data_16788 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16788 _Entry.Title ; Solution structure of NusE:NusG-CTD complex ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-03-25 _Entry.Accession_date 2010-03-25 _Entry.Last_release_date 2011-05-02 _Entry.Original_release_date 2011-05-02 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Bjoern Burmann . M. . 16788 2 Kristian Schweimer . . . 16788 3 Paul Roesch . . . 16788 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'NusE:NusG complex' . 16788 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16788 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 410 16788 '15N chemical shifts' 120 16788 '1H chemical shifts' 928 16788 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 . . 2011-05-02 2010-03-25 original author . 16788 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2KVQ 'BMRB Entry Tracking System' 16788 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16788 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 20413501 _Citation.Full_citation . _Citation.Title 'A NusE:NusG Complex Links Transcription and Translation' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Science _Citation.Journal_name_full . _Citation.Journal_volume 328 _Citation.Journal_issue 5977 _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 501 _Citation.Page_last 504 _Citation.Year 2010 _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 Bjoern Burmann . M. . 16788 1 2 Kristian Schweimer . . . 16788 1 3 Xiao Luo . . . 16788 1 4 Markus Wahl . C. . 16788 1 5 Barbara Stitt . L. . 16788 1 6 Max Gottesman . E. . 16788 1 7 Paul Roesch . . . 16788 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16788 _Assembly.ID 1 _Assembly.Name NusG:NusE _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 NusE 1 $NusE A . yes native no no . . . 16788 1 2 NusG 2 $NusG-CTD B . yes native no no . . . 16788 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_NusE _Entity.Sf_category entity _Entity.Sf_framecode NusE _Entity.Entry_ID 16788 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name NusE _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID E _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GPLGSMQNQRIRIRLKAFDH RLIDQATAEIVETAKRTGAQ VRGPIPLPTRSRTHLRLVDI VEPTEKTVDALMRLDLAAGV DVQISLG ; _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 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 8937.450 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2KVQ . "Solution Structure Of Nuse:nusg-Ctd Complex" . . . . . 100.00 87 100.00 100.00 3.66e-53 . . . . 16788 1 2 no PDB 3D3B . "Structural And Functional Analysis Of The E. Coli Nusb-s10 Transcription Antitermination Complex." . . . . . 100.00 87 100.00 100.00 3.66e-53 . . . . 16788 1 3 no PDB 3D3C . "Structural And Functional Analysis Of The E. Coli Nusb-S10 Transcription Antitermination Complex" . . . . . 100.00 87 98.85 98.85 3.45e-52 . . . . 16788 1 4 no PDB 3IMQ . "Crystal Structure Of The Nusb101-S10(Delta Loop) Complex" . . . . . 100.00 87 100.00 100.00 3.66e-53 . . . . 16788 1 5 no EMBL CDK48609 . "SSU ribosomal protein S10p (S20e) [Escherichia coli IS1]" . . . . . 51.72 74 100.00 100.00 4.40e-22 . . . . 16788 1 6 no EMBL CDK60294 . "SSU ribosomal protein S10p (S20e) [Escherichia coli IS9]" . . . . . 51.72 74 100.00 100.00 4.40e-22 . . . . 16788 1 7 no EMBL CDL02401 . "SSU ribosomal protein S10p (S20e) [Escherichia coli IS35]" . . . . . 51.72 74 100.00 100.00 4.40e-22 . . . . 16788 1 8 no EMBL CDL28926 . "SSU ribosomal protein S10p (S20e) [Escherichia coli ISC7]" . . . . . 51.72 74 100.00 100.00 4.40e-22 . . . . 16788 1 9 no EMBL CDL47417 . "SSU ribosomal protein S10p (S20e) [Escherichia coli ISC41]" . . . . . 51.72 74 100.00 100.00 4.40e-22 . . . . 16788 1 10 no GB ESD90132 . "ribosomal protein S10p/S20e, partial [Escherichia coli 908585]" . . . . . 52.87 49 97.83 97.83 3.84e-22 . . . . 16788 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 -4 GLY . 16788 1 2 -3 PRO . 16788 1 3 -2 LEU . 16788 1 4 -1 GLY . 16788 1 5 0 SER . 16788 1 6 1 MET . 16788 1 7 2 GLN . 16788 1 8 3 ASN . 16788 1 9 4 GLN . 16788 1 10 5 ARG . 16788 1 11 6 ILE . 16788 1 12 7 ARG . 16788 1 13 8 ILE . 16788 1 14 9 ARG . 16788 1 15 10 LEU . 16788 1 16 11 LYS . 16788 1 17 12 ALA . 16788 1 18 13 PHE . 16788 1 19 14 ASP . 16788 1 20 15 HIS . 16788 1 21 16 ARG . 16788 1 22 17 LEU . 16788 1 23 18 ILE . 16788 1 24 19 ASP . 16788 1 25 20 GLN . 16788 1 26 21 ALA . 16788 1 27 22 THR . 16788 1 28 23 ALA . 16788 1 29 24 GLU . 16788 1 30 25 ILE . 16788 1 31 26 VAL . 16788 1 32 27 GLU . 16788 1 33 28 THR . 16788 1 34 29 ALA . 16788 1 35 30 LYS . 16788 1 36 31 ARG . 16788 1 37 32 THR . 16788 1 38 33 GLY . 16788 1 39 34 ALA . 16788 1 40 35 GLN . 16788 1 41 36 VAL . 16788 1 42 37 ARG . 16788 1 43 38 GLY . 16788 1 44 39 PRO . 16788 1 45 40 ILE . 16788 1 46 41 PRO . 16788 1 47 42 LEU . 16788 1 48 43 PRO . 16788 1 49 44 THR . 16788 1 50 45 ARG . 16788 1 51 46 SER . 16788 1 52 47 ARG . 16788 1 53 48 THR . 16788 1 54 49 HIS . 16788 1 55 50 LEU . 16788 1 56 51 ARG . 16788 1 57 52 LEU . 16788 1 58 53 VAL . 16788 1 59 54 ASP . 16788 1 60 55 ILE . 16788 1 61 56 VAL . 16788 1 62 57 GLU . 16788 1 63 58 PRO . 16788 1 64 59 THR . 16788 1 65 60 GLU . 16788 1 66 61 LYS . 16788 1 67 62 THR . 16788 1 68 63 VAL . 16788 1 69 64 ASP . 16788 1 70 65 ALA . 16788 1 71 66 LEU . 16788 1 72 67 MET . 16788 1 73 68 ARG . 16788 1 74 69 LEU . 16788 1 75 70 ASP . 16788 1 76 71 LEU . 16788 1 77 72 ALA . 16788 1 78 73 ALA . 16788 1 79 74 GLY . 16788 1 80 75 VAL . 16788 1 81 76 ASP . 16788 1 82 77 VAL . 16788 1 83 78 GLN . 16788 1 84 79 ILE . 16788 1 85 80 SER . 16788 1 86 81 LEU . 16788 1 87 82 GLY . 16788 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 16788 1 . PRO 2 2 16788 1 . LEU 3 3 16788 1 . GLY 4 4 16788 1 . SER 5 5 16788 1 . MET 6 6 16788 1 . GLN 7 7 16788 1 . ASN 8 8 16788 1 . GLN 9 9 16788 1 . ARG 10 10 16788 1 . ILE 11 11 16788 1 . ARG 12 12 16788 1 . ILE 13 13 16788 1 . ARG 14 14 16788 1 . LEU 15 15 16788 1 . LYS 16 16 16788 1 . ALA 17 17 16788 1 . PHE 18 18 16788 1 . ASP 19 19 16788 1 . HIS 20 20 16788 1 . ARG 21 21 16788 1 . LEU 22 22 16788 1 . ILE 23 23 16788 1 . ASP 24 24 16788 1 . GLN 25 25 16788 1 . ALA 26 26 16788 1 . THR 27 27 16788 1 . ALA 28 28 16788 1 . GLU 29 29 16788 1 . ILE 30 30 16788 1 . VAL 31 31 16788 1 . GLU 32 32 16788 1 . THR 33 33 16788 1 . ALA 34 34 16788 1 . LYS 35 35 16788 1 . ARG 36 36 16788 1 . THR 37 37 16788 1 . GLY 38 38 16788 1 . ALA 39 39 16788 1 . GLN 40 40 16788 1 . VAL 41 41 16788 1 . ARG 42 42 16788 1 . GLY 43 43 16788 1 . PRO 44 44 16788 1 . ILE 45 45 16788 1 . PRO 46 46 16788 1 . LEU 47 47 16788 1 . PRO 48 48 16788 1 . THR 49 49 16788 1 . ARG 50 50 16788 1 . SER 51 51 16788 1 . ARG 52 52 16788 1 . THR 53 53 16788 1 . HIS 54 54 16788 1 . LEU 55 55 16788 1 . ARG 56 56 16788 1 . LEU 57 57 16788 1 . VAL 58 58 16788 1 . ASP 59 59 16788 1 . ILE 60 60 16788 1 . VAL 61 61 16788 1 . GLU 62 62 16788 1 . PRO 63 63 16788 1 . THR 64 64 16788 1 . GLU 65 65 16788 1 . LYS 66 66 16788 1 . THR 67 67 16788 1 . VAL 68 68 16788 1 . ASP 69 69 16788 1 . ALA 70 70 16788 1 . LEU 71 71 16788 1 . MET 72 72 16788 1 . ARG 73 73 16788 1 . LEU 74 74 16788 1 . ASP 75 75 16788 1 . LEU 76 76 16788 1 . ALA 77 77 16788 1 . ALA 78 78 16788 1 . GLY 79 79 16788 1 . VAL 80 80 16788 1 . ASP 81 81 16788 1 . VAL 82 82 16788 1 . GLN 83 83 16788 1 . ILE 84 84 16788 1 . SER 85 85 16788 1 . LEU 86 86 16788 1 . GLY 87 87 16788 1 stop_ save_ save_NusG-CTD _Entity.Sf_category entity _Entity.Sf_framecode NusG-CTD _Entity.Entry_ID 16788 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name NusG-CTD _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID G _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GAMGRPKTLFEPGEMVRVND GPFADFNGVVEEVDYEKSRL KVSVSIFGRATPVELDFSQV EKA ; _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 63 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 6639.524 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-30 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 15490 . NusG . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 2 no PDB 2JVV . "Solution Structure Of E. Coli Nusg Carboxyterminal Domain" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 3 no PDB 2KVQ . "Solution Structure Of Nuse:nusg-Ctd Complex" . . . . . 100.00 63 100.00 100.00 3.47e-36 . . . . 16788 2 4 no DBJ BAB38328 . "component in transcription antitermination [Escherichia coli O157:H7 str. Sakai]" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 5 no DBJ BAE77338 . "transcription termination factor [Escherichia coli str. K-12 substr. W3110]" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 6 no DBJ BAG79793 . "transcription antitermination protein [Escherichia coli SE11]" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 7 no DBJ BAH61119 . "transcription antitermination protein [Klebsiella pneumoniae subsp. pneumoniae NTUH-K2044]" . . . . . 93.65 181 100.00 100.00 6.41e-32 . . . . 16788 2 8 no DBJ BAI28242 . "transcription termination factor NusG [Escherichia coli O26:H11 str. 11368]" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 9 no EMBL CAD09492 . "transcription antitermination protein [Salmonella enterica subsp. enterica serovar Typhi str. CT18]" . . . . . 93.65 181 100.00 100.00 6.41e-32 . . . . 16788 2 10 no EMBL CAP78438 . "Transcription antitermination protein nusG [Escherichia coli LF82]" . . . . . 93.65 181 100.00 100.00 6.41e-32 . . . . 16788 2 11 no EMBL CAQ34328 . "transcription termination factor NusG [Escherichia coli BL21(DE3)]" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 12 no EMBL CAQ91223 . "transcription termination factor [Escherichia fergusonii ATCC 35469]" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 13 no EMBL CAR00955 . "transcription termination factor [Escherichia coli IAI1]" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 14 no GB AAA24622 . "NusG protein [Escherichia coli]" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 15 no GB AAC43080 . "ORF_o181 [Escherichia coli str. K-12 substr. MG1655]" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 16 no GB AAC76956 . "transcription termination factor [Escherichia coli str. K-12 substr. MG1655]" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 17 no GB AAF33495 . "99% identity over 181 amino acids with E. coli transcription antitermination factor (NUSG) (SW:P16921) [Salmonella enterica sub" . . . . . 93.65 181 100.00 100.00 6.41e-32 . . . . 16788 2 18 no GB AAG59178 . "component in transcription antitermination [Escherichia coli O157:H7 str. EDL933]" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 19 no PIR AB0934 . "transcription antitermination protein STY3737 [imported] - Salmonella enterica subsp. enterica serovar Typhi (strain CT18)" . . . . . 93.65 181 100.00 100.00 6.41e-32 . . . . 16788 2 20 no REF NP_290613 . "transcription antitermination protein NusG [Escherichia coli O157:H7 str. EDL933]" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 21 no REF NP_312932 . "transcription antitermination protein NusG [Escherichia coli O157:H7 str. Sakai]" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 22 no REF NP_418409 . "transcription termination factor [Escherichia coli str. K-12 substr. MG1655]" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 23 no REF NP_457922 . "transcription antitermination protein [Salmonella enterica subsp. enterica serovar Typhi str. CT18]" . . . . . 93.65 181 100.00 100.00 6.41e-32 . . . . 16788 2 24 no REF NP_463017 . "transcription termination/antitermination protein NusG [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]" . . . . . 93.65 181 100.00 100.00 6.41e-32 . . . . 16788 2 25 no SP P0AA01 . "RecName: Full=Transcription termination/antitermination protein NusG [Escherichia coli CFT073]" . . . . . 93.65 181 100.00 100.00 6.41e-32 . . . . 16788 2 26 no SP P0AA02 . "RecName: Full=Transcription termination/antitermination protein NusG [Salmonella enterica subsp. enterica serovar Typhimurium s" . . . . . 93.65 181 100.00 100.00 6.41e-32 . . . . 16788 2 27 no SP P0AA03 . "RecName: Full=Transcription termination/antitermination protein NusG [Salmonella enterica subsp. enterica serovar Typhi]" . . . . . 93.65 181 100.00 100.00 6.41e-32 . . . . 16788 2 28 no SP P0AFG0 . "RecName: Full=Transcription termination/antitermination protein NusG [Escherichia coli K-12]" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 2 29 no SP P0AFG1 . "RecName: Full=Transcription termination/antitermination protein NusG [Escherichia coli O157:H7]" . . . . . 93.65 181 100.00 100.00 7.29e-32 . . . . 16788 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 1 119 GLY . 16788 2 2 120 ALA . 16788 2 3 121 MET . 16788 2 4 122 GLY . 16788 2 5 123 ARG . 16788 2 6 124 PRO . 16788 2 7 125 LYS . 16788 2 8 126 THR . 16788 2 9 127 LEU . 16788 2 10 128 PHE . 16788 2 11 129 GLU . 16788 2 12 130 PRO . 16788 2 13 131 GLY . 16788 2 14 132 GLU . 16788 2 15 133 MET . 16788 2 16 134 VAL . 16788 2 17 135 ARG . 16788 2 18 136 VAL . 16788 2 19 137 ASN . 16788 2 20 138 ASP . 16788 2 21 139 GLY . 16788 2 22 140 PRO . 16788 2 23 141 PHE . 16788 2 24 142 ALA . 16788 2 25 143 ASP . 16788 2 26 144 PHE . 16788 2 27 145 ASN . 16788 2 28 146 GLY . 16788 2 29 147 VAL . 16788 2 30 148 VAL . 16788 2 31 149 GLU . 16788 2 32 150 GLU . 16788 2 33 151 VAL . 16788 2 34 152 ASP . 16788 2 35 153 TYR . 16788 2 36 154 GLU . 16788 2 37 155 LYS . 16788 2 38 156 SER . 16788 2 39 157 ARG . 16788 2 40 158 LEU . 16788 2 41 159 LYS . 16788 2 42 160 VAL . 16788 2 43 161 SER . 16788 2 44 162 VAL . 16788 2 45 163 SER . 16788 2 46 164 ILE . 16788 2 47 165 PHE . 16788 2 48 166 GLY . 16788 2 49 167 ARG . 16788 2 50 168 ALA . 16788 2 51 169 THR . 16788 2 52 170 PRO . 16788 2 53 171 VAL . 16788 2 54 172 GLU . 16788 2 55 173 LEU . 16788 2 56 174 ASP . 16788 2 57 175 PHE . 16788 2 58 176 SER . 16788 2 59 177 GLN . 16788 2 60 178 VAL . 16788 2 61 179 GLU . 16788 2 62 180 LYS . 16788 2 63 181 ALA . 16788 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 16788 2 . ALA 2 2 16788 2 . MET 3 3 16788 2 . GLY 4 4 16788 2 . ARG 5 5 16788 2 . PRO 6 6 16788 2 . LYS 7 7 16788 2 . THR 8 8 16788 2 . LEU 9 9 16788 2 . PHE 10 10 16788 2 . GLU 11 11 16788 2 . PRO 12 12 16788 2 . GLY 13 13 16788 2 . GLU 14 14 16788 2 . MET 15 15 16788 2 . VAL 16 16 16788 2 . ARG 17 17 16788 2 . VAL 18 18 16788 2 . ASN 19 19 16788 2 . ASP 20 20 16788 2 . GLY 21 21 16788 2 . PRO 22 22 16788 2 . PHE 23 23 16788 2 . ALA 24 24 16788 2 . ASP 25 25 16788 2 . PHE 26 26 16788 2 . ASN 27 27 16788 2 . GLY 28 28 16788 2 . VAL 29 29 16788 2 . VAL 30 30 16788 2 . GLU 31 31 16788 2 . GLU 32 32 16788 2 . VAL 33 33 16788 2 . ASP 34 34 16788 2 . TYR 35 35 16788 2 . GLU 36 36 16788 2 . LYS 37 37 16788 2 . SER 38 38 16788 2 . ARG 39 39 16788 2 . LEU 40 40 16788 2 . LYS 41 41 16788 2 . VAL 42 42 16788 2 . SER 43 43 16788 2 . VAL 44 44 16788 2 . SER 45 45 16788 2 . ILE 46 46 16788 2 . PHE 47 47 16788 2 . GLY 48 48 16788 2 . ARG 49 49 16788 2 . ALA 50 50 16788 2 . THR 51 51 16788 2 . PRO 52 52 16788 2 . VAL 53 53 16788 2 . GLU 54 54 16788 2 . LEU 55 55 16788 2 . ASP 56 56 16788 2 . PHE 57 57 16788 2 . SER 58 58 16788 2 . GLN 59 59 16788 2 . VAL 60 60 16788 2 . GLU 61 61 16788 2 . LYS 62 62 16788 2 . ALA 63 63 16788 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 16788 _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 $NusE . 562 organism . 'Escherichia coli' 'E. coli' . . Eubacteria . Escherichia coli K12 . . . . . . . . . . . . . . . . . . . . 16788 1 2 2 $NusG-CTD . 562 organism . 'Escherichia coli' 'E. coli' . . Eubacteria . Escherichia coli K12 . . . . . . . . . . . . . . . . . . . . 