data_11087 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11087 _Entry.Title ; Solution structure of the PH domain of Kindlin-3 from human ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-01-15 _Entry.Accession_date 2010-01-19 _Entry.Last_release_date 2011-01-14 _Entry.Original_release_date 2011-01-14 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.14 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 H. Li . . . 11087 2 M. Sato . . . 11087 3 S. Koshiba . . . 11087 4 S. Watanabe . . . 11087 5 T. Harada . . . 11087 6 T. Kigawa . . . 11087 7 S. Yokoyama . . . 11087 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'Protein 3000' 'RIKEN Structural Genomics/Proteomics Initiative (RSGI)' . 11087 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11087 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 608 11087 '15N chemical shifts' 134 11087 '1H chemical shifts' 956 11087 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2011-01-14 2010-01-15 original author . 11087 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2YS3 'BMRB Entry Tracking System' 11087 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11087 _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 PH domain of Kindlin-3 from human' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 H. Li . . . 11087 1 2 M. Sato . . . 11087 1 3 S. Koshiba . . . 11087 1 4 S. Watanabe . . . 11087 1 5 T. Harada . . . 11087 1 6 T. Kigawa . . . 11087 1 7 S. Yokoyama . . . 11087 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11087 _Assembly.ID 1 _Assembly.Name 'Unc-112-related protein 2' _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 'PH domain, UNP residues 349-478' 1 $entity_1 A . yes native no no . . . 11087 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2ys3 . . . . . . 11087 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11087 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'PH domain, UNP residues 349-478' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGIPELKDHLRIFRP RKLTLKGYRQHWVVFKETTL SYYKSQDEAPGDPIQQLNLK GCEVVPDVNVSGQKFCIKLL VPSPEGMSEIYLRCQDEQQY ARWMAGCRLASKGRTMADSS YTSEVQAILAFLSLQRT ; _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 137 _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 2YS3 . "Solution Structure Of The Ph Domain Of Kindlin-3 From Human" . . . . . 100.00 137 100.00 100.00 3.34e-96 . . . . 11087 1 2 no DBJ BAC04220 . "unnamed protein product [Homo sapiens]" . . . . . 96.35 663 96.97 98.48 1.28e-83 . . . . 11087 1 3 no GB AAH04347 . "Fermitin family homolog 3 (Drosophila) [Homo sapiens]" . . . . . 96.35 663 98.48 99.24 4.55e-85 . . . . 11087 1 4 no GB AAH13366 . "Fermitin family homolog 3 (Drosophila) [Homo sapiens]" . . . . . 96.35 663 98.48 99.24 4.55e-85 . . . . 11087 1 5 no GB AAH15584 . "Fermitin family homolog 3 (Drosophila) [Homo sapiens]" . . . . . 96.35 663 98.48 99.24 4.55e-85 . . . . 11087 1 6 no GB AAI09489 . "Fermitin family homolog 3 (Drosophila) [Bos taurus]" . . . . . 94.89 665 98.46 100.00 7.53e-84 . . . . 11087 1 7 no GB AAM19736 . "UNC-112 related protein 2 short form URP2SF [Homo sapiens]" . . . . . 96.35 663 98.48 99.24 4.55e-85 . . . . 11087 1 8 no REF NP_001032695 . "fermitin family homolog 3 [Bos taurus]" . . . . . 94.89 665 98.46 100.00 7.53e-84 . . . . 11087 1 9 no REF NP_113659 . "fermitin family homolog 3 short form [Homo sapiens]" . . . . . 96.35 663 98.48 99.24 4.55e-85 . . . . 11087 1 10 no REF XP_001118313 . "PREDICTED: fermitin family homolog 3-like [Macaca mulatta]" . . . . . 94.89 598 98.46 99.23 4.73e-84 . . . . 11087 1 11 no REF XP_002821634 . "PREDICTED: LOW QUALITY PROTEIN: fermitin family homolog 3 [Pongo abelii]" . . . . . 96.35 663 98.48 99.24 4.55e-85 . . . . 11087 1 12 no REF XP_003639703 . "PREDICTED: LOW QUALITY PROTEIN: fermitin family homolog 3 [Canis lupus familiaris]" . . . . . 96.35 663 96.97 98.48 4.99e-84 . . . . 11087 1 13 no SP Q32LP0 . "RecName: Full=Fermitin family homolog 3; AltName: Full=Kindlin-3; AltName: Full=Unc-112-related protein 2" . . . . . 94.89 665 98.46 100.00 7.53e-84 . . . . 11087 1 14 no TPG DAA13656 . "TPA: fermitin family homolog 3-like [Bos taurus]" . . . . . 62.77 273 97.67 100.00 9.40e-52 . . . . 11087 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 . 11087 1 2 . SER . 11087 1 3 . SER . 11087 1 4 . GLY . 11087 1 5 . SER . 11087 1 6 . SER . 11087 1 7 . GLY . 11087 1 8 . ILE . 11087 1 9 . PRO . 11087 1 10 . GLU . 11087 1 11 . LEU . 11087 1 12 . LYS . 11087 1 13 . ASP . 11087 1 14 . HIS . 11087 1 15 . LEU . 11087 1 16 . ARG . 11087 1 17 . ILE . 11087 1 18 . PHE . 11087 1 19 . ARG . 11087 1 20 . PRO . 11087 1 21 . ARG . 11087 1 22 . LYS . 11087 1 23 . LEU . 11087 1 24 . THR . 11087 1 25 . LEU . 11087 1 26 . LYS . 11087 1 27 . GLY . 11087 1 28 . TYR . 11087 1 29 . ARG . 11087 1 30 . GLN . 11087 1 31 . HIS . 11087 1 32 . TRP . 11087 1 33 . VAL . 11087 1 34 . VAL . 11087 1 35 . PHE . 11087 1 36 . LYS . 11087 1 37 . GLU . 11087 1 38 . THR . 11087 1 39 . THR . 11087 1 40 . LEU . 11087 1 41 . SER . 11087 1 42 . TYR . 11087 1 43 . TYR . 11087 1 44 . LYS . 11087 1 45 . SER . 11087 1 46 . GLN . 11087 1 47 . ASP . 11087 1 48 . GLU . 11087 1 49 . ALA . 11087 1 50 . PRO . 11087 1 51 . GLY . 11087 1 52 . ASP . 11087 1 53 . PRO . 11087 1 54 . ILE . 11087 1 55 . GLN . 11087 1 56 . GLN . 11087 1 57 . LEU . 11087 1 58 . ASN . 11087 1 59 . LEU . 11087 1 60 . LYS . 11087 1 61 . GLY . 11087 1 62 . CYS . 11087 1 63 . GLU . 11087 1 64 . VAL . 11087 1 65 . VAL . 11087 1 66 . PRO . 11087 1 67 . ASP . 11087 1 68 . VAL . 11087 1 69 . ASN . 11087 1 70 . VAL . 11087 1 71 . SER . 11087 1 72 . GLY . 11087 1 73 . GLN . 11087 1 74 . LYS . 11087 1 75 . PHE . 11087 1 76 . CYS . 11087 1 77 . ILE . 11087 1 78 . LYS . 11087 1 79 . LEU . 11087 1 80 . LEU . 11087 1 81 . VAL . 11087 1 82 . PRO . 11087 1 83 . SER . 11087 1 84 . PRO . 11087 1 85 . GLU . 11087 1 86 . GLY . 11087 1 87 . MET . 11087 1 88 . SER . 11087 1 89 . GLU . 11087 1 90 . ILE . 11087 1 91 . TYR . 11087 1 92 . LEU . 11087 1 93 . ARG . 11087 1 94 . CYS . 11087 1 95 . GLN . 11087 1 96 . ASP . 11087 1 97 . GLU . 11087 1 98 . GLN . 11087 1 99 . GLN . 11087 1 100 . TYR . 11087 1 101 . ALA . 11087 1 102 . ARG . 11087 1 103 . TRP . 11087 1 104 . MET . 11087 1 105 . ALA . 11087 1 106 . GLY . 11087 1 107 . CYS . 11087 1 108 . ARG . 11087 1 109 . LEU . 11087 1 110 . ALA . 11087 1 111 . SER . 11087 1 112 . LYS . 11087 1 113 . GLY . 11087 1 114 . ARG . 11087 1 115 . THR . 11087 1 116 . MET . 11087 1 117 . ALA . 11087 1 118 . ASP . 11087 1 119 . SER . 11087 1 120 . SER . 11087 1 121 . TYR . 11087 1 122 . THR . 11087 1 123 . SER . 11087 1 124 . GLU . 11087 1 125 . VAL . 11087 1 126 . GLN . 11087 1 127 . ALA . 11087 1 128 . ILE . 11087 1 129 . LEU . 11087 1 130 . ALA . 11087 1 131 . PHE . 11087 1 132 . LEU . 11087 1 133 . SER . 11087 1 134 . LEU . 11087 1 135 . GLN . 11087 1 136 . ARG . 11087 1 137 . THR . 11087 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 11087 1 . SER 2 2 11087 1 . SER 3 3 11087 1 . GLY 4 4 11087 1 . SER 5 5 11087 1 . SER 6 6 11087 1 . GLY 7 7 11087 1 . ILE 8 8 11087 1 . PRO 9 9 11087 1 . GLU 10 10 11087 1 . LEU 11 11 11087 1 . LYS 12 12 11087 1 . ASP 13 13 11087 1 . HIS 14 14 11087 1 . LEU 15 15 11087 1 . ARG 16 16 11087 1 . ILE 17 17 11087 1 . PHE 18 18 11087 1 . ARG 19 19 11087 1 . PRO 20 20 11087 1 . ARG 21 21 11087 1 . LYS 22 22 11087 1 . LEU 23 23 11087 1 . THR 24 24 11087 1 . LEU 25 25 11087 1 . LYS 26 26 11087 1 . GLY 27 27 11087 1 . TYR 28 28 11087 1 . ARG 29 29 11087 1 . GLN 30 30 11087 1 . HIS 31 31 11087 1 . TRP 32 32 11087 1 . VAL 33 33 11087 1 . VAL 34 34 11087 1 . PHE 35 35 11087 1 . LYS 36 36 11087 1 . GLU 37 37 11087 1 . THR 38 38 11087 1 . THR 39 39 11087 1 . LEU 40 40 11087 1 . SER 41 41 11087 1 . TYR 42 42 11087 1 . TYR 43 43 11087 1 . LYS 44 44 11087 1 . SER 45 45 11087 1 . GLN 46 46 11087 1 . ASP 47 47 11087 1 . GLU 48 48 11087 1 . ALA 49 49 11087 1 . PRO 50 50 11087 1 . GLY 51 51 11087 1 . ASP 52 52 11087 1 . PRO 53 53 11087 1 . ILE 54 54 11087 1 . GLN 55 55 11087 1 . GLN 56 56 11087 1 . LEU 57 57 11087 1 . ASN 58 58 11087 1 . LEU 59 59 11087 1 . LYS 60 60 11087 1 . GLY 61 61 11087 1 . CYS 62 62 11087 1 . GLU 63 63 11087 1 . VAL 64 64 11087 1 . VAL 65 65 11087 1 . PRO 66 66 11087 1 . ASP 67 67 11087 1 . VAL 68 68 11087 1 . ASN 69 69 11087 1 . VAL 70 70 11087 1 . SER 71 71 11087 1 . GLY 72 72 11087 1 . GLN 73 73 11087 1 . LYS 74 74 11087 1 . PHE 75 75 11087 1 . CYS 76 76 11087 1 . ILE 77 77 11087 1 . LYS 78 78 11087 1 . LEU 79 79 11087 1 . LEU 80 80 11087 1 . VAL 81 81 11087 1 . PRO 82 82 11087 1 . SER 83 83 11087 1 . PRO 84 84 11087 1 . GLU 85 85 11087 1 . GLY 86 86 11087 1 . MET 87 87 11087 1 . SER 88 88 11087 1 . GLU 89 89 11087 1 . ILE 90 90 11087 1 . TYR 91 91 11087 1 . LEU 92 92 11087 1 . ARG 93 93 11087 1 . CYS 94 94 11087 1 . GLN 95 95 11087 1 . ASP 96 96 11087 1 . GLU 97 97 11087 1 . GLN 98 98 11087 1 . GLN 99 99 11087 1 . TYR 100 100 11087 1 . ALA 101 101 11087 1 . ARG 102 102 11087 1 . TRP 103 103 11087 1 . MET 104 104 11087 1 . ALA 105 105 11087 1 . GLY 106 106 11087 1 . CYS 107 107 11087 1 . ARG 108 108 11087 1 . LEU 109 109 11087 1 . ALA 110 110 11087 1 . SER 111 111 11087 1 . LYS 112 112 11087 1 . GLY 113 113 11087 1 . ARG 114 114 11087 1 . THR 115 115 11087 1 . MET 116 116 11087 1 . ALA 117 117 11087 1 . ASP 118 118 11087 1 . SER 119 119 11087 1 . SER 120 120 11087 1 . TYR 121 121 11087 1 . THR 122 122 11087 1 . SER 123 123 11087 1 . GLU 124 124 11087 1 . VAL 125 125 11087 1 . GLN 126 126 11087 1 . ALA 127 127 11087 1 . ILE 128 128 11087 1 . LEU 129 129 11087 1 . ALA 130 130 11087 1 . PHE 131 131 11087 1 . LEU 132 132 11087 1 . SER 133 133 11087 1 . LEU 134 134 11087 1 . GLN 135 135 11087 1 . ARG 136 136 11087 1 . THR 137 137 11087 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 11087 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11087 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 11087 _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' 'E. coli - cell free' 'E. coli' . 