data_10125 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 10125 _Entry.Title ; Solution structure of the dsRBD from hypothetical protein BAB26260 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-04-02 _Entry.Accession_date 2007-04-04 _Entry.Last_release_date 2008-09-02 _Entry.Original_release_date 2008-09-02 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version production.3.0.2.8 _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 T. Nagata . . . 10125 2 Y. Muto . . . 10125 3 M. Inoue . . . 10125 4 T. Kigawa . . . 10125 5 T. Terada . . . 10125 6 M. Shirouzu . . . 10125 7 S. Yokoyama . . . 10125 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' 10125 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 10125 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 547 10125 '15N chemical shifts' 124 10125 '1H chemical shifts' 857 10125 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 . . 2008-09-02 2007-04-02 original author . 10125 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1WHN 'BMRB Entry Tracking System' 10125 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 10125 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Solution structure of the dsRBD from hypothetical protein BAB26260' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Not known' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 T. Nagata . . . 10125 1 2 Y. Muto . . . 10125 1 3 M. Inoue . . . 10125 1 4 T. Kigawa . . . 10125 1 5 T. Terada . . . 10125 1 6 M. Shirouzu . . . 10125 1 7 S. Yokoyama . . . 10125 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 10125 _Assembly.ID 1 _Assembly.Name 'hypothetical protein RIKEN cDNA 2310016K04' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _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 'hypothetical protein RIKEN cDNA 2310016K04' 1 $entity_1 A . yes native no no . . . 10125 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 1WHN . . 'solution NMR' . . . 10125 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 10125 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'double-stranded RNA binding 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 ; GSSGSSGSGIIKMAIRFDRR AYPPQITPKMCLLEWCRREK LPQPVYETVQRTIDRMFCSV VTVAEQKYQSTLWDKSKKLA EQTAAIVCLRSQGLPEGRLG EESPSLNKRKREAPDQDPGG PRSGPSSG ; _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 128 _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 2015-11-26 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 PDB 1WHN . "Solution Structure Of The Dsrbd From Hypothetical Protein Bab26260" . . . . . 100.00 128 100.00 100.00 1.40e-86 . . . . 10125 1 2 no DBJ BAB26260 . "unnamed protein product [Mus musculus]" . . . . . 89.84 493 100.00 100.00 6.58e-75 . . . . 10125 1 3 no GB AAH58431 . "Dus2l protein, partial [Mus musculus]" . . . . . 89.84 289 100.00 100.00 1.16e-76 . . . . 10125 1 4 no GB AAI16935 . "Dihydrouridine synthase 2-like (SMM1, S. cerevisiae) [Mus musculus]" . . . . . 89.84 493 100.00 100.00 6.58e-75 . . . . 10125 1 5 no GB AAI16937 . "Dihydrouridine synthase 2-like (SMM1, S. cerevisiae) [Mus musculus]" . . . . . 89.84 493 100.00 100.00 6.58e-75 . . . . 10125 1 6 no GB EDL11340 . "mCG20459, isoform CRA_a [Mus musculus]" . . . . . 89.84 380 100.00 100.00 1.40e-75 . . . . 10125 1 7 no GB EDL11341 . "mCG20459, isoform CRA_b [Mus musculus]" . . . . . 89.84 493 100.00 100.00 6.58e-75 . . . . 10125 1 8 no REF NP_001288105 . "tRNA-dihydrouridine(20) synthase [NAD(P)+]-like isoform 2 [Mus musculus]" . . . . . 89.84 380 100.00 100.00 1.40e-75 . . . . 10125 1 9 no REF NP_079794 . "tRNA-dihydrouridine(20) synthase [NAD(P)+]-like isoform 1 [Mus musculus]" . . . . . 89.84 493 100.00 100.00 6.58e-75 . . . . 10125 1 10 no REF XP_006531341 . "PREDICTED: tRNA-dihydrouridine(20) synthase [NAD(P)+]-like isoform X1 [Mus musculus]" . . . . . 89.84 493 100.00 100.00 6.58e-75 . . . . 10125 1 11 no REF XP_006986898 . "PREDICTED: tRNA-dihydrouridine(20) synthase [NAD(P)+]-like [Peromyscus maniculatus bairdii]" . . . . . 89.84 493 98.26 99.13 2.10e-73 . . . . 10125 1 12 no SP Q9D7B1 . "RecName: Full=tRNA-dihydrouridine(20) synthase [NAD(P)+]-like; AltName: Full=Dihydrouridine synthase 2; AltName: Full=tRNA-dihy" . . . . . 89.84 493 100.00 100.00 6.58e-75 . . . . 10125 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'double-stranded RNA binding domain' . 10125 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 10125 1 2 . SER . 10125 1 3 . SER . 10125 1 4 . GLY . 10125 1 5 . SER . 10125 1 6 . SER . 10125 1 7 . GLY . 10125 1 8 . SER . 10125 1 9 . GLY . 10125 1 10 . ILE . 10125 1 11 . ILE . 10125 1 12 . LYS . 10125 1 13 . MET . 10125 1 14 . ALA . 10125 1 15 . ILE . 10125 1 16 . ARG . 10125 1 17 . PHE . 10125 1 18 . ASP . 10125 1 19 . ARG . 10125 1 20 . ARG . 10125 1 21 . ALA . 10125 1 22 . TYR . 10125 1 23 . PRO . 10125 1 24 . PRO . 10125 1 25 . GLN . 10125 1 26 . ILE . 10125 1 27 . THR . 10125 1 28 . PRO . 10125 1 29 . LYS . 10125 1 30 . MET . 10125 1 31 . CYS . 10125 1 32 . LEU . 10125 1 33 . LEU . 10125 1 34 . GLU . 10125 1 35 . TRP . 10125 1 36 . CYS . 10125 1 37 . ARG . 10125 1 38 . ARG . 10125 1 39 . GLU . 10125 1 40 . LYS . 10125 1 41 . LEU . 10125 1 42 . PRO . 10125 1 43 . GLN . 10125 1 44 . PRO . 10125 1 45 . VAL . 10125 1 46 . TYR . 10125 1 47 . GLU . 10125 1 48 . THR . 10125 1 49 . VAL . 10125 1 50 . GLN . 10125 1 51 . ARG . 10125 1 52 . THR . 10125 1 53 . ILE . 10125 1 54 . ASP . 10125 1 55 . ARG . 10125 1 56 . MET . 10125 1 57 . PHE . 10125 1 58 . CYS . 10125 1 59 . SER . 10125 1 60 . VAL . 10125 1 61 . VAL . 10125 1 62 . THR . 10125 1 63 . VAL . 10125 1 64 . ALA . 10125 1 65 . GLU . 10125 1 66 . GLN . 10125 1 67 . LYS . 10125 1 68 . TYR . 10125 1 69 . GLN . 10125 1 70 . SER . 10125 1 71 . THR . 10125 1 72 . LEU . 10125 1 73 . TRP . 10125 1 74 . ASP . 10125 1 75 . LYS . 10125 1 76 . SER . 10125 1 77 . LYS . 10125 1 78 . LYS . 10125 1 79 . LEU . 10125 1 80 . ALA . 10125 1 81 . GLU . 10125 1 82 . GLN . 10125 1 83 . THR . 10125 1 84 . ALA . 10125 1 85 . ALA . 10125 1 86 . ILE . 10125 1 87 . VAL . 10125 1 88 . CYS . 10125 1 89 . LEU . 10125 1 90 . ARG . 10125 1 91 . SER . 10125 1 92 . GLN . 10125 1 93 . GLY . 10125 1 94 . LEU . 10125 1 95 . PRO . 10125 1 96 . GLU . 10125 1 97 . GLY . 10125 1 98 . ARG . 10125 1 99 . LEU . 10125 1 100 . GLY . 10125 1 101 . GLU . 10125 1 102 . GLU . 10125 1 103 . SER . 10125 1 104 . PRO . 10125 1 105 . SER . 10125 1 106 . LEU . 10125 1 107 . ASN . 10125 1 108 . LYS . 10125 1 109 . ARG . 10125 1 110 . LYS . 10125 1 111 . ARG . 10125 1 112 . GLU . 10125 1 113 . ALA . 10125 1 114 . PRO . 10125 1 115 . ASP . 10125 1 116 . GLN . 10125 1 117 . ASP . 10125 1 118 . PRO . 10125 1 119 . GLY . 10125 1 120 . GLY . 10125 1 121 . PRO . 10125 1 122 . ARG . 10125 1 123 . SER . 10125 1 124 . GLY . 10125 1 125 . PRO . 10125 1 126 . SER . 10125 1 127 . SER . 10125 1 128 . GLY . 10125 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 10125 1 . SER 2 2 10125 1 . SER 3 3 10125 1 . GLY 4 4 10125 1 . SER 5 5 10125 1 . SER 6 6 10125 1 . GLY 7 7 10125 1 . SER 8 8 10125 1 . GLY 9 9 10125 1 . ILE 10 10 10125 1 . ILE 11 11 10125 1 . LYS 12 12 10125 1 . MET 13 13 10125 1 . ALA 14 14 10125 1 . ILE 15 15 10125 1 . ARG 16 16 10125 1 . PHE 17 17 10125 1 . ASP 18 18 10125 1 . ARG 19 19 10125 1 . ARG 20 20 10125 1 . ALA 21 21 10125 1 . TYR 22 22 10125 1 . PRO 23 23 10125 1 . PRO 24 24 10125 1 . GLN 25 25 10125 1 . ILE 26 26 10125 1 . THR 27 27 10125 1 . PRO 28 28 10125 1 . LYS 29 29 10125 1 . MET 30 30 10125 1 . CYS 31 31 10125 1 . LEU 32 32 10125 1 . LEU 33 33 10125 1 . GLU 34 34 10125 1 . TRP 35 35 10125 1 . CYS 36 36 10125 1 . ARG 37 37 10125 1 . ARG 38 38 10125 1 . GLU 39 39 10125 1 . LYS 40 40 10125 1 . LEU 41 41 10125 1 . PRO 42 42 10125 1 . GLN 43 43 10125 1 . PRO 44 44 10125 1 . VAL 45 45 10125 1 . TYR 46 46 10125 1 . GLU 47 47 10125 1 . THR 48 48 10125 1 . VAL 49 49 10125 1 . GLN 50 50 10125 1 . ARG 51 51 10125 1 . THR 52 52 10125 1 . ILE 53 53 10125 1 . ASP 54 54 10125 1 . ARG 55 55 10125 1 . MET 56 56 10125 1 . PHE 57 57 10125 1 . CYS 58 58 10125 1 . SER 59 59 10125 1 . VAL 60 60 10125 1 . VAL 61 61 10125 1 . THR 62 62 10125 1 . VAL 63 63 10125 1 . ALA 64 64 10125 1 . GLU 65 65 10125 1 . GLN 66 66 10125 1 . LYS 67 67 10125 1 . TYR 68 68 10125 1 . GLN 69 69 10125 1 . SER 70 70 10125 1 . THR 71 71 10125 1 . LEU 72 72 10125 1 . TRP 73 73 10125 1 . ASP 74 74 10125 1 . LYS 75 75 10125 1 . SER 76 76 10125 1 . LYS 77 77 10125 1 . LYS 78 78 10125 1 . LEU 79 79 10125 1 . ALA 80 80 10125 1 . GLU 81 81 10125 1 . GLN 82 82 10125 1 . THR 83 83 10125 1 . ALA 84 84 10125 1 . ALA 85 85 10125 1 . ILE 86 86 10125 1 . VAL 87 87 10125 1 . CYS 88 88 10125 1 . LEU 89 89 10125 1 . ARG 90 90 10125 1 . SER 91 91 10125 1 . GLN 92 92 10125 1 . GLY 93 93 10125 1 . LEU 94 94 10125 1 . PRO 95 95 10125 1 . GLU 96 96 10125 1 . GLY 97 97 10125 1 . ARG 98 98 10125 1 . LEU 99 99 10125 1 . GLY 100 100 10125 1 . GLU 101 101 10125 1 . GLU 102 102 10125 1 . SER 103 103 10125 1 . PRO 104 104 10125 1 . SER 105 105 10125 1 . LEU 106 106 10125 1 . ASN 107 107 10125 1 . LYS 108 108 10125 1 . ARG 109 109 10125 1 . LYS 110 110 10125 1 . ARG 111 111 10125 1 . GLU 112 112 10125 1 . ALA 113 113 10125 1 . PRO 114 114 10125 1 . ASP 115 115 10125 1 . GLN 116 116 10125 1 . ASP 117 117 10125 1 . PRO 118 118 10125 1 . GLY 119 119 10125 1 . GLY 120 120 10125 1 . PRO 121 121 10125 1 . ARG 122 122 10125 1 . SER 123 123 10125 1 . GLY 124 124 10125 1 . PRO 125 125 10125 1 . SER 126 126 10125 1 . SER 127 127 10125 1 . GLY 128 128 10125 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 10125 _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 . . . mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 10125 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 10125 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'cell free synthesis' . . . . . . . . . . . . . . . . . . . plasmid . . P021209-40 . . . . . . 10125 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 10125 _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 'double-stranded RNA binding domain' '[U-13C; U-15N]' . . 1 $entity_1 . . 1.28 . . mM . . . . 10125 1 2 phosphate . . . . . . buffer 20 . . mM . . . . 10125 1 3 NaCl . . . . . . salt 100 . . mM . . . . 10125 1 4 DTT . . . . . . salt 1 . . mM . . . . 10125 1 5 NaN3 . . . . . . . 0.02 . . % . . . . 10125 1 6 H2O . . . . . . solvent 90 . . % . . . . 10125 1 7 D2O . . . . . . solvent 10 . . % . . . . 10125 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 10125 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 100 0.1 mM 10125 1 pH 6.0 0.05 pH 10125 1 pressure 1 0.001 atm 10125 1 temperature 298 0.1 K 10125 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 10125 _Software.ID 1 _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 . . 10125 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10125 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 10125 _Software.ID 2 _Software.Name CYANA _Software.Version 2.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 10125 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 10125 2 'structure solution' 10125 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 10125 _Software.ID 3 _Software.Name NMRPipe _Software.Version 2.3 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 10125 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 10125 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 10125 _Software.ID 4 _Software.Name Kujira _Software.Version 0.901 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 10125 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10125 4 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 10125 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 10125 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker AVANCE . 800 . . . 10125 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 10125 _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 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10125 1 2 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10125 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 10125 _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 . . . . . . . . . 10125 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 10125 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 10125 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 10125 _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 13C-separated NOESY' 1 $sample_1 isotropic 10125 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10125 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 6 6 SER HA H 1 4.482 0.030 . 1 . . . . 6 SER HA . 10125 1 2 . 1 1 6 6 SER HB2 H 1 3.895 0.030 . 1 . . . . 6 SER HB2 . 10125 1 3 . 1 1 6 6 SER HB3 H 1 3.895 0.030 . 1 . . . . 6 SER HB3 . 10125 1 4 . 1 1 6 6 SER C C 13 175.114 0.300 . 1 . . . . 6 SER C . 10125 1 5 . 1 1 6 6 SER CA C 13 58.598 0.300 . 1 . . . . 6 SER CA . 10125 1 6 . 1 1 6 6 SER CB C 13 63.873 0.300 . 1 . . . . 6 SER CB . 10125 1 7 . 1 1 7 7 GLY H H 1 8.422 0.030 . 1 . . . . 7 GLY H . 10125 1 8 . 1 1 7 7 GLY HA2 H 1 4.008 0.030 . 1 . . . . 7 GLY HA2 . 10125 1 9 . 1 1 7 7 GLY HA3 H 1 4.008 0.030 . 1 . . . . 7 GLY HA3 . 10125 1 10 . 1 1 7 7 GLY C C 13 174.315 0.300 . 1 . . . . 7 GLY C . 10125 1 11 . 1 1 7 7 GLY CA C 13 45.469 0.300 . 1 . . . . 7 GLY CA . 10125 1 12 . 1 1 7 7 GLY N N 15 110.832 0.300 . 1 . . . . 7 GLY N . 10125 1 13 . 1 1 8 8 SER H H 1 8.277 0.030 . 1 . . . . 8 SER H . 10125 1 14 . 1 1 8 8 SER HA H 1 4.442 0.030 . 1 . . . . 8 SER HA . 10125 1 15 . 1 1 8 8 SER HB2 H 1 3.882 0.030 . 1 . . . . 8 SER HB2 . 10125 1 16 . 1 1 8 8 SER HB3 H 1 3.882 0.030 . 1 . . . . 8 SER HB3 . 10125 1 17 . 1 1 8 8 SER C C 13 175.077 0.300 . 1 . . . . 8 SER C . 10125 1 18 . 1 1 8 8 SER CA C 13 58.494 0.300 . 1 . . . . 8 SER CA . 10125 1 19 . 1 1 8 8 SER CB C 13 63.900 0.300 . 1 . . . . 8 SER CB . 10125 1 20 . 1 1 8 8 SER N N 15 115.817 0.300 . 1 . . . . 8 SER N . 10125 1 21 . 1 1 9 9 GLY H H 1 8.448 0.030 . 1 . . . . 9 GLY H . 10125 1 22 . 1 1 9 9 GLY HA2 H 1 3.917 0.030 . 1 . . . . 9 GLY HA2 . 10125 1 23 . 1 1 9 9 GLY HA3 H 1 3.917 0.030 . 1 . . . . 9 GLY HA3 . 10125 1 24 . 1 1 9 9 GLY C C 13 173.286 0.300 . 1 . . . . 9 GLY C . 10125 1 25 . 1 1 9 9 GLY CA C 13 45.218 0.300 . 1 . . . . 9 GLY CA . 10125 1 26 . 1 1 9 9 GLY N N 15 110.946 0.300 . 1 . . . . 9 GLY N . 10125 1 27 . 1 1 10 10 ILE H H 1 7.883 0.030 . 1 . . . . 10 ILE H . 10125 1 28 . 1 1 10 10 ILE HA H 1 3.797 0.030 . 1 . . . . 10 ILE HA . 10125 1 29 . 1 1 10 10 ILE HB H 1 1.472 0.030 . 1 . . . . 10 ILE HB . 10125 1 30 . 1 1 10 10 ILE HG12 H 1 1.468 0.030 . 2 . . . . 10 ILE HG12 . 10125 1 31 . 1 1 10 10 ILE HG13 H 1 0.715 0.030 . 2 . . . . 10 ILE HG13 . 10125 1 32 . 1 1 10 10 ILE HG21 H 1 0.678 0.030 . 1 . . . . 10 ILE HG2 . 10125 1 33 . 1 1 10 10 ILE HG22 H 1 0.678 0.030 . 1 . . . . 10 ILE HG2 . 10125 1 34 . 1 1 10 10 ILE HG23 H 1 0.678 0.030 . 1 . . . . 10 ILE HG2 . 10125 1 35 . 1 1 10 10 ILE HD11 H 1 0.776 0.030 . 1 . . . . 10 ILE HD1 . 10125 1 36 . 1 1 10 10 ILE HD12 H 1 0.776 0.030 . 1 . . . . 10 ILE HD1 . 10125 1 37 . 1 1 10 10 ILE HD13 H 1 0.776 0.030 . 1 . . . . 10 ILE HD1 . 10125 1 38 . 1 1 10 10 ILE C C 13 175.626 0.300 . 1 . . . . 10 ILE C . 10125 1 39 . 1 1 10 10 ILE CA C 13 61.452 0.300 . 1 . . . . 10 ILE CA . 10125 1 40 . 1 1 10 10 ILE CB C 13 39.927 0.300 . 1 . . . . 10 ILE CB . 10125 1 41 . 1 1 10 10 ILE CG1 C 13 28.069 0.300 . 1 . . . . 10 ILE CG1 . 10125 1 42 . 1 1 10 10 ILE CG2 C 13 18.003 0.300 . 1 . . . . 10 ILE CG2 . 10125 1 43 . 1 1 10 10 ILE CD1 C 13 13.676 0.300 . 1 . . . . 10 ILE CD1 . 10125 1 44 . 1 1 10 10 ILE N N 15 121.141 0.300 . 1 . . . . 10 ILE N . 