16788 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 16788 _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 $NusE . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 (DE3)' . . . . . . . . . . . . . . . pGEX-6P . . . . . . 16788 1 2 2 $NusG-CTD . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 (DE3)' . . . . . . . . . . . . . . . pETGB1A . . . . . . 16788 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_15N_13C_-NusG-CTD_NusE_NusB _Sample.Sf_category sample _Sample.Sf_framecode 15N_13C_-NusG-CTD_NusE_NusB _Sample.Entry_ID 16788 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 '15N, 13C -NusG-CTD' '[U-100% 13C; U-100% 15N]' . . 2 $NusG-CTD . . 300 . . uM . . . . 16788 1 2 NusE 'natural abundance' . . 1 $NusE . . 300 . . uM . . . . 16788 1 3 NusB 'natural abundance' . . . . . . 300 . . uM . . . . 16788 1 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16788 1 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . 16788 1 6 'Sodium Chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 16788 1 7 HEPES 'natural abundance' . . . . . . 25 . . mM . . . . 16788 1 stop_ save_ save_15N_13C_2H-NusE_NusB_NusG-CTD _Sample.Sf_category sample _Sample.Sf_framecode 15N_13C_2H-NusE_NusB_NusG-CTD _Sample.Entry_ID 16788 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 '15N, 13C, 2H-NusE' '[U-100% 13C; U-100% 15N; U-80% 2H]' . . 1 $NusE . . 300 . . uM . . . . 16788 2 2 NusG-CTD 'natural abundance' . . 2 $NusG-CTD . . 300 . . uM . . . . 16788 2 3 NusB 'natural abundance' . . . . . . 300 . . uM . . . . 16788 2 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16788 2 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . 16788 2 6 'Sodium Chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 16788 2 7 HEPES 'natural abundance' . . . . . . 25 . . mM . . . . 16788 2 stop_ save_ save_NusG-CTD_15N_13C_NusE_NusB _Sample.Sf_category sample _Sample.Sf_framecode NusG-CTD_15N_13C_NusE_NusB _Sample.Entry_ID 16788 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 NusG-CTD 'natural abundance' . . 2 $NusG-CTD . . 0.3 . . mM . . . . 16788 3 2 '15N, 13C NusE' '[U-100% 13C; U-100% 15N]' . . 1 $NusE . . 0.3 . . mM . . . . 16788 3 3 NusB 'natural abundance' . . . . . . 0.3 . . mM . . . . 16788 3 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16788 3 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . 16788 3 6 'Sodium Chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 16788 3 7 HEPES 'natural abundance' . . . . . . 25 . . mM . . . . 16788 3 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 16788 _Sample_condition_list.ID 1 _Sample_condition_list.Details 'Measurements were performed in the presence of NusB, which is not participating in the NusE:NusG interaction, to assure correct folding of NusE.' loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 75 . mM 16788 1 pH 7.5 . pH 16788 1 temperature 310 . K 16788 1 stop_ save_ ############################ # Computer software used # ############################ save_xwinnmr _Software.Sf_category software _Software.Sf_framecode xwinnmr _Software.Entry_ID 16788 _Software.ID 1 _Software.Name xwinnmr _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 16788 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 16788 1 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 16788 _Software.ID 2 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 16788 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 16788 2 'peak picking' 16788 2 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 16788 _Software.ID 3 _Software.Name 'X-PLOR NIH' _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 16788 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 16788 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 16788 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 16788 _NMR_spectrometer.ID 2 _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 16788 _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 . 700 . . . 16788 1 2 spectrometer_2 Bruker Avance . 800 . . . 16788 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 16788 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $15N_13C_-NusG-CTD_NusE_NusB isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16788 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $15N_13C_-NusG-CTD_NusE_NusB isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16788 1 3 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $15N_13C_-NusG-CTD_NusE_NusB isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16788 1 4 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $15N_13C_-NusG-CTD_NusE_NusB isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16788 1 5 '3D 13C filtered(F1)-13C edited NOESY' no . . . . . . . . . . 1 $15N_13C_-NusG-CTD_NusE_NusB isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16788 1 6 '2D 1H-15N HSQC' no . . . . . . . . . . 3 $NusG-CTD_15N_13C_NusE_NusB isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16788 1 7 '2D 1H-13C HSQC' no . . . . . . . . . . 3 $NusG-CTD_15N_13C_NusE_NusB isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16788 1 8 '3D 1H-13C NOESY' no . . . . . . . . . . 3 $NusG-CTD_15N_13C_NusE_NusB isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16788 1 9 '3D 1H-15N NOESY' no . . . . . . . . . . 3 $NusG-CTD_15N_13C_NusE_NusB isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16788 1 10 '3D 13C filtered(F1)-133D 13C filtered(F1)-13C edited NOESY' no . . . . . . . . . . 3 $NusG-CTD_15N_13C_NusE_NusB isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16788 1 11 '3D HNCA' no . . . . . . . . . . 2 $15N_13C_2H-NusE_NusB_NusG-CTD isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16788 1 12 '3D HNCACB' no . . . . . . . . . . 2 $15N_13C_2H-NusE_NusB_NusG-CTD isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16788 1 13 '3D HCCH-TOCSY' no . . . . . . . . . . 3 $NusG-CTD_15N_13C_NusE_NusB isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16788 1 14 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $15N_13C_-NusG-CTD_NusE_NusB isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16788 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 16788 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 16788 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 16788 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 16788 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_Assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode Assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 16788 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 16788 1 2 '2D 1H-13C HSQC' . . . 16788 1 6 '2D 1H-15N HSQC' . . . 16788 1 8 '3D 1H-13C NOESY' . . . 16788 1 13 '3D HCCH-TOCSY' . . . 16788 1 14 '3D HCCH-TOCSY' . . . 16788 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 9 9 GLN H H 1 8.12 0.02 . 1 . . . . 4 GLN H . 16788 1 2 . 1 1 9 9 GLN HA H 1 4.51 0.02 . 1 . . . . 4 GLN HA . 16788 1 3 . 1 1 9 9 GLN HB2 H 1 2.01 0.02 . 2 . . . . 4 GLN HB2 . 16788 1 4 . 1 1 9 9 GLN HB3 H 1 2.08 0.02 . 2 . . . . 4 GLN HB3 . 16788 1 5 . 1 1 9 9 GLN HG2 H 1 2.55 0.02 . 2 . . . . 4 GLN HG2 . 16788 1 6 . 1 1 9 9 GLN HG3 H 1 2.60 0.02 . 2 . . . . 4 GLN HG3 . 16788 1 7 . 1 1 9 9 GLN CA C 13 55.81 0.2 . 1 . . . . 4 GLN CA . 16788 1 8 . 1 1 9 9 GLN CB C 13 32.65 0.2 . 1 . . . . 4 GLN CB . 16788 1 9 . 1 1 9 9 GLN CG C 13 32.27 0.2 . 1 . . . . 4 GLN CG . 16788 1 10 . 1 1 9 9 GLN N N 15 119.48 0.1 . 1 . . . . 4 GLN N . 16788 1 11 . 1 1 10 10 ARG H H 1 8.26 0.02 . 1 . . . . 5 ARG H . 16788 1 12 . 1 1 10 10 ARG HA H 1 4.91 0.02 . 1 . . . . 5 ARG HA . 16788 1 13 . 1 1 10 10 ARG HB2 H 1 1.72 0.02 . 2 . . . . 5 ARG HB2 . 16788 1 14 . 1 1 10 10 ARG HB3 H 1 1.72 0.02 . 2 . . . . 5 ARG HB3 . 16788 1 15 . 1 1 10 10 ARG HD2 H 1 2.99 0.02 . 2 . . . . 5 ARG HD2 . 16788 1 16 . 1 1 10 10 ARG HD3 H 1 2.99 0.02 . 2 . . . . 5 ARG HD3 . 16788 1 17 . 1 1 10 10 ARG HG2 H 1 1.44 0.02 . 2 . . . . 5 ARG HG2 . 16788 1 18 . 1 1 10 10 ARG HG3 H 1 1.44 0.02 . 2 . . . . 5 ARG HG3 . 16788 1 19 . 1 1 10 10 ARG CA C 13 55.81 0.2 . 1 . . . . 5 ARG CA . 16788 1 20 . 1 1 10 10 ARG CB C 13 33.43 0.2 . 1 . . . . 5 ARG CB . 16788 1 21 . 1 1 10 10 ARG CD C 13 43.67 0.2 . 1 . . . . 5 ARG CD . 16788 1 22 . 1 1 10 10 ARG CG C 13 27.01 0.2 . 1 . . . . 5 ARG CG . 16788 1 23 . 1 1 10 10 ARG N N 15 120.83 0.1 . 1 . . . . 5 ARG N . 16788 1 24 . 1 1 11 11 ILE H H 1 8.89 0.02 . 1 . . . . 6 ILE H . 16788 1 25 . 1 1 11 11 ILE HA H 1 4.39 0.02 . 1 . . . . 6 ILE HA . 16788 1 26 . 1 1 11 11 ILE HB H 1 1.87 0.02 . 1 . . . . 6 ILE HB . 16788 1 27 . 1 1 11 11 ILE HD11 H 1 0.88 0.02 . 1 . . . . 6 ILE MD . 16788 1 28 . 1 1 11 11 ILE HD12 H 1 0.88 0.02 . 1 . . . . 6 ILE MD . 16788 1 29 . 1 1 11 11 ILE HD13 H 1 0.88 0.02 . 1 . . . . 6 ILE MD . 16788 1 30 . 1 1 11 11 ILE HG12 H 1 1.20 0.02 . 2 . . . . 6 ILE HG12 . 16788 1 31 . 1 1 11 11 ILE HG13 H 1 1.49 0.02 . 2 . . . . 6 ILE HG13 . 16788 1 32 . 1 1 11 11 ILE HG21 H 1 0.88 0.02 . 1 . . . . 6 ILE MG . 16788 1 33 . 1 1 11 11 ILE HG22 H 1 0.88 0.02 . 1 . . . . 6 ILE MG . 16788 1 34 . 1 1 11 11 ILE HG23 H 1 0.88 0.02 . 1 . . . . 6 ILE MG . 16788 1 35 . 1 1 11 11 ILE CA C 13 60.97 0.2 . 1 . . . . 6 ILE CA . 16788 1 36 . 1 1 11 11 ILE CB C 13 38.91 0.2 . 1 . . . . 6 ILE CB . 16788 1 37 . 1 1 11 11 ILE CD1 C 13 13.13 0.2 . 1 . . . . 6 ILE CD1 . 16788 1 38 . 1 1 11 11 ILE CG1 C 13 27.44 0.2 . 1 . . . . 6 ILE CG1 . 16788 1 39 . 1 1 11 11 ILE CG2 C 13 17.55 0.2 . 1 . . . . 6 ILE CG2 . 16788 1 40 . 1 1 11 11 ILE N N 15 123.46 0.1 . 1 . . . . 6 ILE N . 16788 1 41 . 1 1 12 12 ARG H H 1 8.95 0.02 . 1 . . . . 7 ARG H . 16788 1 42 . 1 1 12 12 ARG HA H 1 5.22 0.02 . 1 . . . . 7 ARG HA . 16788 1 43 . 1 1 12 12 ARG HB2 H 1 1.82 0.02 . 2 . . . . 7 ARG HB2 . 16788 1 44 . 1 1 12 12 ARG HB3 H 1 1.82 0.02 . 2 . . . . 7 ARG HB3 . 16788 1 45 . 1 1 12 12 ARG HD2 H 1 3.09 0.02 . 2 . . . . 7 ARG HD2 . 16788 1 46 . 1 1 12 12 ARG HD3 H 1 3.09 0.02 . 2 . . . . 7 ARG HD3 . 16788 1 47 . 1 1 12 12 ARG HG2 H 1 1.59 0.02 . 2 . . . . 7 ARG HG2 . 16788 1 48 . 1 1 12 12 ARG HG3 H 1 1.65 0.02 . 2 . . . . 7 ARG HG3 . 16788 1 49 . 1 1 12 12 ARG CA C 13 55.69 0.2 . 1 . . . . 7 ARG CA . 16788 1 50 . 1 1 12 12 ARG CB C 13 31.35 0.2 . 1 . . . . 7 ARG CB . 16788 1 51 . 1 1 12 12 ARG CD C 13 43.32 0.2 . 1 . . . . 7 ARG CD . 16788 1 52 . 1 1 12 12 ARG CG C 13 27.22 0.2 . 1 . . . . 7 ARG CG . 16788 1 53 . 1 1 12 12 ARG N N 15 128.29 0.1 . 1 . . . . 7 ARG N . 16788 1 54 . 1 1 13 13 ILE H H 1 9.34 0.02 . 1 . . . . 8 ILE H . 16788 1 55 . 1 1 13 13 ILE HA H 1 4.72 0.02 . 1 . . . . 8 ILE HA . 16788 1 56 . 1 1 13 13 ILE HB H 1 1.90 0.02 . 1 . . . . 8 ILE HB . 16788 1 57 . 1 1 13 13 ILE HD11 H 1 0.98 0.02 . 1 . . . . 8 ILE MD . 16788 1 58 . 1 1 13 13 ILE HD12 H 1 0.98 0.02 . 1 . . . . 8 ILE MD . 16788 1 59 . 1 1 13 13 ILE HD13 H 1 0.98 0.02 . 1 . . . . 8 ILE MD . 16788 1 60 . 1 1 13 13 ILE HG12 H 1 1.00 0.02 . 2 . . . . 8 ILE HG12 . 16788 1 61 . 1 1 13 13 ILE HG13 H 1 1.00 0.02 . 2 . . . . 8 ILE HG13 . 16788 1 62 . 1 1 13 13 ILE HG21 H 1 0.80 0.02 . 1 . . . . 8 ILE MG . 16788 1 63 . 1 1 13 13 ILE HG22 H 1 0.80 0.02 . 1 . . . . 8 ILE MG . 16788 1 64 . 1 1 13 13 ILE HG23 H 1 0.80 0.02 . 1 . . . . 8 ILE MG . 16788 1 65 . 1 1 13 13 ILE CA C 13 59.56 0.2 . 1 . . . . 8 ILE CA . 16788 1 66 . 1 1 13 13 ILE CB C 13 40.06 0.2 . 1 . . . . 8 ILE CB . 16788 1 67 . 1 1 13 13 ILE CD1 C 13 14.64 0.2 . 1 . . . . 8 ILE CD1 . 16788 1 68 . 1 1 13 13 ILE CG1 C 13 26.86 0.2 . 1 . . . . 8 ILE CG1 . 16788 1 69 . 1 1 13 13 ILE CG2 C 13 18.40 0.2 . 1 . . . . 8 ILE CG2 . 16788 1 70 . 1 1 13 13 ILE N N 15 126.97 0.1 . 1 . . . . 8 ILE N . 16788 1 71 . 1 1 14 14 ARG H H 1 8.85 0.02 . 1 . . . . 9 ARG H . 16788 1 72 . 1 1 14 14 ARG HA H 1 5.18 0.02 . 1 . . . . 9 ARG HA . 16788 1 73 . 1 1 14 14 ARG HB2 H 1 1.64 0.02 . 2 . . . . 9 ARG HB2 . 16788 1 74 . 1 1 14 14 ARG HB3 H 1 1.81 0.02 . 2 . . . . 9 ARG HB3 . 16788 1 75 . 1 1 14 14 ARG HD2 H 1 3.06 0.02 . 2 . . . . 9 ARG HD2 . 16788 1 76 . 1 1 14 14 ARG HD3 H 1 3.11 0.02 . 2 . . . . 9 ARG HD3 . 16788 1 77 . 1 1 14 14 ARG HG2 H 1 1.41 0.02 . 2 . . . . 9 ARG HG2 . 16788 1 78 . 1 1 14 14 ARG HG3 H 1 1.41 0.02 . 2 . . . . 9 ARG HG3 . 16788 1 79 . 1 1 14 14 ARG CA C 13 54.63 0.2 . 1 . . . . 9 ARG CA . 16788 1 80 . 1 1 14 14 ARG CB C 13 32.98 0.2 . 1 . . . . 9 ARG CB . 16788 1 81 . 1 1 14 14 ARG CD C 13 43.48 0.2 . 1 . . . . 9 ARG CD . 16788 1 82 . 1 1 14 14 ARG CG C 13 27.26 0.2 . 1 . . . . 9 ARG CG . 16788 1 83 . 1 1 14 14 ARG N N 15 128.01 0.1 . 1 . . . . 9 ARG N . 16788 1 84 . 1 1 15 15 LEU H H 1 9.03 0.02 . 1 . . . . 10 LEU H . 16788 1 85 . 1 1 15 15 LEU HA H 1 5.48 0.02 . 1 . . . . 10 LEU HA . 16788 1 86 . 1 1 15 15 LEU HB2 H 1 1.60 0.02 . 2 . . . . 10 LEU HB2 . 16788 1 87 . 1 1 15 15 LEU HB3 H 1 1.73 0.02 . 2 . . . . 10 LEU HB3 . 16788 1 88 . 1 1 15 15 LEU HD11 H 1 0.79 0.02 . 2 . . . . 10 LEU MD1 . 16788 1 89 . 1 1 15 15 LEU HD12 H 1 0.79 0.02 . 2 . . . . 10 LEU MD1 . 16788 1 90 . 1 1 15 15 LEU HD13 H 1 0.79 0.02 . 2 . . . . 10 LEU MD1 . 16788 1 91 . 1 1 15 15 LEU HD21 H 1 0.64 0.02 . 2 . . . . 10 LEU MD2 . 16788 1 92 . 1 1 15 15 LEU HD22 H 1 0.64 0.02 . 2 . . . . 10 LEU MD2 . 16788 1 93 . 1 1 15 15 LEU HD23 H 1 0.64 0.02 . 2 . . . . 10 LEU MD2 . 16788 1 94 . 1 1 15 15 LEU HG H 1 1.56 0.02 . 1 . . . . 10 LEU HG . 16788 1 95 . 1 1 15 15 LEU CA C 13 54.13 0.2 . 1 . . . . 10 LEU CA . 16788 1 96 . 1 1 15 15 LEU CB C 13 45.67 0.2 . 1 . . . . 10 LEU CB . 16788 1 97 . 1 1 15 15 LEU CD1 C 13 26.29 0.2 . 2 . . . . 10 LEU CD1 . 16788 1 98 . 1 1 15 15 LEU CD2 C 13 25.46 0.2 . 2 . . . . 10 LEU CD2 . 16788 1 99 . 1 1 15 15 LEU CG C 13 27.47 0.2 . 1 . . . . 10 LEU CG . 16788 1 100 . 1 1 15 15 LEU N N 15 125.57 0.1 . 1 . . . . 10 LEU N . 16788 1 101 . 1 1 16 16 LYS H H 1 8.62 0.02 . 1 . . . . 11 LYS H . 16788 1 102 . 1 1 16 16 LYS HA H 1 5.63 0.02 . 1 . . . . 11 LYS HA . 16788 1 103 . 1 1 16 16 LYS HB2 H 1 1.65 0.02 . 2 . . . . 11 LYS HB2 . 16788 1 104 . 1 1 16 16 LYS HB3 H 1 1.65 0.02 . 2 . . . . 11 LYS HB3 . 16788 1 105 . 1 1 16 16 LYS HD2 H 1 1.55 0.02 . 2 . . . . 11 LYS HD2 . 16788 1 106 . 1 1 16 16 LYS HD3 H 1 1.55 0.02 . 2 . . . . 11 LYS HD3 . 16788 1 107 . 1 1 16 16 LYS HE2 H 1 2.85 0.02 . 2 . . . . 11 LYS HE2 . 16788 1 108 . 1 1 16 16 LYS HE3 H 1 2.85 0.02 . 2 . . . . 11 LYS HE3 . 16788 1 109 . 1 1 16 16 LYS HG2 H 1 1.27 0.02 . 2 . . . . 11 LYS HG2 . 16788 1 110 . 1 1 16 16 LYS CA C 13 53.87 0.2 . 1 . . . . 11 LYS CA . 16788 1 111 . 1 1 16 16 LYS CB C 13 37.03 0.2 . 1 . . . . 11 LYS CB . 16788 1 112 . 1 1 16 16 LYS CD C 13 29.69 0.2 . 1 . . . . 11 LYS CD . 16788 1 113 . 1 1 16 16 LYS CE C 13 41.63 0.2 . 1 . . . . 11 LYS CE . 16788 1 114 . 1 1 16 16 LYS N N 15 121.39 0.1 . 1 . . . . 11 LYS N . 16788 1 115 . 1 1 17 17 ALA H H 1 8.59 0.02 . 1 . . . . 12 ALA H . 16788 1 116 . 1 1 17 17 ALA HA H 1 4.79 0.02 . 1 . . . . 12 ALA HA . 16788 1 117 . 1 1 17 17 ALA HB1 H 1 1.60 0.02 . 1 . . . . 12 ALA MB . 16788 1 118 . 1 1 17 17 ALA HB2 H 1 1.60 0.02 . 1 . . . . 12 ALA MB . 16788 1 119 . 1 1 17 17 ALA HB3 H 1 1.60 0.02 . 1 . . . . 12 ALA MB . 16788 1 120 . 1 1 17 17 ALA CA C 13 51.63 0.2 . 1 . . . . 12 ALA CA . 16788 1 121 . 1 1 17 17 ALA CB C 13 24.46 0.2 . 1 . . . . 12 ALA CB . 16788 1 122 . 1 1 17 17 ALA N N 15 122.50 0.1 . 1 . . . . 12 ALA N . 16788 1 123 . 1 1 18 18 PHE H H 1 9.01 0.02 . 1 . . . . 13 PHE H . 16788 1 124 . 1 1 18 18 PHE HA H 1 5.39 0.02 . 1 . . . . 13 PHE HA . 16788 1 125 . 1 1 18 18 PHE HB2 H 1 3.05 0.02 . 2 . . . . 13 PHE HB2 . 16788 1 126 . 1 1 18 18 PHE HB3 H 1 3.58 0.02 . 2 . . . . 13 PHE HB3 . 16788 1 127 . 1 1 18 18 PHE CA C 13 58.32 0.2 . 1 . . . . 13 PHE CA . 16788 1 128 . 1 1 18 18 PHE CB C 13 39.36 0.2 . 1 . . . . 13 PHE CB . 16788 1 129 . 1 1 18 18 PHE N N 15 118.11 0.1 . 1 . . . . 13 PHE N . 16788 1 130 . 1 1 19 19 ASP H H 1 7.41 0.02 . 1 . . . . 14 ASP H . 16788 1 131 . 1 1 19 19 ASP HA H 1 4.78 0.02 . 