . 103 VAL N . 11366 1 1033 . 2 2 57 57 VAL H H 1 8.777 0.030 . 1 . . . . 104 VAL H . 11366 1 1034 . 2 2 57 57 VAL HA H 1 4.730 0.030 . 1 . . . . 104 VAL HA . 11366 1 1035 . 2 2 57 57 VAL HB H 1 2.130 0.030 . 1 . . . . 104 VAL HB . 11366 1 1036 . 2 2 57 57 VAL HG11 H 1 0.838 0.030 . 1 . . . . 104 VAL HG1 . 11366 1 1037 . 2 2 57 57 VAL HG12 H 1 0.838 0.030 . 1 . . . . 104 VAL HG1 . 11366 1 1038 . 2 2 57 57 VAL HG13 H 1 0.838 0.030 . 1 . . . . 104 VAL HG1 . 11366 1 1039 . 2 2 57 57 VAL HG21 H 1 0.943 0.030 . 1 . . . . 104 VAL HG2 . 11366 1 1040 . 2 2 57 57 VAL HG22 H 1 0.943 0.030 . 1 . . . . 104 VAL HG2 . 11366 1 1041 . 2 2 57 57 VAL HG23 H 1 0.943 0.030 . 1 . . . . 104 VAL HG2 . 11366 1 1042 . 2 2 57 57 VAL C C 13 176.194 0.300 . 1 . . . . 104 VAL C . 11366 1 1043 . 2 2 57 57 VAL CA C 13 60.368 0.300 . 1 . . . . 104 VAL CA . 11366 1 1044 . 2 2 57 57 VAL CB C 13 32.230 0.300 . 1 . . . . 104 VAL CB . 11366 1 1045 . 2 2 57 57 VAL CG1 C 13 20.640 0.300 . 2 . . . . 104 VAL CG1 . 11366 1 1046 . 2 2 57 57 VAL CG2 C 13 20.401 0.300 . 2 . . . . 104 VAL CG2 . 11366 1 1047 . 2 2 57 57 VAL N N 15 125.513 0.300 . 1 . . . . 104 VAL N . 11366 1 1048 . 2 2 58 58 TYR H H 1 9.074 0.030 . 1 . . . . 105 TYR H . 11366 1 1049 . 2 2 58 58 TYR HA H 1 4.534 0.030 . 1 . . . . 105 TYR HA . 11366 1 1050 . 2 2 58 58 TYR HB2 H 1 3.748 0.030 . 2 . . . . 105 TYR HB2 . 11366 1 1051 . 2 2 58 58 TYR HB3 H 1 2.855 0.030 . 2 . . . . 105 TYR HB3 . 11366 1 1052 . 2 2 58 58 TYR HD1 H 1 7.140 0.030 . 1 . . . . 105 TYR HD1 . 11366 1 1053 . 2 2 58 58 TYR HD2 H 1 7.140 0.030 . 1 . . . . 105 TYR HD2 . 11366 1 1054 . 2 2 58 58 TYR HE1 H 1 6.661 0.030 . 1 . . . . 105 TYR HE1 . 11366 1 1055 . 2 2 58 58 TYR HE2 H 1 6.661 0.030 . 1 . . . . 105 TYR HE2 . 11366 1 1056 . 2 2 58 58 TYR C C 13 175.872 0.300 . 1 . . . . 105 TYR C . 11366 1 1057 . 2 2 58 58 TYR CA C 13 60.588 0.300 . 1 . . . . 105 TYR CA . 11366 1 1058 . 2 2 58 58 TYR CB C 13 39.313 0.300 . 1 . . . . 105 TYR CB . 11366 1 1059 . 2 2 58 58 TYR CD1 C 13 132.480 0.300 . 1 . . . . 105 TYR CD1 . 11366 1 1060 . 2 2 58 58 TYR CD2 C 13 132.480 0.300 . 1 . . . . 105 TYR CD2 . 11366 1 1061 . 2 2 58 58 TYR CE1 C 13 118.190 0.300 . 1 . . . . 105 TYR CE1 . 11366 1 1062 . 2 2 58 58 TYR CE2 C 13 118.190 0.300 . 1 . . . . 105 TYR CE2 . 11366 1 1063 . 2 2 58 58 TYR N N 15 128.397 0.300 . 1 . . . . 105 TYR N . 11366 1 1064 . 2 2 59 59 GLU H H 1 7.831 0.030 . 1 . . . . 106 GLU H . 11366 1 1065 . 2 2 59 59 GLU HA H 1 4.249 0.030 . 1 . . . . 106 GLU HA . 11366 1 1066 . 2 2 59 59 GLU HB2 H 1 2.179 0.030 . 2 . . . . 106 GLU HB2 . 11366 1 1067 . 2 2 59 59 GLU HB3 H 1 2.023 0.030 . 2 . . . . 106 GLU HB3 . 11366 1 1068 . 2 2 59 59 GLU HG2 H 1 2.254 0.030 . 2 . . . . 106 GLU HG2 . 11366 1 1069 . 2 2 59 59 GLU HG3 H 1 2.067 0.030 . 2 . . . . 106 GLU HG3 . 11366 1 1070 . 2 2 59 59 GLU C C 13 177.084 0.300 . 1 . . . . 106 GLU C . 11366 1 1071 . 2 2 59 59 GLU CA C 13 59.140 0.300 . 1 . . . . 106 GLU CA . 11366 1 1072 . 2 2 59 59 GLU CB C 13 30.284 0.300 . 1 . . . . 106 GLU CB . 11366 1 1073 . 2 2 59 59 GLU CG C 13 35.995 0.300 . 1 . . . . 106 GLU CG . 11366 1 1074 . 2 2 59 59 GLU N N 15 117.968 0.300 . 1 . . . . 106 GLU N . 11366 1 1075 . 2 2 60 60 ASP H H 1 9.380 0.030 . 1 . . . . 107 ASP H . 11366 1 1076 . 2 2 60 60 ASP HA H 1 5.231 0.030 . 1 . . . . 107 ASP HA . 11366 1 1077 . 2 2 60 60 ASP HB2 H 1 2.981 0.030 . 2 . . . . 107 ASP HB2 . 11366 1 1078 . 2 2 60 60 ASP HB3 H 1 2.534 0.030 . 2 . . . . 107 ASP HB3 . 11366 1 1079 . 2 2 60 60 ASP C C 13 176.816 0.300 . 1 . . . . 107 ASP C . 11366 1 1080 . 2 2 60 60 ASP CA C 13 52.663 0.300 . 1 . . . . 107 ASP CA . 11366 1 1081 . 2 2 60 60 ASP CB C 13 45.877 0.300 . 1 . . . . 107 ASP CB . 11366 1 1082 . 2 2 60 60 ASP N N 15 120.062 0.300 . 1 . . . . 