10125 1 45 . 1 1 11 11 ILE H H 1 8.178 0.030 . 1 . . . . 11 ILE H . 10125 1 46 . 1 1 11 11 ILE HA H 1 3.948 0.030 . 1 . . . . 11 ILE HA . 10125 1 47 . 1 1 11 11 ILE HB H 1 1.614 0.030 . 1 . . . . 11 ILE HB . 10125 1 48 . 1 1 11 11 ILE HG12 H 1 1.444 0.030 . 2 . . . . 11 ILE HG12 . 10125 1 49 . 1 1 11 11 ILE HG13 H 1 0.989 0.030 . 2 . . . . 11 ILE HG13 . 10125 1 50 . 1 1 11 11 ILE HG21 H 1 0.949 0.030 . 1 . . . . 11 ILE HG2 . 10125 1 51 . 1 1 11 11 ILE HG22 H 1 0.949 0.030 . 1 . . . . 11 ILE HG2 . 10125 1 52 . 1 1 11 11 ILE HG23 H 1 0.949 0.030 . 1 . . . . 11 ILE HG2 . 10125 1 53 . 1 1 11 11 ILE HD11 H 1 0.658 0.030 . 1 . . . . 11 ILE HD1 . 10125 1 54 . 1 1 11 11 ILE HD12 H 1 0.658 0.030 . 1 . . . . 11 ILE HD1 . 10125 1 55 . 1 1 11 11 ILE HD13 H 1 0.658 0.030 . 1 . . . . 11 ILE HD1 . 10125 1 56 . 1 1 11 11 ILE C C 13 174.392 0.300 . 1 . . . . 11 ILE C . 10125 1 57 . 1 1 11 11 ILE CA C 13 62.108 0.300 . 1 . . . . 11 ILE CA . 10125 1 58 . 1 1 11 11 ILE CB C 13 37.904 0.300 . 1 . . . . 11 ILE CB . 10125 1 59 . 1 1 11 11 ILE CG1 C 13 28.652 0.300 . 1 . . . . 11 ILE CG1 . 10125 1 60 . 1 1 11 11 ILE CG2 C 13 16.921 0.300 . 1 . . . . 11 ILE CG2 . 10125 1 61 . 1 1 11 11 ILE CD1 C 13 13.344 0.300 . 1 . . . . 11 ILE CD1 . 10125 1 62 . 1 1 11 11 ILE N N 15 131.450 0.300 . 1 . . . . 11 ILE N . 10125 1 63 . 1 1 12 12 LYS H H 1 8.191 0.030 . 1 . . . . 12 LYS H . 10125 1 64 . 1 1 12 12 LYS HA H 1 6.241 0.030 . 1 . . . . 12 LYS HA . 10125 1 65 . 1 1 12 12 LYS HB2 H 1 1.597 0.030 . 1 . . . . 12 LYS HB2 . 10125 1 66 . 1 1 12 12 LYS HB3 H 1 1.597 0.030 . 1 . . . . 12 LYS HB3 . 10125 1 67 . 1 1 12 12 LYS HG2 H 1 1.311 0.030 . 1 . . . . 12 LYS HG2 . 10125 1 68 . 1 1 12 12 LYS HG3 H 1 1.311 0.030 . 1 . . . . 12 LYS HG3 . 10125 1 69 . 1 1 12 12 LYS HD2 H 1 1.447 0.030 . 2 . . . . 12 LYS HD2 . 10125 1 70 . 1 1 12 12 LYS HD3 H 1 1.488 0.030 . 2 . . . . 12 LYS HD3 . 10125 1 71 . 1 1 12 12 LYS HE2 H 1 2.823 0.030 . 2 . . . . 12 LYS HE2 . 10125 1 72 . 1 1 12 12 LYS HE3 H 1 2.742 0.030 . 2 . . . . 12 LYS HE3 . 10125 1 73 . 1 1 12 12 LYS C C 13 177.452 0.300 . 1 . . . . 12 LYS C . 10125 1 74 . 1 1 12 12 LYS CA C 13 54.073 0.300 . 1 . . . . 12 LYS CA . 10125 1 75 . 1 1 12 12 LYS CB C 13 36.438 0.300 . 1 . . . . 12 LYS CB . 10125 1 76 . 1 1 12 12 LYS CG C 13 25.241 0.300 . 1 . . . . 12 LYS CG . 10125 1 77 . 1 1 12 12 LYS CD C 13 29.733 0.300 . 1 . . . . 12 LYS CD . 10125 1 78 . 1 1 12 12 LYS CE C 13 42.213 0.300 . 1 . . . . 12 LYS CE . 10125 1 79 . 1 1 12 12 LYS N N 15 124.766 0.300 . 1 . . . . 12 LYS N . 10125 1 80 . 1 1 13 13 MET H H 1 7.530 0.030 . 1 . . . . 13 MET H . 10125 1 81 . 1 1 13 13 MET HA H 1 4.588 0.030 . 1 . . . . 13 MET HA . 10125 1 82 . 1 1 13 13 MET HB2 H 1 1.762 0.030 . 2 . . . . 13 MET HB2 . 10125 1 83 . 1 1 13 13 MET HB3 H 1 2.148 0.030 . 2 . . . . 13 MET HB3 . 10125 1 84 . 1 1 13 13 MET HG2 H 1 2.581 0.030 . 2 . . . . 13 MET HG2 . 10125 1 85 . 1 1 13 13 MET HG3 H 1 2.381 0.030 . 2 . . . . 13 MET HG3 . 10125 1 86 . 1 1 13 13 MET HE1 H 1 2.041 0.030 . 1 . . . . 13 MET HE . 10125 1 87 . 1 1 13 13 MET HE2 H 1 2.041 0.030 . 1 . . . . 13 MET HE . 10125 1 88 . 1 1 13 13 MET HE3 H 1 2.041 0.030 . 1 . . . . 13 MET HE . 10125 1 89 . 1 1 13 13 MET C C 13 174.096 0.300 . 1 . . . . 13 MET C . 10125 1 90 . 1 1 13 13 MET CA C 13 55.042 0.300 . 1 . . . . 13 MET CA . 10125 1 91 . 1 1 13 13 MET CB C 13 39.721 0.300 . 1 . . . . 13 MET CB . 10125 1 92 . 1 1 13 13 MET CG C 13 33.061 0.300 . 1 . . . . 13 MET CG . 10125 1 93 . 1 1 13 13 MET CE C 13 17.371 0.300 . 1 . . . . 13 MET CE . 10125 1 94 . 1 1 13 13 MET N N 15 116.610 0.300 . 1 . . . . 13 MET N . 10125 1 95 . 1 1 14 14 ALA H H 1 8.789 0.030 . 1 . . . . 14 ALA H . 10125 1 96 . 1 1 14 14 ALA HA H 1 4.931 0.030 . 1 . . . . 14 ALA HA . 10125 1 97 . 1 1 14 14 ALA HB1 H 1 1.229 0.030 . 1 . . . . 14 ALA HB . 10125 1 98 . 1 1 14 14 ALA HB2 H 1 1.229 0.030 . 1 . . . . 14 ALA HB . 10125 1 99 . 1 1 14 14 ALA HB3 H 1 1.229 0.030 . 1 . . . . 14 ALA HB . 10125 1 100 . 1 1 14 14 ALA C C 13 175.504 0.300 . 1 . . . . 14 ALA C . 10125 1 101 . 1 1 14 14 ALA CA C 13 51.136 0.300 . 1 . . . . 14 ALA CA . 10125 1 102 . 1 1 14 14 ALA CB C 13 17.386 0.300 . 1 . . . . 14 ALA CB . 10125 1 103 . 1 1 14 14 ALA N N 15 126.805 0.300 . 1 . . . . 14 ALA N . 10125 1 104 . 1 1 15 15 ILE H H 1 7.322 0.030 . 1 . . . . 15 ILE H . 10125 1 105 . 1 1 15 15 ILE HA H 1 4.654 0.030 . 1 . . . . 15 ILE HA . 10125 1 106 . 1 1 15 15 ILE HB H 1 1.617 0.030 . 1 . . . . 15 ILE HB . 10125 1 107 . 1 1 15 15 ILE HG12 H 1 1.307 0.030 . 2 . . . . 15 ILE HG12 . 10125 1 108 . 1 1 15 15 ILE HG13 H 1 1.041 0.030 . 2 . . . . 15 ILE HG13 . 10125 1 109 . 1 1 15 15 ILE HG21 H 1 0.838 0.030 . 1 . . . . 15 ILE HG2 . 10125 1 110 . 1 1 15 15 ILE HG22 H 1 0.838 0.030 . 1 . . . . 15 ILE HG2 . 10125 1 111 . 1 1 15 15 ILE HG23 H 1 0.838 0.030 . 1 . . . . 15 ILE HG2 . 10125 1 112 . 1 1 15 15 ILE HD11 H 1 0.857 0.030 . 1 . . . . 15 ILE HD1 . 10125 1 113 . 1 1 15 15 ILE HD12 H 1 0.857 0.030 . 1 . . . . 15 ILE HD1 . 10125 1 114 . 1 1 15 15 ILE HD13 H 1 0.857 0.030 . 1 . . . . 15 ILE HD1 . 10125 1 115 . 1 1 15 15 ILE C C 13 173.466 0.300 . 1 . . . . 15 ILE C . 10125 1 116 . 1 1 15 15 ILE CA C 13 58.787 0.300 . 1 . . . . 15 ILE CA . 10125 1 117 . 1 1 15 15 ILE CB C 13 42.795 0.300 . 1 . . . . 15 ILE CB . 10125 1 118 . 1 1 15 15 ILE CG1 C 13 27.250 0.300 . 1 . . . . 15 ILE CG1 . 10125 1 119 . 1 1 15 15 ILE CG2 C 13 18.419 0.300 . 1 . . . . 15 ILE CG2 . 10125 1 120 . 1 1 15 15 ILE CD1 C 13 14.176 0.300 . 1 . . . . 15 ILE CD1 . 10125 1 121 . 1 1 15 15 ILE N N 15 120.575 0.300 . 1 . . . . 15 ILE N . 10125 1 122 . 1 1 16 16 ARG H H 1 8.388 0.030 . 1 . . . . 16 ARG H . 10125 1 123 . 1 1 16 16 ARG HA H 1 4.928 0.030 . 1 . . . . 16 ARG HA . 10125 1 124 . 1 1 16 16 ARG HB2 H 1 1.731 0.030 . 1 . . . . 16 ARG HB2 . 10125 1 125 . 1 1 16 16 ARG HB3 H 1 1.731 0.030 . 1 . . . . 16 ARG HB3 . 10125 1 126 . 1 1 16 16 ARG HG2 H 1 1.672 0.030 . 2 . . . . 16 ARG HG2 . 10125 1 127 . 1 1 16 16 ARG HG3 H 1 1.778 0.030 . 2 . . . . 16 ARG HG3 . 10125 1 128 . 1 1 16 16 ARG HD2 H 1 3.265 0.030 . 2 . . . . 16 ARG HD2 . 10125 1 129 . 1 1 16 16 ARG HD3 H 1 3.378 0.030 . 2 . . . . 16 ARG HD3 . 10125 1 130 . 1 1 16 16 ARG HE H 1 6.905 0.030 . 1 . . . . 16 ARG HE . 10125 1 131 . 1 1 16 16 ARG C C 13 175.738 0.300 . 1 . . . . 16 ARG C . 10125 1 132 . 1 1 16 16 ARG CA C 13 55.503 0.300 . 1 . . . . 16 ARG CA . 10125 1 133 . 1 1 16 16 ARG CB C 13 34.169 0.300 . 1 . . . . 16 ARG CB . 10125 1 134 . 1 1 16 16 ARG CG C 13 28.508 0.300 . 1 . . . . 16 ARG CG . 10125 1 135 . 1 1 16 16 ARG CD C 13 43.877 0.300 . 1 . . . . 16 ARG CD . 10125 1 136 . 1 1 16 16 ARG N N 15 122.727 0.300 . 1 . . . . 16 ARG N . 10125 1 137 . 1 1 16 16 ARG NE N 15 84.212 0.300 . 1 . . . . 16 ARG NE . 10125 1 138 . 1 1 17 17 PHE H H 1 9.181 0.030 . 1 . . . . 17 PHE H . 10125 1 139 . 1 1 17 17 PHE HA H 1 4.396 0.030 . 1 . . . . 17 PHE HA . 10125 1 140 . 1 1 17 17 PHE HB2 H 1 2.884 0.030 . 1 . . . . 17 PHE HB2 . 10125 1 141 . 1 1 17 17 PHE HB3 H 1 2.884 0.030 . 1 . . . . 17 PHE HB3 . 10125 1 142 . 1 1 17 17 PHE HD1 H 1 7.075 0.030 . 1 . . . . 17 PHE HD1 . 10125 1 143 . 1 1 17 17 PHE HD2 H 1 7.075 0.030 . 1 . . . . 17 PHE HD2 . 10125 1 144 . 1 1 17 17 PHE HE1 H 1 6.921 0.030 . 1 . . . . 17 PHE HE1 . 10125 1 145 . 1 1 17 17 PHE HE2 H 1 6.921 0.030 . 1 . . . . 17 PHE HE2 . 10125 1 146 . 1 1 17 17 PHE HZ H 1 7.155 0.030 . 1 . . . . 17 PHE HZ . 10125 1 147 . 1 1 17 17 PHE C C 13 173.344 0.300 . 1 . . . . 17 PHE C . 10125 1 148 . 1 1 17 17 PHE CA C 13 57.774 0.300 . 1 . . . . 17 PHE CA . 10125 1 149 . 1 1 17 17 PHE CB C 13 39.715 0.300 . 1 . . . . 17 PHE CB . 10125 1 150 . 1 1 17 17 PHE CD1 C 13 132.032 0.300 . 1 . . . . 17 PHE CD1 . 10125 1 151 . 1 1 17 17 PHE CD2 C 13 132.032 0.300 . 1 . . . . 17 PHE CD2 . 10125 1 152 . 1 1 17 17 PHE CE1 C 13 131.089 0.300 . 1 . . . . 17 PHE CE1 . 10125 1 153 . 1 1 17 17 PHE CE2 C 13 131.089 0.300 . 1 . . . . 17 PHE CE2 . 10125 1 154 . 1 1 17 17 PHE CZ C 13 129.127 0.300 . 1 . . . . 17 PHE CZ . 10125 1 155 . 1 1 17 17 PHE N N 15 126.126 0.300 . 1 . . . . 17 PHE N . 10125 1 156 . 1 1 18 18 ASP H H 1 8.211 0.030 . 1 . . . . 18 ASP H . 10125 1 157 . 1 1 18 18 ASP HA H 1 4.490 0.030 . 1 . . . . 18 ASP HA . 10125 1 158 . 1 1 18 18 ASP HB2 H 1 2.467 0.030 . 2 . . . . 18 ASP HB2 . 10125 1 159 . 1 1 18 18 ASP HB3 H 1 2.835 0.030 . 2 . . . . 18 ASP HB3 . 10125 1 160 . 1 1 18 18 ASP C C 13 175.867 0.300 . 1 . . . . 18 ASP C . 10125 1 161 . 1 1 18 18 ASP CA C 13 51.686 0.300 . 1 . . . . 18 ASP CA . 10125 1 162 . 1 1 18 18 ASP CB C 13 42.041 0.300 . 1 . . . . 18 ASP CB . 10125 1 163 . 1 1 18 18 ASP N N 15 129.637 0.300 . 1 . . . . 18 ASP N . 10125 1 164 . 1 1 19 19 ARG H H 1 8.205 0.030 . 1 . . . . 19 ARG H . 10125 1 165 . 1 1 19 19 ARG HA H 1 3.599 0.030 . 1 . . . . 19 ARG HA . 10125 1 166 . 1 1 19 19 ARG HB2 H 1 1.626 0.030 . 2 . . . . 19 ARG HB2 . 10125 1 167 . 1 1 19 19 ARG HB3 H 1 1.731 0.030 . 2 . . . . 19 ARG HB3 . 10125 1 168 . 1 1 19 19 ARG HG2 H 1 1.681 0.030 . 2 . . . . 19 ARG HG2 . 10125 1 169 . 1 1 19 19 ARG HG3 H 1 1.512 0.030 . 2 . . . . 19 ARG HG3 . 10125 1 170 . 1 1 19 19 ARG HD2 H 1 3.216 0.030 . 2 . . . . 19 ARG HD2 . 10125 1 171 . 1 1 19 19 ARG HD3 H 1 3.262 0.030 . 2 . . . . 19 ARG HD3 . 10125 1 172 . 1 1 19 19 ARG C C 13 177.636 0.300 . 1 . . . . 19 ARG C . 10125 1 173 . 1 1 19 19 ARG CA C 13 58.332 0.300 . 1 . . . . 19 ARG CA . 10125 1 174 . 1 1 19 19 ARG CB C 13 30.063 0.300 . 1 . . . . 19 ARG CB . 10125 1 175 . 1 1 19 19 ARG CG C 13 26.489 0.300 . 1 . . . . 19 ARG CG . 10125 1 176 . 1 1 19 19 ARG CD C 13 43.794 0.300 . 1 . . . . 19 ARG CD . 10125 1 177 . 1 1 19 19 ARG N N 15 124.880 0.300 . 1 . . . . 19 ARG N . 10125 1 178 . 1 1 20 20 ARG H H 1 8.058 0.030 . 1 . . . . 20 ARG H . 10125 1 179 . 1 1 20 20 ARG HA H 1 4.124 0.030 . 1 . . . . 20 ARG HA . 10125 1 180 . 1 1 20 20 ARG HB2 H 1 1.805 0.030 . 2 . . . . 20 ARG HB2 . 10125 1 181 . 1 1 20 20 ARG HB3 H 1 1.860 0.030 . 2 . . . . 20 ARG HB3 . 10125 1 182 . 1 1 20 20 ARG HG2 H 1 1.666 0.030 . 1 . . . . 20 ARG HG2 . 10125 1 183 . 1 1 20 20 ARG HG3 H 1 1.666 0.030 . 1 . . . . 20 ARG HG3 . 10125 1 184 . 1 1 20 20 ARG HD2 H 1 3.173 0.030 . 2 . . . . 20 ARG HD2 . 10125 1 185 . 1 1 20 20 ARG HD3 H 1 3.235 0.030 . 2 . . . . 20 ARG HD3 . 10125 1 186 . 1 1 20 20 ARG C C 13 177.052 0.300 . 1 . . . . 20 ARG C . 10125 1 187 . 1 1 20 20 ARG CA C 13 57.576 0.300 . 1 . . . . 20 ARG CA . 10125 1 188 . 1 1 20 20 ARG CB C 13 29.714 0.300 . 1 . . . . 20 ARG CB . 10125 1 189 . 1 1 20 20 ARG CG C 13 26.988 0.300 . 1 . . . . 20 ARG CG . 10125 1 190 . 1 1 20 20 ARG CD C 13 43.294 0.300 . 1 . . . . 20 ARG CD . 10125 1 191 . 1 1 20 20 ARG N N 15 116.716 0.300 . 1 . . . . 20 ARG N . 10125 1 192 . 1 1 21 21 ALA H H 1 7.635 0.030 . 1 . . . . 21 ALA H . 10125 1 193 . 1 1 21 21 ALA HA H 1 4.259 0.030 . 1 . . . . 21 ALA HA . 10125 1 194 . 1 1 21 21 ALA HB1 H 1 1.345 0.030 . 1 . . . . 21 ALA HB . 10125 1 195 . 1 1 21 21 ALA HB2 H 1 1.345 0.030 . 1 . . . . 21 ALA HB . 10125 1 196 . 1 1 21 21 ALA HB3 H 1 1.345 0.030 . 1 . . . . 21 ALA HB . 10125 1 197 . 1 1 21 21 ALA C C 13 175.461 0.300 . 1 . . . . 21 ALA C . 10125 1 198 . 1 1 21 21 ALA CA C 13 52.034 0.300 . 1 . . . . 21 ALA CA . 10125 1 199 . 1 1 21 21 ALA CB C 13 19.286 0.300 . 1 . . . . 21 ALA CB . 10125 1 200 . 1 1 21 21 ALA N N 15 119.312 0.300 . 1 . . . . 21 ALA N . 10125 1 201 . 1 1 22 22 TYR H H 1 7.371 0.030 . 1 . . . . 22 TYR H . 10125 1 202 . 1 1 22 22 TYR HA H 1 4.686 0.030 . 1 . . . . 22 TYR HA . 10125 1 203 . 1 1 22 22 TYR HB2 H 1 2.790 0.030 . 2 . . . . 22 TYR HB2 . 10125 1 204 . 1 1 22 22 TYR HB3 H 1 3.363 0.030 . 2 . . . . 22 TYR HB3 . 10125 1 205 . 1 1 22 22 TYR HD1 H 1 7.137 0.030 . 1 . . . . 22 TYR HD1 . 10125 1 206 . 1 1 22 22 TYR HD2 H 1 7.137 0.030 . 1 . . . . 22 TYR HD2 . 10125 1 207 . 1 1 22 22 TYR HE1 H 1 6.899 0.030 . 1 . . . . 22 TYR HE1 . 10125 1 208 . 1 1 22 22 TYR HE2 H 1 6.899 0.030 . 1 . . . . 22 TYR HE2 . 10125 1 209 . 1 1 22 22 TYR C C 13 173.249 0.300 . 1 . . . . 22 TYR C . 10125 1 210 . 1 1 22 22 TYR CA C 13 56.662 0.300 . 1 . . . . 22 TYR CA . 10125 1 211 . 1 1 22 22 TYR CB C 13 40.909 0.300 . 1 . . . . 22 TYR CB . 10125 1 212 . 1 1 22 22 TYR CD1 C 13 133.584 0.300 . 1 . . . . 22 TYR CD1 . 10125 1 213 . 1 1 22 22 TYR CD2 C 13 133.584 0.300 . 1 . . . . 22 TYR CD2 . 10125 1 214 . 1 1 22 22 TYR CE1 C 13 118.589 0.300 . 1 . . . . 22 TYR CE1 . 10125 1 215 . 1 1 22 22 TYR CE2 C 13 118.589 0.300 . 1 . . . . 22 TYR CE2 . 10125 1 216 . 1 1 22 22 TYR N N 15 118.536 0.300 . 1 . . . . 22 TYR N . 10125 1 217 . 1 1 23 23 PRO HA H 1 4.742 0.030 . 1 . . . . 23 PRO HA . 10125 1 218 . 1 1 23 23 PRO HB2 H 1 2.494 0.030 . 2 . . . . 23 PRO HB2 . 10125 1 219 . 1 1 23 23 PRO HB3 H 1 1.933 0.030 . 2 . . . . 23 PRO HB3 . 10125 1 220 . 1 1 23 23 PRO HG2 H 1 2.039 0.030 . 1 . . . . 23 PRO HG2 . 10125 1 221 . 1 1 23 23 PRO HG3 H 1 2.039 0.030 . 1 . . . . 23 PRO HG3 . 10125 1 222 . 1 1 23 23 PRO HD2 H 1 3.530 0.030 . 2 . . . . 23 PRO HD2 . 10125 1 223 . 1 1 23 23 PRO HD3 H 1 3.784 0.030 . 2 . . . . 23 PRO HD3 . 10125 1 224 . 1 1 23 23 PRO CA C 13 61.537 0.300 . 1 . . . . 23 PRO CA . 10125 1 225 . 1 1 23 23 PRO CB C 13 30.664 0.300 . 1 . . . . 23 PRO CB . 10125 1 226 . 1 1 23 23 PRO CG C 13 27.611 0.300 . 1 . . . . 23 PRO CG . 10125 1 227 . 1 1 23 23 PRO CD C 13 50.844 0.300 . 1 . . . . 23 PRO CD . 10125 1 228 . 1 1 24 24 PRO HA H 1 4.342 0.030 . 1 . . . . 24 PRO HA . 10125 1 229 . 1 1 24 24 PRO HB2 H 1 1.927 0.030 . 2 . . . . 24 PRO HB2 . 10125 1 230 . 1 1 24 24 PRO HB3 H 1 2.371 0.030 . 2 . . . . 24 PRO HB3 . 10125 1 231 . 1 1 24 24 PRO HG2 H 1 2.089 0.030 . 1 . . . . 24 PRO HG2 . 10125 1 232 . 1 1 24 24 PRO HG3 H 1 2.089 0.030 . 1 . . . . 24 PRO HG3 . 10125 1 233 . 1 1 24 24 PRO HD2 H 1 3.826 0.030 . 2 . . . . 24 PRO HD2 . 10125 1 234 . 1 1 24 24 PRO HD3 H 1 3.691 0.030 . 2 . . . . 24 PRO HD3 . 10125 1 235 . 1 1 24 24 PRO C C 13 177.544 0.300 . 1 . . . . 24 PRO C . 10125 1 236 . 1 1 24 24 PRO CA C 13 64.443 0.300 . 1 . . . . 24 PRO CA . 10125 1 237 . 1 1 24 24 PRO CB C 13 31.926 0.300 . 1 . . . . 24 PRO CB . 10125 1 238 . 1 1 24 24 PRO CG C 13 27.737 0.300 . 1 . . . . 24 PRO CG . 10125 1 239 . 1 1 24 24 PRO CD C 13 50.249 0.300 . 1 . . . . 24 PRO CD . 10125 1 240 . 1 1 25 25 GLN H H 1 8.565 0.030 . 1 . . . . 25 GLN H . 10125 1 241 . 1 1 25 25 GLN HA H 1 4.174 0.030 . 1 . . . . 25 GLN HA . 10125 1 242 . 1 1 25 25 GLN HB2 H 1 2.241 0.030 . 2 . . . . 25 GLN HB2 . 10125 1 243 . 1 1 25 25 GLN HB3 H 1 2.198 0.030 . 2 . . . . 25 GLN HB3 . 10125 1 244 . 1 1 25 25 GLN HG2 H 1 2.343 0.030 . 2 . . . . 25 GLN HG2 . 10125 1 245 . 1 1 25 25 GLN HG3 H 1 2.404 0.030 . 2 . . . . 25 GLN HG3 . 10125 1 246 . 1 1 25 25 GLN HE21 H 1 7.584 0.030 . 2 . . . . 25 GLN HE21 . 10125 1 247 . 1 1 25 25 GLN HE22 H 1 6.901 0.030 . 2 . . . . 25 GLN HE22 . 10125 1 248 . 1 1 25 25 GLN C C 13 175.044 0.300 . 1 . . . . 25 GLN C . 10125 1 249 . 1 1 25 25 GLN CA C 13 57.007 0.300 . 1 . . . . 25 GLN CA . 10125 1 250 . 1 1 25 25 GLN CB C 13 27.760 0.300 . 1 . . . . 25 GLN CB . 10125 1 251 . 1 1 25 25 GLN CG C 13 34.258 0.300 . 1 . . . . 25 GLN CG . 10125 1 252 . 1 1 25 25 GLN N N 15 113.438 0.300 . 1 . . . . 25 GLN N . 10125 1 253 . 1 1 25 25 GLN NE2 N 15 111.950 0.300 . 1 . . . . 25 GLN NE2 . 10125 1 254 . 1 1 26 26 ILE H H 1 7.630 0.030 . 1 . . . . 26 ILE H . 10125 1 255 . 1 1 26 26 ILE HA H 1 4.709 0.030 . 1 . . . . 26 ILE HA . 10125 1 256 . 1 1 26 26 ILE HB H 1 1.852 0.030 . 1 . . . . 26 ILE HB . 10125 1 257 . 1 1 26 26 ILE HG12 H 1 1.249 0.030 . 2 . . . . 26 ILE HG12 . 10125 1 258 . 1 1 26 26 ILE HG13 H 1 1.479 0.030 . 2 . . . . 26 ILE HG13 . 10125 1 259 . 1 1 26 26 ILE HG21 H 1 0.946 0.030 . 1 . . . . 26 ILE HG2 . 10125 1 260 . 