1 . . . . 14 ASP HA . 16788 1 132 . 1 1 19 19 ASP HB2 H 1 2.79 0.02 . 2 . . . . 14 ASP HB2 . 16788 1 133 . 1 1 19 19 ASP HB3 H 1 2.86 0.02 . 2 . . . . 14 ASP HB3 . 16788 1 134 . 1 1 19 19 ASP CA C 13 53.34 0.2 . 1 . . . . 14 ASP CA . 16788 1 135 . 1 1 19 19 ASP CB C 13 39.05 0.2 . 1 . . . . 14 ASP CB . 16788 1 136 . 1 1 19 19 ASP N N 15 119.20 0.1 . 1 . . . . 14 ASP N . 16788 1 137 . 1 1 20 20 HIS H H 1 8.40 0.02 . 1 . . . . 15 HIS H . 16788 1 138 . 1 1 20 20 HIS HA H 1 3.80 0.02 . 1 . . . . 15 HIS HA . 16788 1 139 . 1 1 20 20 HIS HB2 H 1 2.77 0.02 . 2 . . . . 15 HIS HB2 . 16788 1 140 . 1 1 20 20 HIS HB3 H 1 2.77 0.02 . 2 . . . . 15 HIS HB3 . 16788 1 141 . 1 1 20 20 HIS CA C 13 57.40 0.2 . 1 . . . . 15 HIS CA . 16788 1 142 . 1 1 20 20 HIS CB C 13 29.29 0.2 . 1 . . . . 15 HIS CB . 16788 1 143 . 1 1 20 20 HIS N N 15 125.36 0.1 . 1 . . . . 15 HIS N . 16788 1 144 . 1 1 21 21 ARG H H 1 7.51 0.02 . 1 . . . . 16 ARG H . 16788 1 145 . 1 1 21 21 ARG HA H 1 3.99 0.02 . 1 . . . . 16 ARG HA . 16788 1 146 . 1 1 21 21 ARG HB2 H 1 1.72 0.02 . 2 . . . . 16 ARG HB2 . 16788 1 147 . 1 1 21 21 ARG HB3 H 1 1.72 0.02 . 2 . . . . 16 ARG HB3 . 16788 1 148 . 1 1 21 21 ARG HD2 H 1 3.12 0.02 . 2 . . . . 16 ARG HD2 . 16788 1 149 . 1 1 21 21 ARG HD3 H 1 3.12 0.02 . 2 . . . . 16 ARG HD3 . 16788 1 150 . 1 1 21 21 ARG HG2 H 1 1.21 0.02 . 2 . . . . 16 ARG HG2 . 16788 1 151 . 1 1 21 21 ARG HG3 H 1 1.35 0.02 . 2 . . . . 16 ARG HG3 . 16788 1 152 . 1 1 21 21 ARG CA C 13 58.68 0.2 . 1 . . . . 16 ARG CA . 16788 1 153 . 1 1 21 21 ARG CB C 13 28.98 0.2 . 1 . . . . 16 ARG CB . 16788 1 154 . 1 1 21 21 ARG CD C 13 42.99 0.2 . 1 . . . . 16 ARG CD . 16788 1 155 . 1 1 21 21 ARG CG C 13 27.25 0.2 . 1 . . . . 16 ARG CG . 16788 1 156 . 1 1 21 21 ARG N N 15 122.14 0.1 . 1 . . . . 16 ARG N . 16788 1 157 . 1 1 22 22 LEU H H 1 7.45 0.02 . 1 . . . . 17 LEU H . 16788 1 158 . 1 1 22 22 LEU HA H 1 4.05 0.02 . 1 . . . . 17 LEU HA . 16788 1 159 . 1 1 22 22 LEU HB2 H 1 1.46 0.02 . 2 . . . . 17 LEU HB2 . 16788 1 160 . 1 1 22 22 LEU HB3 H 1 1.59 0.02 . 2 . . . . 17 LEU HB3 . 16788 1 161 . 1 1 22 22 LEU HD11 H 1 0.93 0.02 . 2 . . . . 17 LEU MD1 . 16788 1 162 . 1 1 22 22 LEU HD12 H 1 0.93 0.02 . 2 . . . . 17 LEU MD1 . 16788 1 163 . 1 1 22 22 LEU HD13 H 1 0.93 0.02 . 2 . . . . 17 LEU MD1 . 16788 1 164 . 1 1 22 22 LEU HD21 H 1 0.86 0.02 . 2 . . . . 17 LEU MD2 . 16788 1 165 . 1 1 22 22 LEU HD22 H 1 0.86 0.02 . 2 . . . . 17 LEU MD2 . 16788 1 166 . 1 1 22 22 LEU HD23 H 1 0.86 0.02 . 2 . . . . 17 LEU MD2 . 16788 1 167 . 1 1 22 22 LEU HG H 1 1.71 0.02 . 1 . . . . 17 LEU HG . 16788 1 168 . 1 1 22 22 LEU CA C 13 56.97 0.2 . 1 . . . . 17 LEU CA . 16788 1 169 . 1 1 22 22 LEU CB C 13 42.34 0.2 . 1 . . . . 17 LEU CB . 16788 1 170 . 1 1 22 22 LEU CD1 C 13 24.25 0.2 . 2 . . . . 17 LEU CD1 . 16788 1 171 . 1 1 22 22 LEU CD2 C 13 24.25 0.2 . 2 . . . . 17 LEU CD2 . 16788 1 172 . 1 1 22 22 LEU CG C 13 26.89 0.2 . 1 . . . . 17 LEU CG . 16788 1 173 . 1 1 22 22 LEU N N 15 119.31 0.1 . 1 . . . . 17 LEU N . 16788 1 174 . 1 1 23 23 ILE H H 1 7.74 0.02 . 1 . . . . 18 ILE H . 16788 1 175 . 1 1 23 23 ILE HA H 1 3.91 0.02 . 1 . . . . 18 ILE HA . 16788 1 176 . 1 1 23 23 ILE HB H 1 1.74 0.02 . 1 . . . . 18 ILE HB . 16788 1 177 . 1 1 23 23 ILE HD11 H 1 0.73 0.02 . 1 . . . . 18 ILE MD . 16788 1 178 . 1 1 23 23 ILE HD12 H 1 0.73 0.02 . 1 . . . . 18 ILE MD . 16788 1 179 . 1 1 23 23 ILE HD13 H 1 0.73 0.02 . 1 . . . . 18 ILE MD . 16788 1 180 . 1 1 23 23 ILE HG12 H 1 1.22 0.02 . 2 . . . . 18 ILE HG12 . 16788 1 181 . 1 1 23 23 ILE HG13 H 1 1.31 0.02 . 2 . . . . 18 ILE HG13 . 16788 1 182 . 1 1 23 23 ILE HG21 H 1 1.08 0.02 . 1 . . . . 18 ILE MG . 16788 1 183 . 1 1 23 23 ILE HG22 H 1 1.08 0.02 . 1 . . . . 18 ILE MG . 16788 1 184 . 1 1 23 23 ILE HG23 H 1 1.08 0.02 . 1 . . . . 18 ILE MG . 16788 1 185 . 1 1 23 23 ILE CA C 13 65.44 0.2 . 1 . . . . 18 ILE CA . 16788 1 186 . 1 1 23 23 ILE CB C 13 37.43 0.2 . 1 . . . . 18 ILE CB . 16788 1 187 . 1 1 23 23 ILE CD1 C 13 15.16 0.2 . 1 . . . . 18 ILE CD1 . 16788 1 188 . 1 1 23 23 ILE CG1 C 13 31.50 0.2 . 1 . . . . 18 ILE CG1 . 16788 1 189 . 1 1 23 23 ILE CG2 C 13 16.45 0.2 . 1 . . . . 18 ILE CG2 . 16788 1 190 . 1 1 23 23 ILE N N 15 118.05 0.1 . 1 . . . . 18 ILE N . 16788 1 191 . 1 1 24 24 ASP H H 1 8.10 0.02 . 1 . . . . 19 ASP H . 16788 1 192 . 1 1 24 24 ASP HA H 1 4.75 0.02 . 1 . . . . 19 ASP HA . 16788 1 193 . 1 1 24 24 ASP HB2 H 1 2.77 0.02 . 2 . . . . 19 ASP HB2 . 16788 1 194 . 1 1 24 24 ASP HB3 H 1 2.94 0.02 . 2 . . . . 19 ASP HB3 . 16788 1 195 . 1 1 24 24 ASP CA C 13 58.26 0.2 . 1 . . . . 19 ASP CA . 16788 1 196 . 1 1 24 24 ASP CB C 13 39.45 0.2 . 1 . . . . 19 ASP CB . 16788 1 197 . 1 1 24 24 ASP N N 15 127.37 0.1 . 1 . . . . 19 ASP N . 16788 1 198 . 1 1 25 25 GLN H H 1 7.83 0.02 . 1 . . . . 20 GLN H . 16788 1 199 . 1 1 25 25 GLN HA H 1 4.15 0.02 . 1 . . . . 20 GLN HA . 16788 1 200 . 1 1 25 25 GLN HB2 H 1 2.19 0.02 . 2 . . . . 20 GLN HB2 . 16788 1 201 . 1 1 25 25 GLN HB3 H 1 2.19 0.02 . 2 . . . . 20 GLN HB3 . 16788 1 202 . 1 1 25 25 GLN HG2 H 1 2.38 0.02 . 2 . . . . 20 GLN HG2 . 16788 1 203 . 1 1 25 25 GLN HG3 H 1 2.49 0.02 . 2 . . . . 20 GLN HG3 . 16788 1 204 . 1 1 25 25 GLN CA C 13 59.16 0.2 . 1 . . . . 20 GLN CA . 16788 1 205 . 1 1 25 25 GLN CB C 13 28.16 0.2 . 1 . . . . 20 GLN CB . 16788 1 206 . 1 1 25 25 GLN CG C 13 33.65 0.2 . 1 . . . . 20 GLN CG . 16788 1 207 . 1 1 25 25 GLN N N 15 123.10 0.1 . 1 . . . . 20 GLN N . 16788 1 208 . 1 1 26 26 ALA H H 1 8.22 0.02 . 1 . . . . 21 ALA H . 16788 1 209 . 1 1 26 26 ALA HA H 1 4.17 0.02 . 1 . . . . 21 ALA HA . 16788 1 210 . 1 1 26 26 ALA HB1 H 1 1.49 0.02 . 1 . . . . 21 ALA MB . 16788 1 211 . 1 1 26 26 ALA HB2 H 1 1.49 0.02 . 1 . . . . 21 ALA MB . 16788 1 212 . 1 1 26 26 ALA HB3 H 1 1.49 0.02 . 1 . . . . 21 ALA MB . 16788 1 213 . 1 1 26 26 ALA CA C 13 54.96 0.2 . 1 . . . . 21 ALA CA . 16788 1 214 . 1 1 26 26 ALA CB C 13 19.38 0.2 . 1 . . . . 21 ALA CB . 16788 1 215 . 1 1 26 26 ALA N N 15 121.68 0.1 . 1 . . . . 21 ALA N . 16788 1 216 . 1 1 27 27 THR H H 1 8.02 0.02 . 1 . . . . 22 THR H . 16788 1 217 . 1 1 27 27 THR HA H 1 3.46 0.02 . 1 . . . . 22 THR HA . 16788 1 218 . 1 1 27 27 THR HB H 1 3.92 0.02 . 1 . . . . 22 THR HB . 16788 1 219 . 1 1 27 27 THR HG21 H 1 1.13 0.02 . 1 . . . . 22 THR MG . 16788 1 220 . 1 1 27 27 THR HG22 H 1 1.13 0.02 . 1 . . . . 22 THR MG . 16788 1 221 . 1 1 27 27 THR HG23 H 1 1.13 0.02 . 1 . . . . 22 THR MG . 16788 1 222 . 1 1 27 27 THR CA C 13 68.41 0.2 . 1 . . . . 22 THR CA . 16788 1 223 . 1 1 27 27 THR CB C 13 68.52 0.2 . 1 . . . . 22 THR CB . 16788 1 224 . 1 1 27 27 THR N N 15 113.89 0.1 . 1 . . . . 22 THR N . 16788 1 225 . 1 1 28 28 ALA H H 1 7.86 0.02 . 1 . . . . 23 ALA H . 16788 1 226 . 1 1 28 28 ALA HA H 1 3.85 0.02 . 1 . . . . 23 ALA HA . 16788 1 227 . 1 1 28 28 ALA HB1 H 1 1.53 0.02 . 1 . . . . 23 ALA MB . 16788 1 228 . 1 1 28 28 ALA HB2 H 1 1.53 0.02 . 1 . . . . 23 ALA MB . 16788 1 229 . 1 1 28 28 ALA HB3 H 1 1.53 0.02 . 1 . . . . 23 ALA MB . 16788 1 230 . 1 1 28 28 ALA CA C 13 55.97 0.2 . 1 . . . . 23 ALA CA . 16788 1 231 . 1 1 28 28 ALA CB C 13 18.00 0.2 . 1 . . . . 23 ALA CB . 16788 1 232 . 1 1 28 28 ALA N N 15 123.21 0.1 . 1 . . . . 23 ALA N . 16788 1 233 . 1 1 29 29 GLU H H 1 8.11 0.02 . 1 . . . . 24 GLU H . 16788 1 234 . 1 1 29 29 GLU HA H 1 4.14 0.02 . 1 . . . . 24 GLU HA . 16788 1 235 . 1 1 29 29 GLU HB2 H 1 2.05 0.02 . 2 . . . . 24 GLU HB2 . 16788 1 236 . 1 1 29 29 GLU HB3 H 1 2.23 0.02 . 2 . . . . 24 GLU HB3 . 16788 1 237 . 1 1 29 29 GLU HG2 H 1 2.25 0.02 . 2 . . . . 24 GLU HG2 . 16788 1 238 . 1 1 29 29 GLU HG3 H 1 2.45 0.02 . 2 . . . . 24 GLU HG3 . 16788 1 239 . 1 1 29 29 GLU CA C 13 59.75 0.2 . 1 . . . . 24 GLU CA . 16788 1 240 . 1 1 29 29 GLU CB C 13 29.47 0.2 . 1 . . . . 24 GLU CB . 16788 1 241 . 1 1 29 29 GLU CG C 13 36.72 0.2 . 1 . . . . 24 GLU CG . 16788 1 242 . 1 1 29 29 GLU N N 15 118.51 0.1 . 1 . . . . 24 GLU N . 16788 1 243 . 1 1 30 30 ILE H H 1 8.18 0.02 . 1 . . . . 25 ILE H . 16788 1 244 . 1 1 30 30 ILE HA H 1 3.44 0.02 . 1 . . . . 25 ILE HA . 16788 1 245 . 1 1 30 30 ILE HB H 1 2.15 0.02 . 1 . . . . 25 ILE HB . 16788 1 246 . 1 1 30 30 ILE HD11 H 1 0.68 0.02 . 1 . . . . 25 ILE MD . 16788 1 247 . 1 1 30 30 ILE HD12 H 1 0.68 0.02 . 1 . . . . 25 ILE MD . 16788 1 248 . 1 1 30 30 ILE HD13 H 1 0.68 0.02 . 1 . . . . 25 ILE MD . 16788 1 249 . 1 1 30 30 ILE HG12 H 1 0.94 0.02 . 2 . . . . 25 ILE HG12 . 16788 1 250 . 1 1 30 30 ILE HG13 H 1 1.75 0.02 . 2 . . . . 25 ILE HG13 . 16788 1 251 . 1 1 30 30 ILE HG21 H 1 0.88 0.02 . 1 . . . . 25 ILE MG . 16788 1 252 . 1 1 30 30 ILE HG22 H 1 0.88 0.02 . 1 . . . . 25 ILE MG . 16788 1 253 . 1 1 30 30 ILE HG23 H 1 0.88 0.02 . 1 . . . . 25 ILE MG . 16788 1 254 . 1 1 30 30 ILE CA C 13 66.63 0.2 . 1 . . . . 25 ILE CA . 16788 1 255 . 1 1 30 30 ILE CB C 13 37.73 0.2 . 1 . . . . 25 ILE CB . 16788 1 256 . 1 1 30 30 ILE CD1 C 13 14.64 0.2 . 1 . . . . 25 ILE CD1 . 16788 1 257 . 1 1 30 30 ILE CG1 C 13 30.49 0.2 . 1 . . . . 25 ILE CG1 . 16788 1 258 . 1 1 30 30 ILE CG2 C 13 17.54 0.2 . 1 . . . . 25 ILE CG2 . 16788 1 259 . 1 1 30 30 ILE N N 15 122.30 0.1 . 1 . . . . 25 ILE N . 16788 1 260 . 1 1 31 31 VAL H H 1 8.27 0.02 . 1 . . . . 26 VAL H . 16788 1 261 . 1 1 31 31 VAL HA H 1 3.38 0.02 . 1 . . . . 26 VAL HA . 16788 1 262 . 1 1 31 31 VAL HB H 1 2.29 0.02 . 1 . . . . 26 VAL HB . 16788 1 263 . 1 1 31 31 VAL HG11 H 1 0.98 0.02 . 2 . . . . 26 VAL MG1 . 16788 1 264 . 1 1 31 31 VAL HG12 H 1 0.98 0.02 . 2 . . . . 26 VAL MG1 . 16788 1 265 . 1 1 31 31 VAL HG13 H 1 0.98 0.02 . 2 . . . . 26 VAL MG1 . 16788 1 266 . 1 1 31 31 VAL HG21 H 1 0.91 0.02 . 2 . . . . 26 VAL MG2 . 16788 1 267 . 1 1 31 31 VAL HG22 H 1 0.91 0.02 . 2 . . . . 26 VAL MG2 . 16788 1 268 . 1 1 31 31 VAL HG23 H 1 0.91 0.02 . 2 . . . . 26 VAL MG2 . 16788 1 269 . 1 1 31 31 VAL CA C 13 67.23 0.2 . 1 . . . . 26 VAL CA . 16788 1 270 . 1 1 31 31 VAL CB C 13 31.78 0.2 . 1 . . . . 26 VAL CB . 16788 1 271 . 1 1 31 31 VAL CG1 C 13 21.78 0.2 . 2 . . . . 26 VAL CG1 . 16788 1 272 . 1 1 31 31 VAL CG2 C 13 22.73 0.2 . 2 . . . . 26 VAL CG2 . 16788 1 273 . 1 1 31 31 VAL N N 15 119.72 0.1 . 1 . . . . 26 VAL N . 16788 1 274 . 1 1 32 32 GLU H H 1 8.66 0.02 . 1 . . . . 27 GLU H . 16788 1 275 . 1 1 32 32 GLU HA H 1 4.02 0.02 . 1 . . . . 27 GLU HA . 16788 1 276 . 1 1 32 32 GLU HB2 H 1 2.09 0.02 . 2 . . . . 27 GLU HB2 . 16788 1 277 . 1 1 32 32 GLU HB3 H 1 2.09 0.02 . 2 . . . . 27 GLU HB3 . 16788 1 278 . 1 1 32 32 GLU HG2 H 1 2.37 0.02 . 2 . . . . 27 GLU HG2 . 16788 1 279 . 1 1 32 32 GLU HG3 H 1 2.37 0.02 . 2 . . . . 27 GLU HG3 . 16788 1 280 . 1 1 32 32 GLU CA C 13 59.21 0.2 . 1 . . . . 27 GLU CA . 16788 1 281 . 1 1 32 32 GLU CB C 13 29.70 0.2 . 1 . . . . 27 GLU CB . 16788 1 282 . 1 1 32 32 GLU CG C 13 36.18 0.2 . 1 . . . . 27 GLU CG . 16788 1 283 . 1 1 32 32 GLU N N 15 118.65 0.1 . 1 . . . . 27 GLU N . 16788 1 284 . 1 1 33 33 THR H H 1 8.01 0.02 . 1 . . . . 28 THR H . 16788 1 285 . 1 1 33 33 THR HA H 1 3.83 0.02 . 1 . . . . 28 THR HA . 16788 1 286 . 1 1 33 33 THR HB H 1 4.31 0.02 . 1 . . . . 28 THR HB . 16788 1 287 . 1 1 33 33 THR HG21 H 1 1.14 0.02 . 1 . . . . 28 THR MG . 16788 1 288 . 1 1 33 33 THR HG22 H 1 1.14 0.02 . 1 . . . . 28 THR MG . 16788 1 289 . 1 1 33 33 THR HG23 H 1 1.14 0.02 . 1 . . . . 28 THR MG . 16788 1 290 . 1 1 33 33 THR CA C 13 67.50 0.2 . 1 . . . . 28 THR CA . 16788 1 291 . 1 1 33 33 THR CB C 13 67.96 0.2 . 1 . . . . 28 THR CB . 16788 1 292 . 1 1 33 33 THR N N 15 116.17 0.1 . 1 . . . . 28 THR N . 16788 1 293 . 1 1 34 34 ALA H H 1 8.44 0.02 . 1 . . . . 29 ALA H . 16788 1 294 . 1 1 34 34 ALA HA H 1 3.82 0.02 . 1 . . . . 29 ALA HA . 16788 1 295 . 1 1 34 34 ALA HB1 H 1 1.37 0.02 . 1 . . . . 29 ALA MB . 16788 1 296 . 1 1 34 34 ALA HB2 H 1 1.37 0.02 . 1 . . . . 29 ALA MB . 16788 1 297 . 1 1 34 34 ALA HB3 H 1 1.37 0.02 . 1 . . . . 29 ALA MB . 16788 1 298 . 1 1 34 34 ALA CA C 13 56.05 0.2 . 1 . . . . 29 ALA CA . 16788 1 299 . 1 1 34 34 ALA CB C 13 18.35 0.2 . 1 . . . . 29 ALA CB . 16788 1 300 . 1 1 34 34 ALA N N 15 123.69 0.1 . 1 . . . . 29 ALA N . 16788 1 301 . 1 1 35 35 LYS H H 1 8.38 0.02 . 1 . . . . 30 LYS H . 16788 1 302 . 1 1 35 35 LYS HA H 1 4.17 0.02 . 1 . . . . 30 LYS HA . 16788 1 303 . 1 1 35 35 LYS HB2 H 1 1.86 0.02 . 2 . . . . 30 LYS HB2 . 16788 1 304 . 1 1 35 35 LYS HB3 H 1 1.86 0.02 . 2 . . . . 30 LYS HB3 . 16788 1 305 . 1 1 35 35 LYS HE2 H 1 3.08 0.02 . 2 . . . . 30 LYS HE2 . 16788 1 306 . 1 1 35 35 LYS HE3 H 1 3.08 0.02 . 2 . . . . 30 LYS HE3 . 16788 1 307 . 1 1 35 35 LYS HG2 H 1 1.57 0.02 . 2 . . . . 30 LYS HG2 . 16788 1 308 . 1 1 35 35 LYS HG3 H 1 1.76 0.02 . 2 . . . . 30 LYS HG3 . 16788 1 309 . 1 1 35 35 LYS CA C 13 59.75 0.2 . 1 . . . . 30 LYS CA . 16788 1 310 . 1 1 35 35 LYS CB C 13 32.09 0.2 . 1 . . . . 30 LYS CB . 16788 1 311 . 1 1 35 35 LYS CE C 13 41.62 0.2 . 1 . . . . 30 LYS CE . 16788 1 312 . 1 1 35 35 LYS CG C 13 25.44 0.2 . 1 . . . . 30 LYS CG . 16788 1 313 . 1 1 35 35 LYS N N 15 117.12 0.1 . 1 . . . . 30 LYS N . 16788 1 314 . 1 1 36 36 ARG H H 1 8.52 0.02 . 1 . . . . 31 ARG H . 16788 1 315 . 1 1 36 36 ARG HA H 1 4.30 0.02 . 1 . . . . 31 ARG HA . 16788 1 316 . 1 1 36 36 ARG HB2 H 1 1.95 0.02 . 2 . . . . 31 ARG HB2 . 16788 1 317 . 1 1 36 36 ARG HB3 H 1 2.09 0.02 . 2 . . . . 31 ARG HB3 . 16788 1 318 . 1 1 36 36 ARG HD2 H 1 3.25 0.02 . 2 . . . . 31 ARG HD2 . 16788 1 319 . 1 1 36 36 ARG HD3 H 1 3.25 0.02 . 2 . . . . 31 ARG HD3 . 16788 1 320 . 1 1 36 36 ARG HG2 H 1 1.83 0.02 . 2 . . . . 31 ARG HG2 . 16788 1 321 . 1 1 36 36 ARG HG3 H 1 1.83 0.02 . 2 . . . . 31 ARG HG3 . 16788 1 322 . 1 1 36 36 ARG CA C 13 58.75 0.2 . 1 . . . . 31 ARG CA . 16788 1 323 . 1 1 36 36 ARG CB C 13 30.27 0.2 . 1 . . . . 31 ARG CB . 16788 1 324 . 1 1 36 36 ARG CD C 13 43.60 0.2 . 1 . . . . 31 ARG CD . 16788 1 325 . 1 1 36 36 ARG CG C 13 27.57 0.2 . 1 . . . . 31 ARG CG . 16788 1 326 . 1 1 36 36 ARG N N 15 119.27 0.1 . 1 . . . . 31 ARG N . 16788 1 327 . 1 1 37 37 THR H H 1 7.37 0.02 . 1 . . . . 32 THR H . 16788 1 328 . 1 1 37 37 THR HA H 1 4.49 0.02 . 1 . . . . 32 THR HA . 16788 1 329 . 1 1 37 37 THR HB H 1 4.30 0.02 . 1 . . . . 32 THR HB . 16788 1 330 . 1 1 37 37 THR HG21 H 1 1.30 0.02 . 1 . . . . 32 THR MG . 16788 1 331 . 1 1 37 37 THR HG22 H 1 1.30 0.02 . 1 . . . . 32 THR MG . 16788 1 332 . 1 1 37 37 THR HG23 H 1 1.30 0.02 . 1 . . . . 32 THR MG . 16788 1 333 . 1 1 37 37 THR CA C 13 61.53 0.2 . 1 . . . . 32 THR CA . 16788 1 334 . 1 1 37 37 THR CB C 13 69.63 0.2 . 1 . . . . 32 THR CB . 16788 1 335 . 1 1 37 37 THR N N 15 105.14 0.1 . 1 . . . . 32 THR N . 16788 1 336 . 1 1 38 38 GLY H H 1 7.70 0.02 . 1 . . . . 33 GLY H . 16788 1 337 . 1 1 38 38 GLY HA2 H 1 3.85 0.02 . 2 . . . . 33 GLY HA2 . 16788 1 338 . 1 1 38 38 GLY HA3 H 1 4.31 0.02 . 2 . . . . 33 GLY HA3 . 16788 1 339 . 1 1 38 38 GLY CA C 13 46.03 0.2 . 1 . . . . 33 GLY CA . 16788 1 340 . 1 1 38 38 GLY N N 15 109.05 0.1 . 1 . . . . 33 GLY N . 16788 1 341 . 1 1 39 39 ALA H H 1 7.78 0.02 . 1 . . . . 34 ALA H . 16788 1 342 . 1 1 39 39 ALA HA H 1 4.72 0.02 . 1 . . . . 34 ALA HA . 16788 1 343 . 1 1 39 39 ALA HB1 H 1 1.40 0.02 . 1 . . . . 34 ALA MB . 16788 1 344 . 1 1 39 39 ALA HB2 H 1 1.40 0.02 . 1 . . . . 34 ALA MB . 16788 1 345 . 1 1 39 39 ALA HB3 H 1 1.40 0.02 . 1 . . . . 34 ALA MB . 16788 1 346 . 1 1 39 39 ALA CA C 13 50.39 0.2 . 1 . . . . 34 ALA CA . 16788 1 347 . 1 1 39 39 ALA CB C 13 21.42 0.2 . 1 . . . . 34 ALA CB . 16788 1 348 . 1 1 39 39 ALA N N 15 122.57 0.1 . 1 . . . . 34 ALA N . 16788 1 349 . 1 1 40 40 GLN H H 1 8.19 0.02 . 1 . . . . 35 GLN H . 16788 1 350 . 1 1 40 40 GLN HA H 1 4.63 0.02 . 1 . . . . 35 GLN HA . 16788 1 351 . 1 1 40 40 GLN HB3 H 1 2.13 0.02 . 2 . . . . 35 GLN HB3 . 16788 1 352 . 1 1 40 40 GLN HG3 H 1 2.38 0.02 . 2 . . . . 35 GLN HG3 . 16788 1 353 . 1 1 40 40 GLN CA C 13 54.26 0.2 . 1 . . . . 35 GLN CA . 16788 1 354 . 1 1 40 40 GLN CB C 13 31.77 0.2 . 1 . . . . 35 GLN CB . 16788 1 355 . 1 1 40 40 GLN CG C 13 33.82 0.2 . 