data_10236 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 10236 _Entry.Title ; Structure of the C-terminal PID Domain of Fe65L1 Complexed with the Cytoplasmic Tail of APP Reveals a Novel Peptide Binding Mode ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2008-08-22 _Entry.Accession_date 2008-08-22 _Entry.Last_release_date 2009-03-19 _Entry.Original_release_date 2009-03-19 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.120 _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 H. Li . . . 10236 2 S. Koshiba . . . 10236 3 N. Tochio . . . 10236 4 S. Watanabe . . . 10236 5 T. Harada . . . 10236 6 M. Inoue . . . 10236 7 T. Kigawa . . . 10236 8 S. Yokoyama . . . 10236 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'Protein 3000 Project' 'Protein Research Group, RIKEN Genomic Sciences Center' 'RIKEN GSC' 10236 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 10236 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 552 10236 '15N chemical shifts' 136 10236 '1H chemical shifts' 1087 10236 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 . . 2009-03-19 2008-08-22 original author . 10236 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2ROZ 'BMRB Entry Tracking System' 10236 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 10236 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 18650440 _Citation.Full_citation . _Citation.Title ; Structure of the C-terminal PID Domain of Fe65L1 Complexed with the Cytoplasmic Tail of APP Reveals a Novel Peptide Binding Mode ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full 'Journal of Biological Chemistry' _Citation.Journal_volume 283 _Citation.Journal_issue 40 _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 27165 _Citation.Page_last 27178 _Citation.Year 2008 _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 H. Li . . . 10236 1 2 S. Koshiba . . . 10236 1 3 F. Hayashi . . . 10236 1 4 N. Tochio . . . 10236 1 5 T. Tomozawa . . . 10236 1 6 T. Kasai . . . 10236 1 7 T. Yabuki . . . 10236 1 8 Y. Motoda . . . 10236 1 9 T. Harada . . . 10236 1 10 S. Watanabe . . . 10236 1 11 M. Inoue . . . 10236 1 12 Y. Hayashizaki . . . 10236 1 13 A. Tanaka . . . 10236 1 14 T. Kigawa . . . 10236 1 15 S. Yokoyama . . . 10236 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 10236 _Assembly.ID 1 _Assembly.Name 'peptide from Amyloid beta A4 protein, Amyloid beta A4 precursor protein-binding family B member 2' _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 'peptide from Amyloid beta A4 protein' 1 $entity_1 . . yes native no no . . . 10236 1 2 'C-terminal PID Domain' 2 $entity_2 . . yes native no no . . . 10236 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . PDB 2ROZ . . . . . . 10236 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 10236 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'peptide from Amyloid beta A4 protein' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; DAAVTPEERHLSKMQQNGYE NPTYKFFEQMQN ; _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 32 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 10237 . "PID domain and APP peptide" . . . . . 100.00 185 100.00 100.00 6.13e-14 . . . . 10236 1 2 no BMRB 10238 . "APP peptide and PID domain" . . . . . 100.00 176 100.00 100.00 6.21e-14 . . . . 10236 1 3 no BMRB 10239 . "APP peptide and PID domain" . . . . . 100.00 185 100.00 100.00 6.13e-14 . . . . 10236 1 4 no BMRB 15775 . APP_C99 . . . . . 100.00 122 100.00 100.00 1.10e-14 . . . . 10236 1 5 no PDB 2LP1 . "The Solution Nmr Structure Of The Transmembrane C-Terminal Domain Of The Amyloid Precursor Protein (C99)" . . . . . 100.00 122 100.00 100.00 1.10e-14 . . . . 10236 1 6 no PDB 2ROZ . "Structure Of The C-Terminal Pid Domain Of Fe65l1 Complexed With The Cytoplasmic Tail Of App Reveals A Novel Peptide Binding Mod" . . . . . 100.00 32 100.00 100.00 3.58e-14 . . . . 10236 1 7 no PDB 2YSZ . "Solution Structure Of The Chimera Of The C-Terminal Pid Domain Of Fe65l And The C-Terminal Tail Peptide Of App" . . . . . 100.00 185 100.00 100.00 6.13e-14 . . . . 10236 1 8 no PDB 2YT0 . "Solution Structure Of The Chimera Of The C-Terminal Tail Peptide Of App And The C-Terminal Pid Domain Of Fe65l" . . . . . 100.00 176 100.00 100.00 6.21e-14 . . . . 10236 1 9 no PDB 2YT1 . "Solution Structure Of The Chimera Of The C-Terminal Tail Peptide Of App And The C-Terminal Pid Domain Of Fe65l" . . . . . 100.00 185 100.00 100.00 6.13e-14 . . . . 10236 1 10 no PDB 3DXC . "Crystal Structure Of The Intracellular Domain Of Human App In Complex With Fe65-Ptb2" . . . . . 100.00 35 100.00 100.00 3.05e-14 . . . . 10236 1 11 no DBJ BAA22264 . "amyloid precursor protein [Homo sapiens]" . . . . . 100.00 770 100.00 100.00 1.16e-12 . . . . 10236 1 12 no DBJ BAA24230 . "EL amyloid precursor protein 699 [Narke japonica]" . . . . . 100.00 699 100.00 100.00 1.13e-12 . . . . 10236 1 13 no DBJ BAA84580 . "amyloid precursor protein [Sus scrofa]" . . . . . 100.00 770 100.00 100.00 1.14e-12 . . . . 10236 1 14 no DBJ BAC34997 . "unnamed protein product [Mus musculus]" . . . . . 100.00 218 100.00 100.00 8.71e-14 . . . . 10236 1 15 no DBJ BAC36369 . "unnamed protein product [Mus musculus]" . . . . . 100.00 384 100.00 100.00 3.64e-13 . . . . 10236 1 16 no EMBL CAA30050 . "amyloid A4 protein [Homo sapiens]" . . . . . 100.00 751 100.00 100.00 1.25e-12 . . . . 10236 1 17 no EMBL CAA30488 . "unnamed protein product [Rattus rattus]" . . . . . 100.00 695 100.00 100.00 9.81e-13 . . . . 10236 1 18 no EMBL CAA31830 . "A4 amyloid protein precursor [Homo sapiens]" . . . . . 100.00 695 100.00 100.00 1.03e-12 . . . . 10236 1 19 no EMBL CAA66230 . "putative amyloid precursor protein [Cavia sp.]" . . . . . 100.00 695 100.00 100.00 1.05e-12 . . . . 10236 1 20 no EMBL CAA68374 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 695 100.00 100.00 1.03e-12 . . . . 10236 1 21 no GB AAA36829 . "amyloid b-protein precursor [Macaca fascicularis]" . . . . . 100.00 695 100.00 100.00 1.03e-12 . . . . 10236 1 22 no GB AAA37139 . "beta-amyloid protein [Mus musculus]" . . . . . 100.00 695 100.00 100.00 9.62e-13 . . . . 10236 1 23 no GB AAA51722 . "amyloid beta-protein precursor, partial [Homo sapiens]" . . . . . 100.00 412 100.00 100.00 4.19e-13 . . . . 10236 1 24 no GB AAA51726 . "beta-amyloid A4, partial [Homo sapiens]" . . . . . 100.00 264 100.00 100.00 1.02e-13 . . . . 10236 1 25 no GB AAB41502 . "hippocampal amyloid precursor protein [Mus musculus]" . . . . . 100.00 695 100.00 100.00 9.81e-13 . . . . 10236 1 26 no PRF 1303338A . "amyloid A4 protein precursor" . . . . . 100.00 695 100.00 100.00 1.03e-12 . . . . 10236 1 27 no PRF 1403400A . "amyloid protein A4" . . . . . 100.00 751 100.00 100.00 1.25e-12 . . . . 10236 1 28 no PRF 1507304A . "beta amyloid peptide precursor" . . . . . 100.00 412 100.00 100.00 4.31e-13 . . . . 10236 1 29 no PRF 1507304B . "beta amyloid peptide precursor" . . . . . 100.00 574 100.00 100.00 6.80e-13 . . . . 10236 1 30 no PRF 1507304C . "beta amyloid peptide precursor" . . . . . 100.00 165 100.00 100.00 6.73e-14 . . . . 10236 1 31 no REF NP_000475 . "amyloid beta A4 protein isoform a precursor [Homo sapiens]" . . . . . 100.00 770 100.00 100.00 1.16e-12 . . . . 10236 1 32 no REF NP_001006601 . "amyloid beta A4 protein isoform APP-770 precursor [Canis lupus familiaris]" . . . . . 100.00 770 100.00 100.00 1.07e-12 . . . . 10236 1 33 no REF NP_001013036 . "amyloid beta A4 protein precursor [Pan troglodytes]" . . . . . 100.00 770 100.00 100.00 1.17e-12 . . . . 10236 1 34 no REF NP_001070264 . "amyloid beta A4 protein precursor [Bos taurus]" . . . . . 100.00 695 100.00 100.00 9.53e-13 . . . . 10236 1 35 no REF NP_001127014 . "amyloid beta A4 protein precursor [Pongo abelii]" . . . . . 100.00 695 100.00 100.00 1.05e-12 . . . . 10236 1 36 no SP O73683 . "RecName: Full=Amyloid beta A4 protein; AltName: Full=ABPP; Short=APP; AltName: Full=Alzheimer disease amyloid A4 protein homolo" . . . . . 100.00 780 100.00 100.00 1.34e-12 . . . . 10236 1 37 no SP P05067 . "RecName: Full=Amyloid beta A4 protein; AltName: Full=ABPP; AltName: Full=APPI; Short=APP; AltName: Full=Alzheimer disease amylo" . . . . . 100.00 770 100.00 100.00 1.16e-12 . . . . 10236 1 38 no SP P08592 . "RecName: Full=Amyloid beta A4 protein; AltName: Full=ABPP; Short=APP; AltName: Full=Alzheimer disease amyloid A4 protein homolo" . . . . . 100.00 770 100.00 100.00 1.17e-12 . . . . 10236 1 39 no SP P12023 . "RecName: Full=Amyloid beta A4 protein; AltName: Full=ABPP; Short=APP; AltName: Full=Alzheimer disease amyloid A4 protein homolo" . . . . . 100.00 770 100.00 100.00 1.17e-12 . . . . 10236 1 40 no SP P53601 . "RecName: Full=Amyloid beta A4 protein; AltName: Full=ABPP; Short=APP; AltName: Full=Alzheimer disease amyloid A4 protein homolo" . . . . . 100.00 770 100.00 100.00 1.19e-12 . . . . 10236 1 41 no TPG DAA33655 . "TPA: amyloid beta A4 protein [Bos taurus]" . . . . . 100.00 695 100.00 100.00 9.53e-13 . . . . 10236 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'peptide from Amyloid beta A4 protein' . 10236 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 . ASP . 10236 1 2 . ALA . 10236 1 3 . ALA . 10236 1 4 . VAL . 10236 1 5 . THR . 10236 1 6 . PRO . 10236 1 7 . GLU . 10236 1 8 . GLU . 10236 1 9 . ARG . 10236 1 10 . HIS . 10236 1 11 . LEU . 10236 1 12 . SER . 10236 1 13 . LYS . 10236 1 14 . MET . 10236 1 15 . GLN . 10236 1 16 . GLN . 10236 1 17 . ASN . 10236 1 18 . GLY . 10236 1 19 . TYR . 10236 1 20 . GLU . 10236 1 21 . ASN . 10236 1 22 . PRO . 10236 1 23 . THR . 10236 1 24 . TYR . 10236 1 25 . LYS . 10236 1 26 . PHE . 10236 1 27 . PHE . 10236 1 28 . GLU . 10236 1 29 . GLN . 10236 1 30 . MET . 10236 1 31 . GLN . 10236 1 32 . ASN . 10236 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 . ASP 1 1 10236 1 . ALA 2 2 10236 1 . ALA 3 3 10236 1 . VAL 4 4 10236 1 . THR 5 5 10236 1 . PRO 6 6 10236 1 . GLU 7 7 10236 1 . GLU 8 8 10236 1 . ARG 9 9 10236 1 . HIS 10 10 10236 1 . LEU 11 11 10236 1 . SER 12 12 10236 1 . LYS 13 13 10236 1 . MET 14 14 10236 1 . GLN 15 15 10236 1 . GLN 16 16 10236 1 . ASN 17 17 10236 1 . GLY 18 18 10236 1 . TYR 19 19 10236 1 . GLU 20 20 10236 1 . ASN 21 21 10236 1 . PRO 22 22 10236 1 . THR 23 23 10236 1 . TYR 24 24 10236 1 . LYS 25 25 10236 1 . PHE 26 26 10236 1 . PHE 27 27 10236 1 . GLU 28 28 10236 1 . GLN 29 29 10236 1 . MET 30 30 10236 1 . GLN 31 31 10236 1 . ASN 32 32 10236 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 10236 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name 'C-terminal PID Domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGPTPKTELVQKFRV QYLGMLPVDRPVGMDTLNSA IENLMTSSSKEDWPSVNMNV ADATVTVISEKNEEEVLVEC RVRFLSFMGVGKDVHTFAFI MDTGNQRFECHVFWCEPNAA NVSEAVQAACSGPSSG ; _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 136 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-31 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 10235 . "Phosphotyrosine-Interaction Domain" . . . . . 100.00 136 100.00 100.00 4.03e-95 . . . . 10236 2 2 no BMRB 10237 . "PID domain and APP peptide" . . . . . 100.00 185 100.00 100.00 3.90e-95 . . . . 10236 2 3 no BMRB 10238 . "APP peptide and PID domain" . . . . . 95.59 176 100.00 100.00 7.07e-91 . . . . 10236 2 4 no BMRB 10239 . "APP peptide and PID domain" . . . . . 95.59 185 100.00 100.00 9.34e-91 . . . . 10236 2 5 no PDB 1WGU . "Solution Structure Of The C-Terminal Phosphotyrosine Interaction Domain Of Apbb2 From Mouse" . . . . . 100.00 136 100.00 100.00 4.03e-95 . . . . 10236 2 6 no PDB 2ROZ . "Structure Of The C-Terminal Pid Domain Of Fe65l1 Complexed With The Cytoplasmic Tail Of App Reveals A Novel Peptide Binding Mod" . . . . . 100.00 136 100.00 100.00 4.03e-95 . . . . 10236 2 7 no PDB 2YSZ . "Solution Structure Of The Chimera Of The C-Terminal Pid Domain Of Fe65l And The C-Terminal Tail Peptide Of App" . . . . . 100.00 185 100.00 100.00 3.90e-95 . . . . 10236 2 8 no PDB 2YT0 . "Solution Structure Of The Chimera Of The C-Terminal Tail Peptide Of App And The C-Terminal Pid Domain Of Fe65l" . . . . . 95.59 176 100.00 100.00 7.07e-91 . . . . 10236 2 9 no PDB 2YT1 . "Solution Structure Of The Chimera Of The C-Terminal Tail Peptide Of App And The C-Terminal Pid Domain Of Fe65l" . . . . . 95.59 185 100.00 100.00 9.34e-91 . . . . 10236 2 10 no DBJ BAB23568 . "unnamed protein product [Mus musculus]" . . . . . 90.44 760 100.00 100.00 9.36e-80 . . . . 10236 2 11 no DBJ BAE31851 . "unnamed protein product [Mus musculus]" . . . . . 90.44 738 100.00 100.00 4.38e-80 . . . . 10236 2 12 no DBJ BAE39700 . "unnamed protein product [Mus musculus]" . . . . . 90.44 758 100.00 100.00 8.60e-80 . . . . 10236 2 13 no DBJ BAE41482 . "unnamed protein product [Mus musculus]" . . . . . 90.44 736 100.00 100.00 4.90e-80 . . . . 10236 2 14 no DBJ BAE42990 . "unnamed protein product [Mus musculus]" . . . . . 90.44 210 100.00 100.00 1.25e-85 . . . . 10236 2 15 no GB AAD55360 . "FE65-like protein [Mus musculus]" . . . . . 61.03 141 97.59 98.80 1.52e-52 . . . . 10236 2 16 no GB AAH76587 . "Apbb2 protein [Mus musculus]" . . . . . 90.44 737 100.00 100.00 4.39e-80 . . . . 10236 2 17 no GB EDL37768 . "amyloid beta (A4) precursor protein-binding, family B, member 2, isoform CRA_a [Mus musculus]" . . . . . 90.44 731 100.00 100.00 4.84e-80 . . . . 10236 2 18 no GB EDL90042 . "similar to amyloid beta (A4) precursor protein-binding, family B, member 2 (predicted) [Rattus norvegicus]" . . . . . 90.44 731 97.56 99.19 1.72e-78 . . . . 10236 2 19 no GB EGW02447 . "Amyloid beta A4 precursor protein-binding family B member 2 [Cricetulus griseus]" . . . . . 90.44 468 97.56 99.19 1.35e-79 . . . . 10236 2 20 no REF NP_001188342 . "amyloid beta A4 precursor protein-binding family B member 2 isoform 2 [Mus musculus]" . . . . . 90.44 758 100.00 100.00 8.60e-80 . . . . 10236 2 21 no REF NP_001188343 . "amyloid beta A4 precursor protein-binding family B member 2 isoform 3 [Mus musculus]" . . . . . 90.44 738 100.00 100.00 4.29e-80 . . . . 10236 2 22 no REF NP_001188344 . "amyloid beta A4 precursor protein-binding family B member 2 isoform 4 [Mus musculus]" . . . . . 90.44 737 100.00 100.00 4.39e-80 . . . . 10236 2 23 no REF NP_001188345 . "amyloid beta A4 precursor protein-binding family B member 2 isoform 5 [Mus musculus]" . . . . . 90.44 210 100.00 100.00 1.25e-85 . . . . 10236 2 24 no REF NP_033816 . "amyloid beta A4 precursor protein-binding family B member 2 isoform 1 [Mus musculus]" . . . . . 90.44 760 100.00 100.00 9.36e-80 . . . . 10236 2 25 no SP Q9DBR4 . "RecName: Full=Amyloid beta A4 precursor protein-binding family B member 2 [Mus musculus]" . . . . . 90.44 760 100.00 100.00 9.36e-80 . . . . 10236 2 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'C-terminal PID Domain' . 10236 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 56 GLY . 10236 2 2 57 SER . 10236 2 3 58 SER . 10236 2 4 59 GLY . 10236 2 5 60 SER . 10236 2 6 61 SER . 10236 2 7 62 GLY . 10236 2 8 63 PRO . 10236 2 9 64 THR . 10236 2 10 65 PRO . 10236 2 11 66 LYS . 10236 2 12 67 THR . 10236 2 13 68 GLU . 10236 2 14 69 LEU . 10236 2 15 70 VAL . 10236 2 16 71 GLN . 10236 2 17 72 LYS . 10236 2 18 73 PHE . 10236 2 19 74 ARG . 10236 2 20 75 VAL . 10236 2 21 76 GLN . 10236 2 22 77 TYR . 10236 2 23 78 LEU . 10236 2 24 79 GLY . 10236 2 25 80 MET . 10236 2 26 81 LEU . 10236 2 27 82 PRO . 10236 2 28 83 VAL . 10236 2 29 84 ASP . 10236 2 30 85 ARG . 10236 2 31 86 PRO . 10236 2 32 87 VAL . 10236 2 33 88 GLY . 10236 2 34 89 MET . 10236 2 35 90 ASP . 10236 2 36 91 THR . 10236 2 37 92 LEU . 10236 2 38 93 ASN . 10236 2 39 94 SER . 10236 2 40 95 ALA . 10236 2 41 96 ILE . 10236 2 42 97 GLU . 10236 2 43 98 ASN . 10236 2 44 99 LEU . 10236 2 45 100 MET . 10236 2 46 101 THR . 10236 2 47 102 SER . 10236 2 48 103 SER . 10236 2 49 104 SER . 10236 2 50 105 LYS . 10236 2 51 106 GLU . 10236 2 52 107 ASP . 10236 2 53 108 TRP . 10236 2 54 109 PRO . 10236 2 55 110 SER . 10236 2 56 111 VAL . 10236 2 57 112 ASN . 10236 2 58 113 MET . 10236 2 59 114 ASN . 10236 2 60 115 VAL . 10236 2 61 116 ALA . 10236 2 62 117 ASP . 10236 2 63 118 ALA . 10236 2 64 119 THR . 10236 2 65 120 VAL . 10236 2 66 121 THR . 10236 2 67 122 VAL . 10236 2 68 123 ILE . 10236 2 69 124 SER . 10236 2 70 125 GLU . 10236 2 71 126 LYS . 10236 2 72 127 ASN . 10236 2 73 128 GLU . 10236 2 74 129 GLU . 10236 2 75 130 GLU . 10236 2 76 131 VAL . 10236 2 77 132 LEU . 10236 2 78 133 VAL . 10236 2 79 134 GLU . 10236 2 80 135 CYS . 10236 2 81 136 ARG . 10236 2 82 137 VAL . 10236 2 83 138 ARG . 10236 2 84 139 PHE . 10236 2 85 140 LEU . 10236 2 86 141 SER . 10236 2 87 142 PHE . 10236 2 88 143 MET . 10236 2 89 144 GLY . 10236 2 90 145 VAL . 10236 2 91 146 GLY . 10236 2 92 147 LYS . 10236 2 93 148 ASP . 10236 2 94 149 VAL . 10236 2 95 150 HIS . 10236 2 96 151 THR . 10236 2 97 152 PHE . 10236 2 98 153 ALA . 10236 2 99 154 PHE . 10236 2 100 155 ILE . 10236 2 101 156 MET . 10236 2 102 157 ASP . 10236 2 103 158 THR . 10236 2 104 159 GLY . 10236 2 105 160 ASN . 10236 2 106 161 GLN . 10236 2 107 162 ARG . 10236 2 108 163 PHE . 10236 2 109 164 GLU . 10236 2 110 165 CYS . 10236 2 111 166 HIS . 10236 2 112 167 VAL . 10236 2 113 168 PHE . 10236 2 114 169 TRP . 10236 2 115 170 CYS . 10236 2 116 171 GLU . 10236 2 117 172 PRO . 10236 2 118 173 ASN . 10236 2 119 174 ALA . 10236 2 120 175 ALA . 10236 2 121 176 ASN . 10236 2 122 177 VAL . 10236 2 123 178 SER . 10236 2 124 179 GLU . 10236 2 125 180 ALA . 10236 2 126 181 VAL . 10236 2 127 182 GLN . 10236 2 128 183 ALA . 10236 2 129 184 ALA . 10236 2 130 185 CYS . 10236 2 131 186 SER . 10236 2 132 187 GLY . 10236 2 133 188 PRO . 10236 2 134 189 SER . 10236 2 135 190 SER . 10236 2 136 191 GLY . 10236 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 10236 2 . SER 2 2 10236 2 . SER 3 3 10236 2 . GLY 4 4 10236 2 . SER 5 5 10236 2 . SER 6 6 10236 2 . GLY 7 7 10236 2 . PRO 8 8 10236 2 . THR 9 9 10236 2 . PRO 10 10 10236 2 . LYS 11 11 10236 2 . THR 12 12 10236 2 . GLU 13 13 10236 2 . LEU 14 14 10236 2 . VAL 15 15 10236 2 . GLN 16 16 10236 2 . LYS 17 17 10236 2 . PHE 18 18 10236 2 . ARG 19 19 10236 2 . VAL 20 20 10236 2 . GLN 21 21 10236 2 . TYR 22 22 10236 2 . LEU 23 23 10236 2 . GLY 24 24 10236 2 . MET 25 25 10236 2 . LEU 26 26 10236 2 . PRO 27 27 10236 2 . VAL 28 28 10236 2 . ASP 29 29 10236 2 . ARG 30 30 10236 2 . PRO 31 31 10236 2 . VAL 32 32 10236 2 . GLY 33 33 10236 2 . MET 34 34 10236 2 . ASP 35 35 10236 2 . THR 36 36 10236 2 . LEU 37 37 10236 2 . ASN 38 38 10236 2 . SER 39 39 10236 2 . ALA 40 40 10236 2 . ILE 41 41 10236 2 . GLU 42 42 10236 2 . ASN 43 43 10236 2 . LEU 44 44 10236 2 . MET 45 45 10236 2 . THR 46 46 10236 2 . SER 47 47 10236 2 . SER 48 48 10236 2 . SER 49 49 10236 2 . LYS 50 50 10236 2 . GLU 51 51 10236 2 . ASP 52 52 10236 2 . TRP 53 53 10236 2 . PRO 54 54 10236 2 . SER 55 55 10236 2 . VAL 56 56 10236 2 . ASN 57 57 10236 2 . MET 58 58 10236 2 . ASN 59 59 10236 2 . VAL 60 60 10236 2 . ALA 61 61 10236 2 . ASP 62 62 10236 2 . ALA 63 63 10236 2 . THR 64 64 10236 2 . VAL 65 65 10236 2 . THR 66 66 10236 2 . VAL 67 67 10236 2 . ILE 68 68 10236 2 . SER 69 69 10236 2 . GLU 70 70 10236 2 . LYS 71 71 10236 2 . ASN 72 72 10236 2 . GLU 73 73 10236 2 . GLU 74 74 10236 2 . GLU 75 75 10236 2 . VAL 76 76 10236 2 . LEU 77 77 10236 2 . VAL 78 78 10236 2 . GLU 79 79 10236 2 . CYS 80 80 10236 2 . ARG 81 81 10236 2 . VAL 82 82 10236 2 . ARG 83 83 10236 2 . PHE 84 84 10236 2 . LEU 85 85 10236 2 . SER 86 86 10236 2 . PHE 87 87 10236 2 . MET 88 88 10236 2 . GLY 89 89 10236 2 . VAL 90 90 10236 2 . GLY 91 91 10236 2 . LYS 92 92 10236 2 . ASP 93 93 10236 2 . VAL 94 94 10236 2 . HIS 95 95 10236 2 . THR 96 96 10236 2 . PHE 97 97 10236 2 . ALA 98 98 10236 2 . PHE 99 99 10236 2 . ILE 100 100 10236 2 . MET 101 101 10236 2 . ASP 102 102 10236 2 . THR 103 103 10236 2 . GLY 104 104 10236 2 . ASN 105 105 10236 2 . GLN 106 106 10236 2 . ARG 107 107 10236 2 . PHE 108 108 10236 2 . GLU 109 109 10236 2 . CYS 110 110 10236 2 . HIS 111 111 10236 2 . VAL 112 112 10236 2 . PHE 113 113 10236 2 . TRP 114 114 10236 2 . CYS 115 115 10236 2 . GLU 116 116 10236 2 . PRO 117 117 10236 2 . ASN 118 118 10236 2 . ALA 119 119 10236 2 . ALA 120 120 10236 2 . ASN 121 121 10236 2 . VAL 122 122 10236 2 . SER 123 123 10236 2 . GLU 124 124 10236 2 . ALA 125 125 10236 2 . VAL 126 126 10236 2 . GLN 127 127 10236 2 . ALA 128 128 10236 2 . ALA 129 129 10236 2 . CYS 130 130 10236 2 . SER 131 131 10236 2 . GLY 132 132 10236 2 . PRO 133 133 10236 2 . SER 134 134 10236 2 . SER 135 135 10236 2 . GLY 136 136 10236 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 10236 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 10090 organism . 