1 1 26 26 ILE HG22 H 1 0.946 0.030 . 1 . . . . 26 ILE HG2 . 10125 1 261 . 1 1 26 26 ILE HG23 H 1 0.946 0.030 . 1 . . . . 26 ILE HG2 . 10125 1 262 . 1 1 26 26 ILE HD11 H 1 0.833 0.030 . 1 . . . . 26 ILE HD1 . 10125 1 263 . 1 1 26 26 ILE HD12 H 1 0.833 0.030 . 1 . . . . 26 ILE HD1 . 10125 1 264 . 1 1 26 26 ILE HD13 H 1 0.833 0.030 . 1 . . . . 26 ILE HD1 . 10125 1 265 . 1 1 26 26 ILE C C 13 174.178 0.300 . 1 . . . . 26 ILE C . 10125 1 266 . 1 1 26 26 ILE CA C 13 59.968 0.300 . 1 . . . . 26 ILE CA . 10125 1 267 . 1 1 26 26 ILE CB C 13 40.099 0.300 . 1 . . . . 26 ILE CB . 10125 1 268 . 1 1 26 26 ILE CG1 C 13 27.250 0.300 . 1 . . . . 26 ILE CG1 . 10125 1 269 . 1 1 26 26 ILE CG2 C 13 18.003 0.300 . 1 . . . . 26 ILE CG2 . 10125 1 270 . 1 1 26 26 ILE CD1 C 13 12.179 0.300 . 1 . . . . 26 ILE CD1 . 10125 1 271 . 1 1 26 26 ILE N N 15 120.122 0.300 . 1 . . . . 26 ILE N . 10125 1 272 . 1 1 27 27 THR H H 1 7.168 0.030 . 1 . . . . 27 THR H . 10125 1 273 . 1 1 27 27 THR HA H 1 4.521 0.030 . 1 . . . . 27 THR HA . 10125 1 274 . 1 1 27 27 THR HB H 1 4.225 0.030 . 1 . . . . 27 THR HB . 10125 1 275 . 1 1 27 27 THR HG21 H 1 1.081 0.030 . 1 . . . . 27 THR HG2 . 10125 1 276 . 1 1 27 27 THR HG22 H 1 1.081 0.030 . 1 . . . . 27 THR HG2 . 10125 1 277 . 1 1 27 27 THR HG23 H 1 1.081 0.030 . 1 . . . . 27 THR HG2 . 10125 1 278 . 1 1 27 27 THR C C 13 173.498 0.300 . 1 . . . . 27 THR C . 10125 1 279 . 1 1 27 27 THR CA C 13 57.447 0.300 . 1 . . . . 27 THR CA . 10125 1 280 . 1 1 27 27 THR CB C 13 69.302 0.300 . 1 . . . . 27 THR CB . 10125 1 281 . 1 1 27 27 THR CG2 C 13 22.040 0.300 . 1 . . . . 27 THR CG2 . 10125 1 282 . 1 1 27 27 THR N N 15 112.192 0.300 . 1 . . . . 27 THR N . 10125 1 283 . 1 1 28 28 PRO HA H 1 4.042 0.030 . 1 . . . . 28 PRO HA . 10125 1 284 . 1 1 28 28 PRO HB2 H 1 2.052 0.030 . 2 . . . . 28 PRO HB2 . 10125 1 285 . 1 1 28 28 PRO HB3 H 1 1.992 0.030 . 2 . . . . 28 PRO HB3 . 10125 1 286 . 1 1 28 28 PRO HG2 H 1 1.677 0.030 . 2 . . . . 28 PRO HG2 . 10125 1 287 . 1 1 28 28 PRO HG3 H 1 1.586 0.030 . 2 . . . . 28 PRO HG3 . 10125 1 288 . 1 1 28 28 PRO HD2 H 1 2.979 0.030 . 2 . . . . 28 PRO HD2 . 10125 1 289 . 1 1 28 28 PRO HD3 H 1 2.366 0.030 . 2 . . . . 28 PRO HD3 . 10125 1 290 . 1 1 28 28 PRO C C 13 178.029 0.300 . 1 . . . . 28 PRO C . 10125 1 291 . 1 1 28 28 PRO CA C 13 65.666 0.300 . 1 . . . . 28 PRO CA . 10125 1 292 . 1 1 28 28 PRO CB C 13 32.641 0.300 . 1 . . . . 28 PRO CB . 10125 1 293 . 1 1 28 28 PRO CG C 13 28.069 0.300 . 1 . . . . 28 PRO CG . 10125 1 294 . 1 1 28 28 PRO CD C 13 50.249 0.300 . 1 . . . . 28 PRO CD . 10125 1 295 . 1 1 29 29 LYS H H 1 8.574 0.030 . 1 . . . . 29 LYS H . 10125 1 296 . 1 1 29 29 LYS HA H 1 3.664 0.030 . 1 . . . . 29 LYS HA . 10125 1 297 . 1 1 29 29 LYS HB2 H 1 1.427 0.030 . 2 . . . . 29 LYS HB2 . 10125 1 298 . 1 1 29 29 LYS HB3 H 1 1.657 0.030 . 2 . . . . 29 LYS HB3 . 10125 1 299 . 1 1 29 29 LYS HG2 H 1 1.229 0.030 . 2 . . . . 29 LYS HG2 . 10125 1 300 . 1 1 29 29 LYS HG3 H 1 1.283 0.030 . 2 . . . . 29 LYS HG3 . 10125 1 301 . 1 1 29 29 LYS HD2 H 1 1.215 0.030 . 1 . . . . 29 LYS HD2 . 10125 1 302 . 1 1 29 29 LYS HD3 H 1 1.215 0.030 . 1 . . . . 29 LYS HD3 . 10125 1 303 . 1 1 29 29 LYS HE2 H 1 1.863 0.030 . 2 . . . . 29 LYS HE2 . 10125 1 304 . 1 1 29 29 LYS HE3 H 1 2.434 0.030 . 2 . . . . 29 LYS HE3 . 10125 1 305 . 1 1 29 29 LYS C C 13 180.297 0.300 . 1 . . . . 29 LYS C . 10125 1 306 . 1 1 29 29 LYS CA C 13 61.129 0.300 . 1 . . . . 29 LYS CA . 10125 1 307 . 1 1 29 29 LYS CB C 13 33.052 0.300 . 1 . . . . 29 LYS CB . 10125 1 308 . 1 1 29 29 LYS CG C 13 25.407 0.300 . 1 . . . . 29 LYS CG . 10125 1 309 . 1 1 29 29 LYS CD C 13 29.733 0.300 . 1 . . . . 29 LYS CD . 10125 1 310 . 1 1 29 29 LYS CE C 13 41.464 0.300 . 1 . . . . 29 LYS CE . 10125 1 311 . 1 1 29 29 LYS N N 15 116.318 0.300 . 1 . . . . 29 LYS N . 10125 1 312 . 1 1 30 30 MET H H 1 7.518 0.030 . 1 . . . . 30 MET H . 10125 1 313 . 1 1 30 30 MET HA H 1 4.162 0.030 . 1 . . . . 30 MET HA . 10125 1 314 . 1 1 30 30 MET HB2 H 1 2.314 0.030 . 1 . . . . 30 MET HB2 . 10125 1 315 . 1 1 30 30 MET HB3 H 1 2.314 0.030 . 1 . . . . 30 MET HB3 . 10125 1 316 . 1 1 30 30 MET HG2 H 1 2.573 0.030 . 2 . . . . 30 MET HG2 . 10125 1 317 . 1 1 30 30 MET HG3 H 1 2.672 0.030 . 2 . . . . 30 MET HG3 . 10125 1 318 . 1 1 30 30 MET HE1 H 1 2.199 0.030 . 1 . . . . 30 MET HE . 10125 1 319 . 1 1 30 30 MET HE2 H 1 2.199 0.030 . 1 . . . . 30 MET HE . 10125 1 320 . 1 1 30 30 MET HE3 H 1 2.199 0.030 . 1 . . . . 30 MET HE . 10125 1 321 . 1 1 30 30 MET C C 13 178.661 0.300 . 1 . . . . 30 MET C . 10125 1 322 . 1 1 30 30 MET CA C 13 58.740 0.300 . 1 . . . . 30 MET CA . 10125 1 323 . 1 1 30 30 MET CB C 13 33.316 0.300 . 1 . . . . 30 MET CB . 10125 1 324 . 1 1 30 30 MET CG C 13 31.922 0.300 . 1 . . . . 30 MET CG . 10125 1 325 . 1 1 30 30 MET CE C 13 17.240 0.300 . 1 . . . . 30 MET CE . 10125 1 326 . 1 1 30 30 MET N N 15 119.216 0.300 . 1 . . . . 30 MET N . 10125 1 327 . 1 1 31 31 CYS H H 1 8.041 0.030 . 1 . . . . 31 CYS H . 10125 1 328 . 1 1 31 31 CYS HA H 1 4.150 0.030 . 1 . . . . 31 CYS HA . 10125 1 329 . 1 1 31 31 CYS HB2 H 1 2.924 0.030 . 2 . . . . 31 CYS HB2 . 10125 1 330 . 1 1 31 31 CYS HB3 H 1 2.979 0.030 . 2 . . . . 31 CYS HB3 . 10125 1 331 . 1 1 31 31 CYS C C 13 177.744 0.300 . 1 . . . . 31 CYS C . 10125 1 332 . 1 1 31 31 CYS CA C 13 63.228 0.300 . 1 . . . . 31 CYS CA . 10125 1 333 . 1 1 31 31 CYS CB C 13 26.667 0.300 . 1 . . . . 31 CYS CB . 10125 1 334 . 1 1 31 31 CYS N N 15 119.357 0.300 . 1 . . . . 31 CYS N . 10125 1 335 . 1 1 32 32 LEU H H 1 8.728 0.030 . 1 . . . . 32 LEU H . 10125 1 336 . 1 1 32 32 LEU HA H 1 4.338 0.030 . 1 . . . . 32 LEU HA . 10125 1 337 . 1 1 32 32 LEU HB2 H 1 1.285 0.030 . 2 . . . . 32 LEU HB2 . 10125 1 338 . 1 1 32 32 LEU HB3 H 1 1.963 0.030 . 2 . . . . 32 LEU HB3 . 10125 1 339 . 1 1 32 32 LEU HG H 1 1.653 0.030 . 1 . . . . 32 LEU HG . 10125 1 340 . 1 1 32 32 LEU HD11 H 1 0.913 0.030 . 1 . . . . 32 LEU HD1 . 10125 1 341 . 1 1 32 32 LEU HD12 H 1 0.913 0.030 . 1 . . . . 32 LEU HD1 . 10125 1 342 . 1 1 32 32 LEU HD13 H 1 0.913 0.030 . 1 . . . . 32 LEU HD1 . 10125 1 343 . 1 1 32 32 LEU HD21 H 1 0.972 0.030 . 1 . . . . 32 LEU HD2 . 10125 1 344 . 1 1 32 32 LEU HD22 H 1 0.972 0.030 . 1 . . . . 32 LEU HD2 . 10125 1 345 . 1 1 32 32 LEU HD23 H 1 0.972 0.030 . 1 . . . . 32 LEU HD2 . 10125 1 346 . 1 1 32 32 LEU C C 13 177.894 0.300 . 1 . . . . 32 LEU C . 10125 1 347 . 1 1 32 32 LEU CA C 13 57.795 0.300 . 1 . . . . 32 LEU CA . 10125 1 348 . 1 1 32 32 LEU CB C 13 41.889 0.300 . 1 . . . . 32 LEU CB . 10125 1 349 . 1 1 32 32 LEU CG C 13 27.404 0.300 . 1 . . . . 32 LEU CG . 10125 1 350 . 1 1 32 32 LEU CD1 C 13 25.657 0.300 . 2 . . . . 32 LEU CD1 . 10125 1 351 . 1 1 32 32 LEU CD2 C 13 23.660 0.300 . 2 . . . . 32 LEU CD2 . 10125 1 352 . 1 1 32 32 LEU N N 15 121.740 0.300 . 1 . . . . 32 LEU N . 10125 1 353 . 1 1 33 33 LEU H H 1 8.013 0.030 . 1 . . . . 33 LEU H . 10125 1 354 . 1 1 33 33 LEU HA H 1 3.980 0.030 . 1 . . . . 33 LEU HA . 10125 1 355 . 1 1 33 33 LEU HB2 H 1 1.831 0.030 . 2 . . . . 33 LEU HB2 . 10125 1 356 . 1 1 33 33 LEU HB3 H 1 1.954 0.030 . 2 . . . . 33 LEU HB3 . 10125 1 357 . 1 1 33 33 LEU HG H 1 1.663 0.030 . 1 . . . . 33 LEU HG . 10125 1 358 . 1 1 33 33 LEU HD11 H 1 0.982 0.030 . 1 . . . . 33 LEU HD1 . 10125 1 359 . 1 1 33 33 LEU HD12 H 1 0.982 0.030 . 1 . . . . 33 LEU HD1 . 10125 1 360 . 1 1 33 33 LEU HD13 H 1 0.982 0.030 . 1 . . . . 33 LEU HD1 . 10125 1 361 . 1 1 33 33 LEU HD21 H 1 1.015 0.030 . 1 . . . . 33 LEU HD2 . 10125 1 362 . 1 1 33 33 LEU HD22 H 1 1.015 0.030 . 1 . . . . 33 LEU HD2 . 10125 1 363 . 1 1 33 33 LEU HD23 H 1 1.015 0.030 . 1 . . . . 33 LEU HD2 . 10125 1 364 . 1 1 33 33 LEU C C 13 179.201 0.300 . 1 . . . . 33 LEU C . 10125 1 365 . 1 1 33 33 LEU CA C 13 58.996 0.300 . 1 . . . . 33 LEU CA . 10125 1 366 . 1 1 33 33 LEU CB C 13 41.841 0.300 . 1 . . . . 33 LEU CB . 10125 1 367 . 1 1 33 33 LEU CG C 13 27.250 0.300 . 1 . . . . 33 LEU CG . 10125 1 368 . 1 1 33 33 LEU CD1 C 13 25.241 0.300 . 2 . . . . 33 LEU CD1 . 10125 1 369 . 1 1 33 33 LEU CD2 C 13 24.242 0.300 . 2 . . . . 33 LEU CD2 . 10125 1 370 . 1 1 33 33 LEU N N 15 121.255 0.300 . 1 . . . . 33 LEU N . 10125 1 371 . 1 1 34 34 GLU H H 1 8.135 0.030 . 1 . . . . 34 GLU H . 10125 1 372 . 1 1 34 34 GLU HA H 1 4.126 0.030 . 1 . . . . 34 GLU HA . 10125 1 373 . 1 1 34 34 GLU HB2 H 1 2.111 0.030 . 2 . . . . 34 GLU HB2 . 10125 1 374 . 1 1 34 34 GLU HB3 H 1 2.156 0.030 . 2 . . . . 34 GLU HB3 . 10125 1 375 . 1 1 34 34 GLU HG2 H 1 2.417 0.030 . 1 . . . . 34 GLU HG2 . 10125 1 376 . 1 1 34 34 GLU HG3 H 1 2.417 0.030 . 1 . . . . 34 GLU HG3 . 10125 1 377 . 1 1 34 34 GLU C C 13 178.613 0.300 . 1 . . . . 34 GLU C . 10125 1 378 . 1 1 34 34 GLU CA C 13 59.113 0.300 . 1 . . . . 34 GLU CA . 10125 1 379 . 1 1 34 34 GLU CB C 13 29.001 0.300 . 1 . . . . 34 GLU CB . 10125 1 380 . 1 1 34 34 GLU CG C 13 35.973 0.300 . 1 . . . . 34 GLU CG . 10125 1 381 . 1 1 34 34 GLU N N 15 118.196 0.300 . 1 . . . . 34 GLU N . 10125 1 382 . 1 1 35 35 TRP H H 1 8.077 0.030 . 1 . . . . 35 TRP H . 10125 1 383 . 1 1 35 35 TRP HA H 1 4.199 0.030 . 1 . . . . 35 TRP HA . 10125 1 384 . 1 1 35 35 TRP HB2 H 1 3.286 0.030 . 2 . . . . 35 TRP HB2 . 10125 1 385 . 1 1 35 35 TRP HB3 H 1 3.536 0.030 . 2 . . . . 35 TRP HB3 . 10125 1 386 . 1 1 35 35 TRP HD1 H 1 7.161 0.030 . 1 . . . . 35 TRP HD1 . 10125 1 387 . 1 1 35 35 TRP HE1 H 1 10.092 0.030 . 1 . . . . 35 TRP HE1 . 10125 1 388 . 1 1 35 35 TRP HE3 H 1 7.547 0.030 . 1 . . . . 35 TRP HE3 . 10125 1 389 . 1 1 35 35 TRP HZ2 H 1 7.269 0.030 . 1 . . . . 35 TRP HZ2 . 10125 1 390 . 1 1 35 35 TRP HH2 H 1 6.966 0.030 . 1 . . . . 35 TRP HH2 . 10125 1 391 . 1 1 35 35 TRP C C 13 177.284 0.300 . 1 . . . . 35 TRP C . 10125 1 392 . 1 1 35 35 TRP CA C 13 62.659 0.300 . 1 . . . . 35 TRP CA . 10125 1 393 . 1 1 35 35 TRP CB C 13 27.968 0.300 . 1 . . . . 35 TRP CB . 10125 1 394 . 1 1 35 35 TRP CD1 C 13 125.713 0.300 . 1 . . . . 35 TRP CD1 . 10125 1 395 . 1 1 35 35 TRP CE3 C 13 120.502 0.300 . 1 . . . . 35 TRP CE3 . 10125 1 396 . 1 1 35 35 TRP CZ2 C 13 114.053 0.300 . 1 . . . . 35 TRP CZ2 . 10125 1 397 . 1 1 35 35 TRP CZ3 C 13 121.221 0.300 . 1 . . . . 35 TRP CZ3 . 10125 1 398 . 1 1 35 35 TRP CH2 C 13 123.916 0.300 . 1 . . . . 35 TRP CH2 . 10125 1 399 . 1 1 35 35 TRP N N 15 122.274 0.300 . 1 . . . . 35 TRP N . 10125 1 400 . 1 1 35 35 TRP NE1 N 15 129.959 0.300 . 1 . . . . 35 TRP NE1 . 10125 1 401 . 1 1 36 36 CYS H H 1 8.431 0.030 . 1 . . . . 36 CYS H . 10125 1 402 . 1 1 36 36 CYS HA H 1 3.518 0.030 . 1 . . . . 36 CYS HA . 10125 1 403 . 1 1 36 36 CYS HB2 H 1 2.702 0.030 . 2 . . . . 36 CYS HB2 . 10125 1 404 . 1 1 36 36 CYS HB3 H 1 3.118 0.030 . 2 . . . . 36 CYS HB3 . 10125 1 405 . 1 1 36 36 CYS C C 13 176.662 0.300 . 1 . . . . 36 CYS C . 10125 1 406 . 1 1 36 36 CYS CA C 13 64.748 0.300 . 1 . . . . 36 CYS CA . 10125 1 407 . 1 1 36 36 CYS CB C 13 26.202 0.300 . 1 . . . . 36 CYS CB . 10125 1 408 . 1 1 36 36 CYS N N 15 115.477 0.300 . 1 . . . . 36 CYS N . 10125 1 409 . 1 1 37 37 ARG H H 1 8.098 0.030 . 1 . . . . 37 ARG H . 10125 1 410 . 1 1 37 37 ARG HA H 1 4.028 0.030 . 1 . . . . 37 ARG HA . 10125 1 411 . 1 1 37 37 ARG HB2 H 1 1.914 0.030 . 1 . . . . 37 ARG HB2 . 10125 1 412 . 1 1 37 37 ARG HB3 H 1 1.914 0.030 . 1 . . . . 37 ARG HB3 . 10125 1 413 . 1 1 37 37 ARG HG2 H 1 1.562 0.030 . 2 . . . . 37 ARG HG2 . 10125 1 414 . 1 1 37 37 ARG HG3 H 1 1.784 0.030 . 2 . . . . 37 ARG HG3 . 10125 1 415 . 1 1 37 37 ARG HD2 H 1 3.144 0.030 . 2 . . . . 37 ARG HD2 . 10125 1 416 . 1 1 37 37 ARG HD3 H 1 3.203 0.030 . 2 . . . . 37 ARG HD3 . 10125 1 417 . 1 1 37 37 ARG C C 13 180.529 0.300 . 1 . . . . 37 ARG C . 10125 1 418 . 1 1 37 37 ARG CA C 13 59.412 0.300 . 1 . . . . 37 ARG CA . 10125 1 419 . 1 1 37 37 ARG CB C 13 30.093 0.300 . 1 . . . . 37 ARG CB . 10125 1 420 . 1 1 37 37 ARG CG C 13 27.430 0.300 . 1 . . . . 37 ARG CG . 10125 1 421 . 1 1 37 37 ARG CD C 13 43.781 0.300 . 1 . . . . 37 ARG CD . 10125 1 422 . 1 1 37 37 ARG N N 15 117.856 0.300 . 1 . . . . 37 ARG N . 10125 1 423 . 1 1 38 38 ARG H H 1 8.196 0.030 . 1 . . . . 38 ARG H . 10125 1 424 . 1 1 38 38 ARG HA H 1 3.919 0.030 . 1 . . . . 38 ARG HA . 10125 1 425 . 1 1 38 38 ARG HB2 H 1 1.868 0.030 . 2 . . . . 38 ARG HB2 . 10125 1 426 . 1 1 38 38 ARG HB3 H 1 1.951 0.030 . 2 . . . . 38 ARG HB3 . 10125 1 427 . 1 1 38 38 ARG HG2 H 1 1.604 0.030 . 2 . . . . 38 ARG HG2 . 10125 1 428 . 1 1 38 38 ARG HG3 H 1 1.836 0.030 . 2 . . . . 38 ARG HG3 . 10125 1 429 . 1 1 38 38 ARG HD2 H 1 3.251 0.030 . 2 . . . . 38 ARG HD2 . 10125 1 430 . 1 1 38 38 ARG HD3 H 1 3.214 0.030 . 2 . . . . 38 ARG HD3 . 10125 1 431 . 1 1 38 38 ARG HE H 1 7.649 0.030 . 1 . . . . 38 ARG HE . 10125 1 432 . 1 1 38 38 ARG C C 13 178.256 0.300 . 1 . . . . 38 ARG C . 10125 1 433 . 1 1 38 38 ARG CA C 13 59.541 0.300 . 1 . . . . 38 ARG CA . 10125 1 434 . 1 1 38 38 ARG CB C 13 30.305 0.300 . 1 . . . . 38 ARG CB . 10125 1 435 . 1 1 38 38 ARG CG C 13 27.610 0.300 . 1 . . . . 38 ARG CG . 10125 1 436 . 1 1 38 38 ARG CD C 13 43.794 0.300 . 1 . . . . 38 ARG CD . 10125 1 437 . 1 1 38 38 ARG N N 15 121.490 0.300 . 1 . . . . 38 ARG N . 10125 1 438 . 1 1 38 38 ARG NE N 15 85.005 0.300 . 1 . . . . 38 ARG NE . 10125 1 439 . 1 1 39 39 GLU H H 1 7.698 0.030 . 1 . . . . 39 GLU H . 10125 1 440 . 1 1 39 39 GLU HA H 1 3.883 0.030 . 1 . . . . 39 GLU HA . 10125 1 441 . 1 1 39 39 GLU HB2 H 1 0.890 0.030 . 2 . . . . 39 GLU HB2 . 10125 1 442 . 1 1 39 39 GLU HB3 H 1 1.793 0.030 . 2 . . . . 39 GLU HB3 . 10125 1 443 . 1 1 39 39 GLU HG2 H 1 1.078 0.030 . 2 . . . . 39 GLU HG2 . 10125 1 444 . 1 1 39 39 GLU HG3 H 1 1.365 0.030 . 2 . . . . 39 GLU HG3 . 10125 1 445 . 1 1 39 39 GLU C C 13 174.591 0.300 . 1 . . . . 39 GLU C . 10125 1 446 . 1 1 39 39 GLU CA C 13 55.338 0.300 . 1 . . . . 39 GLU CA . 10125 1 447 . 1 1 39 39 GLU CB C 13 29.479 0.300 . 1 . . . . 39 GLU CB . 10125 1 448 . 1 1 39 39 GLU CG C 13 34.725 0.300 . 1 . . . . 39 GLU CG . 10125 1 449 . 1 1 39 39 GLU N N 15 116.157 0.300 . 1 . . . . 39 GLU N . 10125 1 450 . 1 1 40 40 LYS H H 1 7.556 0.030 . 1 . . . . 40 LYS H . 10125 1 451 . 1 1 40 40 LYS HA H 1 3.767 0.030 . 1 . . . . 40 LYS HA . 10125 1 452 . 1 1 40 40 LYS HB2 H 1 1.823 0.030 . 2 . . . . 40 LYS HB2 . 10125 1 453 . 1 1 40 40 LYS HB3 H 1 2.035 0.030 . 2 . . . . 40 LYS HB3 . 10125 1 454 . 1 1 40 40 LYS HG2 H 1 1.275 0.030 . 1 . . . . 40 LYS HG2 . 10125 1 455 . 1 1 40 40 LYS HG3 H 1 1.275 0.030 . 1 . . . . 40 LYS HG3 . 10125 1 456 . 1 1 40 40 LYS HD2 H 1 1.596 0.030 . 2 . . . . 40 LYS HD2 . 10125 1 457 . 1 1 40 40 LYS HD3 H 1 1.672 0.030 . 2 . . . . 40 LYS HD3 . 10125 1 458 . 1 1 40 40 LYS HE2 H 1 2.963 0.030 . 1 . . . . 40 LYS HE2 . 10125 1 459 . 1 1 40 40 LYS HE3 H 1 2.963 0.030 . 1 . . . . 40 LYS HE3 . 10125 1 460 . 1 1 40 40 LYS C C 13 175.712 0.300 . 1 . . . . 40 LYS C . 10125 1 461 . 1 1 40 40 LYS CA C 13 57.181 0.300 . 1 . . . . 40 LYS CA . 10125 1 462 . 1 1 40 40 LYS CB C 13 28.370 0.300 . 1 . . . . 40 LYS CB . 10125 1 463 . 1 1 40 40 LYS CG C 13 25.094 0.300 . 1 . . . . 40 LYS CG . 10125 1 464 . 1 1 40 40 LYS CD C 13 29.025 0.300 . 1 . . . . 40 LYS CD . 10125 1 465 . 1 1 40 40 LYS CE C 13 42.379 0.300 . 1 . . . . 40 LYS CE . 10125 1 466 . 1 1 40 40 LYS N N 15 115.364 0.300 . 1 . . . . 40 LYS N . 10125 1 467 . 1 1 41 41 LEU H H 1 8.364 0.030 . 1 . . . . 41 LEU H . 10125 1 468 . 1 1 41 41 LEU HA H 1 4.696 0.030 . 1 . . . . 41 LEU HA . 10125 1 469 . 1 1 41 41 LEU HB2 H 1 1.341 0.030 . 1 . . . . 41 LEU HB2 . 10125 1 470 . 1 1 41 41 LEU HB3 H 1 1.341 0.030 . 1 . . . . 41 LEU HB3 . 10125 1 471 . 1 1 41 41 LEU HG H 1 1.335 0.030 . 1 . . . . 41 LEU HG . 10125 1 472 . 1 1 41 41 LEU HD11 H 1 0.840 0.030 . 1 . . . . 41 LEU HD1 . 10125 1 473 . 1 1 41 41 LEU HD12 H 1 0.840 0.030 . 1 . . . . 41 LEU HD1 . 10125 1 474 . 1 1 41 41 LEU HD13 H 1 0.840 0.030 . 1 . . . . 