562 Escherichia coli . . . . . . . . . . . . . . . . P060904-05 . . . . . . 11087 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11087 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.18mM PH domain [U-15N,13C], 20mM d-Tris-HCl, 100mM NaCl, 1mM d-DTT, 0.02% NaN3, 90% H2O, 10% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O, 10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'PH domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.18 . . mM . . . . 11087 1 2 TRIS [U-2H] . . . . . buffer 20 . . mM . . . . 11087 1 3 'sodium chloride' 'natural abundance' . . . . . salt 100 . . mM . . . . 11087 1 4 DTT [U-2H] . . . . . salt 1 . . mM . . . . 11087 1 5 'sodium azide' 'natural abundance' . . . . . salt 0.02 . . % . . . . 11087 1 6 H2O . . . . . . solvent 90 . . % . . . . 11087 1 7 D2O . . . . . . solvent 10 . . % . . . . 11087 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 11087 _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' 120 0.1 mM 11087 1 pH 7.0 0.05 pH 11087 1 pressure 1 0.001 atm 11087 1 temperature 296 0.1 K 11087 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 11087 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 11087 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11087 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11087 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20031121 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 11087 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11087 2 stop_ save_ save_NMRVIEW _Software.Sf_category software _Software.Sf_framecode NMRVIEW _Software.Entry_ID 11087 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, B.A.' . . 11087 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11087 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11087 _Software.ID 4 _Software.Name Kujira _Software.Version 0.9820 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11087 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11087 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11087 _Software.ID 5 _Software.Name CYANA _Software.Version 2.0.17 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 11087 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 11087 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 11087 _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 11087 _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 . . . 11087 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 11087 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11087 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11087 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 11087 _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 . . . . . . . . . 11087 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11087 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11087 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 11087 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11087 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11087 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $XWINNMR . . 11087 1 2 $NMRPipe . . 11087 1 3 $NMRVIEW . . 11087 1 4 $Kujira . . 11087 1 5 $CYANA . . 11087 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 4.468 0.030 . 1 . . . . 6 SER HA . 11087 1 2 . 1 1 6 6 SER HB2 H 1 3.885 0.030 . 1 . . . . 6 SER HB2 . 11087 1 3 . 1 1 6 6 SER HB3 H 1 3.885 0.030 . 1 . . . . 6 SER HB3 . 11087 1 4 . 1 1 6 6 SER C C 13 174.891 0.300 . 1 . . . . 6 SER C . 11087 1 5 . 1 1 6 6 SER CA C 13 58.544 0.300 . 1 . . . . 6 SER CA . 11087 1 6 . 1 1 6 6 SER CB C 13 63.840 0.300 . 1 . . . . 6 SER CB . 11087 1 7 . 1 1 7 7 GLY H H 1 8.345 0.030 . 1 . . . . 7 GLY H . 11087 1 8 . 1 1 7 7 GLY HA2 H 1 3.922 0.030 . 1 . . . . 7 GLY HA2 . 11087 1 9 . 1 1 7 7 GLY HA3 H 1 3.922 0.030 . 1 . . . . 7 GLY HA3 . 11087 1 10 . 1 1 7 7 GLY C C 13 173.643 0.300 . 1 . . . . 7 GLY C . 11087 1 11 . 1 1 7 7 GLY CA C 13 45.138 0.300 . 1 . . . . 7 GLY CA . 11087 1 12 . 1 1 7 7 GLY N N 15 110.586 0.300 . 1 . . . . 7 GLY N . 11087 1 13 . 1 1 8 8 ILE H H 1 7.962 0.030 . 1 . . . . 8 ILE H . 11087 1 14 . 1 1 8 8 ILE HA H 1 4.389 0.030 . 1 . . . . 8 ILE HA . 11087 1 15 . 1 1 8 8 ILE HB H 1 1.766 0.030 . 1 . . . . 8 ILE HB . 11087 1 16 . 1 1 8 8 ILE HD11 H 1 0.821 0.030 . 1 . . . . 8 ILE HD1 . 11087 1 17 . 1 1 8 8 ILE HD12 H 1 0.821 0.030 . 1 . . . . 8 ILE HD1 . 11087 1 18 . 1 1 8 8 ILE HD13 H 1 0.821 0.030 . 1 . . . . 8 ILE HD1 . 11087 1 19 . 1 1 8 8 ILE HG12 H 1 1.442 0.030 . 2 . . . . 8 ILE HG12 . 11087 1 20 . 1 1 8 8 ILE HG13 H 1 1.073 0.030 . 2 . . . . 8 ILE HG13 . 11087 1 21 . 1 1 8 8 ILE HG21 H 1 0.884 0.030 . 1 . . . . 8 ILE HG2 . 11087 1 22 . 1 1 8 8 ILE HG22 H 1 0.884 0.030 . 1 . . . . 8 ILE HG2 . 11087 1 23 . 1 1 8 8 ILE HG23 H 1 0.884 0.030 . 1 . . . . 8 ILE HG2 . 11087 1 24 . 1 1 8 8 ILE C C 13 174.468 0.300 . 1 . . . . 8 ILE C . 11087 1 25 . 1 1 8 8 ILE CA C 13 58.579 0.300 . 1 . . . . 8 ILE CA . 11087 1 26 . 1 1 8 8 ILE CB C 13 38.795 0.300 . 1 . . . . 8 ILE CB . 11087 1 27 . 1 1 8 8 ILE CD1 C 13 13.158 0.300 . 1 . . . . 8 ILE CD1 . 11087 1 28 . 1 1 8 8 ILE CG1 C 13 26.880 0.300 . 1 . . . . 8 ILE CG1 . 11087 1 29 . 1 1 8 8 ILE CG2 C 13 17.304 0.300 . 1 . . . . 8 ILE CG2 . 11087 1 30 . 1 1 8 8 ILE N N 15 121.629 0.300 . 1 . . . . 8 ILE N . 11087 1 31 . 1 1 9 9 PRO HA H 1 4.348 0.030 . 1 . . . . 9 PRO HA . 11087 1 32 . 1 1 9 9 PRO HB2 H 1 1.635 0.030 . 2 . . . . 9 PRO HB2 . 11087 1 33 . 1 1 9 9 PRO HB3 H 1 2.086 0.030 . 2 . . . . 9 PRO HB3 . 11087 1 34 . 1 1 9 9 PRO HD2 H 1 3.517 0.030 . 2 . . . . 9 PRO HD2 . 11087 1 35 . 1 1 9 9 PRO HD3 H 1 3.829 0.030 . 2 . . . . 9 PRO HD3 . 11087 1 36 . 1 1 9 9 PRO HG2 H 1 1.792 0.030 . 2 . . . . 9 PRO HG2 . 11087 1 37 . 1 1 9 9 PRO HG3 H 1 1.685 0.030 . 2 . . . . 9 PRO HG3 . 11087 1 38 . 1 1 9 9 PRO C C 13 174.905 0.300 . 1 . . . . 9 PRO C . 11087 1 39 . 1 1 9 9 PRO CA C 13 63.153 0.300 . 1 . . . . 9 PRO CA . 11087 1 40 . 1 1 9 9 PRO CB C 13 31.769 0.300 . 1 . . . . 9 PRO CB . 11087 1 41 . 1 1 9 9 PRO CD C 13 50.765 0.300 . 1 . . . . 9 PRO CD . 11087 1 42 . 1 1 9 9 PRO CG C 13 27.328 0.300 . 1 . . . . 9 PRO CG . 11087 1 43 . 1 1 10 10 GLU H H 1 8.004 0.030 . 1 . . . . 10 GLU H . 11087 1 44 . 1 1 10 10 GLU HA H 1 4.777 0.030 . 1 . . . . 10 GLU HA . 11087 1 45 . 1 1 10 10 GLU HB2 H 1 1.857 0.030 . 2 . . . . 10 GLU HB2 . 11087 1 46 . 1 1 10 10 GLU HB3 H 1 1.740 0.030 . 2 . . . . 10 GLU HB3 . 11087 1 47 . 1 1 10 10 GLU HG2 H 1 2.006 0.030 . 1 . . . . 10 GLU HG2 . 11087 1 48 . 1 1 10 10 GLU HG3 H 1 2.006 0.030 . 1 . . . . 10 GLU HG3 . 11087 1 49 . 1 1 10 10 GLU C C 13 175.217 0.300 . 1 . . . . 10 GLU C . 11087 1 50 . 1 1 10 10 GLU CA C 13 54.497 0.300 . 1 . . . . 10 GLU CA . 11087 1 51 . 1 1 10 10 GLU CB C 13 33.496 0.300 . 1 . . . . 10 GLU CB . 11087 1 52 . 1 1 10 10 GLU CG C 13 35.642 0.300 . 1 . . . . 10 GLU CG . 11087 1 53 . 1 1 10 10 GLU N N 15 118.701 0.300 . 1 . . . . 10 GLU N . 11087 1 54 . 1 1 11 11 LEU H H 1 8.668 0.030 . 1 . . . . 11 LEU H . 11087 1 55 . 1 1 11 11 LEU HA H 1 4.487 0.030 . 1 . . . . 11 LEU HA . 11087 1 56 . 1 1 11 11 LEU HB2 H 1 0.629 0.030 . 2 . . . . 11 LEU HB2 . 11087 1 57 . 1 1 11 11 LEU HB3 H 1 0.678 0.030 . 2 . . . . 11 LEU HB3 . 11087 1 58 . 1 1 11 11 LEU HD11 H 1 -0.221 0.030 . 1 . . . . 11 LEU HD1 . 11087 1 59 . 1 1 11 11 LEU HD12 H 1 -0.221 0.030 . 1 . . . . 11 LEU HD1 . 11087 1 60 . 1 1 11 11 LEU HD13 H 1 -0.221 0.030 . 1 . . . . 11 LEU HD1 . 11087 1 61 . 1 1 11 11 LEU HD21 H 1 0.291 0.030 . 1 . . . . 11 LEU HD2 . 11087 1 62 . 1 1 11 11 LEU HD22 H 1 0.291 0.030 . 1 . . . . 11 LEU HD2 . 11087 1 63 . 1 1 11 11 LEU HD23 H 1 0.291 0.030 . 1 . . . . 11 LEU HD2 . 11087 1 64 . 1 1 11 11 LEU HG H 1 0.843 0.030 . 1 . . . . 11 LEU HG . 11087 1 65 . 1 1 11 11 LEU C C 13 174.623 0.300 . 1 . . . . 11 LEU C . 11087 1 66 . 1 1 11 11 LEU CA C 13 53.765 0.300 . 1 . . . . 11 LEU CA . 11087 1 67 . 1 1 11 11 LEU CB C 13 44.603 0.300 . 1 . . . . 11 LEU CB . 11087 1 68 . 1 1 11 11 LEU CD1 C 13 24.296 0.300 . 2 . . . . 11 LEU CD1 . 11087 1 69 . 1 1 11 11 LEU CD2 C 13 23.134 0.300 . 2 . . . . 11 LEU CD2 . 11087 1 70 . 1 1 11 11 LEU CG C 13 26.124 0.300 . 1 . . . . 11 LEU CG . 11087 1 71 . 1 1 11 11 LEU N N 15 124.486 0.300 . 1 . . . . 11 LEU N . 11087 1 72 . 1 1 12 12 LYS H H 1 8.123 0.030 . 1 . . . . 12 LYS H . 11087 1 73 . 1 1 12 12 LYS HA H 1 5.481 0.030 . 1 . . . . 12 LYS HA . 11087 1 74 . 1 1 12 12 LYS HB2 H 1 1.571 0.030 . 1 . . . . 12 LYS HB2 . 11087 1 75 . 1 1 12 12 LYS HB3 H 1 1.571 0.030 . 1 . . . . 12 LYS HB3 . 11087 1 76 . 1 1 12 12 LYS HD2 H 1 1.835 0.030 . 2 . . . . 12 LYS HD2 . 11087 1 77 . 1 1 12 12 LYS HD3 H 1 1.782 0.030 . 2 . . . . 12 LYS HD3 . 11087 1 78 . 1 1 12 12 LYS HE2 H 1 3.067 0.030 . 2 . . . . 12 LYS HE2 . 11087 1 79 . 1 1 12 12 LYS HE3 H 1 3.026 0.030 . 2 . . . . 12 LYS HE3 . 11087 1 80 . 1 1 12 12 LYS HG2 H 1 1.484 0.030 . 2 . . . . 12 LYS HG2 . 11087 1 81 . 1 1 12 12 LYS HG3 H 1 1.409 0.030 . 2 . . . . 12 LYS HG3 . 11087 1 82 . 1 1 12 12 LYS C C 13 174.746 0.300 . 1 . . . . 12 LYS C . 11087 1 83 . 1 1 12 12 LYS CA C 13 54.146 0.300 . 1 . . . . 12 LYS CA . 11087 1 84 . 1 1 12 12 LYS CB C 13 34.729 0.300 . 1 . . . . 12 LYS CB . 11087 1 85 . 1 1 12 12 LYS CD C 13 30.150 0.300 . 1 . . . . 12 LYS CD . 11087 1 86 . 1 1 12 12 LYS CE C 13 42.377 0.300 . 1 . . . . 12 LYS CE . 11087 1 87 . 1 1 12 12 LYS CG C 13 24.286 0.300 . 1 . . . . 12 LYS CG . 11087 1 88 . 1 1 12 12 LYS N N 15 119.874 0.300 . 1 . . . . 12 LYS N . 11087 1 89 . 1 1 13 13 ASP H H 1 8.476 0.030 . 1 . . . . 13 ASP H . 11087 1 90 . 1 1 13 13 ASP HA H 1 4.715 0.030 . 1 . . . . 13 ASP HA . 11087 1 91 . 1 1 13 13 ASP HB2 H 1 2.420 0.030 . 2 . . . . 13 ASP HB2 . 11087 1 92 . 1 1 13 13 ASP HB3 H 1 2.643 0.030 . 2 . . . . 13 ASP HB3 . 11087 1 93 . 1 1 13 13 ASP C C 13 175.038 0.300 . 1 . . . . 13 ASP C . 11087 1 94 . 1 1 13 13 ASP CA C 13 54.005 0.300 . 1 . . . . 13 ASP CA . 11087 1 95 . 1 1 13 13 ASP CB C 13 46.147 0.300 . 1 . . . . 13 ASP CB . 11087 1 96 . 