'Mus musculus' mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 10236 1 2 2 $entity_2 . 10090 organism . 'Mus musculus' mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 10236 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 10236 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 10236 1 2 2 $entity_2 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . . . . . . . . . . . . . . 10236 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 10236 _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 'Fe65L1 PID2' '[U-13C; U-15N]' . . 2 $entity_2 . protein 0.37 . . mM . . . . 10236 1 2 'APP-derived 32-mer peptide' 'natural abundance' . . 1 $entity_1 . protein 0.37 . . mM . . . . 10236 1 3 d-Tris-HCl . . . . . . buffer 20 . . mM . . . . 10236 1 4 NaCl . . . . . . salt 100 . . mM . . . . 10236 1 5 d-DTT . . . . . . salt 1 . . mM . . . . 10236 1 6 NaN3 . . . . . . salt 0.02 . . % . . . . 10236 1 7 H2O . . . . . . solvent 90 . . % . . . . 10236 1 8 D2O . . . . . . solvent 10 . . % . . . . 10236 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 10236 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.120 0.1 M 10236 1 pH 7.0 0.05 pH 10236 1 pressure 1 0.001 atm 10236 1 temperature 296 0.1 K 10236 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 10236 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 10236 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 10236 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 10236 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20031121 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 10236 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 10236 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 10236 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 10236 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10236 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 10236 _Software.ID 4 _Software.Name Kujira _Software.Version 0.9820 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 10236 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10236 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 10236 _Software.ID 5 _Software.Name CYANA _Software.Version 1.0.8 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Herrmann, Guntert and Wuthrich' . . 10236 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 10236 5 'structure solution' 10236 5 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 10236 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 10236 _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 . 900 . . . 10236 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 10236 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10236 1 2 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10236 1 3 '3D 13C,15N F1-FILTERED 13C F3-EDITED NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10236 1 4 '3D 13C,15N F1-FILTERED 15N F3-EDITED NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10236 1 5 '2D F2 13C,15N- FILTERED NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10236 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 10236 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 10236 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 10236 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 10236 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 10236 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 1H-15N NOESY' 1 $sample_1 isotropic 10236 1 2 '3D 1H-13C NOESY' 1 $sample_1 isotropic 10236 1 3 '3D 13C,15N F1-FILTERED 13C F3-EDITED NOESY' 1 $sample_1 isotropic 10236 1 4 '3D 13C,15N F1-FILTERED 15N F3-EDITED NOESY' 1 $sample_1 isotropic 10236 1 5 '2D F2 13C,15N- FILTERED NOESY' 1 $sample_1 isotropic 10236 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ASP HB2 H 1 2.652 0.030 . 2 . . . . 1 ASP HB2 . 10236 1 2 . 1 1 1 1 ASP HB3 H 1 2.533 0.030 . 2 . . . . 1 ASP HB3 . 10236 1 3 . 1 1 2 2 ALA H H 1 8.056 0.030 . 1 . . . . 2 ALA H . 10236 1 4 . 1 1 2 2 ALA HA H 1 4.330 0.030 . 1 . . . . 2 ALA HA . 10236 1 5 . 1 1 3 3 ALA H H 1 8.369 0.030 . 1 . . . . 3 ALA H . 10236 1 6 . 1 1 3 3 ALA HA H 1 4.328 0.030 . 1 . . . . 3 ALA HA . 10236 1 7 . 1 1 3 3 ALA HB1 H 1 1.353 0.030 . 1 . . . . 3 ALA HB . 10236 1 8 . 1 1 3 3 ALA HB2 H 1 1.353 0.030 . 1 . . . . 3 ALA HB . 10236 1 9 . 1 1 3 3 ALA HB3 H 1 1.353 0.030 . 1 . . . . 3 ALA HB . 10236 1 10 . 1 1 4 4 VAL H H 1 8.188 0.030 . 1 . . . . 4 VAL H . 10236 1 11 . 1 1 4 4 VAL HA H 1 4.284 0.030 . 1 . . . . 4 VAL HA . 10236 1 12 . 1 1 4 4 VAL HB H 1 2.069 0.030 . 1 . . . . 4 VAL HB . 10236 1 13 . 1 1 4 4 VAL HG11 H 1 0.945 0.030 . 1 . . . . 4 VAL HG1 . 10236 1 14 . 1 1 4 4 VAL HG12 H 1 0.945 0.030 . 1 . . . . 4 VAL HG1 . 10236 1 15 . 1 1 4 4 VAL HG13 H 1 0.945 0.030 . 1 . . . . 4 VAL HG1 . 10236 1 16 . 1 1 4 4 VAL HG21 H 1 0.932 0.030 . 1 . . . . 4 VAL HG2 . 10236 1 17 . 1 1 4 4 VAL HG22 H 1 0.932 0.030 . 1 . . . . 4 VAL HG2 . 10236 1 18 . 1 1 4 4 VAL HG23 H 1 0.932 0.030 . 1 . . . . 4 VAL HG2 . 10236 1 19 . 1 1 5 5 THR H H 1 8.480 0.030 . 1 . . . . 5 THR H . 10236 1 20 . 1 1 5 5 THR HA H 1 4.682 0.030 . 1 . . . . 5 THR HA . 10236 1 21 . 1 1 5 5 THR HB H 1 4.682 0.030 . 1 . . . . 5 THR HB . 10236 1 22 . 1 1 5 5 THR HG21 H 1 1.343 0.030 . 1 . . . . 5 THR HG2 . 10236 1 23 . 1 1 5 5 THR HG22 H 1 1.343 0.030 . 1 . . . . 5 THR HG2 . 10236 1 24 . 1 1 5 5 THR HG23 H 1 1.343 0.030 . 1 . . . . 5 THR HG2 . 10236 1 25 . 1 1 6 6 PRO HA H 1 4.194 0.030 . 1 . . . . 6 PRO HA . 10236 1 26 . 1 1 6 6 PRO HB2 H 1 2.357 0.030 . 2 . . . . 6 PRO HB2 . 10236 1 27 . 1 1 6 6 PRO HB3 H 1 1.959 0.030 . 2 . . . . 6 PRO HB3 . 10236 1 28 . 1 1 6 6 PRO HD2 H 1 3.918 0.030 . 1 . . . . 6 PRO HD2 . 10236 1 29 . 1 1 6 6 PRO HD3 H 1 3.918 0.030 . 1 . . . . 6 PRO HD3 . 10236 1 30 . 1 1 6 6 PRO HG2 H 1 2.212 0.030 . 1 . . . . 6 PRO HG2 . 10236 1 31 . 1 1 6 6 PRO HG3 H 1 2.212 0.030 . 1 . . . . 6 PRO HG3 . 10236 1 32 . 1 1 7 7 GLU H H 1 8.560 0.030 . 1 . . . . 7 GLU H . 10236 1 33 . 1 1 7 7 GLU HA H 1 4.054 0.030 . 1 . . . . 7 GLU HA . 10236 1 34 . 1 1 7 7 GLU HB2 H 1 2.097 0.030 . 2 . . . . 7 GLU HB2 . 10236 1 35 . 1 1 7 7 GLU HB3 H 1 1.818 0.030 . 2 . . . . 7 GLU HB3 . 10236 1 36 . 1 1 7 7 GLU HG2 H 1 2.126 0.030 . 1 . . . . 7 GLU HG2 . 10236 1 37 . 1 1 7 7 GLU HG3 H 1 2.126 0.030 . 1 . . . . 7 GLU HG3 . 10236 1 38 . 1 1 8 8 GLU H H 1 7.815 0.030 . 1 . . . . 8 GLU H . 10236 1 39 . 1 1 8 8 GLU HA H 1 3.918 0.030 . 1 . . . . 8 GLU HA . 10236 1 40 . 1 1 8 8 GLU HB2 H 1 2.008 0.030 . 2 . . . . 8 GLU HB2 . 10236 1 41 . 1 1 8 8 GLU HB3 H 1 2.257 0.030 . 2 . . . . 8 GLU HB3 . 10236 1 42 . 1 1 8 8 GLU HG2 H 1 2.326 0.030 . 1 . . . . 8 GLU HG2 . 10236 1 43 . 1 1 8 8 GLU HG3 H 1 2.326 0.030 . 1 . . . . 8 GLU HG3 . 10236 1 44 . 1 1 9 9 ARG H H 1 8.383 0.030 . 1 . . . . 9 ARG H . 10236 1 45 . 1 1 9 9 ARG HA H 1 4.008 0.030 . 1 . . . . 9 ARG HA . 10236 1 46 . 1 1 9 9 ARG HB2 H 1 1.882 0.030 . 1 . . . . 9 ARG HB2 . 10236 1 47 . 1 1 9 9 ARG HB3 H 1 1.882 0.030 . 1 . . . . 9 ARG HB3 . 10236 1 48 . 1 1 9 9 ARG HD2 H 1 3.175 0.030 . 2 . . . . 9 ARG HD2 . 10236 1 49 . 1 1 9 9 ARG HD3 H 1 3.239 0.030 . 2 . . . . 9 ARG HD3 . 10236 1 50 . 1 1 9 9 ARG HG2 H 1 1.596 0.030 . 2 . . . . 9 ARG HG2 . 10236 1 51 . 1 1 9 9 ARG HG3 H 1 1.713 0.030 . 2 . . . . 9 ARG HG3 . 10236 1 52 . 1 1 10 10 HIS H H 1 8.220 0.030 . 1 . . . . 10 HIS H . 10236 1 53 . 1 1 10 10 HIS HA H 1 4.276 0.030 . 1 . . . . 10 HIS HA . 10236 1 54 . 1 1 10 10 HIS HB2 H 1 3.135 0.030 . 1 . . . . 10 HIS HB2 . 10236 1 55 . 1 1 10 10 HIS HB3 H 1 3.135 0.030 . 1 . . . . 10 HIS HB3 . 10236 1 56 . 1 1 10 10 HIS HD2 H 1 6.418 0.030 . 1 . . . . 10 HIS HD2 . 10236 1 57 . 1 1 10 10 HIS HE1 H 1 7.431 0.030 . 1 . . . . 10 HIS HE1 . 10236 1 58 . 1 1 11 11 LEU H H 1 8.439 0.030 . 1 . . . . 11 LEU H . 10236 1 59 . 1 1 11 11 LEU HA H 1 3.578 0.030 . 1 . . . . 11 LEU HA . 10236 1 60 . 1 1 11 11 LEU HB2 H 1 1.868 0.030 . 2 . . . . 11 LEU HB2 . 10236 1 61 . 1 1 11 11 LEU HB3 H 1 1.318 0.030 . 2 . . . . 11 LEU HB3 . 10236 1 62 . 1 1 11 11 LEU HD11 H 1 0.744 0.030 . 1 . . . . 11 LEU HD1 . 10236 1 63 . 1 1 11 11 LEU HD12 H 1 0.744 0.030 . 1 . . . . 11 LEU HD1 . 10236 1 64 . 1 1 11 11 LEU HD13 H 1 0.744 0.030 . 1 . . . . 11 LEU HD1 . 10236 1 65 . 1 1 11 11 LEU HD21 H 1 0.710 0.030 . 1 . . . . 11 LEU HD2 . 10236 1 66 . 1 1 11 11 LEU HD22 H 1 0.710 0.030 . 1 . . . . 11 LEU HD2 . 10236 1 67 . 1 1 11 11 LEU HD23 H 1 0.710 0.030 . 1 . . . . 11 LEU HD2 . 10236 1 68 . 1 1 11 11 LEU HG H 1 1.673 0.030 . 1 . . . . 11 LEU HG . 10236 1 69 . 1 1 12 12 SER H H 1 8.111 0.030 . 1 . . . . 12 SER H . 10236 1 70 . 1 1 12 12 SER HA H 1 4.328 0.030 . 1 . . . . 12 SER HA . 10236 1 71 . 1 1 12 12 SER HB2 H 1 3.972 0.030 . 1 . . . . 12 SER HB2 . 10236 1 72 . 1 1 12 12 SER HB3 H 1 3.972 0.030 . 1 . . . . 12 SER HB3 . 10236 1 73 . 1 1 13 13 LYS H H 1 7.720 0.030 . 1 . . . . 13 LYS H . 10236 1 74 . 1 1 13 13 LYS HA H 1 4.176 0.030 . 1 . . . . 13 LYS HA . 10236 1 75 . 1 1 13 13 LYS HB2 H 1 1.979 0.030 . 2 . . . . 13 LYS HB2 . 10236 1 76 . 1 1 13 13 LYS HB3 H 1 1.931 0.030 . 2 . . . . 13 LYS HB3 . 10236 1 77 . 1 1 13 13 LYS HD2 H 1 1.747 0.030 . 1 . . . . 13 LYS HD2 . 10236 1 78 . 1 1 13 13 LYS HD3 H 1 1.747 0.030 . 1 . . . . 13 LYS HD3 . 10236 1 79 . 1 1 13 13 LYS HE2 H 1 3.003 0.030 . 1 . . . . 13 LYS HE2 . 10236 1 80 . 1 1 13 13 LYS HE3 H 1 3.003 0.030 . 1 . . . . 13 LYS HE3 . 10236 1 81 . 1 1 13 13 LYS HG2 H 1 1.498 0.030 . 2 . . . . 13 LYS HG2 . 10236 1 82 . 1 1 13 13 LYS HG3 H 1 1.642 0.030 . 2 . . . . 13 LYS HG3 . 10236 1 83 . 1 1 14 14 MET H H 1 8.164 0.030 . 1 . . . . 14 MET H . 10236 1 84 . 1 1 14 14 MET HA H 1 4.124 0.030 . 1 . . . . 14 MET HA . 10236 1 85 . 1 1 14 14 MET HB2 H 1 1.618 0.030 . 2 . . . . 14 MET HB2 . 10236 1 86 . 1 1 14 14 MET HB3 H 1 2.172 0.030 . 2 . . . . 14 MET HB3 . 10236 1 87 . 1 1 14 14 MET HE1 H 1 1.855 0.030 . 1 . . . . 14 MET HE . 10236 1 88 . 1 1 14 14 MET HE2 H 1 1.855 0.030 . 1 . . . . 14 MET HE . 10236 1 89 . 1 1 14 14 MET HE3 H 1 1.855 0.030 . 1 . . . . 14 MET HE . 10236 1 90 . 1 1 14 14 MET HG2 H 1 2.330 0.030 . 2 . . . . 14 MET HG2 . 10236 1 91 . 1 1 14 14 MET HG3 H 1 1.943 0.030 . 2 . . . . 14 MET HG3 . 10236 1 92 . 1 1 15 15 GLN H H 1 8.118 0.030 . 1 . . . . 15 GLN H . 10236 1 93 . 1 1 15 15 GLN HA H 1 4.875 0.030 . 1 . . . . 15 GLN HA . 10236 1 94 . 1 1 15 15 GLN HB2 H 1 1.848 0.030 . 2 . . . . 15 GLN HB2 . 10236 1 95 . 1 1 15 15 GLN HB3 H 1 2.224 0.030 . 2 . . . . 15 GLN HB3 . 10236 1 96 . 1 1 15 15 GLN HE21 H 1 6.173 0.030 . 2 . . . . 15 GLN HE21 . 10236 1 97 . 1 1 15 15 GLN HE22 H 1 8.246 0.030 . 2 . . . . 15 GLN HE22 . 10236 1 98 . 1 1 15 15 GLN HG2 H 1 2.348 0.030 . 2 . . . . 15 GLN HG2 . 10236 1 99 . 1 1 15 15 GLN HG3 H 1 2.179 0.030 . 2 . . . . 15 GLN HG3 . 10236 1 100 . 1 1 16 16 GLN H H 1 7.285 0.030 . 1 . . . . 16 GLN H . 10236 1 101 . 1 1 16 16 GLN HA H 1 4.204 0.030 . 1 . . . . 16 GLN HA . 10236 1 102 . 1 1 16 16 GLN HB2 H 1 2.100 0.030 . 2 . . . . 16 GLN HB2 . 10236 1 103 . 1 1 16 16 GLN HB3 H 1 1.965 0.030 . 2 . . . . 16 GLN HB3 . 10236 1 104 . 1 1 16 16 GLN HE21 H 1 7.430 0.030 . 2 . . . . 16 GLN HE21 . 10236 1 105 . 1 1 16 16 GLN HE22 H 1 6.820 0.030 . 2 . . . . 16 GLN HE22 . 10236 1 106 . 1 1 16 16 GLN HG2 H 1 2.318 0.030 . 2 . . . . 16 GLN HG2 . 10236 1 107 . 1 1 16 16 GLN HG3 H 1 2.546 0.030 . 2 . . . . 16 GLN HG3 . 10236 1 108 . 1 1 17 17 ASN H H 1 8.289 0.030 . 1 . . . . 17 ASN H . 10236 1 109 . 1 1 17 17 ASN HA H 1 5.032 0.030 . 1 . . . . 17 ASN HA . 10236 1 110 . 1 1 17 17 ASN HB2 H 1 3.000 0.030 . 2 . . . . 17 ASN HB2 . 10236 1 111 . 1 1 17 17 ASN HB3 H 1 2.812 0.030 . 2 . . . . 17 ASN HB3 . 10236 1 112 . 1 1 17 17 ASN HD21 H 1 7.044 0.030 . 2 . . . . 17 ASN HD21 . 10236 1 113 . 1 1 17 17 ASN HD22 H 1 7.625 0.030 . 2 . . . . 17 ASN HD22 . 10236 1 114 . 1 1 18 18 GLY H H 1 7.858 0.030 . 1 . . . . 18 GLY H . 10236 1 115 . 1 1 18 18 GLY HA2 H 1 4.266 0.030 . 2 . . . . 18 GLY HA2 . 10236 1 116 . 1 1 18 18 GLY HA3 H 1 3.984 0.030 . 2 . . . . 18 GLY HA3 . 10236 1 117 . 1 1 19 19 TYR H H 1 8.019 0.030 . 1 . . . . 19 TYR H . 10236 1 118 . 1 1 19 19 TYR HA H 1 4.663 0.030 . 1 . . . . 19 TYR HA . 10236 1 119 . 1 1 19 19 TYR HB2 H 1 2.678 0.030 . 2 . . . . 19 TYR HB2 . 10236 1 120 . 1 1 19 19 TYR HB3 H 1 2.456 0.030 . 2 . . . . 19 TYR HB3 . 10236 1 121 . 1 1 19 19 TYR HD1 H 1 7.001 0.030 . 1 . . . . 19 TYR HD1 . 10236 1 122 . 1 1 19 19 TYR HD2 H 1 7.001 0.030 . 1 . . . . 19 TYR HD2 . 10236 1 123 . 1 1 19 19 TYR HE1 H 1 6.768 0.030 . 1 . . . . 19 TYR HE1 . 10236 1 124 . 1 1 19 19 TYR HE2 H 1 6.768 0.030 . 1 . . . . 19 TYR HE2 . 10236 1 125 . 1 1 20 20 GLU H H 1 8.243 0.030 . 1 . . . . 20 GLU H . 10236 1 126 . 1 1 20 20 GLU HA H 1 4.644 0.030 . 1 . . . . 20 GLU HA . 10236 1 127 . 1 1 20 20 GLU HB2 H 1 2.068 0.030 . 2 . . . . 20 GLU HB2 . 10236 1 128 . 1 1 20 20 GLU HB3 H 1 1.968 0.030 . 2 . . . . 20 GLU HB3 . 10236 1 129 . 1 1 20 20 GLU HG2 H 1 2.319 0.030 . 2 . . . . 20 GLU HG2 . 10236 1 130 . 1 1 20 20 GLU HG3 H 1 2.578 0.030 . 2 . . . . 20 GLU HG3 . 10236 1 131 . 1 1 21 21 ASN H H 1 7.083 0.030 . 1 . . . . 21 ASN H . 10236 1 132 . 1 1 21 21 ASN HA H 1 4.469 0.030 . 1 . . . . 21 ASN HA . 10236 1 133 . 1 1 21 21 ASN HB2 H 1 2.620 0.030 . 2 . . . . 21 ASN HB2 . 10236 1 134 . 1 1 21 21 ASN HB3 H 1 3.378 0.030 . 2 . . . . 21 ASN HB3 . 10236 1 135 . 1 1 21 21 ASN HD21 H 1 6.080 0.030 . 2 . . . . 21 ASN HD21 . 10236 1 136 . 1 1 21 21 ASN HD22 H 1 9.446 0.030 . 2 . . . . 21 ASN HD22 . 10236 1 137 . 1 1 22 22 PRO HA H 1 3.816 0.030 . 1 . . . . 22 PRO HA . 10236 1 138 . 1 1 22 22 PRO HB2 H 1 2.034 0.030 . 2 . . . . 22 PRO HB2 . 10236 1 139 . 1 1 22 22 PRO HD2 H 1 4.131 0.030 . 1 . . . . 22 PRO HD2 . 10236 1 140 . 1 1 22 22 PRO HD3 H 1 4.131 0.030 . 1 . . . . 22 PRO HD3 . 10236 1 141 . 1 1 23 23 THR H H 1 7.908 0.030 . 1 . . . . 23 THR H . 10236 1 142 . 1 1 23 23 THR HA H 1 4.195 0.030 . 1 . . . . 23 THR HA . 10236 1 143 . 1 1 23 23 THR HB H 1 4.314 0.030 . 1 . . . . 23 THR HB . 10236 1 144 . 1 1 23 23 THR HG21 H 1 1.232 0.030 . 1 . . . . 23 THR HG2 . 10236 1 145 . 1 1 23 23 THR HG22 H 1 1.232 0.030 . 1 . . . . 23 THR HG2 . 10236 1 146 . 1 1 23 23 THR HG23 H 1 1.232 0.030 . 1 . . . . 23 THR HG2 . 10236 1 147 . 1 1 24 24 TYR H H 1 7.016 0.030 . 1 . . . . 24 TYR H . 10236 1 148 . 1 1 24 24 TYR HA H 1 4.518 0.030 . 1 . . . . 24 TYR HA . 10236 1 149 . 1 1 24 24 TYR HB2 H 1 3.364 0.030 . 2 . . . . 24 TYR HB2 . 10236 1 150 . 1 1 24 24 TYR HB3 H 1 3.023 0.030 . 2 . . . . 24 TYR HB3 . 10236 1 151 . 1 1 24 24 TYR HD1 H 1 7.283 0.030 . 1 . . . . 24 TYR HD1 . 10236 1 152 . 1 1 24 24 TYR HD2 H 1 7.283 0.030 . 1 . . . . 24 TYR HD2 . 10236 1 153 . 1 1 24 24 TYR HE1 H 1 6.968 0.030 . 1 . . . . 24 TYR HE1 . 10236 1 154 . 1 1 24 24 TYR HE2 H 1 6.968 0.030 . 1 . . . . 24 TYR HE2 . 10236 1 155 . 1 1 25 25 LYS H H 1 8.103 0.030 . 1 . . . . 25 LYS H . 10236 1 156 . 1 1 25 25 LYS HA H 1 3.828 0.030 . 1 . . . . 25 LYS HA . 10236 1 157 . 1 1 25 25 LYS HB2 H 1 1.385 0.030 . 2 . . . . 25 LYS HB2 . 10236 1 158 . 1 1 25 25 LYS HB3 H 1 1.273 0.030 . 2 . . . . 25 LYS HB3 . 10236 1 159 . 1 1 25 25 LYS HD2 H 1 1.449 0.030 . 1 . . . . 25 LYS HD2 . 10236 1 160 . 1 1 25 25 LYS HD3 H 1 1.449 0.030 . 1 . . . . 25 LYS HD3 . 10236 1 161 . 1 1 25 25 LYS HE2 H 1 2.820 0.030 . 1 . . . . 25 LYS HE2 . 10236 1 162 . 1 1 25 25 LYS HE3 H 1 2.820 0.030 . 1 . . . . 25 LYS HE3 . 10236 1 163 . 1 1 25 25 LYS HG2 H 1 0.979 0.030 . 2 . . . . 25 LYS HG2 . 10236 1 164 . 1 1 25 25 LYS HG3 H 1 0.794 0.030 . 2 . . . . 25 LYS HG3 . 10236 1 165 . 1 1 26 26 PHE H H 1 7.278 0.030 . 1 . . . . 26 PHE H . 10236 1 166 . 1 1 26 26 PHE HA H 1 4.552 0.030 . 1 . . . . 26 PHE HA . 10236 1 167 . 1 1 26 26 PHE HB2 H 1 3.171 0.030 . 2 . . . . 26 PHE HB2 . 10236 1 168 . 1 1 26 26 PHE HB3 H 1 2.803 0.030 . 2 . . . . 26 PHE HB3 . 10236 1 169 . 1 1 26 26 PHE HD1 H 1 7.106 0.030 . 1 . . . . 26 PHE HD1 . 10236 1 170 . 1 1 26 26 PHE HD2 H 1 7.106 0.030 . 1 . . . . 26 PHE HD2 . 10236 1 171 . 1 1 26 26 PHE HE1 H 1 7.319 0.030 . 1 . . . . 26 PHE HE1 . 10236 1 172 . 1 1 26 26 PHE HE2 H 1 7.319 0.030 . 1 . . . . 26 PHE HE2 . 10236 1 173 . 1 1 27 27 PHE H H 1 7.746 0.030 . 1 . . . . 27 PHE H . 10236 1 174 . 1 1 27 27 PHE HA H 1 4.381 0.030 . 1 . . . . 27 PHE HA . 10236 1 175 . 1 1 27 27 PHE HB2 H 1 3.118 0.030 . 2 . . . . 27 PHE HB2 . 10236 1 176 . 1 1 27 27 PHE HB3 H 1 2.968 0.030 . 2 . . . . 27 PHE HB3 . 10236 1 177 . 1 1 27 27 PHE HD1 H 1 7.258 0.030 . 1 . . . . 27 PHE HD1 . 10236 1 178 . 1 1 27 27 PHE HD2 H 1 7.258 0.030 . 1 . . . . 27 PHE HD2 . 10236 1 179 . 1 1 27 27 PHE HE1 H 1 7.283 0.030 . 1 . . . . 27 PHE HE1 . 10236 1 180 . 1 1 27 27 PHE HE2 H 1 7.283 0.030 . 1 . . . . 27 PHE HE2 . 10236 1 181 . 1 1 28 28 GLU H H 1 8.203 0.030 . 1 . . . . 28 GLU H . 10236 1 182 . 1 1 28 28 GLU HA H 1 4.222 0.030 . 1 . . . . 28 GLU HA . 10236 1 183 . 1 1 28 28 GLU HB2 H 1 2.104 0.030 . 1 . . . . 28 GLU HB2 . 10236 1 184 . 1 1 28 28 GLU HB3 H 1 2.104 0.030 . 1 . . . . 28 GLU HB3 . 10236 1 185 . 1 1 28 28 GLU HG2 H 1 2.408 0.030 . 2 . . . . 28 GLU HG2 . 10236 1 186 . 1 1 28 28 GLU HG3 H 1 2.558 0.030 . 2 . . . . 28 GLU HG3 . 10236 1 187 . 1 1 29 29 GLN HA H 1 4.232 0.030 . 1 . . . . 29 GLN HA . 10236 1 188 . 1 1 29 29 GLN HB2 H 1 2.101 0.030 . 2 . . . . 29 GLN HB2 . 10236 1 189 . 1 1 29 29 GLN HB3 H 1 1.976 0.030 . 2 . . . . 29 GLN HB3 . 10236 1 190 . 1 1 29 29 GLN HE21 H 1 7.568 0.030 . 2 . . . . 29 GLN HE21 . 10236 1 191 . 1 1 29 29 GLN HE22 H 1 6.844 0.030 . 2 . . . . 29 GLN HE22 . 10236 1 192 . 1 1 29 29 GLN HG2 H 1 2.355 0.030 . 1 . . . . 29 GLN HG2 . 10236 1 193 . 1 1 29 29 GLN HG3 H 1 2.355 0.030 . 1 . . . . 29 GLN HG3 . 10236 1 194 . 1 1 30 30 MET H H 1 8.040 0.030 . 1 . . . . 30 MET H . 10236 1 195 . 1 1 30 30 MET HA H 1 4.044 0.030 . 1 . . . . 30 MET HA . 10236 1 196 . 1 1 30 30 MET HB2 H 1 1.968 0.030 . 2 . . . . 30 MET HB2 . 10236 1 197 . 1 1 30 30 MET HB3 H 1 2.103 0.030 . 2 . . . . 30 MET HB3 . 10236 1 198 . 1 1 30 30 MET HE1 H 1 1.800 0.030 . 1 . . . . 30 MET HE . 10236 1 199 . 1 1 30 30 MET HE2 H 1 1.800 0.030 . 1 . . . . 30 MET HE . 10236 1 200 . 1 1 30 30 MET HE3 H 1 1.800 0.030 . 1 . . . . 30 MET HE . 10236 1 201 . 1 1 30 30 MET HG2 H 1 2.352 0.030 . 1 . . . . 30 MET HG2 . 10236 1 202 . 1 1 30 30 MET HG3 H 1 2.352 0.030 . 1 . . . . 30 MET HG3 . 10236 1 203 . 1 1 31 31 GLN H H 1 8.248 0.030 . 1 . . . . 31 GLN H . 10236 1 204 . 1 1 31 31 GLN HE21 H 1 7.513 0.030 . 2 . . . . 31 GLN HE21 . 10236 1 205 . 1 1 31 31 GLN HE22 H 1 6.815 0.030 . 2 . . . . 31 GLN HE22 . 10236 1 206 . 1 1 31 31 GLN HG2 H 1 2.322 0.030 . 1 . . . . 31 GLN HG2 . 