107 ASP N . 11366 1 1083 . 2 2 61 61 ILE H H 1 8.996 0.030 . 1 . . . . 108 ILE H . 11366 1 1084 . 2 2 61 61 ILE HA H 1 3.685 0.030 . 1 . . . . 108 ILE HA . 11366 1 1085 . 2 2 61 61 ILE HB H 1 1.533 0.030 . 1 . . . . 108 ILE HB . 11366 1 1086 . 2 2 61 61 ILE HD11 H 1 0.604 0.030 . 1 . . . . 108 ILE HD1 . 11366 1 1087 . 2 2 61 61 ILE HD12 H 1 0.604 0.030 . 1 . . . . 108 ILE HD1 . 11366 1 1088 . 2 2 61 61 ILE HD13 H 1 0.604 0.030 . 1 . . . . 108 ILE HD1 . 11366 1 1089 . 2 2 61 61 ILE HG12 H 1 1.000 0.030 . 2 . . . . 108 ILE HG12 . 11366 1 1090 . 2 2 61 61 ILE HG13 H 1 0.812 0.030 . 2 . . . . 108 ILE HG13 . 11366 1 1091 . 2 2 61 61 ILE HG21 H 1 0.438 0.030 . 1 . . . . 108 ILE HG2 . 11366 1 1092 . 2 2 61 61 ILE HG22 H 1 0.438 0.030 . 1 . . . . 108 ILE HG2 . 11366 1 1093 . 2 2 61 61 ILE HG23 H 1 0.438 0.030 . 1 . . . . 108 ILE HG2 . 11366 1 1094 . 2 2 61 61 ILE C C 13 174.746 0.300 . 1 . . . . 108 ILE C . 11366 1 1095 . 2 2 61 61 ILE CA C 13 64.985 0.300 . 1 . . . . 108 ILE CA . 11366 1 1096 . 2 2 61 61 ILE CB C 13 38.788 0.300 . 1 . . . . 108 ILE CB . 11366 1 1097 . 2 2 61 61 ILE CD1 C 13 14.599 0.300 . 1 . . . . 108 ILE CD1 . 11366 1 1098 . 2 2 61 61 ILE CG1 C 13 29.260 0.300 . 1 . . . . 108 ILE CG1 . 11366 1 1099 . 2 2 61 61 ILE CG2 C 13 16.451 0.300 . 1 . . . . 108 ILE CG2 . 11366 1 1100 . 2 2 61 61 ILE N N 15 126.981 0.300 . 1 . . . . 108 ILE N . 11366 1 1101 . 2 2 62 62 PHE H H 1 8.455 0.030 . 1 . . . . 109 PHE H . 11366 1 1102 . 2 2 62 62 PHE HA H 1 4.081 0.030 . 1 . . . . 109 PHE HA . 11366 1 1103 . 2 2 62 62 PHE HB2 H 1 3.232 0.030 . 2 . . . . 109 PHE HB2 . 11366 1 1104 . 2 2 62 62 PHE HB3 H 1 3.108 0.030 . 2 . . . . 109 PHE HB3 . 11366 1 1105 . 2 2 62 62 PHE HD1 H 1 7.530 0.030 . 1 . . . . 109 PHE HD1 . 11366 1 1106 . 2 2 62 62 PHE HD2 H 1 7.530 0.030 . 1 . . . . 109 PHE HD2 . 11366 1 1107 . 2 2 62 62 PHE HE1 H 1 7.368 0.030 . 1 . . . . 109 PHE HE1 . 11366 1 1108 . 2 2 62 62 PHE HE2 H 1 7.368 0.030 . 1 . . . . 109 PHE HE2 . 11366 1 1109 . 2 2 62 62 PHE HZ H 1 7.324 0.030 . 1 . . . . 109 PHE HZ . 11366 1 1110 . 2 2 62 62 PHE C C 13 179.385 0.300 . 1 . . . . 109 PHE C . 11366 1 1111 . 2 2 62 62 PHE CA C 13 62.123 0.300 . 1 . . . . 109 PHE CA . 11366 1 1112 . 2 2 62 62 PHE CB C 13 37.502 0.300 . 1 . . . . 109 PHE CB . 11366 1 1113 . 2 2 62 62 PHE CD1 C 13 132.082 0.300 . 1 . . . . 109 PHE CD1 . 11366 1 1114 . 2 2 62 62 PHE CD2 C 13 132.082 0.300 . 1 . . . . 109 PHE CD2 . 11366 1 1115 . 2 2 62 62 PHE CE1 C 13 131.480 0.300 . 1 . . . . 109 PHE CE1 . 11366 1 1116 . 2 2 62 62 PHE CE2 C 13 131.480 0.300 . 1 . . . . 109 PHE CE2 . 11366 1 1117 . 2 2 62 62 PHE CZ C 13 128.140 0.300 . 1 . . . . 109 PHE CZ . 11366 1 1118 . 2 2 62 62 PHE N N 15 121.788 0.300 . 1 . . . . 109 PHE N . 11366 1 1119 . 2 2 63 63 ASP H H 1 7.690 0.030 . 1 . . . . 110 ASP H . 11366 1 1120 . 2 2 63 63 ASP HA H 1 4.540 0.030 . 1 . . . . 110 ASP HA . 11366 1 1121 . 2 2 63 63 ASP HB2 H 1 3.107 0.030 . 2 . . . . 110 ASP HB2 . 11366 1 1122 . 2 2 63 63 ASP HB3 H 1 2.697 0.030 . 2 . . . . 110 ASP HB3 . 11366 1 1123 . 2 2 63 63 ASP C C 13 177.181 0.300 . 1 . . . . 110 ASP C . 11366 1 1124 . 2 2 63 63 ASP CA C 13 57.075 0.300 . 1 . . . . 110 ASP CA . 11366 1 1125 . 2 2 63 63 ASP CB C 13 39.837 0.300 . 1 . . . . 110 ASP CB . 11366 1 1126 . 2 2 63 63 ASP N N 15 123.227 0.300 . 1 . . . . 110 ASP N . 11366 1 1127 . 2 2 64 64 ALA H H 1 7.270 0.030 . 1 . . . . 111 ALA H . 11366 1 1128 . 2 2 64 64 ALA HA H 1 3.302 0.030 . 1 . . . . 111 ALA HA . 11366 1 1129 . 2 2 64 64 ALA HB1 H 1 1.644 0.030 . 1 . . . . 111 ALA HB . 11366 1 1130 . 2 2 64 64 ALA HB2 H 1 1.644 0.030 . 1 . . . . 111 ALA HB . 11366 1 1131 . 2 2 64 64 ALA HB3 H 1 1.644 0.030 . 1 . . . . 111 ALA HB . 11366 1 1132 . 2 2 64 64 ALA C C 13 179.065 0.300 . 1 . . . . 111 ALA C . 