41 LEU HD1 . 10125 1 475 . 1 1 41 41 LEU HD21 H 1 0.597 0.030 . 1 . . . . 41 LEU HD2 . 10125 1 476 . 1 1 41 41 LEU HD22 H 1 0.597 0.030 . 1 . . . . 41 LEU HD2 . 10125 1 477 . 1 1 41 41 LEU HD23 H 1 0.597 0.030 . 1 . . . . 41 LEU HD2 . 10125 1 478 . 1 1 41 41 LEU C C 13 174.580 0.300 . 1 . . . . 41 LEU C . 10125 1 479 . 1 1 41 41 LEU CA C 13 52.046 0.300 . 1 . . . . 41 LEU CA . 10125 1 480 . 1 1 41 41 LEU CB C 13 43.081 0.300 . 1 . . . . 41 LEU CB . 10125 1 481 . 1 1 41 41 LEU CG C 13 26.564 0.300 . 1 . . . . 41 LEU CG . 10125 1 482 . 1 1 41 41 LEU CD1 C 13 22.758 0.300 . 2 . . . . 41 LEU CD1 . 10125 1 483 . 1 1 41 41 LEU CD2 C 13 26.711 0.300 . 2 . . . . 41 LEU CD2 . 10125 1 484 . 1 1 41 41 LEU N N 15 120.235 0.300 . 1 . . . . 41 LEU N . 10125 1 485 . 1 1 42 42 PRO HA H 1 4.369 0.030 . 1 . . . . 42 PRO HA . 10125 1 486 . 1 1 42 42 PRO HB2 H 1 1.816 0.030 . 2 . . . . 42 PRO HB2 . 10125 1 487 . 1 1 42 42 PRO HB3 H 1 2.351 0.030 . 2 . . . . 42 PRO HB3 . 10125 1 488 . 1 1 42 42 PRO HG2 H 1 2.081 0.030 . 1 . . . . 42 PRO HG2 . 10125 1 489 . 1 1 42 42 PRO HG3 H 1 2.081 0.030 . 1 . . . . 42 PRO HG3 . 10125 1 490 . 1 1 42 42 PRO HD2 H 1 3.519 0.030 . 2 . . . . 42 PRO HD2 . 10125 1 491 . 1 1 42 42 PRO HD3 H 1 3.847 0.030 . 2 . . . . 42 PRO HD3 . 10125 1 492 . 1 1 42 42 PRO C C 13 175.527 0.300 . 1 . . . . 42 PRO C . 10125 1 493 . 1 1 42 42 PRO CA C 13 62.108 0.300 . 1 . . . . 42 PRO CA . 10125 1 494 . 1 1 42 42 PRO CB C 13 31.718 0.300 . 1 . . . . 42 PRO CB . 10125 1 495 . 1 1 42 42 PRO CG C 13 27.737 0.300 . 1 . . . . 42 PRO CG . 10125 1 496 . 1 1 42 42 PRO CD C 13 50.366 0.300 . 1 . . . . 42 PRO CD . 10125 1 497 . 1 1 43 43 GLN H H 1 8.170 0.030 . 1 . . . . 43 GLN H . 10125 1 498 . 1 1 43 43 GLN HA H 1 4.286 0.030 . 1 . . . . 43 GLN HA . 10125 1 499 . 1 1 43 43 GLN HB2 H 1 2.023 0.030 . 1 . . . . 43 GLN HB2 . 10125 1 500 . 1 1 43 43 GLN HB3 H 1 2.023 0.030 . 1 . . . . 43 GLN HB3 . 10125 1 501 . 1 1 43 43 GLN HG2 H 1 2.448 0.030 . 1 . . . . 43 GLN HG2 . 10125 1 502 . 1 1 43 43 GLN HG3 H 1 2.448 0.030 . 1 . . . . 43 GLN HG3 . 10125 1 503 . 1 1 43 43 GLN HE21 H 1 7.650 0.030 . 2 . . . . 43 GLN HE21 . 10125 1 504 . 1 1 43 43 GLN HE22 H 1 6.891 0.030 . 2 . . . . 43 GLN HE22 . 10125 1 505 . 1 1 43 43 GLN C C 13 174.498 0.300 . 1 . . . . 43 GLN C . 10125 1 506 . 1 1 43 43 GLN CA C 13 55.022 0.300 . 1 . . . . 43 GLN CA . 10125 1 507 . 1 1 43 43 GLN CB C 13 27.533 0.300 . 1 . . . . 43 GLN CB . 10125 1 508 . 1 1 43 43 GLN CG C 13 33.828 0.300 . 1 . . . . 43 GLN CG . 10125 1 509 . 1 1 43 43 GLN N N 15 118.536 0.300 . 1 . . . . 43 GLN N . 10125 1 510 . 1 1 43 43 GLN NE2 N 15 112.079 0.300 . 1 . . . . 43 GLN NE2 . 10125 1 511 . 1 1 44 44 PRO HA H 1 4.369 0.030 . 1 . . . . 44 PRO HA . 10125 1 512 . 1 1 44 44 PRO HB2 H 1 1.590 0.030 . 2 . . . . 44 PRO HB2 . 10125 1 513 . 1 1 44 44 PRO HB3 H 1 1.729 0.030 . 2 . . . . 44 PRO HB3 . 10125 1 514 . 1 1 44 44 PRO HG2 H 1 2.246 0.030 . 2 . . . . 44 PRO HG2 . 10125 1 515 . 1 1 44 44 PRO HG3 H 1 1.929 0.030 . 2 . . . . 44 PRO HG3 . 10125 1 516 . 1 1 44 44 PRO HD2 H 1 3.647 0.030 . 2 . . . . 44 PRO HD2 . 10125 1 517 . 1 1 44 44 PRO HD3 H 1 4.155 0.030 . 2 . . . . 44 PRO HD3 . 10125 1 518 . 1 1 44 44 PRO C C 13 175.523 0.300 . 1 . . . . 44 PRO C . 10125 1 519 . 1 1 44 44 PRO CA C 13 63.071 0.300 . 1 . . . . 44 PRO CA . 10125 1 520 . 1 1 44 44 PRO CB C 13 32.945 0.300 . 1 . . . . 44 PRO CB . 10125 1 521 . 1 1 44 44 PRO CG C 13 28.569 0.300 . 1 . . . . 44 PRO CG . 10125 1 522 . 1 1 44 44 PRO CD C 13 50.865 0.300 . 1 . . . . 44 PRO CD . 10125 1 523 . 1 1 45 45 VAL H H 1 7.457 0.030 . 1 . . . . 45 VAL H . 10125 1 524 . 1 1 45 45 VAL HA H 1 4.332 0.030 . 1 . . . . 45 VAL HA . 10125 1 525 . 1 1 45 45 VAL HB H 1 1.816 0.030 . 1 . . . . 45 VAL HB . 10125 1 526 . 1 1 45 45 VAL HG11 H 1 0.917 0.030 . 1 . . . . 45 VAL HG1 . 10125 1 527 . 1 1 45 45 VAL HG12 H 1 0.917 0.030 . 1 . . . . 45 VAL HG1 . 10125 1 528 . 1 1 45 45 VAL HG13 H 1 0.917 0.030 . 1 . . . . 45 VAL HG1 . 10125 1 529 . 1 1 45 45 VAL HG21 H 1 0.974 0.030 . 1 . . . . 45 VAL HG2 . 10125 1 530 . 1 1 45 45 VAL HG22 H 1 0.974 0.030 . 1 . . . . 45 VAL HG2 . 10125 1 531 . 1 1 45 45 VAL HG23 H 1 0.974 0.030 . 1 . . . . 45 VAL HG2 . 10125 1 532 . 1 1 45 45 VAL C C 13 174.276 0.300 . 1 . . . . 45 VAL C . 10125 1 533 . 1 1 45 45 VAL CA C 13 61.398 0.300 . 1 . . . . 45 VAL CA . 10125 1 534 . 1 1 45 45 VAL CB C 13 34.991 0.300 . 1 . . . . 45 VAL CB . 10125 1 535 . 1 1 45 45 VAL CG1 C 13 21.321 0.300 . 2 . . . . 45 VAL CG1 . 10125 1 536 . 1 1 45 45 VAL CG2 C 13 20.962 0.300 . 2 . . . . 45 VAL CG2 . 10125 1 537 . 1 1 45 45 VAL N N 15 121.255 0.300 . 1 . . . . 45 VAL N . 10125 1 538 . 1 1 46 46 TYR H H 1 8.970 0.030 . 1 . . . . 46 TYR H . 10125 1 539 . 1 1 46 46 TYR HA H 1 4.973 0.030 . 1 . . . . 46 TYR HA . 10125 1 540 . 1 1 46 46 TYR HB2 H 1 2.573 0.030 . 2 . . . . 46 TYR HB2 . 10125 1 541 . 1 1 46 46 TYR HB3 H 1 2.740 0.030 . 2 . . . . 46 TYR HB3 . 10125 1 542 . 1 1 46 46 TYR HD1 H 1 6.893 0.030 . 1 . . . . 46 TYR HD1 . 10125 1 543 . 1 1 46 46 TYR HD2 H 1 6.893 0.030 . 1 . . . . 46 TYR HD2 . 10125 1 544 . 1 1 46 46 TYR HE1 H 1 6.650 0.030 . 1 . . . . 46 TYR HE1 . 10125 1 545 . 1 1 46 46 TYR HE2 H 1 6.650 0.030 . 1 . . . . 46 TYR HE2 . 10125 1 546 . 1 1 46 46 TYR C C 13 175.868 0.300 . 1 . . . . 46 TYR C . 10125 1 547 . 1 1 46 46 TYR CA C 13 57.682 0.300 . 1 . . . . 46 TYR CA . 10125 1 548 . 1 1 46 46 TYR CB C 13 40.656 0.300 . 1 . . . . 46 TYR CB . 10125 1 549 . 1 1 46 46 TYR CD1 C 13 132.613 0.300 . 1 . . . . 46 TYR CD1 . 10125 1 550 . 1 1 46 46 TYR CD2 C 13 132.613 0.300 . 1 . . . . 46 TYR CD2 . 10125 1 551 . 1 1 46 46 TYR CE1 C 13 118.294 0.300 . 1 . . . . 46 TYR CE1 . 10125 1 552 . 1 1 46 46 TYR CE2 C 13 118.294 0.300 . 1 . . . . 46 TYR CE2 . 10125 1 553 . 1 1 46 46 TYR N N 15 125.786 0.300 . 1 . . . . 46 TYR N . 10125 1 554 . 1 1 47 47 GLU H H 1 8.999 0.030 . 1 . . . . 47 GLU H . 10125 1 555 . 1 1 47 47 GLU HA H 1 4.709 0.030 . 1 . . . . 47 GLU HA . 10125 1 556 . 1 1 47 47 GLU HB2 H 1 1.907 0.030 . 2 . . . . 47 GLU HB2 . 10125 1 557 . 1 1 47 47 GLU HB3 H 1 2.027 0.030 . 2 . . . . 47 GLU HB3 . 10125 1 558 . 1 1 47 47 GLU HG2 H 1 2.127 0.030 . 1 . . . . 47 GLU HG2 . 10125 1 559 . 1 1 47 47 GLU HG3 H 1 2.127 0.030 . 1 . . . . 47 GLU HG3 . 10125 1 560 . 1 1 47 47 GLU C C 13 175.484 0.300 . 1 . . . . 47 GLU C . 10125 1 561 . 1 1 47 47 GLU CA C 13 55.617 0.300 . 1 . . . . 47 GLU CA . 10125 1 562 . 1 1 47 47 GLU CB C 13 32.451 0.300 . 1 . . . . 47 GLU CB . 10125 1 563 . 1 1 47 47 GLU CG C 13 36.472 0.300 . 1 . . . . 47 GLU CG . 10125 1 564 . 1 1 47 47 GLU N N 15 124.993 0.300 . 1 . . . . 47 GLU N . 10125 1 565 . 1 1 48 48 THR H H 1 9.144 0.030 . 1 . . . . 48 THR H . 10125 1 566 . 1 1 48 48 THR HA H 1 5.007 0.030 . 1 . . . . 48 THR HA . 10125 1 567 . 1 1 48 48 THR HB H 1 3.919 0.030 . 1 . . . . 48 THR HB . 10125 1 568 . 1 1 48 48 THR HG21 H 1 1.298 0.030 . 1 . . . . 48 THR HG2 . 10125 1 569 . 1 1 48 48 THR HG22 H 1 1.298 0.030 . 1 . . . . 48 THR HG2 . 10125 1 570 . 1 1 48 48 THR HG23 H 1 1.298 0.030 . 1 . . . . 48 THR HG2 . 10125 1 571 . 1 1 48 48 THR C C 13 173.529 0.300 . 1 . . . . 48 THR C . 10125 1 572 . 1 1 48 48 THR CA C 13 62.960 0.300 . 1 . . . . 48 THR CA . 10125 1 573 . 1 1 48 48 THR CB C 13 69.492 0.300 . 1 . . . . 48 THR CB . 10125 1 574 . 1 1 48 48 THR CG2 C 13 23.910 0.300 . 1 . . . . 48 THR CG2 . 10125 1 575 . 1 1 48 48 THR N N 15 125.333 0.300 . 1 . . . . 48 THR N . 10125 1 576 . 1 1 49 49 VAL H H 1 8.735 0.030 . 1 . . . . 49 VAL H . 10125 1 577 . 1 1 49 49 VAL HA H 1 4.678 0.030 . 1 . . . . 49 VAL HA . 10125 1 578 . 1 1 49 49 VAL HB H 1 2.190 0.030 . 1 . . . . 49 VAL HB . 10125 1 579 . 1 1 49 49 VAL HG11 H 1 1.003 0.030 . 1 . . . . 49 VAL HG1 . 10125 1 580 . 1 1 49 49 VAL HG12 H 1 1.003 0.030 . 1 . . . . 49 VAL HG1 . 10125 1 581 . 1 1 49 49 VAL HG13 H 1 1.003 0.030 . 1 . . . . 49 VAL HG1 . 10125 1 582 . 1 1 49 49 VAL HG21 H 1 0.980 0.030 . 1 . . . . 49 VAL HG2 . 10125 1 583 . 1 1 49 49 VAL HG22 H 1 0.980 0.030 . 1 . . . . 49 VAL HG2 . 10125 1 584 . 1 1 49 49 VAL HG23 H 1 0.980 0.030 . 1 . . . . 49 VAL HG2 . 10125 1 585 . 1 1 49 49 VAL C C 13 172.804 0.300 . 1 . . . . 49 VAL C . 10125 1 586 . 1 1 49 49 VAL CA C 13 59.939 0.300 . 1 . . . . 49 VAL CA . 10125 1 587 . 1 1 49 49 VAL CB C 13 35.336 0.300 . 1 . . . . 49 VAL CB . 10125 1 588 . 1 1 49 49 VAL CG1 C 13 21.095 0.300 . 2 . . . . 49 VAL CG1 . 10125 1 589 . 1 1 49 49 VAL CG2 C 13 19.728 0.300 . 2 . . . . 49 VAL CG2 . 10125 1 590 . 1 1 49 49 VAL N N 15 124.993 0.300 . 1 . . . . 49 VAL N . 10125 1 591 . 1 1 50 50 GLN H H 1 8.375 0.030 . 1 . . . . 50 GLN H . 10125 1 592 . 1 1 50 50 GLN HA H 1 5.086 0.030 . 1 . . . . 50 GLN HA . 10125 1 593 . 1 1 50 50 GLN HB2 H 1 1.309 0.030 . 2 . . . . 50 GLN HB2 . 10125 1 594 . 1 1 50 50 GLN HB3 H 1 1.757 0.030 . 2 . . . . 50 GLN HB3 . 10125 1 595 . 1 1 50 50 GLN HG2 H 1 1.543 0.030 . 2 . . . . 50 GLN HG2 . 10125 1 596 . 1 1 50 50 GLN HG3 H 1 0.928 0.030 . 2 . . . . 50 GLN HG3 . 10125 1 597 . 1 1 50 50 GLN HE21 H 1 6.920 0.030 . 2 . . . . 50 GLN HE21 . 10125 1 598 . 1 1 50 50 GLN HE22 H 1 7.010 0.030 . 2 . . . . 50 GLN HE22 . 10125 1 599 . 1 1 50 50 GLN C C 13 175.897 0.300 . 1 . . . . 50 GLN C . 10125 1 600 . 1 1 50 50 GLN CA C 13 52.980 0.300 . 1 . . . . 50 GLN CA . 10125 1 601 . 1 1 50 50 GLN CB C 13 31.561 0.300 . 1 . . . . 50 GLN CB . 10125 1 602 . 1 1 50 50 GLN CG C 13 33.311 0.300 . 1 . . . . 50 GLN CG . 10125 1 603 . 1 1 50 50 GLN N N 15 122.474 0.300 . 1 . . . . 50 GLN N . 10125 1 604 . 1 1 50 50 GLN NE2 N 15 113.778 0.300 . 1 . . . . 50 GLN NE2 . 10125 1 605 . 1 1 51 51 ARG H H 1 8.962 0.030 . 1 . . . . 51 ARG H . 10125 1 606 . 1 1 51 51 ARG HA H 1 4.879 0.030 . 1 . . . . 51 ARG HA . 10125 1 607 . 1 1 51 51 ARG HB2 H 1 1.500 0.030 . 2 . . . . 51 ARG HB2 . 10125 1 608 . 1 1 51 51 ARG HB3 H 1 1.658 0.030 . 2 . . . . 51 ARG HB3 . 10125 1 609 . 1 1 51 51 ARG HG2 H 1 1.310 0.030 . 1 . . . . 51 ARG HG2 . 10125 1 610 . 1 1 51 51 ARG HG3 H 1 1.310 0.030 . 1 . . . . 51 ARG HG3 . 10125 1 611 . 1 1 51 51 ARG HD2 H 1 2.180 0.030 . 2 . . . . 51 ARG HD2 . 10125 1 612 . 1 1 51 51 ARG HD3 H 1 0.855 0.030 . 2 . . . . 51 ARG HD3 . 10125 1 613 . 1 1 51 51 ARG HE H 1 5.361 0.030 . 1 . . . . 51 ARG HE . 10125 1 614 . 1 1 51 51 ARG C C 13 176.541 0.300 . 1 . . . . 51 ARG C . 10125 1 615 . 1 1 51 51 ARG CA C 13 53.975 0.300 . 1 . . . . 51 ARG CA . 10125 1 616 . 1 1 51 51 ARG CB C 13 31.397 0.300 . 1 . . . . 51 ARG CB . 10125 1 617 . 1 1 51 51 ARG CG C 13 25.324 0.300 . 1 . . . . 51 ARG CG . 10125 1 618 . 1 1 51 51 ARG CD C 13 43.062 0.300 . 1 . . . . 51 ARG CD . 10125 1 619 . 1 1 51 51 ARG N N 15 126.466 0.300 . 1 . . . . 51 ARG N . 10125 1 620 . 1 1 52 52 THR H H 1 8.440 0.030 . 1 . . . . 52 THR H . 10125 1 621 . 1 1 52 52 THR HA H 1 3.795 0.030 . 1 . . . . 52 THR HA . 10125 1 622 . 1 1 52 52 THR HB H 1 4.111 0.030 . 1 . . . . 52 THR HB . 10125 1 623 . 1 1 52 52 THR HG21 H 1 1.206 0.030 . 1 . . . . 52 THR HG2 . 10125 1 624 . 1 1 52 52 THR HG22 H 1 1.206 0.030 . 1 . . . . 52 THR HG2 . 10125 1 625 . 1 1 52 52 THR HG23 H 1 1.206 0.030 . 1 . . . . 52 THR HG2 . 10125 1 626 . 1 1 52 52 THR C C 13 177.504 0.300 . 1 . . . . 52 THR C . 10125 1 627 . 1 1 52 52 THR CA C 13 65.162 0.300 . 1 . . . . 52 THR CA . 10125 1 628 . 1 1 52 52 THR CB C 13 68.935 0.300 . 1 . . . . 52 THR CB . 10125 1 629 . 1 1 52 52 THR CG2 C 13 22.162 0.300 . 1 . . . . 52 THR CG2 . 10125 1 630 . 1 1 52 52 THR N N 15 117.035 0.300 . 1 . . . . 52 THR N . 10125 1 631 . 1 1 53 53 ILE H H 1 7.940 0.030 . 1 . . . . 53 ILE H . 10125 1 632 . 1 1 53 53 ILE HA H 1 3.919 0.030 . 1 . . . . 53 ILE HA . 10125 1 633 . 1 1 53 53 ILE HB H 1 1.767 0.030 . 1 . . . . 53 ILE HB . 10125 1 634 . 1 1 53 53 ILE HG12 H 1 1.064 0.030 . 2 . . . . 53 ILE HG12 . 10125 1 635 . 1 1 53 53 ILE HG13 H 1 1.308 0.030 . 2 . . . . 53 ILE HG13 . 10125 1 636 . 1 1 53 53 ILE HG21 H 1 0.667 0.030 . 1 . . . . 53 ILE HG2 . 10125 1 637 . 1 1 53 53 ILE HG22 H 1 0.667 0.030 . 1 . . . . 53 ILE HG2 . 10125 1 638 . 1 1 53 53 ILE HG23 H 1 0.667 0.030 . 1 . . . . 53 ILE HG2 . 10125 1 639 . 1 1 53 53 ILE HD11 H 1 0.790 0.030 . 1 . . . . 53 ILE HD1 . 10125 1 640 . 1 1 53 53 ILE HD12 H 1 0.790 0.030 . 1 . . . . 53 ILE HD1 . 10125 1 641 . 1 1 53 53 ILE HD13 H 1 0.790 0.030 . 1 . . . . 53 ILE HD1 . 10125 1 642 . 1 1 53 53 ILE C C 13 175.428 0.300 . 1 . . . . 53 ILE C . 10125 1 643 . 1 1 53 53 ILE CA C 13 63.642 0.300 . 1 . . . . 53 ILE CA . 10125 1 644 . 1 1 53 53 ILE CB C 13 37.425 0.300 . 1 . . . . 53 ILE CB . 10125 1 645 . 1 1 53 53 ILE CG1 C 13 28.328 0.300 . 1 . . . . 53 ILE CG1 . 10125 1 646 . 1 1 53 53 ILE CG2 C 13 16.829 0.300 . 1 . . . . 53 ILE CG2 . 10125 1 647 . 1 1 53 53 ILE CD1 C 13 13.712 0.300 . 1 . . . . 53 ILE CD1 . 10125 1 648 . 1 1 53 53 ILE N N 15 118.705 0.300 . 1 . . . . 53 ILE N . 10125 1 649 . 1 1 54 54 ASP H H 1 6.835 0.030 . 1 . . . . 54 ASP H . 10125 1 650 . 1 1 54 54 ASP HA H 1 4.612 0.030 . 1 . . . . 54 ASP HA . 10125 1 651 . 1 1 54 54 ASP HB2 H 1 2.347 0.030 . 2 . . . . 54 ASP HB2 . 10125 1 652 . 1 1 54 54 ASP HB3 H 1 2.983 0.030 . 2 . . . . 54 ASP HB3 . 10125 1 653 . 1 1 54 54 ASP C C 13 175.361 0.300 . 1 . . . . 54 ASP C . 10125 1 654 . 1 1 54 54 ASP CA C 13 52.139 0.300 . 1 . . . . 54 ASP CA . 10125 1 655 . 1 1 54 54 ASP CB C 13 41.451 0.300 . 1 . . . . 54 ASP CB . 10125 1 656 . 1 1 54 54 ASP N N 15 116.157 0.300 . 1 . . . . 54 ASP N . 10125 1 657 . 1 1 55 55 ARG H H 1 7.540 0.030 . 1 . . . . 55 ARG H . 10125 1 658 . 1 1 55 55 ARG HA H 1 3.858 0.030 . 1 . . . . 55 ARG HA . 10125 1 659 . 1 1 55 55 ARG HB2 H 1 1.937 0.030 . 2 . . . . 55 ARG HB2 . 10125 1 660 . 1 1 55 55 ARG HB3 H 1 2.085 0.030 . 2 . . . . 55 ARG HB3 . 10125 1 661 . 1 1 55 55 ARG HG2 H 1 1.456 0.030 . 2 . . . . 55 ARG HG2 . 10125 1 662 . 1 1 55 55 ARG HG3 H 1 1.572 0.030 . 2 . . . . 55 ARG HG3 . 10125 1 663 . 1 1 55 55 ARG HD2 H 1 3.118 0.030 . 2 . . . . 55 ARG HD2 . 10125 1 664 . 1 1 55 55 ARG HD3 H 1 3.156 0.030 . 2 . . . . 55 ARG HD3 . 10125 1 665 . 1 1 55 55 ARG C C 13 175.817 0.300 . 1 . . . . 55 ARG C . 10125 1 666 . 1 1 55 55 ARG CA C 13 57.594 0.300 . 1 . . . . 55 ARG CA . 10125 1 667 . 1 1 55 55 ARG CB C 13 26.705 0.300 . 1 . . . . 55 ARG CB . 10125 1 668 . 1 1 55 55 ARG CG C 13 27.610 0.300 . 1 . . . . 55 ARG CG . 10125 1 669 . 1 1 55 55 ARG CD C 13 43.062 0.300 . 1 . . . . 55 ARG CD . 10125 1 670 . 1 1 55 55 ARG N N 15 111.966 0.300 . 1 . . . . 55 ARG N . 10125 1 671 . 1 1 56 56 MET H H 1 7.355 0.030 . 1 . . . . 56 MET H . 10125 1 672 . 1 1 56 56 MET HA H 1 4.867 0.030 . 1 . . . . 56 MET HA . 10125 1 673 . 1 1 56 56 MET HB2 H 1 2.306 0.030 . 2 . . . . 56 MET HB2 . 10125 1 674 . 1 1 56 56 MET HB3 H 1 2.554 0.030 . 2 . . . . 56 MET HB3 . 10125 1 675 . 1 1 56 56 MET HG2 H 1 2.449 0.030 . 2 . . . . 56 MET HG2 . 10125 1 676 . 1 1 56 56 MET HG3 H 1 2.065 0.030 . 2 . . . . 56 MET HG3 . 10125 1 677 . 1 1 56 56 MET HE1 H 1 2.019 0.030 . 1 . . . . 56 MET HE . 10125 1 678 . 1 1 56 56 MET HE2 H 1 2.019 0.030 . 1 . . . . 56 MET HE . 10125 1 679 . 1 1 56 56 MET HE3 H 1 2.019 0.030 . 1 . . . . 56 MET HE . 10125 1 680 . 1 1 56 56 MET C C 13 174.344 0.300 . 1 . . . . 56 MET C . 10125 1 681 . 1 1 56 56 MET CA C 13 55.939 0.300 . 1 . . . . 56 MET CA . 10125 1 682 . 1 1 56 56 MET CB C 13 34.218 0.300 . 1 . . . . 56 MET CB . 10125 1 683 . 1 1 56 56 MET CG C 13 34.226 0.300 . 1 . . . . 56 MET CG . 10125 1 684 . 1 1 56 56 MET CE C 13 17.907 0.300 . 1 . . . . 56 MET CE . 10125 1 685 . 1 1 56 56 MET N N 15 117.403 0.300 . 1 . . . . 56 MET N . 10125 1 686 . 1 1 57 57 PHE H H 1 9.882 0.030 . 1 . . . . 57 PHE H . 10125 1 687 . 1 1 57 57 PHE HA H 1 5.978 0.030 . 1 . . . . 57 PHE HA . 10125 1 688 . 1 1 57 57 PHE HB2 H 1 2.539 0.030 . 1 . . . . 57 PHE HB2 . 