10236 1 207 . 1 1 31 31 GLN HG3 H 1 2.322 0.030 . 1 . . . . 31 GLN HG3 . 10236 1 208 . 2 2 8 8 PRO HA H 1 4.460 0.030 . 1 . . . . 63 PRO HA . 10236 1 209 . 2 2 8 8 PRO HB2 H 1 1.886 0.030 . 2 . . . . 63 PRO HB2 . 10236 1 210 . 2 2 8 8 PRO HB3 H 1 2.245 0.030 . 2 . . . . 63 PRO HB3 . 10236 1 211 . 2 2 8 8 PRO HD2 H 1 3.609 0.030 . 1 . . . . 63 PRO HD2 . 10236 1 212 . 2 2 8 8 PRO HD3 H 1 3.609 0.030 . 1 . . . . 63 PRO HD3 . 10236 1 213 . 2 2 8 8 PRO HG2 H 1 1.984 0.030 . 1 . . . . 63 PRO HG2 . 10236 1 214 . 2 2 8 8 PRO HG3 H 1 1.984 0.030 . 1 . . . . 63 PRO HG3 . 10236 1 215 . 2 2 8 8 PRO C C 13 177.111 0.300 . 1 . . . . 63 PRO C . 10236 1 216 . 2 2 8 8 PRO CA C 13 63.177 0.300 . 1 . . . . 63 PRO CA . 10236 1 217 . 2 2 8 8 PRO CB C 13 32.104 0.300 . 1 . . . . 63 PRO CB . 10236 1 218 . 2 2 8 8 PRO CD C 13 49.856 0.300 . 1 . . . . 63 PRO CD . 10236 1 219 . 2 2 8 8 PRO CG C 13 27.089 0.300 . 1 . . . . 63 PRO CG . 10236 1 220 . 2 2 9 9 THR H H 1 8.353 0.030 . 1 . . . . 64 THR H . 10236 1 221 . 2 2 9 9 THR HA H 1 4.540 0.030 . 1 . . . . 64 THR HA . 10236 1 222 . 2 2 9 9 THR HB H 1 4.098 0.030 . 1 . . . . 64 THR HB . 10236 1 223 . 2 2 9 9 THR HG21 H 1 1.236 0.030 . 1 . . . . 64 THR HG2 . 10236 1 224 . 2 2 9 9 THR HG22 H 1 1.236 0.030 . 1 . . . . 64 THR HG2 . 10236 1 225 . 2 2 9 9 THR HG23 H 1 1.236 0.030 . 1 . . . . 64 THR HG2 . 10236 1 226 . 2 2 9 9 THR CA C 13 59.889 0.300 . 1 . . . . 64 THR CA . 10236 1 227 . 2 2 9 9 THR CB C 13 69.757 0.300 . 1 . . . . 64 THR CB . 10236 1 228 . 2 2 9 9 THR CG2 C 13 21.560 0.300 . 1 . . . . 64 THR CG2 . 10236 1 229 . 2 2 9 9 THR N N 15 117.904 0.300 . 1 . . . . 64 THR N . 10236 1 230 . 2 2 10 10 PRO HA H 1 4.391 0.030 . 1 . . . . 65 PRO HA . 10236 1 231 . 2 2 10 10 PRO HB2 H 1 1.867 0.030 . 2 . . . . 65 PRO HB2 . 10236 1 232 . 2 2 10 10 PRO HB3 H 1 2.283 0.030 . 2 . . . . 65 PRO HB3 . 10236 1 233 . 2 2 10 10 PRO HD2 H 1 3.850 0.030 . 2 . . . . 65 PRO HD2 . 10236 1 234 . 2 2 10 10 PRO HD3 H 1 3.668 0.030 . 2 . . . . 65 PRO HD3 . 10236 1 235 . 2 2 10 10 PRO HG2 H 1 2.009 0.030 . 2 . . . . 65 PRO HG2 . 10236 1 236 . 2 2 10 10 PRO HG3 H 1 1.956 0.030 . 2 . . . . 65 PRO HG3 . 10236 1 237 . 2 2 10 10 PRO C C 13 176.796 0.300 . 1 . . . . 65 PRO C . 10236 1 238 . 2 2 10 10 PRO CA C 13 63.177 0.300 . 1 . . . . 65 PRO CA . 10236 1 239 . 2 2 10 10 PRO CB C 13 32.268 0.300 . 1 . . . . 65 PRO CB . 10236 1 240 . 2 2 10 10 PRO CD C 13 51.144 0.300 . 1 . . . . 65 PRO CD . 10236 1 241 . 2 2 10 10 PRO CG C 13 27.500 0.300 . 1 . . . . 65 PRO CG . 10236 1 242 . 2 2 11 11 LYS H H 1 8.479 0.030 . 1 . . . . 66 LYS H . 10236 1 243 . 2 2 11 11 LYS HA H 1 4.304 0.030 . 1 . . . . 66 LYS HA . 10236 1 244 . 2 2 11 11 LYS HB2 H 1 1.818 0.030 . 2 . . . . 66 LYS HB2 . 10236 1 245 . 2 2 11 11 LYS HB3 H 1 1.761 0.030 . 2 . . . . 66 LYS HB3 . 10236 1 246 . 2 2 11 11 LYS HD2 H 1 1.657 0.030 . 2 . . . . 66 LYS HD2 . 10236 1 247 . 2 2 11 11 LYS HG2 H 1 1.438 0.030 . 2 . . . . 66 LYS HG2 . 10236 1 248 . 2 2 11 11 LYS C C 13 176.917 0.300 . 1 . . . . 66 LYS C . 10236 1 249 . 2 2 11 11 LYS CA C 13 56.272 0.300 . 1 . . . . 66 LYS CA . 10236 1 250 . 2 2 11 11 LYS CB C 13 32.926 0.300 . 1 . . . . 66 LYS CB . 10236 1 251 . 2 2 11 11 LYS CD C 13 29.062 0.300 . 1 . . . . 66 LYS CD . 10236 1 252 . 2 2 11 11 LYS CE C 13 41.968 0.300 . 1 . . . . 66 LYS CE . 10236 1 253 . 2 2 11 11 LYS CG C 13 24.787 0.300 . 1 . . . . 66 LYS CG . 10236 1 254 . 2 2 11 11 LYS N N 15 122.224 0.300 . 1 . . . . 66 LYS N . 10236 1 255 . 2 2 12 12 THR H H 1 8.160 0.030 . 1 . . . . 67 THR H . 10236 1 256 . 2 2 12 12 THR HA H 1 4.260 0.030 . 1 . . . . 67 THR HA . 10236 1 257 . 2 2 12 12 THR HB H 1 4.150 0.030 . 1 . . . . 67 THR HB . 10236 1 258 . 2 2 12 12 THR HG21 H 1 1.160 0.030 . 1 . . . . 67 THR HG2 . 10236 1 259 . 2 2 12 12 THR HG22 H 1 1.160 0.030 . 1 . . . . 67 THR HG2 . 10236 1 260 . 2 2 12 12 THR HG23 H 1 1.160 0.030 . 1 . . . . 67 THR HG2 . 10236 1 261 . 2 2 12 12 THR C C 13 174.398 0.300 . 1 . . . . 67 THR C . 10236 1 262 . 2 2 12 12 THR CA C 13 61.698 0.300 . 1 . . . . 67 THR CA . 10236 1 263 . 2 2 12 12 THR CB C 13 69.688 0.300 . 1 . . . . 67 THR CB . 10236 1 264 . 2 2 12 12 THR CG2 C 13 21.664 0.300 . 1 . . . . 67 THR CG2 . 10236 1 265 . 2 2 12 12 THR N N 15 115.677 0.300 . 1 . . . . 67 THR N . 10236 1 266 . 2 2 13 13 GLU H H 1 8.418 0.030 . 1 . . . . 68 GLU H . 10236 1 267 . 2 2 13 13 GLU HA H 1 4.300 0.030 . 1 . . . . 68 GLU HA . 10236 1 268 . 2 2 13 13 GLU HB2 H 1 1.868 0.030 . 2 . . . . 68 GLU HB2 . 10236 1 269 . 2 2 13 13 GLU HB3 H 1 2.022 0.030 . 2 . . . . 68 GLU HB3 . 10236 1 270 . 2 2 13 13 GLU HG2 H 1 2.228 0.030 . 1 . . . . 68 GLU HG2 . 10236 1 271 . 2 2 13 13 GLU HG3 H 1 2.228 0.030 . 1 . . . . 68 GLU HG3 . 10236 1 272 . 2 2 13 13 GLU C C 13 175.948 0.300 . 1 . . . . 68 GLU C . 10236 1 273 . 2 2 13 13 GLU CA C 13 56.443 0.300 . 1 . . . . 68 GLU CA . 10236 1 274 . 2 2 13 13 GLU CB C 13 30.373 0.300 . 1 . . . . 68 GLU CB . 10236 1 275 . 2 2 13 13 GLU CG C 13 36.049 0.300 . 1 . . . . 68 GLU CG . 10236 1 276 . 2 2 13 13 GLU N N 15 123.472 0.300 . 1 . . . . 68 GLU N . 10236 1 277 . 2 2 14 14 LEU H H 1 8.257 0.030 . 1 . . . . 69 LEU H . 10236 1 278 . 2 2 14 14 LEU HA H 1 4.317 0.030 . 1 . . . . 69 LEU HA . 10236 1 279 . 2 2 14 14 LEU HB2 H 1 1.578 0.030 . 1 . . . . 69 LEU HB2 . 10236 1 280 . 2 2 14 14 LEU HB3 H 1 1.578 0.030 . 1 . . . . 69 LEU HB3 . 10236 1 281 . 2 2 14 14 LEU HD11 H 1 0.872 0.030 . 1 . . . . 69 LEU HD1 . 10236 1 282 . 2 2 14 14 LEU HD12 H 1 0.872 0.030 . 1 . . . . 69 LEU HD1 . 10236 1 283 . 2 2 14 14 LEU HD13 H 1 0.872 0.030 . 1 . . . . 69 LEU HD1 . 10236 1 284 . 2 2 14 14 LEU HD21 H 1 0.815 0.030 . 1 . . . . 69 LEU HD2 . 10236 1 285 . 2 2 14 14 LEU HD22 H 1 0.815 0.030 . 1 . . . . 69 LEU HD2 . 10236 1 286 . 2 2 14 14 LEU HD23 H 1 0.815 0.030 . 1 . . . . 69 LEU HD2 . 10236 1 287 . 2 2 14 14 LEU HG H 1 1.530 0.030 . 1 . . . . 69 LEU HG . 10236 1 288 . 2 2 14 14 LEU C C 13 176.578 0.300 . 1 . . . . 69 LEU C . 10236 1 289 . 2 2 14 14 LEU CA C 13 55.121 0.300 . 1 . . . . 69 LEU CA . 10236 1 290 . 2 2 14 14 LEU CB C 13 42.317 0.300 . 1 . . . . 69 LEU CB . 10236 1 291 . 2 2 14 14 LEU CD1 C 13 24.870 0.300 . 2 . . . . 69 LEU CD1 . 10236 1 292 . 2 2 14 14 LEU CD2 C 13 23.717 0.300 . 2 . . . . 69 LEU CD2 . 10236 1 293 . 2 2 14 14 LEU CG C 13 27.089 0.300 . 1 . . . . 69 LEU CG . 10236 1 294 . 2 2 14 14 LEU N N 15 123.785 0.300 . 1 . . . . 69 LEU N . 10236 1 295 . 2 2 15 15 VAL H H 1 8.050 0.030 . 1 . . . . 70 VAL H . 10236 1 296 . 2 2 15 15 VAL HA H 1 4.241 0.030 . 1 . . . . 70 VAL HA . 10236 1 297 . 2 2 15 15 VAL HB H 1 1.889 0.030 . 1 . . . . 70 VAL HB . 10236 1 298 . 2 2 15 15 VAL HG11 H 1 0.726 0.030 . 1 . . . . 70 VAL HG1 . 10236 1 299 . 2 2 15 15 VAL HG12 H 1 0.726 0.030 . 1 . . . . 70 VAL HG1 . 10236 1 300 . 2 2 15 15 VAL HG13 H 1 0.726 0.030 . 1 . . . . 70 VAL HG1 . 10236 1 301 . 2 2 15 15 VAL HG21 H 1 0.837 0.030 . 1 . . . . 70 VAL HG2 . 10236 1 302 . 2 2 15 15 VAL HG22 H 1 0.837 0.030 . 1 . . . . 70 VAL HG2 . 10236 1 303 . 2 2 15 15 VAL HG23 H 1 0.837 0.030 . 1 . . . . 70 VAL HG2 . 10236 1 304 . 2 2 15 15 VAL C C 13 175.512 0.300 . 1 . . . . 70 VAL C . 10236 1 305 . 2 2 15 15 VAL CA C 13 61.780 0.300 . 1 . . . . 70 VAL CA . 10236 1 306 . 2 2 15 15 VAL CB C 13 33.402 0.300 . 1 . . . . 70 VAL CB . 10236 1 307 . 2 2 15 15 VAL CG1 C 13 21.006 0.300 . 2 . . . . 70 VAL CG1 . 10236 1 308 . 2 2 15 15 VAL CG2 C 13 21.006 0.300 . 2 . . . . 70 VAL CG2 . 10236 1 309 . 2 2 15 15 VAL N N 15 122.571 0.300 . 1 . . . . 70 VAL N . 10236 1 310 . 2 2 16 16 GLN H H 1 8.298 0.030 . 1 . . . . 71 GLN H . 10236 1 311 . 2 2 16 16 GLN HA H 1 4.322 0.030 . 1 . . . . 71 GLN HA . 10236 1 312 . 2 2 16 16 GLN HB2 H 1 1.878 0.030 . 1 . . . . 71 GLN HB2 . 10236 1 313 . 2 2 16 16 GLN HB3 H 1 1.878 0.030 . 1 . . . . 71 GLN HB3 . 10236 1 314 . 2 2 16 16 GLN HE21 H 1 6.921 0.030 . 2 . . . . 71 GLN HE21 . 10236 1 315 . 2 2 16 16 GLN HE22 H 1 7.494 0.030 . 2 . . . . 71 GLN HE22 . 10236 1 316 . 2 2 16 16 GLN HG2 H 1 2.118 0.030 . 2 . . . . 71 GLN HG2 . 10236 1 317 . 2 2 16 16 GLN HG3 H 1 2.249 0.030 . 2 . . . . 71 GLN HG3 . 10236 1 318 . 2 2 16 16 GLN C C 13 173.357 0.300 . 1 . . . . 71 GLN C . 10236 1 319 . 2 2 16 16 GLN CA C 13 55.257 0.300 . 1 . . . . 71 GLN CA . 10236 1 320 . 2 2 16 16 GLN CB C 13 31.551 0.300 . 1 . . . . 71 GLN CB . 10236 1 321 . 2 2 16 16 GLN CG C 13 34.420 0.300 . 1 . . . . 71 GLN CG . 10236 1 322 . 2 2 16 16 GLN N N 15 125.313 0.300 . 1 . . . . 71 GLN N . 10236 1 323 . 2 2 16 16 GLN NE2 N 15 111.668 0.300 . 1 . . . . 71 GLN NE2 . 10236 1 324 . 2 2 17 17 LYS H H 1 7.748 0.030 . 1 . . . . 72 LYS H . 10236 1 325 . 2 2 17 17 LYS HA H 1 5.089 0.030 . 1 . . . . 72 LYS HA . 10236 1 326 . 2 2 17 17 LYS HB2 H 1 1.515 0.030 . 2 . . . . 72 LYS HB2 . 10236 1 327 . 2 2 17 17 LYS HB3 H 1 1.435 0.030 . 2 . . . . 72 LYS HB3 . 10236 1 328 . 2 2 17 17 LYS HD2 H 1 1.499 0.030 . 1 . . . . 72 LYS HD2 . 10236 1 329 . 2 2 17 17 LYS HD3 H 1 1.499 0.030 . 1 . . . . 72 LYS HD3 . 10236 1 330 . 2 2 17 17 LYS HE2 H 1 2.791 0.030 . 1 . . . . 72 LYS HE2 . 10236 1 331 . 2 2 17 17 LYS HE3 H 1 2.791 0.030 . 1 . . . . 72 LYS HE3 . 10236 1 332 . 2 2 17 17 LYS HG2 H 1 1.168 0.030 . 2 . . . . 72 LYS HG2 . 10236 1 333 . 2 2 17 17 LYS HG3 H 1 1.096 0.030 . 2 . . . . 72 LYS HG3 . 10236 1 334 . 2 2 17 17 LYS C C 13 175.198 0.300 . 1 . . . . 72 LYS C . 10236 1 335 . 2 2 17 17 LYS CA C 13 55.106 0.300 . 1 . . . . 72 LYS CA . 10236 1 336 . 2 2 17 17 LYS CB C 13 35.063 0.300 . 1 . . . . 72 LYS CB . 10236 1 337 . 2 2 17 17 LYS CD C 13 29.510 0.300 . 1 . . . . 72 LYS CD . 10236 1 338 . 2 2 17 17 LYS CE C 13 41.804 0.300 . 1 . . . . 72 LYS CE . 10236 1 339 . 2 2 17 17 LYS CG C 13 24.705 0.300 . 1 . . . . 72 LYS CG . 10236 1 340 . 2 2 17 17 LYS N N 15 122.892 0.300 . 1 . . . . 72 LYS N . 10236 1 341 . 2 2 18 18 PHE H H 1 8.912 0.030 . 1 . . . . 73 PHE H . 10236 1 342 . 2 2 18 18 PHE HA H 1 4.716 0.030 . 1 . . . . 73 PHE HA . 10236 1 343 . 2 2 18 18 PHE HB2 H 1 3.052 0.030 . 2 . . . . 73 PHE HB2 . 10236 1 344 . 2 2 18 18 PHE HB3 H 1 2.614 0.030 . 2 . . . . 73 PHE HB3 . 10236 1 345 . 2 2 18 18 PHE HD1 H 1 7.077 0.030 . 1 . . . . 73 PHE HD1 . 10236 1 346 . 2 2 18 18 PHE HD2 H 1 7.077 0.030 . 1 . . . . 73 PHE HD2 . 10236 1 347 . 2 2 18 18 PHE HE1 H 1 6.888 0.030 . 1 . . . . 73 PHE HE1 . 10236 1 348 . 2 2 18 18 PHE HE2 H 1 6.888 0.030 . 1 . . . . 73 PHE HE2 . 10236 1 349 . 2 2 18 18 PHE C C 13 174.325 0.300 . 1 . . . . 73 PHE C . 10236 1 350 . 2 2 18 18 PHE CA C 13 56.354 0.300 . 1 . . . . 73 PHE CA . 10236 1 351 . 2 2 18 18 PHE CB C 13 42.544 0.300 . 1 . . . . 73 PHE CB . 10236 1 352 . 2 2 18 18 PHE CD1 C 13 132.402 0.300 . 1 . . . . 73 PHE CD1 . 10236 1 353 . 2 2 18 18 PHE CD2 C 13 132.402 0.300 . 1 . . . . 73 PHE CD2 . 10236 1 354 . 2 2 18 18 PHE CE1 C 13 130.161 0.300 . 1 . . . . 73 PHE CE1 . 10236 1 355 . 2 2 18 18 PHE CE2 C 13 130.161 0.300 . 1 . . . . 73 PHE CE2 . 10236 1 356 . 2 2 18 18 PHE N N 15 122.498 0.300 . 1 . . . . 73 PHE N . 10236 1 357 . 2 2 19 19 ARG H H 1 8.873 0.030 . 1 . . . . 74 ARG H . 10236 1 358 . 2 2 19 19 ARG HA H 1 5.295 0.030 . 1 . . . . 74 ARG HA . 10236 1 359 . 2 2 19 19 ARG HB2 H 1 2.001 0.030 . 2 . . . . 74 ARG HB2 . 10236 1 360 . 2 2 19 19 ARG HB3 H 1 1.806 0.030 . 2 . . . . 74 ARG HB3 . 10236 1 361 . 2 2 19 19 ARG HD2 H 1 3.253 0.030 . 1 . . . . 74 ARG HD2 . 10236 1 362 . 2 2 19 19 ARG HD3 H 1 3.253 0.030 . 1 . . . . 74 ARG HD3 . 10236 1 363 . 2 2 19 19 ARG HE H 1 7.819 0.030 . 1 . . . . 74 ARG HE . 10236 1 364 . 2 2 19 19 ARG HG2 H 1 1.638 0.030 . 1 . . . . 74 ARG HG2 . 10236 1 365 . 2 2 19 19 ARG HG3 H 1 1.638 0.030 . 1 . . . . 74 ARG HG3 . 10236 1 366 . 2 2 19 19 ARG C C 13 176.457 0.300 . 1 . . . . 74 ARG C . 10236 1 367 . 2 2 19 19 ARG CA C 13 56.175 0.300 . 1 . . . . 74 ARG CA . 10236 1 368 . 2 2 19 19 ARG CB C 13 30.110 0.300 . 1 . . . . 74 ARG CB . 10236 1 369 . 2 2 19 19 ARG CD C 13 43.201 0.300 . 1 . . . . 74 ARG CD . 10236 1 370 . 2 2 19 19 ARG CG C 13 27.480 0.300 . 1 . . . . 74 ARG CG . 10236 1 371 . 2 2 19 19 ARG N N 15 126.869 0.300 . 1 . . . . 74 ARG N . 10236 1 372 . 2 2 19 19 ARG NE N 15 85.527 0.300 . 1 . . . . 74 ARG NE . 10236 1 373 . 2 2 20 20 VAL H H 1 8.899 0.030 . 1 . . . . 75 VAL H . 10236 1 374 . 2 2 20 20 VAL HA H 1 5.319 0.030 . 1 . . . . 75 VAL HA . 10236 1 375 . 2 2 20 20 VAL HB H 1 2.813 0.030 . 1 . . . . 75 VAL HB . 10236 1 376 . 2 2 20 20 VAL HG11 H 1 1.005 0.030 . 1 . . . . 75 VAL HG1 . 10236 1 377 . 2 2 20 20 VAL HG12 H 1 1.005 0.030 . 1 . . . . 75 VAL HG1 . 10236 1 378 . 2 2 20 20 VAL HG13 H 1 1.005 0.030 . 1 . . . . 75 VAL HG1 . 10236 1 379 . 2 2 20 20 VAL HG21 H 1 0.804 0.030 . 1 . . . . 75 VAL HG2 . 10236 1 380 . 2 2 20 20 VAL HG22 H 1 0.804 0.030 . 1 . . . . 75 VAL HG2 . 10236 1 381 . 2 2 20 20 VAL HG23 H 1 0.804 0.030 . 1 . . . . 75 VAL HG2 . 10236 1 382 . 2 2 20 20 VAL C C 13 174.737 0.300 . 1 . . . . 75 VAL C . 10236 1 383 . 2 2 20 20 VAL CA C 13 59.483 0.300 . 1 . . . . 75 VAL CA . 10236 1 384 . 2 2 20 20 VAL CB C 13 36.184 0.300 . 1 . . . . 75 VAL CB . 10236 1 385 . 2 2 20 20 VAL CG1 C 13 24.049 0.300 . 2 . . . . 75 VAL CG1 . 10236 1 386 . 2 2 20 20 VAL CG2 C 13 20.102 0.300 . 2 . . . . 75 VAL CG2 . 10236 1 387 . 2 2 20 20 VAL N N 15 120.661 0.300 . 1 . . . . 75 VAL N . 10236 1 388 . 2 2 21 21 GLN H H 1 9.113 0.030 . 1 . . . . 76 GLN H . 10236 1 389 . 2 2 21 21 GLN HA H 1 5.782 0.030 . 1 . . . . 76 GLN HA . 10236 1 390 . 2 2 21 21 GLN HB2 H 1 2.484 0.030 . 2 . . . . 76 GLN HB2 . 10236 1 391 . 2 2 21 21 GLN HB3 H 1 2.268 0.030 . 2 . . . . 76 GLN HB3 . 10236 1 392 . 2 2 21 21 GLN HE21 H 1 6.641 0.030 . 2 . . . . 76 GLN HE21 . 10236 1 393 . 2 2 21 21 GLN HE22 H 1 8.053 0.030 . 2 . . . . 76 GLN HE22 . 10236 1 394 . 2 2 21 21 GLN HG2 H 1 2.522 0.030 . 1 . . . . 76 GLN HG2 . 10236 1 395 . 2 2 21 21 GLN HG3 H 1 2.522 0.030 . 1 . . . . 76 GLN HG3 . 10236 1 396 . 2 2 21 21 GLN C C 13 175.973 0.300 . 1 . . . . 76 GLN C . 10236 1 397 . 2 2 21 21 GLN CA C 13 54.920 0.300 . 1 . . . . 76 GLN CA . 10236 1 398 . 2 2 21 21 GLN CB C 13 34.323 0.300 . 1 . . . . 76 GLN CB . 10236 1 399 . 2 2 21 21 GLN CG C 13 36.508 0.300 . 1 . . . . 76 GLN CG . 10236 1 400 . 2 2 21 21 GLN N N 15 116.487 0.300 . 1 . . . . 76 GLN N . 10236 1 401 . 2 2 21 21 GLN NE2 N 15 112.869 0.300 . 1 . . . . 76 GLN NE2 . 10236 1 402 . 2 2 22 22 TYR H H 1 8.870 0.030 . 1 . . . . 77 TYR H . 10236 1 403 . 2 2 22 22 TYR HA H 1 5.117 0.030 . 1 . . . . 77 TYR HA . 10236 1 404 . 2 2 22 22 TYR HB2 H 1 2.931 0.030 . 1 . . . . 77 TYR HB2 . 10236 1 405 . 2 2 22 22 TYR HB3 H 1 2.931 0.030 . 1 . . . . 77 TYR HB3 . 10236 1 406 . 2 2 22 22 TYR HD1 H 1 6.679 0.030 . 1 . . . . 77 TYR HD1 . 10236 1 407 . 2 2 22 22 TYR HD2 H 1 6.679 0.030 . 1 . . . . 77 TYR HD2 . 10236 1 408 . 2 2 22 22 TYR HE1 H 1 6.539 0.030 . 1 . . . . 77 TYR HE1 . 10236 1 409 . 2 2 22 22 TYR HE2 H 1 6.539 0.030 . 1 . . . . 77 TYR HE2 . 10236 1 410 . 2 2 22 22 TYR C C 13 173.623 0.300 . 1 . . . . 77 TYR C . 10236 1 411 . 2 2 22 22 TYR CA C 13 54.463 0.300 . 1 . . . . 77 TYR CA . 10236 1 412 . 2 2 22 22 TYR CB C 13 41.311 0.300 . 1 . . . . 77 TYR CB . 10236 1 413 . 2 2 22 22 TYR CD1 C 13 132.496 0.300 . 1 . . . . 77 TYR CD1 . 10236 1 414 . 2 2 22 22 TYR CD2 C 13 132.496 0.300 . 1 . . . . 77 TYR CD2 . 10236 1 415 . 2 2 22 22 TYR CE1 C 13 117.981 0.300 . 1 . . . . 77 TYR CE1 . 10236 1 416 . 2 2 22 22 TYR CE2 C 13 117.981 0.300 . 1 . . . . 77 TYR CE2 . 10236 1 417 . 2 2 22 22 TYR N N 15 123.700 0.300 . 1 . . . . 77 TYR N . 10236 1 418 . 2 2 23 23 LEU H H 1 8.356 0.030 . 1 . . . . 78 LEU H . 10236 1 419 . 2 2 23 23 LEU HA H 1 3.303 0.030 . 1 . . . . 78 LEU HA . 10236 1 420 . 2 2 23 23 LEU HB2 H 1 0.898 0.030 . 2 . . . . 78 LEU HB2 . 10236 1 421 . 2 2 23 23 LEU HB3 H 1 0.496 0.030 . 2 . . . . 78 LEU HB3 . 10236 1 422 . 2 2 23 23 LEU HD11 H 1 -0.043 0.030 . 1 . . . . 78 LEU HD1 . 10236 1 423 . 2 2 23 23 LEU HD12 H 1 -0.043 0.030 . 1 . . . . 78 LEU HD1 . 10236 1 424 . 2 2 23 23 LEU HD13 H 1 -0.043 0.030 . 1 . . . . 78 LEU HD1 . 10236 1 425 . 2 2 23 23 LEU HD21 H 1 -0.009 0.030 . 1 . . . . 78 LEU HD2 . 10236 1 426 . 2 2 23 23 LEU HD22 H 1 -0.009 0.030 . 1 . . . . 78 LEU HD2 . 10236 1 427 . 2 2 23 23 LEU HD23 H 1 -0.009 0.030 . 1 . . . . 78 LEU HD2 . 10236 1 428 . 2 2 23 23 LEU HG H 1 -0.880 0.030 . 1 . . . . 78 LEU HG . 10236 1 429 . 2 2 23 23 LEU C C 13 175.658 0.300 . 1 . . . . 78 LEU C . 10236 1 430 . 2 2 23 23 LEU CA C 13 58.932 0.300 . 1 . . . . 78 LEU CA . 10236 1 431 . 2 2 23 23 LEU CB C 13 41.779 0.300 . 1 . . . . 78 LEU CB . 10236 1 432 . 2 2 23 23 LEU CD1 C 13 25.586 0.300 . 2 . . . . 78 LEU CD1 . 10236 1 433 . 2 2 23 23 LEU CD2 C 13 26.507 0.300 . 2 . . . . 78 LEU CD2 . 10236 1 434 . 2 2 23 23 LEU CG C 13 30.360 0.300 . 1 . . . . 78 LEU CG . 10236 1 435 . 2 2 23 23 LEU N N 15 129.909 0.300 . 1 . . . . 78 LEU N . 10236 1 436 . 2 2 24 24 GLY H H 1 5.511 0.030 . 1 . . . . 79 GLY H . 10236 1 437 . 2 2 24 24 GLY HA2 H 1 4.028 0.030 . 2 . . . . 79 GLY HA2 . 10236 1 438 . 2 2 24 24 GLY HA3 H 1 2.289 0.030 . 2 . . . . 79 GLY HA3 . 10236 1 439 . 2 2 24 24 GLY C C 13 169.069 0.300 . 1 . . . . 79 GLY C . 10236 1 440 . 2 2 24 24 GLY CA C 13 43.323 0.300 . 1 . . . . 79 GLY CA . 10236 1 441 . 2 2 24 24 GLY N N 15 103.273 0.300 . 1 . . . . 79 GLY N . 10236 1 442 . 2 2 25 25 MET H H 1 7.571 0.030 . 1 . . . . 80 MET H . 10236 1 443 . 2 2 25 25 MET HA H 1 5.177 0.030 . 1 . . . . 80 MET HA . 10236 1 444 . 2 2 25 25 MET HB2 H 1 1.417 0.030 . 2 . . . . 80 MET HB2 . 10236 1 445 . 2 2 25 25 MET HB3 H 1 1.339 0.030 . 2 . . . . 80 MET HB3 . 10236 1 446 . 2 2 25 25 MET HE1 H 1 1.876 0.030 . 1 . . . . 80 MET HE . 10236 1 447 . 2 2 25 25 MET HE2 H 1 1.876 0.030 . 1 . . . . 80 MET HE . 10236 1 448 . 2 2 25 25 MET HE3 H 1 1.876 0.030 . 1 . . . . 80 MET HE . 10236 1 449 . 2 2 25 25 MET HG2 H 1 1.622 0.030 . 2 . . . . 80 MET HG2 . 10236 1 450 . 2 2 25 25 MET HG3 H 1 1.964 0.030 . 2 . . . . 80 MET HG3 . 10236 1 451 . 2 2 25 25 MET C C 13 175.585 0.300 . 1 . . . . 80 MET C . 10236 1 452 . 2 2 25 25 MET CA C 13 52.133 0.300 . 1 . . . . 80 MET CA . 10236 1 453 . 2 2 25 25 MET CB C 13 34.022 0.300 . 1 . . . . 80 MET CB . 10236 1 454 . 2 2 25 25 MET CE C 13 17.497 0.300 . 1 . . . . 80 MET CE . 10236 1 455 . 2 2 25 25 MET CG C 13 32.102 0.300 . 1 . . . . 80 MET CG . 10236 1 456 . 2 2 25 25 MET N N 15 116.984 0.300 . 1 . . . . 80 MET N . 10236 1 457 . 2 2 26 26 LEU H H 1 8.559 0.030 . 1 . . . . 81 LEU H . 10236 1 458 . 2 2 26 26 LEU HA H 1 4.772 0.030 . 1 . . . . 81 LEU HA . 10236 1 459 . 2 2 26 26 LEU HB2 H 1 1.438 0.030 . 2 . . . . 81 LEU HB2 . 10236 1 460 . 2 2 26 26 LEU HB3 H 1 1.104 0.030 . 2 . . . . 81 LEU HB3 . 10236 1 461 . 2 2 26 26 LEU HD11 H 1 0.893 0.030 . 1 . . . . 81 LEU HD1 . 10236 1 462 . 2 2 26 26 LEU HD12 H 1 0.893 0.030 . 1 . . . . 81 LEU HD1 . 10236 1 463 . 2 2 26 26 LEU HD13 H 1 0.893 0.030 . 1 . . . . 81 LEU HD1 . 10236 1 464 . 2 2 26 26 LEU HD21 H 1 0.902 0.030 . 1 . . . . 81 LEU HD2 . 10236 1 465 . 2 2 26 26 LEU HD22 H 1 0.902 0.030 . 1 . . . . 81 LEU HD2 . 10236 1 466 . 2 2 26 26 LEU HD23 H 1 0.902 0.030 . 1 . . . . 81 LEU HD2 . 10236 1 467 . 2 2 26 26 LEU HG H 1 1.538 0.030 . 1 . . . . 81 LEU HG . 10236 1 468 . 2 2 26 26 LEU CA C 13 51.833 0.300 . 1 . . . . 81 LEU CA . 10236 1 469 . 2 2 26 26 LEU CB C 13 46.653 0.300 . 1 . . . . 81 LEU CB . 10236 1 470 . 2 2 26 26 LEU CD1 C 13 24.814 0.300 . 2 . . . . 81 LEU CD1 . 10236 1 471 . 2 2 26 26 LEU CD2 C 13 25.995 0.300 . 2 . . . . 81 LEU CD2 . 10236 1 472 . 2 2 26 26 LEU CG C 13 26.516 0.300 . 1 . . . . 81 LEU CG . 10236 1 473 . 2 2 26 26 LEU N N 15 125.808 0.300 . 1 . . . . 81 LEU N . 10236 1 474 . 2 2 27 27 PRO HA H 1 4.954 0.030 . 