1 . . . . 35 GLN CG . 16788 1 356 . 1 1 40 40 GLN N N 15 116.51 0.1 . 1 . . . . 35 GLN N . 16788 1 357 . 1 1 41 41 VAL H H 1 8.80 0.02 . 1 . . . . 36 VAL H . 16788 1 358 . 1 1 41 41 VAL HA H 1 5.16 0.02 . 1 . . . . 36 VAL HA . 16788 1 359 . 1 1 41 41 VAL HB H 1 1.91 0.02 . 1 . . . . 36 VAL HB . 16788 1 360 . 1 1 41 41 VAL HG11 H 1 0.90 0.02 . 2 . . . . 36 VAL MG1 . 16788 1 361 . 1 1 41 41 VAL HG12 H 1 0.90 0.02 . 2 . . . . 36 VAL MG1 . 16788 1 362 . 1 1 41 41 VAL HG13 H 1 0.90 0.02 . 2 . . . . 36 VAL MG1 . 16788 1 363 . 1 1 41 41 VAL HG21 H 1 0.90 0.02 . 2 . . . . 36 VAL MG2 . 16788 1 364 . 1 1 41 41 VAL HG22 H 1 0.90 0.02 . 2 . . . . 36 VAL MG2 . 16788 1 365 . 1 1 41 41 VAL HG23 H 1 0.90 0.02 . 2 . . . . 36 VAL MG2 . 16788 1 366 . 1 1 41 41 VAL CA C 13 59.85 0.2 . 1 . . . . 36 VAL CA . 16788 1 367 . 1 1 41 41 VAL CB C 13 35.08 0.2 . 1 . . . . 36 VAL CB . 16788 1 368 . 1 1 41 41 VAL CG1 C 13 21.54 0.2 . 2 . . . . 36 VAL CG1 . 16788 1 369 . 1 1 41 41 VAL N N 15 117.27 0.1 . 1 . . . . 36 VAL N . 16788 1 370 . 1 1 42 42 ARG H H 1 8.92 0.02 . 1 . . . . 37 ARG H . 16788 1 371 . 1 1 42 42 ARG HA H 1 5.20 0.02 . 1 . . . . 37 ARG HA . 16788 1 372 . 1 1 42 42 ARG HB2 H 1 1.88 0.02 . 2 . . . . 37 ARG HB2 . 16788 1 373 . 1 1 42 42 ARG HB3 H 1 1.88 0.02 . 2 . . . . 37 ARG HB3 . 16788 1 374 . 1 1 42 42 ARG HD2 H 1 3.01 0.02 . 2 . . . . 37 ARG HD2 . 16788 1 375 . 1 1 42 42 ARG HD3 H 1 3.01 0.02 . 2 . . . . 37 ARG HD3 . 16788 1 376 . 1 1 42 42 ARG HG2 H 1 1.46 0.02 . 2 . . . . 37 ARG HG2 . 16788 1 377 . 1 1 42 42 ARG HG3 H 1 1.46 0.02 . 2 . . . . 37 ARG HG3 . 16788 1 378 . 1 1 42 42 ARG CA C 13 54.67 0.2 . 1 . . . . 37 ARG CA . 16788 1 379 . 1 1 42 42 ARG CB C 13 31.59 0.2 . 1 . . . . 37 ARG CB . 16788 1 380 . 1 1 42 42 ARG CD C 13 43.70 0.2 . 1 . . . . 37 ARG CD . 16788 1 381 . 1 1 42 42 ARG CG C 13 26.64 0.2 . 1 . . . . 37 ARG CG . 16788 1 382 . 1 1 42 42 ARG N N 15 124.53 0.1 . 1 . . . . 37 ARG N . 16788 1 383 . 1 1 43 43 GLY H H 1 8.62 0.02 . 1 . . . . 38 GLY H . 16788 1 384 . 1 1 43 43 GLY HA2 H 1 3.57 0.02 . 2 . . . . 38 GLY HA2 . 16788 1 385 . 1 1 43 43 GLY HA3 H 1 3.57 0.02 . 2 . . . . 38 GLY HA3 . 16788 1 386 . 1 1 43 43 GLY CA C 13 44.27 0.2 . 1 . . . . 38 GLY CA . 16788 1 387 . 1 1 43 43 GLY N N 15 112.02 0.1 . 1 . . . . 38 GLY N . 16788 1 388 . 1 1 44 44 PRO HA H 1 5.33 0.02 . 1 . . . . 39 PRO HA . 16788 1 389 . 1 1 44 44 PRO CA C 13 61.66 0.2 . 1 . . . . 39 PRO CA . 16788 1 390 . 1 1 45 45 ILE H H 1 9.31 0.02 . 1 . . . . 40 ILE H . 16788 1 391 . 1 1 45 45 ILE HA H 1 5.25 0.02 . 1 . . . . 40 ILE HA . 16788 1 392 . 1 1 45 45 ILE HB H 1 1.92 0.02 . 1 . . . . 40 ILE HB . 16788 1 393 . 1 1 45 45 ILE HD11 H 1 0.85 0.02 . 1 . . . . 40 ILE MD . 16788 1 394 . 1 1 45 45 ILE HD12 H 1 0.85 0.02 . 1 . . . . 40 ILE MD . 16788 1 395 . 1 1 45 45 ILE HD13 H 1 0.85 0.02 . 1 . . . . 40 ILE MD . 16788 1 396 . 1 1 45 45 ILE HG12 H 1 1.25 0.02 . 2 . . . . 40 ILE HG12 . 16788 1 397 . 1 1 45 45 ILE HG13 H 1 1.52 0.02 . 2 . . . . 40 ILE HG13 . 16788 1 398 . 1 1 45 45 ILE HG21 H 1 1.05 0.02 . 1 . . . . 40 ILE MG . 16788 1 399 . 1 1 45 45 ILE HG22 H 1 1.05 0.02 . 1 . . . . 40 ILE MG . 16788 1 400 . 1 1 45 45 ILE HG23 H 1 1.05 0.02 . 1 . . . . 40 ILE MG . 16788 1 401 . 1 1 45 45 ILE CA C 13 56.36 0.2 . 1 . . . . 40 ILE CA . 16788 1 402 . 1 1 45 45 ILE CB C 13 40.91 0.2 . 1 . . . . 40 ILE CB . 16788 1 403 . 1 1 45 45 ILE CD1 C 13 12.39 0.2 . 1 . . . . 40 ILE CD1 . 16788 1 404 . 1 1 45 45 ILE CG1 C 13 25.46 0.2 . 1 . . . . 40 ILE CG1 . 16788 1 405 . 1 1 45 45 ILE CG2 C 13 18.16 0.2 . 1 . . . . 40 ILE CG2 . 16788 1 406 . 1 1 45 45 ILE N N 15 114.04 0.1 . 1 . . . . 40 ILE N . 16788 1 407 . 1 1 46 46 PRO HA H 1 5.18 0.02 . 1 . . . . 41 PRO HA . 16788 1 408 . 1 1 46 46 PRO CA C 13 61.25 0.2 . 1 . . . . 41 PRO CA . 16788 1 409 . 1 1 47 47 LEU H H 1 7.33 0.02 . 1 . . . . 42 LEU H . 16788 1 410 . 1 1 47 47 LEU HA H 1 4.99 0.02 . 1 . . . . 42 LEU HA . 16788 1 411 . 1 1 47 47 LEU HB2 H 1 1.58 0.02 . 2 . . . . 42 LEU HB2 . 16788 1 412 . 1 1 47 47 LEU HB3 H 1 1.58 0.02 . 2 . . . . 42 LEU HB3 . 16788 1 413 . 1 1 47 47 LEU HD11 H 1 0.91 0.02 . 2 . . . . 42 LEU MD1 . 16788 1 414 . 1 1 47 47 LEU HD12 H 1 0.91 0.02 . 2 . . . . 42 LEU MD1 . 16788 1 415 . 1 1 47 47 LEU HD13 H 1 0.91 0.02 . 2 . . . . 42 LEU MD1 . 16788 1 416 . 1 1 47 47 LEU HD21 H 1 0.91 0.02 . 2 . . . . 42 LEU MD2 . 16788 1 417 . 1 1 47 47 LEU HD22 H 1 0.91 0.02 . 2 . . . . 42 LEU MD2 . 16788 1 418 . 1 1 47 47 LEU HD23 H 1 0.91 0.02 . 2 . . . . 42 LEU MD2 . 16788 1 419 . 1 1 47 47 LEU HG H 1 0.90 0.02 . 1 . . . . 42 LEU HG . 16788 1 420 . 1 1 47 47 LEU CA C 13 51.71 0.2 . 1 . . . . 42 LEU CA . 16788 1 421 . 1 1 47 47 LEU CB C 13 41.38 0.2 . 1 . . . . 42 LEU CB . 16788 1 422 . 1 1 47 47 LEU CD1 C 13 22.75 0.2 . 2 . . . . 42 LEU CD1 . 16788 1 423 . 1 1 47 47 LEU CG C 13 25.36 0.2 . 1 . . . . 42 LEU CG . 16788 1 424 . 1 1 47 47 LEU N N 15 122.40 0.1 . 1 . . . . 42 LEU N . 16788 1 425 . 1 1 48 48 PRO HA H 1 3.85 0.02 . 1 . . . . 43 PRO HA . 16788 1 426 . 1 1 48 48 PRO HB2 H 1 1.89 0.02 . 2 . . . . 43 PRO HB2 . 16788 1 427 . 1 1 48 48 PRO HB3 H 1 1.89 0.02 . 2 . . . . 43 PRO HB3 . 16788 1 428 . 1 1 48 48 PRO CA C 13 64.03 0.2 . 1 . . . . 43 PRO CA . 16788 1 429 . 1 1 48 48 PRO CB C 13 31.39 0.2 . 1 . . . . 43 PRO CB . 16788 1 430 . 1 1 49 49 THR H H 1 8.36 0.02 . 1 . . . . 44 THR H . 16788 1 431 . 1 1 49 49 THR HA H 1 4.24 0.02 . 1 . . . . 44 THR HA . 16788 1 432 . 1 1 49 49 THR HB H 1 4.12 0.02 . 1 . . . . 44 THR HB . 16788 1 433 . 1 1 49 49 THR HG21 H 1 0.70 0.02 . 1 . . . . 44 THR MG . 16788 1 434 . 1 1 49 49 THR HG22 H 1 0.70 0.02 . 1 . . . . 44 THR MG . 16788 1 435 . 1 1 49 49 THR HG23 H 1 0.70 0.02 . 1 . . . . 44 THR MG . 16788 1 436 . 1 1 49 49 THR CA C 13 62.56 0.2 . 1 . . . . 44 THR CA . 16788 1 437 . 1 1 49 49 THR CB C 13 69.89 0.2 . 1 . . . . 44 THR CB . 16788 1 438 . 1 1 49 49 THR N N 15 120.35 0.1 . 1 . . . . 44 THR N . 16788 1 439 . 1 1 50 50 ARG H H 1 8.23 0.02 . 1 . . . . 45 ARG H . 16788 1 440 . 1 1 50 50 ARG HA H 1 4.63 0.02 . 1 . . . . 45 ARG HA . 16788 1 441 . 1 1 50 50 ARG HB2 H 1 1.68 0.02 . 2 . . . . 45 ARG HB2 . 16788 1 442 . 1 1 50 50 ARG HB3 H 1 1.81 0.02 . 2 . . . . 45 ARG HB3 . 16788 1 443 . 1 1 50 50 ARG HD2 H 1 3.21 0.02 . 2 . . . . 45 ARG HD2 . 16788 1 444 . 1 1 50 50 ARG HD3 H 1 3.21 0.02 . 2 . . . . 45 ARG HD3 . 16788 1 445 . 1 1 50 50 ARG HG2 H 1 1.55 0.02 . 2 . . . . 45 ARG HG2 . 16788 1 446 . 1 1 50 50 ARG HG3 H 1 1.68 0.02 . 2 . . . . 45 ARG HG3 . 16788 1 447 . 1 1 50 50 ARG CA C 13 54.30 0.2 . 1 . . . . 45 ARG CA . 16788 1 448 . 1 1 50 50 ARG CB C 13 31.73 0.2 . 1 . . . . 45 ARG CB . 16788 1 449 . 1 1 50 50 ARG CD C 13 43.37 0.2 . 1 . . . . 45 ARG CD . 16788 1 450 . 1 1 50 50 ARG CG C 13 26.71 0.2 . 1 . . . . 45 ARG CG . 16788 1 451 . 1 1 50 50 ARG N N 15 126.38 0.1 . 1 . . . . 45 ARG N . 16788 1 452 . 1 1 51 51 SER HA H 1 4.06 0.02 . 1 . . . . 46 SER HA . 16788 1 453 . 1 1 51 51 SER HB2 H 1 3.94 0.02 . 2 . . . . 46 SER HB2 . 16788 1 454 . 1 1 51 51 SER HB3 H 1 4.14 0.02 . 2 . . . . 46 SER HB3 . 16788 1 455 . 1 1 51 51 SER CA C 13 59.02 0.2 . 1 . . . . 46 SER CA . 16788 1 456 . 1 1 51 51 SER CB C 13 61.68 0.2 . 1 . . . . 46 SER CB . 16788 1 457 . 1 1 52 52 ARG HA H 1 3.77 0.02 . 1 . . . . 47 ARG HA . 16788 1 458 . 1 1 52 52 ARG HB2 H 1 1.92 0.02 . 2 . . . . 47 ARG HB2 . 16788 1 459 . 1 1 52 52 ARG HB3 H 1 1.92 0.02 . 2 . . . . 47 ARG HB3 . 16788 1 460 . 1 1 52 52 ARG HD2 H 1 3.26 0.02 . 2 . . . . 47 ARG HD2 . 16788 1 461 . 1 1 52 52 ARG HD3 H 1 3.26 0.02 . 2 . . . . 47 ARG HD3 . 16788 1 462 . 1 1 52 52 ARG HG2 H 1 1.67 0.02 . 2 . . . . 47 ARG HG2 . 16788 1 463 . 1 1 52 52 ARG HG3 H 1 1.74 0.02 . 2 . . . . 47 ARG HG3 . 16788 1 464 . 1 1 52 52 ARG CA C 13 57.21 0.2 . 1 . . . . 47 ARG CA . 16788 1 465 . 1 1 52 52 ARG CB C 13 30.36 0.2 . 1 . . . . 47 ARG CB . 16788 1 466 . 1 1 52 52 ARG CD C 13 43.32 0.2 . 1 . . . . 47 ARG CD . 16788 1 467 . 1 1 52 52 ARG CG C 13 26.85 0.2 . 1 . . . . 47 ARG CG . 16788 1 468 . 1 1 53 53 THR H H 1 7.90 0.02 . 1 . . . . 48 THR H . 16788 1 469 . 1 1 53 53 THR HA H 1 4.15 0.02 . 1 . . . . 48 THR HA . 16788 1 470 . 1 1 53 53 THR HB H 1 3.87 0.02 . 1 . . . . 48 THR HB . 16788 1 471 . 1 1 53 53 THR HG21 H 1 0.97 0.02 . 1 . . . . 48 THR MG . 16788 1 472 . 1 1 53 53 THR HG22 H 1 0.97 0.02 . 1 . . . . 48 THR MG . 16788 1 473 . 1 1 53 53 THR HG23 H 1 0.97 0.02 . 1 . . . . 48 THR MG . 16788 1 474 . 1 1 53 53 THR CA C 13 62.33 0.2 . 1 . . . . 48 THR CA . 16788 1 475 . 1 1 53 53 THR CB C 13 69.51 0.2 . 1 . . . . 48 THR CB . 16788 1 476 . 1 1 53 53 THR N N 15 114.23 0.1 . 1 . . . . 48 THR N . 16788 1 477 . 1 1 54 54 HIS H H 1 8.88 0.02 . 1 . . . . 49 HIS H . 16788 1 478 . 1 1 54 54 HIS HA H 1 4.75 0.02 . 1 . . . . 49 HIS HA . 16788 1 479 . 1 1 54 54 HIS HB2 H 1 2.85 0.02 . 2 . . . . 49 HIS HB2 . 16788 1 480 . 1 1 54 54 HIS HB3 H 1 2.85 0.02 . 2 . . . . 49 HIS HB3 . 16788 1 481 . 1 1 54 54 HIS HD2 H 1 6.99 0.02 . 1 . . . . 49 HIS HD2 . 16788 1 482 . 1 1 54 54 HIS HE1 H 1 7.45 0.02 . 1 . . . . 49 HIS HE1 . 16788 1 483 . 1 1 54 54 HIS CA C 13 55.65 0.2 . 1 . . . . 49 HIS CA . 16788 1 484 . 1 1 54 54 HIS CB C 13 32.87 0.2 . 1 . . . . 49 HIS CB . 16788 1 485 . 1 1 54 54 HIS N N 15 127.07 0.1 . 1 . . . . 49 HIS N . 16788 1 486 . 1 1 55 55 LEU H H 1 8.58 0.02 . 1 . . . . 50 LEU H . 16788 1 487 . 1 1 55 55 LEU HA H 1 5.64 0.02 . 1 . . . . 50 LEU HA . 16788 1 488 . 1 1 55 55 LEU HB2 H 1 1.41 0.02 . 2 . . . . 50 LEU HB2 . 16788 1 489 . 1 1 55 55 LEU HB3 H 1 1.65 0.02 . 2 . . . . 50 LEU HB3 . 16788 1 490 . 1 1 55 55 LEU HD11 H 1 0.90 0.02 . 2 . . . . 50 LEU MD1 . 16788 1 491 . 1 1 55 55 LEU HD12 H 1 0.90 0.02 . 2 . . . . 50 LEU MD1 . 16788 1 492 . 1 1 55 55 LEU HD13 H 1 0.90 0.02 . 2 . . . . 50 LEU MD1 . 16788 1 493 . 1 1 55 55 LEU HD21 H 1 0.90 0.02 . 2 . . . . 50 LEU MD2 . 16788 1 494 . 1 1 55 55 LEU HD22 H 1 0.90 0.02 . 2 . . . . 50 LEU MD2 . 16788 1 495 . 1 1 55 55 LEU HD23 H 1 0.90 0.02 . 2 . . . . 50 LEU MD2 . 16788 1 496 . 1 1 55 55 LEU HG H 1 1.65 0.02 . 1 . . . . 50 LEU HG . 16788 1 497 . 1 1 55 55 LEU CA C 13 54.03 0.2 . 1 . . . . 50 LEU CA . 16788 1 498 . 1 1 55 55 LEU CB C 13 48.65 0.2 . 1 . . . . 50 LEU CB . 16788 1 499 . 1 1 55 55 LEU CD1 C 13 25.49 0.2 . 2 . . . . 50 LEU CD1 . 16788 1 500 . 1 1 55 55 LEU CG C 13 27.72 0.2 . 1 . . . . 50 LEU CG . 16788 1 501 . 1 1 55 55 LEU N N 15 120.30 0.1 . 1 . . . . 50 LEU N . 16788 1 502 . 1 1 56 56 ARG H H 1 8.78 0.02 . 1 . . . . 51 ARG H . 16788 1 503 . 1 1 56 56 ARG HA H 1 5.24 0.02 . 1 . . . . 51 ARG HA . 16788 1 504 . 1 1 56 56 ARG CA C 13 53.54 0.2 . 1 . . . . 51 ARG CA . 16788 1 505 . 1 1 56 56 ARG N N 15 121.75 0.1 . 1 . . . . 51 ARG N . 16788 1 506 . 1 1 57 57 LEU H H 1 8.84 0.02 . 1 . . . . 52 LEU H . 16788 1 507 . 1 1 57 57 LEU HA H 1 5.47 0.02 . 1 . . . . 52 LEU HA . 16788 1 508 . 1 1 57 57 LEU HB2 H 1 1.60 0.02 . 2 . . . . 52 LEU HB2 . 16788 1 509 . 1 1 57 57 LEU HB3 H 1 1.74 0.02 . 2 . . . . 52 LEU HB3 . 16788 1 510 . 1 1 57 57 LEU HD11 H 1 0.89 0.02 . 2 . . . . 52 LEU MD1 . 16788 1 511 . 1 1 57 57 LEU HD12 H 1 0.89 0.02 . 2 . . . . 52 LEU MD1 . 16788 1 512 . 1 1 57 57 LEU HD13 H 1 0.89 0.02 . 2 . . . . 52 LEU MD1 . 16788 1 513 . 1 1 57 57 LEU HD21 H 1 0.89 0.02 . 2 . . . . 52 LEU MD2 . 16788 1 514 . 1 1 57 57 LEU HD22 H 1 0.89 0.02 . 2 . . . . 52 LEU MD2 . 16788 1 515 . 1 1 57 57 LEU HD23 H 1 0.89 0.02 . 2 . . . . 52 LEU MD2 . 16788 1 516 . 1 1 57 57 LEU HG H 1 1.59 0.02 . 1 . . . . 52 LEU HG . 16788 1 517 . 1 1 57 57 LEU CA C 13 53.72 0.2 . 1 . . . . 52 LEU CA . 16788 1 518 . 1 1 57 57 LEU CB C 13 45.65 0.2 . 1 . . . . 52 LEU CB . 16788 1 519 . 1 1 57 57 LEU CD1 C 13 25.52 0.2 . 2 . . . . 52 LEU CD1 . 16788 1 520 . 1 1 57 57 LEU CG C 13 27.50 0.2 . 1 . . . . 52 LEU CG . 16788 1 521 . 1 1 57 57 LEU N N 15 122.14 0.1 . 1 . . . . 52 LEU N . 16788 1 522 . 1 1 58 58 VAL H H 1 9.12 0.02 . 1 . . . . 53 VAL H . 16788 1 523 . 1 1 58 58 VAL HA H 1 4.48 0.02 . 1 . . . . 53 VAL HA . 16788 1 524 . 1 1 58 58 VAL HB H 1 2.06 0.02 . 1 . . . . 53 VAL HB . 16788 1 525 . 1 1 58 58 VAL HG11 H 1 0.90 0.02 . 2 . . . . 53 VAL MG1 . 16788 1 526 . 1 1 58 58 VAL HG12 H 1 0.90 0.02 . 2 . . . . 53 VAL MG1 . 16788 1 527 . 1 1 58 58 VAL HG13 H 1 0.90 0.02 . 2 . . . . 53 VAL MG1 . 16788 1 528 . 1 1 58 58 VAL HG21 H 1 0.90 0.02 . 2 . . . . 53 VAL MG2 . 16788 1 529 . 1 1 58 58 VAL HG22 H 1 0.90 0.02 . 2 . . . . 53 VAL MG2 . 16788 1 530 . 1 1 58 58 VAL HG23 H 1 0.90 0.02 . 2 . . . . 53 VAL MG2 . 16788 1 531 . 1 1 58 58 VAL CA C 13 61.88 0.2 . 1 . . . . 53 VAL CA . 16788 1 532 . 1 1 58 58 VAL CB C 13 35.25 0.2 . 1 . . . . 53 VAL CB . 16788 1 533 . 1 1 58 58 VAL CG1 C 13 21.37 0.2 . 2 . . . . 53 VAL CG1 . 16788 1 534 . 1 1 58 58 VAL N N 15 122.19 0.1 . 1 . . . . 53 VAL N . 16788 1 535 . 1 1 59 59 ASP H H 1 8.15 0.02 . 1 . . . . 54 ASP H . 16788 1 536 . 1 1 59 59 ASP HA H 1 5.90 0.02 . 1 . . . . 54 ASP HA . 16788 1 537 . 1 1 59 59 ASP CA C 13 52.47 0.2 . 1 . . . . 54 ASP CA . 16788 1 538 . 1 1 59 59 ASP N N 15 125.85 0.1 . 1 . . . . 54 ASP N . 16788 1 539 . 1 1 60 60 ILE H H 1 9.37 0.02 . 1 . . . . 55 ILE H . 16788 1 540 . 1 1 60 60 ILE HA H 1 4.72 0.02 . 1 . . . . 55 ILE HA . 16788 1 541 . 1 1 60 60 ILE HB H 1 1.89 0.02 . 1 . . . . 55 ILE HB . 16788 1 542 . 1 1 60 60 ILE HD11 H 1 0.77 0.02 . 1 . . . . 55 ILE MD . 16788 1 543 . 1 1 60 60 ILE HD12 H 1 0.77 0.02 . 1 . . . . 55 ILE MD . 16788 1 544 . 1 1 60 60 ILE HD13 H 1 0.77 0.02 . 1 . . . . 55 ILE MD . 16788 1 545 . 1 1 60 60 ILE HG12 H 1 1.06 0.02 . 2 . . . . 55 ILE HG12 . 16788 1 546 . 1 1 60 60 ILE HG13 H 1 1.52 0.02 . 2 . . . . 55 ILE HG13 . 16788 1 547 . 1 1 60 60 ILE HG21 H 1 0.83 0.02 . 1 . . . . 55 ILE MG . 16788 1 548 . 1 1 60 60 ILE HG22 H 1 0.83 0.02 . 1 . . . . 55 ILE MG . 16788 1 549 . 1 1 60 60 ILE HG23 H 1 0.83 0.02 . 1 . . . . 55 ILE MG . 16788 1 550 . 1 1 60 60 ILE CA C 13 59.52 0.2 . 1 . . . . 55 ILE CA . 16788 1 551 . 1 1 60 60 ILE CB C 13 38.64 0.2 . 1 . . . . 55 ILE CB . 16788 1 552 . 1 1 60 60 ILE CD1 C 13 13.61 0.2 . 1 . . . . 55 ILE CD1 . 16788 1 553 . 1 1 60 60 ILE CG1 C 13 27.80 0.2 . 1 . . . . 55 ILE CG1 . 16788 1 554 . 1 1 60 60 ILE CG2 C 13 18.81 0.2 . 1 . . . . 55 ILE CG2 . 16788 1 555 . 1 1 60 60 ILE N N 15 122.46 0.1 . 1 . . . . 55 ILE N . 16788 1 556 . 1 1 61 61 VAL H H 1 8.77 0.02 . 1 . . . . 56 VAL H . 16788 1 557 . 1 1 61 61 VAL HA H 1 4.51 0.02 . 1 . . . . 56 VAL HA . 16788 1 558 . 1 1 61 61 VAL HB H 1 1.87 0.02 . 1 . . . . 56 VAL HB . 16788 1 559 . 1 1 61 61 VAL HG11 H 1 0.73 0.02 . 2 . . . . 56 VAL MG1 . 16788 1 560 . 1 1 61 61 VAL HG12 H 1 0.73 0.02 . 2 . . . . 56 VAL MG1 . 16788 1 561 . 1 1 61 61 VAL HG13 H 1 0.73 0.02 . 2 . . . . 56 VAL MG1 . 16788 1 562 . 1 1 61 61 VAL HG21 H 1 0.73 0.02 . 2 . . . . 56 VAL MG2 . 16788 1 563 . 1 1 61 61 VAL HG22 H 1 0.73 0.02 . 2 . . . . 56 VAL MG2 . 16788 1 564 . 1 1 61 61 VAL HG23 H 1 0.73 0.02 . 2 . . . . 56 VAL MG2 . 16788 1 565 . 1 1 61 61 VAL CA C 13 60.54 0.2 . 1 . . . . 56 VAL CA . 16788 1 566 . 1 1 61 61 VAL CB C 13 31.62 0.2 . 1 . . . . 56 VAL CB . 16788 1 567 . 1 1 61 61 VAL CG1 C 13 21.37 0.2 . 2 . . . . 56 VAL CG1 . 16788 1 568 . 1 1 61 61 VAL N N 15 126.22 0.1 . 1 . . . . 56 VAL N . 16788 1 569 . 1 1 62 62 GLU H H 1 9.00 0.02 . 1 . . . . 57 GLU H . 16788 1 570 . 1 1 62 62 GLU HA H 1 4.49 0.02 . 1 . . . . 57 GLU HA . 16788 1 571 . 1 1 62 62 GLU HB2 H 1 2.07 0.02 . 2 . . . . 57 GLU HB2 . 16788 1 572 . 1 1 62 62 GLU HB3 H 1 2.13 0.02 . 2 . . . . 57 GLU HB3 . 16788 1 573 . 1 1 62 62 GLU HG2 H 1 2.30 0.02 . 2 . . . . 57 GLU HG2 . 16788 1 574 . 1 1 62 62 GLU HG3 H 1 2.30 0.02 . 2 . . . . 57 GLU HG3 . 16788 1 575 . 1 1 62 62 GLU CA C 13 55.88 0.2 . 1 . . . . 57 GLU CA . 16788 1 576 . 1 1 62 62 GLU CB C 13 29.71 0.2 . 1 . . . . 57 GLU CB . 16788 1 577 . 1 1 62 62 GLU CG C 13 34.22 0.2 . 1 . . . . 57 GLU CG . 16788 1 578 . 1 1 62 62 GLU N N 15 118.84 0.1 . 1 . . . . 