1 1 13 13 ASP N N 15 122.103 0.300 . 1 . . . . 13 ASP N . 11087 1 97 . 1 1 14 14 HIS H H 1 9.238 0.030 . 1 . . . . 14 HIS H . 11087 1 98 . 1 1 14 14 HIS HA H 1 5.691 0.030 . 1 . . . . 14 HIS HA . 11087 1 99 . 1 1 14 14 HIS HB2 H 1 3.104 0.030 . 2 . . . . 14 HIS HB2 . 11087 1 100 . 1 1 14 14 HIS HB3 H 1 2.986 0.030 . 2 . . . . 14 HIS HB3 . 11087 1 101 . 1 1 14 14 HIS HD2 H 1 6.718 0.030 . 1 . . . . 14 HIS HD2 . 11087 1 102 . 1 1 14 14 HIS HE1 H 1 7.696 0.030 . 1 . . . . 14 HIS HE1 . 11087 1 103 . 1 1 14 14 HIS C C 13 175.550 0.300 . 1 . . . . 14 HIS C . 11087 1 104 . 1 1 14 14 HIS CA C 13 57.617 0.300 . 1 . . . . 14 HIS CA . 11087 1 105 . 1 1 14 14 HIS CB C 13 30.206 0.300 . 1 . . . . 14 HIS CB . 11087 1 106 . 1 1 14 14 HIS CD2 C 13 128.957 0.300 . 1 . . . . 14 HIS CD2 . 11087 1 107 . 1 1 14 14 HIS CE1 C 13 138.650 0.300 . 1 . . . . 14 HIS CE1 . 11087 1 108 . 1 1 14 14 HIS N N 15 117.984 0.300 . 1 . . . . 14 HIS N . 11087 1 109 . 1 1 15 15 LEU H H 1 8.296 0.030 . 1 . . . . 15 LEU H . 11087 1 110 . 1 1 15 15 LEU HA H 1 4.753 0.030 . 1 . . . . 15 LEU HA . 11087 1 111 . 1 1 15 15 LEU HB2 H 1 1.159 0.030 . 1 . . . . 15 LEU HB2 . 11087 1 112 . 1 1 15 15 LEU HB3 H 1 1.159 0.030 . 1 . . . . 15 LEU HB3 . 11087 1 113 . 1 1 15 15 LEU HD11 H 1 -0.704 0.030 . 1 . . . . 15 LEU HD1 . 11087 1 114 . 1 1 15 15 LEU HD12 H 1 -0.704 0.030 . 1 . . . . 15 LEU HD1 . 11087 1 115 . 1 1 15 15 LEU HD13 H 1 -0.704 0.030 . 1 . . . . 15 LEU HD1 . 11087 1 116 . 1 1 15 15 LEU HD21 H 1 0.260 0.030 . 1 . . . . 15 LEU HD2 . 11087 1 117 . 1 1 15 15 LEU HD22 H 1 0.260 0.030 . 1 . . . . 15 LEU HD2 . 11087 1 118 . 1 1 15 15 LEU HD23 H 1 0.260 0.030 . 1 . . . . 15 LEU HD2 . 11087 1 119 . 1 1 15 15 LEU HG H 1 0.811 0.030 . 1 . . . . 15 LEU HG . 11087 1 120 . 1 1 15 15 LEU C C 13 175.859 0.300 . 1 . . . . 15 LEU C . 11087 1 121 . 1 1 15 15 LEU CA C 13 53.301 0.300 . 1 . . . . 15 LEU CA . 11087 1 122 . 1 1 15 15 LEU CB C 13 45.861 0.300 . 1 . . . . 15 LEU CB . 11087 1 123 . 1 1 15 15 LEU CD1 C 13 24.640 0.300 . 2 . . . . 15 LEU CD1 . 11087 1 124 . 1 1 15 15 LEU CD2 C 13 23.979 0.300 . 2 . . . . 15 LEU CD2 . 11087 1 125 . 1 1 15 15 LEU CG C 13 27.038 0.300 . 1 . . . . 15 LEU CG . 11087 1 126 . 1 1 15 15 LEU N N 15 122.026 0.300 . 1 . . . . 15 LEU N . 11087 1 127 . 1 1 16 16 ARG H H 1 7.442 0.030 . 1 . . . . 16 ARG H . 11087 1 128 . 1 1 16 16 ARG HA H 1 5.013 0.030 . 1 . . . . 16 ARG HA . 11087 1 129 . 1 1 16 16 ARG HB2 H 1 1.683 0.030 . 1 . . . . 16 ARG HB2 . 11087 1 130 . 1 1 16 16 ARG HB3 H 1 1.683 0.030 . 1 . . . . 16 ARG HB3 . 11087 1 131 . 1 1 16 16 ARG HD2 H 1 3.120 0.030 . 2 . . . . 16 ARG HD2 . 11087 1 132 . 1 1 16 16 ARG HD3 H 1 2.987 0.030 . 2 . . . . 16 ARG HD3 . 11087 1 133 . 1 1 16 16 ARG HG2 H 1 1.833 0.030 . 2 . . . . 16 ARG HG2 . 11087 1 134 . 1 1 16 16 ARG HG3 H 1 1.450 0.030 . 2 . . . . 16 ARG HG3 . 11087 1 135 . 1 1 16 16 ARG C C 13 175.096 0.300 . 1 . . . . 16 ARG C . 11087 1 136 . 1 1 16 16 ARG CA C 13 55.271 0.300 . 1 . . . . 16 ARG CA . 11087 1 137 . 1 1 16 16 ARG CB C 13 32.591 0.300 . 1 . . . . 16 ARG CB . 11087 1 138 . 1 1 16 16 ARG CD C 13 43.693 0.300 . 1 . . . . 16 ARG CD . 11087 1 139 . 1 1 16 16 ARG CG C 13 28.197 0.300 . 1 . . . . 16 ARG CG . 11087 1 140 . 1 1 16 16 ARG N N 15 118.003 0.300 . 1 . . . . 16 ARG N . 11087 1 141 . 1 1 17 17 ILE H H 1 8.963 0.030 . 1 . . . . 17 ILE H . 11087 1 142 . 1 1 17 17 ILE HA H 1 5.426 0.030 . 1 . . . . 17 ILE HA . 11087 1 143 . 1 1 17 17 ILE HB H 1 1.470 0.030 . 1 . . . . 17 ILE HB . 11087 1 144 . 1 1 17 17 ILE HD11 H 1 -0.129 0.030 . 1 . . . . 17 ILE HD1 . 11087 1 145 . 1 1 17 17 ILE HD12 H 1 -0.129 0.030 . 1 . . . . 17 ILE HD1 . 11087 1 146 . 1 1 17 17 ILE HD13 H 1 -0.129 0.030 . 1 . . . . 17 ILE HD1 . 11087 1 147 . 1 1 17 17 ILE HG12 H 1 1.169 0.030 . 2 . . . . 17 ILE HG12 . 11087 1 148 . 1 1 17 17 ILE HG13 H 1 0.794 0.030 . 2 . . . . 17 ILE HG13 . 11087 1 149 . 1 1 17 17 ILE HG21 H 1 0.354 0.030 . 1 . . . . 17 ILE HG2 . 11087 1 150 . 1 1 17 17 ILE HG22 H 1 0.354 0.030 . 1 . . . . 17 ILE HG2 . 11087 1 151 . 1 1 17 17 ILE HG23 H 1 0.354 0.030 . 1 . . . . 17 ILE HG2 . 11087 1 152 . 1 1 17 17 ILE C C 13 175.513 0.300 . 1 . . . . 17 ILE C . 11087 1 153 . 1 1 17 17 ILE CA C 13 59.775 0.300 . 1 . . . . 17 ILE CA . 11087 1 154 . 1 1 17 17 ILE CB C 13 41.192 0.300 . 1 . . . . 17 ILE CB . 11087 1 155 . 1 1 17 17 ILE CD1 C 13 12.279 0.300 . 1 . . . . 17 ILE CD1 . 11087 1 156 . 1 1 17 17 ILE CG1 C 13 27.097 0.300 . 1 . . . . 17 ILE CG1 . 11087 1 157 . 1 1 17 17 ILE CG2 C 13 16.546 0.300 . 1 . . . . 17 ILE CG2 . 11087 1 158 . 1 1 17 17 ILE N N 15 122.074 0.300 . 1 . . . . 17 ILE N . 11087 1 159 . 1 1 18 18 PHE H H 1 8.947 0.030 . 1 . . . . 18 PHE H . 11087 1 160 . 1 1 18 18 PHE HA H 1 4.816 0.030 . 1 . . . . 18 PHE HA . 11087 1 161 . 1 1 18 18 PHE HB2 H 1 2.018 0.030 . 2 . . . . 18 PHE HB2 . 11087 1 162 . 1 1 18 18 PHE HB3 H 1 1.335 0.030 . 2 . . . . 18 PHE HB3 . 11087 1 163 . 1 1 18 18 PHE HD1 H 1 6.623 0.030 . 1 . . . . 18 PHE HD1 . 11087 1 164 . 1 1 18 18 PHE HD2 H 1 6.623 0.030 . 1 . . . . 18 PHE HD2 . 11087 1 165 . 1 1 18 18 PHE HE1 H 1 7.141 0.030 . 1 . . . . 18 PHE HE1 . 11087 1 166 . 1 1 18 18 PHE HE2 H 1 7.141 0.030 . 1 . . . . 18 PHE HE2 . 11087 1 167 . 1 1 18 18 PHE HZ H 1 7.205 0.030 . 1 . . . . 18 PHE HZ . 11087 1 168 . 1 1 18 18 PHE C C 13 172.956 0.300 . 1 . . . . 18 PHE C . 11087 1 169 . 1 1 18 18 PHE CA C 13 54.990 0.300 . 1 . . . . 18 PHE CA . 11087 1 170 . 1 1 18 18 PHE CB C 13 41.380 0.300 . 1 . . . . 18 PHE CB . 11087 1 171 . 1 1 18 18 PHE CD1 C 13 130.993 0.300 . 1 . . . . 18 PHE CD1 . 11087 1 172 . 1 1 18 18 PHE CD2 C 13 130.993 0.300 . 1 . . . . 18 PHE CD2 . 11087 1 173 . 1 1 18 18 PHE CE1 C 13 131.008 0.300 . 1 . . . . 18 PHE CE1 . 11087 1 174 . 1 1 18 18 PHE CE2 C 13 131.008 0.300 . 1 . . . . 18 PHE CE2 . 11087 1 175 . 1 1 18 18 PHE CZ C 13 129.967 0.300 . 1 . . . . 18 PHE CZ . 11087 1 176 . 1 1 18 18 PHE N N 15 129.905 0.300 . 1 . . . . 18 PHE N . 11087 1 177 . 1 1 19 19 ARG H H 1 7.861 0.030 . 1 . . . . 19 ARG H . 11087 1 178 . 1 1 19 19 ARG HA H 1 4.742 0.030 . 1 . . . . 19 ARG HA . 11087 1 179 . 1 1 19 19 ARG HB2 H 1 1.857 0.030 . 2 . . . . 19 ARG HB2 . 11087 1 180 . 1 1 19 19 ARG HB3 H 1 1.494 0.030 . 2 . . . . 19 ARG HB3 . 11087 1 181 . 1 1 19 19 ARG HD2 H 1 3.175 0.030 . 2 . . . . 19 ARG HD2 . 11087 1 182 . 1 1 19 19 ARG HD3 H 1 3.042 0.030 . 2 . . . . 19 ARG HD3 . 11087 1 183 . 1 1 19 19 ARG HG2 H 1 1.498 0.030 . 1 . . . . 19 ARG HG2 . 11087 1 184 . 1 1 19 19 ARG HG3 H 1 1.498 0.030 . 1 . . . . 19 ARG HG3 . 11087 1 185 . 1 1 19 19 ARG C C 13 172.965 0.300 . 1 . . . . 19 ARG C . 11087 1 186 . 1 1 19 19 ARG CA C 13 52.210 0.300 . 1 . . . . 19 ARG CA . 11087 1 187 . 1 1 19 19 ARG CB C 13 31.851 0.300 . 1 . . . . 19 ARG CB . 11087 1 188 . 1 1 19 19 ARG CD C 13 44.227 0.300 . 1 . . . . 19 ARG CD . 11087 1 189 . 1 1 19 19 ARG CG C 13 26.286 0.300 . 1 . . . . 19 ARG CG . 11087 1 190 . 1 1 19 19 ARG N N 15 127.609 0.300 . 1 . . . . 19 ARG N . 11087 1 191 . 1 1 20 20 PRO HA H 1 3.747 0.030 . 1 . . . . 20 PRO HA . 11087 1 192 . 1 1 20 20 PRO HB2 H 1 1.762 0.030 . 2 . . . . 20 PRO HB2 . 11087 1 193 . 1 1 20 20 PRO HB3 H 1 2.054 0.030 . 2 . . . . 20 PRO HB3 . 11087 1 194 . 1 1 20 20 PRO HD2 H 1 3.576 0.030 . 2 . . . . 20 PRO HD2 . 11087 1 195 . 1 1 20 20 PRO HD3 H 1 2.436 0.030 . 2 . . . . 20 PRO HD3 . 11087 1 196 . 1 1 20 20 PRO HG2 H 1 1.567 0.030 . 2 . . . . 20 PRO HG2 . 11087 1 197 . 1 1 20 20 PRO HG3 H 1 1.700 0.030 . 2 . . . . 20 PRO HG3 . 11087 1 198 . 1 1 20 20 PRO C C 13 177.057 0.300 . 1 . . . . 20 PRO C . 11087 1 199 . 1 1 20 20 PRO CA C 13 63.435 0.300 . 1 . . . . 20 PRO CA . 11087 1 200 . 1 1 20 20 PRO CB C 13 31.882 0.300 . 1 . . . . 20 PRO CB . 11087 1 201 . 1 1 20 20 PRO CD C 13 50.129 0.300 . 1 . . . . 20 PRO CD . 11087 1 202 . 1 1 20 20 PRO CG C 13 26.940 0.300 . 1 . . . . 20 PRO CG . 11087 1 203 . 1 1 21 21 ARG H H 1 8.582 0.030 . 1 . . . . 21 ARG H . 11087 1 204 . 1 1 21 21 ARG HA H 1 4.184 0.030 . 1 . . . . 21 ARG HA . 11087 1 205 . 1 1 21 21 ARG HB2 H 1 1.823 0.030 . 2 . . . . 21 ARG HB2 . 11087 1 206 . 1 1 21 21 ARG HB3 H 1 1.984 0.030 . 2 . . . . 21 ARG HB3 . 11087 1 207 . 1 1 21 21 ARG HD2 H 1 3.147 0.030 . 1 . . . . 21 ARG HD2 . 11087 1 208 . 1 1 21 21 ARG HD3 H 1 3.147 0.030 . 1 . . . . 21 ARG HD3 . 11087 1 209 . 1 1 21 21 ARG HG2 H 1 1.609 0.030 . 1 . . . . 21 ARG HG2 . 11087 1 210 . 1 1 21 21 ARG HG3 H 1 1.609 0.030 . 1 . . . . 21 ARG HG3 . 11087 1 211 . 1 1 21 21 ARG C C 13 176.212 0.300 . 1 . . . . 21 ARG C . 11087 1 212 . 1 1 21 21 ARG CA C 13 56.397 0.300 . 1 . . . . 21 ARG CA . 11087 1 213 . 1 1 21 21 ARG CB C 13 29.549 0.300 . 1 . . . . 21 ARG CB . 11087 1 214 . 1 1 21 21 ARG CD C 13 43.301 0.300 . 1 . . . . 21 ARG CD . 11087 1 215 . 1 1 21 21 ARG CG C 13 27.628 0.300 . 1 . . . . 21 ARG CG . 11087 1 216 . 1 1 21 21 ARG N N 15 115.690 0.300 . 1 . . . . 21 ARG N . 11087 1 217 . 1 1 22 22 LYS HA H 1 4.468 0.030 . 1 . . . . 22 LYS HA . 11087 1 218 . 1 1 22 22 LYS HB2 H 1 1.786 0.030 . 1 . . . . 22 LYS HB2 . 11087 1 219 . 1 1 22 22 LYS HB3 H 1 1.786 0.030 . 1 . . . . 22 LYS HB3 . 11087 1 220 . 1 1 22 22 LYS HD2 H 1 1.635 0.030 . 1 . . . . 22 LYS HD2 . 11087 1 221 . 1 1 22 22 LYS HD3 H 1 1.635 0.030 . 1 . . . . 22 LYS HD3 . 11087 1 222 . 1 1 22 22 LYS HE2 H 1 2.934 0.030 . 1 . . . . 22 LYS HE2 . 11087 1 223 . 1 1 22 22 LYS HE3 H 1 2.934 0.030 . 1 . . . . 22 LYS HE3 . 11087 1 224 . 1 1 22 22 LYS HG2 H 1 1.337 0.030 . 1 . . . . 22 LYS HG2 . 11087 1 225 . 1 1 22 22 LYS HG3 H 1 1.337 0.030 . 1 . . . . 22 LYS HG3 . 11087 1 226 . 1 1 22 22 LYS C C 13 176.420 0.300 . 1 . . . . 22 LYS C . 11087 1 227 . 1 1 22 22 LYS CA C 13 54.814 0.300 . 1 . . . . 22 LYS CA . 11087 1 228 . 1 1 22 22 LYS CB C 13 31.851 0.300 . 1 . . . . 22 LYS CB . 11087 1 229 . 1 1 22 22 LYS CD C 13 28.480 0.300 . 1 . . . . 22 LYS CD . 11087 1 230 . 1 1 22 22 LYS CE C 13 42.213 0.300 . 1 . . . . 22 LYS CE . 11087 1 231 . 1 1 22 22 LYS CG C 13 24.450 0.300 . 1 . . . . 22 LYS CG . 11087 1 232 . 1 1 23 23 LEU H H 1 8.232 0.030 . 