1 . . . . 82 PRO HA . 10236 1 475 . 2 2 27 27 PRO HB2 H 1 2.339 0.030 . 2 . . . . 82 PRO HB2 . 10236 1 476 . 2 2 27 27 PRO HB3 H 1 1.895 0.030 . 2 . . . . 82 PRO HB3 . 10236 1 477 . 2 2 27 27 PRO HD2 H 1 3.595 0.030 . 2 . . . . 82 PRO HD2 . 10236 1 478 . 2 2 27 27 PRO HD3 H 1 3.760 0.030 . 2 . . . . 82 PRO HD3 . 10236 1 479 . 2 2 27 27 PRO HG2 H 1 2.103 0.030 . 2 . . . . 82 PRO HG2 . 10236 1 480 . 2 2 27 27 PRO HG3 H 1 1.874 0.030 . 2 . . . . 82 PRO HG3 . 10236 1 481 . 2 2 27 27 PRO C C 13 176.699 0.300 . 1 . . . . 82 PRO C . 10236 1 482 . 2 2 27 27 PRO CA C 13 62.273 0.300 . 1 . . . . 82 PRO CA . 10236 1 483 . 2 2 27 27 PRO CB C 13 32.102 0.300 . 1 . . . . 82 PRO CB . 10236 1 484 . 2 2 27 27 PRO CD C 13 51.179 0.300 . 1 . . . . 82 PRO CD . 10236 1 485 . 2 2 27 27 PRO CG C 13 27.648 0.300 . 1 . . . . 82 PRO CG . 10236 1 486 . 2 2 28 28 VAL H H 1 8.008 0.030 . 1 . . . . 83 VAL H . 10236 1 487 . 2 2 28 28 VAL HA H 1 4.829 0.030 . 1 . . . . 83 VAL HA . 10236 1 488 . 2 2 28 28 VAL HB H 1 2.135 0.030 . 1 . . . . 83 VAL HB . 10236 1 489 . 2 2 28 28 VAL HG11 H 1 0.764 0.030 . 1 . . . . 83 VAL HG1 . 10236 1 490 . 2 2 28 28 VAL HG12 H 1 0.764 0.030 . 1 . . . . 83 VAL HG1 . 10236 1 491 . 2 2 28 28 VAL HG13 H 1 0.764 0.030 . 1 . . . . 83 VAL HG1 . 10236 1 492 . 2 2 28 28 VAL HG21 H 1 0.666 0.030 . 1 . . . . 83 VAL HG2 . 10236 1 493 . 2 2 28 28 VAL HG22 H 1 0.666 0.030 . 1 . . . . 83 VAL HG2 . 10236 1 494 . 2 2 28 28 VAL HG23 H 1 0.666 0.030 . 1 . . . . 83 VAL HG2 . 10236 1 495 . 2 2 28 28 VAL C C 13 176.118 0.300 . 1 . . . . 83 VAL C . 10236 1 496 . 2 2 28 28 VAL CA C 13 58.903 0.300 . 1 . . . . 83 VAL CA . 10236 1 497 . 2 2 28 28 VAL CB C 13 36.217 0.300 . 1 . . . . 83 VAL CB . 10236 1 498 . 2 2 28 28 VAL CG1 C 13 23.143 0.300 . 2 . . . . 83 VAL CG1 . 10236 1 499 . 2 2 28 28 VAL CG2 C 13 19.249 0.300 . 2 . . . . 83 VAL CG2 . 10236 1 500 . 2 2 28 28 VAL N N 15 112.846 0.300 . 1 . . . . 83 VAL N . 10236 1 501 . 2 2 29 29 ASP H H 1 8.496 0.030 . 1 . . . . 84 ASP H . 10236 1 502 . 2 2 29 29 ASP HA H 1 4.744 0.030 . 1 . . . . 84 ASP HA . 10236 1 503 . 2 2 29 29 ASP HB2 H 1 2.742 0.030 . 1 . . . . 84 ASP HB2 . 10236 1 504 . 2 2 29 29 ASP HB3 H 1 2.742 0.030 . 1 . . . . 84 ASP HB3 . 10236 1 505 . 2 2 29 29 ASP C C 13 175.924 0.300 . 1 . . . . 84 ASP C . 10236 1 506 . 2 2 29 29 ASP CA C 13 54.792 0.300 . 1 . . . . 84 ASP CA . 10236 1 507 . 2 2 29 29 ASP CB C 13 41.823 0.300 . 1 . . . . 84 ASP CB . 10236 1 508 . 2 2 29 29 ASP N N 15 117.022 0.300 . 1 . . . . 84 ASP N . 10236 1 509 . 2 2 30 30 ARG H H 1 7.071 0.030 . 1 . . . . 85 ARG H . 10236 1 510 . 2 2 30 30 ARG HA H 1 4.559 0.030 . 1 . . . . 85 ARG HA . 10236 1 511 . 2 2 30 30 ARG HB2 H 1 1.730 0.030 . 2 . . . . 85 ARG HB2 . 10236 1 512 . 2 2 30 30 ARG HB3 H 1 1.647 0.030 . 2 . . . . 85 ARG HB3 . 10236 1 513 . 2 2 30 30 ARG HD2 H 1 3.117 0.030 . 1 . . . . 85 ARG HD2 . 10236 1 514 . 2 2 30 30 ARG HD3 H 1 3.117 0.030 . 1 . . . . 85 ARG HD3 . 10236 1 515 . 2 2 30 30 ARG HE H 1 7.253 0.030 . 1 . . . . 85 ARG HE . 10236 1 516 . 2 2 30 30 ARG HG2 H 1 1.531 0.030 . 1 . . . . 85 ARG HG2 . 10236 1 517 . 2 2 30 30 ARG HG3 H 1 1.531 0.030 . 1 . . . . 85 ARG HG3 . 10236 1 518 . 2 2 30 30 ARG CA C 13 52.309 0.300 . 1 . . . . 85 ARG CA . 10236 1 519 . 2 2 30 30 ARG CB C 13 32.761 0.300 . 1 . . . . 85 ARG CB . 10236 1 520 . 2 2 30 30 ARG CD C 13 43.219 0.300 . 1 . . . . 85 ARG CD . 10236 1 521 . 2 2 30 30 ARG CG C 13 26.392 0.300 . 1 . . . . 85 ARG CG . 10236 1 522 . 2 2 30 30 ARG N N 15 116.738 0.300 . 1 . . . . 85 ARG N . 10236 1 523 . 2 2 30 30 ARG NE N 15 85.574 0.300 . 1 . . . . 85 ARG NE . 10236 1 524 . 2 2 31 31 PRO HA H 1 3.462 0.030 . 1 . . . . 86 PRO HA . 10236 1 525 . 2 2 31 31 PRO HB2 H 1 1.275 0.030 . 2 . . . . 86 PRO HB2 . 10236 1 526 . 2 2 31 31 PRO HB3 H 1 1.422 0.030 . 2 . . . . 86 PRO HB3 . 10236 1 527 . 2 2 31 31 PRO HD2 H 1 2.912 0.030 . 2 . . . . 86 PRO HD2 . 10236 1 528 . 2 2 31 31 PRO HD3 H 1 3.480 0.030 . 2 . . . . 86 PRO HD3 . 10236 1 529 . 2 2 31 31 PRO HG2 H 1 1.822 0.030 . 2 . . . . 86 PRO HG2 . 10236 1 530 . 2 2 31 31 PRO HG3 H 1 1.732 0.030 . 2 . . . . 86 PRO HG3 . 10236 1 531 . 2 2 31 31 PRO C C 13 176.021 0.300 . 1 . . . . 86 PRO C . 10236 1 532 . 2 2 31 31 PRO CA C 13 62.181 0.300 . 1 . . . . 86 PRO CA . 10236 1 533 . 2 2 31 31 PRO CB C 13 31.610 0.300 . 1 . . . . 86 PRO CB . 10236 1 534 . 2 2 31 31 PRO CD C 13 49.474 0.300 . 1 . . . . 86 PRO CD . 10236 1 535 . 2 2 31 31 PRO CG C 13 26.046 0.300 . 1 . . . . 86 PRO CG . 10236 1 536 . 2 2 32 32 VAL H H 1 6.267 0.030 . 1 . . . . 87 VAL H . 10236 1 537 . 2 2 32 32 VAL HA H 1 3.685 0.030 . 1 . . . . 87 VAL HA . 10236 1 538 . 2 2 32 32 VAL HB H 1 1.606 0.030 . 1 . . . . 87 VAL HB . 10236 1 539 . 2 2 32 32 VAL HG11 H 1 0.715 0.030 . 1 . . . . 87 VAL HG1 . 10236 1 540 . 2 2 32 32 VAL HG12 H 1 0.715 0.030 . 1 . . . . 87 VAL HG1 . 10236 1 541 . 2 2 32 32 VAL HG13 H 1 0.715 0.030 . 1 . . . . 87 VAL HG1 . 10236 1 542 . 2 2 32 32 VAL HG21 H 1 0.520 0.030 . 1 . . . . 87 VAL HG2 . 10236 1 543 . 2 2 32 32 VAL HG22 H 1 0.520 0.030 . 1 . . . . 87 VAL HG2 . 10236 1 544 . 2 2 32 32 VAL HG23 H 1 0.520 0.030 . 1 . . . . 87 VAL HG2 . 10236 1 545 . 2 2 32 32 VAL C C 13 174.156 0.300 . 1 . . . . 87 VAL C . 10236 1 546 . 2 2 32 32 VAL CA C 13 58.051 0.300 . 1 . . . . 87 VAL CA . 10236 1 547 . 2 2 32 32 VAL CB C 13 36.900 0.300 . 1 . . . . 87 VAL CB . 10236 1 548 . 2 2 32 32 VAL CG1 C 13 21.466 0.300 . 2 . . . . 87 VAL CG1 . 10236 1 549 . 2 2 32 32 VAL CG2 C 13 18.362 0.300 . 2 . . . . 87 VAL CG2 . 10236 1 550 . 2 2 32 32 VAL N N 15 106.871 0.300 . 1 . . . . 87 VAL N . 10236 1 551 . 2 2 33 33 GLY H H 1 3.385 0.030 . 1 . . . . 88 GLY H . 10236 1 552 . 2 2 33 33 GLY HA2 H 1 4.229 0.030 . 2 . . . . 88 GLY HA2 . 10236 1 553 . 2 2 33 33 GLY HA3 H 1 3.168 0.030 . 2 . . . . 88 GLY HA3 . 10236 1 554 . 2 2 33 33 GLY C C 13 173.647 0.300 . 1 . . . . 88 GLY C . 10236 1 555 . 2 2 33 33 GLY CA C 13 44.738 0.300 . 1 . . . . 88 GLY CA . 10236 1 556 . 2 2 33 33 GLY N N 15 105.710 0.300 . 1 . . . . 88 GLY N . 10236 1 557 . 2 2 34 34 MET H H 1 8.949 0.030 . 1 . . . . 89 MET H . 10236 1 558 . 2 2 34 34 MET HA H 1 4.748 0.030 . 1 . . . . 89 MET HA . 10236 1 559 . 2 2 34 34 MET HB2 H 1 2.037 0.030 . 1 . . . . 89 MET HB2 . 10236 1 560 . 2 2 34 34 MET HB3 H 1 2.037 0.030 . 1 . . . . 89 MET HB3 . 10236 1 561 . 2 2 34 34 MET HE1 H 1 2.059 0.030 . 1 . . . . 89 MET HE . 10236 1 562 . 2 2 34 34 MET HE2 H 1 2.059 0.030 . 1 . . . . 89 MET HE . 10236 1 563 . 2 2 34 34 MET HE3 H 1 2.059 0.030 . 1 . . . . 89 MET HE . 10236 1 564 . 2 2 34 34 MET HG2 H 1 2.468 0.030 . 2 . . . . 89 MET HG2 . 10236 1 565 . 2 2 34 34 MET HG3 H 1 2.591 0.030 . 2 . . . . 89 MET HG3 . 10236 1 566 . 2 2 34 34 MET C C 13 178.880 0.300 . 1 . . . . 89 MET C . 10236 1 567 . 2 2 34 34 MET CA C 13 55.532 0.300 . 1 . . . . 89 MET CA . 10236 1 568 . 2 2 34 34 MET CB C 13 29.300 0.300 . 1 . . . . 89 MET CB . 10236 1 569 . 2 2 34 34 MET CE C 13 16.100 0.300 . 1 . . . . 89 MET CE . 10236 1 570 . 2 2 34 34 MET CG C 13 32.368 0.300 . 1 . . . . 89 MET CG . 10236 1 571 . 2 2 34 34 MET N N 15 125.155 0.300 . 1 . . . . 89 MET N . 10236 1 572 . 2 2 35 35 ASP H H 1 8.948 0.030 . 1 . . . . 90 ASP H . 10236 1 573 . 2 2 35 35 ASP HA H 1 4.376 0.030 . 1 . . . . 90 ASP HA . 10236 1 574 . 2 2 35 35 ASP HB2 H 1 2.698 0.030 . 2 . . . . 90 ASP HB2 . 10236 1 575 . 2 2 35 35 ASP HB3 H 1 2.610 0.030 . 2 . . . . 90 ASP HB3 . 10236 1 576 . 2 2 35 35 ASP C C 13 179.194 0.300 . 1 . . . . 90 ASP C . 10236 1 577 . 2 2 35 35 ASP CA C 13 56.930 0.300 . 1 . . . . 90 ASP CA . 10236 1 578 . 2 2 35 35 ASP CB C 13 38.523 0.300 . 1 . . . . 90 ASP CB . 10236 1 579 . 2 2 35 35 ASP N N 15 120.225 0.300 . 1 . . . . 90 ASP N . 10236 1 580 . 2 2 36 36 THR H H 1 7.481 0.030 . 1 . . . . 91 THR H . 10236 1 581 . 2 2 36 36 THR HA H 1 3.704 0.030 . 1 . . . . 91 THR HA . 10236 1 582 . 2 2 36 36 THR HB H 1 3.802 0.030 . 1 . . . . 91 THR HB . 10236 1 583 . 2 2 36 36 THR HG21 H 1 1.066 0.030 . 1 . . . . 91 THR HG2 . 10236 1 584 . 2 2 36 36 THR HG22 H 1 1.066 0.030 . 1 . . . . 91 THR HG2 . 10236 1 585 . 2 2 36 36 THR HG23 H 1 1.066 0.030 . 1 . . . . 91 THR HG2 . 10236 1 586 . 2 2 36 36 THR C C 13 176.409 0.300 . 1 . . . . 91 THR C . 10236 1 587 . 2 2 36 36 THR CA C 13 66.244 0.300 . 1 . . . . 91 THR CA . 10236 1 588 . 2 2 36 36 THR CB C 13 68.473 0.300 . 1 . . . . 91 THR CB . 10236 1 589 . 2 2 36 36 THR CG2 C 13 21.828 0.300 . 1 . . . . 91 THR CG2 . 10236 1 590 . 2 2 36 36 THR N N 15 119.852 0.300 . 1 . . . . 91 THR N . 10236 1 591 . 2 2 37 37 LEU H H 1 7.930 0.030 . 1 . . . . 92 LEU H . 10236 1 592 . 2 2 37 37 LEU HA H 1 3.739 0.030 . 1 . . . . 92 LEU HA . 10236 1 593 . 2 2 37 37 LEU HB2 H 1 1.859 0.030 . 2 . . . . 92 LEU HB2 . 10236 1 594 . 2 2 37 37 LEU HB3 H 1 1.608 0.030 . 2 . . . . 92 LEU HB3 . 10236 1 595 . 2 2 37 37 LEU HD11 H 1 0.713 0.030 . 1 . . . . 92 LEU HD1 . 10236 1 596 . 2 2 37 37 LEU HD12 H 1 0.713 0.030 . 1 . . . . 92 LEU HD1 . 10236 1 597 . 2 2 37 37 LEU HD13 H 1 0.713 0.030 . 1 . . . . 92 LEU HD1 . 10236 1 598 . 2 2 37 37 LEU HD21 H 1 0.596 0.030 . 1 . . . . 92 LEU HD2 . 10236 1 599 . 2 2 37 37 LEU HD22 H 1 0.596 0.030 . 1 . . . . 92 LEU HD2 . 10236 1 600 . 2 2 37 37 LEU HD23 H 1 0.596 0.030 . 1 . . . . 92 LEU HD2 . 10236 1 601 . 2 2 37 37 LEU HG H 1 1.366 0.030 . 1 . . . . 92 LEU HG . 10236 1 602 . 2 2 37 37 LEU C C 13 178.443 0.300 . 1 . . . . 92 LEU C . 10236 1 603 . 2 2 37 37 LEU CA C 13 58.765 0.300 . 1 . . . . 92 LEU CA . 10236 1 604 . 2 2 37 37 LEU CB C 13 44.194 0.300 . 1 . . . . 92 LEU CB . 10236 1 605 . 2 2 37 37 LEU CD1 C 13 26.451 0.300 . 2 . . . . 92 LEU CD1 . 10236 1 606 . 2 2 37 37 LEU CD2 C 13 25.600 0.300 . 2 . . . . 92 LEU CD2 . 10236 1 607 . 2 2 37 37 LEU CG C 13 26.360 0.300 . 1 . . . . 92 LEU CG . 10236 1 608 . 2 2 37 37 LEU N N 15 122.219 0.300 . 1 . . . . 92 LEU N . 10236 1 609 . 2 2 38 38 ASN H H 1 9.103 0.030 . 1 . . . . 93 ASN H . 10236 1 610 . 2 2 38 38 ASN HA H 1 4.549 0.030 . 1 . . . . 93 ASN HA . 10236 1 611 . 2 2 38 38 ASN HB2 H 1 2.930 0.030 . 2 . . . . 93 ASN HB2 . 10236 1 612 . 2 2 38 38 ASN HB3 H 1 2.562 0.030 . 2 . . . . 93 ASN HB3 . 10236 1 613 . 2 2 38 38 ASN HD21 H 1 7.688 0.030 . 2 . . . . 93 ASN HD21 . 10236 1 614 . 2 2 38 38 ASN HD22 H 1 7.247 0.030 . 2 . . . . 93 ASN HD22 . 10236 1 615 . 2 2 38 38 ASN C C 13 178.080 0.300 . 1 . . . . 93 ASN C . 10236 1 616 . 2 2 38 38 ASN CA C 13 56.518 0.300 . 1 . . . . 93 ASN CA . 10236 1 617 . 2 2 38 38 ASN CB C 13 38.007 0.300 . 1 . . . . 93 ASN CB . 10236 1 618 . 2 2 38 38 ASN N N 15 114.770 0.300 . 1 . . . . 93 ASN N . 10236 1 619 . 2 2 38 38 ASN ND2 N 15 112.398 0.300 . 1 . . . . 93 ASN ND2 . 10236 1 620 . 2 2 39 39 SER H H 1 7.742 0.030 . 1 . . . . 94 SER H . 10236 1 621 . 2 2 39 39 SER HA H 1 4.191 0.030 . 1 . . . . 94 SER HA . 10236 1 622 . 2 2 39 39 SER HB2 H 1 3.959 0.030 . 2 . . . . 94 SER HB2 . 10236 1 623 . 2 2 39 39 SER HB3 H 1 3.910 0.030 . 2 . . . . 94 SER HB3 . 10236 1 624 . 2 2 39 39 SER C C 13 176.530 0.300 . 1 . . . . 94 SER C . 10236 1 625 . 2 2 39 39 SER CA C 13 61.847 0.300 . 1 . . . . 94 SER CA . 10236 1 626 . 2 2 39 39 SER CB C 13 62.535 0.300 . 1 . . . . 94 SER CB . 10236 1 627 . 2 2 39 39 SER N N 15 114.879 0.300 . 1 . . . . 94 SER N . 10236 1 628 . 2 2 40 40 ALA H H 1 7.205 0.030 . 1 . . . . 95 ALA H . 10236 1 629 . 2 2 40 40 ALA HA H 1 4.083 0.030 . 1 . . . . 95 ALA HA . 10236 1 630 . 2 2 40 40 ALA HB1 H 1 1.292 0.030 . 1 . . . . 95 ALA HB . 10236 1 631 . 2 2 40 40 ALA HB2 H 1 1.292 0.030 . 1 . . . . 95 ALA HB . 10236 1 632 . 2 2 40 40 ALA HB3 H 1 1.292 0.030 . 1 . . . . 95 ALA HB . 10236 1 633 . 2 2 40 40 ALA C C 13 178.758 0.300 . 1 . . . . 95 ALA C . 10236 1 634 . 2 2 40 40 ALA CA C 13 55.074 0.300 . 1 . . . . 95 ALA CA . 10236 1 635 . 2 2 40 40 ALA CB C 13 18.544 0.300 . 1 . . . . 95 ALA CB . 10236 1 636 . 2 2 40 40 ALA N N 15 124.158 0.300 . 1 . . . . 95 ALA N . 10236 1 637 . 2 2 41 41 ILE H H 1 8.197 0.030 . 1 . . . . 96 ILE H . 10236 1 638 . 2 2 41 41 ILE HA H 1 3.326 0.030 . 1 . . . . 96 ILE HA . 10236 1 639 . 2 2 41 41 ILE HB H 1 1.945 0.030 . 1 . . . . 96 ILE HB . 10236 1 640 . 2 2 41 41 ILE HD11 H 1 0.640 0.030 . 1 . . . . 96 ILE HD1 . 10236 1 641 . 2 2 41 41 ILE HD12 H 1 0.640 0.030 . 1 . . . . 96 ILE HD1 . 10236 1 642 . 2 2 41 41 ILE HD13 H 1 0.640 0.030 . 1 . . . . 96 ILE HD1 . 10236 1 643 . 2 2 41 41 ILE HG12 H 1 1.754 0.030 . 2 . . . . 96 ILE HG12 . 10236 1 644 . 2 2 41 41 ILE HG13 H 1 0.727 0.030 . 2 . . . . 96 ILE HG13 . 10236 1 645 . 2 2 41 41 ILE HG21 H 1 0.926 0.030 . 1 . . . . 96 ILE HG2 . 10236 1 646 . 2 2 41 41 ILE HG22 H 1 0.926 0.030 . 1 . . . . 96 ILE HG2 . 10236 1 647 . 2 2 41 41 ILE HG23 H 1 0.926 0.030 . 1 . . . . 96 ILE HG2 . 10236 1 648 . 2 2 41 41 ILE C C 13 177.862 0.300 . 1 . . . . 96 ILE C . 10236 1 649 . 2 2 41 41 ILE CA C 13 66.535 0.300 . 1 . . . . 96 ILE CA . 10236 1 650 . 2 2 41 41 ILE CB C 13 38.949 0.300 . 1 . . . . 96 ILE CB . 10236 1 651 . 2 2 41 41 ILE CD1 C 13 12.929 0.300 . 1 . . . . 96 ILE CD1 . 10236 1 652 . 2 2 41 41 ILE CG1 C 13 28.972 0.300 . 1 . . . . 96 ILE CG1 . 10236 1 653 . 2 2 41 41 ILE CG2 C 13 17.708 0.300 . 1 . . . . 96 ILE CG2 . 10236 1 654 . 2 2 41 41 ILE N N 15 116.775 0.300 . 1 . . . . 96 ILE N . 10236 1 655 . 2 2 42 42 GLU H H 1 8.469 0.030 . 1 . . . . 97 GLU H . 10236 1 656 . 2 2 42 42 GLU HA H 1 3.899 0.030 . 1 . . . . 97 GLU HA . 10236 1 657 . 2 2 42 42 GLU HB2 H 1 2.033 0.030 . 1 . . . . 97 GLU HB2 . 10236 1 658 . 2 2 42 42 GLU HB3 H 1 2.033 0.030 . 1 . . . . 97 GLU HB3 . 10236 1 659 . 2 2 42 42 GLU HG2 H 1 2.342 0.030 . 2 . . . . 97 GLU HG2 . 10236 1 660 . 2 2 42 42 GLU HG3 H 1 2.483 0.030 . 2 . . . . 97 GLU HG3 . 10236 1 661 . 2 2 42 42 GLU C C 13 179.485 0.300 . 1 . . . . 97 GLU C . 10236 1 662 . 2 2 42 42 GLU CA C 13 59.446 0.300 . 1 . . . . 97 GLU CA . 10236 1 663 . 2 2 42 42 GLU CB C 13 29.048 0.300 . 1 . . . . 97 GLU CB . 10236 1 664 . 2 2 42 42 GLU CG C 13 36.781 0.300 . 1 . . . . 97 GLU CG . 10236 1 665 . 2 2 42 42 GLU N N 15 116.152 0.300 . 1 . . . . 97 GLU N . 10236 1 666 . 2 2 43 43 ASN H H 1 7.834 0.030 . 1 . . . . 98 ASN H . 10236 1 667 . 2 2 43 43 ASN HA H 1 4.339 0.030 . 1 . . . . 98 ASN HA . 10236 1 668 . 2 2 43 43 ASN HB2 H 1 2.862 0.030 . 2 . . . . 98 ASN HB2 . 10236 1 669 . 2 2 43 43 ASN HB3 H 1 2.780 0.030 . 2 . . . . 98 ASN HB3 . 10236 1 670 . 2 2 43 43 ASN HD21 H 1 7.282 0.030 . 2 . . . . 98 ASN HD21 . 10236 1 671 . 2 2 43 43 ASN HD22 H 1 6.771 0.030 . 2 . . . . 98 ASN HD22 . 10236 1 672 . 2 2 43 43 ASN C C 13 178.661 0.300 . 1 . . . . 98 ASN C . 10236 1 673 . 2 2 43 43 ASN CA C 13 56.436 0.300 . 1 . . . . 98 ASN CA . 10236 1 674 . 2 2 43 43 ASN CB C 13 38.844 0.300 . 1 . . . . 98 ASN CB . 10236 1 675 . 2 2 43 43 ASN N N 15 118.649 0.300 . 1 . . . . 98 ASN N . 10236 1 676 . 2 2 43 43 ASN ND2 N 15 111.703 0.300 . 1 . . . . 98 ASN ND2 . 10236 1 677 . 2 2 44 44 LEU H H 1 7.941 0.030 . 1 . . . . 99 LEU H . 10236 1 678 . 2 2 44 44 LEU HA H 1 4.081 0.030 . 1 . . . . 99 LEU HA . 10236 1 679 . 2 2 44 44 LEU HB2 H 1 1.564 0.030 . 2 . . . . 99 LEU HB2 . 10236 1 680 . 2 2 44 44 LEU HB3 H 1 0.961 0.030 . 2 . . . . 99 LEU HB3 . 10236 1 681 . 2 2 44 44 LEU HD11 H 1 0.233 0.030 . 1 . . . . 99 LEU HD1 . 10236 1 682 . 2 2 44 44 LEU HD12 H 1 0.233 0.030 . 1 . . . . 99 LEU HD1 . 10236 1 683 . 2 2 44 44 LEU HD13 H 1 0.233 0.030 . 1 . . . . 99 LEU HD1 . 10236 1 684 . 2 2 44 44 LEU HD21 H 1 0.599 0.030 . 1 . . . . 99 LEU HD2 . 10236 1 685 . 2 2 44 44 LEU HD22 H 1 0.599 0.030 . 1 . . . . 99 LEU HD2 . 10236 1 686 . 2 2 44 44 LEU HD23 H 1 0.599 0.030 . 1 . . . . 99 LEU HD2 . 10236 1 687 . 2 2 44 44 LEU HG H 1 1.528 0.030 . 1 . . . . 99 LEU HG . 10236 1 688 . 2 2 44 44 LEU C C 13 179.848 0.300 . 1 . . . . 99 LEU C . 10236 1 689 . 2 2 44 44 LEU CA C 13 57.882 0.300 . 1 . . . . 99 LEU CA . 10236 1 690 . 2 2 44 44 LEU CB C 13 41.899 0.300 . 1 . . . . 99 LEU CB . 10236 1 691 . 2 2 44 44 LEU CD1 C 13 25.395 0.300 . 2 . . . . 99 LEU CD1 . 10236 1 692 . 2 2 44 44 LEU CD2 C 13 22.306 0.300 . 2 . . . . 99 LEU CD2 . 10236 1 693 . 2 2 44 44 LEU CG C 13 26.925 0.300 . 1 . . . . 99 LEU CG . 10236 1 694 . 2 2 44 44 LEU N N 15 119.745 0.300 . 1 . . . . 99 LEU N . 10236 1 695 . 2 2 45 45 MET H H 1 8.598 0.030 . 1 . . . . 100 MET H . 10236 1 696 . 2 2 45 45 MET HA H 1 4.248 0.030 . 1 . . . . 100 MET HA . 10236 1 697 . 2 2 45 45 MET HB2 H 1 2.297 0.030 . 2 . . . . 100 MET HB2 . 10236 1 698 . 2 2 45 45 MET HB3 H 1 2.201 0.030 . 2 . . . . 100 MET HB3 . 10236 1 699 . 2 2 45 45 MET HE1 H 1 2.340 0.030 . 1 . . . . 100 MET HE . 10236 1 700 . 2 2 45 45 MET HE2 H 1 2.340 0.030 . 1 . . . . 100 MET HE . 10236 1 701 . 2 2 45 45 MET HE3 H 1 2.340 0.030 . 1 . . . . 100 MET HE . 10236 1 702 . 2 2 45 45 MET HG2 H 1 2.461 0.030 . 2 . . . . 100 MET HG2 . 10236 1 703 . 2 2 45 45 MET HG3 H 1 2.761 0.030 . 2 . . . . 100 MET HG3 . 10236 1 704 . 2 2 45 45 MET C C 13 177.305 0.300 . 1 . . . . 100 MET C . 10236 1 705 . 2 2 45 45 MET CA C 13 58.703 0.300 . 1 . . . . 100 MET CA . 10236 1 706 . 2 2 45 45 MET CB C 13 33.669 0.300 . 1 . . . . 100 MET CB . 10236 1 707 . 2 2 45 45 MET CE C 13 17.079 0.300 . 1 . . . . 100 MET CE . 10236 1 708 . 2 2 45 45 MET CG C 13 33.001 0.300 . 1 . . . . 100 MET CG . 10236 1 709 . 2 2 45 45 MET N N 15 118.449 0.300 . 1 . . . . 100 MET N . 10236 1 710 . 2 2 46 46 THR H H 1 7.766 0.030 . 1 . . . . 101 THR H . 10236 1 711 . 2 2 46 46 THR HA H 1 4.428 0.030 . 1 . . . . 101 THR HA . 10236 1 712 . 2 2 46 46 THR HB H 1 4.429 0.030 . 1 . . . . 101 THR HB . 10236 1 713 . 2 2 46 46 THR HG21 H 1 1.346 0.030 . 1 . . . . 101 THR HG2 . 10236 1 714 . 2 2 46 46 THR HG22 H 1 1.346 0.030 . 1 . . . . 101 THR HG2 . 10236 1 715 . 2 2 46 46 THR HG23 H 1 1.346 0.030 . 1 . . . . 101 THR HG2 . 10236 1 716 . 2 2 46 46 THR C C 13 175.730 0.300 . 1 . . . . 101 THR C . 10236 1 717 . 2 2 46 46 THR CA C 13 63.533 0.300 . 1 . . . . 101 THR CA . 10236 1 718 . 2 2 46 46 THR CB C 13 69.835 0.300 . 1 . . . . 101 THR CB . 10236 1 719 . 2 2 46 46 THR CG2 C 13 21.585 0.300 . 1 . . . . 101 THR CG2 . 10236 1 720 . 2 2 46 46 THR N N 15 108.370 0.300 . 1 . . . . 101 THR N . 10236 1 721 . 2 2 47 47 SER H H 1 7.747 0.030 . 1 . . . . 102 SER H . 10236 1 722 . 2 2 47 47 SER HA H 1 4.553 0.030 . 1 . . . . 102 SER HA . 10236 1 723 . 2 2 47 47 SER HB2 H 1 4.057 0.030 . 2 . . . . 102 SER HB2 . 10236 1 724 . 2 2 47 47 SER HB3 H 1 3.956 0.030 . 2 . . . . 102 SER HB3 . 10236 1 725 . 2 2 47 47 SER C C 13 173.453 0.300 . 1 . . . . 102 SER C . 10236 1 726 . 2 2 47 47 SER CA C 13 59.067 0.300 . 1 . . . . 102 SER CA . 10236 1 727 . 2 2 47 47 SER CB C 13 64.328 0.300 . 1 . . . . 102 SER CB . 10236 1 728 . 2 2 47 47 SER N N 15 115.310 0.300 . 1 . . . . 102 SER N . 10236 1 729 . 2 2 48 48 SER H H 1 7.736 0.030 . 1 . . . . 103 SER H . 10236 1 730 . 2 2 48 48 SER HA H 1 4.714 0.030 . 1 . . . . 103 SER HA . 10236 1 731 . 2 2 48 48 SER HB2 H 1 4.118 0.030 . 1 . . . . 103 SER HB2 . 10236 1 732 . 2 2 48 48 SER HB3 H 1 4.118 0.030 . 1 . . . . 103 SER HB3 . 10236 1 733 . 2 2 48 48 SER C C 13 172.170 0.300 . 1 . . . . 103 SER C . 10236 1 734 . 2 2 48 48 SER CA C 13 57.669 0.300 . 1 . . . . 103 SER CA . 10236 1 735 . 2 2 48 48 SER CB C 13 65.726 0.300 . 1 . . . . 103 SER CB . 10236 1 736 . 2 2 48 48 SER N N 15 114.470 0.300 . 1 . . . . 103 SER N . 10236 1 737 . 2 2 49 49 SER H H 1 8.586 0.030 . 1 . . . . 104 SER H . 10236 1 738 . 2 2 49 49 SER HA H 1 4.401 0.030 . 1 . . . . 104 SER HA . 10236 1 739 . 2 2 49 49 SER HB2 H 1 3.630 0.030 . 2 . . . . 104 SER HB2 . 10236 1 740 . 2 2 49 49 SER HB3 H 1 3.594 0.030 . 2 . . . . 104 SER HB3 . 10236 1 741 . 2 2 49 49 SER C C 13 173.453 0.300 . 1 . . . . 