57 GLU N . 16788 1 579 . 1 1 63 63 PRO HA H 1 4.52 0.02 . 1 . . . . 58 PRO HA . 16788 1 580 . 1 1 63 63 PRO HB2 H 1 2.01 0.02 . 2 . . . . 58 PRO HB2 . 16788 1 581 . 1 1 63 63 PRO HB3 H 1 2.30 0.02 . 2 . . . . 58 PRO HB3 . 16788 1 582 . 1 1 63 63 PRO HD2 H 1 3.77 0.02 . 2 . . . . 58 PRO HD2 . 16788 1 583 . 1 1 63 63 PRO HD3 H 1 3.86 0.02 . 2 . . . . 58 PRO HD3 . 16788 1 584 . 1 1 63 63 PRO HG2 H 1 2.05 0.02 . 2 . . . . 58 PRO HG2 . 16788 1 585 . 1 1 63 63 PRO HG3 H 1 2.08 0.02 . 2 . . . . 58 PRO HG3 . 16788 1 586 . 1 1 63 63 PRO CA C 13 63.36 0.2 . 1 . . . . 58 PRO CA . 16788 1 587 . 1 1 63 63 PRO CB C 13 32.16 0.2 . 1 . . . . 58 PRO CB . 16788 1 588 . 1 1 63 63 PRO CD C 13 50.81 0.2 . 1 . . . . 58 PRO CD . 16788 1 589 . 1 1 63 63 PRO CG C 13 27.45 0.2 . 1 . . . . 58 PRO CG . 16788 1 590 . 1 1 64 64 THR H H 1 7.70 0.02 . 1 . . . . 59 THR H . 16788 1 591 . 1 1 64 64 THR HA H 1 4.82 0.02 . 1 . . . . 59 THR HA . 16788 1 592 . 1 1 64 64 THR HB H 1 4.84 0.02 . 1 . . . . 59 THR HB . 16788 1 593 . 1 1 64 64 THR HG21 H 1 1.40 0.02 . 1 . . . . 59 THR MG . 16788 1 594 . 1 1 64 64 THR HG22 H 1 1.40 0.02 . 1 . . . . 59 THR MG . 16788 1 595 . 1 1 64 64 THR HG23 H 1 1.40 0.02 . 1 . . . . 59 THR MG . 16788 1 596 . 1 1 64 64 THR CA C 13 59.63 0.2 . 1 . . . . 59 THR CA . 16788 1 597 . 1 1 64 64 THR CB C 13 72.42 0.2 . 1 . . . . 59 THR CB . 16788 1 598 . 1 1 64 64 THR N N 15 109.05 0.1 . 1 . . . . 59 THR N . 16788 1 599 . 1 1 65 65 GLU HA H 1 4.18 0.02 . 1 . . . . 60 GLU HA . 16788 1 600 . 1 1 65 65 GLU HB2 H 1 2.17 0.02 . 2 . . . . 60 GLU HB2 . 16788 1 601 . 1 1 65 65 GLU HB3 H 1 2.17 0.02 . 2 . . . . 60 GLU HB3 . 16788 1 602 . 1 1 65 65 GLU HG2 H 1 2.22 0.02 . 2 . . . . 60 GLU HG2 . 16788 1 603 . 1 1 65 65 GLU HG3 H 1 2.39 0.02 . 2 . . . . 60 GLU HG3 . 16788 1 604 . 1 1 65 65 GLU CA C 13 59.61 0.2 . 1 . . . . 60 GLU CA . 16788 1 605 . 1 1 65 65 GLU CB C 13 28.87 0.2 . 1 . . . . 60 GLU CB . 16788 1 606 . 1 1 65 65 GLU CG C 13 36.31 0.2 . 1 . . . . 60 GLU CG . 16788 1 607 . 1 1 66 66 LYS H H 1 7.79 0.02 . 1 . . . . 61 LYS H . 16788 1 608 . 1 1 66 66 LYS HA H 1 4.30 0.02 . 1 . . . . 61 LYS HA . 16788 1 609 . 1 1 66 66 LYS HB2 H 1 1.91 0.02 . 2 . . . . 61 LYS HB2 . 16788 1 610 . 1 1 66 66 LYS HB3 H 1 1.91 0.02 . 2 . . . . 61 LYS HB3 . 16788 1 611 . 1 1 66 66 LYS HD2 H 1 1.72 0.02 . 2 . . . . 61 LYS HD2 . 16788 1 612 . 1 1 66 66 LYS HD3 H 1 1.72 0.02 . 2 . . . . 61 LYS HD3 . 16788 1 613 . 1 1 66 66 LYS HE2 H 1 3.04 0.02 . 2 . . . . 61 LYS HE2 . 16788 1 614 . 1 1 66 66 LYS HE3 H 1 3.04 0.02 . 2 . . . . 61 LYS HE3 . 16788 1 615 . 1 1 66 66 LYS HG2 H 1 1.55 0.02 . 2 . . . . 61 LYS HG2 . 16788 1 616 . 1 1 66 66 LYS HG3 H 1 1.67 0.02 . 2 . . . . 61 LYS HG3 . 16788 1 617 . 1 1 66 66 LYS CA C 13 58.27 0.2 . 1 . . . . 61 LYS CA . 16788 1 618 . 1 1 66 66 LYS CB C 13 32.63 0.2 . 1 . . . . 61 LYS CB . 16788 1 619 . 1 1 66 66 LYS CD C 13 28.61 0.2 . 1 . . . . 61 LYS CD . 16788 1 620 . 1 1 66 66 LYS CE C 13 41.93 0.2 . 1 . . . . 61 LYS CE . 16788 1 621 . 1 1 66 66 LYS CG C 13 25.32 0.2 . 1 . . . . 61 LYS CG . 16788 1 622 . 1 1 66 66 LYS N N 15 117.50 0.1 . 1 . . . . 61 LYS N . 16788 1 623 . 1 1 67 67 THR H H 1 8.00 0.02 . 1 . . . . 62 THR H . 16788 1 624 . 1 1 67 67 THR HA H 1 4.13 0.02 . 1 . . . . 62 THR HA . 16788 1 625 . 1 1 67 67 THR HB H 1 4.27 0.02 . 1 . . . . 62 THR HB . 16788 1 626 . 1 1 67 67 THR HG21 H 1 1.11 0.02 . 1 . . . . 62 THR MG . 16788 1 627 . 1 1 67 67 THR HG22 H 1 1.11 0.02 . 1 . . . . 62 THR MG . 16788 1 628 . 1 1 67 67 THR HG23 H 1 1.11 0.02 . 1 . . . . 62 THR MG . 16788 1 629 . 1 1 67 67 THR CA C 13 66.70 0.2 . 1 . . . . 62 THR CA . 16788 1 630 . 1 1 67 67 THR CB C 13 68.71 0.2 . 1 . . . . 62 THR CB . 16788 1 631 . 1 1 67 67 THR N N 15 119.00 0.1 . 1 . . . . 62 THR N . 16788 1 632 . 1 1 68 68 VAL H H 1 7.87 0.02 . 1 . . . . 63 VAL H . 16788 1 633 . 1 1 68 68 VAL HA H 1 3.26 0.02 . 1 . . . . 63 VAL HA . 16788 1 634 . 1 1 68 68 VAL HB H 1 2.10 0.02 . 1 . . . . 63 VAL HB . 16788 1 635 . 1 1 68 68 VAL HG11 H 1 0.78 0.02 . 2 . . . . 63 VAL MG1 . 16788 1 636 . 1 1 68 68 VAL HG12 H 1 0.78 0.02 . 2 . . . . 63 VAL MG1 . 16788 1 637 . 1 1 68 68 VAL HG13 H 1 0.78 0.02 . 2 . . . . 63 VAL MG1 . 16788 1 638 . 1 1 68 68 VAL HG21 H 1 0.85 0.02 . 2 . . . . 63 VAL MG2 . 16788 1 639 . 1 1 68 68 VAL HG22 H 1 0.85 0.02 . 2 . . . . 63 VAL MG2 . 16788 1 640 . 1 1 68 68 VAL HG23 H 1 0.85 0.02 . 2 . . . . 63 VAL MG2 . 16788 1 641 . 1 1 68 68 VAL CA C 13 68.15 0.2 . 1 . . . . 63 VAL CA . 16788 1 642 . 1 1 68 68 VAL CB C 13 31.35 0.2 . 1 . . . . 63 VAL CB . 16788 1 643 . 1 1 68 68 VAL CG1 C 13 22.92 0.2 . 2 . . . . 63 VAL CG1 . 16788 1 644 . 1 1 68 68 VAL CG2 C 13 21.63 0.2 . 2 . . . . 63 VAL CG2 . 16788 1 645 . 1 1 68 68 VAL N N 15 120.39 0.1 . 1 . . . . 63 VAL N . 16788 1 646 . 1 1 69 69 ASP H H 1 7.95 0.02 . 1 . . . . 64 ASP H . 16788 1 647 . 1 1 69 69 ASP HA H 1 4.25 0.02 . 1 . . . . 64 ASP HA . 16788 1 648 . 1 1 69 69 ASP HB2 H 1 2.59 0.02 . 2 . . . . 64 ASP HB2 . 16788 1 649 . 1 1 69 69 ASP HB3 H 1 2.81 0.02 . 2 . . . . 64 ASP HB3 . 16788 1 650 . 1 1 69 69 ASP CA C 13 57.88 0.2 . 1 . . . . 64 ASP CA . 16788 1 651 . 1 1 69 69 ASP CB C 13 42.27 0.2 . 1 . . . . 64 ASP CB . 16788 1 652 . 1 1 69 69 ASP N N 15 118.63 0.1 . 1 . . . . 64 ASP N . 16788 1 653 . 1 1 70 70 ALA H H 1 7.82 0.02 . 1 . . . . 65 ALA H . 16788 1 654 . 1 1 70 70 ALA HA H 1 4.06 0.02 . 1 . . . . 65 ALA HA . 16788 1 655 . 1 1 70 70 ALA HB1 H 1 1.49 0.02 . 1 . . . . 65 ALA MB . 16788 1 656 . 1 1 70 70 ALA HB2 H 1 1.49 0.02 . 1 . . . . 65 ALA MB . 16788 1 657 . 1 1 70 70 ALA HB3 H 1 1.49 0.02 . 1 . . . . 65 ALA MB . 16788 1 658 . 1 1 70 70 ALA CA C 13 54.97 0.2 . 1 . . . . 65 ALA CA . 16788 1 659 . 1 1 70 70 ALA CB C 13 19.38 0.2 . 1 . . . . 65 ALA CB . 16788 1 660 . 1 1 70 70 ALA N N 15 118.40 0.1 . 1 . . . . 65 ALA N . 16788 1 661 . 1 1 71 71 LEU H H 1 8.23 0.02 . 1 . . . . 66 LEU H . 16788 1 662 . 1 1 71 71 LEU HA H 1 4.06 0.02 . 1 . . . . 66 LEU HA . 16788 1 663 . 1 1 71 71 LEU HB2 H 1 1.51 0.02 . 2 . . . . 66 LEU HB2 . 16788 1 664 . 1 1 71 71 LEU HB3 H 1 1.91 0.02 . 2 . . . . 66 LEU HB3 . 16788 1 665 . 1 1 71 71 LEU CA C 13 57.14 0.2 . 1 . . . . 66 LEU CA . 16788 1 666 . 1 1 71 71 LEU CB C 13 42.05 0.2 . 1 . . . . 66 LEU CB . 16788 1 667 . 1 1 71 71 LEU N N 15 117.79 0.1 . 1 . . . . 66 LEU N . 16788 1 668 . 1 1 72 72 MET H H 1 8.06 0.02 . 1 . . . . 67 MET H . 16788 1 669 . 1 1 72 72 MET HA H 1 4.15 0.02 . 1 . . . . 67 MET HA . 16788 1 670 . 1 1 72 72 MET HB2 H 1 2.06 0.02 . 2 . . . . 67 MET HB2 . 16788 1 671 . 1 1 72 72 MET HB3 H 1 2.13 0.02 . 2 . . . . 67 MET HB3 . 16788 1 672 . 1 1 72 72 MET HE1 H 1 1.89 0.02 . 1 . . . . 67 MET ME . 16788 1 673 . 1 1 72 72 MET HE2 H 1 1.89 0.02 . 1 . . . . 67 MET ME . 16788 1 674 . 1 1 72 72 MET HE3 H 1 1.89 0.02 . 1 . . . . 67 MET ME . 16788 1 675 . 1 1 72 72 MET HG2 H 1 2.71 0.02 . 2 . . . . 67 MET HG2 . 16788 1 676 . 1 1 72 72 MET HG3 H 1 2.86 0.02 . 2 . . . . 67 MET HG3 . 16788 1 677 . 1 1 72 72 MET CA C 13 58.95 0.2 . 1 . . . . 67 MET CA . 16788 1 678 . 1 1 72 72 MET CB C 13 32.81 0.2 . 1 . . . . 67 MET CB . 16788 1 679 . 1 1 72 72 MET CE C 13 16.91 0.2 . 1 . . . . 67 MET CE . 16788 1 680 . 1 1 72 72 MET CG C 13 32.36 0.2 . 1 . . . . 67 MET CG . 16788 1 681 . 1 1 72 72 MET N N 15 116.35 0.1 . 1 . . . . 67 MET N . 16788 1 682 . 1 1 73 73 ARG H H 1 7.17 0.02 . 1 . . . . 68 ARG H . 16788 1 683 . 1 1 73 73 ARG HA H 1 4.38 0.02 . 1 . . . . 68 ARG HA . 16788 1 684 . 1 1 73 73 ARG HB2 H 1 1.68 0.02 . 2 . . . . 68 ARG HB2 . 16788 1 685 . 1 1 73 73 ARG HB3 H 1 2.06 0.02 . 2 . . . . 68 ARG HB3 . 16788 1 686 . 1 1 73 73 ARG HD2 H 1 3.09 0.02 . 2 . . . . 68 ARG HD2 . 16788 1 687 . 1 1 73 73 ARG HD3 H 1 3.09 0.02 . 2 . . . . 68 ARG HD3 . 16788 1 688 . 1 1 73 73 ARG HG2 H 1 1.76 0.02 . 2 . . . . 68 ARG HG2 . 16788 1 689 . 1 1 73 73 ARG HG3 H 1 1.76 0.02 . 2 . . . . 68 ARG HG3 . 16788 1 690 . 1 1 73 73 ARG CA C 13 55.88 0.2 . 1 . . . . 68 ARG CA . 16788 1 691 . 1 1 73 73 ARG CB C 13 30.89 0.2 . 1 . . . . 68 ARG CB . 16788 1 692 . 1 1 73 73 ARG CD C 13 42.99 0.2 . 1 . . . . 68 ARG CD . 16788 1 693 . 1 1 73 73 ARG CG C 13 27.18 0.2 . 1 . . . . 68 ARG CG . 16788 1 694 . 1 1 73 73 ARG N N 15 115.84 0.1 . 1 . . . . 68 ARG N . 16788 1 695 . 1 1 74 74 LEU H H 1 7.04 0.02 . 1 . . . . 69 LEU H . 16788 1 696 . 1 1 74 74 LEU HA H 1 4.22 0.02 . 1 . . . . 69 LEU HA . 16788 1 697 . 1 1 74 74 LEU HB2 H 1 1.79 0.02 . 2 . . . . 69 LEU HB2 . 16788 1 698 . 1 1 74 74 LEU HB3 H 1 1.94 0.02 . 2 . . . . 69 LEU HB3 . 16788 1 699 . 1 1 74 74 LEU HD11 H 1 0.92 0.02 . 2 . . . . 69 LEU MD1 . 16788 1 700 . 1 1 74 74 LEU HD12 H 1 0.92 0.02 . 2 . . . . 69 LEU MD1 . 16788 1 701 . 1 1 74 74 LEU HD13 H 1 0.92 0.02 . 2 . . . . 69 LEU MD1 . 16788 1 702 . 1 1 74 74 LEU HD21 H 1 0.92 0.02 . 2 . . . . 69 LEU MD2 . 16788 1 703 . 1 1 74 74 LEU HD22 H 1 0.92 0.02 . 2 . . . . 69 LEU MD2 . 16788 1 704 . 1 1 74 74 LEU HD23 H 1 0.92 0.02 . 2 . . . . 69 LEU MD2 . 16788 1 705 . 1 1 74 74 LEU CA C 13 55.23 0.2 . 1 . . . . 69 LEU CA . 16788 1 706 . 1 1 74 74 LEU CB C 13 43.13 0.2 . 1 . . . . 69 LEU CB . 16788 1 707 . 1 1 74 74 LEU CD1 C 13 25.10 0.2 . 2 . . . . 69 LEU CD1 . 16788 1 708 . 1 1 74 74 LEU N N 15 123.33 0.1 . 1 . . . . 69 LEU N . 16788 1 709 . 1 1 75 75 ASP H H 1 8.38 0.02 . 1 . . . . 70 ASP H . 16788 1 710 . 1 1 75 75 ASP HA H 1 4.68 0.02 . 1 . . . . 70 ASP HA . 16788 1 711 . 1 1 75 75 ASP HB2 H 1 2.47 0.02 . 2 . . . . 70 ASP HB2 . 16788 1 712 . 1 1 75 75 ASP HB3 H 1 2.72 0.02 . 2 . . . . 70 ASP HB3 . 16788 1 713 . 1 1 75 75 ASP CA C 13 53.27 0.2 . 1 . . . . 70 ASP CA . 16788 1 714 . 1 1 75 75 ASP CB C 13 40.82 0.2 . 1 . . . . 70 ASP CB . 16788 1 715 . 1 1 75 75 ASP N N 15 125.36 0.1 . 1 . . . . 70 ASP N . 16788 1 716 . 1 1 76 76 LEU H H 1 7.66 0.02 . 1 . . . . 71 LEU H . 16788 1 717 . 1 1 76 76 LEU HA H 1 4.32 0.02 . 1 . . . . 71 LEU HA . 16788 1 718 . 1 1 76 76 LEU HB2 H 1 1.48 0.02 . 2 . . . . 71 LEU HB2 . 16788 1 719 . 1 1 76 76 LEU HB3 H 1 1.54 0.02 . 2 . . . . 71 LEU HB3 . 16788 1 720 . 1 1 76 76 LEU HD11 H 1 0.61 0.02 . 2 . . . . 71 LEU MD1 . 16788 1 721 . 1 1 76 76 LEU HD12 H 1 0.61 0.02 . 2 . . . . 71 LEU MD1 . 16788 1 722 . 1 1 76 76 LEU HD13 H 1 0.61 0.02 . 2 . . . . 71 LEU MD1 . 16788 1 723 . 1 1 76 76 LEU HD21 H 1 0.47 0.02 . 2 . . . . 71 LEU MD2 . 16788 1 724 . 1 1 76 76 LEU HD22 H 1 0.47 0.02 . 2 . . . . 71 LEU MD2 . 16788 1 725 . 1 1 76 76 LEU HD23 H 1 0.47 0.02 . 2 . . . . 71 LEU MD2 . 16788 1 726 . 1 1 76 76 LEU CA C 13 53.91 0.2 . 1 . . . . 71 LEU CA . 16788 1 727 . 1 1 76 76 LEU CB C 13 43.89 0.2 . 1 . . . . 71 LEU CB . 16788 1 728 . 1 1 76 76 LEU CD1 C 13 23.97 0.2 . 2 . . . . 71 LEU CD1 . 16788 1 729 . 1 1 76 76 LEU CD2 C 13 23.97 0.2 . 2 . . . . 71 LEU CD2 . 16788 1 730 . 1 1 76 76 LEU N N 15 124.46 0.1 . 1 . . . . 71 LEU N . 16788 1 731 . 1 1 77 77 ALA H H 1 8.70 0.02 . 1 . . . . 72 ALA H . 16788 1 732 . 1 1 77 77 ALA HA H 1 4.18 0.02 . 1 . . . . 72 ALA HA . 16788 1 733 . 1 1 77 77 ALA HB1 H 1 1.48 0.02 . 1 . . . . 72 ALA MB . 16788 1 734 . 1 1 77 77 ALA HB2 H 1 1.48 0.02 . 1 . . . . 72 ALA MB . 16788 1 735 . 1 1 77 77 ALA HB3 H 1 1.48 0.02 . 1 . . . . 72 ALA MB . 16788 1 736 . 1 1 77 77 ALA CA C 13 53.93 0.2 . 1 . . . . 72 ALA CA . 16788 1 737 . 1 1 77 77 ALA CB C 13 18.85 0.2 . 1 . . . . 72 ALA CB . 16788 1 738 . 1 1 77 77 ALA N N 15 126.41 0.1 . 1 . . . . 72 ALA N . 16788 1 739 . 1 1 78 78 ALA H H 1 8.44 0.02 . 1 . . . . 73 ALA H . 16788 1 740 . 1 1 78 78 ALA HA H 1 4.11 0.02 . 1 . . . . 73 ALA HA . 16788 1 741 . 1 1 78 78 ALA HB1 H 1 1.43 0.02 . 1 . . . . 73 ALA MB . 16788 1 742 . 1 1 78 78 ALA HB2 H 1 1.43 0.02 . 1 . . . . 73 ALA MB . 16788 1 743 . 1 1 78 78 ALA HB3 H 1 1.43 0.02 . 1 . . . . 73 ALA MB . 16788 1 744 . 1 1 78 78 ALA CA C 13 52.90 0.2 . 1 . . . . 73 ALA CA . 16788 1 745 . 1 1 78 78 ALA CB C 13 19.30 0.2 . 1 . . . . 73 ALA CB . 16788 1 746 . 1 1 78 78 ALA N N 15 124.13 0.1 . 1 . . . . 73 ALA N . 16788 1 747 . 1 1 79 79 GLY H H 1 8.46 0.02 . 1 . . . . 74 GLY H . 16788 1 748 . 1 1 79 79 GLY HA2 H 1 3.94 0.02 . 2 . . . . 74 GLY HA2 . 16788 1 749 . 1 1 79 79 GLY HA3 H 1 4.00 0.02 . 2 . . . . 74 GLY HA3 . 16788 1 750 . 1 1 79 79 GLY CA C 13 45.19 0.2 . 1 . . . . 74 GLY CA . 16788 1 751 . 1 1 79 79 GLY N N 15 104.97 0.1 . 1 . . . . 74 GLY N . 16788 1 752 . 1 1 80 80 VAL H H 1 7.80 0.02 . 1 . . . . 75 VAL H . 16788 1 753 . 1 1 80 80 VAL HA H 1 4.59 0.02 . 1 . . . . 75 VAL HA . 16788 1 754 . 1 1 80 80 VAL HB H 1 2.10 0.02 . 1 . . . . 75 VAL HB . 16788 1 755 . 1 1 80 80 VAL HG11 H 1 0.81 0.02 . 2 . . . . 75 VAL MG1 . 16788 1 756 . 1 1 80 80 VAL HG12 H 1 0.81 0.02 . 2 . . . . 75 VAL MG1 . 16788 1 757 . 1 1 80 80 VAL HG13 H 1 0.81 0.02 . 2 . . . . 75 VAL MG1 . 16788 1 758 . 1 1 80 80 VAL HG21 H 1 0.74 0.02 . 2 . . . . 75 VAL MG2 . 16788 1 759 . 1 1 80 80 VAL HG22 H 1 0.74 0.02 . 2 . . . . 75 VAL MG2 . 16788 1 760 . 1 1 80 80 VAL HG23 H 1 0.74 0.02 . 2 . . . . 75 VAL MG2 . 16788 1 761 . 1 1 80 80 VAL CA C 13 61.03 0.2 . 1 . . . . 75 VAL CA . 16788 1 762 . 1 1 80 80 VAL CB C 13 32.88 0.2 . 1 . . . . 75 VAL CB . 16788 1 763 . 1 1 80 80 VAL CG1 C 13 21.86 0.2 . 2 . . . . 75 VAL CG1 . 16788 1 764 . 1 1 80 80 VAL CG2 C 13 21.86 0.2 . 2 . . . . 75 VAL CG2 . 16788 1 765 . 1 1 80 80 VAL N N 15 121.48 0.1 . 1 . . . . 75 VAL N . 16788 1 766 . 1 1 81 81 ASP H H 1 9.25 0.02 . 1 . . . . 76 ASP H . 16788 1 767 . 1 1 81 81 ASP HA H 1 4.84 0.02 . 1 . . . . 76 ASP HA . 16788 1 768 . 1 1 81 81 ASP HB2 H 1 2.58 0.02 . 2 . . . . 76 ASP HB2 . 16788 1 769 . 1 1 81 81 ASP HB3 H 1 2.72 0.02 . 2 . . . . 76 ASP HB3 . 16788 1 770 . 1 1 81 81 ASP CA C 13 53.88 0.2 . 1 . . . . 76 ASP CA . 16788 1 771 . 1 1 81 81 ASP CB C 13 43.97 0.2 . 1 . . . . 76 ASP CB . 16788 1 772 . 1 1 81 81 ASP N N 15 128.30 0.1 . 1 . . . . 76 ASP N . 16788 1 773 . 1 1 82 82 VAL H H 1 8.19 0.02 . 1 . . . . 77 VAL H . 16788 1 774 . 1 1 82 82 VAL HA H 1 5.11 0.02 . 1 . . . . 77 VAL HA . 16788 1 775 . 1 1 82 82 VAL HB H 1 1.77 0.02 . 1 . . . . 77 VAL HB . 16788 1 776 . 1 1 82 82 VAL HG11 H 1 0.80 0.02 . 2 . . . . 77 VAL MG1 . 16788 1 777 . 1 1 82 82 VAL HG12 H 1 0.80 0.02 . 2 . . . . 77 VAL MG1 . 16788 1 778 . 1 1 82 82 VAL HG13 H 1 0.80 0.02 . 2 . . . . 77 VAL MG1 . 16788 1 779 . 1 1 82 82 VAL HG21 H 1 0.67 0.02 . 2 . . . . 77 VAL MG2 . 16788 1 780 . 1 1 82 82 VAL HG22 H 1 0.67 0.02 . 2 . . . . 77 VAL MG2 . 16788 1 781 . 1 1 82 82 VAL HG23 H 1 0.67 0.02 . 2 . . . . 77 VAL MG2 . 16788 1 782 . 1 1 82 82 VAL CA C 13 59.90 0.2 . 1 . . . . 77 VAL CA . 16788 1 783 . 1 1 82 82 VAL CB C 13 35.19 0.2 . 1 . . . . 77 VAL CB . 16788 1 784 . 1 1 82 82 VAL CG1 C 13 21.31 0.2 . 2 . . . . 77 VAL CG1 . 16788 1 785 . 1 1 82 82 VAL CG2 C 13 21.31 0.2 . 2 . . . . 77 VAL CG2 . 16788 1 786 . 1 1 82 82 VAL N N 15 121.38 0.1 . 1 . . . . 77 VAL N . 16788 1 787 . 1 1 83 83 GLN H H 1 8.57 0.02 . 1 . . . . 78 GLN H . 16788 1 788 . 1 1 83 83 GLN HA H 1 4.74 0.02 . 1 . . . . 78 GLN HA . 16788 1 789 . 1 1 83 83 GLN HB2 H 1 1.97 0.02 . 2 . . . . 78 GLN HB2 . 16788 1 790 . 1 1 83 83 GLN HB3 H 1 2.17 0.02 . 2 . . . . 78 GLN HB3 . 16788 1 791 . 1 1 83 83 GLN HG2 H 1 2.37 0.02 . 2 . . . . 78 GLN HG2 . 16788 1 792 . 1 1 83 83 GLN HG3 H 1 2.37 0.02 . 2 . . . . 78 GLN HG3 . 16788 1 793 . 1 1 83 83 GLN CA C 13 54.94 0.2 . 1 . . . . 78 GLN CA . 16788 1 794 . 1 1 83 83 GLN CB C 13 32.57 0.2 . 1 . . . . 78 GLN CB . 16788 1 795 . 1 1 83 83 GLN CG C 13 33.84 0.2 . 1 . . . . 78 GLN CG . 16788 1 796 . 1 1 83 83 GLN N N 15 124.23 0.1 . 1 . . . . 78 GLN N . 16788 1 797 . 1 1 84 84 ILE HA H 1 4.74 0.02 . 1 . . . . 79 ILE HA . 16788 1 798 . 1 1 84 84 ILE HB H 1 1.88 0.02 . 1 . . . . 79 ILE HB . 16788 1 799 . 1 1 84 84 ILE HD11 H 1 0.89 0.02 . 1 . . . . 79 ILE MD . 16788 1 800 . 1 1 84 84 ILE HD12 H 1 0.89 0.02 . 1 . . . . 79 ILE MD . 16788 1 801 . 1 1 84 84 ILE HD13 H 1 0.89 0.02 . 1 . . . . 79 ILE MD . 16788 1 802 . 1 1 84 84 ILE HG12 H 1 1.61 0.02 . 