11366 1 1133 . 2 2 64 64 ALA CA C 13 54.893 0.300 . 1 . . . . 111 ALA CA . 11366 1 1134 . 2 2 64 64 ALA CB C 13 19.893 0.300 . 1 . . . . 111 ALA CB . 11366 1 1135 . 2 2 64 64 ALA N N 15 121.457 0.300 . 1 . . . . 111 ALA N . 11366 1 1136 . 2 2 65 65 LYS H H 1 7.757 0.030 . 1 . . . . 112 LYS H . 11366 1 1137 . 2 2 65 65 LYS HA H 1 4.813 0.030 . 1 . . . . 112 LYS HA . 11366 1 1138 . 2 2 65 65 LYS HB2 H 1 1.925 0.030 . 2 . . . . 112 LYS HB2 . 11366 1 1139 . 2 2 65 65 LYS HB3 H 1 1.797 0.030 . 2 . . . . 112 LYS HB3 . 11366 1 1140 . 2 2 65 65 LYS HD2 H 1 1.677 0.030 . 1 . . . . 112 LYS HD2 . 11366 1 1141 . 2 2 65 65 LYS HD3 H 1 1.677 0.030 . 1 . . . . 112 LYS HD3 . 11366 1 1142 . 2 2 65 65 LYS HE2 H 1 3.073 0.030 . 2 . . . . 112 LYS HE2 . 11366 1 1143 . 2 2 65 65 LYS HE3 H 1 3.008 0.030 . 2 . . . . 112 LYS HE3 . 11366 1 1144 . 2 2 65 65 LYS HG2 H 1 1.536 0.030 . 2 . . . . 112 LYS HG2 . 11366 1 1145 . 2 2 65 65 LYS HG3 H 1 1.475 0.030 . 2 . . . . 112 LYS HG3 . 11366 1 1146 . 2 2 65 65 LYS C C 13 177.916 0.300 . 1 . . . . 112 LYS C . 11366 1 1147 . 2 2 65 65 LYS CA C 13 58.125 0.300 . 1 . . . . 112 LYS CA . 11366 1 1148 . 2 2 65 65 LYS CB C 13 32.390 0.300 . 1 . . . . 112 LYS CB . 11366 1 1149 . 2 2 65 65 LYS CD C 13 29.461 0.300 . 1 . . . . 112 LYS CD . 11366 1 1150 . 2 2 65 65 LYS CE C 13 42.559 0.300 . 1 . . . . 112 LYS CE . 11366 1 1151 . 2 2 65 65 LYS CG C 13 24.993 0.300 . 1 . . . . 112 LYS CG . 11366 1 1152 . 2 2 65 65 LYS N N 15 117.861 0.300 . 1 . . . . 112 LYS N . 11366 1 1153 . 2 2 66 66 ASN H H 1 7.641 0.030 . 1 . . . . 113 ASN H . 11366 1 1154 . 2 2 66 66 ASN HA H 1 4.559 0.030 . 1 . . . . 113 ASN HA . 11366 1 1155 . 2 2 66 66 ASN HB2 H 1 3.112 0.030 . 1 . . . . 113 ASN HB2 . 11366 1 1156 . 2 2 66 66 ASN HB3 H 1 3.112 0.030 . 1 . . . . 113 ASN HB3 . 11366 1 1157 . 2 2 66 66 ASN HD21 H 1 8.323 0.030 . 2 . . . . 113 ASN HD21 . 11366 1 1158 . 2 2 66 66 ASN HD22 H 1 6.952 0.030 . 2 . . . . 113 ASN HD22 . 11366 1 1159 . 2 2 66 66 ASN C C 13 178.404 0.300 . 1 . . . . 113 ASN C . 11366 1 1160 . 2 2 66 66 ASN CA C 13 56.067 0.300 . 1 . . . . 113 ASN CA . 11366 1 1161 . 2 2 66 66 ASN CB C 13 38.445 0.300 . 1 . . . . 113 ASN CB . 11366 1 1162 . 2 2 66 66 ASN N N 15 117.207 0.300 . 1 . . . . 113 ASN N . 11366 1 1163 . 2 2 66 66 ASN ND2 N 15 113.019 0.300 . 1 . . . . 113 ASN ND2 . 11366 1 1164 . 2 2 67 67 ALA H H 1 8.459 0.030 . 1 . . . . 114 ALA H . 11366 1 1165 . 2 2 67 67 ALA HA H 1 2.519 0.030 . 1 . . . . 114 ALA HA . 11366 1 1166 . 2 2 67 67 ALA HB1 H 1 1.187 0.030 . 1 . . . . 114 ALA HB . 11366 1 1167 . 2 2 67 67 ALA HB2 H 1 1.187 0.030 . 1 . . . . 114 ALA HB . 11366 1 1168 . 2 2 67 67 ALA HB3 H 1 1.187 0.030 . 1 . . . . 114 ALA HB . 11366 1 1169 . 2 2 67 67 ALA C C 13 178.369 0.300 . 1 . . . . 114 ALA C . 11366 1 1170 . 2 2 67 67 ALA CA C 13 55.015 0.300 . 1 . . . . 114 ALA CA . 11366 1 1171 . 2 2 67 67 ALA CB C 13 19.273 0.300 . 1 . . . . 114 ALA CB . 11366 1 1172 . 2 2 67 67 ALA N N 15 123.328 0.300 . 1 . . . . 114 ALA N . 11366 1 1173 . 2 2 68 68 CYS H H 1 8.768 0.030 . 1 . . . . 115 CYS H . 11366 1 1174 . 2 2 68 68 CYS HA H 1 3.556 0.030 . 1 . . . . 115 CYS HA . 11366 1 1175 . 2 2 68 68 CYS HB2 H 1 3.226 0.030 . 2 . . . . 115 CYS HB2 . 11366 1 1176 . 2 2 68 68 CYS HB3 H 1 2.644 0.030 . 2 . . . . 115 CYS HB3 . 11366 1 1177 . 2 2 68 68 CYS C C 13 177.354 0.300 . 1 . . . . 115 CYS C . 11366 1 1178 . 2 2 68 68 CYS CA C 13 62.168 0.300 . 1 . . . . 115 CYS CA . 11366 1 1179 . 2 2 68 68 CYS CB C 13 26.256 0.300 . 1 . . . . 115 CYS CB . 11366 1 1180 . 2 2 68 68 CYS N N 15 119.829 0.300 . 1 . . . . 115 CYS N . 11366 1 1181 . 2 2 69 69 ASP H H 1 8.583 0.030 . 1 . . . . 116 ASP H . 11366 1 1182 . 2 2 69 69 ASP HA H 1 4.313 0.030 . 1 . . . . 116 ASP HA . 11366 1 1183 . 