1 . . . . 23 LEU H . 11087 1 233 . 1 1 23 23 LEU HA H 1 4.242 0.030 . 1 . . . . 23 LEU HA . 11087 1 234 . 1 1 23 23 LEU HB2 H 1 1.639 0.030 . 2 . . . . 23 LEU HB2 . 11087 1 235 . 1 1 23 23 LEU HB3 H 1 1.762 0.030 . 2 . . . . 23 LEU HB3 . 11087 1 236 . 1 1 23 23 LEU HD11 H 1 0.894 0.030 . 1 . . . . 23 LEU HD1 . 11087 1 237 . 1 1 23 23 LEU HD12 H 1 0.894 0.030 . 1 . . . . 23 LEU HD1 . 11087 1 238 . 1 1 23 23 LEU HD13 H 1 0.894 0.030 . 1 . . . . 23 LEU HD1 . 11087 1 239 . 1 1 23 23 LEU HD21 H 1 0.935 0.030 . 1 . . . . 23 LEU HD2 . 11087 1 240 . 1 1 23 23 LEU HD22 H 1 0.935 0.030 . 1 . . . . 23 LEU HD2 . 11087 1 241 . 1 1 23 23 LEU HD23 H 1 0.935 0.030 . 1 . . . . 23 LEU HD2 . 11087 1 242 . 1 1 23 23 LEU HG H 1 1.625 0.030 . 1 . . . . 23 LEU HG . 11087 1 243 . 1 1 23 23 LEU C C 13 177.908 0.300 . 1 . . . . 23 LEU C . 11087 1 244 . 1 1 23 23 LEU CA C 13 56.397 0.300 . 1 . . . . 23 LEU CA . 11087 1 245 . 1 1 23 23 LEU CB C 13 41.719 0.300 . 1 . . . . 23 LEU CB . 11087 1 246 . 1 1 23 23 LEU CD1 C 13 23.217 0.300 . 2 . . . . 23 LEU CD1 . 11087 1 247 . 1 1 23 23 LEU CD2 C 13 25.000 0.300 . 2 . . . . 23 LEU CD2 . 11087 1 248 . 1 1 23 23 LEU CG C 13 27.087 0.300 . 1 . . . . 23 LEU CG . 11087 1 249 . 1 1 23 23 LEU N N 15 122.169 0.300 . 1 . . . . 23 LEU N . 11087 1 250 . 1 1 24 24 THR H H 1 7.170 0.030 . 1 . . . . 24 THR H . 11087 1 251 . 1 1 24 24 THR HA H 1 4.244 0.030 . 1 . . . . 24 THR HA . 11087 1 252 . 1 1 24 24 THR HB H 1 4.338 0.030 . 1 . . . . 24 THR HB . 11087 1 253 . 1 1 24 24 THR HG21 H 1 1.242 0.030 . 1 . . . . 24 THR HG2 . 11087 1 254 . 1 1 24 24 THR HG22 H 1 1.242 0.030 . 1 . . . . 24 THR HG2 . 11087 1 255 . 1 1 24 24 THR HG23 H 1 1.242 0.030 . 1 . . . . 24 THR HG2 . 11087 1 256 . 1 1 24 24 THR C C 13 174.612 0.300 . 1 . . . . 24 THR C . 11087 1 257 . 1 1 24 24 THR CA C 13 62.555 0.300 . 1 . . . . 24 THR CA . 11087 1 258 . 1 1 24 24 THR CB C 13 69.344 0.300 . 1 . . . . 24 THR CB . 11087 1 259 . 1 1 24 24 THR CG2 C 13 22.148 0.300 . 1 . . . . 24 THR CG2 . 11087 1 260 . 1 1 25 25 LEU H H 1 7.910 0.030 . 1 . . . . 25 LEU H . 11087 1 261 . 1 1 25 25 LEU HA H 1 4.503 0.030 . 1 . . . . 25 LEU HA . 11087 1 262 . 1 1 25 25 LEU HB2 H 1 1.742 0.030 . 2 . . . . 25 LEU HB2 . 11087 1 263 . 1 1 25 25 LEU HB3 H 1 1.583 0.030 . 2 . . . . 25 LEU HB3 . 11087 1 264 . 1 1 25 25 LEU HD11 H 1 0.946 0.030 . 1 . . . . 25 LEU HD1 . 11087 1 265 . 1 1 25 25 LEU HD12 H 1 0.946 0.030 . 1 . . . . 25 LEU HD1 . 11087 1 266 . 1 1 25 25 LEU HD13 H 1 0.946 0.030 . 1 . . . . 25 LEU HD1 . 11087 1 267 . 1 1 25 25 LEU HD21 H 1 0.904 0.030 . 1 . . . . 25 LEU HD2 . 11087 1 268 . 1 1 25 25 LEU HD22 H 1 0.904 0.030 . 1 . . . . 25 LEU HD2 . 11087 1 269 . 1 1 25 25 LEU HD23 H 1 0.904 0.030 . 1 . . . . 25 LEU HD2 . 11087 1 270 . 1 1 25 25 LEU HG H 1 1.595 0.030 . 1 . . . . 25 LEU HG . 11087 1 271 . 1 1 25 25 LEU C C 13 176.552 0.300 . 1 . . . . 25 LEU C . 11087 1 272 . 1 1 25 25 LEU CA C 13 54.497 0.300 . 1 . . . . 25 LEU CA . 11087 1 273 . 1 1 25 25 LEU CB C 13 42.253 0.300 . 1 . . . . 25 LEU CB . 11087 1 274 . 1 1 25 25 LEU CD1 C 13 25.355 0.300 . 2 . . . . 25 LEU CD1 . 11087 1 275 . 1 1 25 25 LEU CD2 C 13 23.628 0.300 . 2 . . . . 25 LEU CD2 . 11087 1 276 . 1 1 25 25 LEU CG C 13 26.753 0.300 . 1 . . . . 25 LEU CG . 11087 1 277 . 1 1 25 25 LEU N N 15 123.094 0.300 . 1 . . . . 25 LEU N . 11087 1 278 . 1 1 26 26 LYS H H 1 8.239 0.030 . 1 . . . . 26 LYS H . 11087 1 279 . 1 1 26 26 LYS HA H 1 4.393 0.030 . 1 . . . . 26 LYS HA . 11087 1 280 . 1 1 26 26 LYS HB2 H 1 1.802 0.030 . 1 . . . . 26 LYS HB2 . 11087 1 281 . 1 1 26 26 LYS HB3 H 1 1.802 0.030 . 1 . . . . 26 LYS HB3 . 11087 1 282 . 1 1 26 26 LYS HD2 H 1 1.675 0.030 . 1 . . . . 26 LYS HD2 . 11087 1 283 . 1 1 26 26 LYS HD3 H 1 1.675 0.030 . 1 . . . . 26 LYS HD3 . 11087 1 284 . 1 1 26 26 LYS HE2 H 1 2.993 0.030 . 1 . . . . 26 LYS HE2 . 11087 1 285 . 1 1 26 26 LYS HE3 H 1 2.993 0.030 . 1 . . . . 26 LYS HE3 . 11087 1 286 . 1 1 26 26 LYS HG2 H 1 1.395 0.030 . 1 . . . . 26 LYS HG2 . 11087 1 287 . 1 1 26 26 LYS HG3 H 1 1.395 0.030 . 1 . . . . 26 LYS HG3 . 11087 1 288 . 1 1 26 26 LYS C C 13 177.118 0.300 . 1 . . . . 26 LYS C . 11087 1 289 . 1 1 26 26 LYS CA C 13 56.221 0.300 . 1 . . . . 26 LYS CA . 11087 1 290 . 1 1 26 26 LYS CB C 13 33.249 0.300 . 1 . . . . 26 LYS CB . 11087 1 291 . 1 1 26 26 LYS CD C 13 28.973 0.300 . 1 . . . . 26 LYS CD . 11087 1 292 . 1 1 26 26 LYS CE C 13 42.295 0.300 . 1 . . . . 26 LYS CE . 11087 1 293 . 1 1 26 26 LYS CG C 13 24.957 0.300 . 1 . . . . 26 LYS CG . 11087 1 294 . 1 1 26 26 LYS N N 15 121.059 0.300 . 1 . . . . 26 LYS N . 11087 1 295 . 1 1 27 27 GLY H H 1 7.973 0.030 . 1 . . . . 27 GLY H . 11087 1 296 . 1 1 27 27 GLY HA2 H 1 3.660 0.030 . 2 . . . . 27 GLY HA2 . 11087 1 297 . 1 1 27 27 GLY HA3 H 1 3.998 0.030 . 2 . . . . 27 GLY HA3 . 11087 1 298 . 1 1 27 27 GLY C C 13 173.123 0.300 . 1 . . . . 27 GLY C . 11087 1 299 . 1 1 27 27 GLY CA C 13 44.962 0.300 . 1 . . . . 27 GLY CA . 11087 1 300 . 1 1 27 27 GLY N N 15 108.340 0.300 . 1 . . . . 27 GLY N . 11087 1 301 . 1 1 28 28 TYR H H 1 8.521 0.030 . 1 . . . . 28 TYR H . 11087 1 302 . 1 1 28 28 TYR HA H 1 4.420 0.030 . 1 . . . . 28 TYR HA . 11087 1 303 . 1 1 28 28 TYR HB2 H 1 2.925 0.030 . 2 . . . . 28 TYR HB2 . 11087 1 304 . 1 1 28 28 TYR HB3 H 1 2.518 0.030 . 2 . . . . 28 TYR HB3 . 11087 1 305 . 1 1 28 28 TYR HD1 H 1 6.801 0.030 . 1 . . . . 28 TYR HD1 . 11087 1 306 . 1 1 28 28 TYR HD2 H 1 6.801 0.030 . 1 . . . . 28 TYR HD2 . 11087 1 307 . 1 1 28 28 TYR HE1 H 1 6.492 0.030 . 1 . . . . 28 TYR HE1 . 11087 1 308 . 1 1 28 28 TYR HE2 H 1 6.492 0.030 . 1 . . . . 28 TYR HE2 . 11087 1 309 . 1 1 28 28 TYR C C 13 176.927 0.300 . 1 . . . . 28 TYR C . 11087 1 310 . 1 1 28 28 TYR CA C 13 59.212 0.300 . 1 . . . . 28 TYR CA . 11087 1 311 . 1 1 28 28 TYR CB C 13 39.420 0.300 . 1 . . . . 28 TYR CB . 11087 1 312 . 1 1 28 28 TYR CD1 C 13 133.159 0.300 . 1 . . . . 28 TYR CD1 . 11087 1 313 . 1 1 28 28 TYR CD2 C 13 133.159 0.300 . 1 . . . . 28 TYR CD2 . 11087 1 314 . 1 1 28 28 TYR CE1 C 13 119.005 0.300 . 1 . . . . 28 TYR CE1 . 11087 1 315 . 1 1 28 28 TYR CE2 C 13 119.005 0.300 . 1 . . . . 28 TYR CE2 . 11087 1 316 . 1 1 28 28 TYR N N 15 118.839 0.300 . 1 . . . . 28 TYR N . 11087 1 317 . 1 1 29 29 ARG H H 1 8.559 0.030 . 1 . . . . 29 ARG H . 11087 1 318 . 1 1 29 29 ARG HB2 H 1 1.857 0.030 . 1 . . . . 29 ARG HB2 . 11087 1 319 . 1 1 29 29 ARG HB3 H 1 1.857 0.030 . 1 . . . . 29 ARG HB3 . 11087 1 320 . 1 1 29 29 ARG HD2 H 1 3.297 0.030 . 2 . . . . 29 ARG HD2 . 11087 1 321 . 1 1 29 29 ARG HG2 H 1 1.724 0.030 . 2 . . . . 29 ARG HG2 . 11087 1 322 . 1 1 29 29 ARG HG3 H 1 1.627 0.030 . 2 . . . . 29 ARG HG3 . 11087 1 323 . 1 1 29 29 ARG C C 13 176.382 0.300 . 1 . . . . 29 ARG C . 11087 1 324 . 1 1 29 29 ARG CA C 13 54.603 0.300 . 1 . . . . 29 ARG CA . 11087 1 325 . 1 1 29 29 ARG CB C 13 33.543 0.300 . 1 . . . . 29 ARG CB . 11087 1 326 . 1 1 29 29 ARG CG C 13 27.007 0.300 . 1 . . . . 29 ARG CG . 11087 1 327 . 1 1 29 29 ARG N N 15 121.936 0.300 . 1 . . . . 29 ARG N . 11087 1 328 . 1 1 30 30 GLN H H 1 8.970 0.030 . 1 . . . . 30 GLN H . 11087 1 329 . 1 1 30 30 GLN HA H 1 4.649 0.030 . 1 . . . . 30 GLN HA . 11087 1 330 . 1 1 30 30 GLN HB2 H 1 1.974 0.030 . 2 . . . . 30 GLN HB2 . 11087 1 331 . 1 1 30 30 GLN HB3 H 1 2.098 0.030 . 2 . . . . 30 GLN HB3 . 11087 1 332 . 1 1 30 30 GLN HE21 H 1 7.354 0.030 . 2 . . . . 30 GLN HE21 . 11087 1 333 . 1 1 30 30 GLN HE22 H 1 6.761 0.030 . 2 . . . . 30 GLN HE22 . 11087 1 334 . 1 1 30 30 GLN HG2 H 1 2.215 0.030 . 2 . . . . 30 GLN HG2 . 11087 1 335 . 1 1 30 30 GLN HG3 H 1 2.353 0.030 . 2 . . . . 30 GLN HG3 . 11087 1 336 . 1 1 30 30 GLN C C 13 174.398 0.300 . 1 . . . . 30 GLN C . 11087 1 337 . 1 1 30 30 GLN CA C 13 57.559 0.300 . 1 . . . . 30 GLN CA . 11087 1 338 . 1 1 30 30 GLN CB C 13 29.857 0.300 . 1 . . . . 30 GLN CB . 11087 1 339 . 1 1 30 30 GLN CG C 13 34.767 0.300 . 1 . . . . 30 GLN CG . 11087 1 340 . 1 1 30 30 GLN NE2 N 15 111.834 0.300 . 1 . . . . 30 GLN NE2 . 11087 1 341 . 1 1 31 31 HIS H H 1 9.203 0.030 . 1 . . . . 31 HIS H . 11087 1 342 . 1 1 31 31 HIS HA H 1 5.050 0.030 . 1 . . . . 31 HIS HA . 11087 1 343 . 1 1 31 31 HIS HB2 H 1 2.515 0.030 . 2 . . . . 31 HIS HB2 . 11087 1 344 . 1 1 31 31 HIS HB3 H 1 3.743 0.030 . 2 . . . . 31 HIS HB3 . 11087 1 345 . 1 1 31 31 HIS HD2 H 1 6.386 0.030 . 1 . . . . 31 HIS HD2 . 11087 1 346 . 1 1 31 31 HIS HE1 H 1 7.696 0.030 . 1 . . . . 31 HIS HE1 . 11087 1 347 . 1 1 31 31 HIS C C 13 173.218 0.300 . 1 . . . . 31 HIS C . 11087 1 348 . 1 1 31 31 HIS CA C 13 56.257 0.300 . 1 . . . . 31 HIS CA . 11087 1 349 . 1 1 31 31 HIS CB C 13 34.047 0.300 . 1 . . . . 31 HIS CB . 11087 1 350 . 1 1 31 31 HIS CE1 C 13 138.650 0.300 . 1 . . . . 31 HIS CE1 . 11087 1 351 . 1 1 31 31 HIS N N 15 124.463 0.300 . 1 . . . . 31 HIS N . 11087 1 352 . 1 1 32 32 TRP H H 1 8.200 0.030 . 1 . . . . 32 TRP H . 11087 1 353 . 1 1 32 32 TRP HA H 1 5.091 0.030 . 1 . . . . 32 TRP HA . 11087 1 354 . 1 1 32 32 TRP HB2 H 1 2.959 0.030 . 2 . . . . 32 TRP HB2 . 11087 1 355 . 1 1 32 32 TRP HB3 H 1 2.862 0.030 . 2 . . . . 32 TRP HB3 . 11087 1 356 . 1 1 32 32 TRP HD1 H 1 6.386 0.030 . 1 . . . . 32 TRP HD1 . 11087 1 357 . 1 1 32 32 TRP HE1 H 1 10.100 0.030 . 1 . . . . 32 TRP HE1 . 11087 1 358 . 1 1 32 32 TRP HE3 H 1 5.901 0.030 . 1 . . . . 32 TRP HE3 . 11087 1 359 . 1 1 32 32 TRP HH2 H 1 7.034 0.030 . 1 . . . . 32 TRP HH2 . 11087 1 360 . 1 1 32 32 TRP HZ2 H 1 7.215 0.030 . 1 . . . . 32 TRP HZ2 . 11087 1 361 . 1 1 32 32 TRP HZ3 H 1 6.737 0.030 . 1 . . . . 32 TRP HZ3 . 11087 1 362 . 1 1 32 32 TRP C C 13 174.268 0.300 . 1 . . . . 32 TRP C . 11087 1 363 . 1 1 32 32 TRP CA C 13 56.257 0.300 . 1 . . . . 32 TRP CA . 11087 1 364 . 1 1 32 32 TRP CB C 13 31.620 0.300 . 1 . . . . 32 TRP CB . 11087 1 365 . 1 1 32 32 TRP CD1 C 13 125.542 0.300 . 1 . . . . 32 TRP CD1 . 11087 1 366 . 1 1 32 32 TRP CE3 C 13 120.668 0.300 . 1 . . . . 32 TRP CE3 . 11087 1 367 . 1 1 32 32 TRP CH2 C 13 124.497 0.300 . 1 . . . . 32 TRP CH2 . 11087 1 368 . 1 1 32 32 TRP CZ2 C 13 114.356 0.300 . 1 . . . . 32 TRP CZ2 . 