2 . . . . 79 ILE HG12 . 16788 1 803 . 1 1 84 84 ILE HG13 H 1 1.61 0.02 . 2 . . . . 79 ILE HG13 . 16788 1 804 . 1 1 84 84 ILE HG21 H 1 0.89 0.02 . 1 . . . . 79 ILE MG . 16788 1 805 . 1 1 84 84 ILE HG22 H 1 0.89 0.02 . 1 . . . . 79 ILE MG . 16788 1 806 . 1 1 84 84 ILE HG23 H 1 0.89 0.02 . 1 . . . . 79 ILE MG . 16788 1 807 . 1 1 84 84 ILE CA C 13 61.12 0.2 . 1 . . . . 79 ILE CA . 16788 1 808 . 1 1 84 84 ILE CB C 13 41.03 0.2 . 1 . . . . 79 ILE CB . 16788 1 809 . 1 1 84 84 ILE CD1 C 13 14.27 0.2 . 1 . . . . 79 ILE CD1 . 16788 1 810 . 1 1 84 84 ILE CG1 C 13 27.76 0.2 . 1 . . . . 79 ILE CG1 . 16788 1 811 . 1 1 84 84 ILE CG2 C 13 17.99 0.2 . 1 . . . . 79 ILE CG2 . 16788 1 812 . 1 1 85 85 SER H H 1 9.36 0.02 . 1 . . . . 80 SER H . 16788 1 813 . 1 1 85 85 SER HA H 1 5.05 0.02 . 1 . . . . 80 SER HA . 16788 1 814 . 1 1 85 85 SER HB2 H 1 3.78 0.02 . 2 . . . . 80 SER HB2 . 16788 1 815 . 1 1 85 85 SER HB3 H 1 3.79 0.02 . 2 . . . . 80 SER HB3 . 16788 1 816 . 1 1 85 85 SER CA C 13 56.96 0.2 . 1 . . . . 80 SER CA . 16788 1 817 . 1 1 85 85 SER CB C 13 65.29 0.2 . 1 . . . . 80 SER CB . 16788 1 818 . 1 1 85 85 SER N N 15 121.96 0.1 . 1 . . . . 80 SER N . 16788 1 819 . 1 1 86 86 LEU H H 1 8.80 0.02 . 1 . . . . 81 LEU H . 16788 1 820 . 1 1 86 86 LEU HA H 1 5.13 0.02 . 1 . . . . 81 LEU HA . 16788 1 821 . 1 1 86 86 LEU HB2 H 1 1.66 0.02 . 2 . . . . 81 LEU HB2 . 16788 1 822 . 1 1 86 86 LEU HB3 H 1 1.66 0.02 . 2 . . . . 81 LEU HB3 . 16788 1 823 . 1 1 86 86 LEU HD21 H 1 0.85 0.02 . 2 . . . . 81 LEU MD2 . 16788 1 824 . 1 1 86 86 LEU HD22 H 1 0.85 0.02 . 2 . . . . 81 LEU MD2 . 16788 1 825 . 1 1 86 86 LEU HD23 H 1 0.85 0.02 . 2 . . . . 81 LEU MD2 . 16788 1 826 . 1 1 86 86 LEU N N 15 125.57 0.1 . 1 . . . . 81 LEU N . 16788 1 827 . 1 1 87 87 GLY H H 1 8.31 0.02 . 1 . . . . 82 GLY H . 16788 1 828 . 1 1 87 87 GLY HA2 H 1 3.93 0.02 . 2 . . . . 82 GLY HA2 . 16788 1 829 . 1 1 87 87 GLY HA3 H 1 3.83 0.02 . 2 . . . . 82 GLY HA3 . 16788 1 830 . 1 1 87 87 GLY CA C 13 46.37 0.2 . 1 . . . . 82 GLY CA . 16788 1 831 . 1 1 87 87 GLY N N 15 116.90 0.1 . 1 . . . . 82 GLY N . 16788 1 832 . 2 2 1 1 GLY HA2 H 1 3.72 0.02 . 2 . . . . 119 GLY HA2 . 16788 1 833 . 2 2 1 1 GLY HA3 H 1 3.72 0.02 . 2 . . . . 119 GLY HA3 . 16788 1 834 . 2 2 1 1 GLY CA C 13 44.17 0.2 . 1 . . . . 119 GLY CA . 16788 1 835 . 2 2 2 2 ALA HA H 1 4.38 0.02 . 1 . . . . 120 ALA HA . 16788 1 836 . 2 2 2 2 ALA HB1 H 1 1.42 0.02 . 1 . . . . 120 ALA MB . 16788 1 837 . 2 2 2 2 ALA HB2 H 1 1.42 0.02 . 1 . . . . 120 ALA MB . 16788 1 838 . 2 2 2 2 ALA HB3 H 1 1.42 0.02 . 1 . . . . 120 ALA MB . 16788 1 839 . 2 2 2 2 ALA CA C 13 52.49 0.2 . 1 . . . . 120 ALA CA . 16788 1 840 . 2 2 2 2 ALA CB C 13 19.33 0.2 . 1 . . . . 120 ALA CB . 16788 1 841 . 2 2 3 3 MET HA H 1 4.52 0.02 . 1 . . . . 121 MET HA . 16788 1 842 . 2 2 3 3 MET HB2 H 1 2.07 0.02 . 2 . . . . 121 MET HB2 . 16788 1 843 . 2 2 3 3 MET HB3 H 1 2.14 0.02 . 2 . . . . 121 MET HB3 . 16788 1 844 . 2 2 3 3 MET HE1 H 1 2.13 0.02 . 1 . . . . 121 MET ME . 16788 1 845 . 2 2 3 3 MET HE2 H 1 2.13 0.02 . 1 . . . . 121 MET ME . 16788 1 846 . 2 2 3 3 MET HE3 H 1 2.13 0.02 . 1 . . . . 121 MET ME . 16788 1 847 . 2 2 3 3 MET HG2 H 1 2.60 0.02 . 2 . . . . 121 MET HG2 . 16788 1 848 . 2 2 3 3 MET HG3 H 1 2.67 0.02 . 2 . . . . 121 MET HG3 . 16788 1 849 . 2 2 3 3 MET CA C 13 55.53 0.2 . 1 . . . . 121 MET CA . 16788 1 850 . 2 2 3 3 MET CB C 13 32.10 0.2 . 1 . . . . 121 MET CB . 16788 1 851 . 2 2 3 3 MET CE C 13 16.98 0.2 . 1 . . . . 121 MET CE . 16788 1 852 . 2 2 3 3 MET CG C 13 32.87 0.2 . 1 . . . . 121 MET CG . 16788 1 853 . 2 2 4 4 GLY HA2 H 1 3.97 0.02 . 2 . . . . 122 GLY HA2 . 16788 1 854 . 2 2 4 4 GLY HA3 H 1 3.97 0.02 . 2 . . . . 122 GLY HA3 . 16788 1 855 . 2 2 4 4 GLY CA C 13 45.12 0.2 . 1 . . . . 122 GLY CA . 16788 1 856 . 2 2 5 5 ARG HA H 1 4.65 0.02 . 1 . . . . 123 ARG HA . 16788 1 857 . 2 2 5 5 ARG HB2 H 1 1.75 0.02 . 2 . . . . 123 ARG HB2 . 16788 1 858 . 2 2 5 5 ARG HB3 H 1 1.86 0.02 . 2 . . . . 123 ARG HB3 . 16788 1 859 . 2 2 5 5 ARG HD2 H 1 3.21 0.02 . 2 . . . . 123 ARG HD2 . 16788 1 860 . 2 2 5 5 ARG HD3 H 1 3.28 0.02 . 2 . . . . 123 ARG HD3 . 16788 1 861 . 2 2 5 5 ARG HG2 H 1 1.64 0.02 . 2 . . . . 123 ARG HG2 . 16788 1 862 . 2 2 5 5 ARG HG3 H 1 1.64 0.02 . 2 . . . . 123 ARG HG3 . 16788 1 863 . 2 2 5 5 ARG CA C 13 53.85 0.2 . 1 . . . . 123 ARG CA . 16788 1 864 . 2 2 5 5 ARG CB C 13 30.31 0.2 . 1 . . . . 123 ARG CB . 16788 1 865 . 2 2 5 5 ARG CD C 13 43.54 0.2 . 1 . . . . 123 ARG CD . 16788 1 866 . 2 2 5 5 ARG CG C 13 26.79 0.2 . 1 . . . . 123 ARG CG . 16788 1 867 . 2 2 6 6 PRO HA H 1 4.46 0.02 . 1 . . . . 124 PRO HA . 16788 1 868 . 2 2 6 6 PRO HB2 H 1 1.90 0.02 . 2 . . . . 124 PRO HB2 . 16788 1 869 . 2 2 6 6 PRO HB3 H 1 2.34 0.02 . 2 . . . . 124 PRO HB3 . 16788 1 870 . 2 2 6 6 PRO HD2 H 1 3.58 0.02 . 2 . . . . 124 PRO HD2 . 16788 1 871 . 2 2 6 6 PRO HD3 H 1 3.83 0.02 . 2 . . . . 124 PRO HD3 . 16788 1 872 . 2 2 6 6 PRO HG2 H 1 1.98 0.02 . 2 . . . . 124 PRO HG2 . 16788 1 873 . 2 2 6 6 PRO HG3 H 1 1.98 0.02 . 2 . . . . 124 PRO HG3 . 16788 1 874 . 2 2 6 6 PRO CA C 13 63.06 0.2 . 1 . . . . 124 PRO CA . 16788 1 875 . 2 2 6 6 PRO CB C 13 32.31 0.2 . 1 . . . . 124 PRO CB . 16788 1 876 . 2 2 6 6 PRO CD C 13 50.68 0.2 . 1 . . . . 124 PRO CD . 16788 1 877 . 2 2 6 6 PRO CG C 13 27.47 0.2 . 1 . . . . 124 PRO CG . 16788 1 878 . 2 2 7 7 LYS HA H 1 4.27 0.02 . 1 . . . . 125 LYS HA . 16788 1 879 . 2 2 7 7 LYS HB2 H 1 1.79 0.02 . 2 . . . . 125 LYS HB2 . 16788 1 880 . 2 2 7 7 LYS HB3 H 1 1.84 0.02 . 2 . . . . 125 LYS HB3 . 16788 1 881 . 2 2 7 7 LYS HD2 H 1 1.71 0.02 . 2 . . . . 125 LYS HD2 . 16788 1 882 . 2 2 7 7 LYS HD3 H 1 1.71 0.02 . 2 . . . . 125 LYS HD3 . 16788 1 883 . 2 2 7 7 LYS HE2 H 1 3.00 0.02 . 2 . . . . 125 LYS HE2 . 16788 1 884 . 2 2 7 7 LYS HE3 H 1 3.00 0.02 . 2 . . . . 125 LYS HE3 . 16788 1 885 . 2 2 7 7 LYS HG2 H 1 1.43 0.02 . 2 . . . . 125 LYS HG2 . 16788 1 886 . 2 2 7 7 LYS HG3 H 1 1.51 0.02 . 2 . . . . 125 LYS HG3 . 16788 1 887 . 2 2 7 7 LYS CA C 13 56.76 0.2 . 1 . . . . 125 LYS CA . 16788 1 888 . 2 2 7 7 LYS CB C 13 32.98 0.2 . 1 . . . . 125 LYS CB . 16788 1 889 . 2 2 7 7 LYS CD C 13 29.10 0.2 . 1 . . . . 125 LYS CD . 16788 1 890 . 2 2 7 7 LYS CE C 13 41.96 0.2 . 1 . . . . 125 LYS CE . 16788 1 891 . 2 2 7 7 LYS CG C 13 24.91 0.2 . 1 . . . . 125 LYS CG . 16788 1 892 . 2 2 8 8 THR HA H 1 4.15 0.02 . 1 . . . . 126 THR HA . 16788 1 893 . 2 2 8 8 THR HB H 1 4.01 0.02 . 1 . . . . 126 THR HB . 16788 1 894 . 2 2 8 8 THR HG21 H 1 0.92 0.02 . 1 . . . . 126 THR MG . 16788 1 895 . 2 2 8 8 THR HG22 H 1 0.92 0.02 . 1 . . . . 126 THR MG . 16788 1 896 . 2 2 8 8 THR HG23 H 1 0.92 0.02 . 1 . . . . 126 THR MG . 16788 1 897 . 2 2 8 8 THR CA C 13 61.63 0.2 . 1 . . . . 126 THR CA . 16788 1 898 . 2 2 8 8 THR CB C 13 69.74 0.2 . 1 . . . . 126 THR CB . 16788 1 899 . 2 2 9 9 LEU H H 1 7.87 0.02 . 1 . . . . 127 LEU H . 16788 1 900 . 2 2 9 9 LEU HA H 1 4.49 0.02 . 1 . . . . 127 LEU HA . 16788 1 901 . 2 2 9 9 LEU HB2 H 1 1.38 0.02 . 2 . . . . 127 LEU HB2 . 16788 1 902 . 2 2 9 9 LEU HB3 H 1 1.49 0.02 . 2 . . . . 127 LEU HB3 . 16788 1 903 . 2 2 9 9 LEU HD11 H 1 0.87 0.02 . 2 . . . . 127 LEU MD1 . 16788 1 904 . 2 2 9 9 LEU HD12 H 1 0.87 0.02 . 2 . . . . 127 LEU MD1 . 16788 1 905 . 2 2 9 9 LEU HD13 H 1 0.87 0.02 . 2 . . . . 127 LEU MD1 . 16788 1 906 . 2 2 9 9 LEU HD21 H 1 0.79 0.02 . 2 . . . . 127 LEU MD2 . 16788 1 907 . 2 2 9 9 LEU HD22 H 1 0.79 0.02 . 2 . . . . 127 LEU MD2 . 16788 1 908 . 2 2 9 9 LEU HD23 H 1 0.79 0.02 . 2 . . . . 127 LEU MD2 . 16788 1 909 . 2 2 9 9 LEU HG H 1 1.45 0.02 . 1 . . . . 127 LEU HG . 16788 1 910 . 2 2 9 9 LEU CA C 13 54.66 0.2 . 1 . . . . 127 LEU CA . 16788 1 911 . 2 2 9 9 LEU CB C 13 43.40 0.2 . 1 . . . . 127 LEU CB . 16788 1 912 . 2 2 9 9 LEU CD1 C 13 25.02 0.2 . 2 . . . . 127 LEU CD1 . 16788 1 913 . 2 2 9 9 LEU CD2 C 13 23.82 0.2 . 2 . . . . 127 LEU CD2 . 16788 1 914 . 2 2 9 9 LEU CG C 13 27.03 0.2 . 1 . . . . 127 LEU CG . 16788 1 915 . 2 2 9 9 LEU N N 15 124.47 0.1 . 1 . . . . 127 LEU N . 16788 1 916 . 2 2 10 10 PHE H H 1 7.48 0.02 . 1 . . . . 128 PHE H . 16788 1 917 . 2 2 10 10 PHE HA H 1 4.97 0.02 . 1 . . . . 128 PHE HA . 16788 1 918 . 2 2 10 10 PHE HB2 H 1 2.26 0.02 . 2 . . . . 128 PHE HB2 . 16788 1 919 . 2 2 10 10 PHE HB3 H 1 2.67 0.02 . 2 . . . . 128 PHE HB3 . 16788 1 920 . 2 2 10 10 PHE HD1 H 1 6.45 0.02 . 1 . . . . 128 PHE HD1 . 16788 1 921 . 2 2 10 10 PHE HD2 H 1 6.45 0.02 . 1 . . . . 128 PHE HD2 . 16788 1 922 . 2 2 10 10 PHE HE1 H 1 6.55 0.02 . 1 . . . . 128 PHE HE1 . 16788 1 923 . 2 2 10 10 PHE HE2 H 1 6.55 0.02 . 1 . . . . 128 PHE HE2 . 16788 1 924 . 2 2 10 10 PHE HZ H 1 7.00 0.02 . 1 . . . . 128 PHE HZ . 16788 1 925 . 2 2 10 10 PHE CA C 13 56.51 0.2 . 1 . . . . 128 PHE CA . 16788 1 926 . 2 2 10 10 PHE CB C 13 43.84 0.2 . 1 . . . . 128 PHE CB . 16788 1 927 . 2 2 10 10 PHE N N 15 117.34 0.1 . 1 . . . . 128 PHE N . 16788 1 928 . 2 2 11 11 GLU H H 1 9.10 0.02 . 1 . . . . 129 GLU H . 16788 1 929 . 2 2 11 11 GLU HA H 1 4.94 0.02 . 1 . . . . 129 GLU HA . 16788 1 930 . 2 2 11 11 GLU HB2 H 1 1.80 0.02 . 2 . . . . 129 GLU HB2 . 16788 1 931 . 2 2 11 11 GLU HB3 H 1 2.01 0.02 . 2 . . . . 129 GLU HB3 . 16788 1 932 . 2 2 11 11 GLU HG2 H 1 2.21 0.02 . 2 . . . . 129 GLU HG2 . 16788 1 933 . 2 2 11 11 GLU HG3 H 1 2.21 0.02 . 2 . . . . 129 GLU HG3 . 16788 1 934 . 2 2 11 11 GLU CA C 13 52.83 0.2 . 1 . . . . 129 GLU CA . 16788 1 935 . 2 2 11 11 GLU CB C 13 31.99 0.2 . 1 . . . . 129 GLU CB . 16788 1 936 . 2 2 11 11 GLU CG C 13 35.88 0.2 . 1 . . . . 129 GLU CG . 16788 1 937 . 2 2 11 11 GLU N N 15 121.27 0.1 . 1 . . . . 129 GLU N . 16788 1 938 . 2 2 12 12 PRO HA H 1 3.96 0.02 . 1 . . . . 130 PRO HA . 16788 1 939 . 2 2 12 12 PRO HB2 H 1 1.92 0.02 . 2 . . . . 130 PRO HB2 . 16788 1 940 . 2 2 12 12 PRO HB3 H 1 2.25 0.02 . 2 . . . . 130 PRO HB3 . 16788 1 941 . 2 2 12 12 PRO HD2 H 1 3.76 0.02 . 2 . . . . 130 PRO HD2 . 16788 1 942 . 2 2 12 12 PRO HD3 H 1 3.76 0.02 . 2 . . . . 130 PRO HD3 . 16788 1 943 . 2 2 12 12 PRO HG2 H 1 1.74 0.02 . 2 . . . . 130 PRO HG2 . 16788 1 944 . 2 2 12 12 PRO HG3 H 1 2.35 0.02 . 2 . . . . 130 PRO HG3 . 16788 1 945 . 2 2 12 12 PRO CA C 13 63.73 0.2 . 1 . . . . 130 PRO CA . 16788 1 946 . 2 2 12 12 PRO CB C 13 31.47 0.2 . 1 . . . . 130 PRO CB . 16788 1 947 . 2 2 12 12 PRO CD C 13 50.80 0.2 . 1 . . . . 130 PRO CD . 16788 1 948 . 2 2 12 12 PRO CG C 13 28.74 0.2 . 1 . . . . 130 PRO CG . 16788 1 949 . 2 2 13 13 GLY H H 1 9.31 0.02 . 1 . . . . 131 GLY H . 16788 1 950 . 2 2 13 13 GLY HA2 H 1 3.49 0.02 . 2 . . . . 131 GLY HA2 . 16788 1 951 . 2 2 13 13 GLY HA3 H 1 4.47 0.02 . 2 . . . . 131 GLY HA3 . 16788 1 952 . 2 2 13 13 GLY CA C 13 44.81 0.2 . 1 . . . . 131 GLY CA . 16788 1 953 . 2 2 13 13 GLY N N 15 112.78 0.1 . 1 . . . . 131 GLY N . 16788 1 954 . 2 2 14 14 GLU H H 1 7.80 0.02 . 1 . . . . 132 GLU H . 16788 1 955 . 2 2 14 14 GLU HA H 1 4.43 0.02 . 1 . . . . 132 GLU HA . 16788 1 956 . 2 2 14 14 GLU HB2 H 1 2.07 0.02 . 2 . . . . 132 GLU HB2 . 16788 1 957 . 2 2 14 14 GLU HB3 H 1 2.38 0.02 . 2 . . . . 132 GLU HB3 . 16788 1 958 . 2 2 14 14 GLU HG2 H 1 2.41 0.02 . 2 . . . . 132 GLU HG2 . 16788 1 959 . 2 2 14 14 GLU HG3 H 1 2.43 0.02 . 2 . . . . 132 GLU HG3 . 16788 1 960 . 2 2 14 14 GLU CA C 13 56.62 0.2 . 1 . . . . 132 GLU CA . 16788 1 961 . 2 2 14 14 GLU CB C 13 31.58 0.2 . 1 . . . . 132 GLU CB . 16788 1 962 . 2 2 14 14 GLU CG C 13 37.35 0.2 . 1 . . . . 132 GLU CG . 16788 1 963 . 2 2 14 14 GLU N N 15 120.56 0.1 . 1 . . . . 132 GLU N . 16788 1 964 . 2 2 15 15 MET H H 1 8.59 0.02 . 1 . . . . 133 MET H . 16788 1 965 . 2 2 15 15 MET HA H 1 5.23 0.02 . 1 . . . . 133 MET HA . 16788 1 966 . 2 2 15 15 MET HB2 H 1 2.11 0.02 . 2 . . . . 133 MET HB2 . 16788 1 967 . 2 2 15 15 MET HB3 H 1 2.11 0.02 . 2 . . . . 133 MET HB3 . 16788 1 968 . 2 2 15 15 MET HE1 H 1 2.07 0.02 . 1 . . . . 133 MET ME . 16788 1 969 . 2 2 15 15 MET HE2 H 1 2.07 0.02 . 1 . . . . 133 MET ME . 16788 1 970 . 2 2 15 15 MET HE3 H 1 2.07 0.02 . 1 . . . . 133 MET ME . 16788 1 971 . 2 2 15 15 MET HG2 H 1 2.59 0.02 . 2 . . . . 133 MET HG2 . 16788 1 972 . 2 2 15 15 MET HG3 H 1 2.66 0.02 . 2 . . . . 133 MET HG3 . 16788 1 973 . 2 2 15 15 MET CA C 13 54.65 0.2 . 1 . . . . 133 MET CA . 16788 1 974 . 2 2 15 15 MET CB C 13 33.12 0.2 . 1 . . . . 133 MET CB . 16788 1 975 . 2 2 15 15 MET CE C 13 16.66 0.2 . 1 . . . . 133 MET CE . 16788 1 976 . 2 2 15 15 MET CG C 13 32.17 0.2 . 1 . . . . 133 MET CG . 16788 1 977 . 2 2 15 15 MET N N 15 121.73 0.1 . 1 . . . . 133 MET N . 16788 1 978 . 2 2 16 16 VAL H H 1 8.99 0.02 . 1 . . . . 134 VAL H . 16788 1 979 . 2 2 16 16 VAL HA H 1 5.08 0.02 . 1 . . . . 134 VAL HA . 16788 1 980 . 2 2 16 16 VAL HB H 1 2.06 0.02 . 1 . . . . 134 VAL HB . 16788 1 981 . 2 2 16 16 VAL HG11 H 1 0.66 0.02 . 2 . . . . 134 VAL MG1 . 16788 1 982 . 2 2 16 16 VAL HG12 H 1 0.66 0.02 . 2 . . . . 134 VAL MG1 . 16788 1 983 . 2 2 16 16 VAL HG13 H 1 0.66 0.02 . 2 . . . . 134 VAL MG1 . 16788 1 984 . 2 2 16 16 VAL HG21 H 1 0.47 0.02 . 2 . . . . 134 VAL MG2 . 16788 1 985 . 2 2 16 16 VAL HG22 H 1 0.47 0.02 . 2 . . . . 134 VAL MG2 . 16788 1 986 . 2 2 16 16 VAL HG23 H 1 0.47 0.02 . 2 . . . . 134 VAL MG2 . 16788 1 987 . 2 2 16 16 VAL CA C 13 58.67 0.2 . 1 . . . . 134 VAL CA . 16788 1 988 . 2 2 16 16 VAL CB C 13 36.08 0.2 . 1 . . . . 134 VAL CB . 16788 1 989 . 2 2 16 16 VAL CG1 C 13 22.39 0.2 . 2 . . . . 134 VAL CG1 . 16788 1 990 . 2 2 16 16 VAL CG2 C 13 18.25 0.2 . 2 . . . . 134 VAL CG2 . 16788 1 991 . 2 2 16 16 VAL N N 15 116.35 0.1 . 1 . . . . 134 VAL N . 16788 1 992 . 2 2 17 17 ARG H H 1 8.98 0.02 . 1 . . . . 135 ARG H . 16788 1 993 . 2 2 17 17 ARG HA H 1 5.05 0.02 . 1 . . . . 135 ARG HA . 16788 1 994 . 2 2 17 17 ARG HB2 H 1 1.62 0.02 . 2 . . . . 135 ARG HB2 . 16788 1 995 . 2 2 17 17 ARG HB3 H 1 1.71 0.02 . 2 . . . . 135 ARG HB3 . 16788 1 996 . 2 2 17 17 ARG HD2 H 1 3.20 0.02 . 2 . . . . 135 ARG HD2 . 16788 1 997 . 2 2 17 17 ARG HD3 H 1 3.30 0.02 . 2 . . . . 135 ARG HD3 . 16788 1 998 . 2 2 17 17 ARG HG2 H 1 1.45 0.02 . 2 . . . . 135 ARG HG2 . 16788 1 999 . 2 2 17 17 ARG HG3 H 1 1.45 0.02 . 2 . . . . 135 ARG HG3 . 16788 1 1000 . 2 2 17 17 ARG CA C 13 58.67 0.2 . 1 . . . . 135 ARG CA . 16788 1 1001 . 2 2 17 17 ARG CB C 13 33.60 0.2 . 1 . . . . 135 ARG CB . 16788 1 1002 . 2 2 17 17 ARG CD C 13 43.24 0.2 . 1 . . . . 135 ARG CD . 16788 1 1003 . 2 2 17 17 ARG CG C 13 27.73 0.2 . 1 . . . . 135 ARG CG . 16788 1 1004 . 2 2 17 17 ARG N N 15 121.27 0.1 . 1 . . . . 135 ARG N . 16788 1 1005 . 2 2 18 18 VAL H H 1 8.75 0.02 . 1 . . . . 136 VAL H . 16788 1 1006 . 2 2 18 18 VAL HA H 1 4.32 0.02 . 1 . . . . 136 VAL HA . 16788 1 1007 . 2 2 18 18 VAL HB H 1 2.54 0.02 . 1 . . . . 136 VAL HB . 16788 1 1008 . 2 2 18 18 VAL HG11 H 1 1.07 0.02 . 2 . . . . 136 VAL MG1 . 16788 1 1009 . 2 2 18 18 VAL HG12 H 1 1.07 0.02 . 2 . . . . 136 VAL MG1 . 16788 1 1010 . 2 2 18 18 VAL HG13 H 1 1.07 0.02 . 2 . . . . 136 VAL MG1 . 16788 1 1011 . 2 2 18 18 VAL HG21 H 1 0.74 0.02 . 2 . . . . 136 VAL MG2 . 16788 1 1012 . 2 2 18 18 VAL HG22 H 1 0.74 0.02 . 2 . . . . 136 VAL MG2 . 16788 1 1013 . 2 2 18 18 VAL HG23 H 1 0.74 0.02 . 2 . . . . 136 VAL MG2 . 16788 1 1014 . 2 2 18 18 VAL CA C 13 62.90 0.2 . 1 . . . . 136 VAL CA . 16788 1 1015 . 2 2 18 18 VAL CB C 13 30.94 0.2 . 1 . . . . 136 VAL CB . 16788 1 1016 . 2 2 18 18 VAL CG1 C 13 22.75 0.2 . 2 . . . . 136 VAL CG1 . 16788 1 1017 . 2 2 18 18 VAL CG2 C 13 20.89 0.2 . 2 . . . . 136 VAL CG2 . 16788 1 1018 . 2 2 18 18 VAL N N 15 127.21 0.1 . 1 . . . . 136 VAL N . 16788 1 1019 . 2 2 19 19 ASN H H 1 9.08 0.02 . 1 . . . . 137 ASN H . 16788 1 1020 . 2 2 19 19 ASN HA H 1 5.08 0.02 . 1 . . . . 137 ASN HA . 16788 1 1021 . 2 2 19 19 ASN HB2 H 1 2.47 0.02 . 2 . . . . 137 ASN HB2 . 16788 1 1022 . 2 2 19 19 ASN HB3 H 1 2.98 0.02 . 2 . . . . 137 ASN HB3 . 16788 1 1023 . 2 2 19 19 ASN HD21 H 1 6.60 0.02 . 1 . . . . 137 ASN HD21 . 16788 1 1024 . 2 2 19 19 ASN HD22 H 1 7.35 0.02 . 1 . . . . 