2 2 69 69 ASP HB2 H 1 2.705 0.030 . 2 . . . . 116 ASP HB2 . 11366 1 1184 . 2 2 69 69 ASP HB3 H 1 2.377 0.030 . 2 . . . . 116 ASP HB3 . 11366 1 1185 . 2 2 69 69 ASP C C 13 178.233 0.300 . 1 . . . . 116 ASP C . 11366 1 1186 . 2 2 69 69 ASP CA C 13 56.688 0.300 . 1 . . . . 116 ASP CA . 11366 1 1187 . 2 2 69 69 ASP CB C 13 40.173 0.300 . 1 . . . . 116 ASP CB . 11366 1 1188 . 2 2 69 69 ASP N N 15 116.344 0.300 . 1 . . . . 116 ASP N . 11366 1 1189 . 2 2 70 70 HIS H H 1 7.530 0.030 . 1 . . . . 117 HIS H . 11366 1 1190 . 2 2 70 70 HIS HA H 1 4.473 0.030 . 1 . . . . 117 HIS HA . 11366 1 1191 . 2 2 70 70 HIS HB2 H 1 3.266 0.030 . 2 . . . . 117 HIS HB2 . 11366 1 1192 . 2 2 70 70 HIS HB3 H 1 2.691 0.030 . 2 . . . . 117 HIS HB3 . 11366 1 1193 . 2 2 70 70 HIS HD2 H 1 7.369 0.030 . 1 . . . . 117 HIS HD2 . 11366 1 1194 . 2 2 70 70 HIS HE1 H 1 8.355 0.030 . 1 . . . . 117 HIS HE1 . 11366 1 1195 . 2 2 70 70 HIS C C 13 176.583 0.300 . 1 . . . . 117 HIS C . 11366 1 1196 . 2 2 70 70 HIS CA C 13 59.363 0.300 . 1 . . . . 117 HIS CA . 11366 1 1197 . 2 2 70 70 HIS CB C 13 30.229 0.300 . 1 . . . . 117 HIS CB . 11366 1 1198 . 2 2 70 70 HIS CD2 C 13 121.870 0.300 . 1 . . . . 117 HIS CD2 . 11366 1 1199 . 2 2 70 70 HIS CE1 C 13 137.476 0.300 . 1 . . . . 117 HIS CE1 . 11366 1 1200 . 2 2 70 70 HIS N N 15 114.043 0.300 . 1 . . . . 117 HIS N . 11366 1 1201 . 2 2 71 71 LEU H H 1 8.548 0.030 . 1 . . . . 118 LEU H . 11366 1 1202 . 2 2 71 71 LEU HA H 1 4.360 0.030 . 1 . . . . 118 LEU HA . 11366 1 1203 . 2 2 71 71 LEU HB2 H 1 1.656 0.030 . 2 . . . . 118 LEU HB2 . 11366 1 1204 . 2 2 71 71 LEU HB3 H 1 1.220 0.030 . 2 . . . . 118 LEU HB3 . 11366 1 1205 . 2 2 71 71 LEU HD11 H 1 0.274 0.030 . 1 . . . . 118 LEU HD1 . 11366 1 1206 . 2 2 71 71 LEU HD12 H 1 0.274 0.030 . 1 . . . . 118 LEU HD1 . 11366 1 1207 . 2 2 71 71 LEU HD13 H 1 0.274 0.030 . 1 . . . . 118 LEU HD1 . 11366 1 1208 . 2 2 71 71 LEU HD21 H 1 0.430 0.030 . 1 . . . . 118 LEU HD2 . 11366 1 1209 . 2 2 71 71 LEU HD22 H 1 0.430 0.030 . 1 . . . . 118 LEU HD2 . 11366 1 1210 . 2 2 71 71 LEU HD23 H 1 0.430 0.030 . 1 . . . . 118 LEU HD2 . 11366 1 1211 . 2 2 71 71 LEU HG H 1 1.301 0.030 . 1 . . . . 118 LEU HG . 11366 1 1212 . 2 2 71 71 LEU C C 13 177.352 0.300 . 1 . . . . 118 LEU C . 11366 1 1213 . 2 2 71 71 LEU CA C 13 55.640 0.300 . 1 . . . . 118 LEU CA . 11366 1 1214 . 2 2 71 71 LEU CB C 13 43.188 0.300 . 1 . . . . 118 LEU CB . 11366 1 1215 . 2 2 71 71 LEU CD1 C 13 23.029 0.300 . 2 . . . . 118 LEU CD1 . 11366 1 1216 . 2 2 71 71 LEU CD2 C 13 27.678 0.300 . 2 . . . . 118 LEU CD2 . 11366 1 1217 . 2 2 71 71 LEU CG C 13 26.519 0.300 . 1 . . . . 118 LEU CG . 11366 1 1218 . 2 2 71 71 LEU N N 15 118.310 0.300 . 1 . . . . 118 LEU N . 11366 1 1219 . 2 2 72 72 SER H H 1 7.346 0.030 . 1 . . . . 119 SER H . 11366 1 1220 . 2 2 72 72 SER HA H 1 4.122 0.030 . 1 . . . . 119 SER HA . 11366 1 1221 . 2 2 72 72 SER HB2 H 1 4.038 0.030 . 2 . . . . 119 SER HB2 . 11366 1 1222 . 2 2 72 72 SER HB3 H 1 3.980 0.030 . 2 . . . . 119 SER HB3 . 11366 1 1223 . 2 2 72 72 SER C C 13 176.291 0.300 . 1 . . . . 119 SER C . 11366 1 1224 . 2 2 72 72 SER CA C 13 60.681 0.300 . 1 . . . . 119 SER CA . 11366 1 1225 . 2 2 72 72 SER CB C 13 62.875 0.300 . 1 . . . . 119 SER CB . 11366 1 1226 . 2 2 72 72 SER N N 15 113.848 0.300 . 1 . . . . 119 SER N . 11366 1 1227 . 2 2 73 73 GLY H H 1 8.779 0.030 . 1 . . . . 120 GLY H . 11366 1 1228 . 2 2 73 73 GLY HA2 H 1 4.223 0.030 . 2 . . . . 120 GLY HA2 . 11366 1 1229 . 2 2 73 73 GLY HA3 H 1 3.814 0.030 . 2 . . . . 120 GLY HA3 . 11366 1 1230 . 2 2 73 73 GLY C C 13 173.497 0.300 . 1 . . . . 120 GLY C . 11366 1 1231 . 2 2 73 73 GLY CA C 13 46.127 0.300 . 1 . . . . 120 GLY CA . 11366 1 1232 . 2 2 73 73 GLY N N 15 117.303 0.300 . 1 . . . . 120 GLY N . 11366 1 1233 . 2 2 74 74 PHE H H 1 8.071 0.030 . 