10125 1 689 . 1 1 57 57 PHE HB3 H 1 2.539 0.030 . 1 . . . . 57 PHE HB3 . 10125 1 690 . 1 1 57 57 PHE HD1 H 1 7.008 0.030 . 1 . . . . 57 PHE HD1 . 10125 1 691 . 1 1 57 57 PHE HD2 H 1 7.008 0.030 . 1 . . . . 57 PHE HD2 . 10125 1 692 . 1 1 57 57 PHE HE1 H 1 7.376 0.030 . 1 . . . . 57 PHE HE1 . 10125 1 693 . 1 1 57 57 PHE HE2 H 1 7.376 0.030 . 1 . . . . 57 PHE HE2 . 10125 1 694 . 1 1 57 57 PHE HZ H 1 7.295 0.030 . 1 . . . . 57 PHE HZ . 10125 1 695 . 1 1 57 57 PHE C C 13 175.281 0.300 . 1 . . . . 57 PHE C . 10125 1 696 . 1 1 57 57 PHE CA C 13 57.209 0.300 . 1 . . . . 57 PHE CA . 10125 1 697 . 1 1 57 57 PHE CB C 13 44.469 0.300 . 1 . . . . 57 PHE CB . 10125 1 698 . 1 1 57 57 PHE CD1 C 13 131.676 0.300 . 1 . . . . 57 PHE CD1 . 10125 1 699 . 1 1 57 57 PHE CD2 C 13 131.676 0.300 . 1 . . . . 57 PHE CD2 . 10125 1 700 . 1 1 57 57 PHE CE1 C 13 131.642 0.300 . 1 . . . . 57 PHE CE1 . 10125 1 701 . 1 1 57 57 PHE CE2 C 13 131.642 0.300 . 1 . . . . 57 PHE CE2 . 10125 1 702 . 1 1 57 57 PHE CZ C 13 131.103 0.300 . 1 . . . . 57 PHE CZ . 10125 1 703 . 1 1 57 57 PHE N N 15 116.497 0.300 . 1 . . . . 57 PHE N . 10125 1 704 . 1 1 58 58 CYS H H 1 8.408 0.030 . 1 . . . . 58 CYS H . 10125 1 705 . 1 1 58 58 CYS HA H 1 4.448 0.030 . 1 . . . . 58 CYS HA . 10125 1 706 . 1 1 58 58 CYS HB2 H 1 0.814 0.030 . 2 . . . . 58 CYS HB2 . 10125 1 707 . 1 1 58 58 CYS HB3 H 1 0.718 0.030 . 2 . . . . 58 CYS HB3 . 10125 1 708 . 1 1 58 58 CYS C C 13 173.605 0.300 . 1 . . . . 58 CYS C . 10125 1 709 . 1 1 58 58 CYS CA C 13 58.936 0.300 . 1 . . . . 58 CYS CA . 10125 1 710 . 1 1 58 58 CYS CB C 13 25.452 0.300 . 1 . . . . 58 CYS CB . 10125 1 711 . 1 1 58 58 CYS N N 15 118.763 0.300 . 1 . . . . 58 CYS N . 10125 1 712 . 1 1 59 59 SER H H 1 9.711 0.030 . 1 . . . . 59 SER H . 10125 1 713 . 1 1 59 59 SER HA H 1 5.463 0.030 . 1 . . . . 59 SER HA . 10125 1 714 . 1 1 59 59 SER HB2 H 1 3.475 0.030 . 2 . . . . 59 SER HB2 . 10125 1 715 . 1 1 59 59 SER HB3 H 1 3.655 0.030 . 2 . . . . 59 SER HB3 . 10125 1 716 . 1 1 59 59 SER C C 13 172.565 0.300 . 1 . . . . 59 SER C . 10125 1 717 . 1 1 59 59 SER CA C 13 57.795 0.300 . 1 . . . . 59 SER CA . 10125 1 718 . 1 1 59 59 SER CB C 13 65.587 0.300 . 1 . . . . 59 SER CB . 10125 1 719 . 1 1 59 59 SER N N 15 126.692 0.300 . 1 . . . . 59 SER N . 10125 1 720 . 1 1 60 60 VAL H H 1 8.829 0.030 . 1 . . . . 60 VAL H . 10125 1 721 . 1 1 60 60 VAL HA H 1 4.842 0.030 . 1 . . . . 60 VAL HA . 10125 1 722 . 1 1 60 60 VAL HB H 1 1.938 0.030 . 1 . . . . 60 VAL HB . 10125 1 723 . 1 1 60 60 VAL HG11 H 1 0.856 0.030 . 1 . . . . 60 VAL HG1 . 10125 1 724 . 1 1 60 60 VAL HG12 H 1 0.856 0.030 . 1 . . . . 60 VAL HG1 . 10125 1 725 . 1 1 60 60 VAL HG13 H 1 0.856 0.030 . 1 . . . . 60 VAL HG1 . 10125 1 726 . 1 1 60 60 VAL HG21 H 1 0.873 0.030 . 1 . . . . 60 VAL HG2 . 10125 1 727 . 1 1 60 60 VAL HG22 H 1 0.873 0.030 . 1 . . . . 60 VAL HG2 . 10125 1 728 . 1 1 60 60 VAL HG23 H 1 0.873 0.030 . 1 . . . . 60 VAL HG2 . 10125 1 729 . 1 1 60 60 VAL C C 13 176.308 0.300 . 1 . . . . 60 VAL C . 10125 1 730 . 1 1 60 60 VAL CA C 13 60.547 0.300 . 1 . . . . 60 VAL CA . 10125 1 731 . 1 1 60 60 VAL CB C 13 34.258 0.300 . 1 . . . . 60 VAL CB . 10125 1 732 . 1 1 60 60 VAL CG1 C 13 21.501 0.300 . 2 . . . . 60 VAL CG1 . 10125 1 733 . 1 1 60 60 VAL CG2 C 13 21.680 0.300 . 2 . . . . 60 VAL CG2 . 10125 1 734 . 1 1 60 60 VAL N N 15 124.993 0.300 . 1 . . . . 60 VAL N . 10125 1 735 . 1 1 61 61 VAL H H 1 9.039 0.030 . 1 . . . . 61 VAL H . 10125 1 736 . 1 1 61 61 VAL HA H 1 5.368 0.030 . 1 . . . . 61 VAL HA . 10125 1 737 . 1 1 61 61 VAL HB H 1 1.516 0.030 . 1 . . . . 61 VAL HB . 10125 1 738 . 1 1 61 61 VAL HG11 H 1 0.797 0.030 . 1 . . . . 61 VAL HG1 . 10125 1 739 . 1 1 61 61 VAL HG12 H 1 0.797 0.030 . 1 . . . . 61 VAL HG1 . 10125 1 740 . 1 1 61 61 VAL HG13 H 1 0.797 0.030 . 1 . . . . 61 VAL HG1 . 10125 1 741 . 1 1 61 61 VAL HG21 H 1 -0.011 0.030 . 1 . . . . 61 VAL HG2 . 10125 1 742 . 1 1 61 61 VAL HG22 H 1 -0.011 0.030 . 1 . . . . 61 VAL HG2 . 10125 1 743 . 1 1 61 61 VAL HG23 H 1 -0.011 0.030 . 1 . . . . 61 VAL HG2 . 10125 1 744 . 1 1 61 61 VAL C C 13 173.189 0.300 . 1 . . . . 61 VAL C . 10125 1 745 . 1 1 61 61 VAL CA C 13 57.058 0.300 . 1 . . . . 61 VAL CA . 10125 1 746 . 1 1 61 61 VAL CB C 13 35.003 0.300 . 1 . . . . 61 VAL CB . 10125 1 747 . 1 1 61 61 VAL CG1 C 13 20.962 0.300 . 2 . . . . 61 VAL CG1 . 10125 1 748 . 1 1 61 61 VAL CG2 C 13 22.552 0.300 . 2 . . . . 61 VAL CG2 . 10125 1 749 . 1 1 61 61 VAL N N 15 127.712 0.300 . 1 . . . . 61 VAL N . 10125 1 750 . 1 1 62 62 THR H H 1 8.768 0.030 . 1 . . . . 62 THR H . 10125 1 751 . 1 1 62 62 THR HA H 1 5.226 0.030 . 1 . . . . 62 THR HA . 10125 1 752 . 1 1 62 62 THR HB H 1 3.804 0.030 . 1 . . . . 62 THR HB . 10125 1 753 . 1 1 62 62 THR HG21 H 1 0.903 0.030 . 1 . . . . 62 THR HG2 . 10125 1 754 . 1 1 62 62 THR HG22 H 1 0.903 0.030 . 1 . . . . 62 THR HG2 . 10125 1 755 . 1 1 62 62 THR HG23 H 1 0.903 0.030 . 1 . . . . 62 THR HG2 . 10125 1 756 . 1 1 62 62 THR C C 13 175.740 0.300 . 1 . . . . 62 THR C . 10125 1 757 . 1 1 62 62 THR CA C 13 61.689 0.300 . 1 . . . . 62 THR CA . 10125 1 758 . 1 1 62 62 THR CB C 13 69.507 0.300 . 1 . . . . 62 THR CB . 10125 1 759 . 1 1 62 62 THR CG2 C 13 20.665 0.300 . 1 . . . . 62 THR CG2 . 10125 1 760 . 1 1 62 62 THR N N 15 124.426 0.300 . 1 . . . . 62 THR N . 10125 1 761 . 1 1 63 63 VAL H H 1 9.070 0.030 . 1 . . . . 63 VAL H . 10125 1 762 . 1 1 63 63 VAL HA H 1 4.369 0.030 . 1 . . . . 63 VAL HA . 10125 1 763 . 1 1 63 63 VAL HB H 1 1.987 0.030 . 1 . . . . 63 VAL HB . 10125 1 764 . 1 1 63 63 VAL HG11 H 1 1.030 0.030 . 1 . . . . 63 VAL HG1 . 10125 1 765 . 1 1 63 63 VAL HG12 H 1 1.030 0.030 . 1 . . . . 63 VAL HG1 . 10125 1 766 . 1 1 63 63 VAL HG13 H 1 1.030 0.030 . 1 . . . . 63 VAL HG1 . 10125 1 767 . 1 1 63 63 VAL HG21 H 1 0.963 0.030 . 1 . . . . 63 VAL HG2 . 10125 1 768 . 1 1 63 63 VAL HG22 H 1 0.963 0.030 . 1 . . . . 63 VAL HG2 . 10125 1 769 . 1 1 63 63 VAL HG23 H 1 0.963 0.030 . 1 . . . . 63 VAL HG2 . 10125 1 770 . 1 1 63 63 VAL C C 13 175.993 0.300 . 1 . . . . 63 VAL C . 10125 1 771 . 1 1 63 63 VAL CA C 13 61.478 0.300 . 1 . . . . 63 VAL CA . 10125 1 772 . 1 1 63 63 VAL CB C 13 35.864 0.300 . 1 . . . . 63 VAL CB . 10125 1 773 . 1 1 63 63 VAL CG1 C 13 22.040 0.300 . 2 . . . . 63 VAL CG1 . 10125 1 774 . 1 1 63 63 VAL CG2 C 13 23.657 0.300 . 2 . . . . 63 VAL CG2 . 10125 1 775 . 1 1 63 63 VAL N N 15 128.505 0.300 . 1 . . . . 63 VAL N . 10125 1 776 . 1 1 64 64 ALA H H 1 9.665 0.030 . 1 . . . . 64 ALA H . 10125 1 777 . 1 1 64 64 ALA HA H 1 4.038 0.030 . 1 . . . . 64 ALA HA . 10125 1 778 . 1 1 64 64 ALA HB1 H 1 1.526 0.030 . 1 . . . . 64 ALA HB . 10125 1 779 . 1 1 64 64 ALA HB2 H 1 1.526 0.030 . 1 . . . . 64 ALA HB . 10125 1 780 . 1 1 64 64 ALA HB3 H 1 1.526 0.030 . 1 . . . . 64 ALA HB . 10125 1 781 . 1 1 64 64 ALA C C 13 175.945 0.300 . 1 . . . . 64 ALA C . 10125 1 782 . 1 1 64 64 ALA CA C 13 53.513 0.300 . 1 . . . . 64 ALA CA . 10125 1 783 . 1 1 64 64 ALA CB C 13 17.450 0.300 . 1 . . . . 64 ALA CB . 10125 1 784 . 1 1 64 64 ALA N N 15 133.715 0.300 . 1 . . . . 64 ALA N . 10125 1 785 . 1 1 65 65 GLU H H 1 8.491 0.030 . 1 . . . . 65 GLU H . 10125 1 786 . 1 1 65 65 GLU HA H 1 3.703 0.030 . 1 . . . . 65 GLU HA . 10125 1 787 . 1 1 65 65 GLU HB2 H 1 2.227 0.030 . 1 . . . . 65 GLU HB2 . 10125 1 788 . 1 1 65 65 GLU HB3 H 1 2.227 0.030 . 1 . . . . 65 GLU HB3 . 10125 1 789 . 1 1 65 65 GLU HG2 H 1 2.105 0.030 . 2 . . . . 65 GLU HG2 . 10125 1 790 . 1 1 65 65 GLU HG3 H 1 2.196 0.030 . 2 . . . . 65 GLU HG3 . 10125 1 791 . 1 1 65 65 GLU C C 13 174.625 0.300 . 1 . . . . 65 GLU C . 10125 1 792 . 1 1 65 65 GLU CA C 13 57.789 0.300 . 1 . . . . 65 GLU CA . 10125 1 793 . 1 1 65 65 GLU CB C 13 28.048 0.300 . 1 . . . . 65 GLU CB . 10125 1 794 . 1 1 65 65 GLU CG C 13 36.722 0.300 . 1 . . . . 65 GLU CG . 10125 1 795 . 1 1 65 65 GLU N N 15 110.040 0.300 . 1 . . . . 65 GLU N . 10125 1 796 . 1 1 66 66 GLN H H 1 7.950 0.030 . 1 . . . . 66 GLN H . 10125 1 797 . 1 1 66 66 GLN HA H 1 4.475 0.030 . 1 . . . . 66 GLN HA . 10125 1 798 . 1 1 66 66 GLN HB2 H 1 2.011 0.030 . 1 . . . . 66 GLN HB2 . 10125 1 799 . 1 1 66 66 GLN HB3 H 1 2.011 0.030 . 1 . . . . 66 GLN HB3 . 10125 1 800 . 1 1 66 66 GLN HG2 H 1 1.636 0.030 . 2 . . . . 66 GLN HG2 . 10125 1 801 . 1 1 66 66 GLN HG3 H 1 2.153 0.030 . 2 . . . . 66 GLN HG3 . 10125 1 802 . 1 1 66 66 GLN HE21 H 1 6.899 0.030 . 2 . . . . 66 GLN HE21 . 10125 1 803 . 1 1 66 66 GLN HE22 H 1 7.707 0.030 . 2 . . . . 66 GLN HE22 . 10125 1 804 . 1 1 66 66 GLN C C 13 173.149 0.300 . 1 . . . . 66 GLN C . 10125 1 805 . 1 1 66 66 GLN CA C 13 54.078 0.300 . 1 . . . . 66 GLN CA . 10125 1 806 . 1 1 66 66 GLN CB C 13 31.233 0.300 . 1 . . . . 66 GLN CB . 10125 1 807 . 1 1 66 66 GLN CG C 13 34.078 0.300 . 1 . . . . 66 GLN CG . 10125 1 808 . 1 1 66 66 GLN N N 15 121.368 0.300 . 1 . . . . 66 GLN N . 10125 1 809 . 1 1 66 66 GLN NE2 N 15 116.837 0.300 . 1 . . . . 66 GLN NE2 . 10125 1 810 . 1 1 67 67 LYS H H 1 7.946 0.030 . 1 . . . . 67 LYS H . 10125 1 811 . 1 1 67 67 LYS HA H 1 5.243 0.030 . 1 . . . . 67 LYS HA . 10125 1 812 . 1 1 67 67 LYS HB2 H 1 1.348 0.030 . 2 . . . . 67 LYS HB2 . 10125 1 813 . 1 1 67 67 LYS HB3 H 1 1.582 0.030 . 2 . . . . 67 LYS HB3 . 10125 1 814 . 1 1 67 67 LYS HG2 H 1 1.267 0.030 . 2 . . . . 67 LYS HG2 . 10125 1 815 . 1 1 67 67 LYS HG3 H 1 1.489 0.030 . 2 . . . . 67 LYS HG3 . 10125 1 816 . 1 1 67 67 LYS HD2 H 1 1.451 0.030 . 1 . . . . 67 LYS HD2 . 10125 1 817 . 1 1 67 67 LYS HD3 H 1 1.451 0.030 . 1 . . . . 67 LYS HD3 . 10125 1 818 . 1 1 67 67 LYS HE2 H 1 2.827 0.030 . 2 . . . . 67 LYS HE2 . 10125 1 819 . 1 1 67 67 LYS HE3 H 1 2.863 0.030 . 2 . . . . 67 LYS HE3 . 10125 1 820 . 1 1 67 67 LYS C C 13 176.337 0.300 . 1 . . . . 67 LYS C . 10125 1 821 . 1 1 67 67 LYS CA C 13 55.817 0.300 . 1 . . . . 67 LYS CA . 10125 1 822 . 1 1 67 67 LYS CB C 13 36.215 0.300 . 1 . . . . 67 LYS CB . 10125 1 823 . 1 1 67 67 LYS CG C 13 25.993 0.300 . 1 . . . . 67 LYS CG . 10125 1 824 . 1 1 67 67 LYS CD C 13 29.227 0.300 . 1 . . . . 67 LYS CD . 10125 1 825 . 1 1 67 67 LYS CE C 13 42.296 0.300 . 1 . . . . 67 LYS CE . 10125 1 826 . 1 1 67 67 LYS N N 15 123.633 0.300 . 1 . . . . 67 LYS N . 10125 1 827 . 1 1 68 68 TYR H H 1 8.848 0.030 . 1 . . . . 68 TYR H . 10125 1 828 . 1 1 68 68 TYR HA H 1 5.442 0.030 . 1 . . . . 68 TYR HA . 10125 1 829 . 1 1 68 68 TYR HB2 H 1 2.671 0.030 . 2 . . . . 68 TYR HB2 . 10125 1 830 . 1 1 68 68 TYR HB3 H 1 2.782 0.030 . 2 . . . . 68 TYR HB3 . 10125 1 831 . 1 1 68 68 TYR HD1 H 1 7.181 0.030 . 1 . . . . 68 TYR HD1 . 10125 1 832 . 1 1 68 68 TYR HD2 H 1 7.181 0.030 . 1 . . . . 68 TYR HD2 . 10125 1 833 . 1 1 68 68 TYR HE1 H 1 6.762 0.030 . 1 . . . . 68 TYR HE1 . 10125 1 834 . 1 1 68 68 TYR HE2 H 1 6.762 0.030 . 1 . . . . 68 TYR HE2 . 10125 1 835 . 1 1 68 68 TYR C C 13 174.543 0.300 . 1 . . . . 68 TYR C . 10125 1 836 . 1 1 68 68 TYR CA C 13 56.702 0.300 . 1 . . . . 68 TYR CA . 10125 1 837 . 1 1 68 68 TYR CB C 13 40.748 0.300 . 1 . . . . 68 TYR CB . 10125 1 838 . 1 1 68 68 TYR CE1 C 13 118.694 0.300 . 1 . . . . 68 TYR CE1 . 10125 1 839 . 1 1 68 68 TYR CE2 C 13 118.694 0.300 . 1 . . . . 68 TYR CE2 . 10125 1 840 . 1 1 68 68 TYR N N 15 120.462 0.300 . 1 . . . . 68 TYR N . 10125 1 841 . 1 1 69 69 GLN H H 1 8.955 0.030 . 1 . . . . 69 GLN H . 10125 1 842 . 1 1 69 69 GLN HA H 1 4.686 0.030 . 1 . . . . 69 GLN HA . 10125 1 843 . 1 1 69 69 GLN HB2 H 1 1.783 0.030 . 2 . . . . 69 GLN HB2 . 10125 1 844 . 1 1 69 69 GLN HB3 H 1 1.939 0.030 . 2 . . . . 69 GLN HB3 . 10125 1 845 . 1 1 69 69 GLN HG2 H 1 2.473 0.030 . 2 . . . . 69 GLN HG2 . 10125 1 846 . 1 1 69 69 GLN HG3 H 1 2.795 0.030 . 2 . . . . 69 GLN HG3 . 10125 1 847 . 1 1 69 69 GLN HE21 H 1 6.263 0.030 . 2 . . . . 69 GLN HE21 . 10125 1 848 . 1 1 69 69 GLN HE22 H 1 6.305 0.030 . 2 . . . . 69 GLN HE22 . 10125 1 849 . 1 1 69 69 GLN C C 13 173.050 0.300 . 1 . . . . 69 GLN C . 10125 1 850 . 1 1 69 69 GLN CA C 13 55.364 0.300 . 1 . . . . 69 GLN CA . 10125 1 851 . 1 1 69 69 GLN CB C 13 34.968 0.300 . 1 . . . . 69 GLN CB . 10125 1 852 . 1 1 69 69 GLN CG C 13 33.144 0.300 . 1 . . . . 69 GLN CG . 10125 1 853 . 1 1 69 69 GLN N N 15 120.802 0.300 . 1 . . . . 69 GLN N . 10125 1 854 . 1 1 69 69 GLN NE2 N 15 109.134 0.300 . 1 . . . . 69 GLN NE2 . 10125 1 855 . 1 1 70 70 SER H H 1 10.782 0.030 . 1 . . . . 70 SER H . 10125 1 856 . 1 1 70 70 SER HA H 1 5.640 0.030 . 1 . . . . 70 SER HA . 10125 1 857 . 1 1 70 70 SER HB2 H 1 3.794 0.030 . 2 . . . . 70 SER HB2 . 10125 1 858 . 1 1 70 70 SER HB3 H 1 3.914 0.030 . 2 . . . . 70 SER HB3 . 10125 1 859 . 1 1 70 70 SER C C 13 176.036 0.300 . 1 . . . . 70 SER C . 10125 1 860 . 1 1 70 70 SER CA C 13 55.483 0.300 . 1 . . . . 70 SER CA . 10125 1 861 . 1 1 70 70 SER CB C 13 64.119 0.300 . 1 . . . . 70 SER CB . 10125 1 862 . 1 1 70 70 SER N N 15 120.462 0.300 . 1 . . . . 70 SER N . 10125 1 863 . 1 1 71 71 THR H H 1 7.902 0.030 . 1 . . . . 71 THR H . 10125 1 864 . 1 1 71 71 THR HA H 1 4.354 0.030 . 1 . . . . 71 THR HA . 10125 1 865 . 1 1 71 71 THR HB H 1 4.481 0.030 . 1 . . . . 71 THR HB . 10125 1 866 . 1 1 71 71 THR HG21 H 1 1.115 0.030 . 1 . . . . 71 THR HG2 . 10125 1 867 . 1 1 71 71 THR HG22 H 1 1.115 0.030 . 1 . . . . 71 THR HG2 . 10125 1 868 . 1 1 71 71 THR HG23 H 1 1.115 0.030 . 1 . . . . 71 THR HG2 . 10125 1 869 . 1 1 71 71 THR C C 13 175.038 0.300 . 1 . . . . 71 THR C . 10125 1 870 . 1 1 71 71 THR CA C 13 62.466 0.300 . 1 . . . . 71 THR CA . 10125 1 871 . 1 1 71 71 THR CB C 13 67.888 0.300 . 1 . . . . 71 THR CB . 10125 1 872 . 1 1 71 71 THR CG2 C 13 23.244 0.300 . 1 . . . . 71 THR CG2 . 10125 1 873 . 1 1 71 71 THR N N 15 111.853 0.300 . 1 . . . . 71 THR N . 10125 1 874 . 1 1 72 72 LEU H H 1 9.201 0.030 . 1 . . . . 72 LEU H . 10125 1 875 . 1 1 72 72 LEU HA H 1 4.871 0.030 . 1 . . . . 72 LEU HA . 10125 1 876 . 1 1 72 72 LEU HB2 H 1 1.395 0.030 . 2 . . . . 72 LEU HB2 . 10125 1 877 . 1 1 72 72 LEU HB3 H 1 1.775 0.030 . 2 . . . . 72 LEU HB3 . 10125 1 878 . 1 1 72 72 LEU HG H 1 1.479 0.030 . 1 . . . . 72 LEU HG . 10125 1 879 . 1 1 72 72 LEU HD11 H 1 0.651 0.030 . 1 . . . . 72 LEU HD1 . 10125 1 880 . 1 1 72 72 LEU HD12 H 1 0.651 0.030 . 1 . . . . 72 LEU HD1 . 10125 1 881 . 1 1 72 72 LEU HD13 H 1 0.651 0.030 . 1 . . . . 72 LEU HD1 . 10125 1 882 . 1 1 72 72 LEU HD21 H 1 0.861 0.030 . 1 . . . . 72 LEU HD2 . 10125 1 883 . 1 1 72 72 LEU HD22 H 1 0.861 0.030 . 1 . . . . 72 LEU HD2 . 10125 1 884 . 1 1 72 72 LEU HD23 H 1 0.861 0.030 . 1 . . . . 72 LEU HD2 . 10125 1 885 . 1 1 72 72 LEU C C 13 175.835 0.300 . 1 . . . . 72 LEU C . 10125 1 886 . 1 1 72 72 LEU CA C 13 54.022 0.300 . 1 . . . . 72 LEU CA . 10125 1 887 . 1 1 72 72 LEU CB C 13 42.269 0.300 . 1 . . . . 72 LEU CB . 10125 1 888 . 1 1 72 72 LEU CG C 13 27.120 0.300 . 1 . . . . 72 LEU CG . 10125 1 889 . 1 1 72 72 LEU CD1 C 13 25.241 0.300 . 2 . . . . 72 LEU CD1 . 10125 1 890 . 1 1 72 72 LEU CD2 C 13 22.579 0.300 . 2 . . . . 72 LEU CD2 . 10125 1 891 . 1 1 72 72 LEU N N 15 124.200 0.300 . 1 . . . . 72 LEU N . 10125 1 892 . 1 1 73 73 TRP H H 1 8.712 0.030 . 1 . . . . 73 TRP H . 10125 1 893 . 1 1 73 73 TRP HA H 1 4.803 0.030 . 1 . . . . 73 TRP HA . 10125 1 894 . 1 1 73 73 TRP HB2 H 1 2.942 0.030 . 2 . . . . 73 TRP HB2 . 10125 1 895 . 1 1 73 73 TRP HB3 H 1 3.351 0.030 . 2 . . . . 73 TRP HB3 . 10125 1 896 . 1 1 73 73 TRP HD1 H 1 7.259 0.030 . 1 . . . . 73 TRP HD1 . 10125 1 897 . 1 1 73 73 TRP HE1 H 1 9.830 0.030 . 1 . . . . 73 TRP HE1 . 10125 1 898 . 1 1 73 73 TRP HE3 H 1 7.153 0.030 . 1 . . . . 73 TRP HE3 . 10125 1 899 . 1 1 73 73 TRP HZ2 H 1 7.366 0.030 . 1 . . . . 73 TRP HZ2 . 10125 1 900 . 1 1 73 73 TRP HH2 H 1 6.966 0.030 . 1 . . . . 73 TRP HH2 . 10125 1 901 . 1 1 73 73 TRP C C 13 176.273 0.300 . 1 . . . . 73 TRP C . 10125 1 902 . 1 1 73 73 TRP CA C 13 58.154 0.300 . 1 . . . . 73 TRP CA . 10125 1 903 . 1 1 73 73 TRP CB C 13 30.442 0.300 . 