104 SER C . 10236 1 742 . 2 2 49 49 SER CA C 13 56.867 0.300 . 1 . . . . 104 SER CA . 10236 1 743 . 2 2 49 49 SER CB C 13 65.008 0.300 . 1 . . . . 104 SER CB . 10236 1 744 . 2 2 49 49 SER N N 15 115.051 0.300 . 1 . . . . 104 SER N . 10236 1 745 . 2 2 50 50 LYS H H 1 7.634 0.030 . 1 . . . . 105 LYS H . 10236 1 746 . 2 2 50 50 LYS HA H 1 1.311 0.030 . 1 . . . . 105 LYS HA . 10236 1 747 . 2 2 50 50 LYS HB2 H 1 0.885 0.030 . 2 . . . . 105 LYS HB2 . 10236 1 748 . 2 2 50 50 LYS HB3 H 1 0.717 0.030 . 2 . . . . 105 LYS HB3 . 10236 1 749 . 2 2 50 50 LYS HD2 H 1 1.032 0.030 . 2 . . . . 105 LYS HD2 . 10236 1 750 . 2 2 50 50 LYS HD3 H 1 0.919 0.030 . 2 . . . . 105 LYS HD3 . 10236 1 751 . 2 2 50 50 LYS HE2 H 1 2.275 0.030 . 2 . . . . 105 LYS HE2 . 10236 1 752 . 2 2 50 50 LYS HE3 H 1 2.493 0.030 . 2 . . . . 105 LYS HE3 . 10236 1 753 . 2 2 50 50 LYS HG2 H 1 0.580 0.030 . 2 . . . . 105 LYS HG2 . 10236 1 754 . 2 2 50 50 LYS HG3 H 1 0.718 0.030 . 2 . . . . 105 LYS HG3 . 10236 1 755 . 2 2 50 50 LYS C C 13 177.232 0.300 . 1 . . . . 105 LYS C . 10236 1 756 . 2 2 50 50 LYS CA C 13 57.258 0.300 . 1 . . . . 105 LYS CA . 10236 1 757 . 2 2 50 50 LYS CB C 13 32.098 0.300 . 1 . . . . 105 LYS CB . 10236 1 758 . 2 2 50 50 LYS CD C 13 29.144 0.300 . 1 . . . . 105 LYS CD . 10236 1 759 . 2 2 50 50 LYS CE C 13 41.557 0.300 . 1 . . . . 105 LYS CE . 10236 1 760 . 2 2 50 50 LYS CG C 13 23.719 0.300 . 1 . . . . 105 LYS CG . 10236 1 761 . 2 2 50 50 LYS N N 15 123.341 0.300 . 1 . . . . 105 LYS N . 10236 1 762 . 2 2 51 51 GLU H H 1 7.930 0.030 . 1 . . . . 106 GLU H . 10236 1 763 . 2 2 51 51 GLU HA H 1 3.764 0.030 . 1 . . . . 106 GLU HA . 10236 1 764 . 2 2 51 51 GLU HB2 H 1 1.814 0.030 . 2 . . . . 106 GLU HB2 . 10236 1 765 . 2 2 51 51 GLU HB3 H 1 1.663 0.030 . 2 . . . . 106 GLU HB3 . 10236 1 766 . 2 2 51 51 GLU HG2 H 1 2.099 0.030 . 2 . . . . 106 GLU HG2 . 10236 1 767 . 2 2 51 51 GLU HG3 H 1 2.059 0.030 . 2 . . . . 106 GLU HG3 . 10236 1 768 . 2 2 51 51 GLU C C 13 176.966 0.300 . 1 . . . . 106 GLU C . 10236 1 769 . 2 2 51 51 GLU CA C 13 58.090 0.300 . 1 . . . . 106 GLU CA . 10236 1 770 . 2 2 51 51 GLU CB C 13 28.651 0.300 . 1 . . . . 106 GLU CB . 10236 1 771 . 2 2 51 51 GLU CG C 13 36.296 0.300 . 1 . . . . 106 GLU CG . 10236 1 772 . 2 2 51 51 GLU N N 15 115.372 0.300 . 1 . . . . 106 GLU N . 10236 1 773 . 2 2 52 52 ASP H H 1 7.760 0.030 . 1 . . . . 107 ASP H . 10236 1 774 . 2 2 52 52 ASP HA H 1 4.564 0.030 . 1 . . . . 107 ASP HA . 10236 1 775 . 2 2 52 52 ASP HB2 H 1 2.848 0.030 . 2 . . . . 107 ASP HB2 . 10236 1 776 . 2 2 52 52 ASP HB3 H 1 2.704 0.030 . 2 . . . . 107 ASP HB3 . 10236 1 777 . 2 2 52 52 ASP C C 13 176.796 0.300 . 1 . . . . 107 ASP C . 10236 1 778 . 2 2 52 52 ASP CA C 13 54.628 0.300 . 1 . . . . 107 ASP CA . 10236 1 779 . 2 2 52 52 ASP CB C 13 41.807 0.300 . 1 . . . . 107 ASP CB . 10236 1 780 . 2 2 52 52 ASP N N 15 117.376 0.300 . 1 . . . . 107 ASP N . 10236 1 781 . 2 2 53 53 TRP H H 1 7.020 0.030 . 1 . . . . 108 TRP H . 10236 1 782 . 2 2 53 53 TRP HA H 1 5.249 0.030 . 1 . . . . 108 TRP HA . 10236 1 783 . 2 2 53 53 TRP HB2 H 1 3.378 0.030 . 2 . . . . 108 TRP HB2 . 10236 1 784 . 2 2 53 53 TRP HB3 H 1 2.801 0.030 . 2 . . . . 108 TRP HB3 . 10236 1 785 . 2 2 53 53 TRP HD1 H 1 6.930 0.030 . 1 . . . . 108 TRP HD1 . 10236 1 786 . 2 2 53 53 TRP HE1 H 1 9.868 0.030 . 1 . . . . 108 TRP HE1 . 10236 1 787 . 2 2 53 53 TRP HE3 H 1 6.919 0.030 . 1 . . . . 108 TRP HE3 . 10236 1 788 . 2 2 53 53 TRP HH2 H 1 6.584 0.030 . 1 . . . . 108 TRP HH2 . 10236 1 789 . 2 2 53 53 TRP HZ2 H 1 7.276 0.030 . 1 . . . . 108 TRP HZ2 . 10236 1 790 . 2 2 53 53 TRP HZ3 H 1 5.890 0.030 . 1 . . . . 108 TRP HZ3 . 10236 1 791 . 2 2 53 53 TRP CA C 13 53.061 0.300 . 1 . . . . 108 TRP CA . 10236 1 792 . 2 2 53 53 TRP CB C 13 28.379 0.300 . 1 . . . . 108 TRP CB . 10236 1 793 . 2 2 53 53 TRP CD1 C 13 124.770 0.300 . 1 . . . . 108 TRP CD1 . 10236 1 794 . 2 2 53 53 TRP CE3 C 13 120.107 0.300 . 1 . . . . 108 TRP CE3 . 10236 1 795 . 2 2 53 53 TRP CH2 C 13 123.917 0.300 . 1 . . . . 108 TRP CH2 . 10236 1 796 . 2 2 53 53 TRP CZ2 C 13 114.437 0.300 . 1 . . . . 108 TRP CZ2 . 10236 1 797 . 2 2 53 53 TRP CZ3 C 13 121.504 0.300 . 1 . . . . 108 TRP CZ3 . 10236 1 798 . 2 2 53 53 TRP N N 15 123.772 0.300 . 1 . . . . 108 TRP N . 10236 1 799 . 2 2 53 53 TRP NE1 N 15 129.586 0.300 . 1 . . . . 108 TRP NE1 . 10236 1 800 . 2 2 54 54 PRO HA H 1 4.619 0.030 . 1 . . . . 109 PRO HA . 10236 1 801 . 2 2 54 54 PRO HB2 H 1 2.460 0.030 . 2 . . . . 109 PRO HB2 . 10236 1 802 . 2 2 54 54 PRO HB3 H 1 1.992 0.030 . 2 . . . . 109 PRO HB3 . 10236 1 803 . 2 2 54 54 PRO HD2 H 1 4.218 0.030 . 2 . . . . 109 PRO HD2 . 10236 1 804 . 2 2 54 54 PRO HD3 H 1 4.735 0.030 . 2 . . . . 109 PRO HD3 . 10236 1 805 . 2 2 54 54 PRO HG2 H 1 2.299 0.030 . 2 . . . . 109 PRO HG2 . 10236 1 806 . 2 2 54 54 PRO HG3 H 1 2.255 0.030 . 2 . . . . 109 PRO HG3 . 10236 1 807 . 2 2 54 54 PRO C C 13 176.821 0.300 . 1 . . . . 109 PRO C . 10236 1 808 . 2 2 54 54 PRO CA C 13 63.050 0.300 . 1 . . . . 109 PRO CA . 10236 1 809 . 2 2 54 54 PRO CB C 13 32.519 0.300 . 1 . . . . 109 PRO CB . 10236 1 810 . 2 2 54 54 PRO CD C 13 51.372 0.300 . 1 . . . . 109 PRO CD . 10236 1 811 . 2 2 54 54 PRO CG C 13 27.512 0.300 . 1 . . . . 109 PRO CG . 10236 1 812 . 2 2 55 55 SER H H 1 8.741 0.030 . 1 . . . . 110 SER H . 10236 1 813 . 2 2 55 55 SER HA H 1 5.025 0.030 . 1 . . . . 110 SER HA . 10236 1 814 . 2 2 55 55 SER HB2 H 1 3.884 0.030 . 1 . . . . 110 SER HB2 . 10236 1 815 . 2 2 55 55 SER HB3 H 1 3.884 0.030 . 1 . . . . 110 SER HB3 . 10236 1 816 . 2 2 55 55 SER C C 13 174.544 0.300 . 1 . . . . 110 SER C . 10236 1 817 . 2 2 55 55 SER CA C 13 59.126 0.300 . 1 . . . . 110 SER CA . 10236 1 818 . 2 2 55 55 SER CB C 13 63.339 0.300 . 1 . . . . 110 SER CB . 10236 1 819 . 2 2 55 55 SER N N 15 117.469 0.300 . 1 . . . . 110 SER N . 10236 1 820 . 2 2 56 56 VAL H H 1 9.419 0.030 . 1 . . . . 111 VAL H . 10236 1 821 . 2 2 56 56 VAL HA H 1 5.021 0.030 . 1 . . . . 111 VAL HA . 10236 1 822 . 2 2 56 56 VAL HB H 1 2.145 0.030 . 1 . . . . 111 VAL HB . 10236 1 823 . 2 2 56 56 VAL HG11 H 1 0.869 0.030 . 1 . . . . 111 VAL HG1 . 10236 1 824 . 2 2 56 56 VAL HG12 H 1 0.869 0.030 . 1 . . . . 111 VAL HG1 . 10236 1 825 . 2 2 56 56 VAL HG13 H 1 0.869 0.030 . 1 . . . . 111 VAL HG1 . 10236 1 826 . 2 2 56 56 VAL HG21 H 1 0.745 0.030 . 1 . . . . 111 VAL HG2 . 10236 1 827 . 2 2 56 56 VAL HG22 H 1 0.745 0.030 . 1 . . . . 111 VAL HG2 . 10236 1 828 . 2 2 56 56 VAL HG23 H 1 0.745 0.030 . 1 . . . . 111 VAL HG2 . 10236 1 829 . 2 2 56 56 VAL C C 13 173.550 0.300 . 1 . . . . 111 VAL C . 10236 1 830 . 2 2 56 56 VAL CA C 13 58.734 0.300 . 1 . . . . 111 VAL CA . 10236 1 831 . 2 2 56 56 VAL CB C 13 35.857 0.300 . 1 . . . . 111 VAL CB . 10236 1 832 . 2 2 56 56 VAL CG1 C 13 22.321 0.300 . 2 . . . . 111 VAL CG1 . 10236 1 833 . 2 2 56 56 VAL CG2 C 13 20.595 0.300 . 2 . . . . 111 VAL CG2 . 10236 1 834 . 2 2 56 56 VAL N N 15 118.720 0.300 . 1 . . . . 111 VAL N . 10236 1 835 . 2 2 57 57 ASN H H 1 9.085 0.030 . 1 . . . . 112 ASN H . 10236 1 836 . 2 2 57 57 ASN HA H 1 5.607 0.030 . 1 . . . . 112 ASN HA . 10236 1 837 . 2 2 57 57 ASN HB2 H 1 2.514 0.030 . 2 . . . . 112 ASN HB2 . 10236 1 838 . 2 2 57 57 ASN HB3 H 1 2.393 0.030 . 2 . . . . 112 ASN HB3 . 10236 1 839 . 2 2 57 57 ASN HD21 H 1 7.357 0.030 . 2 . . . . 112 ASN HD21 . 10236 1 840 . 2 2 57 57 ASN HD22 H 1 6.987 0.030 . 2 . . . . 112 ASN HD22 . 10236 1 841 . 2 2 57 57 ASN C C 13 174.253 0.300 . 1 . . . . 112 ASN C . 10236 1 842 . 2 2 57 57 ASN CA C 13 52.080 0.300 . 1 . . . . 112 ASN CA . 10236 1 843 . 2 2 57 57 ASN CB C 13 41.146 0.300 . 1 . . . . 112 ASN CB . 10236 1 844 . 2 2 57 57 ASN N N 15 117.546 0.300 . 1 . . . . 112 ASN N . 10236 1 845 . 2 2 57 57 ASN ND2 N 15 112.806 0.300 . 1 . . . . 112 ASN ND2 . 10236 1 846 . 2 2 58 58 MET H H 1 9.601 0.030 . 1 . . . . 113 MET H . 10236 1 847 . 2 2 58 58 MET HA H 1 4.940 0.030 . 1 . . . . 113 MET HA . 10236 1 848 . 2 2 58 58 MET HB2 H 1 2.026 0.030 . 2 . . . . 113 MET HB2 . 10236 1 849 . 2 2 58 58 MET HB3 H 1 1.581 0.030 . 2 . . . . 113 MET HB3 . 10236 1 850 . 2 2 58 58 MET HE1 H 1 0.958 0.030 . 1 . . . . 113 MET HE . 10236 1 851 . 2 2 58 58 MET HE2 H 1 0.958 0.030 . 1 . . . . 113 MET HE . 10236 1 852 . 2 2 58 58 MET HE3 H 1 0.958 0.030 . 1 . . . . 113 MET HE . 10236 1 853 . 2 2 58 58 MET HG2 H 1 1.897 0.030 . 1 . . . . 113 MET HG2 . 10236 1 854 . 2 2 58 58 MET HG3 H 1 1.897 0.030 . 1 . . . . 113 MET HG3 . 10236 1 855 . 2 2 58 58 MET C C 13 173.696 0.300 . 1 . . . . 113 MET C . 10236 1 856 . 2 2 58 58 MET CA C 13 54.381 0.300 . 1 . . . . 113 MET CA . 10236 1 857 . 2 2 58 58 MET CB C 13 35.895 0.300 . 1 . . . . 113 MET CB . 10236 1 858 . 2 2 58 58 MET CE C 13 15.121 0.300 . 1 . . . . 113 MET CE . 10236 1 859 . 2 2 58 58 MET CG C 13 31.610 0.300 . 1 . . . . 113 MET CG . 10236 1 860 . 2 2 58 58 MET N N 15 124.796 0.300 . 1 . . . . 113 MET N . 10236 1 861 . 2 2 59 59 ASN H H 1 9.463 0.030 . 1 . . . . 114 ASN H . 10236 1 862 . 2 2 59 59 ASN HA H 1 5.414 0.030 . 1 . . . . 114 ASN HA . 10236 1 863 . 2 2 59 59 ASN HB2 H 1 2.765 0.030 . 2 . . . . 114 ASN HB2 . 10236 1 864 . 2 2 59 59 ASN HB3 H 1 2.422 0.030 . 2 . . . . 114 ASN HB3 . 10236 1 865 . 2 2 59 59 ASN HD21 H 1 6.852 0.030 . 2 . . . . 114 ASN HD21 . 10236 1 866 . 2 2 59 59 ASN HD22 H 1 6.609 0.030 . 2 . . . . 114 ASN HD22 . 10236 1 867 . 2 2 59 59 ASN C C 13 174.640 0.300 . 1 . . . . 114 ASN C . 10236 1 868 . 2 2 59 59 ASN CA C 13 51.833 0.300 . 1 . . . . 114 ASN CA . 10236 1 869 . 2 2 59 59 ASN CB C 13 40.468 0.300 . 1 . . . . 114 ASN CB . 10236 1 870 . 2 2 59 59 ASN N N 15 127.206 0.300 . 1 . . . . 114 ASN N . 10236 1 871 . 2 2 59 59 ASN ND2 N 15 109.280 0.300 . 1 . . . . 114 ASN ND2 . 10236 1 872 . 2 2 60 60 VAL H H 1 9.231 0.030 . 1 . . . . 115 VAL H . 10236 1 873 . 2 2 60 60 VAL HA H 1 4.515 0.030 . 1 . . . . 115 VAL HA . 10236 1 874 . 2 2 60 60 VAL HB H 1 2.132 0.030 . 1 . . . . 115 VAL HB . 10236 1 875 . 2 2 60 60 VAL HG11 H 1 0.733 0.030 . 1 . . . . 115 VAL HG1 . 10236 1 876 . 2 2 60 60 VAL HG12 H 1 0.733 0.030 . 1 . . . . 115 VAL HG1 . 10236 1 877 . 2 2 60 60 VAL HG13 H 1 0.733 0.030 . 1 . . . . 115 VAL HG1 . 10236 1 878 . 2 2 60 60 VAL HG21 H 1 0.782 0.030 . 1 . . . . 115 VAL HG2 . 10236 1 879 . 2 2 60 60 VAL HG22 H 1 0.782 0.030 . 1 . . . . 115 VAL HG2 . 10236 1 880 . 2 2 60 60 VAL HG23 H 1 0.782 0.030 . 1 . . . . 115 VAL HG2 . 10236 1 881 . 2 2 60 60 VAL C C 13 174.374 0.300 . 1 . . . . 115 VAL C . 10236 1 882 . 2 2 60 60 VAL CA C 13 62.092 0.300 . 1 . . . . 115 VAL CA . 10236 1 883 . 2 2 60 60 VAL CB C 13 32.645 0.300 . 1 . . . . 115 VAL CB . 10236 1 884 . 2 2 60 60 VAL CG1 C 13 21.572 0.300 . 2 . . . . 115 VAL CG1 . 10236 1 885 . 2 2 60 60 VAL CG2 C 13 20.820 0.300 . 2 . . . . 115 VAL CG2 . 10236 1 886 . 2 2 60 60 VAL N N 15 125.429 0.300 . 1 . . . . 115 VAL N . 10236 1 887 . 2 2 61 61 ALA H H 1 8.440 0.030 . 1 . . . . 116 ALA H . 10236 1 888 . 2 2 61 61 ALA HA H 1 4.706 0.030 . 1 . . . . 116 ALA HA . 10236 1 889 . 2 2 61 61 ALA HB1 H 1 1.439 0.030 . 1 . . . . 116 ALA HB . 10236 1 890 . 2 2 61 61 ALA HB2 H 1 1.439 0.030 . 1 . . . . 116 ALA HB . 10236 1 891 . 2 2 61 61 ALA HB3 H 1 1.439 0.030 . 1 . . . . 116 ALA HB . 10236 1 892 . 2 2 61 61 ALA C C 13 175.876 0.300 . 1 . . . . 116 ALA C . 10236 1 893 . 2 2 61 61 ALA CA C 13 51.175 0.300 . 1 . . . . 116 ALA CA . 10236 1 894 . 2 2 61 61 ALA CB C 13 22.061 0.300 . 1 . . . . 116 ALA CB . 10236 1 895 . 2 2 61 61 ALA N N 15 129.729 0.300 . 1 . . . . 116 ALA N . 10236 1 896 . 2 2 62 62 ASP H H 1 8.937 0.030 . 1 . . . . 117 ASP H . 10236 1 897 . 2 2 62 62 ASP HA H 1 4.299 0.030 . 1 . . . . 117 ASP HA . 10236 1 898 . 2 2 62 62 ASP HB2 H 1 2.567 0.030 . 2 . . . . 117 ASP HB2 . 10236 1 899 . 2 2 62 62 ASP HB3 H 1 2.800 0.030 . 2 . . . . 117 ASP HB3 . 10236 1 900 . 2 2 62 62 ASP C C 13 176.821 0.300 . 1 . . . . 117 ASP C . 10236 1 901 . 2 2 62 62 ASP CA C 13 56.108 0.300 . 1 . . . . 117 ASP CA . 10236 1 902 . 2 2 62 62 ASP CB C 13 39.831 0.300 . 1 . . . . 117 ASP CB . 10236 1 903 . 2 2 62 62 ASP N N 15 119.246 0.300 . 1 . . . . 117 ASP N . 10236 1 904 . 2 2 63 63 ALA H H 1 8.842 0.030 . 1 . . . . 118 ALA H . 10236 1 905 . 2 2 63 63 ALA HA H 1 4.148 0.030 . 1 . . . . 118 ALA HA . 10236 1 906 . 2 2 63 63 ALA HB1 H 1 1.501 0.030 . 1 . . . . 118 ALA HB . 10236 1 907 . 2 2 63 63 ALA HB2 H 1 1.501 0.030 . 1 . . . . 118 ALA HB . 10236 1 908 . 2 2 63 63 ALA HB3 H 1 1.501 0.030 . 1 . . . . 118 ALA HB . 10236 1 909 . 2 2 63 63 ALA C C 13 177.571 0.300 . 1 . . . . 118 ALA C . 10236 1 910 . 2 2 63 63 ALA CA C 13 52.773 0.300 . 1 . . . . 118 ALA CA . 10236 1 911 . 2 2 63 63 ALA CB C 13 18.902 0.300 . 1 . . . . 118 ALA CB . 10236 1 912 . 2 2 63 63 ALA N N 15 117.584 0.300 . 1 . . . . 118 ALA N . 10236 1 913 . 2 2 64 64 THR H H 1 7.656 0.030 . 1 . . . . 119 THR H . 10236 1 914 . 2 2 64 64 THR HA H 1 4.954 0.030 . 1 . . . . 119 THR HA . 10236 1 915 . 2 2 64 64 THR HB H 1 4.012 0.030 . 1 . . . . 119 THR HB . 10236 1 916 . 2 2 64 64 THR HG21 H 1 1.040 0.030 . 1 . . . . 119 THR HG2 . 10236 1 917 . 2 2 64 64 THR HG22 H 1 1.040 0.030 . 1 . . . . 119 THR HG2 . 10236 1 918 . 2 2 64 64 THR HG23 H 1 1.040 0.030 . 1 . . . . 119 THR HG2 . 10236 1 919 . 2 2 64 64 THR C C 13 171.903 0.300 . 1 . . . . 119 THR C . 10236 1 920 . 2 2 64 64 THR CA C 13 61.862 0.300 . 1 . . . . 119 THR CA . 10236 1 921 . 2 2 64 64 THR CB C 13 72.577 0.300 . 1 . . . . 119 THR CB . 10236 1 922 . 2 2 64 64 THR CG2 C 13 21.692 0.300 . 1 . . . . 119 THR CG2 . 10236 1 923 . 2 2 64 64 THR N N 15 114.028 0.300 . 1 . . . . 119 THR N . 10236 1 924 . 2 2 65 65 VAL H H 1 8.780 0.030 . 1 . . . . 120 VAL H . 10236 1 925 . 2 2 65 65 VAL HA H 1 4.678 0.030 . 1 . . . . 120 VAL HA . 10236 1 926 . 2 2 65 65 VAL HB H 1 1.691 0.030 . 1 . . . . 120 VAL HB . 10236 1 927 . 2 2 65 65 VAL HG11 H 1 0.614 0.030 . 1 . . . . 120 VAL HG1 . 10236 1 928 . 2 2 65 65 VAL HG12 H 1 0.614 0.030 . 1 . . . . 120 VAL HG1 . 10236 1 929 . 2 2 65 65 VAL HG13 H 1 0.614 0.030 . 1 . . . . 120 VAL HG1 . 10236 1 930 . 2 2 65 65 VAL HG21 H 1 0.614 0.030 . 1 . . . . 120 VAL HG2 . 10236 1 931 . 2 2 65 65 VAL HG22 H 1 0.614 0.030 . 1 . . . . 120 VAL HG2 . 10236 1 932 . 2 2 65 65 VAL HG23 H 1 0.614 0.030 . 1 . . . . 120 VAL HG2 . 10236 1 933 . 2 2 65 65 VAL C C 13 174.592 0.300 . 1 . . . . 120 VAL C . 10236 1 934 . 2 2 65 65 VAL CA C 13 61.411 0.300 . 1 . . . . 120 VAL CA . 10236 1 935 . 2 2 65 65 VAL CB C 13 33.635 0.300 . 1 . . . . 120 VAL CB . 10236 1 936 . 2 2 65 65 VAL CG1 C 13 20.759 0.300 . 2 . . . . 120 VAL CG1 . 10236 1 937 . 2 2 65 65 VAL CG2 C 13 20.759 0.300 . 2 . . . . 120 VAL CG2 . 10236 1 938 . 2 2 65 65 VAL N N 15 126.126 0.300 . 1 . . . . 120 VAL N . 10236 1 939 . 2 2 66 66 THR H H 1 8.969 0.030 . 1 . . . . 121 THR H . 10236 1 940 . 2 2 66 66 THR HA H 1 5.076 0.030 . 1 . . . . 121 THR HA . 10236 1 941 . 2 2 66 66 THR HB H 1 3.928 0.030 . 1 . . . . 121 THR HB . 10236 1 942 . 2 2 66 66 THR HG21 H 1 1.267 0.030 . 1 . . . . 121 THR HG2 . 10236 1 943 . 2 2 66 66 THR HG22 H 1 1.267 0.030 . 1 . . . . 121 THR HG2 . 10236 1 944 . 2 2 66 66 THR HG23 H 1 1.267 0.030 . 1 . . . . 121 THR HG2 . 10236 1 945 . 2 2 66 66 THR C C 13 173.357 0.300 . 1 . . . . 121 THR C . 10236 1 946 . 2 2 66 66 THR CA C 13 61.140 0.300 . 1 . . . . 121 THR CA . 10236 1 947 . 2 2 66 66 THR CB C 13 70.729 0.300 . 1 . . . . 121 THR CB . 10236 1 948 . 2 2 66 66 THR CG2 C 13 22.704 0.300 . 1 . . . . 121 THR CG2 . 10236 1 949 . 2 2 66 66 THR N N 15 122.255 0.300 . 1 . . . . 121 THR N . 10236 1 950 . 2 2 67 67 VAL H H 1 9.151 0.030 . 1 . . . . 122 VAL H . 10236 1 951 . 2 2 67 67 VAL HA H 1 4.816 0.030 . 1 . . . . 122 VAL HA . 10236 1 952 . 2 2 67 67 VAL HB H 1 1.912 0.030 . 1 . . . . 122 VAL HB . 10236 1 953 . 2 2 67 67 VAL HG11 H 1 0.658 0.030 . 1 . . . . 122 VAL HG1 . 10236 1 954 . 2 2 67 67 VAL HG12 H 1 0.658 0.030 . 1 . . . . 122 VAL HG1 . 10236 1 955 . 2 2 67 67 VAL HG13 H 1 0.658 0.030 . 1 . . . . 122 VAL HG1 . 10236 1 956 . 2 2 67 67 VAL HG21 H 1 0.771 0.030 . 1 . . . . 122 VAL HG2 . 10236 1 957 . 2 2 67 67 VAL HG22 H 1 0.771 0.030 . 1 . . . . 122 VAL HG2 . 10236 1 958 . 2 2 67 67 VAL HG23 H 1 0.771 0.030 . 1 . . . . 122 VAL HG2 . 10236 1 959 . 2 2 67 67 VAL C C 13 174.374 0.300 . 1 . . . . 122 VAL C . 10236 1 960 . 2 2 67 67 VAL CA C 13 61.286 0.300 . 1 . . . . 122 VAL CA . 10236 1 961 . 2 2 67 67 VAL CB C 13 32.597 0.300 . 1 . . . . 122 VAL CB . 10236 1 962 . 2 2 67 67 VAL CG1 C 13 21.854 0.300 . 2 . . . . 122 VAL CG1 . 10236 1 963 . 2 2 67 67 VAL CG2 C 13 21.664 0.300 . 2 . . . . 122 VAL CG2 . 10236 1 964 . 2 2 67 67 VAL N N 15 126.629 0.300 . 1 . . . . 122 VAL N . 10236 1 965 . 2 2 68 68 ILE H H 1 9.105 0.030 . 1 . . . . 123 ILE H . 10236 1 966 . 2 2 68 68 ILE HA H 1 4.866 0.030 . 1 . . . . 123 ILE HA . 10236 1 967 . 2 2 68 68 ILE HB H 1 1.746 0.030 . 1 . . . . 123 ILE HB . 10236 1 968 . 2 2 68 68 ILE HD11 H 1 0.831 0.030 . 1 . . . . 123 ILE HD1 . 10236 1 969 . 2 2 68 68 ILE HD12 H 1 0.831 0.030 . 1 . . . . 123 ILE HD1 . 10236 1 970 . 2 2 68 68 ILE HD13 H 1 0.831 0.030 . 1 . . . . 123 ILE HD1 . 10236 1 971 . 2 2 68 68 ILE HG12 H 1 1.461 0.030 . 2 . . . . 123 ILE HG12 . 10236 1 972 . 2 2 68 68 ILE HG13 H 1 1.038 0.030 . 2 . . . . 123 ILE HG13 . 10236 1 973 . 2 2 68 68 ILE HG21 H 1 1.017 0.030 . 1 . . . . 123 ILE HG2 . 10236 1 974 . 2 2 68 68 ILE HG22 H 1 1.017 0.030 . 1 . . . . 123 ILE HG2 . 10236 1 975 . 2 2 68 68 ILE HG23 H 1 1.017 0.030 . 1 . . . . 123 ILE HG2 . 10236 1 976 . 2 2 68 68 ILE C C 13 175.391 0.300 . 1 . . . . 123 ILE C . 10236 1 977 . 2 2 68 68 ILE CA C 13 59.807 0.300 . 1 . . . . 123 ILE CA . 10236 1 978 . 2 2 68 68 ILE CB C 13 41.574 0.300 . 1 . . . . 123 ILE CB . 10236 1 979 . 2 2 68 68 ILE CD1 C 13 13.462 0.300 . 1 . . . . 123 ILE CD1 . 10236 1 980 . 2 2 68 68 ILE CG1 C 13 28.340 0.300 . 1 . . . . 123 ILE CG1 . 10236 1 981 . 2 2 68 68 ILE CG2 C 13 18.292 0.300 . 1 . . . . 123 ILE CG2 . 10236 1 982 . 2 2 68 68 ILE N N 15 128.076 0.300 . 1 . . . . 123 ILE N . 10236 1 983 . 2 2 69 69 SER H H 1 8.451 0.030 . 1 . . . . 124 SER H . 10236 1 984 . 2 2 69 69 SER HA H 1 4.368 0.030 . 1 . . . . 124 SER HA . 10236 1 985 . 2 2 69 69 SER HB2 H 1 4.335 0.030 . 2 . . . . 124 SER HB2 . 10236 1 986 . 2 2 69 69 SER HB3 H 1 4.158 0.030 . 2 . . . . 124 SER HB3 . 10236 1 987 . 2 2 69 69 SER C C 13 174.955 0.300 . 1 . . . . 124 SER C . 10236 1 988 . 2 2 69 69 SER CA C 13 58.903 0.300 . 1 . . . . 124 SER CA . 10236 1 989 . 2 2 69 69 SER CB C 13 63.907 0.300 . 1 . . . . 124 SER CB . 10236 1 990 . 2 2 69 69 SER N N 15 120.215 0.300 . 1 . . . . 124 SER N . 10236 1 991 . 2 2 70 70 GLU H H 1 8.341 0.030 . 1 . . . . 125 GLU H . 10236 1 992 . 2 2 70 70 GLU HA H 1 4.191 0.030 . 1 . . . . 125 GLU HA . 10236 1 993 . 2 2 70 70 GLU HB2 H 1 1.966 0.030 . 2 . . . . 125 GLU HB2 . 10236 1 994 . 2 2 70 70 GLU HB3 H 1 1.851 0.030 . 2 . . . . 125 GLU HB3 . 10236 1 995 . 2 2 70 70 GLU HG2 H 1 2.201 0.030 . 1 . . . . 125 GLU HG2 . 10236 1 996 . 2 2 70 70 GLU HG3 H 1 2.201 0.030 . 1 . . . . 125 GLU HG3 . 10236 1 997 . 2 2 70 70 GLU C C 13 177.135 0.300 . 1 . . . . 125 GLU C . 10236 1 998 . 2 2 70 70 GLU CA C 13 58.343 0.300 . 1 . . . . 125 GLU CA . 10236 1 999 . 2 2 70 70 GLU CB C 13 29.994 0.300 . 1 . . . . 125 GLU CB . 10236 1 1000 . 2 2 70 70 GLU CG C 13 36.543 0.300 . 1 . . . . 125 GLU CG . 10236 1 1001 . 2 2 70 70 GLU N N 15 124.471 0.300 . 1 . . . . 125 GLU N . 10236 1 1002 . 2 2 71 71 LYS H H 1 8.108 0.030 . 1 . . . . 126 LYS H . 10236 1 1003 . 2 2 71 71 LYS HA H 1 4.266 0.030 . 1 . . . . 126 LYS HA . 10236 1 1004 . 2 2 71 71 LYS HB2 H 1 1.876 0.030 . 2 . . . . 126 LYS HB2 . 10236 1 1005 . 2 2 71 71 LYS HB3 H 1 1.782 0.030 . 