11087 1 369 . 1 1 32 32 TRP CZ3 C 13 121.292 0.300 . 1 . . . . 32 TRP CZ3 . 11087 1 370 . 1 1 32 32 TRP N N 15 121.863 0.300 . 1 . . . . 32 TRP N . 11087 1 371 . 1 1 32 32 TRP NE1 N 15 128.169 0.300 . 1 . . . . 32 TRP NE1 . 11087 1 372 . 1 1 33 33 VAL H H 1 8.611 0.030 . 1 . . . . 33 VAL H . 11087 1 373 . 1 1 33 33 VAL HA H 1 4.827 0.030 . 1 . . . . 33 VAL HA . 11087 1 374 . 1 1 33 33 VAL HB H 1 1.792 0.030 . 1 . . . . 33 VAL HB . 11087 1 375 . 1 1 33 33 VAL HG11 H 1 0.942 0.030 . 1 . . . . 33 VAL HG1 . 11087 1 376 . 1 1 33 33 VAL HG12 H 1 0.942 0.030 . 1 . . . . 33 VAL HG1 . 11087 1 377 . 1 1 33 33 VAL HG13 H 1 0.942 0.030 . 1 . . . . 33 VAL HG1 . 11087 1 378 . 1 1 33 33 VAL HG21 H 1 0.758 0.030 . 1 . . . . 33 VAL HG2 . 11087 1 379 . 1 1 33 33 VAL HG22 H 1 0.758 0.030 . 1 . . . . 33 VAL HG2 . 11087 1 380 . 1 1 33 33 VAL HG23 H 1 0.758 0.030 . 1 . . . . 33 VAL HG2 . 11087 1 381 . 1 1 33 33 VAL C C 13 173.085 0.300 . 1 . . . . 33 VAL C . 11087 1 382 . 1 1 33 33 VAL CA C 13 61.464 0.300 . 1 . . . . 33 VAL CA . 11087 1 383 . 1 1 33 33 VAL CB C 13 32.920 0.300 . 1 . . . . 33 VAL CB . 11087 1 384 . 1 1 33 33 VAL CG1 C 13 23.820 0.300 . 2 . . . . 33 VAL CG1 . 11087 1 385 . 1 1 33 33 VAL CG2 C 13 22.922 0.300 . 2 . . . . 33 VAL CG2 . 11087 1 386 . 1 1 33 33 VAL N N 15 130.175 0.300 . 1 . . . . 33 VAL N . 11087 1 387 . 1 1 34 34 VAL H H 1 9.050 0.030 . 1 . . . . 34 VAL H . 11087 1 388 . 1 1 34 34 VAL HA H 1 4.830 0.030 . 1 . . . . 34 VAL HA . 11087 1 389 . 1 1 34 34 VAL HB H 1 2.104 0.030 . 1 . . . . 34 VAL HB . 11087 1 390 . 1 1 34 34 VAL HG11 H 1 0.934 0.030 . 1 . . . . 34 VAL HG1 . 11087 1 391 . 1 1 34 34 VAL HG12 H 1 0.934 0.030 . 1 . . . . 34 VAL HG1 . 11087 1 392 . 1 1 34 34 VAL HG13 H 1 0.934 0.030 . 1 . . . . 34 VAL HG1 . 11087 1 393 . 1 1 34 34 VAL HG21 H 1 0.780 0.030 . 1 . . . . 34 VAL HG2 . 11087 1 394 . 1 1 34 34 VAL HG22 H 1 0.780 0.030 . 1 . . . . 34 VAL HG2 . 11087 1 395 . 1 1 34 34 VAL HG23 H 1 0.780 0.030 . 1 . . . . 34 VAL HG2 . 11087 1 396 . 1 1 34 34 VAL C C 13 174.573 0.300 . 1 . . . . 34 VAL C . 11087 1 397 . 1 1 34 34 VAL CA C 13 61.147 0.300 . 1 . . . . 34 VAL CA . 11087 1 398 . 1 1 34 34 VAL CB C 13 35.469 0.300 . 1 . . . . 34 VAL CB . 11087 1 399 . 1 1 34 34 VAL CG1 C 13 21.204 0.300 . 2 . . . . 34 VAL CG1 . 11087 1 400 . 1 1 34 34 VAL CG2 C 13 20.996 0.300 . 2 . . . . 34 VAL CG2 . 11087 1 401 . 1 1 34 34 VAL N N 15 123.769 0.300 . 1 . . . . 34 VAL N . 11087 1 402 . 1 1 35 35 PHE H H 1 9.598 0.030 . 1 . . . . 35 PHE H . 11087 1 403 . 1 1 35 35 PHE HA H 1 5.603 0.030 . 1 . . . . 35 PHE HA . 11087 1 404 . 1 1 35 35 PHE HB2 H 1 2.929 0.030 . 2 . . . . 35 PHE HB2 . 11087 1 405 . 1 1 35 35 PHE HB3 H 1 2.655 0.030 . 2 . . . . 35 PHE HB3 . 11087 1 406 . 1 1 35 35 PHE HD1 H 1 6.739 0.030 . 1 . . . . 35 PHE HD1 . 11087 1 407 . 1 1 35 35 PHE HD2 H 1 6.739 0.030 . 1 . . . . 35 PHE HD2 . 11087 1 408 . 1 1 35 35 PHE HE1 H 1 6.917 0.030 . 1 . . . . 35 PHE HE1 . 11087 1 409 . 1 1 35 35 PHE HE2 H 1 6.917 0.030 . 1 . . . . 35 PHE HE2 . 11087 1 410 . 1 1 35 35 PHE HZ H 1 6.990 0.030 . 1 . . . . 35 PHE HZ . 11087 1 411 . 1 1 35 35 PHE C C 13 173.078 0.300 . 1 . . . . 35 PHE C . 11087 1 412 . 1 1 35 35 PHE CA C 13 54.814 0.300 . 1 . . . . 35 PHE CA . 11087 1 413 . 1 1 35 35 PHE CB C 13 42.541 0.300 . 1 . . . . 35 PHE CB . 11087 1 414 . 1 1 35 35 PHE CD1 C 13 130.060 0.300 . 1 . . . . 35 PHE CD1 . 11087 1 415 . 1 1 35 35 PHE CD2 C 13 130.060 0.300 . 1 . . . . 35 PHE CD2 . 11087 1 416 . 1 1 35 35 PHE CE1 C 13 130.005 0.300 . 1 . . . . 35 PHE CE1 . 11087 1 417 . 1 1 35 35 PHE CE2 C 13 130.005 0.300 . 1 . . . . 35 PHE CE2 . 11087 1 418 . 1 1 35 35 PHE CZ C 13 129.549 0.300 . 1 . . . . 35 PHE CZ . 11087 1 419 . 1 1 35 35 PHE N N 15 131.642 0.300 . 1 . . . . 35 PHE N . 11087 1 420 . 1 1 36 36 LYS H H 1 8.120 0.030 . 1 . . . . 36 LYS H . 11087 1 421 . 1 1 36 36 LYS HA H 1 4.162 0.030 . 1 . . . . 36 LYS HA . 11087 1 422 . 1 1 36 36 LYS HB2 H 1 1.599 0.030 . 2 . . . . 36 LYS HB2 . 11087 1 423 . 1 1 36 36 LYS HB3 H 1 1.776 0.030 . 2 . . . . 36 LYS HB3 . 11087 1 424 . 1 1 36 36 LYS HD2 H 1 1.603 0.030 . 1 . . . . 36 LYS HD2 . 11087 1 425 . 1 1 36 36 LYS HD3 H 1 1.603 0.030 . 1 . . . . 36 LYS HD3 . 11087 1 426 . 1 1 36 36 LYS HE2 H 1 2.860 0.030 . 1 . . . . 36 LYS HE2 . 11087 1 427 . 1 1 36 36 LYS HE3 H 1 2.860 0.030 . 1 . . . . 36 LYS HE3 . 11087 1 428 . 1 1 36 36 LYS HG2 H 1 1.288 0.030 . 1 . . . . 36 LYS HG2 . 11087 1 429 . 1 1 36 36 LYS HG3 H 1 1.288 0.030 . 1 . . . . 36 LYS HG3 . 11087 1 430 . 1 1 36 36 LYS C C 13 174.662 0.300 . 1 . . . . 36 LYS C . 11087 1 431 . 1 1 36 36 LYS CA C 13 55.377 0.300 . 1 . . . . 36 LYS CA . 11087 1 432 . 1 1 36 36 LYS CB C 13 35.657 0.300 . 1 . . . . 36 LYS CB . 11087 1 433 . 1 1 36 36 LYS CD C 13 29.669 0.300 . 1 . . . . 36 LYS CD . 11087 1 434 . 1 1 36 36 LYS CE C 13 42.087 0.300 . 1 . . . . 36 LYS CE . 11087 1 435 . 1 1 36 36 LYS CG C 13 24.211 0.300 . 1 . . . . 36 LYS CG . 11087 1 436 . 1 1 36 36 LYS N N 15 124.843 0.300 . 1 . . . . 36 LYS N . 11087 1 437 . 1 1 37 37 GLU H H 1 9.273 0.030 . 1 . . . . 37 GLU H . 11087 1 438 . 1 1 37 37 GLU HA H 1 3.518 0.030 . 1 . . . . 37 GLU HA . 11087 1 439 . 1 1 37 37 GLU HB2 H 1 2.175 0.030 . 2 . . . . 37 GLU HB2 . 11087 1 440 . 1 1 37 37 GLU HB3 H 1 2.394 0.030 . 2 . . . . 37 GLU HB3 . 11087 1 441 . 1 1 37 37 GLU HG2 H 1 2.229 0.030 . 2 . . . . 37 GLU HG2 . 11087 1 442 . 1 1 37 37 GLU HG3 H 1 2.197 0.030 . 2 . . . . 37 GLU HG3 . 11087 1 443 . 1 1 37 37 GLU C C 13 174.662 0.300 . 1 . . . . 37 GLU C . 11087 1 444 . 1 1 37 37 GLU CA C 13 59.229 0.300 . 1 . . . . 37 GLU CA . 11087 1 445 . 1 1 37 37 GLU CB C 13 26.831 0.300 . 1 . . . . 37 GLU CB . 11087 1 446 . 1 1 37 37 GLU CG C 13 37.196 0.300 . 1 . . . . 37 GLU CG . 11087 1 447 . 1 1 37 37 GLU N N 15 122.475 0.300 . 1 . . . . 37 GLU N . 11087 1 448 . 1 1 38 38 THR H H 1 8.380 0.030 . 1 . . . . 38 THR H . 11087 1 449 . 1 1 38 38 THR HA H 1 4.829 0.030 . 1 . . . . 38 THR HA . 11087 1 450 . 1 1 38 38 THR HB H 1 4.829 0.030 . 1 . . . . 38 THR HB . 11087 1 451 . 1 1 38 38 THR HG21 H 1 1.018 0.030 . 1 . . . . 38 THR HG2 . 11087 1 452 . 1 1 38 38 THR HG22 H 1 1.018 0.030 . 1 . . . . 38 THR HG2 . 11087 1 453 . 1 1 38 38 THR HG23 H 1 1.018 0.030 . 1 . . . . 38 THR HG2 . 11087 1 454 . 1 1 38 38 THR C C 13 172.904 0.300 . 1 . . . . 38 THR C . 11087 1 455 . 1 1 38 38 THR CA C 13 60.690 0.300 . 1 . . . . 38 THR CA . 11087 1 456 . 1 1 38 38 THR CB C 13 68.692 0.300 . 1 . . . . 38 THR CB . 11087 1 457 . 1 1 38 38 THR CG2 C 13 20.996 0.300 . 1 . . . . 38 THR CG2 . 11087 1 458 . 1 1 38 38 THR N N 15 111.575 0.300 . 1 . . . . 38 THR N . 11087 1 459 . 1 1 39 39 THR H H 1 8.582 0.030 . 1 . . . . 39 THR H . 11087 1 460 . 1 1 39 39 THR HA H 1 5.178 0.030 . 1 . . . . 39 THR HA . 11087 1 461 . 1 1 39 39 THR HB H 1 4.029 0.030 . 1 . . . . 39 THR HB . 11087 1 462 . 1 1 39 39 THR HG21 H 1 0.989 0.030 . 1 . . . . 39 THR HG2 . 11087 1 463 . 1 1 39 39 THR HG22 H 1 0.989 0.030 . 1 . . . . 39 THR HG2 . 11087 1 464 . 1 1 39 39 THR HG23 H 1 0.989 0.030 . 1 . . . . 39 THR HG2 . 11087 1 465 . 1 1 39 39 THR C C 13 172.088 0.300 . 1 . . . . 39 THR C . 11087 1 466 . 1 1 39 39 THR CA C 13 62.555 0.300 . 1 . . . . 39 THR CA . 11087 1 467 . 1 1 39 39 THR CB C 13 71.116 0.300 . 1 . . . . 39 THR CB . 11087 1 468 . 1 1 39 39 THR CG2 C 13 21.325 0.300 . 1 . . . . 39 THR CG2 . 11087 1 469 . 1 1 39 39 THR N N 15 119.426 0.300 . 1 . . . . 39 THR N . 11087 1 470 . 1 1 40 40 LEU H H 1 9.168 0.030 . 1 . . . . 40 LEU H . 11087 1 471 . 1 1 40 40 LEU HA H 1 5.098 0.030 . 1 . . . . 40 LEU HA . 11087 1 472 . 1 1 40 40 LEU HB2 H 1 1.395 0.030 . 2 . . . . 40 LEU HB2 . 11087 1 473 . 1 1 40 40 LEU HB3 H 1 1.748 0.030 . 2 . . . . 40 LEU HB3 . 11087 1 474 . 1 1 40 40 LEU HD11 H 1 0.823 0.030 . 1 . . . . 40 LEU HD1 . 11087 1 475 . 1 1 40 40 LEU HD12 H 1 0.823 0.030 . 1 . . . . 40 LEU HD1 . 11087 1 476 . 1 1 40 40 LEU HD13 H 1 0.823 0.030 . 1 . . . . 40 LEU HD1 . 11087 1 477 . 1 1 40 40 LEU HD21 H 1 0.724 0.030 . 1 . . . . 40 LEU HD2 . 11087 1 478 . 1 1 40 40 LEU HD22 H 1 0.724 0.030 . 1 . . . . 40 LEU HD2 . 11087 1 479 . 1 1 40 40 LEU HD23 H 1 0.724 0.030 . 1 . . . . 40 LEU HD2 . 11087 1 480 . 1 1 40 40 LEU HG H 1 1.550 0.030 . 1 . . . . 40 LEU HG . 11087 1 481 . 1 1 40 40 LEU C C 13 174.689 0.300 . 1 . . . . 40 LEU C . 11087 1 482 . 1 1 40 40 LEU CA C 13 54.357 0.300 . 1 . . . . 40 LEU CA . 11087 1 483 . 1 1 40 40 LEU CB C 13 46.078 0.300 . 1 . . . . 40 LEU CB . 11087 1 484 . 1 1 40 40 LEU CD1 C 13 27.048 0.300 . 2 . . . . 40 LEU CD1 . 11087 1 485 . 1 1 40 40 LEU CD2 C 13 25.518 0.300 . 2 . . . . 40 LEU CD2 . 11087 1 486 . 1 1 40 40 LEU CG C 13 28.315 0.300 . 1 . . . . 40 LEU CG . 11087 1 487 . 1 1 40 40 LEU N N 15 131.727 0.300 . 1 . . . . 40 LEU N . 11087 1 488 . 1 1 41 41 SER H H 1 9.399 0.030 . 1 . . . . 41 SER H . 11087 1 489 . 1 1 41 41 SER HA H 1 5.516 0.030 . 1 . . . . 41 SER HA . 11087 1 490 . 1 1 41 41 SER HB2 H 1 3.817 0.030 . 2 . . . . 41 SER HB2 . 11087 1 491 . 1 1 41 41 SER HB3 H 1 3.525 0.030 . 2 . . . . 41 SER HB3 . 11087 1 492 . 1 1 41 41 SER C C 13 171.828 0.300 . 1 . . . . 41 SER C . 11087 1 493 . 1 1 41 41 SER CA C 13 56.960 0.300 . 1 . . . . 41 SER CA . 11087 1 494 . 1 1 41 41 SER CB C 13 65.957 0.300 . 1 . . . . 41 SER CB . 11087 1 495 . 1 1 41 41 SER N N 15 122.537 0.300 . 1 . . . . 41 SER N . 11087 1 496 . 1 1 42 42 TYR H H 1 7.446 0.030 . 1 . . . . 42 TYR H . 11087 1 497 . 1 1 42 42 TYR HA H 1 5.968 0.030 . 1 . . . . 42 TYR HA . 11087 1 498 . 1 1 42 42 TYR HB2 H 1 2.803 0.030 . 1 . . . . 42 TYR HB2 . 11087 1 499 . 1 1 42 42 TYR HB3 H 1 2.803 0.030 . 1 . . . . 42 TYR HB3 . 11087 1 500 . 1 1 42 42 TYR HD1 H 1 6.375 0.030 . 1 . . . . 42 TYR HD1 . 11087 1 501 . 1 1 42 42 TYR HD2 H 1 6.375 0.030 . 1 . . . . 42 TYR HD2 . 11087 1 502 . 1 1 42 42 TYR HE1 H 1 6.248 0.030 . 1 . . . . 42 TYR HE1 . 11087 1 503 . 1 1 42 42 TYR HE2 H 1 6.248 0.030 . 1 . . . . 42 TYR HE2 . 11087 1 504 . 1 1 42 42 TYR C C 13 172.922 0.300 . 1 . . . . 42 TYR C . 11087 1 505 . 1 1 42 42 TYR CA C 13 55.236 0.300 . 