1 . . . . 73 TRP CB . 10125 1 904 . 1 1 73 73 TRP CD1 C 13 126.072 0.300 . 1 . . . . 73 TRP CD1 . 10125 1 905 . 1 1 73 73 TRP CE3 C 13 120.502 0.300 . 1 . . . . 73 TRP CE3 . 10125 1 906 . 1 1 73 73 TRP CZ2 C 13 114.321 0.300 . 1 . . . . 73 TRP CZ2 . 10125 1 907 . 1 1 73 73 TRP CZ3 C 13 122.658 0.300 . 1 . . . . 73 TRP CZ3 . 10125 1 908 . 1 1 73 73 TRP CH2 C 13 123.916 0.300 . 1 . . . . 73 TRP CH2 . 10125 1 909 . 1 1 73 73 TRP N N 15 121.481 0.300 . 1 . . . . 73 TRP N . 10125 1 910 . 1 1 73 73 TRP NE1 N 15 130.204 0.300 . 1 . . . . 73 TRP NE1 . 10125 1 911 . 1 1 74 74 ASP H H 1 9.989 0.030 . 1 . . . . 74 ASP H . 10125 1 912 . 1 1 74 74 ASP HA H 1 5.574 0.030 . 1 . . . . 74 ASP HA . 10125 1 913 . 1 1 74 74 ASP HB2 H 1 2.479 0.030 . 2 . . . . 74 ASP HB2 . 10125 1 914 . 1 1 74 74 ASP HB3 H 1 2.829 0.030 . 2 . . . . 74 ASP HB3 . 10125 1 915 . 1 1 74 74 ASP C C 13 177.831 0.300 . 1 . . . . 74 ASP C . 10125 1 916 . 1 1 74 74 ASP CA C 13 53.993 0.300 . 1 . . . . 74 ASP CA . 10125 1 917 . 1 1 74 74 ASP CB C 13 49.135 0.300 . 1 . . . . 74 ASP CB . 10125 1 918 . 1 1 74 74 ASP N N 15 122.388 0.300 . 1 . . . . 74 ASP N . 10125 1 919 . 1 1 75 75 LYS H H 1 9.495 0.030 . 1 . . . . 75 LYS H . 10125 1 920 . 1 1 75 75 LYS HA H 1 4.710 0.030 . 1 . . . . 75 LYS HA . 10125 1 921 . 1 1 75 75 LYS HB2 H 1 1.963 0.030 . 2 . . . . 75 LYS HB2 . 10125 1 922 . 1 1 75 75 LYS HB3 H 1 2.095 0.030 . 2 . . . . 75 LYS HB3 . 10125 1 923 . 1 1 75 75 LYS HG2 H 1 1.659 0.030 . 1 . . . . 75 LYS HG2 . 10125 1 924 . 1 1 75 75 LYS HG3 H 1 1.659 0.030 . 1 . . . . 75 LYS HG3 . 10125 1 925 . 1 1 75 75 LYS HD2 H 1 1.810 0.030 . 1 . . . . 75 LYS HD2 . 10125 1 926 . 1 1 75 75 LYS HD3 H 1 1.810 0.030 . 1 . . . . 75 LYS HD3 . 10125 1 927 . 1 1 75 75 LYS HE2 H 1 3.072 0.030 . 1 . . . . 75 LYS HE2 . 10125 1 928 . 1 1 75 75 LYS HE3 H 1 3.072 0.030 . 1 . . . . 75 LYS HE3 . 10125 1 929 . 1 1 75 75 LYS C C 13 176.092 0.300 . 1 . . . . 75 LYS C . 10125 1 930 . 1 1 75 75 LYS CA C 13 58.192 0.300 . 1 . . . . 75 LYS CA . 10125 1 931 . 1 1 75 75 LYS CB C 13 33.910 0.300 . 1 . . . . 75 LYS CB . 10125 1 932 . 1 1 75 75 LYS CG C 13 25.657 0.300 . 1 . . . . 75 LYS CG . 10125 1 933 . 1 1 75 75 LYS CD C 13 29.484 0.300 . 1 . . . . 75 LYS CD . 10125 1 934 . 1 1 75 75 LYS CE C 13 42.130 0.300 . 1 . . . . 75 LYS CE . 10125 1 935 . 1 1 75 75 LYS N N 15 115.930 0.300 . 1 . . . . 75 LYS N . 10125 1 936 . 1 1 76 76 SER H H 1 7.472 0.030 . 1 . . . . 76 SER H . 10125 1 937 . 1 1 76 76 SER HA H 1 4.578 0.030 . 1 . . . . 76 SER HA . 10125 1 938 . 1 1 76 76 SER HB2 H 1 3.775 0.030 . 2 . . . . 76 SER HB2 . 10125 1 939 . 1 1 76 76 SER HB3 H 1 4.027 0.030 . 2 . . . . 76 SER HB3 . 10125 1 940 . 1 1 76 76 SER C C 13 172.661 0.300 . 1 . . . . 76 SER C . 10125 1 941 . 1 1 76 76 SER CA C 13 56.005 0.300 . 1 . . . . 76 SER CA . 10125 1 942 . 1 1 76 76 SER CB C 13 67.071 0.300 . 1 . . . . 76 SER CB . 10125 1 943 . 1 1 76 76 SER N N 15 111.399 0.300 . 1 . . . . 76 SER N . 10125 1 944 . 1 1 77 77 LYS H H 1 7.836 0.030 . 1 . . . . 77 LYS H . 10125 1 945 . 1 1 77 77 LYS HA H 1 3.193 0.030 . 1 . . . . 77 LYS HA . 10125 1 946 . 1 1 77 77 LYS HB2 H 1 1.213 0.030 . 2 . . . . 77 LYS HB2 . 10125 1 947 . 1 1 77 77 LYS HB3 H 1 1.338 0.030 . 2 . . . . 77 LYS HB3 . 10125 1 948 . 1 1 77 77 LYS HG2 H 1 0.907 0.030 . 2 . . . . 77 LYS HG2 . 10125 1 949 . 1 1 77 77 LYS HG3 H 1 1.127 0.030 . 2 . . . . 77 LYS HG3 . 10125 1 950 . 1 1 77 77 LYS HD2 H 1 1.511 0.030 . 2 . . . . 77 LYS HD2 . 10125 1 951 . 1 1 77 77 LYS HD3 H 1 1.580 0.030 . 2 . . . . 77 LYS HD3 . 10125 1 952 . 1 1 77 77 LYS HE2 H 1 2.920 0.030 . 1 . . . . 77 LYS HE2 . 10125 1 953 . 1 1 77 77 LYS HE3 H 1 2.920 0.030 . 1 . . . . 77 LYS HE3 . 10125 1 954 . 1 1 77 77 LYS C C 13 176.860 0.300 . 1 . . . . 77 LYS C . 10125 1 955 . 1 1 77 77 LYS CA C 13 59.412 0.300 . 1 . . . . 77 LYS CA . 10125 1 956 . 1 1 77 77 LYS CB C 13 32.248 0.300 . 1 . . . . 77 LYS CB . 10125 1 957 . 1 1 77 77 LYS CG C 13 24.575 0.300 . 1 . . . . 77 LYS CG . 10125 1 958 . 1 1 77 77 LYS CD C 13 29.816 0.300 . 1 . . . . 77 LYS CD . 10125 1 959 . 1 1 77 77 LYS CE C 13 42.130 0.300 . 1 . . . . 77 LYS CE . 10125 1 960 . 1 1 77 77 LYS N N 15 123.180 0.300 . 1 . . . . 77 LYS N . 10125 1 961 . 1 1 78 78 LYS H H 1 7.831 0.030 . 1 . . . . 78 LYS H . 10125 1 962 . 1 1 78 78 LYS HA H 1 3.775 0.030 . 1 . . . . 78 LYS HA . 10125 1 963 . 1 1 78 78 LYS HB2 H 1 1.688 0.030 . 2 . . . . 78 LYS HB2 . 10125 1 964 . 1 1 78 78 LYS HB3 H 1 1.646 0.030 . 2 . . . . 78 LYS HB3 . 10125 1 965 . 1 1 78 78 LYS HG2 H 1 1.295 0.030 . 2 . . . . 78 LYS HG2 . 10125 1 966 . 1 1 78 78 LYS HG3 H 1 1.434 0.030 . 2 . . . . 78 LYS HG3 . 10125 1 967 . 1 1 78 78 LYS HD2 H 1 1.611 0.030 . 1 . . . . 78 LYS HD2 . 10125 1 968 . 1 1 78 78 LYS HD3 H 1 1.611 0.030 . 1 . . . . 78 LYS HD3 . 10125 1 969 . 1 1 78 78 LYS HE2 H 1 2.921 0.030 . 1 . . . . 78 LYS HE2 . 10125 1 970 . 1 1 78 78 LYS HE3 H 1 2.921 0.030 . 1 . . . . 78 LYS HE3 . 10125 1 971 . 1 1 78 78 LYS C C 13 179.774 0.300 . 1 . . . . 78 LYS C . 10125 1 972 . 1 1 78 78 LYS CA C 13 59.412 0.300 . 1 . . . . 78 LYS CA . 10125 1 973 . 1 1 78 78 LYS CB C 13 32.441 0.300 . 1 . . . . 78 LYS CB . 10125 1 974 . 1 1 78 78 LYS CG C 13 25.407 0.300 . 1 . . . . 78 LYS CG . 10125 1 975 . 1 1 78 78 LYS CD C 13 29.401 0.300 . 1 . . . . 78 LYS CD . 10125 1 976 . 1 1 78 78 LYS CE C 13 41.963 0.300 . 1 . . . . 78 LYS CE . 10125 1 977 . 1 1 78 78 LYS N N 15 116.157 0.300 . 1 . . . . 78 LYS N . 10125 1 978 . 1 1 79 79 LEU H H 1 7.402 0.030 . 1 . . . . 79 LEU H . 10125 1 979 . 1 1 79 79 LEU HA H 1 3.948 0.030 . 1 . . . . 79 LEU HA . 10125 1 980 . 1 1 79 79 LEU HB2 H 1 1.744 0.030 . 1 . . . . 79 LEU HB2 . 10125 1 981 . 1 1 79 79 LEU HB3 H 1 1.744 0.030 . 1 . . . . 79 LEU HB3 . 10125 1 982 . 1 1 79 79 LEU HG H 1 1.621 0.030 . 1 . . . . 79 LEU HG . 10125 1 983 . 1 1 79 79 LEU HD11 H 1 1.087 0.030 . 1 . . . . 79 LEU HD1 . 10125 1 984 . 1 1 79 79 LEU HD12 H 1 1.087 0.030 . 1 . . . . 79 LEU HD1 . 10125 1 985 . 1 1 79 79 LEU HD13 H 1 1.087 0.030 . 1 . . . . 79 LEU HD1 . 10125 1 986 . 1 1 79 79 LEU HD21 H 1 1.106 0.030 . 1 . . . . 79 LEU HD2 . 10125 1 987 . 1 1 79 79 LEU HD22 H 1 1.106 0.030 . 1 . . . . 79 LEU HD2 . 10125 1 988 . 1 1 79 79 LEU HD23 H 1 1.106 0.030 . 1 . . . . 79 LEU HD2 . 10125 1 989 . 1 1 79 79 LEU C C 13 177.738 0.300 . 1 . . . . 79 LEU C . 10125 1 990 . 1 1 79 79 LEU CA C 13 57.882 0.300 . 1 . . . . 79 LEU CA . 10125 1 991 . 1 1 79 79 LEU CB C 13 41.727 0.300 . 1 . . . . 79 LEU CB . 10125 1 992 . 1 1 79 79 LEU CG C 13 27.487 0.300 . 1 . . . . 79 LEU CG . 10125 1 993 . 1 1 79 79 LEU CD1 C 13 26.172 0.300 . 2 . . . . 79 LEU CD1 . 10125 1 994 . 1 1 79 79 LEU CD2 C 13 22.189 0.300 . 2 . . . . 79 LEU CD2 . 10125 1 995 . 1 1 79 79 LEU N N 15 118.360 0.300 . 1 . . . . 79 LEU N . 10125 1 996 . 1 1 80 80 ALA H H 1 7.925 0.030 . 1 . . . . 80 ALA H . 10125 1 997 . 1 1 80 80 ALA HA H 1 4.414 0.030 . 1 . . . . 80 ALA HA . 10125 1 998 . 1 1 80 80 ALA HB1 H 1 1.506 0.030 . 1 . . . . 80 ALA HB . 10125 1 999 . 1 1 80 80 ALA HB2 H 1 1.506 0.030 . 1 . . . . 80 ALA HB . 10125 1 1000 . 1 1 80 80 ALA HB3 H 1 1.506 0.030 . 1 . . . . 80 ALA HB . 10125 1 1001 . 1 1 80 80 ALA C C 13 181.821 0.300 . 1 . . . . 80 ALA C . 10125 1 1002 . 1 1 80 80 ALA CA C 13 54.760 0.300 . 1 . . . . 80 ALA CA . 10125 1 1003 . 1 1 80 80 ALA CB C 13 18.277 0.300 . 1 . . . . 80 ALA CB . 10125 1 1004 . 1 1 80 80 ALA N N 15 120.235 0.300 . 1 . . . . 80 ALA N . 10125 1 1005 . 1 1 81 81 GLU H H 1 7.959 0.030 . 1 . . . . 81 GLU H . 10125 1 1006 . 1 1 81 81 GLU HA H 1 3.832 0.030 . 1 . . . . 81 GLU HA . 10125 1 1007 . 1 1 81 81 GLU HB2 H 1 0.956 0.030 . 2 . . . . 81 GLU HB2 . 10125 1 1008 . 1 1 81 81 GLU HB3 H 1 1.663 0.030 . 2 . . . . 81 GLU HB3 . 10125 1 1009 . 1 1 81 81 GLU HG2 H 1 2.555 0.030 . 2 . . . . 81 GLU HG2 . 10125 1 1010 . 1 1 81 81 GLU HG3 H 1 1.807 0.030 . 2 . . . . 81 GLU HG3 . 10125 1 1011 . 1 1 81 81 GLU C C 13 177.546 0.300 . 1 . . . . 81 GLU C . 10125 1 1012 . 1 1 81 81 GLU CA C 13 59.929 0.300 . 1 . . . . 81 GLU CA . 10125 1 1013 . 1 1 81 81 GLU CB C 13 29.532 0.300 . 1 . . . . 81 GLU CB . 10125 1 1014 . 1 1 81 81 GLU CG C 13 36.306 0.300 . 1 . . . . 81 GLU CG . 10125 1 1015 . 1 1 81 81 GLU N N 15 118.876 0.300 . 1 . . . . 81 GLU N . 10125 1 1016 . 1 1 82 82 GLN H H 1 7.030 0.030 . 1 . . . . 82 GLN H . 10125 1 1017 . 1 1 82 82 GLN HA H 1 3.910 0.030 . 1 . . . . 82 GLN HA . 10125 1 1018 . 1 1 82 82 GLN HB2 H 1 0.788 0.030 . 2 . . . . 82 GLN HB2 . 10125 1 1019 . 1 1 82 82 GLN HB3 H 1 1.565 0.030 . 2 . . . . 82 GLN HB3 . 10125 1 1020 . 1 1 82 82 GLN HG2 H 1 2.533 0.030 . 2 . . . . 82 GLN HG2 . 10125 1 1021 . 1 1 82 82 GLN HG3 H 1 1.650 0.030 . 2 . . . . 82 GLN HG3 . 10125 1 1022 . 1 1 82 82 GLN HE21 H 1 6.166 0.030 . 2 . . . . 82 GLN HE21 . 10125 1 1023 . 1 1 82 82 GLN HE22 H 1 7.007 0.030 . 2 . . . . 82 GLN HE22 . 10125 1 1024 . 1 1 82 82 GLN C C 13 178.733 0.300 . 1 . . . . 82 GLN C . 10125 1 1025 . 1 1 82 82 GLN CA C 13 58.081 0.300 . 1 . . . . 82 GLN CA . 10125 1 1026 . 1 1 82 82 GLN CB C 13 27.250 0.300 . 1 . . . . 82 GLN CB . 10125 1 1027 . 1 1 82 82 GLN CG C 13 30.149 0.300 . 1 . . . . 82 GLN CG . 10125 1 1028 . 1 1 82 82 GLN N N 15 116.011 0.300 . 1 . . . . 82 GLN N . 10125 1 1029 . 1 1 82 82 GLN NE2 N 15 107.888 0.300 . 1 . . . . 82 GLN NE2 . 10125 1 1030 . 1 1 83 83 THR H H 1 8.482 0.030 . 1 . . . . 83 THR H . 10125 1 1031 . 1 1 83 83 THR HA H 1 3.705 0.030 . 1 . . . . 83 THR HA . 10125 1 1032 . 1 1 83 83 THR HB H 1 4.500 0.030 . 1 . . . . 83 THR HB . 10125 1 1033 . 1 1 83 83 THR HG21 H 1 1.462 0.030 . 1 . . . . 83 THR HG2 . 10125 1 1034 . 1 1 83 83 THR HG22 H 1 1.462 0.030 . 1 . . . . 83 THR HG2 . 10125 1 1035 . 1 1 83 83 THR HG23 H 1 1.462 0.030 . 1 . . . . 83 THR HG2 . 10125 1 1036 . 1 1 83 83 THR C C 13 175.188 0.300 . 1 . . . . 83 THR C . 10125 1 1037 . 1 1 83 83 THR CA C 13 67.057 0.300 . 1 . . . . 83 THR CA . 10125 1 1038 . 1 1 83 83 THR CB C 13 68.912 0.300 . 1 . . . . 83 THR CB . 10125 1 1039 . 1 1 83 83 THR CG2 C 13 25.740 0.300 . 1 . . . . 83 THR CG2 . 10125 1 1040 . 1 1 83 83 THR N N 15 117.225 0.300 . 1 . . . . 83 THR N . 10125 1 1041 . 1 1 84 84 ALA H H 1 7.749 0.030 . 1 . . . . 84 ALA H . 10125 1 1042 . 1 1 84 84 ALA HA H 1 4.092 0.030 . 1 . . . . 84 ALA HA . 10125 1 1043 . 1 1 84 84 ALA HB1 H 1 1.525 0.030 . 1 . . . . 84 ALA HB . 10125 1 1044 . 1 1 84 84 ALA HB2 H 1 1.525 0.030 . 1 . . . . 84 ALA HB . 10125 1 1045 . 1 1 84 84 ALA HB3 H 1 1.525 0.030 . 1 . . . . 84 ALA HB . 10125 1 1046 . 1 1 84 84 ALA C C 13 179.049 0.300 . 1 . . . . 84 ALA C . 10125 1 1047 . 1 1 84 84 ALA CA C 13 55.939 0.300 . 1 . . . . 84 ALA CA . 10125 1 1048 . 1 1 84 84 ALA CB C 13 18.513 0.300 . 1 . . . . 84 ALA CB . 10125 1 1049 . 1 1 84 84 ALA N N 15 122.727 0.300 . 1 . . . . 84 ALA N . 10125 1 1050 . 1 1 85 85 ALA H H 1 7.808 0.030 . 1 . . . . 85 ALA H . 10125 1 1051 . 1 1 85 85 ALA HA H 1 3.830 0.030 . 1 . . . . 85 ALA HA . 10125 1 1052 . 1 1 85 85 ALA HB1 H 1 1.459 0.030 . 1 . . . . 85 ALA HB . 10125 1 1053 . 1 1 85 85 ALA HB2 H 1 1.459 0.030 . 1 . . . . 85 ALA HB . 10125 1 1054 . 1 1 85 85 ALA HB3 H 1 1.459 0.030 . 1 . . . . 85 ALA HB . 10125 1 1055 . 1 1 85 85 ALA C C 13 179.882 0.300 . 1 . . . . 85 ALA C . 10125 1 1056 . 1 1 85 85 ALA CA C 13 55.459 0.300 . 1 . . . . 85 ALA CA . 10125 1 1057 . 1 1 85 85 ALA CB C 13 17.194 0.300 . 1 . . . . 85 ALA CB . 10125 1 1058 . 1 1 85 85 ALA N N 15 117.970 0.300 . 1 . . . . 85 ALA N . 10125 1 1059 . 1 1 86 86 ILE H H 1 7.842 0.030 . 1 . . . . 86 ILE H . 10125 1 1060 . 1 1 86 86 ILE HA H 1 3.619 0.030 . 1 . . . . 86 ILE HA . 10125 1 1061 . 1 1 86 86 ILE HB H 1 2.053 0.030 . 1 . . . . 86 ILE HB . 10125 1 1062 . 1 1 86 86 ILE HG12 H 1 1.899 0.030 . 2 . . . . 86 ILE HG12 . 10125 1 1063 . 1 1 86 86 ILE HG13 H 1 1.167 0.030 . 2 . . . . 86 ILE HG13 . 10125 1 1064 . 1 1 86 86 ILE HG21 H 1 0.984 0.030 . 1 . . . . 86 ILE HG2 . 10125 1 1065 . 1 1 86 86 ILE HG22 H 1 0.984 0.030 . 1 . . . . 86 ILE HG2 . 10125 1 1066 . 1 1 86 86 ILE HG23 H 1 0.984 0.030 . 1 . . . . 86 ILE HG2 . 10125 1 1067 . 1 1 86 86 ILE HD11 H 1 1.107 0.030 . 1 . . . . 86 ILE HD1 . 10125 1 1068 . 1 1 86 86 ILE HD12 H 1 1.107 0.030 . 1 . . . . 86 ILE HD1 . 10125 1 1069 . 1 1 86 86 ILE HD13 H 1 1.107 0.030 . 1 . . . . 86 ILE HD1 . 10125 1 1070 . 1 1 86 86 ILE C C 13 177.202 0.300 . 1 . . . . 86 ILE C . 10125 1 1071 . 1 1 86 86 ILE CA C 13 65.701 0.300 . 1 . . . . 86 ILE CA . 10125 1 1072 . 1 1 86 86 ILE CB C 13 37.303 0.300 . 1 . . . . 86 ILE CB . 10125 1 1073 . 1 1 86 86 ILE CG1 C 13 29.401 0.300 . 1 . . . . 86 ILE CG1 . 10125 1 1074 . 1 1 86 86 ILE CG2 C 13 18.806 0.300 . 1 . . . . 86 ILE CG2 . 10125 1 1075 . 1 1 86 86 ILE CD1 C 13 15.212 0.300 . 1 . . . . 86 ILE CD1 . 10125 1 1076 . 1 1 86 86 ILE N N 15 116.185 0.300 . 1 . . . . 86 ILE N . 10125 1 1077 . 1 1 87 87 VAL H H 1 7.828 0.030 . 1 . . . . 87 VAL H . 10125 1 1078 . 1 1 87 87 VAL HA H 1 3.475 0.030 . 1 . . . . 87 VAL HA . 10125 1 1079 . 1 1 87 87 VAL HB H 1 2.250 0.030 . 1 . . . . 87 VAL HB . 10125 1 1080 . 1 1 87 87 VAL HG11 H 1 1.016 0.030 . 1 . . . . 87 VAL HG1 . 10125 1 1081 . 1 1 87 87 VAL HG12 H 1 1.016 0.030 . 1 . . . . 87 VAL HG1 . 10125 1 1082 . 1 1 87 87 VAL HG13 H 1 1.016 0.030 . 1 . . . . 87 VAL HG1 . 10125 1 1083 . 1 1 87 87 VAL HG21 H 1 1.053 0.030 . 1 . . . . 87 VAL HG2 . 10125 1 1084 . 1 1 87 87 VAL HG22 H 1 1.053 0.030 . 1 . . . . 87 VAL HG2 . 10125 1 1085 . 1 1 87 87 VAL HG23 H 1 1.053 0.030 . 1 . . . . 87 VAL HG2 . 10125 1 1086 . 1 1 87 87 VAL C C 13 178.257 0.300 . 1 . . . . 87 VAL C . 10125 1 1087 . 1 1 87 87 VAL CA C 13 67.219 0.300 . 1 . . . . 87 VAL CA . 10125 1 1088 . 1 1 87 87 VAL CB C 13 30.781 0.300 . 1 . . . . 87 VAL CB . 10125 1 1089 . 1 1 87 87 VAL CG1 C 13 22.189 0.300 . 1 . . . . 87 VAL CG1 . 10125 1 1090 . 1 1 87 87 VAL CG2 C 13 22.189 0.300 . 1 . . . . 87 VAL CG2 . 10125 1 1091 . 1 1 87 87 VAL N N 15 120.235 0.300 . 1 . . . . 87 VAL N . 10125 1 1092 . 1 1 88 88 CYS H H 1 7.404 0.030 . 1 . . . . 88 CYS H . 10125 1 1093 . 1 1 88 88 CYS HA H 1 2.783 0.030 . 1 . . . . 88 CYS HA . 10125 1 1094 . 1 1 88 88 CYS HB2 H 1 2.005 0.030 . 2 . . . . 88 CYS HB2 . 10125 1 1095 . 1 1 88 88 CYS HB3 H 1 2.487 0.030 . 2 . . . . 88 CYS HB3 . 10125 1 1096 . 1 1 88 88 CYS C C 13 175.864 0.300 . 1 . . . . 88 CYS C . 10125 1 1097 . 1 1 88 88 CYS CA C 13 62.505 0.300 . 1 . . . . 88 CYS CA . 10125 1 1098 . 1 1 88 88 CYS CB C 13 25.986 0.300 . 1 . . . . 88 CYS CB . 10125 1 1099 . 1 1 88 88 CYS N N 15 118.781 0.300 . 1 . . . . 88 CYS N . 10125 1 1100 . 1 1 89 89 LEU H H 1 8.190 0.030 . 1 . . . . 89 LEU H . 10125 1 1101 . 1 1 89 89 LEU HA H 1 3.468 0.030 . 1 . . . . 89 LEU HA . 10125 1 1102 . 1 1 89 89 LEU HB2 H 1 1.183 0.030 . 2 . . . . 89 LEU HB2 . 10125 1 1103 . 1 1 89 89 LEU HB3 H 1 1.728 0.030 . 2 . . . . 89 LEU HB3 . 10125 1 1104 . 1 1 89 89 LEU HG H 1 1.661 0.030 . 1 . . . . 89 LEU HG . 10125 1 1105 . 1 1 89 89 LEU HD11 H 1 0.839 0.030 . 1 . . . . 89 LEU HD1 . 10125 1 1106 . 1 1 89 89 LEU HD12 H 1 0.839 0.030 . 1 . . . . 89 LEU HD1 . 10125 1 1107 . 1 1 89 89 LEU HD13 H 1 0.839 0.030 . 1 . . . . 89 LEU HD1 . 10125 1 1108 . 1 1 89 89 LEU HD21 H 1 0.460 0.030 . 1 . . . . 89 LEU HD2 . 10125 1 1109 . 1 1 89 89 LEU HD22 H 1 0.460 0.030 . 1 . . . . 89 LEU HD2 . 10125 1 1110 . 1 1 89 89 LEU HD23 H 1 0.460 0.030 . 1 . . . . 89 LEU HD2 . 10125 1 1111 . 1 1 89 89 LEU C C 13 178.784 0.300 . 1 . . . . 89 LEU C . 10125 1 1112 . 1 1 89 89 LEU CA C 13 58.492 0.300 . 1 . . . . 89 LEU CA . 10125 1 1113 . 1 1 89 89 LEU CB C 13 42.564 0.300 . 1 . . . . 89 LEU CB . 10125 1 1114 . 1 1 89 89 LEU CG C 13 26.711 0.300 . 1 . . . . 89 LEU CG . 10125 1 1115 . 1 1 89 89 LEU CD1 C 13 26.239 0.300 . 2 . . . . 89 LEU CD1 . 10125 1 1116 . 