2 . . . . 126 LYS HB3 . 10236 1 1006 . 2 2 71 71 LYS HD2 H 1 1.720 0.030 . 1 . . . . 126 LYS HD2 . 10236 1 1007 . 2 2 71 71 LYS HD3 H 1 1.720 0.030 . 1 . . . . 126 LYS HD3 . 10236 1 1008 . 2 2 71 71 LYS HE2 H 1 3.040 0.030 . 1 . . . . 126 LYS HE2 . 10236 1 1009 . 2 2 71 71 LYS HE3 H 1 3.040 0.030 . 1 . . . . 126 LYS HE3 . 10236 1 1010 . 2 2 71 71 LYS HG2 H 1 1.514 0.030 . 2 . . . . 126 LYS HG2 . 10236 1 1011 . 2 2 71 71 LYS HG3 H 1 1.448 0.030 . 2 . . . . 126 LYS HG3 . 10236 1 1012 . 2 2 71 71 LYS C C 13 176.384 0.300 . 1 . . . . 126 LYS C . 10236 1 1013 . 2 2 71 71 LYS CA C 13 56.765 0.300 . 1 . . . . 126 LYS CA . 10236 1 1014 . 2 2 71 71 LYS CB C 13 33.255 0.300 . 1 . . . . 126 LYS CB . 10236 1 1015 . 2 2 71 71 LYS CD C 13 29.062 0.300 . 1 . . . . 126 LYS CD . 10236 1 1016 . 2 2 71 71 LYS CE C 13 42.114 0.300 . 1 . . . . 126 LYS CE . 10236 1 1017 . 2 2 71 71 LYS CG C 13 25.116 0.300 . 1 . . . . 126 LYS CG . 10236 1 1018 . 2 2 71 71 LYS N N 15 117.217 0.300 . 1 . . . . 126 LYS N . 10236 1 1019 . 2 2 72 72 ASN H H 1 7.474 0.030 . 1 . . . . 127 ASN H . 10236 1 1020 . 2 2 72 72 ASN HA H 1 4.715 0.030 . 1 . . . . 127 ASN HA . 10236 1 1021 . 2 2 72 72 ASN HB2 H 1 2.892 0.030 . 2 . . . . 127 ASN HB2 . 10236 1 1022 . 2 2 72 72 ASN HB3 H 1 2.768 0.030 . 2 . . . . 127 ASN HB3 . 10236 1 1023 . 2 2 72 72 ASN HD21 H 1 7.718 0.030 . 2 . . . . 127 ASN HD21 . 10236 1 1024 . 2 2 72 72 ASN HD22 H 1 7.016 0.030 . 2 . . . . 127 ASN HD22 . 10236 1 1025 . 2 2 72 72 ASN C C 13 174.616 0.300 . 1 . . . . 127 ASN C . 10236 1 1026 . 2 2 72 72 ASN CA C 13 52.984 0.300 . 1 . . . . 127 ASN CA . 10236 1 1027 . 2 2 72 72 ASN CB C 13 38.804 0.300 . 1 . . . . 127 ASN CB . 10236 1 1028 . 2 2 72 72 ASN N N 15 116.255 0.300 . 1 . . . . 127 ASN N . 10236 1 1029 . 2 2 72 72 ASN ND2 N 15 112.490 0.300 . 1 . . . . 127 ASN ND2 . 10236 1 1030 . 2 2 73 73 GLU H H 1 8.671 0.030 . 1 . . . . 128 GLU H . 10236 1 1031 . 2 2 73 73 GLU HA H 1 4.155 0.030 . 1 . . . . 128 GLU HA . 10236 1 1032 . 2 2 73 73 GLU HB2 H 1 2.072 0.030 . 2 . . . . 128 GLU HB2 . 10236 1 1033 . 2 2 73 73 GLU HB3 H 1 1.999 0.030 . 2 . . . . 128 GLU HB3 . 10236 1 1034 . 2 2 73 73 GLU HG2 H 1 2.271 0.030 . 1 . . . . 128 GLU HG2 . 10236 1 1035 . 2 2 73 73 GLU HG3 H 1 2.271 0.030 . 1 . . . . 128 GLU HG3 . 10236 1 1036 . 2 2 73 73 GLU C C 13 175.682 0.300 . 1 . . . . 128 GLU C . 10236 1 1037 . 2 2 73 73 GLU CA C 13 57.974 0.300 . 1 . . . . 128 GLU CA . 10236 1 1038 . 2 2 73 73 GLU CB C 13 29.242 0.300 . 1 . . . . 128 GLU CB . 10236 1 1039 . 2 2 73 73 GLU CG C 13 36.509 0.300 . 1 . . . . 128 GLU CG . 10236 1 1040 . 2 2 73 73 GLU N N 15 121.359 0.300 . 1 . . . . 128 GLU N . 10236 1 1041 . 2 2 74 74 GLU H H 1 8.038 0.030 . 1 . . . . 129 GLU H . 10236 1 1042 . 2 2 74 74 GLU HA H 1 4.191 0.030 . 1 . . . . 129 GLU HA . 10236 1 1043 . 2 2 74 74 GLU HB2 H 1 2.125 0.030 . 2 . . . . 129 GLU HB2 . 10236 1 1044 . 2 2 74 74 GLU HB3 H 1 1.951 0.030 . 2 . . . . 129 GLU HB3 . 10236 1 1045 . 2 2 74 74 GLU HG2 H 1 2.271 0.030 . 2 . . . . 129 GLU HG2 . 10236 1 1046 . 2 2 74 74 GLU HG3 H 1 2.178 0.030 . 2 . . . . 129 GLU HG3 . 10236 1 1047 . 2 2 74 74 GLU C C 13 176.239 0.300 . 1 . . . . 129 GLU C . 10236 1 1048 . 2 2 74 74 GLU CA C 13 56.478 0.300 . 1 . . . . 129 GLU CA . 10236 1 1049 . 2 2 74 74 GLU CB C 13 29.484 0.300 . 1 . . . . 129 GLU CB . 10236 1 1050 . 2 2 74 74 GLU CG C 13 36.715 0.300 . 1 . . . . 129 GLU CG . 10236 1 1051 . 2 2 74 74 GLU N N 15 115.559 0.300 . 1 . . . . 129 GLU N . 10236 1 1052 . 2 2 75 75 GLU H H 1 7.968 0.030 . 1 . . . . 130 GLU H . 10236 1 1053 . 2 2 75 75 GLU HA H 1 4.319 0.030 . 1 . . . . 130 GLU HA . 10236 1 1054 . 2 2 75 75 GLU HB2 H 1 2.244 0.030 . 2 . . . . 130 GLU HB2 . 10236 1 1055 . 2 2 75 75 GLU HB3 H 1 1.898 0.030 . 2 . . . . 130 GLU HB3 . 10236 1 1056 . 2 2 75 75 GLU HG2 H 1 2.066 0.030 . 2 . . . . 130 GLU HG2 . 10236 1 1057 . 2 2 75 75 GLU HG3 H 1 2.146 0.030 . 2 . . . . 130 GLU HG3 . 10236 1 1058 . 2 2 75 75 GLU C C 13 173.914 0.300 . 1 . . . . 130 GLU C . 10236 1 1059 . 2 2 75 75 GLU CA C 13 55.861 0.300 . 1 . . . . 130 GLU CA . 10236 1 1060 . 2 2 75 75 GLU CB C 13 30.202 0.300 . 1 . . . . 130 GLU CB . 10236 1 1061 . 2 2 75 75 GLU CG C 13 36.378 0.300 . 1 . . . . 130 GLU CG . 10236 1 1062 . 2 2 75 75 GLU N N 15 122.554 0.300 . 1 . . . . 130 GLU N . 10236 1 1063 . 2 2 76 76 VAL H H 1 8.304 0.030 . 1 . . . . 131 VAL H . 10236 1 1064 . 2 2 76 76 VAL HA H 1 4.047 0.030 . 1 . . . . 131 VAL HA . 10236 1 1065 . 2 2 76 76 VAL HB H 1 1.998 0.030 . 1 . . . . 131 VAL HB . 10236 1 1066 . 2 2 76 76 VAL HG11 H 1 0.894 0.030 . 1 . . . . 131 VAL HG1 . 10236 1 1067 . 2 2 76 76 VAL HG12 H 1 0.894 0.030 . 1 . . . . 131 VAL HG1 . 10236 1 1068 . 2 2 76 76 VAL HG13 H 1 0.894 0.030 . 1 . . . . 131 VAL HG1 . 10236 1 1069 . 2 2 76 76 VAL HG21 H 1 0.779 0.030 . 1 . . . . 131 VAL HG2 . 10236 1 1070 . 2 2 76 76 VAL HG22 H 1 0.779 0.030 . 1 . . . . 131 VAL HG2 . 10236 1 1071 . 2 2 76 76 VAL HG23 H 1 0.779 0.030 . 1 . . . . 131 VAL HG2 . 10236 1 1072 . 2 2 76 76 VAL C C 13 176.602 0.300 . 1 . . . . 131 VAL C . 10236 1 1073 . 2 2 76 76 VAL CA C 13 62.766 0.300 . 1 . . . . 131 VAL CA . 10236 1 1074 . 2 2 76 76 VAL CB C 13 31.782 0.300 . 1 . . . . 131 VAL CB . 10236 1 1075 . 2 2 76 76 VAL CG1 C 13 21.046 0.300 . 2 . . . . 131 VAL CG1 . 10236 1 1076 . 2 2 76 76 VAL CG2 C 13 21.605 0.300 . 2 . . . . 131 VAL CG2 . 10236 1 1077 . 2 2 76 76 VAL N N 15 127.106 0.300 . 1 . . . . 131 VAL N . 10236 1 1078 . 2 2 77 77 LEU H H 1 9.059 0.030 . 1 . . . . 132 LEU H . 10236 1 1079 . 2 2 77 77 LEU HA H 1 4.358 0.030 . 1 . . . . 132 LEU HA . 10236 1 1080 . 2 2 77 77 LEU HB2 H 1 1.498 0.030 . 2 . . . . 132 LEU HB2 . 10236 1 1081 . 2 2 77 77 LEU HB3 H 1 1.318 0.030 . 2 . . . . 132 LEU HB3 . 10236 1 1082 . 2 2 77 77 LEU HD11 H 1 0.895 0.030 . 1 . . . . 132 LEU HD1 . 10236 1 1083 . 2 2 77 77 LEU HD12 H 1 0.895 0.030 . 1 . . . . 132 LEU HD1 . 10236 1 1084 . 2 2 77 77 LEU HD13 H 1 0.895 0.030 . 1 . . . . 132 LEU HD1 . 10236 1 1085 . 2 2 77 77 LEU HD21 H 1 0.878 0.030 . 1 . . . . 132 LEU HD2 . 10236 1 1086 . 2 2 77 77 LEU HD22 H 1 0.878 0.030 . 1 . . . . 132 LEU HD2 . 10236 1 1087 . 2 2 77 77 LEU HD23 H 1 0.878 0.030 . 1 . . . . 132 LEU HD2 . 10236 1 1088 . 2 2 77 77 LEU HG H 1 1.688 0.030 . 1 . . . . 132 LEU HG . 10236 1 1089 . 2 2 77 77 LEU C C 13 177.523 0.300 . 1 . . . . 132 LEU C . 10236 1 1090 . 2 2 77 77 LEU CA C 13 56.625 0.300 . 1 . . . . 132 LEU CA . 10236 1 1091 . 2 2 77 77 LEU CB C 13 42.856 0.300 . 1 . . . . 132 LEU CB . 10236 1 1092 . 2 2 77 77 LEU CD1 C 13 25.856 0.300 . 2 . . . . 132 LEU CD1 . 10236 1 1093 . 2 2 77 77 LEU CD2 C 13 23.089 0.300 . 2 . . . . 132 LEU CD2 . 10236 1 1094 . 2 2 77 77 LEU CG C 13 27.893 0.300 . 1 . . . . 132 LEU CG . 10236 1 1095 . 2 2 77 77 LEU N N 15 129.817 0.300 . 1 . . . . 132 LEU N . 10236 1 1096 . 2 2 78 78 VAL H H 1 7.364 0.030 . 1 . . . . 133 VAL H . 10236 1 1097 . 2 2 78 78 VAL HA H 1 4.198 0.030 . 1 . . . . 133 VAL HA . 10236 1 1098 . 2 2 78 78 VAL HB H 1 1.727 0.030 . 1 . . . . 133 VAL HB . 10236 1 1099 . 2 2 78 78 VAL HG11 H 1 0.519 0.030 . 1 . . . . 133 VAL HG1 . 10236 1 1100 . 2 2 78 78 VAL HG12 H 1 0.519 0.030 . 1 . . . . 133 VAL HG1 . 10236 1 1101 . 2 2 78 78 VAL HG13 H 1 0.519 0.030 . 1 . . . . 133 VAL HG1 . 10236 1 1102 . 2 2 78 78 VAL HG21 H 1 0.571 0.030 . 1 . . . . 133 VAL HG2 . 10236 1 1103 . 2 2 78 78 VAL HG22 H 1 0.571 0.030 . 1 . . . . 133 VAL HG2 . 10236 1 1104 . 2 2 78 78 VAL HG23 H 1 0.571 0.030 . 1 . . . . 133 VAL HG2 . 10236 1 1105 . 2 2 78 78 VAL C C 13 172.848 0.300 . 1 . . . . 133 VAL C . 10236 1 1106 . 2 2 78 78 VAL CA C 13 61.225 0.300 . 1 . . . . 133 VAL CA . 10236 1 1107 . 2 2 78 78 VAL CB C 13 35.773 0.300 . 1 . . . . 133 VAL CB . 10236 1 1108 . 2 2 78 78 VAL CG1 C 13 19.729 0.300 . 2 . . . . 133 VAL CG1 . 10236 1 1109 . 2 2 78 78 VAL CG2 C 13 21.319 0.300 . 2 . . . . 133 VAL CG2 . 10236 1 1110 . 2 2 78 78 VAL N N 15 115.069 0.300 . 1 . . . . 133 VAL N . 10236 1 1111 . 2 2 79 79 GLU H H 1 8.730 0.030 . 1 . . . . 134 GLU H . 10236 1 1112 . 2 2 79 79 GLU HA H 1 4.816 0.030 . 1 . . . . 134 GLU HA . 10236 1 1113 . 2 2 79 79 GLU HB2 H 1 1.988 0.030 . 2 . . . . 134 GLU HB2 . 10236 1 1114 . 2 2 79 79 GLU HB3 H 1 1.784 0.030 . 2 . . . . 134 GLU HB3 . 10236 1 1115 . 2 2 79 79 GLU HG2 H 1 1.861 0.030 . 2 . . . . 134 GLU HG2 . 10236 1 1116 . 2 2 79 79 GLU HG3 H 1 2.035 0.030 . 2 . . . . 134 GLU HG3 . 10236 1 1117 . 2 2 79 79 GLU C C 13 173.696 0.300 . 1 . . . . 134 GLU C . 10236 1 1118 . 2 2 79 79 GLU CA C 13 55.450 0.300 . 1 . . . . 134 GLU CA . 10236 1 1119 . 2 2 79 79 GLU CB C 13 32.021 0.300 . 1 . . . . 134 GLU CB . 10236 1 1120 . 2 2 79 79 GLU CG C 13 36.794 0.300 . 1 . . . . 134 GLU CG . 10236 1 1121 . 2 2 79 79 GLU N N 15 127.983 0.300 . 1 . . . . 134 GLU N . 10236 1 1122 . 2 2 80 80 CYS H H 1 9.268 0.030 . 1 . . . . 135 CYS H . 10236 1 1123 . 2 2 80 80 CYS HA H 1 4.952 0.030 . 1 . . . . 135 CYS HA . 10236 1 1124 . 2 2 80 80 CYS HB2 H 1 2.871 0.030 . 2 . . . . 135 CYS HB2 . 10236 1 1125 . 2 2 80 80 CYS HB3 H 1 2.518 0.030 . 2 . . . . 135 CYS HB3 . 10236 1 1126 . 2 2 80 80 CYS C C 13 174.931 0.300 . 1 . . . . 135 CYS C . 10236 1 1127 . 2 2 80 80 CYS CA C 13 57.136 0.300 . 1 . . . . 135 CYS CA . 10236 1 1128 . 2 2 80 80 CYS CB C 13 29.146 0.300 . 1 . . . . 135 CYS CB . 10236 1 1129 . 2 2 80 80 CYS N N 15 127.044 0.300 . 1 . . . . 135 CYS N . 10236 1 1130 . 2 2 81 81 ARG H H 1 9.201 0.030 . 1 . . . . 136 ARG H . 10236 1 1131 . 2 2 81 81 ARG HA H 1 4.729 0.030 . 1 . . . . 136 ARG HA . 10236 1 1132 . 2 2 81 81 ARG HB2 H 1 2.178 0.030 . 2 . . . . 136 ARG HB2 . 10236 1 1133 . 2 2 81 81 ARG HB3 H 1 1.997 0.030 . 2 . . . . 136 ARG HB3 . 10236 1 1134 . 2 2 81 81 ARG HD2 H 1 3.279 0.030 . 1 . . . . 136 ARG HD2 . 10236 1 1135 . 2 2 81 81 ARG HD3 H 1 3.279 0.030 . 1 . . . . 136 ARG HD3 . 10236 1 1136 . 2 2 81 81 ARG HG2 H 1 1.898 0.030 . 1 . . . . 136 ARG HG2 . 10236 1 1137 . 2 2 81 81 ARG HG3 H 1 1.898 0.030 . 1 . . . . 136 ARG HG3 . 10236 1 1138 . 2 2 81 81 ARG C C 13 178.783 0.300 . 1 . . . . 136 ARG C . 10236 1 1139 . 2 2 81 81 ARG CA C 13 56.354 0.300 . 1 . . . . 136 ARG CA . 10236 1 1140 . 2 2 81 81 ARG CB C 13 29.850 0.300 . 1 . . . . 136 ARG CB . 10236 1 1141 . 2 2 81 81 ARG CD C 13 43.390 0.300 . 1 . . . . 136 ARG CD . 10236 1 1142 . 2 2 81 81 ARG CG C 13 27.580 0.300 . 1 . . . . 136 ARG CG . 10236 1 1143 . 2 2 81 81 ARG N N 15 130.439 0.300 . 1 . . . . 136 ARG N . 10236 1 1144 . 2 2 82 82 VAL H H 1 8.486 0.030 . 1 . . . . 137 VAL H . 10236 1 1145 . 2 2 82 82 VAL HA H 1 3.697 0.030 . 1 . . . . 137 VAL HA . 10236 1 1146 . 2 2 82 82 VAL HB H 1 2.314 0.030 . 1 . . . . 137 VAL HB . 10236 1 1147 . 2 2 82 82 VAL HG11 H 1 0.829 0.030 . 1 . . . . 137 VAL HG1 . 10236 1 1148 . 2 2 82 82 VAL HG12 H 1 0.829 0.030 . 1 . . . . 137 VAL HG1 . 10236 1 1149 . 2 2 82 82 VAL HG13 H 1 0.829 0.030 . 1 . . . . 137 VAL HG1 . 10236 1 1150 . 2 2 82 82 VAL HG21 H 1 0.908 0.030 . 1 . . . . 137 VAL HG2 . 10236 1 1151 . 2 2 82 82 VAL HG22 H 1 0.908 0.030 . 1 . . . . 137 VAL HG2 . 10236 1 1152 . 2 2 82 82 VAL HG23 H 1 0.908 0.030 . 1 . . . . 137 VAL HG2 . 10236 1 1153 . 2 2 82 82 VAL C C 13 177.014 0.300 . 1 . . . . 137 VAL C . 10236 1 1154 . 2 2 82 82 VAL CA C 13 66.481 0.300 . 1 . . . . 137 VAL CA . 10236 1 1155 . 2 2 82 82 VAL CB C 13 31.028 0.300 . 1 . . . . 137 VAL CB . 10236 1 1156 . 2 2 82 82 VAL CG1 C 13 21.834 0.300 . 2 . . . . 137 VAL CG1 . 10236 1 1157 . 2 2 82 82 VAL CG2 C 13 20.266 0.300 . 2 . . . . 137 VAL CG2 . 10236 1 1158 . 2 2 82 82 VAL N N 15 122.335 0.300 . 1 . . . . 137 VAL N . 10236 1 1159 . 2 2 83 83 ARG H H 1 8.056 0.030 . 1 . . . . 138 ARG H . 10236 1 1160 . 2 2 83 83 ARG HA H 1 4.094 0.030 . 1 . . . . 138 ARG HA . 10236 1 1161 . 2 2 83 83 ARG HB2 H 1 1.667 0.030 . 2 . . . . 138 ARG HB2 . 10236 1 1162 . 2 2 83 83 ARG HB3 H 1 1.357 0.030 . 2 . . . . 138 ARG HB3 . 10236 1 1163 . 2 2 83 83 ARG HD2 H 1 2.908 0.030 . 2 . . . . 138 ARG HD2 . 10236 1 1164 . 2 2 83 83 ARG HD3 H 1 2.766 0.030 . 2 . . . . 138 ARG HD3 . 10236 1 1165 . 2 2 83 83 ARG HG2 H 1 1.153 0.030 . 2 . . . . 138 ARG HG2 . 10236 1 1166 . 2 2 83 83 ARG HG3 H 1 0.758 0.030 . 2 . . . . 138 ARG HG3 . 10236 1 1167 . 2 2 83 83 ARG C C 13 175.246 0.300 . 1 . . . . 138 ARG C . 10236 1 1168 . 2 2 83 83 ARG CA C 13 57.669 0.300 . 1 . . . . 138 ARG CA . 10236 1 1169 . 2 2 83 83 ARG CB C 13 29.614 0.300 . 1 . . . . 138 ARG CB . 10236 1 1170 . 2 2 83 83 ARG CD C 13 43.087 0.300 . 1 . . . . 138 ARG CD . 10236 1 1171 . 2 2 83 83 ARG CG C 13 26.267 0.300 . 1 . . . . 138 ARG CG . 10236 1 1172 . 2 2 83 83 ARG N N 15 117.722 0.300 . 1 . . . . 138 ARG N . 10236 1 1173 . 2 2 84 84 PHE H H 1 8.224 0.030 . 1 . . . . 139 PHE H . 10236 1 1174 . 2 2 84 84 PHE HA H 1 5.063 0.030 . 1 . . . . 139 PHE HA . 10236 1 1175 . 2 2 84 84 PHE HB2 H 1 4.461 0.030 . 2 . . . . 139 PHE HB2 . 10236 1 1176 . 2 2 84 84 PHE HB3 H 1 2.971 0.030 . 2 . . . . 139 PHE HB3 . 10236 1 1177 . 2 2 84 84 PHE HD1 H 1 7.428 0.030 . 1 . . . . 139 PHE HD1 . 10236 1 1178 . 2 2 84 84 PHE HD2 H 1 7.428 0.030 . 1 . . . . 139 PHE HD2 . 10236 1 1179 . 2 2 84 84 PHE HE1 H 1 7.346 0.030 . 1 . . . . 139 PHE HE1 . 10236 1 1180 . 2 2 84 84 PHE HE2 H 1 7.346 0.030 . 1 . . . . 139 PHE HE2 . 10236 1 1181 . 2 2 84 84 PHE C C 13 172.969 0.300 . 1 . . . . 139 PHE C . 10236 1 1182 . 2 2 84 84 PHE CA C 13 57.702 0.300 . 1 . . . . 139 PHE CA . 10236 1 1183 . 2 2 84 84 PHE CB C 13 39.429 0.300 . 1 . . . . 139 PHE CB . 10236 1 1184 . 2 2 84 84 PHE CD1 C 13 131.581 0.300 . 1 . . . . 139 PHE CD1 . 10236 1 1185 . 2 2 84 84 PHE CD2 C 13 131.581 0.300 . 1 . . . . 139 PHE CD2 . 10236 1 1186 . 2 2 84 84 PHE CE1 C 13 131.249 0.300 . 1 . . . . 139 PHE CE1 . 10236 1 1187 . 2 2 84 84 PHE CE2 C 13 131.249 0.300 . 1 . . . . 139 PHE CE2 . 10236 1 1188 . 2 2 84 84 PHE N N 15 115.735 0.300 . 1 . . . . 139 PHE N . 10236 1 1189 . 2 2 85 85 LEU H H 1 7.760 0.030 . 1 . . . . 140 LEU H . 10236 1 1190 . 2 2 85 85 LEU HA H 1 4.829 0.030 . 1 . . . . 140 LEU HA . 10236 1 1191 . 2 2 85 85 LEU HB2 H 1 1.976 0.030 . 2 . . . . 140 LEU HB2 . 10236 1 1192 . 2 2 85 85 LEU HB3 H 1 1.446 0.030 . 2 . . . . 140 LEU HB3 . 10236 1 1193 . 2 2 85 85 LEU HD11 H 1 0.223 0.030 . 1 . . . . 140 LEU HD1 . 10236 1 1194 . 2 2 85 85 LEU HD12 H 1 0.223 0.030 . 1 . . . . 140 LEU HD1 . 10236 1 1195 . 2 2 85 85 LEU HD13 H 1 0.223 0.030 . 1 . . . . 140 LEU HD1 . 10236 1 1196 . 2 2 85 85 LEU HD21 H 1 0.757 0.030 . 1 . . . . 140 LEU HD2 . 10236 1 1197 . 2 2 85 85 LEU HD22 H 1 0.757 0.030 . 1 . . . . 140 LEU HD2 . 10236 1 1198 . 2 2 85 85 LEU HD23 H 1 0.757 0.030 . 1 . . . . 140 LEU HD2 . 10236 1 1199 . 2 2 85 85 LEU HG H 1 1.646 0.030 . 1 . . . . 140 LEU HG . 10236 1 1200 . 2 2 85 85 LEU C C 13 175.706 0.300 . 1 . . . . 140 LEU C . 10236 1 1201 . 2 2 85 85 LEU CA C 13 55.450 0.300 . 1 . . . . 140 LEU CA . 10236 1 1202 . 2 2 85 85 LEU CB C 13 43.231 0.300 . 1 . . . . 140 LEU CB . 10236 1 1203 . 2 2 85 85 LEU CD1 C 13 26.283 0.300 . 2 . . . . 140 LEU CD1 . 10236 1 1204 . 2 2 85 85 LEU CD2 C 13 25.230 0.300 . 2 . . . . 140 LEU CD2 . 10236 1 1205 . 2 2 85 85 LEU CG C 13 28.820 0.300 . 1 . . . . 140 LEU CG . 10236 1 1206 . 2 2 85 85 LEU N N 15 125.824 0.300 . 1 . . . . 140 LEU N . 10236 1 1207 . 2 2 86 86 SER H H 1 9.012 0.030 . 1 . . . . 141 SER H . 10236 1 1208 . 2 2 86 86 SER HA H 1 3.931 0.030 . 1 . . . . 141 SER HA . 10236 1 1209 . 2 2 86 86 SER HB2 H 1 3.166 0.030 . 2 . . . . 141 SER HB2 . 10236 1 1210 . 2 2 86 86 SER HB3 H 1 2.257 0.030 . 2 . . . . 141 SER HB3 . 10236 1 1211 . 2 2 86 86 SER C C 13 176.724 0.300 . 1 . . . . 141 SER C . 10236 1 1212 . 2 2 86 86 SER CA C 13 60.597 0.300 . 1 . . . . 141 SER CA . 10236 1 1213 . 2 2 86 86 SER CB C 13 62.766 0.300 . 1 . . . . 141 SER CB . 10236 1 1214 . 2 2 86 86 SER N N 15 120.941 0.300 . 1 . . . . 141 SER N . 10236 1 1215 . 2 2 87 87 PHE H H 1 7.672 0.030 . 1 . . . . 142 PHE H . 10236 1 1216 . 2 2 87 87 PHE HA H 1 5.499 0.030 . 1 . . . . 142 PHE HA . 10236 1 1217 . 2 2 87 87 PHE HB2 H 1 3.690 0.030 . 2 . . . . 142 PHE HB2 . 10236 1 1218 . 2 2 87 87 PHE HB3 H 1 2.626 0.030 . 2 . . . . 142 PHE HB3 . 10236 1 1219 . 2 2 87 87 PHE HD1 H 1 6.993 0.030 . 1 . . . . 142 PHE HD1 . 10236 1 1220 . 2 2 87 87 PHE HD2 H 1 6.993 0.030 . 1 . . . . 142 PHE HD2 . 10236 1 1221 . 2 2 87 87 PHE HE1 H 1 7.268 0.030 . 1 . . . . 142 PHE HE1 . 10236 1 1222 . 2 2 87 87 PHE HE2 H 1 7.268 0.030 . 1 . . . . 142 PHE HE2 . 10236 1 1223 . 2 2 87 87 PHE HZ H 1 7.399 0.030 . 1 . . . . 142 PHE HZ . 10236 1 1224 . 2 2 87 87 PHE C C 13 172.048 0.300 . 1 . . . . 142 PHE C . 10236 1 1225 . 2 2 87 87 PHE CA C 13 57.247 0.300 . 1 . . . . 142 PHE CA . 10236 1 1226 . 2 2 87 87 PHE CB C 13 46.293 0.300 . 1 . . . . 142 PHE CB . 10236 1 1227 . 2 2 87 87 PHE CE1 C 13 130.514 0.300 . 1 . . . . 142 PHE CE1 . 10236 1 1228 . 2 2 87 87 PHE CE2 C 13 130.514 0.300 . 1 . . . . 142 PHE CE2 . 10236 1 1229 . 2 2 87 87 PHE N N 15 124.616 0.300 . 1 . . . . 142 PHE N . 10236 1 1230 . 2 2 88 88 MET H H 1 7.678 0.030 . 1 . . . . 143 MET H . 10236 1 1231 . 2 2 88 88 MET HA H 1 5.276 0.030 . 1 . . . . 143 MET HA . 10236 1 1232 . 2 2 88 88 MET HB2 H 1 2.365 0.030 . 2 . . . . 143 MET HB2 . 10236 1 1233 . 2 2 88 88 MET HB3 H 1 2.096 0.030 . 2 . . . . 143 MET HB3 . 10236 1 1234 . 2 2 88 88 MET HE1 H 1 2.045 0.030 . 1 . . . . 143 MET HE . 10236 1 1235 . 2 2 88 88 MET HE2 H 1 2.045 0.030 . 1 . . . . 143 MET HE . 10236 1 1236 . 2 2 88 88 MET HE3 H 1 2.045 0.030 . 1 . . . . 143 MET HE . 10236 1 1237 . 2 2 88 88 MET HG2 H 1 2.686 0.030 . 2 . . . . 143 MET HG2 . 10236 1 1238 . 2 2 88 88 MET HG3 H 1 2.309 0.030 . 2 . . . . 143 MET HG3 . 10236 1 1239 . 2 2 88 88 MET C C 13 171.273 0.300 . 1 . . . . 143 MET C . 10236 1 1240 . 2 2 88 88 MET CA C 13 54.309 0.300 . 1 . . . . 143 MET CA . 10236 1 1241 . 2 2 88 88 MET CB C 13 36.872 0.300 . 1 . . . . 143 MET CB . 10236 1 1242 . 2 2 88 88 MET CE C 13 20.030 0.300 . 1 . . . . 143 MET CE . 10236 1 1243 . 2 2 88 88 MET CG C 13 31.610 0.300 . 1 . . . . 143 MET CG . 10236 1 1244 . 2 2 88 88 MET N N 15 121.692 0.300 . 1 . . . . 143 MET N . 10236 1 1245 . 2 2 89 89 GLY H H 1 8.096 0.030 . 1 . . . . 144 GLY H . 10236 1 1246 . 2 2 89 89 GLY HA2 H 1 4.146 0.030 . 2 . . . . 144 GLY HA2 . 10236 1 1247 . 2 2 89 89 GLY HA3 H 1 3.797 0.030 . 2 . . . . 144 GLY HA3 . 10236 1 1248 . 2 2 89 89 GLY C C 13 168.996 0.300 . 1 . . . . 144 GLY C . 10236 1 1249 . 2 2 89 89 GLY CA C 13 46.096 0.300 . 1 . . . . 144 GLY CA . 10236 1 1250 . 2 2 89 89 GLY N N 15 103.003 0.300 . 1 . . . . 144 GLY N . 10236 1 1251 . 2 2 90 90 VAL H H 1 6.858 0.030 . 1 . . . . 145 VAL H . 10236 1 1252 . 2 2 90 90 VAL HA H 1 4.888 0.030 . 1 . . . . 145 VAL HA . 10236 1 1253 . 2 2 90 90 VAL HB H 1 1.284 0.030 . 1 . . . . 145 VAL HB . 10236 1 1254 . 2 2 90 90 VAL HG11 H 1 0.924 0.030 . 1 . . . . 145 VAL HG1 . 10236 1 1255 . 2 2 90 90 VAL HG12 H 1 0.924 0.030 . 1 . . . . 145 VAL HG1 . 10236 1 1256 . 2 2 90 90 VAL HG13 H 1 0.924 0.030 . 1 . . . . 145 VAL HG1 . 10236 1 1257 . 2 2 90 90 VAL HG21 H 1 1.279 0.030 . 1 . . . . 145 VAL HG2 . 10236 1 1258 . 2 2 90 90 VAL HG22 H 1 1.279 0.030 . 1 . . . . 145 VAL HG2 . 10236 1 1259 . 2 2 90 90 VAL HG23 H 1 1.279 0.030 . 1 . . . . 145 VAL HG2 . 10236 1 1260 . 2 2 90 90 VAL C C 13 175.004 0.300 . 1 . . . . 145 VAL C . 10236 1 1261 . 2 2 90 90 VAL CA C 13 59.524 0.300 . 1 . . . . 145 VAL CA . 10236 1 1262 . 2 2 90 90 VAL CB C 13 35.730 0.300 . 1 . . . . 145 VAL CB . 10236 1 1263 . 2 2 90 90 VAL CG1 C 13 23.081 0.300 . 2 . . . . 145 VAL CG1 . 10236 1 1264 . 2 2 90 90 VAL CG2 C 13 20.266 0.300 . 2 . . . . 145 VAL CG2 . 10236 1 1265 . 2 2 90 90 VAL N N 15 119.130 0.300 . 1 . . . . 145 VAL N . 