1 . . . . 121 PHE H . 11366 1 1234 . 2 2 74 74 PHE HA H 1 4.415 0.030 . 1 . . . . 121 PHE HA . 11366 1 1235 . 2 2 74 74 PHE HB2 H 1 3.293 0.030 . 2 . . . . 121 PHE HB2 . 11366 1 1236 . 2 2 74 74 PHE HB3 H 1 2.920 0.030 . 2 . . . . 121 PHE HB3 . 11366 1 1237 . 2 2 74 74 PHE HD1 H 1 7.122 0.030 . 1 . . . . 121 PHE HD1 . 11366 1 1238 . 2 2 74 74 PHE HD2 H 1 7.122 0.030 . 1 . . . . 121 PHE HD2 . 11366 1 1239 . 2 2 74 74 PHE HE1 H 1 7.284 0.030 . 1 . . . . 121 PHE HE1 . 11366 1 1240 . 2 2 74 74 PHE HE2 H 1 7.284 0.030 . 1 . . . . 121 PHE HE2 . 11366 1 1241 . 2 2 74 74 PHE HZ H 1 7.309 0.030 . 1 . . . . 121 PHE HZ . 11366 1 1242 . 2 2 74 74 PHE C C 13 174.308 0.300 . 1 . . . . 121 PHE C . 11366 1 1243 . 2 2 74 74 PHE CA C 13 58.743 0.300 . 1 . . . . 121 PHE CA . 11366 1 1244 . 2 2 74 74 PHE CB C 13 41.248 0.300 . 1 . . . . 121 PHE CB . 11366 1 1245 . 2 2 74 74 PHE CD1 C 13 132.140 0.300 . 1 . . . . 121 PHE CD1 . 11366 1 1246 . 2 2 74 74 PHE CD2 C 13 132.140 0.300 . 1 . . . . 121 PHE CD2 . 11366 1 1247 . 2 2 74 74 PHE CE1 C 13 131.480 0.300 . 1 . . . . 121 PHE CE1 . 11366 1 1248 . 2 2 74 74 PHE CE2 C 13 131.480 0.300 . 1 . . . . 121 PHE CE2 . 11366 1 1249 . 2 2 74 74 PHE CZ C 13 129.890 0.300 . 1 . . . . 121 PHE CZ . 11366 1 1250 . 2 2 74 74 PHE N N 15 122.744 0.300 . 1 . . . . 121 PHE N . 11366 1 1251 . 2 2 75 75 ASN H H 1 7.697 0.030 . 1 . . . . 122 ASN H . 11366 1 1252 . 2 2 75 75 ASN HA H 1 4.771 0.030 . 1 . . . . 122 ASN HA . 11366 1 1253 . 2 2 75 75 ASN HB2 H 1 2.493 0.030 . 2 . . . . 122 ASN HB2 . 11366 1 1254 . 2 2 75 75 ASN HB3 H 1 2.260 0.030 . 2 . . . . 122 ASN HB3 . 11366 1 1255 . 2 2 75 75 ASN HD21 H 1 6.368 0.030 . 2 . . . . 122 ASN HD21 . 11366 1 1256 . 2 2 75 75 ASN HD22 H 1 6.228 0.030 . 2 . . . . 122 ASN HD22 . 11366 1 1257 . 2 2 75 75 ASN C C 13 173.968 0.300 . 1 . . . . 122 ASN C . 11366 1 1258 . 2 2 75 75 ASN CA C 13 52.408 0.300 . 1 . . . . 122 ASN CA . 11366 1 1259 . 2 2 75 75 ASN CB C 13 39.511 0.300 . 1 . . . . 122 ASN CB . 11366 1 1260 . 2 2 75 75 ASN N N 15 125.082 0.300 . 1 . . . . 122 ASN N . 11366 1 1261 . 2 2 75 75 ASN ND2 N 15 108.751 0.300 . 1 . . . . 122 ASN ND2 . 11366 1 1262 . 2 2 76 76 VAL H H 1 8.559 0.030 . 1 . . . . 123 VAL H . 11366 1 1263 . 2 2 76 76 VAL HA H 1 4.120 0.030 . 1 . . . . 123 VAL HA . 11366 1 1264 . 2 2 76 76 VAL HB H 1 1.933 0.030 . 1 . . . . 123 VAL HB . 11366 1 1265 . 2 2 76 76 VAL HG11 H 1 1.020 0.030 . 1 . . . . 123 VAL HG1 . 11366 1 1266 . 2 2 76 76 VAL HG12 H 1 1.020 0.030 . 1 . . . . 123 VAL HG1 . 11366 1 1267 . 2 2 76 76 VAL HG13 H 1 1.020 0.030 . 1 . . . . 123 VAL HG1 . 11366 1 1268 . 2 2 76 76 VAL HG21 H 1 0.917 0.030 . 1 . . . . 123 VAL HG2 . 11366 1 1269 . 2 2 76 76 VAL HG22 H 1 0.917 0.030 . 1 . . . . 123 VAL HG2 . 11366 1 1270 . 2 2 76 76 VAL HG23 H 1 0.917 0.030 . 1 . . . . 123 VAL HG2 . 11366 1 1271 . 2 2 76 76 VAL C C 13 174.849 0.300 . 1 . . . . 123 VAL C . 11366 1 1272 . 2 2 76 76 VAL CA C 13 60.929 0.300 . 1 . . . . 123 VAL CA . 11366 1 1273 . 2 2 76 76 VAL CB C 13 33.874 0.300 . 1 . . . . 123 VAL CB . 11366 1 1274 . 2 2 76 76 VAL CG1 C 13 21.851 0.300 . 2 . . . . 123 VAL CG1 . 11366 1 1275 . 2 2 76 76 VAL CG2 C 13 20.779 0.300 . 2 . . . . 123 VAL CG2 . 11366 1 1276 . 2 2 76 76 VAL N N 15 125.390 0.300 . 1 . . . . 123 VAL N . 11366 1 1277 . 2 2 77 77 CYS H H 1 9.269 0.030 . 1 . . . . 124 CYS H . 11366 1 1278 . 2 2 77 77 CYS HA H 1 3.841 0.030 . 1 . . . . 124 CYS HA . 11366 1 1279 . 2 2 77 77 CYS HB2 H 1 3.109 0.030 . 2 . . . . 124 CYS HB2 . 11366 1 1280 . 2 2 77 77 CYS HB3 H 1 2.786 0.030 . 2 . . . . 124 CYS HB3 . 11366 1 1281 . 2 2 77 77 CYS C C 13 173.962 0.300 . 1 . . . . 124 CYS C . 11366 1 1282 . 2 2 77 77 CYS CA C 13 60.335 0.300 . 1 . . . . 124 CYS CA . 11366 1 1283 . 2 2 77 77 CYS CB C 13 25.617 0.300 . 