1 1 89 89 LEU CD2 C 13 23.244 0.300 . 2 . . . . 89 LEU CD2 . 10125 1 1117 . 1 1 89 89 LEU N N 15 117.743 0.300 . 1 . . . . 89 LEU N . 10125 1 1118 . 1 1 90 90 ARG H H 1 9.259 0.030 . 1 . . . . 90 ARG H . 10125 1 1119 . 1 1 90 90 ARG HA H 1 4.206 0.030 . 1 . . . . 90 ARG HA . 10125 1 1120 . 1 1 90 90 ARG HB2 H 1 1.664 0.030 . 2 . . . . 90 ARG HB2 . 10125 1 1121 . 1 1 90 90 ARG HB3 H 1 1.911 0.030 . 2 . . . . 90 ARG HB3 . 10125 1 1122 . 1 1 90 90 ARG HG2 H 1 1.618 0.030 . 1 . . . . 90 ARG HG2 . 10125 1 1123 . 1 1 90 90 ARG HG3 H 1 1.618 0.030 . 1 . . . . 90 ARG HG3 . 10125 1 1124 . 1 1 90 90 ARG HD2 H 1 2.985 0.030 . 2 . . . . 90 ARG HD2 . 10125 1 1125 . 1 1 90 90 ARG HD3 H 1 3.199 0.030 . 2 . . . . 90 ARG HD3 . 10125 1 1126 . 1 1 90 90 ARG C C 13 181.279 0.300 . 1 . . . . 90 ARG C . 10125 1 1127 . 1 1 90 90 ARG CA C 13 58.768 0.300 . 1 . . . . 90 ARG CA . 10125 1 1128 . 1 1 90 90 ARG CB C 13 29.842 0.300 . 1 . . . . 90 ARG CB . 10125 1 1129 . 1 1 90 90 ARG CG C 13 27.250 0.300 . 1 . . . . 90 ARG CG . 10125 1 1130 . 1 1 90 90 ARG CD C 13 42.882 0.300 . 1 . . . . 90 ARG CD . 10125 1 1131 . 1 1 90 90 ARG N N 15 118.196 0.300 . 1 . . . . 90 ARG N . 10125 1 1132 . 1 1 91 91 SER H H 1 8.323 0.030 . 1 . . . . 91 SER H . 10125 1 1133 . 1 1 91 91 SER HA H 1 4.139 0.030 . 1 . . . . 91 SER HA . 10125 1 1134 . 1 1 91 91 SER HB2 H 1 4.068 0.030 . 1 . . . . 91 SER HB2 . 10125 1 1135 . 1 1 91 91 SER HB3 H 1 4.068 0.030 . 1 . . . . 91 SER HB3 . 10125 1 1136 . 1 1 91 91 SER C C 13 175.815 0.300 . 1 . . . . 91 SER C . 10125 1 1137 . 1 1 91 91 SER CA C 13 62.088 0.300 . 1 . . . . 91 SER CA . 10125 1 1138 . 1 1 91 91 SER CB C 13 63.384 0.300 . 1 . . . . 91 SER CB . 10125 1 1139 . 1 1 91 91 SER N N 15 115.986 0.300 . 1 . . . . 91 SER N . 10125 1 1140 . 1 1 92 92 GLN H H 1 7.227 0.030 . 1 . . . . 92 GLN H . 10125 1 1141 . 1 1 92 92 GLN HA H 1 4.308 0.030 . 1 . . . . 92 GLN HA . 10125 1 1142 . 1 1 92 92 GLN HB2 H 1 1.507 0.030 . 2 . . . . 92 GLN HB2 . 10125 1 1143 . 1 1 92 92 GLN HB3 H 1 2.014 0.030 . 2 . . . . 92 GLN HB3 . 10125 1 1144 . 1 1 92 92 GLN HG2 H 1 2.093 0.030 . 2 . . . . 92 GLN HG2 . 10125 1 1145 . 1 1 92 92 GLN HG3 H 1 2.136 0.030 . 2 . . . . 92 GLN HG3 . 10125 1 1146 . 1 1 92 92 GLN HE21 H 1 5.615 0.030 . 2 . . . . 92 GLN HE21 . 10125 1 1147 . 1 1 92 92 GLN HE22 H 1 6.406 0.030 . 2 . . . . 92 GLN HE22 . 10125 1 1148 . 1 1 92 92 GLN C C 13 175.709 0.300 . 1 . . . . 92 GLN C . 10125 1 1149 . 1 1 92 92 GLN CA C 13 55.639 0.300 . 1 . . . . 92 GLN CA . 10125 1 1150 . 1 1 92 92 GLN CB C 13 30.694 0.300 . 1 . . . . 92 GLN CB . 10125 1 1151 . 1 1 92 92 GLN CG C 13 34.617 0.300 . 1 . . . . 92 GLN CG . 10125 1 1152 . 1 1 92 92 GLN N N 15 115.704 0.300 . 1 . . . . 92 GLN N . 10125 1 1153 . 1 1 92 92 GLN NE2 N 15 109.587 0.300 . 1 . . . . 92 GLN NE2 . 10125 1 1154 . 1 1 93 93 GLY H H 1 7.737 0.030 . 1 . . . . 93 GLY H . 10125 1 1155 . 1 1 93 93 GLY HA2 H 1 3.859 0.030 . 1 . . . . 93 GLY HA2 . 10125 1 1156 . 1 1 93 93 GLY HA3 H 1 3.859 0.030 . 1 . . . . 93 GLY HA3 . 10125 1 1157 . 1 1 93 93 GLY C C 13 174.649 0.300 . 1 . . . . 93 GLY C . 10125 1 1158 . 1 1 93 93 GLY CA C 13 46.231 0.300 . 1 . . . . 93 GLY CA . 10125 1 1159 . 1 1 93 93 GLY N N 15 108.907 0.300 . 1 . . . . 93 GLY N . 10125 1 1160 . 1 1 94 94 LEU H H 1 7.851 0.030 . 1 . . . . 94 LEU H . 10125 1 1161 . 1 1 94 94 LEU HA H 1 4.387 0.030 . 1 . . . . 94 LEU HA . 10125 1 1162 . 1 1 94 94 LEU HB2 H 1 1.246 0.030 . 2 . . . . 94 LEU HB2 . 10125 1 1163 . 1 1 94 94 LEU HB3 H 1 1.008 0.030 . 2 . . . . 94 LEU HB3 . 10125 1 1164 . 1 1 94 94 LEU HG H 1 1.052 0.030 . 1 . . . . 94 LEU HG . 10125 1 1165 . 1 1 94 94 LEU HD11 H 1 -0.476 0.030 . 1 . . . . 94 LEU HD1 . 10125 1 1166 . 1 1 94 94 LEU HD12 H 1 -0.476 0.030 . 1 . . . . 94 LEU HD1 . 10125 1 1167 . 1 1 94 94 LEU HD13 H 1 -0.476 0.030 . 1 . . . . 94 LEU HD1 . 10125 1 1168 . 1 1 94 94 LEU HD21 H 1 0.418 0.030 . 1 . . . . 94 LEU HD2 . 10125 1 1169 . 1 1 94 94 LEU HD22 H 1 0.418 0.030 . 1 . . . . 94 LEU HD2 . 10125 1 1170 . 1 1 94 94 LEU HD23 H 1 0.418 0.030 . 1 . . . . 94 LEU HD2 . 10125 1 1171 . 1 1 94 94 LEU C C 13 174.491 0.300 . 1 . . . . 94 LEU C . 10125 1 1172 . 1 1 94 94 LEU CA C 13 52.585 0.300 . 1 . . . . 94 LEU CA . 10125 1 1173 . 1 1 94 94 LEU CB C 13 41.445 0.300 . 1 . . . . 94 LEU CB . 10125 1 1174 . 1 1 94 94 LEU CG C 13 26.352 0.300 . 1 . . . . 94 LEU CG . 10125 1 1175 . 1 1 94 94 LEU CD1 C 13 23.534 0.300 . 2 . . . . 94 LEU CD1 . 10125 1 1176 . 1 1 94 94 LEU CD2 C 13 21.642 0.300 . 2 . . . . 94 LEU CD2 . 10125 1 1177 . 1 1 94 94 LEU N N 15 121.141 0.300 . 1 . . . . 94 LEU N . 10125 1 1178 . 1 1 95 95 PRO HA H 1 4.283 0.030 . 1 . . . . 95 PRO HA . 10125 1 1179 . 1 1 95 95 PRO HB2 H 1 1.857 0.030 . 2 . . . . 95 PRO HB2 . 10125 1 1180 . 1 1 95 95 PRO HB3 H 1 2.291 0.030 . 2 . . . . 95 PRO HB3 . 10125 1 1181 . 1 1 95 95 PRO HG2 H 1 1.976 0.030 . 2 . . . . 95 PRO HG2 . 10125 1 1182 . 1 1 95 95 PRO HG3 H 1 2.099 0.030 . 2 . . . . 95 PRO HG3 . 10125 1 1183 . 1 1 95 95 PRO HD2 H 1 3.789 0.030 . 2 . . . . 95 PRO HD2 . 10125 1 1184 . 1 1 95 95 PRO HD3 H 1 3.454 0.030 . 2 . . . . 95 PRO HD3 . 10125 1 1185 . 1 1 95 95 PRO C C 13 177.172 0.300 . 1 . . . . 95 PRO C . 10125 1 1186 . 1 1 95 95 PRO CA C 13 63.580 0.300 . 1 . . . . 95 PRO CA . 10125 1 1187 . 1 1 95 95 PRO CB C 13 31.685 0.300 . 1 . . . . 95 PRO CB . 10125 1 1188 . 1 1 95 95 PRO CG C 13 27.820 0.300 . 1 . . . . 95 PRO CG . 10125 1 1189 . 1 1 95 95 PRO CD C 13 50.283 0.300 . 1 . . . . 95 PRO CD . 10125 1 1190 . 1 1 96 96 GLU H H 1 8.991 0.030 . 1 . . . . 96 GLU H . 10125 1 1191 . 1 1 96 96 GLU HA H 1 4.374 0.030 . 1 . . . . 96 GLU HA . 10125 1 1192 . 1 1 96 96 GLU HB2 H 1 1.961 0.030 . 2 . . . . 96 GLU HB2 . 10125 1 1193 . 1 1 96 96 GLU HB3 H 1 2.066 0.030 . 2 . . . . 96 GLU HB3 . 10125 1 1194 . 1 1 96 96 GLU HG2 H 1 2.320 0.030 . 2 . . . . 96 GLU HG2 . 10125 1 1195 . 1 1 96 96 GLU HG3 H 1 2.272 0.030 . 2 . . . . 96 GLU HG3 . 10125 1 1196 . 1 1 96 96 GLU C C 13 176.472 0.300 . 1 . . . . 96 GLU C . 10125 1 1197 . 1 1 96 96 GLU CA C 13 56.358 0.300 . 1 . . . . 96 GLU CA . 10125 1 1198 . 1 1 96 96 GLU CB C 13 31.447 0.300 . 1 . . . . 96 GLU CB . 10125 1 1199 . 1 1 96 96 GLU CG C 13 37.055 0.300 . 1 . . . . 96 GLU CG . 10125 1 1200 . 1 1 96 96 GLU N N 15 120.329 0.300 . 1 . . . . 96 GLU N . 10125 1 1201 . 1 1 97 97 GLY H H 1 8.263 0.030 . 1 . . . . 97 GLY H . 10125 1 1202 . 1 1 97 97 GLY HA2 H 1 3.631 0.030 . 2 . . . . 97 GLY HA2 . 10125 1 1203 . 1 1 97 97 GLY HA3 H 1 3.971 0.030 . 2 . . . . 97 GLY HA3 . 10125 1 1204 . 1 1 97 97 GLY C C 13 173.594 0.300 . 1 . . . . 97 GLY C . 10125 1 1205 . 1 1 97 97 GLY CA C 13 45.979 0.300 . 1 . . . . 97 GLY CA . 10125 1 1206 . 1 1 97 97 GLY N N 15 108.228 0.300 . 1 . . . . 97 GLY N . 10125 1 1207 . 1 1 98 98 ARG H H 1 7.404 0.030 . 1 . . . . 98 ARG H . 10125 1 1208 . 1 1 98 98 ARG HA H 1 3.846 0.030 . 1 . . . . 98 ARG HA . 10125 1 1209 . 1 1 98 98 ARG HB2 H 1 1.623 0.030 . 2 . . . . 98 ARG HB2 . 10125 1 1210 . 1 1 98 98 ARG HB3 H 1 1.703 0.030 . 2 . . . . 98 ARG HB3 . 10125 1 1211 . 1 1 98 98 ARG HG2 H 1 1.303 0.030 . 2 . . . . 98 ARG HG2 . 10125 1 1212 . 1 1 98 98 ARG HG3 H 1 1.402 0.030 . 2 . . . . 98 ARG HG3 . 10125 1 1213 . 1 1 98 98 ARG HD2 H 1 3.121 0.030 . 1 . . . . 98 ARG HD2 . 10125 1 1214 . 1 1 98 98 ARG HD3 H 1 3.121 0.030 . 1 . . . . 98 ARG HD3 . 10125 1 1215 . 1 1 98 98 ARG HE H 1 7.304 0.030 . 1 . . . . 98 ARG HE . 10125 1 1216 . 1 1 98 98 ARG C C 13 176.491 0.300 . 1 . . . . 98 ARG C . 10125 1 1217 . 1 1 98 98 ARG CA C 13 55.865 0.300 . 1 . . . . 98 ARG CA . 10125 1 1218 . 1 1 98 98 ARG CB C 13 31.383 0.300 . 1 . . . . 98 ARG CB . 10125 1 1219 . 1 1 98 98 ARG CG C 13 27.457 0.300 . 1 . . . . 98 ARG CG . 10125 1 1220 . 1 1 98 98 ARG CD C 13 43.305 0.300 . 1 . . . . 98 ARG CD . 10125 1 1221 . 1 1 98 98 ARG N N 15 117.177 0.300 . 1 . . . . 98 ARG N . 10125 1 1222 . 1 1 98 98 ARG NE N 15 113.665 0.300 . 1 . . . . 98 ARG NE . 10125 1 1223 . 1 1 99 99 LEU H H 1 8.231 0.030 . 1 . . . . 99 LEU H . 10125 1 1224 . 1 1 99 99 LEU HA H 1 4.198 0.030 . 1 . . . . 99 LEU HA . 10125 1 1225 . 1 1 99 99 LEU HB2 H 1 1.459 0.030 . 1 . . . . 99 LEU HB2 . 10125 1 1226 . 1 1 99 99 LEU HB3 H 1 1.459 0.030 . 1 . . . . 99 LEU HB3 . 10125 1 1227 . 1 1 99 99 LEU HG H 1 1.420 0.030 . 1 . . . . 99 LEU HG . 10125 1 1228 . 1 1 99 99 LEU HD11 H 1 0.815 0.030 . 1 . . . . 99 LEU HD1 . 10125 1 1229 . 1 1 99 99 LEU HD12 H 1 0.815 0.030 . 1 . . . . 99 LEU HD1 . 10125 1 1230 . 1 1 99 99 LEU HD13 H 1 0.815 0.030 . 1 . . . . 99 LEU HD1 . 10125 1 1231 . 1 1 99 99 LEU HD21 H 1 0.844 0.030 . 1 . . . . 99 LEU HD2 . 10125 1 1232 . 1 1 99 99 LEU HD22 H 1 0.844 0.030 . 1 . . . . 99 LEU HD2 . 10125 1 1233 . 1 1 99 99 LEU HD23 H 1 0.844 0.030 . 1 . . . . 99 LEU HD2 . 10125 1 1234 . 1 1 99 99 LEU C C 13 178.004 0.300 . 1 . . . . 99 LEU C . 10125 1 1235 . 1 1 99 99 LEU CA C 13 55.768 0.300 . 1 . . . . 99 LEU CA . 10125 1 1236 . 1 1 99 99 LEU CB C 13 42.267 0.300 . 1 . . . . 99 LEU CB . 10125 1 1237 . 1 1 99 99 LEU CG C 13 27.237 0.300 . 1 . . . . 99 LEU CG . 10125 1 1238 . 1 1 99 99 LEU CD1 C 13 25.274 0.300 . 2 . . . . 99 LEU CD1 . 10125 1 1239 . 1 1 99 99 LEU CD2 C 13 23.660 0.300 . 2 . . . . 99 LEU CD2 . 10125 1 1240 . 1 1 99 99 LEU N N 15 122.048 0.300 . 1 . . . . 99 LEU N . 10125 1 1241 . 1 1 100 100 GLY H H 1 8.690 0.030 . 1 . . . . 100 GLY H . 10125 1 1242 . 1 1 100 100 GLY HA2 H 1 3.819 0.030 . 2 . . . . 100 GLY HA2 . 10125 1 1243 . 1 1 100 100 GLY HA3 H 1 3.993 0.030 . 2 . . . . 100 GLY HA3 . 10125 1 1244 . 1 1 100 100 GLY C C 13 174.167 0.300 . 1 . . . . 100 GLY C . 10125 1 1245 . 1 1 100 100 GLY CA C 13 45.337 0.300 . 1 . . . . 100 GLY CA . 10125 1 1246 . 1 1 100 100 GLY N N 15 110.720 0.300 . 1 . . . . 100 GLY N . 10125 1 1247 . 1 1 101 101 GLU H H 1 7.922 0.030 . 1 . . . . 101 GLU H . 10125 1 1248 . 1 1 101 101 GLU HA H 1 4.234 0.030 . 1 . . . . 101 GLU HA . 10125 1 1249 . 1 1 101 101 GLU HB2 H 1 1.909 0.030 . 2 . . . . 101 GLU HB2 . 10125 1 1250 . 1 1 101 101 GLU HB3 H 1 2.019 0.030 . 2 . . . . 101 GLU HB3 . 10125 1 1251 . 1 1 101 101 GLU HG2 H 1 2.218 0.030 . 1 . . . . 101 GLU HG2 . 10125 1 1252 . 1 1 101 101 GLU HG3 H 1 2.218 0.030 . 1 . . . . 101 GLU HG3 . 10125 1 1253 . 1 1 101 101 GLU C C 13 176.421 0.300 . 1 . . . . 101 GLU C . 10125 1 1254 . 1 1 101 101 GLU CA C 13 56.486 0.300 . 1 . . . . 101 GLU CA . 10125 1 1255 . 1 1 101 101 GLU CB C 13 30.632 0.300 . 1 . . . . 101 GLU CB . 10125 1 1256 . 1 1 101 101 GLU CG C 13 36.223 0.300 . 1 . . . . 101 GLU CG . 10125 1 1257 . 1 1 101 101 GLU N N 15 120.348 0.300 . 1 . . . . 101 GLU N . 10125 1 1258 . 1 1 102 102 GLU H H 1 8.594 0.030 . 1 . . . . 102 GLU H . 10125 1 1259 . 1 1 102 102 GLU HA H 1 4.290 0.030 . 1 . . . . 102 GLU HA . 10125 1 1260 . 1 1 102 102 GLU HB2 H 1 1.913 0.030 . 2 . . . . 102 GLU HB2 . 10125 1 1261 . 1 1 102 102 GLU HB3 H 1 2.019 0.030 . 2 . . . . 102 GLU HB3 . 10125 1 1262 . 1 1 102 102 GLU HG2 H 1 2.254 0.030 . 1 . . . . 102 GLU HG2 . 10125 1 1263 . 1 1 102 102 GLU HG3 H 1 2.254 0.030 . 1 . . . . 102 GLU HG3 . 10125 1 1264 . 1 1 102 102 GLU C C 13 176.213 0.300 . 1 . . . . 102 GLU C . 10125 1 1265 . 1 1 102 102 GLU CA C 13 56.471 0.300 . 1 . . . . 102 GLU CA . 10125 1 1266 . 1 1 102 102 GLU CB C 13 30.378 0.300 . 1 . . . . 102 GLU CB . 10125 1 1267 . 1 1 102 102 GLU CG C 13 36.223 0.300 . 1 . . . . 102 GLU CG . 10125 1 1268 . 1 1 102 102 GLU N N 15 122.387 0.300 . 1 . . . . 102 GLU N . 10125 1 1269 . 1 1 103 103 SER H H 1 8.398 0.030 . 1 . . . . 103 SER H . 10125 1 1270 . 1 1 103 103 SER HA H 1 4.723 0.030 . 1 . . . . 103 SER HA . 10125 1 1271 . 1 1 103 103 SER HB2 H 1 3.853 0.030 . 1 . . . . 103 SER HB2 . 10125 1 1272 . 1 1 103 103 SER HB3 H 1 3.853 0.030 . 1 . . . . 103 SER HB3 . 10125 1 1273 . 1 1 103 103 SER C C 13 173.176 0.300 . 1 . . . . 103 SER C . 10125 1 1274 . 1 1 103 103 SER CA C 13 56.441 0.300 . 1 . . . . 103 SER CA . 10125 1 1275 . 1 1 103 103 SER CB C 13 63.478 0.300 . 1 . . . . 103 SER CB . 10125 1 1276 . 1 1 103 103 SER N N 15 118.309 0.300 . 1 . . . . 103 SER N . 10125 1 1277 . 1 1 104 104 PRO HA H 1 4.449 0.030 . 1 . . . . 104 PRO HA . 10125 1 1278 . 1 1 104 104 PRO HB2 H 1 1.927 0.030 . 2 . . . . 104 PRO HB2 . 10125 1 1279 . 1 1 104 104 PRO HB3 H 1 2.311 0.030 . 2 . . . . 104 PRO HB3 . 10125 1 1280 . 1 1 104 104 PRO HG2 H 1 2.020 0.030 . 2 . . . . 104 PRO HG2 . 10125 1 1281 . 1 1 104 104 PRO HD2 H 1 3.808 0.030 . 1 . . . . 104 PRO HD2 . 10125 1 1282 . 1 1 104 104 PRO HD3 H 1 3.808 0.030 . 1 . . . . 104 PRO HD3 . 10125 1 1283 . 1 1 104 104 PRO C C 13 177.177 0.300 . 1 . . . . 104 PRO C . 10125 1 1284 . 1 1 104 104 PRO CA C 13 63.726 0.300 . 1 . . . . 104 PRO CA . 10125 1 1285 . 1 1 104 104 PRO CB C 13 32.013 0.300 . 1 . . . . 104 PRO CB . 10125 1 1286 . 1 1 104 104 PRO CG C 13 27.404 0.300 . 1 . . . . 104 PRO CG . 10125 1 1287 . 1 1 104 104 PRO CD C 13 50.865 0.300 . 1 . . . . 104 PRO CD . 10125 1 1288 . 1 1 105 105 SER H H 1 8.295 0.030 . 1 . . . . 105 SER H . 10125 1 1289 . 1 1 105 105 SER HA H 1 4.374 0.030 . 1 . . . . 105 SER HA . 10125 1 1290 . 1 1 105 105 SER HB2 H 1 3.859 0.030 . 1 . . . . 105 SER HB2 . 10125 1 1291 . 1 1 105 105 SER HB3 H 1 3.859 0.030 . 1 . . . . 105 SER HB3 . 10125 1 1292 . 1 1 105 105 SER C C 13 174.931 0.300 . 1 . . . . 105 SER C . 10125 1 1293 . 1 1 105 105 SER CA C 13 58.612 0.300 . 1 . . . . 105 SER CA . 10125 1 1294 . 1 1 105 105 SER CB C 13 63.549 0.300 . 1 . . . . 105 SER CB . 10125 1 1295 . 1 1 105 105 SER N N 15 115.170 0.300 . 1 . . . . 105 SER N . 10125 1 1296 . 1 1 106 106 LEU H H 1 8.133 0.030 . 1 . . . . 106 LEU H . 10125 1 1297 . 1 1 106 106 LEU HA H 1 4.293 0.030 . 1 . . . . 106 LEU HA . 10125 1 1298 . 1 1 106 106 LEU HB2 H 1 1.599 0.030 . 2 . . . . 106 LEU HB2 . 10125 1 1299 . 1 1 106 106 LEU HB3 H 1 1.652 0.030 . 2 . . . . 106 LEU HB3 . 10125 1 1300 . 1 1 106 106 LEU HG H 1 1.607 0.030 . 1 . . . . 106 LEU HG . 10125 1 1301 . 1 1 106 106 LEU HD11 H 1 0.914 0.030 . 1 . . . . 106 LEU HD1 . 10125 1 1302 . 1 1 106 106 LEU HD12 H 1 0.914 0.030 . 1 . . . . 106 LEU HD1 . 10125 1 1303 . 1 1 106 106 LEU HD13 H 1 0.914 0.030 . 1 . . . . 106 LEU HD1 . 10125 1 1304 . 1 1 106 106 LEU HD21 H 1 0.853 0.030 . 1 . . . . 106 LEU HD2 . 10125 1 1305 . 1 1 106 106 LEU HD22 H 1 0.853 0.030 . 1 . . . . 106 LEU HD2 . 10125 1 1306 . 1 1 106 106 LEU HD23 H 1 0.853 0.030 . 1 . . . . 106 LEU HD2 . 10125 1 1307 . 1 1 106 106 LEU C C 13 177.255 0.300 . 1 . . . . 106 LEU C . 10125 1 1308 . 1 1 106 106 LEU CA C 13 55.701 0.300 . 1 . . . . 106 LEU CA . 10125 1 1309 . 1 1 106 106 LEU CB C 13 42.219 0.300 . 1 . . . . 106 LEU CB . 10125 1 1310 . 1 1 106 106 LEU CG C 13 26.988 0.300 . 1 . . . . 106 LEU CG . 10125 1 1311 . 1 1 106 106 LEU CD1 C 13 24.908 0.300 . 2 . . . . 106 LEU CD1 . 10125 1 1312 . 1 1 106 106 LEU CD2 C 13 23.494 0.300 . 2 . . . . 106 LEU CD2 . 10125 1 1313 . 1 1 106 106 LEU N N 15 123.747 0.300 . 1 . . . . 106 LEU N . 10125 1 1314 . 1 1 107 107 ASN H H 1 8.283 0.030 . 1 . . . . 107 ASN H . 10125 1 1315 . 1 1 107 107 ASN HA H 1 4.631 0.030 . 1 . . . . 107 ASN HA . 10125 1 1316 . 1 1 107 107 ASN HB2 H 1 2.737 0.030 . 2 . . . . 107 ASN HB2 . 10125 1 1317 . 1 1 107 107 ASN HB3 H 1 2.822 0.030 . 2 . . . . 107 ASN HB3 . 10125 1 1318 . 1 1 107 107 ASN HD21 H 1 7.606 0.030 . 2 . . . . 107 ASN HD21 . 10125 1 1319 . 1 1 107 107 ASN HD22 H 1 6.933 0.030 . 2 . . . . 107 ASN HD22 . 10125 1 1320 . 1 1 107 107 ASN C C 13 175.245 0.300 . 1 . . . . 107 ASN C . 10125 1 1321 . 1 1 107 107 ASN CA C 13 53.510 0.300 . 1 . . . . 107 ASN CA . 10125 1 1322 . 1 1 107 107 ASN CB C 13 38.715 0.300 . 1 . . . . 107 ASN CB . 10125 1 1323 . 1 1 107 107 ASN N N 15 118.632 0.300 . 1 . . . . 107 ASN N . 10125 1 1324 . 1 1 107 107 ASN ND2 N 15 112.817 0.300 . 1 . . . . 