137 ASN HD22 . 16788 1 1025 . 2 2 19 19 ASN CA C 13 52.51 0.2 . 1 . . . . 137 ASN CA . 16788 1 1026 . 2 2 19 19 ASN CB C 13 40.59 0.2 . 1 . . . . 137 ASN CB . 16788 1 1027 . 2 2 19 19 ASN N N 15 125.89 0.1 . 1 . . . . 137 ASN N . 16788 1 1028 . 2 2 19 19 ASN ND2 N 15 108.92 0.1 . 1 . . . . 137 ASN ND2 . 16788 1 1029 . 2 2 20 20 ASP H H 1 7.35 0.02 . 1 . . . . 138 ASP H . 16788 1 1030 . 2 2 20 20 ASP HA H 1 4.97 0.02 . 1 . . . . 138 ASP HA . 16788 1 1031 . 2 2 20 20 ASP HB2 H 1 2.44 0.02 . 2 . . . . 138 ASP HB2 . 16788 1 1032 . 2 2 20 20 ASP HB3 H 1 2.96 0.02 . 2 . . . . 138 ASP HB3 . 16788 1 1033 . 2 2 20 20 ASP CA C 13 53.74 0.2 . 1 . . . . 138 ASP CA . 16788 1 1034 . 2 2 20 20 ASP CB C 13 45.29 0.2 . 1 . . . . 138 ASP CB . 16788 1 1035 . 2 2 20 20 ASP N N 15 116.78 0.1 . 1 . . . . 138 ASP N . 16788 1 1036 . 2 2 21 21 GLY H H 1 8.35 0.02 . 1 . . . . 139 GLY H . 16788 1 1037 . 2 2 21 21 GLY HA2 H 1 3.89 0.02 . 2 . . . . 139 GLY HA2 . 16788 1 1038 . 2 2 21 21 GLY HA3 H 1 4.36 0.02 . 2 . . . . 139 GLY HA3 . 16788 1 1039 . 2 2 21 21 GLY CA C 13 45.18 0.2 . 1 . . . . 139 GLY CA . 16788 1 1040 . 2 2 21 21 GLY N N 15 108.36 0.1 . 1 . . . . 139 GLY N . 16788 1 1041 . 2 2 22 22 PRO HA H 1 4.21 0.02 . 1 . . . . 140 PRO HA . 16788 1 1042 . 2 2 22 22 PRO HB2 H 1 1.16 0.02 . 2 . . . . 140 PRO HB2 . 16788 1 1043 . 2 2 22 22 PRO HB3 H 1 2.01 0.02 . 2 . . . . 140 PRO HB3 . 16788 1 1044 . 2 2 22 22 PRO HD2 H 1 3.56 0.02 . 2 . . . . 140 PRO HD2 . 16788 1 1045 . 2 2 22 22 PRO HD3 H 1 3.71 0.02 . 2 . . . . 140 PRO HD3 . 16788 1 1046 . 2 2 22 22 PRO HG2 H 1 1.65 0.02 . 2 . . . . 140 PRO HG2 . 16788 1 1047 . 2 2 22 22 PRO HG3 H 1 1.86 0.02 . 2 . . . . 140 PRO HG3 . 16788 1 1048 . 2 2 22 22 PRO CA C 13 64.51 0.2 . 1 . . . . 140 PRO CA . 16788 1 1049 . 2 2 22 22 PRO CB C 13 31.61 0.2 . 1 . . . . 140 PRO CB . 16788 1 1050 . 2 2 22 22 PRO CD C 13 49.61 0.2 . 1 . . . . 140 PRO CD . 16788 1 1051 . 2 2 22 22 PRO CG C 13 27.14 0.2 . 1 . . . . 140 PRO CG . 16788 1 1052 . 2 2 23 23 PHE HA H 1 4.46 0.02 . 1 . . . . 141 PHE HA . 16788 1 1053 . 2 2 23 23 PHE HB2 H 1 2.95 0.02 . 2 . . . . 141 PHE HB2 . 16788 1 1054 . 2 2 23 23 PHE HB3 H 1 2.95 0.02 . 2 . . . . 141 PHE HB3 . 16788 1 1055 . 2 2 23 23 PHE HD1 H 1 6.66 0.02 . 1 . . . . 141 PHE HD1 . 16788 1 1056 . 2 2 23 23 PHE HD2 H 1 6.66 0.02 . 1 . . . . 141 PHE HD2 . 16788 1 1057 . 2 2 23 23 PHE HE1 H 1 6.97 0.02 . 1 . . . . 141 PHE HE1 . 16788 1 1058 . 2 2 23 23 PHE HE2 H 1 6.97 0.02 . 1 . . . . 141 PHE HE2 . 16788 1 1059 . 2 2 23 23 PHE HZ H 1 7.23 0.02 . 1 . . . . 141 PHE HZ . 16788 1 1060 . 2 2 23 23 PHE CA C 13 55.82 0.2 . 1 . . . . 141 PHE CA . 16788 1 1061 . 2 2 23 23 PHE CB C 13 40.17 0.2 . 1 . . . . 141 PHE CB . 16788 1 1062 . 2 2 24 24 ALA H H 1 7.30 0.02 . 1 . . . . 142 ALA H . 16788 1 1063 . 2 2 24 24 ALA HA H 1 3.53 0.02 . 1 . . . . 142 ALA HA . 16788 1 1064 . 2 2 24 24 ALA HB1 H 1 1.25 0.02 . 1 . . . . 142 ALA MB . 16788 1 1065 . 2 2 24 24 ALA HB2 H 1 1.25 0.02 . 1 . . . . 142 ALA MB . 16788 1 1066 . 2 2 24 24 ALA HB3 H 1 1.25 0.02 . 1 . . . . 142 ALA MB . 16788 1 1067 . 2 2 24 24 ALA CA C 13 54.12 0.2 . 1 . . . . 142 ALA CA . 16788 1 1068 . 2 2 24 24 ALA CB C 13 17.95 0.2 . 1 . . . . 142 ALA CB . 16788 1 1069 . 2 2 24 24 ALA N N 15 121.29 0.1 . 1 . . . . 142 ALA N . 16788 1 1070 . 2 2 25 25 ASP H H 1 8.94 0.02 . 1 . . . . 143 ASP H . 16788 1 1071 . 2 2 25 25 ASP HA H 1 4.22 0.02 . 1 . . . . 143 ASP HA . 16788 1 1072 . 2 2 25 25 ASP HB2 H 1 2.86 0.02 . 2 . . . . 143 ASP HB2 . 16788 1 1073 . 2 2 25 25 ASP HB3 H 1 3.03 0.02 . 2 . . . . 143 ASP HB3 . 16788 1 1074 . 2 2 25 25 ASP CA C 13 57.16 0.2 . 1 . . . . 143 ASP CA . 16788 1 1075 . 2 2 25 25 ASP CB C 13 39.86 0.2 . 1 . . . . 143 ASP CB . 16788 1 1076 . 2 2 25 25 ASP N N 15 114.14 0.1 . 1 . . . . 143 ASP N . 16788 1 1077 . 2 2 26 26 PHE H H 1 8.36 0.02 . 1 . . . . 144 PHE H . 16788 1 1078 . 2 2 26 26 PHE HA H 1 4.67 0.02 . 1 . . . . 144 PHE HA . 16788 1 1079 . 2 2 26 26 PHE HB2 H 1 2.95 0.02 . 2 . . . . 144 PHE HB2 . 16788 1 1080 . 2 2 26 26 PHE HB3 H 1 3.53 0.02 . 2 . . . . 144 PHE HB3 . 16788 1 1081 . 2 2 26 26 PHE HD1 H 1 7.29 0.02 . 1 . . . . 144 PHE HD1 . 16788 1 1082 . 2 2 26 26 PHE HD2 H 1 7.29 0.02 . 1 . . . . 144 PHE HD2 . 16788 1 1083 . 2 2 26 26 PHE CA C 13 58.49 0.2 . 1 . . . . 144 PHE CA . 16788 1 1084 . 2 2 26 26 PHE CB C 13 39.14 0.2 . 1 . . . . 144 PHE CB . 16788 1 1085 . 2 2 26 26 PHE N N 15 119.69 0.1 . 1 . . . . 144 PHE N . 16788 1 1086 . 2 2 27 27 ASN H H 1 8.61 0.02 . 1 . . . . 145 ASN H . 16788 1 1087 . 2 2 27 27 ASN HA H 1 5.72 0.02 . 1 . . . . 145 ASN HA . 16788 1 1088 . 2 2 27 27 ASN HB2 H 1 2.72 0.02 . 2 . . . . 145 ASN HB2 . 16788 1 1089 . 2 2 27 27 ASN HB3 H 1 2.80 0.02 . 2 . . . . 145 ASN HB3 . 16788 1 1090 . 2 2 27 27 ASN HD21 H 1 7.16 0.02 . 1 . . . . 145 ASN HD21 . 16788 1 1091 . 2 2 27 27 ASN HD22 H 1 6.86 0.02 . 1 . . . . 145 ASN HD22 . 16788 1 1092 . 2 2 27 27 ASN CA C 13 51.96 0.2 . 1 . . . . 145 ASN CA . 16788 1 1093 . 2 2 27 27 ASN CB C 13 41.28 0.2 . 1 . . . . 145 ASN CB . 16788 1 1094 . 2 2 27 27 ASN N N 15 117.84 0.1 . 1 . . . . 145 ASN N . 16788 1 1095 . 2 2 27 27 ASN ND2 N 15 110.42 0.1 . 1 . . . . 145 ASN ND2 . 16788 1 1096 . 2 2 28 28 GLY H H 1 8.78 0.02 . 1 . . . . 146 GLY H . 16788 1 1097 . 2 2 28 28 GLY HA2 H 1 3.60 0.02 . 2 . . . . 146 GLY HA2 . 16788 1 1098 . 2 2 28 28 GLY HA3 H 1 4.69 0.02 . 2 . . . . 146 GLY HA3 . 16788 1 1099 . 2 2 28 28 GLY CA C 13 45.57 0.2 . 1 . . . . 146 GLY CA . 16788 1 1100 . 2 2 28 28 GLY N N 15 106.19 0.1 . 1 . . . . 146 GLY N . 16788 1 1101 . 2 2 29 29 VAL H H 1 7.86 0.02 . 1 . . . . 147 VAL H . 16788 1 1102 . 2 2 29 29 VAL HA H 1 4.90 0.02 . 1 . . . . 147 VAL HA . 16788 1 1103 . 2 2 29 29 VAL HB H 1 1.90 0.02 . 1 . . . . 147 VAL HB . 16788 1 1104 . 2 2 29 29 VAL HG11 H 1 0.95 0.02 . 2 . . . . 147 VAL MG1 . 16788 1 1105 . 2 2 29 29 VAL HG12 H 1 0.95 0.02 . 2 . . . . 147 VAL MG1 . 16788 1 1106 . 2 2 29 29 VAL HG13 H 1 0.95 0.02 . 2 . . . . 147 VAL MG1 . 16788 1 1107 . 2 2 29 29 VAL HG21 H 1 0.88 0.02 . 2 . . . . 147 VAL MG2 . 16788 1 1108 . 2 2 29 29 VAL HG22 H 1 0.88 0.02 . 2 . . . . 147 VAL MG2 . 16788 1 1109 . 2 2 29 29 VAL HG23 H 1 0.88 0.02 . 2 . . . . 147 VAL MG2 . 16788 1 1110 . 2 2 29 29 VAL CA C 13 60.03 0.2 . 1 . . . . 147 VAL CA . 16788 1 1111 . 2 2 29 29 VAL CB C 13 34.63 0.2 . 1 . . . . 147 VAL CB . 16788 1 1112 . 2 2 29 29 VAL CG1 C 13 21.51 0.2 . 2 . . . . 147 VAL CG1 . 16788 1 1113 . 2 2 29 29 VAL CG2 C 13 20.98 0.2 . 2 . . . . 147 VAL CG2 . 16788 1 1114 . 2 2 29 29 VAL N N 15 118.29 0.1 . 1 . . . . 147 VAL N . 16788 1 1115 . 2 2 30 30 VAL H H 1 9.03 0.02 . 1 . . . . 148 VAL H . 16788 1 1116 . 2 2 30 30 VAL HA H 1 3.71 0.02 . 1 . . . . 148 VAL HA . 16788 1 1117 . 2 2 30 30 VAL HB H 1 2.34 0.02 . 1 . . . . 148 VAL HB . 16788 1 1118 . 2 2 30 30 VAL HG11 H 1 0.60 0.02 . 2 . . . . 148 VAL MG1 . 16788 1 1119 . 2 2 30 30 VAL HG12 H 1 0.60 0.02 . 2 . . . . 148 VAL MG1 . 16788 1 1120 . 2 2 30 30 VAL HG13 H 1 0.60 0.02 . 2 . . . . 148 VAL MG1 . 16788 1 1121 . 2 2 30 30 VAL HG21 H 1 0.91 0.02 . 2 . . . . 148 VAL MG2 . 16788 1 1122 . 2 2 30 30 VAL HG22 H 1 0.91 0.02 . 2 . . . . 148 VAL MG2 . 16788 1 1123 . 2 2 30 30 VAL HG23 H 1 0.91 0.02 . 2 . . . . 148 VAL MG2 . 16788 1 1124 . 2 2 30 30 VAL CA C 13 64.92 0.2 . 1 . . . . 148 VAL CA . 16788 1 1125 . 2 2 30 30 VAL CB C 13 32.04 0.2 . 1 . . . . 148 VAL CB . 16788 1 1126 . 2 2 30 30 VAL CG1 C 13 22.84 0.2 . 2 . . . . 148 VAL CG1 . 16788 1 1127 . 2 2 30 30 VAL CG2 C 13 23.84 0.2 . 2 . . . . 148 VAL CG2 . 16788 1 1128 . 2 2 30 30 VAL N N 15 126.44 0.1 . 1 . . . . 148 VAL N . 16788 1 1129 . 2 2 31 31 GLU H H 1 9.51 0.02 . 1 . . . . 149 GLU H . 16788 1 1130 . 2 2 31 31 GLU HA H 1 4.67 0.02 . 1 . . . . 149 GLU HA . 16788 1 1131 . 2 2 31 31 GLU HB2 H 1 1.71 0.02 . 2 . . . . 149 GLU HB2 . 16788 1 1132 . 2 2 31 31 GLU HB3 H 1 2.06 0.02 . 2 . . . . 149 GLU HB3 . 16788 1 1133 . 2 2 31 31 GLU HG2 H 1 2.21 0.02 . 2 . . . . 149 GLU HG2 . 16788 1 1134 . 2 2 31 31 GLU HG3 H 1 2.22 0.02 . 2 . . . . 149 GLU HG3 . 16788 1 1135 . 2 2 31 31 GLU CA C 13 57.32 0.2 . 1 . . . . 149 GLU CA . 16788 1 1136 . 2 2 31 31 GLU CB C 13 31.99 0.2 . 1 . . . . 149 GLU CB . 16788 1 1137 . 2 2 31 31 GLU CG C 13 35.91 0.2 . 1 . . . . 149 GLU CG . 16788 1 1138 . 2 2 31 31 GLU N N 15 129.10 0.1 . 1 . . . . 149 GLU N . 16788 1 1139 . 2 2 32 32 GLU H H 1 7.59 0.02 . 1 . . . . 150 GLU H . 16788 1 1140 . 2 2 32 32 GLU HA H 1 4.63 0.02 . 1 . . . . 150 GLU HA . 16788 1 1141 . 2 2 32 32 GLU HB2 H 1 1.91 0.02 . 2 . . . . 150 GLU HB2 . 16788 1 1142 . 2 2 32 32 GLU HB3 H 1 2.02 0.02 . 2 . . . . 150 GLU HB3 . 16788 1 1143 . 2 2 32 32 GLU HG2 H 1 2.22 0.02 . 2 . . . . 150 GLU HG2 . 16788 1 1144 . 2 2 32 32 GLU HG3 H 1 2.22 0.02 . 2 . . . . 150 GLU HG3 . 16788 1 1145 . 2 2 32 32 GLU CA C 13 55.37 0.2 . 1 . . . . 150 GLU CA . 16788 1 1146 . 2 2 32 32 GLU CB C 13 34.65 0.2 . 1 . . . . 150 GLU CB . 16788 1 1147 . 2 2 32 32 GLU CG C 13 36.65 0.2 . 1 . . . . 150 GLU CG . 16788 1 1148 . 2 2 32 32 GLU N N 15 115.73 0.1 . 1 . . . . 150 GLU N . 16788 1 1149 . 2 2 33 33 VAL H H 1 8.83 0.02 . 1 . . . . 151 VAL H . 16788 1 1150 . 2 2 33 33 VAL HA H 1 4.25 0.02 . 1 . . . . 151 VAL HA . 16788 1 1151 . 2 2 33 33 VAL HB H 1 1.83 0.02 . 1 . . . . 151 VAL HB . 16788 1 1152 . 2 2 33 33 VAL HG11 H 1 0.65 0.02 . 2 . . . . 151 VAL MG1 . 16788 1 1153 . 2 2 33 33 VAL HG12 H 1 0.65 0.02 . 2 . . . . 151 VAL MG1 . 16788 1 1154 . 2 2 33 33 VAL HG13 H 1 0.65 0.02 . 2 . . . . 151 VAL MG1 . 16788 1 1155 . 2 2 33 33 VAL HG21 H 1 0.65 0.02 . 2 . . . . 151 VAL MG2 . 16788 1 1156 . 2 2 33 33 VAL HG22 H 1 0.65 0.02 . 2 . . . . 151 VAL MG2 . 16788 1 1157 . 2 2 33 33 VAL HG23 H 1 0.65 0.02 . 2 . . . . 151 VAL MG2 . 16788 1 1158 . 2 2 33 33 VAL CA C 13 61.77 0.2 . 1 . . . . 151 VAL CA . 16788 1 1159 . 2 2 33 33 VAL CB C 13 35.04 0.2 . 1 . . . . 151 VAL CB . 16788 1 1160 . 2 2 33 33 VAL CG1 C 13 21.13 0.2 . 2 . . . . 151 VAL CG1 . 16788 1 1161 . 2 2 33 33 VAL N N 15 122.12 0.1 . 1 . . . . 151 VAL N . 16788 1 1162 . 2 2 34 34 ASP H H 1 8.74 0.02 . 1 . . . . 152 ASP H . 16788 1 1163 . 2 2 34 34 ASP HA H 1 5.00 0.02 . 1 . . . . 152 ASP HA . 16788 1 1164 . 2 2 34 34 ASP HB2 H 1 2.42 0.02 . 2 . . . . 152 ASP HB2 . 16788 1 1165 . 2 2 34 34 ASP HB3 H 1 2.96 0.02 . 2 . . . . 152 ASP HB3 . 16788 1 1166 . 2 2 34 34 ASP CA C 13 52.02 0.2 . 1 . . . . 152 ASP CA . 16788 1 1167 . 2 2 34 34 ASP CB C 13 41.47 0.2 . 1 . . . . 152 ASP CB . 16788 1 1168 . 2 2 34 34 ASP N N 15 126.55 0.1 . 1 . . . . 152 ASP N . 16788 1 1169 . 2 2 35 35 TYR H H 1 8.82 0.02 . 1 . . . . 153 TYR H . 16788 1 1170 . 2 2 35 35 TYR HA H 1 4.32 0.02 . 1 . . . . 153 TYR HA . 16788 1 1171 . 2 2 35 35 TYR HB2 H 1 3.01 0.02 . 2 . . . . 153 TYR HB2 . 16788 1 1172 . 2 2 35 35 TYR HB3 H 1 3.31 0.02 . 2 . . . . 153 TYR HB3 . 16788 1 1173 . 2 2 35 35 TYR HD1 H 1 7.47 0.02 . 1 . . . . 153 TYR HD1 . 16788 1 1174 . 2 2 35 35 TYR HD2 H 1 7.47 0.02 . 1 . . . . 153 TYR HD2 . 16788 1 1175 . 2 2 35 35 TYR HE1 H 1 7.14 0.02 . 1 . . . . 153 TYR HE1 . 16788 1 1176 . 2 2 35 35 TYR HE2 H 1 7.14 0.02 . 1 . . . . 153 TYR HE2 . 16788 1 1177 . 2 2 35 35 TYR CA C 13 61.77 0.2 . 1 . . . . 153 TYR CA . 16788 1 1178 . 2 2 35 35 TYR CB C 13 38.59 0.2 . 1 . . . . 153 TYR CB . 16788 1 1179 . 2 2 35 35 TYR N N 15 122.65 0.1 . 1 . . . . 153 TYR N . 16788 1 1180 . 2 2 36 36 GLU H H 1 8.44 0.02 . 1 . . . . 154 GLU H . 16788 1 1181 . 2 2 36 36 GLU HA H 1 4.18 0.02 . 1 . . . . 154 GLU HA . 16788 1 1182 . 2 2 36 36 GLU HB2 H 1 2.18 0.02 . 2 . . . . 154 GLU HB2 . 16788 1 1183 . 2 2 36 36 GLU HB3 H 1 2.27 0.02 . 2 . . . . 154 GLU HB3 . 16788 1 1184 . 2 2 36 36 GLU HG2 H 1 2.29 0.02 . 2 . . . . 154 GLU HG2 . 16788 1 1185 . 2 2 36 36 GLU HG3 H 1 2.40 0.02 . 2 . . . . 154 GLU HG3 . 16788 1 1186 . 2 2 36 36 GLU CA C 13 59.23 0.2 . 1 . . . . 154 GLU CA . 16788 1 1187 . 2 2 36 36 GLU CB C 13 29.44 0.2 . 1 . . . . 154 GLU CB . 16788 1 1188 . 2 2 36 36 GLU CG C 13 36.73 0.2 . 1 . . . . 154 GLU CG . 16788 1 1189 . 2 2 36 36 GLU N N 15 120.21 0.1 . 1 . . . . 154 GLU N . 16788 1 1190 . 2 2 37 37 LYS H H 1 7.47 0.02 . 1 . . . . 155 LYS H . 16788 1 1191 . 2 2 37 37 LYS HA H 1 4.33 0.02 . 1 . . . . 155 LYS HA . 16788 1 1192 . 2 2 37 37 LYS HB2 H 1 1.31 0.02 . 2 . . . . 155 LYS HB2 . 16788 1 1193 . 2 2 37 37 LYS HB3 H 1 1.84 0.02 . 2 . . . . 155 LYS HB3 . 16788 1 1194 . 2 2 37 37 LYS HD2 H 1 1.59 0.02 . 2 . . . . 155 LYS HD2 . 16788 1 1195 . 2 2 37 37 LYS HD3 H 1 1.64 0.02 . 2 . . . . 155 LYS HD3 . 16788 1 1196 . 2 2 37 37 LYS HE2 H 1 2.97 0.02 . 2 . . . . 155 LYS HE2 . 16788 1 1197 . 2 2 37 37 LYS HE3 H 1 2.97 0.02 . 2 . . . . 155 LYS HE3 . 16788 1 1198 . 2 2 37 37 LYS HG2 H 1 1.32 0.02 . 2 . . . . 155 LYS HG2 . 16788 1 1199 . 2 2 37 37 LYS HG3 H 1 1.48 0.02 . 2 . . . . 155 LYS HG3 . 16788 1 1200 . 2 2 37 37 LYS CA C 13 55.11 0.2 . 1 . . . . 155 LYS CA . 16788 1 1201 . 2 2 37 37 LYS CB C 13 33.20 0.2 . 1 . . . . 155 LYS CB . 16788 1 1202 . 2 2 37 37 LYS CD C 13 28.74 0.2 . 1 . . . . 155 LYS CD . 16788 1 1203 . 2 2 37 37 LYS CE C 13 41.76 0.2 . 1 . . . . 155 LYS CE . 16788 1 1204 . 2 2 37 37 LYS CG C 13 25.44 0.2 . 1 . . . . 155 LYS CG . 16788 1 1205 . 2 2 37 37 LYS N N 15 115.67 0.1 . 1 . . . . 155 LYS N . 16788 1 1206 . 2 2 38 38 SER H H 1 7.45 0.02 . 1 . . . . 156 SER H . 16788 1 1207 . 2 2 38 38 SER HA H 1 2.52 0.02 . 1 . . . . 156 SER HA . 16788 1 1208 . 2 2 38 38 SER HB2 H 1 3.34 0.02 . 2 . . . . 156 SER HB2 . 16788 1 1209 . 2 2 38 38 SER HB3 H 1 3.92 0.02 . 2 . . . . 156 SER HB3 . 16788 1 1210 . 2 2 38 38 SER CA C 13 58.22 0.2 . 1 . . . . 156 SER CA . 16788 1 1211 . 2 2 38 38 SER CB C 13 61.00 0.2 . 1 . . . . 156 SER CB . 16788 1 1212 . 2 2 38 38 SER N N 15 113.86 0.1 . 1 . . . . 156 SER N . 16788 1 1213 . 2 2 39 39 ARG H H 1 7.68 0.02 . 1 . . . . 157 ARG H . 16788 1 1214 . 2 2 39 39 ARG HA H 1 5.19 0.02 . 1 . . . . 157 ARG HA . 16788 1 1215 . 2 2 39 39 ARG HB2 H 1 1.46 0.02 . 2 . . . . 157 ARG HB2 . 16788 1 1216 . 2 2 39 39 ARG HB3 H 1 1.75 0.02 . 2 . . . . 157 ARG HB3 . 16788 1 1217 . 2 2 39 39 ARG HD2 H 1 3.05 0.02 . 2 . . . . 157 ARG HD2 . 16788 1 1218 . 2 2 39 39 ARG HD3 H 1 3.18 0.02 . 2 . . . . 157 ARG HD3 . 16788 1 1219 . 2 2 39 39 ARG HG2 H 1 1.54 0.02 . 2 . . . . 157 ARG HG2 . 16788 1 1220 . 2 2 39 39 ARG HG3 H 1 1.63 0.02 . 2 . . . . 157 ARG HG3 . 16788 1 1221 . 2 2 39 39 ARG CA C 13 53.21 0.2 . 1 . . . . 157 ARG CA . 16788 1 1222 . 2 2 39 39 ARG CB C 13 34.86 0.2 . 1 . . . . 157 ARG CB . 16788 1 1223 . 2 2 39 39 ARG CD C 13 42.96 0.2 . 1 . . . . 157 ARG CD . 16788 1 1224 . 2 2 39 39 ARG CG C 13 26.48 0.2 . 1 . . . . 157 ARG CG . 16788 1 1225 . 2 2 39 39 ARG N N 15 117.44 0.1 . 1 . . . . 157 ARG N . 16788 1 1226 . 2 2 40 40 LEU H H 1 9.33 0.02 . 1 . . . . 158 LEU H . 16788 1 1227 . 2 2 40 40 LEU HA H 1 5.02 0.02 . 1 . . . . 158 LEU HA . 16788 1 1228 . 2 2 40 40 LEU HB2 H 1 1.37 0.02 . 2 . . . . 158 LEU HB2 . 16788 1 1229 . 2 2 40 40 LEU HB3 H 1 1.65 0.02 . 2 . . . . 158 LEU HB3 . 16788 1 1230 . 2 2 40 40 LEU HD11 H 1 0.12 0.02 . 2 . . . . 158 LEU MD1 . 16788 1 1231 . 2 2 40 40 LEU HD12 H 1 0.12 0.02 . 2 . . . . 158 LEU MD1 . 16788 1 1232 . 2 2 40 40 LEU HD13 H 1 0.12 0.02 . 2 . . . . 158 LEU MD1 . 16788 1 1233 . 2 2 40 40 LEU HD21 H 1 0.40 0.02 . 2 . . . . 158 LEU MD2 . 16788 1 1234 . 2 2 40 40 LEU HD22 H 1 0.40 0.02 . 2 . . . . 158 LEU MD2 . 16788 1 1235 . 2 2 40 40 LEU HD23 H 1 0.40 0.02 . 2 . . . . 158 LEU MD2 . 16788 1 1236 . 2 2 40 40 LEU HG H 1 1.36 0.02 . 1 . . . . 158 LEU HG . 16788 1 1237 . 2 2 40 40 LEU CA C 13 53.47 0.2 . 1 . . . . 158 LEU CA . 16788 1 1238 . 2 2 40 40 LEU CB C 13 46.08 0.2 . 1 . . . . 158 LEU CB . 16788 1 1239 . 2 2 40 40 LEU CD1 C 13 26.83 0.2 . 2 . . . . 158 LEU CD1 . 16788 1 1240 . 2 2 40 40 LEU CD2 C 13 25.92 0.2 . 2 . . . . 158 LEU CD2 . 16788 1 1241 . 2 2 40 40 LEU CG C 13 26.68 0.2 . 1 . . . . 158 LEU CG . 16788 1 1242 . 