1 . . . . 124 CYS CB . 11366 1 1284 . 2 2 77 77 CYS N N 15 123.755 0.300 . 1 . . . . 124 CYS N . 11366 1 1285 . 2 2 78 78 ASN H H 1 8.271 0.030 . 1 . . . . 125 ASN H . 11366 1 1286 . 2 2 78 78 ASN HA H 1 4.202 0.030 . 1 . . . . 125 ASN HA . 11366 1 1287 . 2 2 78 78 ASN HB2 H 1 2.984 0.030 . 2 . . . . 125 ASN HB2 . 11366 1 1288 . 2 2 78 78 ASN HB3 H 1 2.905 0.030 . 2 . . . . 125 ASN HB3 . 11366 1 1289 . 2 2 78 78 ASN HD21 H 1 7.469 0.030 . 2 . . . . 125 ASN HD21 . 11366 1 1290 . 2 2 78 78 ASN HD22 H 1 6.856 0.030 . 2 . . . . 125 ASN HD22 . 11366 1 1291 . 2 2 78 78 ASN C C 13 173.784 0.300 . 1 . . . . 125 ASN C . 11366 1 1292 . 2 2 78 78 ASN CA C 13 54.427 0.300 . 1 . . . . 125 ASN CA . 11366 1 1293 . 2 2 78 78 ASN CB C 13 37.490 0.300 . 1 . . . . 125 ASN CB . 11366 1 1294 . 2 2 78 78 ASN N N 15 110.951 0.300 . 1 . . . . 125 ASN N . 11366 1 1295 . 2 2 78 78 ASN ND2 N 15 113.000 0.300 . 1 . . . . 125 ASN ND2 . 11366 1 1296 . 2 2 79 79 ARG H H 1 7.601 0.030 . 1 . . . . 126 ARG H . 11366 1 1297 . 2 2 79 79 ARG HA H 1 4.371 0.030 . 1 . . . . 126 ARG HA . 11366 1 1298 . 2 2 79 79 ARG HB2 H 1 1.881 0.030 . 2 . . . . 126 ARG HB2 . 11366 1 1299 . 2 2 79 79 ARG HB3 H 1 1.806 0.030 . 2 . . . . 126 ARG HB3 . 11366 1 1300 . 2 2 79 79 ARG HD2 H 1 2.988 0.030 . 1 . . . . 126 ARG HD2 . 11366 1 1301 . 2 2 79 79 ARG HD3 H 1 2.988 0.030 . 1 . . . . 126 ARG HD3 . 11366 1 1302 . 2 2 79 79 ARG HG2 H 1 1.503 0.030 . 1 . . . . 126 ARG HG2 . 11366 1 1303 . 2 2 79 79 ARG HG3 H 1 1.503 0.030 . 1 . . . . 126 ARG HG3 . 11366 1 1304 . 2 2 79 79 ARG C C 13 174.007 0.300 . 1 . . . . 126 ARG C . 11366 1 1305 . 2 2 79 79 ARG CA C 13 54.488 0.300 . 1 . . . . 126 ARG CA . 11366 1 1306 . 2 2 79 79 ARG CB C 13 32.752 0.300 . 1 . . . . 126 ARG CB . 11366 1 1307 . 2 2 79 79 ARG CD C 13 43.278 0.300 . 1 . . . . 126 ARG CD . 11366 1 1308 . 2 2 79 79 ARG CG C 13 26.900 0.300 . 1 . . . . 126 ARG CG . 11366 1 1309 . 2 2 79 79 ARG N N 15 118.543 0.300 . 1 . . . . 126 ARG N . 11366 1 1310 . 2 2 80 80 TYR H H 1 8.145 0.030 . 1 . . . . 127 TYR H . 11366 1 1311 . 2 2 80 80 TYR HA H 1 4.859 0.030 . 1 . . . . 127 TYR HA . 11366 1 1312 . 2 2 80 80 TYR HB2 H 1 2.737 0.030 . 1 . . . . 127 TYR HB2 . 11366 1 1313 . 2 2 80 80 TYR HB3 H 1 2.737 0.030 . 1 . . . . 127 TYR HB3 . 11366 1 1314 . 2 2 80 80 TYR HD1 H 1 7.114 0.030 . 1 . . . . 127 TYR HD1 . 11366 1 1315 . 2 2 80 80 TYR HD2 H 1 7.114 0.030 . 1 . . . . 127 TYR HD2 . 11366 1 1316 . 2 2 80 80 TYR HE1 H 1 6.765 0.030 . 1 . . . . 127 TYR HE1 . 11366 1 1317 . 2 2 80 80 TYR HE2 H 1 6.765 0.030 . 1 . . . . 127 TYR HE2 . 11366 1 1318 . 2 2 80 80 TYR C C 13 176.611 0.300 . 1 . . . . 127 TYR C . 11366 1 1319 . 2 2 80 80 TYR CA C 13 56.779 0.300 . 1 . . . . 127 TYR CA . 11366 1 1320 . 2 2 80 80 TYR CB C 13 38.571 0.300 . 1 . . . . 127 TYR CB . 11366 1 1321 . 2 2 80 80 TYR CD1 C 13 133.389 0.300 . 1 . . . . 127 TYR CD1 . 11366 1 1322 . 2 2 80 80 TYR CD2 C 13 133.389 0.300 . 1 . . . . 127 TYR CD2 . 11366 1 1323 . 2 2 80 80 TYR CE1 C 13 117.890 0.300 . 1 . . . . 127 TYR CE1 . 11366 1 1324 . 2 2 80 80 TYR CE2 C 13 117.890 0.300 . 1 . . . . 127 TYR CE2 . 11366 1 1325 . 2 2 80 80 TYR N N 15 119.059 0.300 . 1 . . . . 127 TYR N . 11366 1 1326 . 2 2 81 81 LEU H H 1 9.044 0.030 . 1 . . . . 128 LEU H . 11366 1 1327 . 2 2 81 81 LEU HA H 1 4.340 0.030 . 1 . . . . 128 LEU HA . 11366 1 1328 . 2 2 81 81 LEU HB2 H 1 2.229 0.030 . 2 . . . . 128 LEU HB2 . 11366 1 1329 . 2 2 81 81 LEU HB3 H 1 1.329 0.030 . 2 . . . . 128 LEU HB3 . 11366 1 1330 . 2 2 81 81 LEU HD11 H 1 0.916 0.030 . 1 . . . . 128 LEU HD1 . 11366 1 1331 . 2 2 81 81 LEU HD12 H 1 0.916 0.030 . 1 . . . . 128 LEU HD1 . 11366 1 1332 . 2 2 81 81 LEU HD13 H 1 0.916 0.030 . 1 . . . . 128 LEU HD1 . 11366 1 1333 . 2 2 81 81 LEU HD21 H 1 0.757 0.030 . 