10236 1 1266 . 2 2 91 91 GLY H H 1 7.511 0.030 . 1 . . . . 146 GLY H . 10236 1 1267 . 2 2 91 91 GLY HA2 H 1 4.644 0.030 . 2 . . . . 146 GLY HA2 . 10236 1 1268 . 2 2 91 91 GLY HA3 H 1 3.738 0.030 . 2 . . . . 146 GLY HA3 . 10236 1 1269 . 2 2 91 91 GLY C C 13 172.242 0.300 . 1 . . . . 146 GLY C . 10236 1 1270 . 2 2 91 91 GLY CA C 13 44.882 0.300 . 1 . . . . 146 GLY CA . 10236 1 1271 . 2 2 91 91 GLY N N 15 110.889 0.300 . 1 . . . . 146 GLY N . 10236 1 1272 . 2 2 92 92 LYS H H 1 8.108 0.030 . 1 . . . . 147 LYS H . 10236 1 1273 . 2 2 92 92 LYS HA H 1 3.809 0.030 . 1 . . . . 147 LYS HA . 10236 1 1274 . 2 2 92 92 LYS HB2 H 1 1.744 0.030 . 1 . . . . 147 LYS HB2 . 10236 1 1275 . 2 2 92 92 LYS HB3 H 1 1.744 0.030 . 1 . . . . 147 LYS HB3 . 10236 1 1276 . 2 2 92 92 LYS HD2 H 1 1.661 0.030 . 1 . . . . 147 LYS HD2 . 10236 1 1277 . 2 2 92 92 LYS HD3 H 1 1.661 0.030 . 1 . . . . 147 LYS HD3 . 10236 1 1278 . 2 2 92 92 LYS HE2 H 1 2.961 0.030 . 2 . . . . 147 LYS HE2 . 10236 1 1279 . 2 2 92 92 LYS HE3 H 1 2.926 0.030 . 2 . . . . 147 LYS HE3 . 10236 1 1280 . 2 2 92 92 LYS HG2 H 1 1.422 0.030 . 1 . . . . 147 LYS HG2 . 10236 1 1281 . 2 2 92 92 LYS HG3 H 1 1.422 0.030 . 1 . . . . 147 LYS HG3 . 10236 1 1282 . 2 2 92 92 LYS C C 13 177.983 0.300 . 1 . . . . 147 LYS C . 10236 1 1283 . 2 2 92 92 LYS CA C 13 59.207 0.300 . 1 . . . . 147 LYS CA . 10236 1 1284 . 2 2 92 92 LYS CB C 13 32.268 0.300 . 1 . . . . 147 LYS CB . 10236 1 1285 . 2 2 92 92 LYS CD C 13 29.062 0.300 . 1 . . . . 147 LYS CD . 10236 1 1286 . 2 2 92 92 LYS CE C 13 42.215 0.300 . 1 . . . . 147 LYS CE . 10236 1 1287 . 2 2 92 92 LYS CG C 13 25.034 0.300 . 1 . . . . 147 LYS CG . 10236 1 1288 . 2 2 92 92 LYS N N 15 117.776 0.300 . 1 . . . . 147 LYS N . 10236 1 1289 . 2 2 93 93 ASP H H 1 8.410 0.030 . 1 . . . . 148 ASP H . 10236 1 1290 . 2 2 93 93 ASP HA H 1 4.933 0.030 . 1 . . . . 148 ASP HA . 10236 1 1291 . 2 2 93 93 ASP HB2 H 1 2.867 0.030 . 2 . . . . 148 ASP HB2 . 10236 1 1292 . 2 2 93 93 ASP HB3 H 1 2.449 0.030 . 2 . . . . 148 ASP HB3 . 10236 1 1293 . 2 2 93 93 ASP C C 13 178.129 0.300 . 1 . . . . 148 ASP C . 10236 1 1294 . 2 2 93 93 ASP CA C 13 52.907 0.300 . 1 . . . . 148 ASP CA . 10236 1 1295 . 2 2 93 93 ASP CB C 13 42.544 0.300 . 1 . . . . 148 ASP CB . 10236 1 1296 . 2 2 93 93 ASP N N 15 116.611 0.300 . 1 . . . . 148 ASP N . 10236 1 1297 . 2 2 94 94 VAL H H 1 8.440 0.030 . 1 . . . . 149 VAL H . 10236 1 1298 . 2 2 94 94 VAL HA H 1 3.798 0.030 . 1 . . . . 149 VAL HA . 10236 1 1299 . 2 2 94 94 VAL HB H 1 2.278 0.030 . 1 . . . . 149 VAL HB . 10236 1 1300 . 2 2 94 94 VAL HG11 H 1 0.973 0.030 . 1 . . . . 149 VAL HG1 . 10236 1 1301 . 2 2 94 94 VAL HG12 H 1 0.973 0.030 . 1 . . . . 149 VAL HG1 . 10236 1 1302 . 2 2 94 94 VAL HG13 H 1 0.973 0.030 . 1 . . . . 149 VAL HG1 . 10236 1 1303 . 2 2 94 94 VAL HG21 H 1 0.677 0.030 . 1 . . . . 149 VAL HG2 . 10236 1 1304 . 2 2 94 94 VAL HG22 H 1 0.677 0.030 . 1 . . . . 149 VAL HG2 . 10236 1 1305 . 2 2 94 94 VAL HG23 H 1 0.677 0.030 . 1 . . . . 149 VAL HG2 . 10236 1 1306 . 2 2 94 94 VAL C C 13 175.246 0.300 . 1 . . . . 149 VAL C . 10236 1 1307 . 2 2 94 94 VAL CA C 13 63.588 0.300 . 1 . . . . 149 VAL CA . 10236 1 1308 . 2 2 94 94 VAL CB C 13 31.702 0.300 . 1 . . . . 149 VAL CB . 10236 1 1309 . 2 2 94 94 VAL CG1 C 13 21.303 0.300 . 2 . . . . 149 VAL CG1 . 10236 1 1310 . 2 2 94 94 VAL CG2 C 13 17.553 0.300 . 2 . . . . 149 VAL CG2 . 10236 1 1311 . 2 2 94 94 VAL N N 15 121.383 0.300 . 1 . . . . 149 VAL N . 10236 1 1312 . 2 2 95 95 HIS H H 1 9.007 0.030 . 1 . . . . 150 HIS H . 10236 1 1313 . 2 2 95 95 HIS HA H 1 3.941 0.030 . 1 . . . . 150 HIS HA . 10236 1 1314 . 2 2 95 95 HIS HB2 H 1 1.458 0.030 . 2 . . . . 150 HIS HB2 . 10236 1 1315 . 2 2 95 95 HIS HB3 H 1 0.649 0.030 . 2 . . . . 150 HIS HB3 . 10236 1 1316 . 2 2 95 95 HIS HD2 H 1 7.026 0.030 . 1 . . . . 150 HIS HD2 . 10236 1 1317 . 2 2 95 95 HIS HE1 H 1 8.632 0.030 . 1 . . . . 150 HIS HE1 . 10236 1 1318 . 2 2 95 95 HIS C C 13 176.312 0.300 . 1 . . . . 150 HIS C . 10236 1 1319 . 2 2 95 95 HIS CA C 13 58.150 0.300 . 1 . . . . 150 HIS CA . 10236 1 1320 . 2 2 95 95 HIS CB C 13 25.814 0.300 . 1 . . . . 150 HIS CB . 10236 1 1321 . 2 2 95 95 HIS CD2 C 13 121.166 0.300 . 1 . . . . 150 HIS CD2 . 10236 1 1322 . 2 2 95 95 HIS CE1 C 13 134.680 0.300 . 1 . . . . 150 HIS CE1 . 10236 1 1323 . 2 2 95 95 HIS N N 15 117.184 0.300 . 1 . . . . 150 HIS N . 10236 1 1324 . 2 2 96 96 THR H H 1 8.478 0.030 . 1 . . . . 151 THR H . 10236 1 1325 . 2 2 96 96 THR HA H 1 5.164 0.030 . 1 . . . . 151 THR HA . 10236 1 1326 . 2 2 96 96 THR HB H 1 3.898 0.030 . 1 . . . . 151 THR HB . 10236 1 1327 . 2 2 96 96 THR HG21 H 1 1.347 0.030 . 1 . . . . 151 THR HG2 . 10236 1 1328 . 2 2 96 96 THR HG22 H 1 1.347 0.030 . 1 . . . . 151 THR HG2 . 10236 1 1329 . 2 2 96 96 THR HG23 H 1 1.347 0.030 . 1 . . . . 151 THR HG2 . 10236 1 1330 . 2 2 96 96 THR C C 13 172.170 0.300 . 1 . . . . 151 THR C . 10236 1 1331 . 2 2 96 96 THR CA C 13 60.464 0.300 . 1 . . . . 151 THR CA . 10236 1 1332 . 2 2 96 96 THR CB C 13 71.934 0.300 . 1 . . . . 151 THR CB . 10236 1 1333 . 2 2 96 96 THR CG2 C 13 24.265 0.300 . 1 . . . . 151 THR CG2 . 10236 1 1334 . 2 2 96 96 THR N N 15 109.497 0.300 . 1 . . . . 151 THR N . 10236 1 1335 . 2 2 97 97 PHE H H 1 8.741 0.030 . 1 . . . . 152 PHE H . 10236 1 1336 . 2 2 97 97 PHE HA H 1 5.295 0.030 . 1 . . . . 152 PHE HA . 10236 1 1337 . 2 2 97 97 PHE HB2 H 1 3.202 0.030 . 2 . . . . 152 PHE HB2 . 10236 1 1338 . 2 2 97 97 PHE HB3 H 1 2.451 0.030 . 2 . . . . 152 PHE HB3 . 10236 1 1339 . 2 2 97 97 PHE HD1 H 1 6.960 0.030 . 1 . . . . 152 PHE HD1 . 10236 1 1340 . 2 2 97 97 PHE HD2 H 1 6.960 0.030 . 1 . . . . 152 PHE HD2 . 10236 1 1341 . 2 2 97 97 PHE HE1 H 1 7.003 0.030 . 1 . . . . 152 PHE HE1 . 10236 1 1342 . 2 2 97 97 PHE HE2 H 1 7.003 0.030 . 1 . . . . 152 PHE HE2 . 10236 1 1343 . 2 2 97 97 PHE HZ H 1 7.167 0.030 . 1 . . . . 152 PHE HZ . 10236 1 1344 . 2 2 97 97 PHE C C 13 172.484 0.300 . 1 . . . . 152 PHE C . 10236 1 1345 . 2 2 97 97 PHE CA C 13 54.826 0.300 . 1 . . . . 152 PHE CA . 10236 1 1346 . 2 2 97 97 PHE CB C 13 44.723 0.300 . 1 . . . . 152 PHE CB . 10236 1 1347 . 2 2 97 97 PHE CD1 C 13 131.917 0.300 . 1 . . . . 152 PHE CD1 . 10236 1 1348 . 2 2 97 97 PHE CD2 C 13 131.917 0.300 . 1 . . . . 152 PHE CD2 . 10236 1 1349 . 2 2 97 97 PHE CE1 C 13 130.664 0.300 . 1 . . . . 152 PHE CE1 . 10236 1 1350 . 2 2 97 97 PHE CE2 C 13 130.664 0.300 . 1 . . . . 152 PHE CE2 . 10236 1 1351 . 2 2 97 97 PHE CZ C 13 129.250 0.300 . 1 . . . . 152 PHE CZ . 10236 1 1352 . 2 2 97 97 PHE N N 15 121.438 0.300 . 1 . . . . 152 PHE N . 10236 1 1353 . 2 2 98 98 ALA H H 1 7.971 0.030 . 1 . . . . 153 ALA H . 10236 1 1354 . 2 2 98 98 ALA HA H 1 5.484 0.030 . 1 . . . . 153 ALA HA . 10236 1 1355 . 2 2 98 98 ALA HB1 H 1 0.994 0.030 . 1 . . . . 153 ALA HB . 10236 1 1356 . 2 2 98 98 ALA HB2 H 1 0.994 0.030 . 1 . . . . 153 ALA HB . 10236 1 1357 . 2 2 98 98 ALA HB3 H 1 0.994 0.030 . 1 . . . . 153 ALA HB . 10236 1 1358 . 2 2 98 98 ALA C C 13 174.204 0.300 . 1 . . . . 153 ALA C . 10236 1 1359 . 2 2 98 98 ALA CA C 13 49.898 0.300 . 1 . . . . 153 ALA CA . 10236 1 1360 . 2 2 98 98 ALA CB C 13 25.203 0.300 . 1 . . . . 153 ALA CB . 10236 1 1361 . 2 2 98 98 ALA N N 15 127.498 0.300 . 1 . . . . 153 ALA N . 10236 1 1362 . 2 2 99 99 PHE H H 1 8.037 0.030 . 1 . . . . 154 PHE H . 10236 1 1363 . 2 2 99 99 PHE HA H 1 5.467 0.030 . 1 . . . . 154 PHE HA . 10236 1 1364 . 2 2 99 99 PHE HB2 H 1 3.378 0.030 . 2 . . . . 154 PHE HB2 . 10236 1 1365 . 2 2 99 99 PHE HB3 H 1 2.731 0.030 . 2 . . . . 154 PHE HB3 . 10236 1 1366 . 2 2 99 99 PHE HD1 H 1 7.048 0.030 . 1 . . . . 154 PHE HD1 . 10236 1 1367 . 2 2 99 99 PHE HD2 H 1 7.048 0.030 . 1 . . . . 154 PHE HD2 . 10236 1 1368 . 2 2 99 99 PHE HE1 H 1 7.169 0.030 . 1 . . . . 154 PHE HE1 . 10236 1 1369 . 2 2 99 99 PHE HE2 H 1 7.169 0.030 . 1 . . . . 154 PHE HE2 . 10236 1 1370 . 2 2 99 99 PHE HZ H 1 6.778 0.030 . 1 . . . . 154 PHE HZ . 10236 1 1371 . 2 2 99 99 PHE C C 13 172.412 0.300 . 1 . . . . 154 PHE C . 10236 1 1372 . 2 2 99 99 PHE CA C 13 54.967 0.300 . 1 . . . . 154 PHE CA . 10236 1 1373 . 2 2 99 99 PHE CB C 13 43.213 0.300 . 1 . . . . 154 PHE CB . 10236 1 1374 . 2 2 99 99 PHE CD1 C 13 132.258 0.300 . 1 . . . . 154 PHE CD1 . 10236 1 1375 . 2 2 99 99 PHE CD2 C 13 132.258 0.300 . 1 . . . . 154 PHE CD2 . 10236 1 1376 . 2 2 99 99 PHE CE1 C 13 130.895 0.300 . 1 . . . . 154 PHE CE1 . 10236 1 1377 . 2 2 99 99 PHE CE2 C 13 130.895 0.300 . 1 . . . . 154 PHE CE2 . 10236 1 1378 . 2 2 99 99 PHE CZ C 13 127.756 0.300 . 1 . . . . 154 PHE CZ . 10236 1 1379 . 2 2 99 99 PHE N N 15 111.373 0.300 . 1 . . . . 154 PHE N . 10236 1 1380 . 2 2 100 100 ILE H H 1 9.321 0.030 . 1 . . . . 155 ILE H . 10236 1 1381 . 2 2 100 100 ILE HA H 1 5.044 0.030 . 1 . . . . 155 ILE HA . 10236 1 1382 . 2 2 100 100 ILE HB H 1 1.731 0.030 . 1 . . . . 155 ILE HB . 10236 1 1383 . 2 2 100 100 ILE HD11 H 1 0.605 0.030 . 1 . . . . 155 ILE HD1 . 10236 1 1384 . 2 2 100 100 ILE HD12 H 1 0.605 0.030 . 1 . . . . 155 ILE HD1 . 10236 1 1385 . 2 2 100 100 ILE HD13 H 1 0.605 0.030 . 1 . . . . 155 ILE HD1 . 10236 1 1386 . 2 2 100 100 ILE HG12 H 1 0.592 0.030 . 2 . . . . 155 ILE HG12 . 10236 1 1387 . 2 2 100 100 ILE HG13 H 1 1.687 0.030 . 2 . . . . 155 ILE HG13 . 10236 1 1388 . 2 2 100 100 ILE HG21 H 1 0.856 0.030 . 1 . . . . 155 ILE HG2 . 10236 1 1389 . 2 2 100 100 ILE HG22 H 1 0.856 0.030 . 1 . . . . 155 ILE HG2 . 10236 1 1390 . 2 2 100 100 ILE HG23 H 1 0.856 0.030 . 1 . . . . 155 ILE HG2 . 10236 1 1391 . 2 2 100 100 ILE C C 13 173.986 0.300 . 1 . . . . 155 ILE C . 10236 1 1392 . 2 2 100 100 ILE CA C 13 60.629 0.300 . 1 . . . . 155 ILE CA . 10236 1 1393 . 2 2 100 100 ILE CB C 13 39.881 0.300 . 1 . . . . 155 ILE CB . 10236 1 1394 . 2 2 100 100 ILE CD1 C 13 13.032 0.300 . 1 . . . . 155 ILE CD1 . 10236 1 1395 . 2 2 100 100 ILE CG1 C 13 28.623 0.300 . 1 . . . . 155 ILE CG1 . 10236 1 1396 . 2 2 100 100 ILE CG2 C 13 18.844 0.300 . 1 . . . . 155 ILE CG2 . 10236 1 1397 . 2 2 100 100 ILE N N 15 121.231 0.300 . 1 . . . . 155 ILE N . 10236 1 1398 . 2 2 101 101 MET H H 1 9.528 0.030 . 1 . . . . 156 MET H . 10236 1 1399 . 2 2 101 101 MET HA H 1 5.796 0.030 . 1 . . . . 156 MET HA . 10236 1 1400 . 2 2 101 101 MET HB2 H 1 2.374 0.030 . 2 . . . . 156 MET HB2 . 10236 1 1401 . 2 2 101 101 MET HB3 H 1 2.330 0.030 . 2 . . . . 156 MET HB3 . 10236 1 1402 . 2 2 101 101 MET HE1 H 1 2.221 0.030 . 1 . . . . 156 MET HE . 10236 1 1403 . 2 2 101 101 MET HE2 H 1 2.221 0.030 . 1 . . . . 156 MET HE . 10236 1 1404 . 2 2 101 101 MET HE3 H 1 2.221 0.030 . 1 . . . . 156 MET HE . 10236 1 1405 . 2 2 101 101 MET HG2 H 1 2.703 0.030 . 1 . . . . 156 MET HG2 . 10236 1 1406 . 2 2 101 101 MET HG3 H 1 2.703 0.030 . 1 . . . . 156 MET HG3 . 10236 1 1407 . 2 2 101 101 MET C C 13 173.986 0.300 . 1 . . . . 156 MET C . 10236 1 1408 . 2 2 101 101 MET CA C 13 53.236 0.300 . 1 . . . . 156 MET CA . 10236 1 1409 . 2 2 101 101 MET CB C 13 38.043 0.300 . 1 . . . . 156 MET CB . 10236 1 1410 . 2 2 101 101 MET CE C 13 17.693 0.300 . 1 . . . . 156 MET CE . 10236 1 1411 . 2 2 101 101 MET CG C 13 31.939 0.300 . 1 . . . . 156 MET CG . 10236 1 1412 . 2 2 101 101 MET N N 15 123.897 0.300 . 1 . . . . 156 MET N . 10236 1 1413 . 2 2 102 102 ASP H H 1 9.482 0.030 . 1 . . . . 157 ASP H . 10236 1 1414 . 2 2 102 102 ASP HA H 1 5.067 0.030 . 1 . . . . 157 ASP HA . 10236 1 1415 . 2 2 102 102 ASP HB2 H 1 3.627 0.030 . 2 . . . . 157 ASP HB2 . 10236 1 1416 . 2 2 102 102 ASP HB3 H 1 2.994 0.030 . 2 . . . . 157 ASP HB3 . 10236 1 1417 . 2 2 102 102 ASP C C 13 177.039 0.300 . 1 . . . . 157 ASP C . 10236 1 1418 . 2 2 102 102 ASP CA C 13 52.883 0.300 . 1 . . . . 157 ASP CA . 10236 1 1419 . 2 2 102 102 ASP CB C 13 43.531 0.300 . 1 . . . . 157 ASP CB . 10236 1 1420 . 2 2 102 102 ASP N N 15 124.672 0.300 . 1 . . . . 157 ASP N . 10236 1 1421 . 2 2 103 103 THR H H 1 8.548 0.030 . 1 . . . . 158 THR H . 10236 1 1422 . 2 2 103 103 THR HA H 1 4.280 0.030 . 1 . . . . 158 THR HA . 10236 1 1423 . 2 2 103 103 THR HB H 1 4.502 0.030 . 1 . . . . 158 THR HB . 10236 1 1424 . 2 2 103 103 THR HG21 H 1 1.217 0.030 . 1 . . . . 158 THR HG2 . 10236 1 1425 . 2 2 103 103 THR HG22 H 1 1.217 0.030 . 1 . . . . 158 THR HG2 . 10236 1 1426 . 2 2 103 103 THR HG23 H 1 1.217 0.030 . 1 . . . . 158 THR HG2 . 10236 1 1427 . 2 2 103 103 THR C C 13 175.125 0.300 . 1 . . . . 158 THR C . 10236 1 1428 . 2 2 103 103 THR CA C 13 62.015 0.300 . 1 . . . . 158 THR CA . 10236 1 1429 . 2 2 103 103 THR CB C 13 68.745 0.300 . 1 . . . . 158 THR CB . 10236 1 1430 . 2 2 103 103 THR CG2 C 13 21.992 0.300 . 1 . . . . 158 THR CG2 . 10236 1 1431 . 2 2 103 103 THR N N 15 116.352 0.300 . 1 . . . . 158 THR N . 10236 1 1432 . 2 2 104 104 GLY H H 1 9.047 0.030 . 1 . . . . 159 GLY H . 10236 1 1433 . 2 2 104 104 GLY HA2 H 1 4.310 0.030 . 2 . . . . 159 GLY HA2 . 10236 1 1434 . 2 2 104 104 GLY HA3 H 1 3.527 0.030 . 2 . . . . 159 GLY HA3 . 10236 1 1435 . 2 2 104 104 GLY C C 13 173.938 0.300 . 1 . . . . 159 GLY C . 10236 1 1436 . 2 2 104 104 GLY CA C 13 44.826 0.300 . 1 . . . . 159 GLY CA . 10236 1 1437 . 2 2 104 104 GLY N N 15 113.007 0.300 . 1 . . . . 159 GLY N . 10236 1 1438 . 2 2 105 105 ASN H H 1 8.740 0.030 . 1 . . . . 160 ASN H . 10236 1 1439 . 2 2 105 105 ASN HA H 1 4.462 0.030 . 1 . . . . 160 ASN HA . 10236 1 1440 . 2 2 105 105 ASN HB2 H 1 2.572 0.030 . 2 . . . . 160 ASN HB2 . 10236 1 1441 . 2 2 105 105 ASN HB3 H 1 2.849 0.030 . 2 . . . . 160 ASN HB3 . 10236 1 1442 . 2 2 105 105 ASN HD21 H 1 6.849 0.030 . 2 . . . . 160 ASN HD21 . 10236 1 1443 . 2 2 105 105 ASN HD22 H 1 7.479 0.030 . 2 . . . . 160 ASN HD22 . 10236 1 1444 . 2 2 105 105 ASN C C 13 173.986 0.300 . 1 . . . . 160 ASN C . 10236 1 1445 . 2 2 105 105 ASN CA C 13 53.471 0.300 . 1 . . . . 160 ASN CA . 10236 1 1446 . 2 2 105 105 ASN CB C 13 37.863 0.300 . 1 . . . . 160 ASN CB . 10236 1 1447 . 2 2 105 105 ASN N N 15 118.345 0.300 . 1 . . . . 160 ASN N . 10236 1 1448 . 2 2 105 105 ASN ND2 N 15 112.871 0.300 . 1 . . . . 160 ASN ND2 . 10236 1 1449 . 2 2 106 106 GLN H H 1 9.060 0.030 . 1 . . . . 161 GLN H . 10236 1 1450 . 2 2 106 106 GLN HA H 1 3.273 0.030 . 1 . . . . 161 GLN HA . 10236 1 1451 . 2 2 106 106 GLN HB2 H 1 2.211 0.030 . 2 . . . . 161 GLN HB2 . 10236 1 1452 . 2 2 106 106 GLN HB3 H 1 2.131 0.030 . 2 . . . . 161 GLN HB3 . 10236 1 1453 . 2 2 106 106 GLN HE21 H 1 6.718 0.030 . 2 . . . . 161 GLN HE21 . 10236 1 1454 . 2 2 106 106 GLN HE22 H 1 7.671 0.030 . 2 . . . . 161 GLN HE22 . 10236 1 1455 . 2 2 106 106 GLN HG2 H 1 2.215 0.030 . 1 . . . . 161 GLN HG2 . 10236 1 1456 . 2 2 106 106 GLN HG3 H 1 2.215 0.030 . 1 . . . . 161 GLN HG3 . 10236 1 1457 . 2 2 106 106 GLN C C 13 173.865 0.300 . 1 . . . . 161 GLN C . 10236 1 1458 . 2 2 106 106 GLN CA C 13 57.027 0.300 . 1 . . . . 161 GLN CA . 10236 1 1459 . 2 2 106 106 GLN CB C 13 25.838 0.300 . 1 . . . . 161 GLN CB . 10236 1 1460 . 2 2 106 106 GLN CG C 13 34.991 0.300 . 1 . . . . 161 GLN CG . 10236 1 1461 . 2 2 106 106 GLN N N 15 112.699 0.300 . 1 . . . . 161 GLN N . 10236 1 1462 . 2 2 106 106 GLN NE2 N 15 112.947 0.300 . 1 . . . . 161 GLN NE2 . 10236 1 1463 . 2 2 107 107 ARG H H 1 6.814 0.030 . 1 . . . . 162 ARG H . 10236 1 1464 . 2 2 107 107 ARG HA H 1 4.278 0.030 . 1 . . . . 162 ARG HA . 10236 1 1465 . 2 2 107 107 ARG HB2 H 1 1.679 0.030 . 2 . . . . 162 ARG HB2 . 10236 1 1466 . 2 2 107 107 ARG HB3 H 1 1.634 0.030 . 2 . . . . 162 ARG HB3 . 10236 1 1467 . 2 2 107 107 ARG HD2 H 1 3.117 0.030 . 1 . . . . 162 ARG HD2 . 10236 1 1468 . 2 2 107 107 ARG HD3 H 1 3.117 0.030 . 1 . . . . 162 ARG HD3 . 10236 1 1469 . 2 2 107 107 ARG HG2 H 1 1.387 0.030 . 2 . . . . 162 ARG HG2 . 10236 1 1470 . 2 2 107 107 ARG HG3 H 1 1.534 0.030 . 2 . . . . 162 ARG HG3 . 10236 1 1471 . 2 2 107 107 ARG C C 13 174.834 0.300 . 1 . . . . 162 ARG C . 10236 1 1472 . 2 2 107 107 ARG CA C 13 54.655 0.300 . 1 . . . . 162 ARG CA . 10236 1 1473 . 2 2 107 107 ARG CB C 13 30.331 0.300 . 1 . . . . 162 ARG CB . 10236 1 1474 . 2 2 107 107 ARG CD C 13 43.366 0.300 . 1 . . . . 162 ARG CD . 10236 1 1475 . 2 2 107 107 ARG CG C 13 27.124 0.300 . 1 . . . . 162 ARG CG . 10236 1 1476 . 2 2 107 107 ARG N N 15 117.791 0.300 . 1 . . . . 162 ARG N . 10236 1 1477 . 2 2 108 108 PHE H H 1 8.286 0.030 . 1 . . . . 163 PHE H . 10236 1 1478 . 2 2 108 108 PHE HA H 1 5.624 0.030 . 1 . . . . 163 PHE HA . 10236 1 1479 . 2 2 108 108 PHE HB2 H 1 2.821 0.030 . 2 . . . . 163 PHE HB2 . 10236 1 1480 . 2 2 108 108 PHE HB3 H 1 2.674 0.030 . 2 . . . . 163 PHE HB3 . 10236 1 1481 . 2 2 108 108 PHE HD1 H 1 6.899 0.030 . 1 . . . . 163 PHE HD1 . 10236 1 1482 . 2 2 108 108 PHE HD2 H 1 6.899 0.030 . 1 . . . . 163 PHE HD2 . 10236 1 1483 . 2 2 108 108 PHE HE1 H 1 7.288 0.030 . 1 . . . . 163 PHE HE1 . 10236 1 1484 . 2 2 108 108 PHE HE2 H 1 7.288 0.030 . 1 . . . . 163 PHE HE2 . 10236 1 1485 . 2 2 108 108 PHE HZ H 1 7.258 0.030 . 1 . . . . 163 PHE HZ . 10236 1 1486 . 2 2 108 108 PHE C C 13 176.288 0.300 . 1 . . . . 163 PHE C . 10236 1 1487 . 2 2 108 108 PHE CA C 13 56.465 0.300 . 1 . . . . 163 PHE CA . 10236 1 1488 . 2 2 108 108 PHE CB C 13 41.188 0.300 . 1 . . . . 163 PHE CB . 10236 1 1489 . 2 2 108 108 PHE CD1 C 13 131.452 0.300 . 1 . . . . 163 PHE CD1 . 10236 1 1490 . 2 2 108 108 PHE CD2 C 13 131.452 0.300 . 1 . . . . 163 PHE CD2 . 10236 1 1491 . 2 2 108 108 PHE CE1 C 13 131.279 0.300 . 1 . . . . 163 PHE CE1 . 10236 1 1492 . 2 2 108 108 PHE CE2 C 13 131.279 0.300 . 1 . . . . 163 PHE CE2 . 10236 1 1493 . 2 2 108 108 PHE CZ C 13 129.265 0.300 . 1 . . . . 163 PHE CZ . 10236 1 1494 . 2 2 108 108 PHE N N 15 122.971 0.300 . 1 . . . . 163 PHE N . 10236 1 1495 . 2 2 109 109 GLU H H 1 9.270 0.030 . 1 . . . . 164 GLU H . 10236 1 1496 . 2 2 109 109 GLU HA H 1 4.623 0.030 . 1 . . . . 164 GLU HA . 10236 1 1497 . 2 2 109 109 GLU HB2 H 1 1.920 0.030 . 2 . . . . 164 GLU HB2 . 10236 1 1498 . 2 2 109 109 GLU HB3 H 1 1.665 0.030 . 2 . . . . 164 GLU HB3 . 10236 1 1499 . 2 2 109 109 GLU HG2 H 1 2.266 0.030 . 2 . . . . 164 GLU HG2 . 10236 1 1500 . 2 2 109 109 GLU HG3 H 1 2.204 0.030 . 2 . . . . 164 GLU HG3 . 10236 1 1501 . 2 2 109 109 GLU C C 13 174.204 0.300 . 1 . . . . 164 GLU C . 10236 1 1502 . 2 2 109 109 GLU CA C 13 55.034 0.300 . 1 . . . . 164 GLU CA . 10236 1 1503 . 2 2 109 109 GLU CB C 13 34.189 0.300 . 1 . . . . 164 GLU CB . 10236 1 1504 . 2 2 109 109 GLU CG C 13 36.299 0.300 . 1 . . . . 164 GLU CG . 10236 1 1505 . 2 2 109 109 GLU N N 15 121.118 0.300 . 1 . . . . 164 GLU N . 10236 1 1506 . 2 2 110 110 CYS H H 1 8.940 0.030 . 1 . . . . 165 CYS H . 10236 1 1507 . 2 2 110 110 CYS HA H 1 5.434 0.030 . 1 . . . . 165 CYS HA . 10236 1 1508 . 2 2 110 110 CYS HB2 H 1 2.617 0.030 . 2 . . . . 165 CYS HB2 . 10236 1 1509 . 2 2 110 110 CYS HB3 H 1 2.407 0.030 . 2 . . . . 165 CYS HB3 . 10236 1 1510 . 2 2 110 110 CYS C C 13 172.654 0.300 . 1 . . . . 165 CYS C . 10236 1 1511 . 2 2 110 110 CYS CA C 13 56.415 0.300 . 1 . . . . 165 CYS CA . 10236 1 1512 . 2 2 110 110 CYS CB C 13 29.168 0.300 . 1 . . . . 165 CYS CB . 10236 1 1513 . 2 2 110 110 CYS N N 15 124.138 0.300 . 1 . . . . 165 CYS N . 10236 1 1514 . 2 2 111 111 HIS H H 1 8.428 0.030 . 1 . . . . 166 HIS H . 10236 1 1515 . 2 2 111 111 HIS HA H 1 4.691 0.030 . 1 . . . . 166 HIS HA . 10236 1 1516 . 2 2 111 111 HIS HB2 H 1 2.603 0.030 . 2 . . . . 166 HIS HB2 . 10236 1 1517 . 2 2 111 111 HIS HB3 H 1 1.724 0.030 . 2 . . . . 166 HIS HB3 . 10236 1 1518 . 2 2 111 111 HIS HD2 H 1 6.491 0.030 . 1 . . . . 166 HIS HD2 . 10236 1 1519 . 2 2 111 111 HIS HE1 H 1 7.707 0.030 . 1 . . . . 166 HIS HE1 . 10236 1 1520 . 2 2 111 111 HIS C C 13 174.253 0.300 . 1 . . . . 166 HIS C . 10236 1 1521 . 2 2 111 111 HIS CA C 13 55.532 0.300 . 1 . . . . 166 HIS CA . 10236 1 1522 . 2 2 111 111 HIS CB C 13 34.012 0.300 . 