1 . . . . 42 TYR CA . 11087 1 506 . 1 1 42 42 TYR CB C 13 42.541 0.300 . 1 . . . . 42 TYR CB . 11087 1 507 . 1 1 42 42 TYR CD1 C 13 133.076 0.300 . 1 . . . . 42 TYR CD1 . 11087 1 508 . 1 1 42 42 TYR CD2 C 13 133.076 0.300 . 1 . . . . 42 TYR CD2 . 11087 1 509 . 1 1 42 42 TYR CE1 C 13 117.782 0.300 . 1 . . . . 42 TYR CE1 . 11087 1 510 . 1 1 42 42 TYR CE2 C 13 117.782 0.300 . 1 . . . . 42 TYR CE2 . 11087 1 511 . 1 1 42 42 TYR N N 15 115.818 0.300 . 1 . . . . 42 TYR N . 11087 1 512 . 1 1 43 43 TYR H H 1 9.589 0.030 . 1 . . . . 43 TYR H . 11087 1 513 . 1 1 43 43 TYR HA H 1 4.891 0.030 . 1 . . . . 43 TYR HA . 11087 1 514 . 1 1 43 43 TYR HB2 H 1 3.454 0.030 . 2 . . . . 43 TYR HB2 . 11087 1 515 . 1 1 43 43 TYR HB3 H 1 3.022 0.030 . 2 . . . . 43 TYR HB3 . 11087 1 516 . 1 1 43 43 TYR HD1 H 1 7.178 0.030 . 1 . . . . 43 TYR HD1 . 11087 1 517 . 1 1 43 43 TYR HD2 H 1 7.178 0.030 . 1 . . . . 43 TYR HD2 . 11087 1 518 . 1 1 43 43 TYR HE1 H 1 6.535 0.030 . 1 . . . . 43 TYR HE1 . 11087 1 519 . 1 1 43 43 TYR HE2 H 1 6.535 0.030 . 1 . . . . 43 TYR HE2 . 11087 1 520 . 1 1 43 43 TYR C C 13 176.506 0.300 . 1 . . . . 43 TYR C . 11087 1 521 . 1 1 43 43 TYR CA C 13 57.101 0.300 . 1 . . . . 43 TYR CA . 11087 1 522 . 1 1 43 43 TYR CB C 13 43.856 0.300 . 1 . . . . 43 TYR CB . 11087 1 523 . 1 1 43 43 TYR CD1 C 13 134.571 0.300 . 1 . . . . 43 TYR CD1 . 11087 1 524 . 1 1 43 43 TYR CD2 C 13 134.571 0.300 . 1 . . . . 43 TYR CD2 . 11087 1 525 . 1 1 43 43 TYR CE1 C 13 117.978 0.300 . 1 . . . . 43 TYR CE1 . 11087 1 526 . 1 1 43 43 TYR CE2 C 13 117.978 0.300 . 1 . . . . 43 TYR CE2 . 11087 1 527 . 1 1 43 43 TYR N N 15 117.780 0.300 . 1 . . . . 43 TYR N . 11087 1 528 . 1 1 44 44 LYS H H 1 10.200 0.030 . 1 . . . . 44 LYS H . 11087 1 529 . 1 1 44 44 LYS HA H 1 4.271 0.030 . 1 . . . . 44 LYS HA . 11087 1 530 . 1 1 44 44 LYS HB2 H 1 2.047 0.030 . 1 . . . . 44 LYS HB2 . 11087 1 531 . 1 1 44 44 LYS HB3 H 1 2.047 0.030 . 1 . . . . 44 LYS HB3 . 11087 1 532 . 1 1 44 44 LYS HD2 H 1 1.815 0.030 . 1 . . . . 44 LYS HD2 . 11087 1 533 . 1 1 44 44 LYS HD3 H 1 1.815 0.030 . 1 . . . . 44 LYS HD3 . 11087 1 534 . 1 1 44 44 LYS HE2 H 1 3.071 0.030 . 1 . . . . 44 LYS HE2 . 11087 1 535 . 1 1 44 44 LYS HE3 H 1 3.071 0.030 . 1 . . . . 44 LYS HE3 . 11087 1 536 . 1 1 44 44 LYS HG2 H 1 1.677 0.030 . 2 . . . . 44 LYS HG2 . 11087 1 537 . 1 1 44 44 LYS HG3 H 1 1.536 0.030 . 2 . . . . 44 LYS HG3 . 11087 1 538 . 1 1 44 44 LYS C C 13 176.676 0.300 . 1 . . . . 44 LYS C . 11087 1 539 . 1 1 44 44 LYS CA C 13 60.233 0.300 . 1 . . . . 44 LYS CA . 11087 1 540 . 1 1 44 44 LYS CB C 13 32.540 0.300 . 1 . . . . 44 LYS CB . 11087 1 541 . 1 1 44 44 LYS CD C 13 29.631 0.300 . 1 . . . . 44 LYS CD . 11087 1 542 . 1 1 44 44 LYS CE C 13 41.884 0.300 . 1 . . . . 44 LYS CE . 11087 1 543 . 1 1 44 44 LYS CG C 13 25.303 0.300 . 1 . . . . 44 LYS CG . 11087 1 544 . 1 1 44 44 LYS N N 15 124.990 0.300 . 1 . . . . 44 LYS N . 11087 1 545 . 1 1 45 45 SER H H 1 7.896 0.030 . 1 . . . . 45 SER H . 11087 1 546 . 1 1 45 45 SER HA H 1 4.798 0.030 . 1 . . . . 45 SER HA . 11087 1 547 . 1 1 45 45 SER HB2 H 1 4.152 0.030 . 2 . . . . 45 SER HB2 . 11087 1 548 . 1 1 45 45 SER HB3 H 1 3.989 0.030 . 2 . . . . 45 SER HB3 . 11087 1 549 . 1 1 45 45 SER C C 13 173.598 0.300 . 1 . . . . 45 SER C . 11087 1 550 . 1 1 45 45 SER CA C 13 56.996 0.300 . 1 . . . . 45 SER CA . 11087 1 551 . 1 1 45 45 SER CB C 13 66.480 0.300 . 1 . . . . 45 SER CB . 11087 1 552 . 1 1 45 45 SER N N 15 109.587 0.300 . 1 . . . . 45 SER N . 11087 1 553 . 1 1 46 46 GLN H H 1 9.107 0.030 . 1 . . . . 46 GLN H . 11087 1 554 . 1 1 46 46 GLN HA H 1 3.007 0.030 . 1 . . . . 46 GLN HA . 11087 1 555 . 1 1 46 46 GLN HB2 H 1 1.038 0.030 . 2 . . . . 46 GLN HB2 . 11087 1 556 . 1 1 46 46 GLN HB3 H 1 1.232 0.030 . 2 . . . . 46 GLN HB3 . 11087 1 557 . 1 1 46 46 GLN HE21 H 1 6.543 0.030 . 2 . . . . 46 GLN HE21 . 11087 1 558 . 1 1 46 46 GLN HE22 H 1 6.024 0.030 . 2 . . . . 46 GLN HE22 . 11087 1 559 . 1 1 46 46 GLN HG2 H 1 1.016 0.030 . 2 . . . . 46 GLN HG2 . 11087 1 560 . 1 1 46 46 GLN HG3 H 1 0.968 0.030 . 2 . . . . 46 GLN HG3 . 11087 1 561 . 1 1 46 46 GLN C C 13 177.246 0.300 . 1 . . . . 46 GLN C . 11087 1 562 . 1 1 46 46 GLN CA C 13 58.684 0.300 . 1 . . . . 46 GLN CA . 11087 1 563 . 1 1 46 46 GLN CB C 13 28.049 0.300 . 1 . . . . 46 GLN CB . 11087 1 564 . 1 1 46 46 GLN CG C 13 33.002 0.300 . 1 . . . . 46 GLN CG . 11087 1 565 . 1 1 46 46 GLN N N 15 120.646 0.300 . 1 . . . . 46 GLN N . 11087 1 566 . 1 1 46 46 GLN NE2 N 15 110.650 0.300 . 1 . . . . 46 GLN NE2 . 11087 1 567 . 1 1 47 47 ASP H H 1 8.008 0.030 . 1 . . . . 47 ASP H . 11087 1 568 . 1 1 47 47 ASP HA H 1 4.269 0.030 . 1 . . . . 47 ASP HA . 11087 1 569 . 1 1 47 47 ASP HB2 H 1 2.603 0.030 . 2 . . . . 47 ASP HB2 . 11087 1 570 . 1 1 47 47 ASP HB3 H 1 2.454 0.030 . 2 . . . . 47 ASP HB3 . 11087 1 571 . 1 1 47 47 ASP C C 13 176.811 0.300 . 1 . . . . 47 ASP C . 11087 1 572 . 1 1 47 47 ASP CA C 13 56.116 0.300 . 1 . . . . 47 ASP CA . 11087 1 573 . 1 1 47 47 ASP CB C 13 40.157 0.300 . 1 . . . . 47 ASP CB . 11087 1 574 . 1 1 47 47 ASP N N 15 116.934 0.300 . 1 . . . . 47 ASP N . 11087 1 575 . 1 1 48 48 GLU H H 1 7.268 0.030 . 1 . . . . 48 GLU H . 11087 1 576 . 1 1 48 48 GLU HA H 1 4.338 0.030 . 1 . . . . 48 GLU HA . 11087 1 577 . 1 1 48 48 GLU HB2 H 1 2.728 0.030 . 2 . . . . 48 GLU HB2 . 11087 1 578 . 1 1 48 48 GLU HB3 H 1 2.200 0.030 . 2 . . . . 48 GLU HB3 . 11087 1 579 . 1 1 48 48 GLU HG2 H 1 2.559 0.030 . 2 . . . . 48 GLU HG2 . 11087 1 580 . 1 1 48 48 GLU HG3 H 1 2.288 0.030 . 2 . . . . 48 GLU HG3 . 11087 1 581 . 1 1 48 48 GLU C C 13 174.133 0.300 . 1 . . . . 48 GLU C . 11087 1 582 . 1 1 48 48 GLU CA C 13 57.383 0.300 . 1 . . . . 48 GLU CA . 11087 1 583 . 1 1 48 48 GLU CB C 13 30.799 0.300 . 1 . . . . 48 GLU CB . 11087 1 584 . 1 1 48 48 GLU CG C 13 37.925 0.300 . 1 . . . . 48 GLU CG . 11087 1 585 . 1 1 48 48 GLU N N 15 117.466 0.300 . 1 . . . . 48 GLU N . 11087 1 586 . 1 1 49 49 ALA H H 1 7.093 0.030 . 1 . . . . 49 ALA H . 11087 1 587 . 1 1 49 49 ALA HA H 1 4.149 0.030 . 1 . . . . 49 ALA HA . 11087 1 588 . 1 1 49 49 ALA HB1 H 1 0.509 0.030 . 1 . . . . 49 ALA HB . 11087 1 589 . 1 1 49 49 ALA HB2 H 1 0.509 0.030 . 1 . . . . 49 ALA HB . 11087 1 590 . 1 1 49 49 ALA HB3 H 1 0.509 0.030 . 1 . . . . 49 ALA HB . 11087 1 591 . 1 1 49 49 ALA C C 13 175.946 0.300 . 1 . . . . 49 ALA C . 11087 1 592 . 1 1 49 49 ALA CA C 13 49.818 0.300 . 1 . . . . 49 ALA CA . 11087 1 593 . 1 1 49 49 ALA CB C 13 17.700 0.300 . 1 . . . . 49 ALA CB . 11087 1 594 . 1 1 49 49 ALA N N 15 121.525 0.300 . 1 . . . . 49 ALA N . 11087 1 595 . 1 1 50 50 PRO HA H 1 4.362 0.030 . 1 . . . . 50 PRO HA . 11087 1 596 . 1 1 50 50 PRO HB2 H 1 2.291 0.030 . 1 . . . . 50 PRO HB2 . 11087 1 597 . 1 1 50 50 PRO HB3 H 1 2.291 0.030 . 1 . . . . 50 PRO HB3 . 11087 1 598 . 1 1 50 50 PRO HD2 H 1 3.531 0.030 . 2 . . . . 50 PRO HD2 . 11087 1 599 . 1 1 50 50 PRO HD3 H 1 3.432 0.030 . 2 . . . . 50 PRO HD3 . 11087 1 600 . 1 1 50 50 PRO HG2 H 1 1.752 0.030 . 2 . . . . 50 PRO HG2 . 11087 1 601 . 1 1 50 50 PRO HG3 H 1 1.968 0.030 . 2 . . . . 50 PRO HG3 . 11087 1 602 . 1 1 50 50 PRO C C 13 178.533 0.300 . 1 . . . . 50 PRO C . 11087 1 603 . 1 1 50 50 PRO CA C 13 63.857 0.300 . 1 . . . . 50 PRO CA . 11087 1 604 . 1 1 50 50 PRO CB C 13 34.483 0.300 . 1 . . . . 50 PRO CB . 11087 1 605 . 1 1 50 50 PRO CD C 13 49.504 0.300 . 1 . . . . 50 PRO CD . 11087 1 606 . 1 1 50 50 PRO CG C 13 24.134 0.300 . 1 . . . . 50 PRO CG . 11087 1 607 . 1 1 51 51 GLY H H 1 8.809 0.030 . 1 . . . . 51 GLY H . 11087 1 608 . 1 1 51 51 GLY HA2 H 1 4.032 0.030 . 2 . . . . 51 GLY HA2 . 11087 1 609 . 1 1 51 51 GLY HA3 H 1 3.925 0.030 . 2 . . . . 51 GLY HA3 . 11087 1 610 . 1 1 51 51 GLY C C 13 173.592 0.300 . 1 . . . . 51 GLY C . 11087 1 611 . 1 1 51 51 GLY CA C 13 47.531 0.300 . 1 . . . . 51 GLY CA . 11087 1 612 . 1 1 51 51 GLY N N 15 113.732 0.300 . 1 . . . . 51 GLY N . 11087 1 613 . 1 1 52 52 ASP H H 1 8.559 0.030 . 1 . . . . 52 ASP H . 11087 1 614 . 1 1 52 52 ASP HA H 1 5.383 0.030 . 1 . . . . 52 ASP HA . 11087 1 615 . 1 1 52 52 ASP HB2 H 1 3.003 0.030 . 2 . . . . 52 ASP HB2 . 11087 1 616 . 1 1 52 52 ASP HB3 H 1 2.541 0.030 . 2 . . . . 52 ASP HB3 . 11087 1 617 . 1 1 52 52 ASP C C 13 171.899 0.300 . 1 . . . . 52 ASP C . 11087 1 618 . 1 1 52 52 ASP CA C 13 52.206 0.300 . 1 . . . . 52 ASP CA . 11087 1 619 . 1 1 52 52 ASP CB C 13 41.611 0.300 . 1 . . . . 52 ASP CB . 11087 1 620 . 1 1 52 52 ASP N N 15 117.439 0.300 . 1 . . . . 52 ASP N . 11087 1 621 . 1 1 53 53 PRO HA H 1 3.837 0.030 . 1 . . . . 53 PRO HA . 11087 1 622 . 1 1 53 53 PRO HB2 H 1 1.224 0.030 . 2 . . . . 53 PRO HB2 . 11087 1 623 . 1 1 53 53 PRO HB3 H 1 1.323 0.030 . 2 . . . . 53 PRO HB3 . 11087 1 624 . 1 1 53 53 PRO HD2 H 1 3.659 0.030 . 2 . . . . 53 PRO HD2 . 11087 1 625 . 1 1 53 53 PRO HD3 H 1 3.797 0.030 . 2 . . . . 53 PRO HD3 . 11087 1 626 . 1 1 53 53 PRO HG2 H 1 1.879 0.030 . 1 . . . . 53 PRO HG2 . 11087 1 627 . 1 1 53 53 PRO HG3 H 1 1.879 0.030 . 1 . . . . 53 PRO HG3 . 11087 1 628 . 1 1 53 53 PRO C C 13 177.721 0.300 . 1 . . . . 53 PRO C . 11087 1 629 . 1 1 53 53 PRO CA C 13 63.083 0.300 . 1 . . . . 53 PRO CA . 11087 1 630 . 1 1 53 53 PRO CB C 13 30.864 0.300 . 1 . . . . 53 PRO CB . 11087 1 631 . 1 1 53 53 PRO CD C 13 50.107 0.300 . 1 . . . . 53 PRO CD . 11087 1 632 . 1 1 53 53 PRO CG C 13 26.506 0.300 . 1 . . . . 53 PRO CG . 11087 1 633 . 1 1 54 54 ILE H H 1 8.770 0.030 . 1 . . . . 54 ILE H . 11087 1 634 . 1 1 54 54 ILE HA H 1 3.568 0.030 . 1 . . . . 54 ILE HA . 11087 1 635 . 1 1 54 54 ILE HB H 1 0.744 0.030 . 1 . . . . 54 ILE HB . 11087 1 636 . 1 1 54 54 ILE HD11 H 1 0.932 0.030 . 1 . . . . 54 ILE HD1 . 11087 1 637 . 1 1 54 54 ILE HD12 H 1 0.932 0.030 . 1 . . . . 54 ILE HD1 . 11087 1 638 . 1 1 54 54 ILE HD13 H 1 0.932 0.030 . 1 . . . . 54 ILE HD1 . 11087 1 639 . 1 1 54 54 ILE HG12 H 1 1.131 0.030 . 2 . . . . 54 ILE HG12 . 11087 1 640 . 1 1 54 54 ILE HG13 H 1 1.792 0.030 . 2 . . . . 54 ILE HG13 . 11087 1 641 . 1 1 54 54 ILE HG21 H 1 0.743 0.030 . 1 . . . . 54 ILE HG2 . 11087 1 642 . 