1 . . . . 128 LEU HD2 . 11366 1 1334 . 2 2 81 81 LEU HD22 H 1 0.757 0.030 . 1 . . . . 128 LEU HD2 . 11366 1 1335 . 2 2 81 81 LEU HD23 H 1 0.757 0.030 . 1 . . . . 128 LEU HD2 . 11366 1 1336 . 2 2 81 81 LEU HG H 1 2.112 0.030 . 1 . . . . 128 LEU HG . 11366 1 1337 . 2 2 81 81 LEU C C 13 177.801 0.300 . 1 . . . . 128 LEU C . 11366 1 1338 . 2 2 81 81 LEU CA C 13 56.208 0.300 . 1 . . . . 128 LEU CA . 11366 1 1339 . 2 2 81 81 LEU CB C 13 42.581 0.300 . 1 . . . . 128 LEU CB . 11366 1 1340 . 2 2 81 81 LEU CD1 C 13 25.554 0.300 . 2 . . . . 128 LEU CD1 . 11366 1 1341 . 2 2 81 81 LEU CD2 C 13 22.617 0.300 . 2 . . . . 128 LEU CD2 . 11366 1 1342 . 2 2 81 81 LEU CG C 13 26.406 0.300 . 1 . . . . 128 LEU CG . 11366 1 1343 . 2 2 81 81 LEU N N 15 123.334 0.300 . 1 . . . . 128 LEU N . 11366 1 1344 . 2 2 82 82 VAL H H 1 7.922 0.030 . 1 . . . . 129 VAL H . 11366 1 1345 . 2 2 82 82 VAL HA H 1 4.329 0.030 . 1 . . . . 129 VAL HA . 11366 1 1346 . 2 2 82 82 VAL HB H 1 1.721 0.030 . 1 . . . . 129 VAL HB . 11366 1 1347 . 2 2 82 82 VAL HG11 H 1 0.893 0.030 . 1 . . . . 129 VAL HG1 . 11366 1 1348 . 2 2 82 82 VAL HG12 H 1 0.893 0.030 . 1 . . . . 129 VAL HG1 . 11366 1 1349 . 2 2 82 82 VAL HG13 H 1 0.893 0.030 . 1 . . . . 129 VAL HG1 . 11366 1 1350 . 2 2 82 82 VAL HG21 H 1 0.997 0.030 . 1 . . . . 129 VAL HG2 . 11366 1 1351 . 2 2 82 82 VAL HG22 H 1 0.997 0.030 . 1 . . . . 129 VAL HG2 . 11366 1 1352 . 2 2 82 82 VAL HG23 H 1 0.997 0.030 . 1 . . . . 129 VAL HG2 . 11366 1 1353 . 2 2 82 82 VAL CA C 13 62.096 0.300 . 1 . . . . 129 VAL CA . 11366 1 1354 . 2 2 82 82 VAL CB C 13 33.636 0.300 . 1 . . . . 129 VAL CB . 11366 1 1355 . 2 2 82 82 VAL CG1 C 13 20.400 0.300 . 2 . . . . 129 VAL CG1 . 11366 1 1356 . 2 2 82 82 VAL CG2 C 13 20.982 0.300 . 2 . . . . 129 VAL CG2 . 11366 1 1357 . 2 2 82 82 VAL N N 15 124.002 0.300 . 1 . . . . 129 VAL N . 11366 1 1358 . 2 2 83 83 VAL H H 1 8.451 0.030 . 1 . . . . 130 VAL H . 11366 1 1359 . 2 2 83 83 VAL HA H 1 4.761 0.030 . 1 . . . . 130 VAL HA . 11366 1 1360 . 2 2 83 83 VAL HB H 1 1.928 0.030 . 1 . . . . 130 VAL HB . 11366 1 1361 . 2 2 83 83 VAL HG11 H 1 0.895 0.030 . 1 . . . . 130 VAL HG1 . 11366 1 1362 . 2 2 83 83 VAL HG12 H 1 0.895 0.030 . 1 . . . . 130 VAL HG1 . 11366 1 1363 . 2 2 83 83 VAL HG13 H 1 0.895 0.030 . 1 . . . . 130 VAL HG1 . 11366 1 1364 . 2 2 83 83 VAL HG21 H 1 0.871 0.030 . 1 . . . . 130 VAL HG2 . 11366 1 1365 . 2 2 83 83 VAL HG22 H 1 0.871 0.030 . 1 . . . . 130 VAL HG2 . 11366 1 1366 . 2 2 83 83 VAL HG23 H 1 0.871 0.030 . 1 . . . . 130 VAL HG2 . 11366 1 1367 . 2 2 83 83 VAL C C 13 173.322 0.300 . 1 . . . . 130 VAL C . 11366 1 1368 . 2 2 83 83 VAL CA C 13 61.492 0.300 . 1 . . . . 130 VAL CA . 11366 1 1369 . 2 2 83 83 VAL CB C 13 34.231 0.300 . 1 . . . . 130 VAL CB . 11366 1 1370 . 2 2 83 83 VAL CG1 C 13 23.890 0.300 . 2 . . . . 130 VAL CG1 . 11366 1 1371 . 2 2 83 83 VAL CG2 C 13 21.585 0.300 . 2 . . . . 130 VAL CG2 . 11366 1 1372 . 2 2 83 83 VAL N N 15 127.023 0.300 . 1 . . . . 130 VAL N . 11366 1 1373 . 2 2 84 84 LEU H H 1 9.061 0.030 . 1 . . . . 131 LEU H . 11366 1 1374 . 2 2 84 84 LEU HA H 1 4.653 0.030 . 1 . . . . 131 LEU HA . 11366 1 1375 . 2 2 84 84 LEU HB2 H 1 1.802 0.030 . 1 . . . . 131 LEU HB2 . 11366 1 1376 . 2 2 84 84 LEU HB3 H 1 1.802 0.030 . 1 . . . . 131 LEU HB3 . 11366 1 1377 . 2 2 84 84 LEU HD11 H 1 0.975 0.030 . 1 . . . . 131 LEU HD1 . 11366 1 1378 . 2 2 84 84 LEU HD12 H 1 0.975 0.030 . 1 . . . . 131 LEU HD1 . 11366 1 1379 . 2 2 84 84 LEU HD13 H 1 0.975 0.030 . 1 . . . . 131 LEU HD1 . 11366 1 1380 . 2 2 84 84 LEU HD21 H 1 0.970 0.030 . 1 . . . . 131 LEU HD2 . 11366 1 1381 . 2 2 84 84 LEU HD22 H 1 0.970 0.030 . 1 . . . . 131 LEU HD2 . 11366 1 1382 . 2 2 84 84 LEU HD23 H 1 0.970 0.030 . 1 . . . . 131 LEU HD2 . 11366 1 1383 . 