2 2 40 40 LEU N N 15 121.41 0.1 . 1 . . . . 158 LEU N . 16788 1 1243 . 2 2 41 41 LYS H H 1 8.44 0.02 . 1 . . . . 159 LYS H . 16788 1 1244 . 2 2 41 41 LYS HA H 1 5.15 0.02 . 1 . . . . 159 LYS HA . 16788 1 1245 . 2 2 41 41 LYS HB2 H 1 1.66 0.02 . 2 . . . . 159 LYS HB2 . 16788 1 1246 . 2 2 41 41 LYS HB3 H 1 1.66 0.02 . 2 . . . . 159 LYS HB3 . 16788 1 1247 . 2 2 41 41 LYS HD2 H 1 1.55 0.02 . 2 . . . . 159 LYS HD2 . 16788 1 1248 . 2 2 41 41 LYS HD3 H 1 1.65 0.02 . 2 . . . . 159 LYS HD3 . 16788 1 1249 . 2 2 41 41 LYS HE2 H 1 2.89 0.02 . 2 . . . . 159 LYS HE2 . 16788 1 1250 . 2 2 41 41 LYS HE3 H 1 2.89 0.02 . 2 . . . . 159 LYS HE3 . 16788 1 1251 . 2 2 41 41 LYS HG2 H 1 1.17 0.02 . 2 . . . . 159 LYS HG2 . 16788 1 1252 . 2 2 41 41 LYS HG3 H 1 1.41 0.02 . 2 . . . . 159 LYS HG3 . 16788 1 1253 . 2 2 41 41 LYS CA C 13 55.25 0.2 . 1 . . . . 159 LYS CA . 16788 1 1254 . 2 2 41 41 LYS CB C 13 34.77 0.2 . 1 . . . . 159 LYS CB . 16788 1 1255 . 2 2 41 41 LYS CD C 13 29.49 0.2 . 1 . . . . 159 LYS CD . 16788 1 1256 . 2 2 41 41 LYS CE C 13 41.78 0.2 . 1 . . . . 159 LYS CE . 16788 1 1257 . 2 2 41 41 LYS CG C 13 25.45 0.2 . 1 . . . . 159 LYS CG . 16788 1 1258 . 2 2 41 41 LYS N N 15 120.21 0.1 . 1 . . . . 159 LYS N . 16788 1 1259 . 2 2 42 42 VAL H H 1 9.21 0.02 . 1 . . . . 160 VAL H . 16788 1 1260 . 2 2 42 42 VAL HA H 1 4.76 0.02 . 1 . . . . 160 VAL HA . 16788 1 1261 . 2 2 42 42 VAL HB H 1 1.64 0.02 . 1 . . . . 160 VAL HB . 16788 1 1262 . 2 2 42 42 VAL HG11 H 1 0.49 0.02 . 2 . . . . 160 VAL MG1 . 16788 1 1263 . 2 2 42 42 VAL HG12 H 1 0.49 0.02 . 2 . . . . 160 VAL MG1 . 16788 1 1264 . 2 2 42 42 VAL HG13 H 1 0.49 0.02 . 2 . . . . 160 VAL MG1 . 16788 1 1265 . 2 2 42 42 VAL HG21 H 1 0.61 0.02 . 2 . . . . 160 VAL MG2 . 16788 1 1266 . 2 2 42 42 VAL HG22 H 1 0.61 0.02 . 2 . . . . 160 VAL MG2 . 16788 1 1267 . 2 2 42 42 VAL HG23 H 1 0.61 0.02 . 2 . . . . 160 VAL MG2 . 16788 1 1268 . 2 2 42 42 VAL CA C 13 59.17 0.2 . 1 . . . . 160 VAL CA . 16788 1 1269 . 2 2 42 42 VAL CB C 13 35.02 0.2 . 1 . . . . 160 VAL CB . 16788 1 1270 . 2 2 42 42 VAL CG1 C 13 21.33 0.2 . 2 . . . . 160 VAL CG1 . 16788 1 1271 . 2 2 42 42 VAL CG2 C 13 22.00 0.2 . 2 . . . . 160 VAL CG2 . 16788 1 1272 . 2 2 42 42 VAL N N 15 124.94 0.1 . 1 . . . . 160 VAL N . 16788 1 1273 . 2 2 43 43 SER H H 1 9.16 0.02 . 1 . . . . 161 SER H . 16788 1 1274 . 2 2 43 43 SER HA H 1 4.81 0.02 . 1 . . . . 161 SER HA . 16788 1 1275 . 2 2 43 43 SER HB2 H 1 3.69 0.02 . 2 . . . . 161 SER HB2 . 16788 1 1276 . 2 2 43 43 SER HB3 H 1 3.69 0.02 . 2 . . . . 161 SER HB3 . 16788 1 1277 . 2 2 43 43 SER CA C 13 57.39 0.2 . 1 . . . . 161 SER CA . 16788 1 1278 . 2 2 43 43 SER CB C 13 63.09 0.2 . 1 . . . . 161 SER CB . 16788 1 1279 . 2 2 43 43 SER N N 15 120.95 0.1 . 1 . . . . 161 SER N . 16788 1 1280 . 2 2 44 44 VAL H H 1 8.70 0.02 . 1 . . . . 162 VAL H . 16788 1 1281 . 2 2 44 44 VAL N N 15 125.24 0.1 . 1 . . . . 162 VAL N . 16788 1 1282 . 2 2 45 45 SER H H 1 8.65 0.02 . 1 . . . . 163 SER H . 16788 1 1283 . 2 2 45 45 SER HA H 1 4.84 0.02 . 1 . . . . 163 SER HA . 16788 1 1284 . 2 2 45 45 SER HB2 H 1 3.73 0.02 . 2 . . . . 163 SER HB2 . 16788 1 1285 . 2 2 45 45 SER HB3 H 1 3.85 0.02 . 2 . . . . 163 SER HB3 . 16788 1 1286 . 2 2 45 45 SER CA C 13 57.39 0.2 . 1 . . . . 163 SER CA . 16788 1 1287 . 2 2 45 45 SER CB C 13 62.56 0.2 . 1 . . . . 163 SER CB . 16788 1 1288 . 2 2 45 45 SER N N 15 119.42 0.1 . 1 . . . . 163 SER N . 16788 1 1289 . 2 2 46 46 ILE H H 1 8.35 0.02 . 1 . . . . 164 ILE H . 16788 1 1290 . 2 2 46 46 ILE HB H 1 1.63 0.02 . 1 . . . . 164 ILE HB . 16788 1 1291 . 2 2 46 46 ILE HD11 H 1 0.44 0.02 . 1 . . . . 164 ILE MD . 16788 1 1292 . 2 2 46 46 ILE HD12 H 1 0.44 0.02 . 1 . . . . 164 ILE MD . 16788 1 1293 . 2 2 46 46 ILE HD13 H 1 0.44 0.02 . 1 . . . . 164 ILE MD . 16788 1 1294 . 2 2 46 46 ILE HG12 H 1 1.08 0.02 . 2 . . . . 164 ILE HG12 . 16788 1 1295 . 2 2 46 46 ILE HG13 H 1 1.08 0.02 . 2 . . . . 164 ILE HG13 . 16788 1 1296 . 2 2 46 46 ILE HG21 H 1 0.60 0.02 . 1 . . . . 164 ILE MG . 16788 1 1297 . 2 2 46 46 ILE HG22 H 1 0.60 0.02 . 1 . . . . 164 ILE MG . 16788 1 1298 . 2 2 46 46 ILE HG23 H 1 0.60 0.02 . 1 . . . . 164 ILE MG . 16788 1 1299 . 2 2 46 46 ILE CB C 13 39.12 0.2 . 1 . . . . 164 ILE CB . 16788 1 1300 . 2 2 46 46 ILE CD1 C 13 13.65 0.2 . 1 . . . . 164 ILE CD1 . 16788 1 1301 . 2 2 46 46 ILE CG1 C 13 27.14 0.2 . 1 . . . . 164 ILE CG1 . 16788 1 1302 . 2 2 46 46 ILE CG2 C 13 16.39 0.2 . 1 . . . . 164 ILE CG2 . 16788 1 1303 . 2 2 46 46 ILE N N 15 126.40 0.1 . 1 . . . . 164 ILE N . 16788 1 1304 . 2 2 48 48 GLY HA2 H 1 4.05 0.02 . 2 . . . . 166 GLY HA2 . 16788 1 1305 . 2 2 48 48 GLY HA3 H 1 4.16 0.02 . 2 . . . . 166 GLY HA3 . 16788 1 1306 . 2 2 48 48 GLY CA C 13 44.59 0.2 . 1 . . . . 166 GLY CA . 16788 1 1307 . 2 2 49 49 ARG H H 1 7.83 0.02 . 1 . . . . 167 ARG H . 16788 1 1308 . 2 2 49 49 ARG N N 15 119.64 0.1 . 1 . . . . 167 ARG N . 16788 1 1309 . 2 2 50 50 ALA HA H 1 4.55 0.02 . 1 . . . . 168 ALA HA . 16788 1 1310 . 2 2 50 50 ALA HB1 H 1 1.29 0.02 . 1 . . . . 168 ALA MB . 16788 1 1311 . 2 2 50 50 ALA HB2 H 1 1.29 0.02 . 1 . . . . 168 ALA MB . 16788 1 1312 . 2 2 50 50 ALA HB3 H 1 1.29 0.02 . 1 . . . . 168 ALA MB . 16788 1 1313 . 2 2 50 50 ALA CA C 13 52.42 0.2 . 1 . . . . 168 ALA CA . 16788 1 1314 . 2 2 50 50 ALA CB C 13 18.27 0.2 . 1 . . . . 168 ALA CB . 16788 1 1315 . 2 2 51 51 THR HA H 1 4.81 0.02 . 1 . . . . 169 THR HA . 16788 1 1316 . 2 2 51 51 THR HB H 1 3.98 0.02 . 1 . . . . 169 THR HB . 16788 1 1317 . 2 2 51 51 THR HG21 H 1 1.14 0.02 . 1 . . . . 169 THR MG . 16788 1 1318 . 2 2 51 51 THR HG22 H 1 1.14 0.02 . 1 . . . . 169 THR MG . 16788 1 1319 . 2 2 51 51 THR HG23 H 1 1.14 0.02 . 1 . . . . 169 THR MG . 16788 1 1320 . 2 2 51 51 THR CA C 13 60.13 0.2 . 1 . . . . 169 THR CA . 16788 1 1321 . 2 2 51 51 THR CB C 13 72.10 0.2 . 1 . . . . 169 THR CB . 16788 1 1322 . 2 2 52 52 PRO HA H 1 4.64 0.02 . 1 . . . . 170 PRO HA . 16788 1 1323 . 2 2 52 52 PRO HB2 H 1 2.16 0.02 . 2 . . . . 170 PRO HB2 . 16788 1 1324 . 2 2 52 52 PRO HB3 H 1 2.38 0.02 . 2 . . . . 170 PRO HB3 . 16788 1 1325 . 2 2 52 52 PRO HD2 H 1 3.59 0.02 . 2 . . . . 170 PRO HD2 . 16788 1 1326 . 2 2 52 52 PRO HD3 H 1 3.84 0.02 . 2 . . . . 170 PRO HD3 . 16788 1 1327 . 2 2 52 52 PRO HG2 H 1 1.79 0.02 . 2 . . . . 170 PRO HG2 . 16788 1 1328 . 2 2 52 52 PRO HG3 H 1 1.93 0.02 . 2 . . . . 170 PRO HG3 . 16788 1 1329 . 2 2 52 52 PRO CA C 13 62.93 0.2 . 1 . . . . 170 PRO CA . 16788 1 1330 . 2 2 52 52 PRO CB C 13 34.53 0.2 . 1 . . . . 170 PRO CB . 16788 1 1331 . 2 2 52 52 PRO CD C 13 50.66 0.2 . 1 . . . . 170 PRO CD . 16788 1 1332 . 2 2 52 52 PRO CG C 13 24.34 0.2 . 1 . . . . 170 PRO CG . 16788 1 1333 . 2 2 53 53 VAL H H 1 9.12 0.02 . 1 . . . . 171 VAL H . 16788 1 1334 . 2 2 53 53 VAL HA H 1 4.16 0.02 . 1 . . . . 171 VAL HA . 16788 1 1335 . 2 2 53 53 VAL HB H 1 2.15 0.02 . 1 . . . . 171 VAL HB . 16788 1 1336 . 2 2 53 53 VAL HG11 H 1 0.69 0.02 . 2 . . . . 171 VAL MG1 . 16788 1 1337 . 2 2 53 53 VAL HG12 H 1 0.69 0.02 . 2 . . . . 171 VAL MG1 . 16788 1 1338 . 2 2 53 53 VAL HG13 H 1 0.69 0.02 . 2 . . . . 171 VAL MG1 . 16788 1 1339 . 2 2 53 53 VAL HG21 H 1 0.63 0.02 . 2 . . . . 171 VAL MG2 . 16788 1 1340 . 2 2 53 53 VAL HG22 H 1 0.63 0.02 . 2 . . . . 171 VAL MG2 . 16788 1 1341 . 2 2 53 53 VAL HG23 H 1 0.63 0.02 . 2 . . . . 171 VAL MG2 . 16788 1 1342 . 2 2 53 53 VAL CA C 13 62.21 0.2 . 1 . . . . 171 VAL CA . 16788 1 1343 . 2 2 53 53 VAL CB C 13 32.67 0.2 . 1 . . . . 171 VAL CB . 16788 1 1344 . 2 2 53 53 VAL CG1 C 13 21.58 0.2 . 2 . . . . 171 VAL CG1 . 16788 1 1345 . 2 2 53 53 VAL CG2 C 13 21.17 0.2 . 2 . . . . 171 VAL CG2 . 16788 1 1346 . 2 2 53 53 VAL N N 15 123.96 0.1 . 1 . . . . 171 VAL N . 16788 1 1347 . 2 2 54 54 GLU HA H 1 5.31 0.02 . 1 . . . . 172 GLU HA . 16788 1 1348 . 2 2 54 54 GLU HB2 H 1 1.91 0.02 . 2 . . . . 172 GLU HB2 . 16788 1 1349 . 2 2 54 54 GLU HB3 H 1 2.06 0.02 . 2 . . . . 172 GLU HB3 . 16788 1 1350 . 2 2 54 54 GLU HG2 H 1 2.04 0.02 . 2 . . . . 172 GLU HG2 . 16788 1 1351 . 2 2 54 54 GLU HG3 H 1 2.20 0.02 . 2 . . . . 172 GLU HG3 . 16788 1 1352 . 2 2 54 54 GLU CA C 13 55.04 0.2 . 1 . . . . 172 GLU CA . 16788 1 1353 . 2 2 54 54 GLU CB C 13 31.57 0.2 . 1 . . . . 172 GLU CB . 16788 1 1354 . 2 2 54 54 GLU CG C 13 37.45 0.2 . 1 . . . . 172 GLU CG . 16788 1 1355 . 2 2 55 55 LEU H H 1 8.96 0.02 . 1 . . . . 173 LEU H . 16788 1 1356 . 2 2 55 55 LEU HA H 1 4.85 0.02 . 1 . . . . 173 LEU HA . 16788 1 1357 . 2 2 55 55 LEU HB2 H 1 1.36 0.02 . 2 . . . . 173 LEU HB2 . 16788 1 1358 . 2 2 55 55 LEU HB3 H 1 1.68 0.02 . 2 . . . . 173 LEU HB3 . 16788 1 1359 . 2 2 55 55 LEU HD11 H 1 0.65 0.02 . 2 . . . . 173 LEU MD1 . 16788 1 1360 . 2 2 55 55 LEU HD12 H 1 0.65 0.02 . 2 . . . . 173 LEU MD1 . 16788 1 1361 . 2 2 55 55 LEU HD13 H 1 0.65 0.02 . 2 . . . . 173 LEU MD1 . 16788 1 1362 . 2 2 55 55 LEU HD21 H 1 0.86 0.02 . 2 . . . . 173 LEU MD2 . 16788 1 1363 . 2 2 55 55 LEU HD22 H 1 0.86 0.02 . 2 . . . . 173 LEU MD2 . 16788 1 1364 . 2 2 55 55 LEU HD23 H 1 0.86 0.02 . 2 . . . . 173 LEU MD2 . 16788 1 1365 . 2 2 55 55 LEU HG H 1 1.36 0.02 . 1 . . . . 173 LEU HG . 16788 1 1366 . 2 2 55 55 LEU CA C 13 53.78 0.2 . 1 . . . . 173 LEU CA . 16788 1 1367 . 2 2 55 55 LEU CB C 13 45.65 0.2 . 1 . . . . 173 LEU CB . 16788 1 1368 . 2 2 55 55 LEU CD1 C 13 27.75 0.2 . 2 . . . . 173 LEU CD1 . 16788 1 1369 . 2 2 55 55 LEU CD2 C 13 24.99 0.2 . 2 . . . . 173 LEU CD2 . 16788 1 1370 . 2 2 55 55 LEU CG C 13 27.67 0.2 . 1 . . . . 173 LEU CG . 16788 1 1371 . 2 2 55 55 LEU N N 15 125.26 0.1 . 1 . . . . 173 LEU N . 16788 1 1372 . 2 2 56 56 ASP H H 1 8.74 0.02 . 1 . . . . 174 ASP H . 16788 1 1373 . 2 2 56 56 ASP HA H 1 5.16 0.02 . 1 . . . . 174 ASP HA . 16788 1 1374 . 2 2 56 56 ASP HB2 H 1 2.65 0.02 . 2 . . . . 174 ASP HB2 . 16788 1 1375 . 2 2 56 56 ASP HB3 H 1 2.93 0.02 . 2 . . . . 174 ASP HB3 . 16788 1 1376 . 2 2 56 56 ASP CA C 13 54.48 0.2 . 1 . . . . 174 ASP CA . 16788 1 1377 . 2 2 56 56 ASP CB C 13 43.07 0.2 . 1 . . . . 174 ASP CB . 16788 1 1378 . 2 2 56 56 ASP N N 15 119.90 0.1 . 1 . . . . 174 ASP N . 16788 1 1379 . 2 2 57 57 PHE H H 1 8.13 0.02 . 1 . . . . 175 PHE H . 16788 1 1380 . 2 2 57 57 PHE HA H 1 4.14 0.02 . 1 . . . . 175 PHE HA . 16788 1 1381 . 2 2 57 57 PHE HB2 H 1 3.40 0.02 . 2 . . . . 175 PHE HB2 . 16788 1 1382 . 2 2 57 57 PHE HB3 H 1 3.40 0.02 . 2 . . . . 175 PHE HB3 . 16788 1 1383 . 2 2 57 57 PHE HD1 H 1 7.10 0.02 . 1 . . . . 175 PHE HD1 . 16788 1 1384 . 2 2 57 57 PHE HD2 H 1 7.10 0.02 . 1 . . . . 175 PHE HD2 . 16788 1 1385 . 2 2 57 57 PHE HE1 H 1 7.35 0.02 . 1 . . . . 175 PHE HE1 . 16788 1 1386 . 2 2 57 57 PHE HE2 H 1 7.35 0.02 . 1 . . . . 175 PHE HE2 . 16788 1 1387 . 2 2 57 57 PHE HZ H 1 6.78 0.02 . 1 . . . . 175 PHE HZ . 16788 1 1388 . 2 2 57 57 PHE CA C 13 58.83 0.2 . 1 . . . . 175 PHE CA . 16788 1 1389 . 2 2 57 57 PHE CB C 13 38.46 0.2 . 1 . . . . 175 PHE CB . 16788 1 1390 . 2 2 57 57 PHE N N 15 121.66 0.1 . 1 . . . . 175 PHE N . 16788 1 1391 . 2 2 58 58 SER H H 1 8.55 0.02 . 1 . . . . 176 SER H . 16788 1 1392 . 2 2 58 58 SER HA H 1 4.42 0.02 . 1 . . . . 176 SER HA . 16788 1 1393 . 2 2 58 58 SER HB2 H 1 4.01 0.02 . 2 . . . . 176 SER HB2 . 16788 1 1394 . 2 2 58 58 SER HB3 H 1 4.17 0.02 . 2 . . . . 176 SER HB3 . 16788 1 1395 . 2 2 58 58 SER CA C 13 60.21 0.2 . 1 . . . . 176 SER CA . 16788 1 1396 . 2 2 58 58 SER CB C 13 63.13 0.2 . 1 . . . . 176 SER CB . 16788 1 1397 . 2 2 58 58 SER N N 15 109.69 0.1 . 1 . . . . 176 SER N . 16788 1 1398 . 2 2 59 59 GLN H H 1 7.84 0.02 . 1 . . . . 177 GLN H . 16788 1 1399 . 2 2 59 59 GLN HA H 1 4.75 0.02 . 1 . . . . 177 GLN HA . 16788 1 1400 . 2 2 59 59 GLN HB2 H 1 2.48 0.02 . 2 . . . . 177 GLN HB2 . 16788 1 1401 . 2 2 59 59 GLN HB3 H 1 2.48 0.02 . 2 . . . . 177 GLN HB3 . 16788 1 1402 . 2 2 59 59 GLN HE21 H 1 6.83 0.02 . 1 . . . . 177 GLN HE21 . 16788 1 1403 . 2 2 59 59 GLN HE22 H 1 6.83 0.02 . 1 . . . . 177 GLN HE22 . 16788 1 1404 . 2 2 59 59 GLN HG2 H 1 2.39 0.02 . 2 . . . . 177 GLN HG2 . 16788 1 1405 . 2 2 59 59 GLN HG3 H 1 2.51 0.02 . 2 . . . . 177 GLN HG3 . 16788 1 1406 . 2 2 59 59 GLN CA C 13 56.28 0.2 . 1 . . . . 177 GLN CA . 16788 1 1407 . 2 2 59 59 GLN CB C 13 31.20 0.2 . 1 . . . . 177 GLN CB . 16788 1 1408 . 2 2 59 59 GLN CG C 13 35.99 0.2 . 1 . . . . 177 GLN CG . 16788 1 1409 . 2 2 59 59 GLN N N 15 119.12 0.1 . 1 . . . . 177 GLN N . 16788 1 1410 . 2 2 59 59 GLN NE2 N 15 111.68 0.1 . 1 . . . . 177 GLN NE2 . 16788 1 1411 . 2 2 60 60 VAL H H 1 7.38 0.02 . 1 . . . . 178 VAL H . 16788 1 1412 . 2 2 60 60 VAL HA H 1 5.30 0.02 . 1 . . . . 178 VAL HA . 16788 1 1413 . 2 2 60 60 VAL HB H 1 1.79 0.02 . 1 . . . . 178 VAL HB . 16788 1 1414 . 2 2 60 60 VAL HG11 H 1 0.55 0.02 . 2 . . . . 178 VAL MG1 . 16788 1 1415 . 2 2 60 60 VAL HG12 H 1 0.55 0.02 . 2 . . . . 178 VAL MG1 . 16788 1 1416 . 2 2 60 60 VAL HG13 H 1 0.55 0.02 . 2 . . . . 178 VAL MG1 . 16788 1 1417 . 2 2 60 60 VAL HG21 H 1 0.67 0.02 . 2 . . . . 178 VAL MG2 . 16788 1 1418 . 2 2 60 60 VAL HG22 H 1 0.67 0.02 . 2 . . . . 178 VAL MG2 . 16788 1 1419 . 2 2 60 60 VAL HG23 H 1 0.67 0.02 . 2 . . . . 178 VAL MG2 . 16788 1 1420 . 2 2 60 60 VAL CA C 13 58.71 0.2 . 1 . . . . 178 VAL CA . 16788 1 1421 . 2 2 60 60 VAL CB C 13 36.01 0.2 . 1 . . . . 178 VAL CB . 16788 1 1422 . 2 2 60 60 VAL CG1 C 13 20.12 0.2 . 2 . . . . 178 VAL CG1 . 16788 1 1423 . 2 2 60 60 VAL CG2 C 13 22.97 0.2 . 2 . . . . 178 VAL CG2 . 16788 1 1424 . 2 2 60 60 VAL N N 15 110.61 0.1 . 1 . . . . 178 VAL N . 16788 1 1425 . 2 2 61 61 GLU H H 1 8.73 0.02 . 1 . . . . 179 GLU H . 16788 1 1426 . 2 2 61 61 GLU HA H 1 4.88 0.02 . 1 . . . . 179 GLU HA . 16788 1 1427 . 2 2 61 61 GLU HB2 H 1 2.03 0.02 . 2 . . . . 179 GLU HB2 . 16788 1 1428 . 2 2 61 61 GLU HB3 H 1 2.12 0.02 . 2 . . . . 179 GLU HB3 . 16788 1 1429 . 2 2 61 61 GLU HG2 H 1 2.35 0.02 . 2 . . . . 179 GLU HG2 . 16788 1 1430 . 2 2 61 61 GLU HG3 H 1 2.23 0.02 . 2 . . . . 179 GLU HG3 . 16788 1 1431 . 2 2 61 61 GLU CA C 13 53.75 0.2 . 1 . . . . 179 GLU CA . 16788 1 1432 . 2 2 61 61 GLU CB C 13 33.81 0.2 . 1 . . . . 179 GLU CB . 16788 1 1433 . 2 2 61 61 GLU CG C 13 35.77 0.2 . 1 . . . . 179 GLU CG . 16788 1 1434 . 2 2 61 61 GLU N N 15 117.96 0.1 . 1 . . . . 179 GLU N . 16788 1 1435 . 2 2 62 62 LYS H H 1 8.78 0.02 . 1 . . . . 180 LYS H . 16788 1 1436 . 2 2 62 62 LYS HA H 1 4.38 0.02 . 1 . . . . 180 LYS HA . 16788 1 1437 . 2 2 62 62 LYS HB2 H 1 1.81 0.02 . 2 . . . . 180 LYS HB2 . 16788 1 1438 . 2 2 62 62 LYS HB3 H 1 2.05 0.02 . 2 . . . . 180 LYS HB3 . 16788 1 1439 . 2 2 62 62 LYS HD2 H 1 1.68 0.02 . 2 . . . . 180 LYS HD2 . 16788 1 1440 . 2 2 62 62 LYS HD3 H 1 1.68 0.02 . 2 . . . . 180 LYS HD3 . 16788 1 1441 . 2 2 62 62 LYS HE2 H 1 2.75 0.02 . 2 . . . . 180 LYS HE2 . 16788 1 1442 . 2 2 62 62 LYS HE3 H 1 2.80 0.02 . 2 . . . . 180 LYS HE3 . 16788 1 1443 . 2 2 62 62 LYS HG2 H 1 1.60 0.02 . 2 . . . . 180 LYS HG2 . 16788 1 1444 . 2 2 62 62 LYS HG3 H 1 1.62 0.02 . 2 . . . . 180 LYS HG3 . 16788 1 1445 . 2 2 62 62 LYS CA C 13 57.95 0.2 . 1 . . . . 180 LYS CA . 16788 1 1446 . 2 2 62 62 LYS CB C 13 32.56 0.2 . 1 . . . . 180 LYS CB . 16788 1 1447 . 2 2 62 62 LYS CD C 13 28.88 0.2 . 1 . . . . 180 LYS CD . 16788 1 1448 . 2 2 62 62 LYS CE C 13 41.91 0.2 . 1 . . . . 180 LYS CE . 16788 1 1449 . 2 2 62 62 LYS CG C 13 26.12 0.2 . 1 . . . . 180 LYS CG . 16788 1 1450 . 2 2 62 62 LYS N N 15 122.29 0.1 . 1 . . . . 180 LYS N . 16788 1 1451 . 2 2 63 63 ALA H H 1 7.92 0.02 . 1 . . . . 181 ALA H . 16788 1 1452 . 2 2 63 63 ALA HA H 1 4.20 0.02 . 1 . . . . 181 ALA HA . 16788 1 1453 . 2 2 63 63 ALA HB1 H 1 1.22 0.02 . 1 . . . . 181 ALA MB . 16788 1 1454 . 2 2 63 63 ALA HB2 H 1 1.22 0.02 . 1 . . . . 181 ALA MB . 16788 1 1455 . 2 2 63 63 ALA HB3 H 1 1.22 0.02 . 1 . . . . 181 ALA MB . 16788 1 1456 . 2 2 63 63 ALA CA C 13 53.41 0.2 . 1 . . . . 181 ALA CA . 16788 1 1457 . 2 2 63 63 ALA CB C 13 20.39 0.2 . 1 . . . . 181 ALA CB . 16788 1 1458 . 2 2 63 63 ALA N N 15 131.76 0.1 . 1 . . . . 181 ALA N . 16788 1 stop_ save_