1 1 54 54 ILE HG22 H 1 0.743 0.030 . 1 . . . . 54 ILE HG2 . 11087 1 643 . 1 1 54 54 ILE HG23 H 1 0.743 0.030 . 1 . . . . 54 ILE HG2 . 11087 1 644 . 1 1 54 54 ILE C C 13 176.965 0.300 . 1 . . . . 54 ILE C . 11087 1 645 . 1 1 54 54 ILE CA C 13 63.927 0.300 . 1 . . . . 54 ILE CA . 11087 1 646 . 1 1 54 54 ILE CB C 13 37.657 0.300 . 1 . . . . 54 ILE CB . 11087 1 647 . 1 1 54 54 ILE CD1 C 13 14.400 0.300 . 1 . . . . 54 ILE CD1 . 11087 1 648 . 1 1 54 54 ILE CG1 C 13 28.653 0.300 . 1 . . . . 54 ILE CG1 . 11087 1 649 . 1 1 54 54 ILE CG2 C 13 17.826 0.300 . 1 . . . . 54 ILE CG2 . 11087 1 650 . 1 1 54 54 ILE N N 15 124.148 0.300 . 1 . . . . 54 ILE N . 11087 1 651 . 1 1 55 55 GLN H H 1 6.083 0.030 . 1 . . . . 55 GLN H . 11087 1 652 . 1 1 55 55 GLN HA H 1 4.191 0.030 . 1 . . . . 55 GLN HA . 11087 1 653 . 1 1 55 55 GLN HB2 H 1 1.633 0.030 . 2 . . . . 55 GLN HB2 . 11087 1 654 . 1 1 55 55 GLN HB3 H 1 1.569 0.030 . 2 . . . . 55 GLN HB3 . 11087 1 655 . 1 1 55 55 GLN HE21 H 1 7.761 0.030 . 2 . . . . 55 GLN HE21 . 11087 1 656 . 1 1 55 55 GLN HE22 H 1 6.718 0.030 . 2 . . . . 55 GLN HE22 . 11087 1 657 . 1 1 55 55 GLN HG2 H 1 2.196 0.030 . 2 . . . . 55 GLN HG2 . 11087 1 658 . 1 1 55 55 GLN HG3 H 1 2.143 0.030 . 2 . . . . 55 GLN HG3 . 11087 1 659 . 1 1 55 55 GLN C C 13 173.089 0.300 . 1 . . . . 55 GLN C . 11087 1 660 . 1 1 55 55 GLN CA C 13 54.990 0.300 . 1 . . . . 55 GLN CA . 11087 1 661 . 1 1 55 55 GLN CB C 13 34.154 0.300 . 1 . . . . 55 GLN CB . 11087 1 662 . 1 1 55 55 GLN CG C 13 35.058 0.300 . 1 . . . . 55 GLN CG . 11087 1 663 . 1 1 55 55 GLN N N 15 111.788 0.300 . 1 . . . . 55 GLN N . 11087 1 664 . 1 1 55 55 GLN NE2 N 15 112.185 0.300 . 1 . . . . 55 GLN NE2 . 11087 1 665 . 1 1 56 56 GLN H H 1 8.361 0.030 . 1 . . . . 56 GLN H . 11087 1 666 . 1 1 56 56 GLN HA H 1 4.939 0.030 . 1 . . . . 56 GLN HA . 11087 1 667 . 1 1 56 56 GLN HB2 H 1 1.825 0.030 . 2 . . . . 56 GLN HB2 . 11087 1 668 . 1 1 56 56 GLN HB3 H 1 1.732 0.030 . 2 . . . . 56 GLN HB3 . 11087 1 669 . 1 1 56 56 GLN HE21 H 1 6.936 0.030 . 2 . . . . 56 GLN HE21 . 11087 1 670 . 1 1 56 56 GLN HE22 H 1 7.659 0.030 . 2 . . . . 56 GLN HE22 . 11087 1 671 . 1 1 56 56 GLN HG2 H 1 2.055 0.030 . 1 . . . . 56 GLN HG2 . 11087 1 672 . 1 1 56 56 GLN HG3 H 1 2.055 0.030 . 1 . . . . 56 GLN HG3 . 11087 1 673 . 1 1 56 56 GLN C C 13 174.362 0.300 . 1 . . . . 56 GLN C . 11087 1 674 . 1 1 56 56 GLN CA C 13 55.131 0.300 . 1 . . . . 56 GLN CA . 11087 1 675 . 1 1 56 56 GLN CB C 13 32.016 0.300 . 1 . . . . 56 GLN CB . 11087 1 676 . 1 1 56 56 GLN CG C 13 34.589 0.300 . 1 . . . . 56 GLN CG . 11087 1 677 . 1 1 56 56 GLN N N 15 121.350 0.300 . 1 . . . . 56 GLN N . 11087 1 678 . 1 1 56 56 GLN NE2 N 15 112.250 0.300 . 1 . . . . 56 GLN NE2 . 11087 1 679 . 1 1 57 57 LEU H H 1 9.412 0.030 . 1 . . . . 57 LEU H . 11087 1 680 . 1 1 57 57 LEU HA H 1 4.668 0.030 . 1 . . . . 57 LEU HA . 11087 1 681 . 1 1 57 57 LEU HB2 H 1 1.825 0.030 . 2 . . . . 57 LEU HB2 . 11087 1 682 . 1 1 57 57 LEU HB3 H 1 1.323 0.030 . 2 . . . . 57 LEU HB3 . 11087 1 683 . 1 1 57 57 LEU HD11 H 1 0.840 0.030 . 1 . . . . 57 LEU HD1 . 11087 1 684 . 1 1 57 57 LEU HD12 H 1 0.840 0.030 . 1 . . . . 57 LEU HD1 . 11087 1 685 . 1 1 57 57 LEU HD13 H 1 0.840 0.030 . 1 . . . . 57 LEU HD1 . 11087 1 686 . 1 1 57 57 LEU HD21 H 1 0.827 0.030 . 1 . . . . 57 LEU HD2 . 11087 1 687 . 1 1 57 57 LEU HD22 H 1 0.827 0.030 . 1 . . . . 57 LEU HD2 . 11087 1 688 . 1 1 57 57 LEU HD23 H 1 0.827 0.030 . 1 . . . . 57 LEU HD2 . 11087 1 689 . 1 1 57 57 LEU HG H 1 1.486 0.030 . 1 . . . . 57 LEU HG . 11087 1 690 . 1 1 57 57 LEU C C 13 174.313 0.300 . 1 . . . . 57 LEU C . 11087 1 691 . 1 1 57 57 LEU CA C 13 53.477 0.300 . 1 . . . . 57 LEU CA . 11087 1 692 . 1 1 57 57 LEU CB C 13 44.749 0.300 . 1 . . . . 57 LEU CB . 11087 1 693 . 1 1 57 57 LEU CD1 C 13 24.124 0.300 . 2 . . . . 57 LEU CD1 . 11087 1 694 . 1 1 57 57 LEU CD2 C 13 25.994 0.300 . 2 . . . . 57 LEU CD2 . 11087 1 695 . 1 1 57 57 LEU CG C 13 26.982 0.300 . 1 . . . . 57 LEU CG . 11087 1 696 . 1 1 57 57 LEU N N 15 125.425 0.300 . 1 . . . . 57 LEU N . 11087 1 697 . 1 1 58 58 ASN H H 1 8.879 0.030 . 1 . . . . 58 ASN H . 11087 1 698 . 1 1 58 58 ASN HA H 1 4.921 0.030 . 1 . . . . 58 ASN HA . 11087 1 699 . 1 1 58 58 ASN HB2 H 1 3.039 0.030 . 2 . . . . 58 ASN HB2 . 11087 1 700 . 1 1 58 58 ASN HB3 H 1 2.687 0.030 . 2 . . . . 58 ASN HB3 . 11087 1 701 . 1 1 58 58 ASN HD21 H 1 7.556 0.030 . 2 . . . . 58 ASN HD21 . 11087 1 702 . 1 1 58 58 ASN HD22 H 1 6.718 0.030 . 2 . . . . 58 ASN HD22 . 11087 1 703 . 1 1 58 58 ASN C C 13 176.162 0.300 . 1 . . . . 58 ASN C . 11087 1 704 . 1 1 58 58 ASN CA C 13 52.633 0.300 . 1 . . . . 58 ASN CA . 11087 1 705 . 1 1 58 58 ASN CB C 13 37.909 0.300 . 1 . . . . 58 ASN CB . 11087 1 706 . 1 1 58 58 ASN N N 15 123.841 0.300 . 1 . . . . 58 ASN N . 11087 1 707 . 1 1 58 58 ASN ND2 N 15 111.601 0.300 . 1 . . . . 58 ASN ND2 . 11087 1 708 . 1 1 59 59 LEU H H 1 9.175 0.030 . 1 . . . . 59 LEU H . 11087 1 709 . 1 1 59 59 LEU HA H 1 4.144 0.030 . 1 . . . . 59 LEU HA . 11087 1 710 . 1 1 59 59 LEU HB2 H 1 1.714 0.030 . 2 . . . . 59 LEU HB2 . 11087 1 711 . 1 1 59 59 LEU HB3 H 1 1.655 0.030 . 2 . . . . 59 LEU HB3 . 11087 1 712 . 1 1 59 59 LEU HD11 H 1 0.753 0.030 . 1 . . . . 59 LEU HD1 . 11087 1 713 . 1 1 59 59 LEU HD12 H 1 0.753 0.030 . 1 . . . . 59 LEU HD1 . 11087 1 714 . 1 1 59 59 LEU HD13 H 1 0.753 0.030 . 1 . . . . 59 LEU HD1 . 11087 1 715 . 1 1 59 59 LEU HD21 H 1 0.773 0.030 . 1 . . . . 59 LEU HD2 . 11087 1 716 . 1 1 59 59 LEU HD22 H 1 0.773 0.030 . 1 . . . . 59 LEU HD2 . 11087 1 717 . 1 1 59 59 LEU HD23 H 1 0.773 0.030 . 1 . . . . 59 LEU HD2 . 11087 1 718 . 1 1 59 59 LEU HG H 1 1.847 0.030 . 1 . . . . 59 LEU HG . 11087 1 719 . 1 1 59 59 LEU C C 13 177.524 0.300 . 1 . . . . 59 LEU C . 11087 1 720 . 1 1 59 59 LEU CA C 13 55.518 0.300 . 1 . . . . 59 LEU CA . 11087 1 721 . 1 1 59 59 LEU CB C 13 41.966 0.300 . 1 . . . . 59 LEU CB . 11087 1 722 . 1 1 59 59 LEU CD1 C 13 26.917 0.300 . 2 . . . . 59 LEU CD1 . 11087 1 723 . 1 1 59 59 LEU CD2 C 13 23.545 0.300 . 2 . . . . 59 LEU CD2 . 11087 1 724 . 1 1 59 59 LEU CG C 13 27.717 0.300 . 1 . . . . 59 LEU CG . 11087 1 725 . 1 1 59 59 LEU N N 15 124.443 0.300 . 1 . . . . 59 LEU N . 11087 1 726 . 1 1 60 60 LYS H H 1 7.944 0.030 . 1 . . . . 60 LYS H . 11087 1 727 . 1 1 60 60 LYS HA H 1 4.402 0.030 . 1 . . . . 60 LYS HA . 11087 1 728 . 1 1 60 60 LYS HB2 H 1 1.752 0.030 . 2 . . . . 60 LYS HB2 . 11087 1 729 . 1 1 60 60 LYS HB3 H 1 1.720 0.030 . 2 . . . . 60 LYS HB3 . 11087 1 730 . 1 1 60 60 LYS HD2 H 1 1.756 0.030 . 2 . . . . 60 LYS HD2 . 11087 1 731 . 1 1 60 60 LYS HD3 H 1 1.720 0.030 . 2 . . . . 60 LYS HD3 . 11087 1 732 . 1 1 60 60 LYS HE2 H 1 2.967 0.030 . 1 . . . . 60 LYS HE2 . 11087 1 733 . 1 1 60 60 LYS HE3 H 1 2.967 0.030 . 1 . . . . 60 LYS HE3 . 11087 1 734 . 1 1 60 60 LYS HG2 H 1 1.385 0.030 . 1 . . . . 60 LYS HG2 . 11087 1 735 . 1 1 60 60 LYS HG3 H 1 1.385 0.030 . 1 . . . . 60 LYS HG3 . 11087 1 736 . 1 1 60 60 LYS C C 13 178.542 0.300 . 1 . . . . 60 LYS C . 11087 1 737 . 1 1 60 60 LYS CA C 13 59.212 0.300 . 1 . . . . 60 LYS CA . 11087 1 738 . 1 1 60 60 LYS CB C 13 31.851 0.300 . 1 . . . . 60 LYS CB . 11087 1 739 . 1 1 60 60 LYS CD C 13 29.713 0.300 . 1 . . . . 60 LYS CD . 11087 1 740 . 1 1 60 60 LYS CE C 13 42.048 0.300 . 1 . . . . 60 LYS CE . 11087 1 741 . 1 1 60 60 LYS CG C 13 25.519 0.300 . 1 . . . . 60 LYS CG . 11087 1 742 . 1 1 60 60 LYS N N 15 121.337 0.300 . 1 . . . . 60 LYS N . 11087 1 743 . 1 1 61 61 GLY H H 1 9.243 0.030 . 1 . . . . 61 GLY H . 11087 1 744 . 1 1 61 61 GLY HA2 H 1 3.873 0.030 . 2 . . . . 61 GLY HA2 . 11087 1 745 . 1 1 61 61 GLY HA3 H 1 4.298 0.030 . 2 . . . . 61 GLY HA3 . 11087 1 746 . 1 1 61 61 GLY C C 13 174.736 0.300 . 1 . . . . 61 GLY C . 11087 1 747 . 1 1 61 61 GLY CA C 13 45.455 0.300 . 1 . . . . 61 GLY CA . 11087 1 748 . 1 1 61 61 GLY N N 15 115.626 0.300 . 1 . . . . 61 GLY N . 11087 1 749 . 1 1 62 62 CYS H H 1 8.355 0.030 . 1 . . . . 62 CYS H . 11087 1 750 . 1 1 62 62 CYS HA H 1 4.816 0.030 . 1 . . . . 62 CYS HA . 11087 1 751 . 1 1 62 62 CYS HB2 H 1 2.905 0.030 . 2 . . . . 62 CYS HB2 . 11087 1 752 . 1 1 62 62 CYS HB3 H 1 3.478 0.030 . 2 . . . . 62 CYS HB3 . 11087 1 753 . 1 1 62 62 CYS C C 13 172.881 0.300 . 1 . . . . 62 CYS C . 11087 1 754 . 1 1 62 62 CYS CA C 13 57.910 0.300 . 1 . . . . 62 CYS CA . 11087 1 755 . 1 1 62 62 CYS CB C 13 28.331 0.300 . 1 . . . . 62 CYS CB . 11087 1 756 . 1 1 62 62 CYS N N 15 118.200 0.300 . 1 . . . . 62 CYS N . 11087 1 757 . 1 1 63 63 GLU H H 1 8.377 0.030 . 1 . . . . 63 GLU H . 11087 1 758 . 1 1 63 63 GLU HA H 1 4.769 0.030 . 1 . . . . 63 GLU HA . 11087 1 759 . 1 1 63 63 GLU HB2 H 1 2.054 0.030 . 2 . . . . 63 GLU HB2 . 11087 1 760 . 1 1 63 63 GLU HB3 H 1 1.966 0.030 . 2 . . . . 63 GLU HB3 . 11087 1 761 . 1 1 63 63 GLU HG2 H 1 2.285 0.030 . 2 . . . . 63 GLU HG2 . 11087 1 762 . 1 1 63 63 GLU HG3 H 1 2.180 0.030 . 2 . . . . 63 GLU HG3 . 11087 1 763 . 1 1 63 63 GLU C C 13 175.003 0.300 . 1 . . . . 63 GLU C . 11087 1 764 . 1 1 63 63 GLU CA C 13 55.412 0.300 . 1 . . . . 63 GLU CA . 11087 1 765 . 1 1 63 63 GLU CB C 13 31.851 0.300 . 1 . . . . 63 GLU CB . 11087 1 766 . 1 1 63 63 GLU CG C 13 36.099 0.300 . 1 . . . . 63 GLU CG . 11087 1 767 . 1 1 63 63 GLU N N 15 119.943 0.300 . 1 . . . . 63 GLU N . 11087 1 768 . 1 1 64 64 VAL H H 1 8.480 0.030 . 1 . . . . 64 VAL H . 11087 1 769 . 1 1 64 64 VAL HA H 1 4.702 0.030 . 1 . . . . 64 VAL HA . 11087 1 770 . 1 1 64 64 VAL HB H 1 1.925 0.030 . 1 . . . . 64 VAL HB . 11087 1 771 . 1 1 64 64 VAL HG11 H 1 0.734 0.030 . 1 . . . . 64 VAL HG1 . 11087 1 772 . 1 1 64 64 VAL HG12 H 1 0.734 0.030 . 1 . . . . 64 VAL HG1 . 11087 1 773 . 1 1 64 64 VAL HG13 H 1 0.734 0.030 . 1 . . . . 64 VAL HG1 . 11087 1 774 . 1 1 64 64 VAL HG21 H 1 0.735 0.030 . 1 . . . . 64 VAL HG2 . 11087 1 775 . 1 1 64 64 VAL HG22 H 1 0.735 0.030 . 1 . . . . 64 VAL HG2 . 11087 1 776 . 1 1 64 64 VAL HG23 H 1 0.735 0.030 . 1 . . . . 64 VAL HG2 . 11087 1 777 . 1 1 64 64 VAL C C 13 175.592 0.300 . 1 . . . . 64 VAL C . 11087 1 778 . 1 1 64 64 VAL CA C 13 60.972 0.300 . 1 . . . . 