2 2 84 84 LEU HG H 1 1.636 0.030 . 1 . . . . 131 LEU HG . 11366 1 1384 . 2 2 84 84 LEU C C 13 176.205 0.300 . 1 . . . . 131 LEU C . 11366 1 1385 . 2 2 84 84 LEU CA C 13 53.390 0.300 . 1 . . . . 131 LEU CA . 11366 1 1386 . 2 2 84 84 LEU CB C 13 45.993 0.300 . 1 . . . . 131 LEU CB . 11366 1 1387 . 2 2 84 84 LEU CD1 C 13 24.224 0.300 . 2 . . . . 131 LEU CD1 . 11366 1 1388 . 2 2 84 84 LEU CD2 C 13 25.889 0.300 . 2 . . . . 131 LEU CD2 . 11366 1 1389 . 2 2 84 84 LEU CG C 13 27.140 0.300 . 1 . . . . 131 LEU CG . 11366 1 1390 . 2 2 84 84 LEU N N 15 126.726 0.300 . 1 . . . . 131 LEU N . 11366 1 1391 . 2 2 85 85 TYR H H 1 8.176 0.030 . 1 . . . . 132 TYR H . 11366 1 1392 . 2 2 85 85 TYR HA H 1 4.951 0.030 . 1 . . . . 132 TYR HA . 11366 1 1393 . 2 2 85 85 TYR HB2 H 1 3.186 0.030 . 2 . . . . 132 TYR HB2 . 11366 1 1394 . 2 2 85 85 TYR HB3 H 1 2.764 0.030 . 2 . . . . 132 TYR HB3 . 11366 1 1395 . 2 2 85 85 TYR HD1 H 1 7.267 0.030 . 1 . . . . 132 TYR HD1 . 11366 1 1396 . 2 2 85 85 TYR HD2 H 1 7.267 0.030 . 1 . . . . 132 TYR HD2 . 11366 1 1397 . 2 2 85 85 TYR HE1 H 1 6.711 0.030 . 1 . . . . 132 TYR HE1 . 11366 1 1398 . 2 2 85 85 TYR HE2 H 1 6.711 0.030 . 1 . . . . 132 TYR HE2 . 11366 1 1399 . 2 2 85 85 TYR C C 13 176.756 0.300 . 1 . . . . 132 TYR C . 11366 1 1400 . 2 2 85 85 TYR CA C 13 59.230 0.300 . 1 . . . . 132 TYR CA . 11366 1 1401 . 2 2 85 85 TYR CB C 13 39.715 0.300 . 1 . . . . 132 TYR CB . 11366 1 1402 . 2 2 85 85 TYR CD1 C 13 133.558 0.300 . 1 . . . . 132 TYR CD1 . 11366 1 1403 . 2 2 85 85 TYR CD2 C 13 133.558 0.300 . 1 . . . . 132 TYR CD2 . 11366 1 1404 . 2 2 85 85 TYR CE1 C 13 118.890 0.300 . 1 . . . . 132 TYR CE1 . 11366 1 1405 . 2 2 85 85 TYR CE2 C 13 118.890 0.300 . 1 . . . . 132 TYR CE2 . 11366 1 1406 . 2 2 85 85 TYR N N 15 118.891 0.300 . 1 . . . . 132 TYR N . 11366 1 1407 . 2 2 86 86 TYR H H 1 8.924 0.030 . 1 . . . . 133 TYR H . 11366 1 1408 . 2 2 86 86 TYR HA H 1 4.576 0.030 . 1 . . . . 133 TYR HA . 11366 1 1409 . 2 2 86 86 TYR HB2 H 1 3.021 0.030 . 2 . . . . 133 TYR HB2 . 11366 1 1410 . 2 2 86 86 TYR HB3 H 1 2.866 0.030 . 2 . . . . 133 TYR HB3 . 11366 1 1411 . 2 2 86 86 TYR HD1 H 1 6.990 0.030 . 1 . . . . 133 TYR HD1 . 11366 1 1412 . 2 2 86 86 TYR HD2 H 1 6.990 0.030 . 1 . . . . 133 TYR HD2 . 11366 1 1413 . 2 2 86 86 TYR HE1 H 1 6.526 0.030 . 1 . . . . 133 TYR HE1 . 11366 1 1414 . 2 2 86 86 TYR HE2 H 1 6.526 0.030 . 1 . . . . 133 TYR HE2 . 11366 1 1415 . 2 2 86 86 TYR C C 13 173.377 0.300 . 1 . . . . 133 TYR C . 11366 1 1416 . 2 2 86 86 TYR CA C 13 58.092 0.300 . 1 . . . . 133 TYR CA . 11366 1 1417 . 2 2 86 86 TYR CB C 13 39.746 0.300 . 1 . . . . 133 TYR CB . 11366 1 1418 . 2 2 86 86 TYR CD1 C 13 132.673 0.300 . 1 . . . . 133 TYR CD1 . 11366 1 1419 . 2 2 86 86 TYR CD2 C 13 132.673 0.300 . 1 . . . . 133 TYR CD2 . 11366 1 1420 . 2 2 86 86 TYR CE1 C 13 118.311 0.300 . 1 . . . . 133 TYR CE1 . 11366 1 1421 . 2 2 86 86 TYR CE2 C 13 118.311 0.300 . 1 . . . . 133 TYR CE2 . 11366 1 1422 . 2 2 86 86 TYR N N 15 124.746 0.300 . 1 . . . . 133 TYR N . 11366 1 1423 . 2 2 87 87 ASN H H 1 7.201 0.030 . 1 . . . . 134 ASN H . 11366 1 1424 . 2 2 87 87 ASN HA H 1 4.209 0.030 . 1 . . . . 134 ASN HA . 11366 1 1425 . 2 2 87 87 ASN HB2 H 1 2.582 0.030 . 2 . . . . 134 ASN HB2 . 11366 1 1426 . 2 2 87 87 ASN HB3 H 1 2.502 0.030 . 2 . . . . 134 ASN HB3 . 11366 1 1427 . 2 2 87 87 ASN HD21 H 1 7.394 0.030 . 2 . . . . 134 ASN HD21 . 11366 1 1428 . 2 2 87 87 ASN HD22 H 1 7.118 0.030 . 2 . . . . 134 ASN HD22 . 11366 1 1429 . 2 2 87 87 ASN CA C 13 54.823 0.300 . 1 . . . . 134 ASN CA . 11366 1 1430 . 2 2 87 87 ASN CB C 13 41.992 0.300 . 1 . . . . 134 ASN CB . 11366 1 1431 . 2 2 87 87 ASN N N 15 129.551 0.300 . 1 . . . . 134 ASN N . 11366 1 1432 . 2 2 87 87 ASN ND2 N 15 113.447 0.300 . 1 . . . . 134 ASN ND2 . 11366 1 stop_ save_