1 . . . . 166 HIS CB . 10236 1 1523 . 2 2 111 111 HIS CD2 C 13 116.435 0.300 . 1 . . . . 166 HIS CD2 . 10236 1 1524 . 2 2 111 111 HIS CE1 C 13 138.945 0.300 . 1 . . . . 166 HIS CE1 . 10236 1 1525 . 2 2 111 111 HIS N N 15 128.884 0.300 . 1 . . . . 166 HIS N . 10236 1 1526 . 2 2 112 112 VAL H H 1 7.580 0.030 . 1 . . . . 167 VAL H . 10236 1 1527 . 2 2 112 112 VAL HA H 1 4.577 0.030 . 1 . . . . 167 VAL HA . 10236 1 1528 . 2 2 112 112 VAL HB H 1 1.421 0.030 . 1 . . . . 167 VAL HB . 10236 1 1529 . 2 2 112 112 VAL HG11 H 1 0.854 0.030 . 1 . . . . 167 VAL HG1 . 10236 1 1530 . 2 2 112 112 VAL HG12 H 1 0.854 0.030 . 1 . . . . 167 VAL HG1 . 10236 1 1531 . 2 2 112 112 VAL HG13 H 1 0.854 0.030 . 1 . . . . 167 VAL HG1 . 10236 1 1532 . 2 2 112 112 VAL HG21 H 1 0.601 0.030 . 1 . . . . 167 VAL HG2 . 10236 1 1533 . 2 2 112 112 VAL HG22 H 1 0.601 0.030 . 1 . . . . 167 VAL HG2 . 10236 1 1534 . 2 2 112 112 VAL HG23 H 1 0.601 0.030 . 1 . . . . 167 VAL HG2 . 10236 1 1535 . 2 2 112 112 VAL C C 13 173.478 0.300 . 1 . . . . 167 VAL C . 10236 1 1536 . 2 2 112 112 VAL CA C 13 61.526 0.300 . 1 . . . . 167 VAL CA . 10236 1 1537 . 2 2 112 112 VAL CB C 13 33.552 0.300 . 1 . . . . 167 VAL CB . 10236 1 1538 . 2 2 112 112 VAL CG1 C 13 24.005 0.300 . 2 . . . . 167 VAL CG1 . 10236 1 1539 . 2 2 112 112 VAL CG2 C 13 22.462 0.300 . 2 . . . . 167 VAL CG2 . 10236 1 1540 . 2 2 112 112 VAL N N 15 119.874 0.300 . 1 . . . . 167 VAL N . 10236 1 1541 . 2 2 113 113 PHE H H 1 9.502 0.030 . 1 . . . . 168 PHE H . 10236 1 1542 . 2 2 113 113 PHE HA H 1 5.443 0.030 . 1 . . . . 168 PHE HA . 10236 1 1543 . 2 2 113 113 PHE HB2 H 1 3.218 0.030 . 2 . . . . 168 PHE HB2 . 10236 1 1544 . 2 2 113 113 PHE HB3 H 1 2.792 0.030 . 2 . . . . 168 PHE HB3 . 10236 1 1545 . 2 2 113 113 PHE HD1 H 1 7.254 0.030 . 1 . . . . 168 PHE HD1 . 10236 1 1546 . 2 2 113 113 PHE HD2 H 1 7.254 0.030 . 1 . . . . 168 PHE HD2 . 10236 1 1547 . 2 2 113 113 PHE HE1 H 1 6.904 0.030 . 1 . . . . 168 PHE HE1 . 10236 1 1548 . 2 2 113 113 PHE HE2 H 1 6.904 0.030 . 1 . . . . 168 PHE HE2 . 10236 1 1549 . 2 2 113 113 PHE HZ H 1 6.778 0.030 . 1 . . . . 168 PHE HZ . 10236 1 1550 . 2 2 113 113 PHE C C 13 173.381 0.300 . 1 . . . . 168 PHE C . 10236 1 1551 . 2 2 113 113 PHE CA C 13 56.847 0.300 . 1 . . . . 168 PHE CA . 10236 1 1552 . 2 2 113 113 PHE CB C 13 43.228 0.300 . 1 . . . . 168 PHE CB . 10236 1 1553 . 2 2 113 113 PHE CD1 C 13 132.490 0.300 . 1 . . . . 168 PHE CD1 . 10236 1 1554 . 2 2 113 113 PHE CD2 C 13 132.490 0.300 . 1 . . . . 168 PHE CD2 . 10236 1 1555 . 2 2 113 113 PHE CE1 C 13 131.673 0.300 . 1 . . . . 168 PHE CE1 . 10236 1 1556 . 2 2 113 113 PHE CE2 C 13 131.673 0.300 . 1 . . . . 168 PHE CE2 . 10236 1 1557 . 2 2 113 113 PHE CZ C 13 128.010 0.300 . 1 . . . . 168 PHE CZ . 10236 1 1558 . 2 2 113 113 PHE N N 15 124.064 0.300 . 1 . . . . 168 PHE N . 10236 1 1559 . 2 2 114 114 TRP H H 1 9.308 0.030 . 1 . . . . 169 TRP H . 10236 1 1560 . 2 2 114 114 TRP HA H 1 4.864 0.030 . 1 . . . . 169 TRP HA . 10236 1 1561 . 2 2 114 114 TRP HB2 H 1 2.919 0.030 . 2 . . . . 169 TRP HB2 . 10236 1 1562 . 2 2 114 114 TRP HB3 H 1 3.209 0.030 . 2 . . . . 169 TRP HB3 . 10236 1 1563 . 2 2 114 114 TRP HD1 H 1 7.302 0.030 . 1 . . . . 169 TRP HD1 . 10236 1 1564 . 2 2 114 114 TRP HE1 H 1 10.655 0.030 . 1 . . . . 169 TRP HE1 . 10236 1 1565 . 2 2 114 114 TRP HE3 H 1 7.248 0.030 . 1 . . . . 169 TRP HE3 . 10236 1 1566 . 2 2 114 114 TRP HH2 H 1 7.163 0.030 . 1 . . . . 169 TRP HH2 . 10236 1 1567 . 2 2 114 114 TRP HZ2 H 1 6.556 0.030 . 1 . . . . 169 TRP HZ2 . 10236 1 1568 . 2 2 114 114 TRP HZ3 H 1 7.010 0.030 . 1 . . . . 169 TRP HZ3 . 10236 1 1569 . 2 2 114 114 TRP C C 13 176.094 0.300 . 1 . . . . 169 TRP C . 10236 1 1570 . 2 2 114 114 TRP CA C 13 56.683 0.300 . 1 . . . . 169 TRP CA . 10236 1 1571 . 2 2 114 114 TRP CB C 13 31.282 0.300 . 1 . . . . 169 TRP CB . 10236 1 1572 . 2 2 114 114 TRP CD1 C 13 127.241 0.300 . 1 . . . . 169 TRP CD1 . 10236 1 1573 . 2 2 114 114 TRP CE3 C 13 120.476 0.300 . 1 . . . . 169 TRP CE3 . 10236 1 1574 . 2 2 114 114 TRP CH2 C 13 124.650 0.300 . 1 . . . . 169 TRP CH2 . 10236 1 1575 . 2 2 114 114 TRP CZ2 C 13 114.143 0.300 . 1 . . . . 169 TRP CZ2 . 10236 1 1576 . 2 2 114 114 TRP CZ3 C 13 121.421 0.300 . 1 . . . . 169 TRP CZ3 . 10236 1 1577 . 2 2 114 114 TRP N N 15 122.423 0.300 . 1 . . . . 169 TRP N . 10236 1 1578 . 2 2 114 114 TRP NE1 N 15 131.731 0.300 . 1 . . . . 169 TRP NE1 . 10236 1 1579 . 2 2 115 115 CYS H H 1 9.324 0.030 . 1 . . . . 170 CYS H . 10236 1 1580 . 2 2 115 115 CYS HA H 1 4.816 0.030 . 1 . . . . 170 CYS HA . 10236 1 1581 . 2 2 115 115 CYS HB2 H 1 2.814 0.030 . 2 . . . . 170 CYS HB2 . 10236 1 1582 . 2 2 115 115 CYS HB3 H 1 2.389 0.030 . 2 . . . . 170 CYS HB3 . 10236 1 1583 . 2 2 115 115 CYS C C 13 172.993 0.300 . 1 . . . . 170 CYS C . 10236 1 1584 . 2 2 115 115 CYS CA C 13 57.094 0.300 . 1 . . . . 170 CYS CA . 10236 1 1585 . 2 2 115 115 CYS CB C 13 30.788 0.300 . 1 . . . . 170 CYS CB . 10236 1 1586 . 2 2 115 115 CYS N N 15 129.667 0.300 . 1 . . . . 170 CYS N . 10236 1 1587 . 2 2 116 116 GLU H H 1 8.838 0.030 . 1 . . . . 171 GLU H . 10236 1 1588 . 2 2 116 116 GLU HA H 1 4.696 0.030 . 1 . . . . 171 GLU HA . 10236 1 1589 . 2 2 116 116 GLU HB2 H 1 1.942 0.030 . 2 . . . . 171 GLU HB2 . 10236 1 1590 . 2 2 116 116 GLU HB3 H 1 2.164 0.030 . 2 . . . . 171 GLU HB3 . 10236 1 1591 . 2 2 116 116 GLU HG2 H 1 2.493 0.030 . 2 . . . . 171 GLU HG2 . 10236 1 1592 . 2 2 116 116 GLU HG3 H 1 2.648 0.030 . 2 . . . . 171 GLU HG3 . 10236 1 1593 . 2 2 116 116 GLU CA C 13 53.559 0.300 . 1 . . . . 171 GLU CA . 10236 1 1594 . 2 2 116 116 GLU CB C 13 30.953 0.300 . 1 . . . . 171 GLU CB . 10236 1 1595 . 2 2 116 116 GLU CG C 13 35.014 0.300 . 1 . . . . 171 GLU CG . 10236 1 1596 . 2 2 116 116 GLU N N 15 120.031 0.300 . 1 . . . . 171 GLU N . 10236 1 1597 . 2 2 117 117 PRO HA H 1 5.097 0.030 . 1 . . . . 172 PRO HA . 10236 1 1598 . 2 2 117 117 PRO HB2 H 1 2.153 0.030 . 2 . . . . 172 PRO HB2 . 10236 1 1599 . 2 2 117 117 PRO HB3 H 1 2.500 0.030 . 2 . . . . 172 PRO HB3 . 10236 1 1600 . 2 2 117 117 PRO HD2 H 1 3.581 0.030 . 2 . . . . 172 PRO HD2 . 10236 1 1601 . 2 2 117 117 PRO HD3 H 1 3.892 0.030 . 2 . . . . 172 PRO HD3 . 10236 1 1602 . 2 2 117 117 PRO HG2 H 1 1.788 0.030 . 2 . . . . 172 PRO HG2 . 10236 1 1603 . 2 2 117 117 PRO HG3 H 1 2.110 0.030 . 2 . . . . 172 PRO HG3 . 10236 1 1604 . 2 2 117 117 PRO C C 13 175.319 0.300 . 1 . . . . 172 PRO C . 10236 1 1605 . 2 2 117 117 PRO CA C 13 64.241 0.300 . 1 . . . . 172 PRO CA . 10236 1 1606 . 2 2 117 117 PRO CB C 13 33.830 0.300 . 1 . . . . 172 PRO CB . 10236 1 1607 . 2 2 117 117 PRO CD C 13 49.815 0.300 . 1 . . . . 172 PRO CD . 10236 1 1608 . 2 2 117 117 PRO CG C 13 24.717 0.300 . 1 . . . . 172 PRO CG . 10236 1 1609 . 2 2 118 118 ASN H H 1 7.398 0.030 . 1 . . . . 173 ASN H . 10236 1 1610 . 2 2 118 118 ASN HA H 1 3.837 0.030 . 1 . . . . 173 ASN HA . 10236 1 1611 . 2 2 118 118 ASN HB2 H 1 2.938 0.030 . 2 . . . . 173 ASN HB2 . 10236 1 1612 . 2 2 118 118 ASN HB3 H 1 2.246 0.030 . 2 . . . . 173 ASN HB3 . 10236 1 1613 . 2 2 118 118 ASN HD21 H 1 7.802 0.030 . 2 . . . . 173 ASN HD21 . 10236 1 1614 . 2 2 118 118 ASN HD22 H 1 7.328 0.030 . 2 . . . . 173 ASN HD22 . 10236 1 1615 . 2 2 118 118 ASN C C 13 174.398 0.300 . 1 . . . . 173 ASN C . 10236 1 1616 . 2 2 118 118 ASN CA C 13 52.577 0.300 . 1 . . . . 173 ASN CA . 10236 1 1617 . 2 2 118 118 ASN CB C 13 38.509 0.300 . 1 . . . . 173 ASN CB . 10236 1 1618 . 2 2 118 118 ASN N N 15 110.784 0.300 . 1 . . . . 173 ASN N . 10236 1 1619 . 2 2 118 118 ASN ND2 N 15 117.654 0.300 . 1 . . . . 173 ASN ND2 . 10236 1 1620 . 2 2 119 119 ALA H H 1 8.550 0.030 . 1 . . . . 174 ALA H . 10236 1 1621 . 2 2 119 119 ALA HA H 1 4.192 0.030 . 1 . . . . 174 ALA HA . 10236 1 1622 . 2 2 119 119 ALA HB1 H 1 1.275 0.030 . 1 . . . . 174 ALA HB . 10236 1 1623 . 2 2 119 119 ALA HB2 H 1 1.275 0.030 . 1 . . . . 174 ALA HB . 10236 1 1624 . 2 2 119 119 ALA HB3 H 1 1.275 0.030 . 1 . . . . 174 ALA HB . 10236 1 1625 . 2 2 119 119 ALA C C 13 177.693 0.300 . 1 . . . . 174 ALA C . 10236 1 1626 . 2 2 119 119 ALA CA C 13 52.629 0.300 . 1 . . . . 174 ALA CA . 10236 1 1627 . 2 2 119 119 ALA CB C 13 20.711 0.300 . 1 . . . . 174 ALA CB . 10236 1 1628 . 2 2 119 119 ALA N N 15 116.042 0.300 . 1 . . . . 174 ALA N . 10236 1 1629 . 2 2 120 120 ALA H H 1 9.090 0.030 . 1 . . . . 175 ALA H . 10236 1 1630 . 2 2 120 120 ALA HA H 1 3.593 0.030 . 1 . . . . 175 ALA HA . 10236 1 1631 . 2 2 120 120 ALA HB1 H 1 1.391 0.030 . 1 . . . . 175 ALA HB . 10236 1 1632 . 2 2 120 120 ALA HB2 H 1 1.391 0.030 . 1 . . . . 175 ALA HB . 10236 1 1633 . 2 2 120 120 ALA HB3 H 1 1.391 0.030 . 1 . . . . 175 ALA HB . 10236 1 1634 . 2 2 120 120 ALA C C 13 177.596 0.300 . 1 . . . . 175 ALA C . 10236 1 1635 . 2 2 120 120 ALA CA C 13 57.695 0.300 . 1 . . . . 175 ALA CA . 10236 1 1636 . 2 2 120 120 ALA CB C 13 18.257 0.300 . 1 . . . . 175 ALA CB . 10236 1 1637 . 2 2 120 120 ALA N N 15 125.370 0.300 . 1 . . . . 175 ALA N . 10236 1 1638 . 2 2 121 121 ASN H H 1 8.500 0.030 . 1 . . . . 176 ASN H . 10236 1 1639 . 2 2 121 121 ASN HA H 1 4.258 0.030 . 1 . . . . 176 ASN HA . 10236 1 1640 . 2 2 121 121 ASN HB2 H 1 2.872 0.030 . 2 . . . . 176 ASN HB2 . 10236 1 1641 . 2 2 121 121 ASN HB3 H 1 2.756 0.030 . 2 . . . . 176 ASN HB3 . 10236 1 1642 . 2 2 121 121 ASN HD21 H 1 7.679 0.030 . 2 . . . . 176 ASN HD21 . 10236 1 1643 . 2 2 121 121 ASN HD22 H 1 7.005 0.030 . 2 . . . . 176 ASN HD22 . 10236 1 1644 . 2 2 121 121 ASN C C 13 178.250 0.300 . 1 . . . . 176 ASN C . 10236 1 1645 . 2 2 121 121 ASN CA C 13 56.108 0.300 . 1 . . . . 176 ASN CA . 10236 1 1646 . 2 2 121 121 ASN CB C 13 37.200 0.300 . 1 . . . . 176 ASN CB . 10236 1 1647 . 2 2 121 121 ASN N N 15 116.653 0.300 . 1 . . . . 176 ASN N . 10236 1 1648 . 2 2 121 121 ASN ND2 N 15 111.299 0.300 . 1 . . . . 176 ASN ND2 . 10236 1 1649 . 2 2 122 122 VAL H H 1 8.200 0.030 . 1 . . . . 177 VAL H . 10236 1 1650 . 2 2 122 122 VAL HA H 1 2.188 0.030 . 1 . . . . 177 VAL HA . 10236 1 1651 . 2 2 122 122 VAL HB H 1 1.060 0.030 . 1 . . . . 177 VAL HB . 10236 1 1652 . 2 2 122 122 VAL HG11 H 1 -0.179 0.030 . 1 . . . . 177 VAL HG1 . 10236 1 1653 . 2 2 122 122 VAL HG12 H 1 -0.179 0.030 . 1 . . . . 177 VAL HG1 . 10236 1 1654 . 2 2 122 122 VAL HG13 H 1 -0.179 0.030 . 1 . . . . 177 VAL HG1 . 10236 1 1655 . 2 2 122 122 VAL HG21 H 1 0.159 0.030 . 1 . . . . 177 VAL HG2 . 10236 1 1656 . 2 2 122 122 VAL HG22 H 1 0.159 0.030 . 1 . . . . 177 VAL HG2 . 10236 1 1657 . 2 2 122 122 VAL HG23 H 1 0.159 0.030 . 1 . . . . 177 VAL HG2 . 10236 1 1658 . 2 2 122 122 VAL C C 13 176.239 0.300 . 1 . . . . 177 VAL C . 10236 1 1659 . 2 2 122 122 VAL CA C 13 65.343 0.300 . 1 . . . . 177 VAL CA . 10236 1 1660 . 2 2 122 122 VAL CB C 13 31.629 0.300 . 1 . . . . 177 VAL CB . 10236 1 1661 . 2 2 122 122 VAL CG1 C 13 20.844 0.300 . 2 . . . . 177 VAL CG1 . 10236 1 1662 . 2 2 122 122 VAL CG2 C 13 23.023 0.300 . 2 . . . . 177 VAL CG2 . 10236 1 1663 . 2 2 122 122 VAL N N 15 121.984 0.300 . 1 . . . . 177 VAL N . 10236 1 1664 . 2 2 123 123 SER H H 1 7.311 0.030 . 1 . . . . 178 SER H . 10236 1 1665 . 2 2 123 123 SER HA H 1 3.221 0.030 . 1 . . . . 178 SER HA . 10236 1 1666 . 2 2 123 123 SER HB2 H 1 3.667 0.030 . 2 . . . . 178 SER HB2 . 10236 1 1667 . 2 2 123 123 SER HB3 H 1 3.588 0.030 . 2 . . . . 178 SER HB3 . 10236 1 1668 . 2 2 123 123 SER C C 13 176.288 0.300 . 1 . . . . 178 SER C . 10236 1 1669 . 2 2 123 123 SER CA C 13 61.286 0.300 . 1 . . . . 178 SER CA . 10236 1 1670 . 2 2 123 123 SER CB C 13 63.394 0.300 . 1 . . . . 178 SER CB . 10236 1 1671 . 2 2 123 123 SER N N 15 112.229 0.300 . 1 . . . . 178 SER N . 10236 1 1672 . 2 2 124 124 GLU H H 1 7.979 0.030 . 1 . . . . 179 GLU H . 10236 1 1673 . 2 2 124 124 GLU HA H 1 3.640 0.030 . 1 . . . . 179 GLU HA . 10236 1 1674 . 2 2 124 124 GLU HB2 H 1 1.754 0.030 . 2 . . . . 179 GLU HB2 . 10236 1 1675 . 2 2 124 124 GLU HB3 H 1 1.493 0.030 . 2 . . . . 179 GLU HB3 . 10236 1 1676 . 2 2 124 124 GLU HG2 H 1 1.830 0.030 . 2 . . . . 179 GLU HG2 . 10236 1 1677 . 2 2 124 124 GLU HG3 H 1 1.670 0.030 . 2 . . . . 179 GLU HG3 . 10236 1 1678 . 2 2 124 124 GLU C C 13 178.298 0.300 . 1 . . . . 179 GLU C . 10236 1 1679 . 2 2 124 124 GLU CA C 13 59.971 0.300 . 1 . . . . 179 GLU CA . 10236 1 1680 . 2 2 124 124 GLU CB C 13 29.394 0.300 . 1 . . . . 179 GLU CB . 10236 1 1681 . 2 2 124 124 GLU CG C 13 35.925 0.300 . 1 . . . . 179 GLU CG . 10236 1 1682 . 2 2 124 124 GLU N N 15 122.726 0.300 . 1 . . . . 179 GLU N . 10236 1 1683 . 2 2 125 125 ALA H H 1 7.490 0.030 . 1 . . . . 180 ALA H . 10236 1 1684 . 2 2 125 125 ALA HA H 1 4.108 0.030 . 1 . . . . 180 ALA HA . 10236 1 1685 . 2 2 125 125 ALA HB1 H 1 1.439 0.030 . 1 . . . . 180 ALA HB . 10236 1 1686 . 2 2 125 125 ALA HB2 H 1 1.439 0.030 . 1 . . . . 180 ALA HB . 10236 1 1687 . 2 2 125 125 ALA HB3 H 1 1.439 0.030 . 1 . . . . 180 ALA HB . 10236 1 1688 . 2 2 125 125 ALA C C 13 180.672 0.300 . 1 . . . . 180 ALA C . 10236 1 1689 . 2 2 125 125 ALA CA C 13 54.823 0.300 . 1 . . . . 180 ALA CA . 10236 1 1690 . 2 2 125 125 ALA CB C 13 18.858 0.300 . 1 . . . . 180 ALA CB . 10236 1 1691 . 2 2 125 125 ALA N N 15 121.488 0.300 . 1 . . . . 180 ALA N . 10236 1 1692 . 2 2 126 126 VAL H H 1 8.118 0.030 . 1 . . . . 181 VAL H . 10236 1 1693 . 2 2 126 126 VAL HA H 1 3.325 0.030 . 1 . . . . 181 VAL HA . 10236 1 1694 . 2 2 126 126 VAL HB H 1 1.871 0.030 . 1 . . . . 181 VAL HB . 10236 1 1695 . 2 2 126 126 VAL HG11 H 1 0.725 0.030 . 1 . . . . 181 VAL HG1 . 10236 1 1696 . 2 2 126 126 VAL HG12 H 1 0.725 0.030 . 1 . . . . 181 VAL HG1 . 10236 1 1697 . 2 2 126 126 VAL HG13 H 1 0.725 0.030 . 1 . . . . 181 VAL HG1 . 10236 1 1698 . 2 2 126 126 VAL HG21 H 1 0.745 0.030 . 1 . . . . 181 VAL HG2 . 10236 1 1699 . 2 2 126 126 VAL HG22 H 1 0.745 0.030 . 1 . . . . 181 VAL HG2 . 10236 1 1700 . 2 2 126 126 VAL HG23 H 1 0.745 0.030 . 1 . . . . 181 VAL HG2 . 10236 1 1701 . 2 2 126 126 VAL C C 13 177.523 0.300 . 1 . . . . 181 VAL C . 10236 1 1702 . 2 2 126 126 VAL CA C 13 66.928 0.300 . 1 . . . . 181 VAL CA . 10236 1 1703 . 2 2 126 126 VAL CB C 13 31.244 0.300 . 1 . . . . 181 VAL CB . 10236 1 1704 . 2 2 126 126 VAL CG1 C 13 23.560 0.300 . 2 . . . . 181 VAL CG1 . 10236 1 1705 . 2 2 126 126 VAL CG2 C 13 23.143 0.300 . 2 . . . . 181 VAL CG2 . 10236 1 1706 . 2 2 126 126 VAL N N 15 119.481 0.300 . 1 . . . . 181 VAL N . 10236 1 1707 . 2 2 127 127 GLN H H 1 8.230 0.030 . 1 . . . . 182 GLN H . 10236 1 1708 . 2 2 127 127 GLN HA H 1 3.429 0.030 . 1 . . . . 182 GLN HA . 10236 1 1709 . 2 2 127 127 GLN HB2 H 1 1.738 0.030 . 2 . . . . 182 GLN HB2 . 10236 1 1710 . 2 2 127 127 GLN HB3 H 1 1.928 0.030 . 2 . . . . 182 GLN HB3 . 10236 1 1711 . 2 2 127 127 GLN HE21 H 1 6.456 0.030 . 2 . . . . 182 GLN HE21 . 10236 1 1712 . 2 2 127 127 GLN HE22 H 1 5.947 0.030 . 2 . . . . 182 GLN HE22 . 10236 1 1713 . 2 2 127 127 GLN HG2 H 1 1.559 0.030 . 2 . . . . 182 GLN HG2 . 10236 1 1714 . 2 2 127 127 GLN HG3 H 1 0.914 0.030 . 2 . . . . 182 GLN HG3 . 10236 1 1715 . 2 2 127 127 GLN C C 13 178.686 0.300 . 1 . . . . 182 GLN C . 10236 1 1716 . 2 2 127 127 GLN CA C 13 60.334 0.300 . 1 . . . . 182 GLN CA . 10236 1 1717 . 2 2 127 127 GLN CB C 13 28.491 0.300 . 1 . . . . 182 GLN CB . 10236 1 1718 . 2 2 127 127 GLN CG C 13 32.697 0.300 . 1 . . . . 182 GLN CG . 10236 1 1719 . 2 2 127 127 GLN N N 15 120.995 0.300 . 1 . . . . 182 GLN N . 10236 1 1720 . 2 2 127 127 GLN NE2 N 15 108.499 0.300 . 1 . . . . 182 GLN NE2 . 10236 1 1721 . 2 2 128 128 ALA H H 1 8.115 0.030 . 1 . . . . 183 ALA H . 10236 1 1722 . 2 2 128 128 ALA HA H 1 3.998 0.030 . 1 . . . . 183 ALA HA . 10236 1 1723 . 2 2 128 128 ALA HB1 H 1 1.398 0.030 . 1 . . . . 183 ALA HB . 10236 1 1724 . 2 2 128 128 ALA HB2 H 1 1.398 0.030 . 1 . . . . 183 ALA HB . 10236 1 1725 . 2 2 128 128 ALA HB3 H 1 1.398 0.030 . 1 . . . . 183 ALA HB . 10236 1 1726 . 2 2 128 128 ALA C C 13 180.406 0.300 . 1 . . . . 183 ALA C . 10236 1 1727 . 2 2 128 128 ALA CA C 13 54.801 0.300 . 1 . . . . 183 ALA CA . 10236 1 1728 . 2 2 128 128 ALA CB C 13 17.795 0.300 . 1 . . . . 183 ALA CB . 10236 1 1729 . 2 2 128 128 ALA N N 15 121.344 0.300 . 1 . . . . 183 ALA N . 10236 1 1730 . 2 2 129 129 ALA H H 1 7.570 0.030 . 1 . . . . 184 ALA H . 10236 1 1731 . 2 2 129 129 ALA HA H 1 4.166 0.030 . 1 . . . . 184 ALA HA . 10236 1 1732 . 2 2 129 129 ALA HB1 H 1 1.355 0.030 . 1 . . . . 184 ALA HB . 10236 1 1733 . 2 2 129 129 ALA HB2 H 1 1.355 0.030 . 1 . . . . 184 ALA HB . 10236 1 1734 . 2 2 129 129 ALA HB3 H 1 1.355 0.030 . 1 . . . . 184 ALA HB . 10236 1 1735 . 2 2 129 129 ALA C C 13 179.073 0.300 . 1 . . . . 184 ALA C . 10236 1 1736 . 2 2 129 129 ALA CA C 13 54.141 0.300 . 1 . . . . 184 ALA CA . 10236 1 1737 . 2 2 129 129 ALA CB C 13 17.662 0.300 . 1 . . . . 184 ALA CB . 10236 1 1738 . 2 2 129 129 ALA N N 15 120.893 0.300 . 1 . . . . 184 ALA N . 10236 1 1739 . 2 2 130 130 CYS H H 1 7.513 0.030 . 1 . . . . 185 CYS H . 10236 1 1740 . 2 2 130 130 CYS HA H 1 4.126 0.030 . 1 . . . . 185 CYS HA . 10236 1 1741 . 2 2 130 130 CYS HB2 H 1 3.334 0.030 . 2 . . . . 185 CYS HB2 . 10236 1 1742 . 2 2 130 130 CYS HB3 H 1 3.212 0.030 . 2 . . . . 185 CYS HB3 . 10236 1 1743 . 2 2 130 130 CYS C C 13 174.883 0.300 . 1 . . . . 185 CYS C . 10236 1 1744 . 2 2 130 130 CYS CA C 13 61.862 0.300 . 1 . . . . 185 CYS CA . 10236 1 1745 . 2 2 130 130 CYS CB C 13 28.526 0.300 . 1 . . . . 185 CYS CB . 10236 1 1746 . 2 2 130 130 CYS N N 15 114.315 0.300 . 1 . . . . 185 CYS N . 10236 1 1747 . 2 2 131 131 SER H H 1 7.738 0.030 . 1 . . . . 186 SER H . 10236 1 1748 . 2 2 131 131 SER HA H 1 4.409 0.030 . 1 . . . . 186 SER HA . 10236 1 1749 . 2 2 131 131 SER HB2 H 1 3.950 0.030 . 1 . . . . 186 SER HB2 . 10236 1 1750 . 2 2 131 131 SER HB3 H 1 3.950 0.030 . 1 . . . . 186 SER HB3 . 10236 1 1751 . 2 2 131 131 SER C C 13 175.004 0.300 . 1 . . . . 186 SER C . 10236 1 1752 . 2 2 131 131 SER CA C 13 59.229 0.300 . 1 . . . . 186 SER CA . 10236 1 1753 . 2 2 131 131 SER CB C 13 64.179 0.300 . 1 . . . . 186 SER CB . 10236 1 1754 . 2 2 131 131 SER N N 15 112.130 0.300 . 1 . . . . 186 SER N . 10236 1 1755 . 2 2 132 132 GLY H H 1 7.930 0.030 . 1 . . . . 187 GLY H . 10236 1 1756 . 2 2 132 132 GLY HA2 H 1 4.141 0.030 . 2 . . . . 187 GLY HA2 . 10236 1 1757 . 2 2 132 132 GLY HA3 H 1 4.073 0.030 . 2 . . . . 187 GLY HA3 . 10236 1 1758 . 2 2 132 132 GLY CA C 13 44.991 0.300 . 1 . . . . 187 GLY CA . 10236 1 1759 . 2 2 132 132 GLY N N 15 110.009 0.300 . 1 . . . . 187 GLY N . 10236 1 1760 . 2 2 133 133 PRO HA H 1 4.458 0.030 . 1 . . . . 188 PRO HA . 10236 1 1761 . 2 2 133 133 PRO HB2 H 1 1.939 0.030 . 2 . . . . 188 PRO HB2 . 10236 1 1762 . 2 2 133 133 PRO HB3 H 1 2.259 0.030 . 2 . . . . 188 PRO HB3 . 10236 1 1763 . 2 2 133 133 PRO HD2 H 1 3.603 0.030 . 1 . . . . 188 PRO HD2 . 10236 1 1764 . 2 2 133 133 PRO HD3 H 1 3.603 0.030 . 1 . . . . 188 PRO HD3 . 10236 1 1765 . 2 2 133 133 PRO HG2 H 1 1.987 0.030 . 1 . . . . 188 PRO HG2 . 10236 1 1766 . 2 2 133 133 PRO HG3 H 1 1.987 0.030 . 1 . . . . 188 PRO HG3 . 10236 1 1767 . 2 2 133 133 PRO C C 13 177.353 0.300 . 1 . . . . 188 PRO C . 10236 1 1768 . 2 2 133 133 PRO CA C 13 63.111 0.300 . 1 . . . . 188 PRO CA . 10236 1 1769 . 2 2 133 133 PRO CB C 13 32.021 0.300 . 1 . . . . 188 PRO CB . 10236 1 1770 . 2 2 133 133 PRO CD C 13 49.942 0.300 . 1 . . . . 188 PRO CD . 10236 1 1771 . 2 2 133 133 PRO CG C 13 27.171 0.300 . 1 . . . . 188 PRO CG . 10236 1 1772 . 2 2 134 134 SER H H 1 8.514 0.030 . 1 . . . . 189 SER H . 10236 1 1773 . 2 2 134 134 SER CA C 13 58.080 0.300 . 1 . . . . 189 SER CA . 10236 1 1774 . 2 2 134 134 SER CB C 13 64.081 0.300 . 1 . . . . 189 SER CB . 10236 1 1775 . 2 2 134 134 SER N N 15 116.401 0.300 . 1 . . . . 189 SER N . 10236 1 stop_ save_