107 ASN ND2 . 10125 1 1325 . 1 1 108 108 LYS H H 1 8.165 0.030 . 1 . . . . 108 LYS H . 10125 1 1326 . 1 1 108 108 LYS HA H 1 4.262 0.030 . 1 . . . . 108 LYS HA . 10125 1 1327 . 1 1 108 108 LYS HB2 H 1 1.739 0.030 . 2 . . . . 108 LYS HB2 . 10125 1 1328 . 1 1 108 108 LYS HB3 H 1 1.845 0.030 . 2 . . . . 108 LYS HB3 . 10125 1 1329 . 1 1 108 108 LYS HG2 H 1 1.398 0.030 . 2 . . . . 108 LYS HG2 . 10125 1 1330 . 1 1 108 108 LYS HG3 H 1 1.443 0.030 . 2 . . . . 108 LYS HG3 . 10125 1 1331 . 1 1 108 108 LYS HD2 H 1 1.673 0.030 . 1 . . . . 108 LYS HD2 . 10125 1 1332 . 1 1 108 108 LYS HD3 H 1 1.673 0.030 . 1 . . . . 108 LYS HD3 . 10125 1 1333 . 1 1 108 108 LYS HE2 H 1 3.000 0.030 . 1 . . . . 108 LYS HE2 . 10125 1 1334 . 1 1 108 108 LYS HE3 H 1 3.000 0.030 . 1 . . . . 108 LYS HE3 . 10125 1 1335 . 1 1 108 108 LYS C C 13 176.565 0.300 . 1 . . . . 108 LYS C . 10125 1 1336 . 1 1 108 108 LYS CA C 13 56.599 0.300 . 1 . . . . 108 LYS CA . 10125 1 1337 . 1 1 108 108 LYS CB C 13 32.853 0.300 . 1 . . . . 108 LYS CB . 10125 1 1338 . 1 1 108 108 LYS CG C 13 24.741 0.300 . 1 . . . . 108 LYS CG . 10125 1 1339 . 1 1 108 108 LYS CD C 13 29.068 0.300 . 1 . . . . 108 LYS CD . 10125 1 1340 . 1 1 108 108 LYS CE C 13 42.130 0.300 . 1 . . . . 108 LYS CE . 10125 1 1341 . 1 1 108 108 LYS N N 15 121.481 0.300 . 1 . . . . 108 LYS N . 10125 1 1342 . 1 1 109 109 ARG H H 1 8.221 0.030 . 1 . . . . 109 ARG H . 10125 1 1343 . 1 1 109 109 ARG HA H 1 4.278 0.030 . 1 . . . . 109 ARG HA . 10125 1 1344 . 1 1 109 109 ARG HB2 H 1 1.832 0.030 . 2 . . . . 109 ARG HB2 . 10125 1 1345 . 1 1 109 109 ARG HB3 H 1 1.768 0.030 . 2 . . . . 109 ARG HB3 . 10125 1 1346 . 1 1 109 109 ARG HG2 H 1 1.651 0.030 . 1 . . . . 109 ARG HG2 . 10125 1 1347 . 1 1 109 109 ARG HG3 H 1 1.651 0.030 . 1 . . . . 109 ARG HG3 . 10125 1 1348 . 1 1 109 109 ARG HD2 H 1 3.187 0.030 . 1 . . . . 109 ARG HD2 . 10125 1 1349 . 1 1 109 109 ARG HD3 H 1 3.187 0.030 . 1 . . . . 109 ARG HD3 . 10125 1 1350 . 1 1 109 109 ARG C C 13 176.360 0.300 . 1 . . . . 109 ARG C . 10125 1 1351 . 1 1 109 109 ARG CA C 13 56.310 0.300 . 1 . . . . 109 ARG CA . 10125 1 1352 . 1 1 109 109 ARG CB C 13 30.773 0.300 . 1 . . . . 109 ARG CB . 10125 1 1353 . 1 1 109 109 ARG CG C 13 27.154 0.300 . 1 . . . . 109 ARG CG . 10125 1 1354 . 1 1 109 109 ARG CD C 13 43.461 0.300 . 1 . . . . 109 ARG CD . 10125 1 1355 . 1 1 109 109 ARG N N 15 121.708 0.300 . 1 . . . . 109 ARG N . 10125 1 1356 . 1 1 110 110 LYS H H 1 8.318 0.030 . 1 . . . . 110 LYS H . 10125 1 1357 . 1 1 110 110 LYS HA H 1 4.259 0.030 . 1 . . . . 110 LYS HA . 10125 1 1358 . 1 1 110 110 LYS HB2 H 1 1.811 0.030 . 2 . . . . 110 LYS HB2 . 10125 1 1359 . 1 1 110 110 LYS HB3 H 1 1.750 0.030 . 2 . . . . 110 LYS HB3 . 10125 1 1360 . 1 1 110 110 LYS HG2 H 1 1.402 0.030 . 2 . . . . 110 LYS HG2 . 10125 1 1361 . 1 1 110 110 LYS HD2 H 1 1.676 0.030 . 2 . . . . 110 LYS HD2 . 10125 1 1362 . 1 1 110 110 LYS HE2 H 1 2.989 0.030 . 2 . . . . 110 LYS HE2 . 10125 1 1363 . 1 1 110 110 LYS C C 13 176.446 0.300 . 1 . . . . 110 LYS C . 10125 1 1364 . 1 1 110 110 LYS CA C 13 56.505 0.300 . 1 . . . . 110 LYS CA . 10125 1 1365 . 1 1 110 110 LYS CB C 13 33.068 0.300 . 1 . . . . 110 LYS CB . 10125 1 1366 . 1 1 110 110 LYS CG C 13 24.825 0.300 . 1 . . . . 110 LYS CG . 10125 1 1367 . 1 1 110 110 LYS CD C 13 29.151 0.300 . 1 . . . . 110 LYS CD . 10125 1 1368 . 1 1 110 110 LYS CE C 13 42.130 0.300 . 1 . . . . 110 LYS CE . 10125 1 1369 . 1 1 110 110 LYS N N 15 123.067 0.300 . 1 . . . . 110 LYS N . 10125 1 1370 . 1 1 111 111 ARG H H 1 8.374 0.030 . 1 . . . . 111 ARG H . 10125 1 1371 . 1 1 111 111 ARG HA H 1 4.290 0.030 . 1 . . . . 111 ARG HA . 10125 1 1372 . 1 1 111 111 ARG HB2 H 1 1.837 0.030 . 2 . . . . 111 ARG HB2 . 10125 1 1373 . 1 1 111 111 ARG HB3 H 1 1.762 0.030 . 2 . . . . 111 ARG HB3 . 10125 1 1374 . 1 1 111 111 ARG HG2 H 1 1.633 0.030 . 2 . . . . 111 ARG HG2 . 10125 1 1375 . 1 1 111 111 ARG HD2 H 1 3.200 0.030 . 2 . . . . 111 ARG HD2 . 10125 1 1376 . 1 1 111 111 ARG C C 13 176.169 0.300 . 1 . . . . 111 ARG C . 10125 1 1377 . 1 1 111 111 ARG CA C 13 56.281 0.300 . 1 . . . . 111 ARG CA . 10125 1 1378 . 1 1 111 111 ARG CB C 13 30.851 0.300 . 1 . . . . 111 ARG CB . 10125 1 1379 . 1 1 111 111 ARG CG C 13 27.154 0.300 . 1 . . . . 111 ARG CG . 10125 1 1380 . 1 1 111 111 ARG CD C 13 43.378 0.300 . 1 . . . . 111 ARG CD . 10125 1 1381 . 1 1 111 111 ARG N N 15 122.841 0.300 . 1 . . . . 111 ARG N . 10125 1 1382 . 1 1 112 112 GLU H H 1 8.488 0.030 . 1 . . . . 112 GLU H . 10125 1 1383 . 1 1 112 112 GLU HA H 1 4.266 0.030 . 1 . . . . 112 GLU HA . 10125 1 1384 . 1 1 112 112 GLU HB2 H 1 1.903 0.030 . 2 . . . . 112 GLU HB2 . 10125 1 1385 . 1 1 112 112 GLU HB3 H 1 2.035 0.030 . 2 . . . . 112 GLU HB3 . 10125 1 1386 . 1 1 112 112 GLU HG2 H 1 2.246 0.030 . 1 . . . . 112 GLU HG2 . 10125 1 1387 . 1 1 112 112 GLU HG3 H 1 2.246 0.030 . 1 . . . . 112 GLU HG3 . 10125 1 1388 . 1 1 112 112 GLU C C 13 175.690 0.300 . 1 . . . . 112 GLU C . 10125 1 1389 . 1 1 112 112 GLU CA C 13 56.371 0.300 . 1 . . . . 112 GLU CA . 10125 1 1390 . 1 1 112 112 GLU CB C 13 30.365 0.300 . 1 . . . . 112 GLU CB . 10125 1 1391 . 1 1 112 112 GLU CG C 13 36.223 0.300 . 1 . . . . 112 GLU CG . 10125 1 1392 . 1 1 112 112 GLU N N 15 122.387 0.300 . 1 . . . . 112 GLU N . 10125 1 1393 . 1 1 113 113 ALA H H 1 8.277 0.030 . 1 . . . . 113 ALA H . 10125 1 1394 . 1 1 113 113 ALA HA H 1 4.595 0.030 . 1 . . . . 113 ALA HA . 10125 1 1395 . 1 1 113 113 ALA HB1 H 1 1.358 0.030 . 1 . . . . 113 ALA HB . 10125 1 1396 . 1 1 113 113 ALA HB2 H 1 1.358 0.030 . 1 . . . . 113 ALA HB . 10125 1 1397 . 1 1 113 113 ALA HB3 H 1 1.358 0.030 . 1 . . . . 113 ALA HB . 10125 1 1398 . 1 1 113 113 ALA C C 13 175.444 0.300 . 1 . . . . 113 ALA C . 10125 1 1399 . 1 1 113 113 ALA CA C 13 50.522 0.300 . 1 . . . . 113 ALA CA . 10125 1 1400 . 1 1 113 113 ALA CB C 13 18.547 0.300 . 1 . . . . 113 ALA CB . 10125 1 1401 . 1 1 113 113 ALA N N 15 125.786 0.300 . 1 . . . . 113 ALA N . 10125 1 1402 . 1 1 114 114 PRO HA H 1 4.417 0.030 . 1 . . . . 114 PRO HA . 10125 1 1403 . 1 1 114 114 PRO HB2 H 1 1.927 0.030 . 2 . . . . 114 PRO HB2 . 10125 1 1404 . 1 1 114 114 PRO HB3 H 1 2.287 0.030 . 2 . . . . 114 PRO HB3 . 10125 1 1405 . 1 1 114 114 PRO HG2 H 1 2.002 0.030 . 2 . . . . 114 PRO HG2 . 10125 1 1406 . 1 1 114 114 PRO HD2 H 1 3.692 0.030 . 2 . . . . 114 PRO HD2 . 10125 1 1407 . 1 1 114 114 PRO HD3 H 1 4.604 0.030 . 2 . . . . 114 PRO HD3 . 10125 1 1408 . 1 1 114 114 PRO C C 13 176.732 0.300 . 1 . . . . 114 PRO C . 10125 1 1409 . 1 1 114 114 PRO CA C 13 63.274 0.300 . 1 . . . . 114 PRO CA . 10125 1 1410 . 1 1 114 114 PRO CB C 13 32.025 0.300 . 1 . . . . 114 PRO CB . 10125 1 1411 . 1 1 114 114 PRO CG C 13 27.321 0.300 . 1 . . . . 114 PRO CG . 10125 1 1412 . 1 1 114 114 PRO CD C 13 50.449 0.300 . 1 . . . . 114 PRO CD . 10125 1 1413 . 1 1 115 115 ASP H H 1 8.379 0.030 . 1 . . . . 115 ASP H . 10125 1 1414 . 1 1 115 115 ASP HA H 1 4.514 0.030 . 1 . . . . 115 ASP HA . 10125 1 1415 . 1 1 115 115 ASP HB2 H 1 2.606 0.030 . 2 . . . . 115 ASP HB2 . 10125 1 1416 . 1 1 115 115 ASP HB3 H 1 2.666 0.030 . 2 . . . . 115 ASP HB3 . 10125 1 1417 . 1 1 115 115 ASP C C 13 176.050 0.300 . 1 . . . . 115 ASP C . 10125 1 1418 . 1 1 115 115 ASP CA C 13 54.486 0.300 . 1 . . . . 115 ASP CA . 10125 1 1419 . 1 1 115 115 ASP CB C 13 40.942 0.300 . 1 . . . . 115 ASP CB . 10125 1 1420 . 1 1 115 115 ASP N N 15 119.442 0.300 . 1 . . . . 115 ASP N . 10125 1 1421 . 1 1 116 116 GLN H H 1 8.153 0.030 . 1 . . . . 116 GLN H . 10125 1 1422 . 1 1 116 116 GLN HA H 1 4.290 0.030 . 1 . . . . 116 GLN HA . 10125 1 1423 . 1 1 116 116 GLN HB2 H 1 1.939 0.030 . 2 . . . . 116 GLN HB2 . 10125 1 1424 . 1 1 116 116 GLN HB3 H 1 2.083 0.030 . 2 . . . . 116 GLN HB3 . 10125 1 1425 . 1 1 116 116 GLN HG2 H 1 2.313 0.030 . 1 . . . . 116 GLN HG2 . 10125 1 1426 . 1 1 116 116 GLN HG3 H 1 2.313 0.030 . 1 . . . . 116 GLN HG3 . 10125 1 1427 . 1 1 116 116 GLN C C 13 175.346 0.300 . 1 . . . . 116 GLN C . 10125 1 1428 . 1 1 116 116 GLN CA C 13 55.438 0.300 . 1 . . . . 116 GLN CA . 10125 1 1429 . 1 1 116 116 GLN CB C 13 29.798 0.300 . 1 . . . . 116 GLN CB . 10125 1 1430 . 1 1 116 116 GLN CG C 13 33.727 0.300 . 1 . . . . 116 GLN CG . 10125 1 1431 . 1 1 116 116 GLN N N 15 119.669 0.300 . 1 . . . . 116 GLN N . 10125 1 1432 . 1 1 117 117 ASP H H 1 8.422 0.030 . 1 . . . . 117 ASP H . 10125 1 1433 . 1 1 117 117 ASP HA H 1 4.820 0.030 . 1 . . . . 117 ASP HA . 10125 1 1434 . 1 1 117 117 ASP HB2 H 1 2.547 0.030 . 2 . . . . 117 ASP HB2 . 10125 1 1435 . 1 1 117 117 ASP HB3 H 1 2.721 0.030 . 2 . . . . 117 ASP HB3 . 10125 1 1436 . 1 1 117 117 ASP C C 13 174.949 0.300 . 1 . . . . 117 ASP C . 10125 1 1437 . 1 1 117 117 ASP CA C 13 52.374 0.300 . 1 . . . . 117 ASP CA . 10125 1 1438 . 1 1 117 117 ASP CB C 13 41.352 0.300 . 1 . . . . 117 ASP CB . 10125 1 1439 . 1 1 117 117 ASP N N 15 123.294 0.300 . 1 . . . . 117 ASP N . 10125 1 1440 . 1 1 118 118 PRO HA H 1 4.422 0.030 . 1 . . . . 118 PRO HA . 10125 1 1441 . 1 1 118 118 PRO HB2 H 1 1.987 0.030 . 2 . . . . 118 PRO HB2 . 10125 1 1442 . 1 1 118 118 PRO HB3 H 1 2.275 0.030 . 2 . . . . 118 PRO HB3 . 10125 1 1443 . 1 1 118 118 PRO HG2 H 1 2.025 0.030 . 1 . . . . 118 PRO HG2 . 10125 1 1444 . 1 1 118 118 PRO HG3 H 1 2.025 0.030 . 1 . . . . 118 PRO HG3 . 10125 1 1445 . 1 1 118 118 PRO HD2 H 1 3.839 0.030 . 1 . . . . 118 PRO HD2 . 10125 1 1446 . 1 1 118 118 PRO HD3 H 1 3.839 0.030 . 1 . . . . 118 PRO HD3 . 10125 1 1447 . 1 1 118 118 PRO C C 13 177.657 0.300 . 1 . . . . 118 PRO C . 10125 1 1448 . 1 1 118 118 PRO CA C 13 63.926 0.300 . 1 . . . . 118 PRO CA . 10125 1 1449 . 1 1 118 118 PRO CB C 13 31.985 0.300 . 1 . . . . 118 PRO CB . 10125 1 1450 . 1 1 118 118 PRO CG C 13 27.071 0.300 . 1 . . . . 118 PRO CG . 10125 1 1451 . 1 1 118 118 PRO CD C 13 50.782 0.300 . 1 . . . . 118 PRO CD . 10125 1 1452 . 1 1 119 119 GLY H H 1 8.558 0.030 . 1 . . . . 119 GLY H . 10125 1 1453 . 1 1 119 119 GLY HA2 H 1 3.968 0.030 . 1 . . . . 119 GLY HA2 . 10125 1 1454 . 1 1 119 119 GLY HA3 H 1 3.968 0.030 . 1 . . . . 119 GLY HA3 . 10125 1 1455 . 1 1 119 119 GLY C C 13 174.481 0.300 . 1 . . . . 119 GLY C . 10125 1 1456 . 1 1 119 119 GLY CA C 13 45.226 0.300 . 1 . . . . 119 GLY CA . 10125 1 1457 . 1 1 119 119 GLY N N 15 108.853 0.300 . 1 . . . . 119 GLY N . 10125 1 1458 . 1 1 120 120 GLY H H 1 7.992 0.030 . 1 . . . . 120 GLY H . 10125 1 1459 . 1 1 120 120 GLY HA2 H 1 3.923 0.030 . 2 . . . . 120 GLY HA2 . 10125 1 1460 . 1 1 120 120 GLY HA3 H 1 4.103 0.030 . 2 . . . . 120 GLY HA3 . 10125 1 1461 . 1 1 120 120 GLY C C 13 171.834 0.300 . 1 . . . . 120 GLY C . 10125 1 1462 . 1 1 120 120 GLY CA C 13 44.569 0.300 . 1 . . . . 120 GLY CA . 10125 1 1463 . 1 1 120 120 GLY N N 15 108.794 0.300 . 1 . . . . 120 GLY N . 10125 1 1464 . 1 1 121 121 PRO HA H 1 4.434 0.030 . 1 . . . . 121 PRO HA . 10125 1 1465 . 1 1 121 121 PRO HB2 H 1 1.915 0.030 . 2 . . . . 121 PRO HB2 . 10125 1 1466 . 1 1 121 121 PRO HB3 H 1 2.275 0.030 . 2 . . . . 121 PRO HB3 . 10125 1 1467 . 1 1 121 121 PRO HG2 H 1 2.008 0.030 . 1 . . . . 121 PRO HG2 . 10125 1 1468 . 1 1 121 121 PRO HG3 H 1 2.008 0.030 . 1 . . . . 121 PRO HG3 . 10125 1 1469 . 1 1 121 121 PRO HD2 H 1 3.628 0.030 . 1 . . . . 121 PRO HD2 . 10125 1 1470 . 1 1 121 121 PRO HD3 H 1 3.628 0.030 . 1 . . . . 121 PRO HD3 . 10125 1 1471 . 1 1 121 121 PRO C C 13 177.336 0.300 . 1 . . . . 121 PRO C . 10125 1 1472 . 1 1 121 121 PRO CA C 13 63.254 0.300 . 1 . . . . 121 PRO CA . 10125 1 1473 . 1 1 121 121 PRO CB C 13 32.102 0.300 . 1 . . . . 121 PRO CB . 10125 1 1474 . 1 1 121 121 PRO CG C 13 27.237 0.300 . 1 . . . . 121 PRO CG . 10125 1 1475 . 1 1 121 121 PRO CD C 13 49.784 0.300 . 1 . . . . 121 PRO CD . 10125 1 1476 . 1 1 122 122 ARG H H 1 8.544 0.030 . 1 . . . . 122 ARG H . 10125 1 1477 . 1 1 122 122 ARG HA H 1 4.392 0.030 . 1 . . . . 122 ARG HA . 10125 1 1478 . 1 1 122 122 ARG HB2 H 1 1.768 0.030 . 1 . . . . 122 ARG HB2 . 10125 1 1479 . 1 1 122 122 ARG HB3 H 1 1.768 0.030 . 1 . . . . 122 ARG HB3 . 10125 1 1480 . 1 1 122 122 ARG HG2 H 1 1.647 0.030 . 1 . . . . 122 ARG HG2 . 10125 1 1481 . 1 1 122 122 ARG HG3 H 1 1.647 0.030 . 1 . . . . 122 ARG HG3 . 10125 1 1482 . 1 1 122 122 ARG C C 13 176.388 0.300 . 1 . . . . 122 ARG C . 10125 1 1483 . 1 1 122 122 ARG CA C 13 55.819 0.300 . 1 . . . . 122 ARG CA . 10125 1 1484 . 1 1 122 122 ARG CB C 13 30.782 0.300 . 1 . . . . 122 ARG CB . 10125 1 1485 . 1 1 122 122 ARG CG C 13 27.071 0.300 . 1 . . . . 122 ARG CG . 10125 1 1486 . 1 1 122 122 ARG N N 15 121.481 0.300 . 1 . . . . 122 ARG N . 10125 1 1487 . 1 1 123 123 SER H H 1 8.304 0.030 . 1 . . . . 123 SER H . 10125 1 1488 . 1 1 123 123 SER HA H 1 4.379 0.030 . 1 . . . . 123 SER HA . 10125 1 1489 . 1 1 123 123 SER HB2 H 1 3.859 0.030 . 1 . . . . 123 SER HB2 . 10125 1 1490 . 1 1 123 123 SER HB3 H 1 3.859 0.030 . 1 . . . . 123 SER HB3 . 10125 1 1491 . 1 1 123 123 SER C C 13 174.502 0.300 . 1 . . . . 123 SER C . 10125 1 1492 . 1 1 123 123 SER CA C 13 58.247 0.300 . 1 . . . . 123 SER CA . 10125 1 1493 . 1 1 123 123 SER CB C 13 64.137 0.300 . 1 . . . . 123 SER CB . 10125 1 1494 . 1 1 123 123 SER N N 15 116.950 0.300 . 1 . . . . 123 SER N . 10125 1 1495 . 1 1 124 124 GLY H H 1 8.268 0.030 . 1 . . . . 124 GLY H . 10125 1 1496 . 1 1 124 124 GLY HA2 H 1 4.118 0.030 . 2 . . . . 124 GLY HA2 . 10125 1 1497 . 1 1 124 124 GLY HA3 H 1 4.478 0.030 . 2 . . . . 124 GLY HA3 . 10125 1 1498 . 1 1 124 124 GLY C C 13 171.762 0.300 . 1 . . . . 124 GLY C . 10125 1 1499 . 1 1 124 124 GLY CA C 13 44.681 0.300 . 1 . . . . 124 GLY CA . 10125 1 1500 . 1 1 124 124 GLY N N 15 110.606 0.300 . 1 . . . . 124 GLY N . 10125 1 1501 . 1 1 125 125 PRO HA H 1 4.470 0.030 . 1 . . . . 125 PRO HA . 10125 1 1502 . 1 1 125 125 PRO HB2 H 1 1.975 0.030 . 2 . . . . 125 PRO HB2 . 10125 1 1503 . 1 1 125 125 PRO HB3 H 1 2.287 0.030 . 2 . . . . 125 PRO HB3 . 10125 1 1504 . 1 1 125 125 PRO C C 13 177.406 0.300 . 1 . . . . 125 PRO C . 10125 1 1505 . 1 1 125 125 PRO CA C 13 63.261 0.300 . 1 . . . . 125 PRO CA . 10125 1 1506 . 1 1 125 125 PRO CB C 13 32.209 0.300 . 1 . . . . 125 PRO CB . 10125 1 1507 . 1 1 125 125 PRO CG C 13 27.154 0.300 . 1 . . . . 125 PRO CG . 10125 1 1508 . 1 1 125 125 PRO CD C 13 49.784 0.300 . 1 . . . . 125 PRO CD . 10125 1 1509 . 1 1 126 126 SER H H 1 8.530 0.030 . 1 . . . . 126 SER H . 10125 1 1510 . 1 1 126 126 SER HA H 1 4.494 0.030 . 1 . . . . 126 SER HA . 10125 1 1511 . 1 1 126 126 SER HB2 H 1 3.895 0.030 . 1 . . . . 126 SER HB2 . 10125 1 1512 . 1 1 126 126 SER HB3 H 1 3.895 0.030 . 1 . . . . 126 SER HB3 . 10125 1 1513 . 1 1 126 126 SER C C 13 174.736 0.300 . 1 . . . . 126 SER C . 10125 1 1514 . 1 1 126 126 SER CA C 13 58.431 0.300 . 1 . . . . 126 SER CA . 10125 1 1515 . 1 1 126 126 SER CB C 13 63.835 0.300 . 1 . . . . 126 SER CB . 10125 1 1516 . 1 1 126 126 SER N N 15 116.250 0.300 . 1 . . . . 126 SER N . 10125 1 1517 . 1 1 127 127 SER H H 1 8.311 0.030 . 1 . . . . 127 SER H . 10125 1 1518 . 1 1 127 127 SER HA H 1 4.482 0.030 . 1 . . . . 127 SER HA . 10125 1 1519 . 1 1 127 127 SER HB2 H 1 3.883 0.030 . 1 . . . . 127 SER HB2 . 10125 1 1520 . 1 1 127 127 SER HB3 H 1 3.883 0.030 . 1 . . . . 127 SER HB3 . 10125 1 1521 . 1 1 127 127 SER C C 13 173.828 0.300 . 1 . . . . 127 SER C . 10125 1 1522 . 1 1 127 127 SER CA C 13 58.431 0.300 . 1 . . . . 127 SER CA . 10125 1 1523 . 1 1 127 127 SER CB C 13 64.074 0.300 . 1 . . . . 127 SER CB . 10125 1 1524 . 1 1 127 127 SER N N 15 117.630 0.300 . 1 . . . . 127 SER N . 10125 1 1525 . 1 1 128 128 GLY H H 1 8.039 0.030 . 1 . . . . 128 GLY H . 10125 1 1526 . 1 1 128 128 GLY C C 13 178.966 0.300 . 1 . . . . 128 GLY C . 10125 1 1527 . 1 1 128 128 GLY CA C 13 46.232 0.300 . 1 . . . . 128 GLY CA . 10125 1 1528 . 1 1 128 128 GLY N N 15 116.723 0.300 . 1 . . . . 128 GLY N . 10125 1 stop_ save_