64 VAL CA . 11087 1 779 . 1 1 64 64 VAL CB C 13 33.167 0.300 . 1 . . . . 64 VAL CB . 11087 1 780 . 1 1 64 64 VAL CG1 C 13 22.341 0.300 . 2 . . . . 64 VAL CG1 . 11087 1 781 . 1 1 64 64 VAL CG2 C 13 21.621 0.300 . 2 . . . . 64 VAL CG2 . 11087 1 782 . 1 1 64 64 VAL N N 15 124.536 0.300 . 1 . . . . 64 VAL N . 11087 1 783 . 1 1 65 65 VAL H H 1 9.509 0.030 . 1 . . . . 65 VAL H . 11087 1 784 . 1 1 65 65 VAL HA H 1 4.785 0.030 . 1 . . . . 65 VAL HA . 11087 1 785 . 1 1 65 65 VAL HB H 1 2.030 0.030 . 1 . . . . 65 VAL HB . 11087 1 786 . 1 1 65 65 VAL HG11 H 1 1.004 0.030 . 1 . . . . 65 VAL HG1 . 11087 1 787 . 1 1 65 65 VAL HG12 H 1 1.004 0.030 . 1 . . . . 65 VAL HG1 . 11087 1 788 . 1 1 65 65 VAL HG13 H 1 1.004 0.030 . 1 . . . . 65 VAL HG1 . 11087 1 789 . 1 1 65 65 VAL HG21 H 1 0.867 0.030 . 1 . . . . 65 VAL HG2 . 11087 1 790 . 1 1 65 65 VAL HG22 H 1 0.867 0.030 . 1 . . . . 65 VAL HG2 . 11087 1 791 . 1 1 65 65 VAL HG23 H 1 0.867 0.030 . 1 . . . . 65 VAL HG2 . 11087 1 792 . 1 1 65 65 VAL C C 13 173.474 0.300 . 1 . . . . 65 VAL C . 11087 1 793 . 1 1 65 65 VAL CA C 13 58.825 0.300 . 1 . . . . 65 VAL CA . 11087 1 794 . 1 1 65 65 VAL CB C 13 35.963 0.300 . 1 . . . . 65 VAL CB . 11087 1 795 . 1 1 65 65 VAL CG1 C 13 20.589 0.300 . 2 . . . . 65 VAL CG1 . 11087 1 796 . 1 1 65 65 VAL CG2 C 13 20.589 0.300 . 2 . . . . 65 VAL CG2 . 11087 1 797 . 1 1 65 65 VAL N N 15 129.806 0.300 . 1 . . . . 65 VAL N . 11087 1 798 . 1 1 66 66 PRO HA H 1 4.660 0.030 . 1 . . . . 66 PRO HA . 11087 1 799 . 1 1 66 66 PRO HB2 H 1 2.058 0.030 . 2 . . . . 66 PRO HB2 . 11087 1 800 . 1 1 66 66 PRO HB3 H 1 2.599 0.030 . 2 . . . . 66 PRO HB3 . 11087 1 801 . 1 1 66 66 PRO HD2 H 1 3.926 0.030 . 2 . . . . 66 PRO HD2 . 11087 1 802 . 1 1 66 66 PRO HD3 H 1 3.804 0.030 . 2 . . . . 66 PRO HD3 . 11087 1 803 . 1 1 66 66 PRO HG2 H 1 2.021 0.030 . 2 . . . . 66 PRO HG2 . 11087 1 804 . 1 1 66 66 PRO HG3 H 1 2.247 0.030 . 2 . . . . 66 PRO HG3 . 11087 1 805 . 1 1 66 66 PRO C C 13 177.047 0.300 . 1 . . . . 66 PRO C . 11087 1 806 . 1 1 66 66 PRO CA C 13 63.012 0.300 . 1 . . . . 66 PRO CA . 11087 1 807 . 1 1 66 66 PRO CB C 13 33.098 0.300 . 1 . . . . 66 PRO CB . 11087 1 808 . 1 1 66 66 PRO CD C 13 51.265 0.300 . 1 . . . . 66 PRO CD . 11087 1 809 . 1 1 66 66 PRO CG C 13 26.999 0.300 . 1 . . . . 66 PRO CG . 11087 1 810 . 1 1 67 67 ASP H H 1 8.537 0.030 . 1 . . . . 67 ASP H . 11087 1 811 . 1 1 67 67 ASP HA H 1 4.697 0.030 . 1 . . . . 67 ASP HA . 11087 1 812 . 1 1 67 67 ASP HB2 H 1 2.555 0.030 . 2 . . . . 67 ASP HB2 . 11087 1 813 . 1 1 67 67 ASP HB3 H 1 2.311 0.030 . 2 . . . . 67 ASP HB3 . 11087 1 814 . 1 1 67 67 ASP C C 13 177.036 0.300 . 1 . . . . 67 ASP C . 11087 1 815 . 1 1 67 67 ASP CA C 13 54.181 0.300 . 1 . . . . 67 ASP CA . 11087 1 816 . 1 1 67 67 ASP CB C 13 41.361 0.300 . 1 . . . . 67 ASP CB . 11087 1 817 . 1 1 67 67 ASP N N 15 123.733 0.300 . 1 . . . . 67 ASP N . 11087 1 818 . 1 1 68 68 VAL H H 1 8.251 0.030 . 1 . . . . 68 VAL H . 11087 1 819 . 1 1 68 68 VAL HA H 1 4.587 0.030 . 1 . . . . 68 VAL HA . 11087 1 820 . 1 1 68 68 VAL HB H 1 1.833 0.030 . 1 . . . . 68 VAL HB . 11087 1 821 . 1 1 68 68 VAL HG11 H 1 0.808 0.030 . 1 . . . . 68 VAL HG1 . 11087 1 822 . 1 1 68 68 VAL HG12 H 1 0.808 0.030 . 1 . . . . 68 VAL HG1 . 11087 1 823 . 1 1 68 68 VAL HG13 H 1 0.808 0.030 . 1 . . . . 68 VAL HG1 . 11087 1 824 . 1 1 68 68 VAL HG21 H 1 0.759 0.030 . 1 . . . . 68 VAL HG2 . 11087 1 825 . 1 1 68 68 VAL HG22 H 1 0.759 0.030 . 1 . . . . 68 VAL HG2 . 11087 1 826 . 1 1 68 68 VAL HG23 H 1 0.759 0.030 . 1 . . . . 68 VAL HG2 . 11087 1 827 . 1 1 68 68 VAL C C 13 176.191 0.300 . 1 . . . . 68 VAL C . 11087 1 828 . 1 1 68 68 VAL CA C 13 59.599 0.300 . 1 . . . . 68 VAL CA . 11087 1 829 . 1 1 68 68 VAL CB C 13 35.489 0.300 . 1 . . . . 68 VAL CB . 11087 1 830 . 1 1 68 68 VAL CG1 C 13 22.314 0.300 . 2 . . . . 68 VAL CG1 . 11087 1 831 . 1 1 68 68 VAL CG2 C 13 21.700 0.300 . 2 . . . . 68 VAL CG2 . 11087 1 832 . 1 1 68 68 VAL N N 15 121.253 0.300 . 1 . . . . 68 VAL N . 11087 1 833 . 1 1 69 69 ASN H H 1 8.816 0.030 . 1 . . . . 69 ASN H . 11087 1 834 . 1 1 69 69 ASN HA H 1 4.739 0.030 . 1 . . . . 69 ASN HA . 11087 1 835 . 1 1 69 69 ASN HB2 H 1 2.679 0.030 . 2 . . . . 69 ASN HB2 . 11087 1 836 . 1 1 69 69 ASN HB3 H 1 2.635 0.030 . 2 . . . . 69 ASN HB3 . 11087 1 837 . 1 1 69 69 ASN HD21 H 1 7.587 0.030 . 2 . . . . 69 ASN HD21 . 11087 1 838 . 1 1 69 69 ASN HD22 H 1 6.885 0.030 . 2 . . . . 69 ASN HD22 . 11087 1 839 . 1 1 69 69 ASN C C 13 175.211 0.300 . 1 . . . . 69 ASN C . 11087 1 840 . 1 1 69 69 ASN CA C 13 52.633 0.300 . 1 . . . . 69 ASN CA . 11087 1 841 . 1 1 69 69 ASN CB C 13 39.828 0.300 . 1 . . . . 69 ASN CB . 11087 1 842 . 1 1 69 69 ASN N N 15 124.119 0.300 . 1 . . . . 69 ASN N . 11087 1 843 . 1 1 69 69 ASN ND2 N 15 111.934 0.300 . 1 . . . . 69 ASN ND2 . 11087 1 844 . 1 1 70 70 VAL H H 1 9.044 0.030 . 1 . . . . 70 VAL H . 11087 1 845 . 1 1 70 70 VAL HA H 1 3.271 0.030 . 1 . . . . 70 VAL HA . 11087 1 846 . 1 1 70 70 VAL HB H 1 2.017 0.030 . 1 . . . . 70 VAL HB . 11087 1 847 . 1 1 70 70 VAL HG11 H 1 0.991 0.030 . 1 . . . . 70 VAL HG1 . 11087 1 848 . 1 1 70 70 VAL HG12 H 1 0.991 0.030 . 1 . . . . 70 VAL HG1 . 11087 1 849 . 1 1 70 70 VAL HG13 H 1 0.991 0.030 . 1 . . . . 70 VAL HG1 . 11087 1 850 . 1 1 70 70 VAL HG21 H 1 1.050 0.030 . 1 . . . . 70 VAL HG2 . 11087 1 851 . 1 1 70 70 VAL HG22 H 1 1.050 0.030 . 1 . . . . 70 VAL HG2 . 11087 1 852 . 1 1 70 70 VAL HG23 H 1 1.050 0.030 . 1 . . . . 70 VAL HG2 . 11087 1 853 . 1 1 70 70 VAL C C 13 179.503 0.300 . 1 . . . . 70 VAL C . 11087 1 854 . 1 1 70 70 VAL CA C 13 67.235 0.300 . 1 . . . . 70 VAL CA . 11087 1 855 . 1 1 70 70 VAL CB C 13 31.687 0.300 . 1 . . . . 70 VAL CB . 11087 1 856 . 1 1 70 70 VAL CG1 C 13 21.490 0.300 . 2 . . . . 70 VAL CG1 . 11087 1 857 . 1 1 70 70 VAL CG2 C 13 23.292 0.300 . 2 . . . . 70 VAL CG2 . 11087 1 858 . 1 1 70 70 VAL N N 15 126.879 0.300 . 1 . . . . 70 VAL N . 11087 1 859 . 1 1 71 71 SER H H 1 8.694 0.030 . 1 . . . . 71 SER H . 11087 1 860 . 1 1 71 71 SER HA H 1 4.205 0.030 . 1 . . . . 71 SER HA . 11087 1 861 . 1 1 71 71 SER HB2 H 1 3.929 0.030 . 1 . . . . 71 SER HB2 . 11087 1 862 . 1 1 71 71 SER HB3 H 1 3.929 0.030 . 1 . . . . 71 SER HB3 . 11087 1 863 . 1 1 71 71 SER C C 13 175.683 0.300 . 1 . . . . 71 SER C . 11087 1 864 . 1 1 71 71 SER CA C 13 61.429 0.300 . 1 . . . . 71 SER CA . 11087 1 865 . 1 1 71 71 SER CB C 13 62.438 0.300 . 1 . . . . 71 SER CB . 11087 1 866 . 1 1 71 71 SER N N 15 117.743 0.300 . 1 . . . . 71 SER N . 11087 1 867 . 1 1 72 72 GLY H H 1 7.532 0.030 . 1 . . . . 72 GLY H . 11087 1 868 . 1 1 72 72 GLY HA2 H 1 3.288 0.030 . 2 . . . . 72 GLY HA2 . 11087 1 869 . 1 1 72 72 GLY HA3 H 1 4.189 0.030 . 2 . . . . 72 GLY HA3 . 11087 1 870 . 1 1 72 72 GLY C C 13 172.992 0.300 . 1 . . . . 72 GLY C . 11087 1 871 . 1 1 72 72 GLY CA C 13 44.645 0.300 . 1 . . . . 72 GLY CA . 11087 1 872 . 1 1 72 72 GLY N N 15 107.716 0.300 . 1 . . . . 72 GLY N . 11087 1 873 . 1 1 73 73 GLN H H 1 7.891 0.030 . 1 . . . . 73 GLN H . 11087 1 874 . 1 1 73 73 GLN HA H 1 3.393 0.030 . 1 . . . . 73 GLN HA . 11087 1 875 . 1 1 73 73 GLN HB2 H 1 2.152 0.030 . 2 . . . . 73 GLN HB2 . 11087 1 876 . 1 1 73 73 GLN HB3 H 1 2.318 0.030 . 2 . . . . 73 GLN HB3 . 11087 1 877 . 1 1 73 73 GLN HE21 H 1 7.675 0.030 . 2 . . . . 73 GLN HE21 . 11087 1 878 . 1 1 73 73 GLN HE22 H 1 7.054 0.030 . 2 . . . . 73 GLN HE22 . 11087 1 879 . 1 1 73 73 GLN HG2 H 1 2.361 0.030 . 1 . . . . 73 GLN HG2 . 11087 1 880 . 1 1 73 73 GLN HG3 H 1 2.361 0.030 . 1 . . . . 73 GLN HG3 . 11087 1 881 . 1 1 73 73 GLN C C 13 173.281 0.300 . 1 . . . . 73 GLN C . 11087 1 882 . 1 1 73 73 GLN CA C 13 56.468 0.300 . 1 . . . . 73 GLN CA . 11087 1 883 . 1 1 73 73 GLN CB C 13 26.510 0.300 . 1 . . . . 73 GLN CB . 11087 1 884 . 1 1 73 73 GLN CG C 13 34.318 0.300 . 1 . . . . 73 GLN CG . 11087 1 885 . 1 1 73 73 GLN N N 15 116.398 0.300 . 1 . . . . 73 GLN N . 11087 1 886 . 1 1 73 73 GLN NE2 N 15 113.294 0.300 . 1 . . . . 73 GLN NE2 . 11087 1 887 . 1 1 74 74 LYS H H 1 7.548 0.030 . 1 . . . . 74 LYS H . 11087 1 888 . 1 1 74 74 LYS HA H 1 4.059 0.030 . 1 . . . . 74 LYS HA . 11087 1 889 . 1 1 74 74 LYS HB2 H 1 1.395 0.030 . 2 . . . . 74 LYS HB2 . 11087 1 890 . 1 1 74 74 LYS HB3 H 1 1.296 0.030 . 2 . . . . 74 LYS HB3 . 11087 1 891 . 1 1 74 74 LYS HD2 H 1 1.377 0.030 . 2 . . . . 74 LYS HD2 . 11087 1 892 . 1 1 74 74 LYS HD3 H 1 1.482 0.030 . 2 . . . . 74 LYS HD3 . 11087 1 893 . 1 1 74 74 LYS HE2 H 1 2.671 0.030 . 2 . . . . 74 LYS HE2 . 11087 1 894 . 1 1 74 74 LYS HE3 H 1 2.513 0.030 . 2 . . . . 74 LYS HE3 . 11087 1 895 . 1 1 74 74 LYS HG2 H 1 1.046 0.030 . 1 . . . . 74 LYS HG2 . 11087 1 896 . 1 1 74 74 LYS HG3 H 1 1.046 0.030 . 1 . . . . 74 LYS HG3 . 11087 1 897 . 1 1 74 74 LYS C C 13 173.558 0.300 . 1 . . . . 74 LYS C . 11087 1 898 . 1 1 74 74 LYS CA C 13 54.884 0.300 . 1 . . . . 74 LYS CA . 11087 1 899 . 1 1 74 74 LYS CB C 13 33.887 0.300 . 1 . . . . 74 LYS CB . 11087 1 900 . 1 1 74 74 LYS CD C 13 29.162 0.300 . 1 . . . . 74 LYS CD . 11087 1 901 . 1 1 74 74 LYS CE C 13 41.910 0.300 . 1 . . . . 74 LYS CE . 11087 1 902 . 1 1 74 74 LYS CG C 13 25.412 0.300 . 1 . . . . 74 LYS CG . 11087 1 903 . 1 1 74 74 LYS N N 15 120.085 0.300 . 1 . . . . 74 LYS N . 11087 1 904 . 1 1 75 75 PHE H H 1 8.860 0.030 . 1 . . . . 75 PHE H . 11087 1 905 . 1 1 75 75 PHE HA H 1 4.335 0.030 . 1 . . . . 75 PHE HA . 11087 1 906 . 1 1 75 75 PHE HB2 H 1 2.788 0.030 . 2 . . . . 75 PHE HB2 . 11087 1 907 . 1 1 75 75 PHE HB3 H 1 2.611 0.030 . 2 . . . . 75 PHE HB3 . 11087 1 908 . 1 1 75 75 PHE HD1 H 1 6.514 0.030 . 1 . . . . 75 PHE HD1 . 11087 1 909 . 1 1 75 75 PHE HD2 H 1 6.514 0.030 . 1 . . . . 75 PHE HD2 . 11087 1 910 . 1 1 75 75 PHE HE1 H 1 7.064 0.030 . 1 . . . . 75 PHE HE1 . 11087 1 911 . 1 1 75 75 PHE HE2 H 1 7.064 0.030 . 1 . . . . 75 PHE HE2 . 11087 1 912 . 1 1 75 75 PHE HZ H 1 7.301 0.030 . 1 . . . . 75 PHE HZ . 11087 1 913 . 1 1 75 75 PHE C C 13 173.754 0.300 . 1 . . . . 75 PHE C . 11087 1 914 . 1 1 75 75 PHE CA C 13 55.694 0.300 . 1 . . . . 75 PHE CA . 11087 1 915 . 1 1 75 75 PHE CB C 13 39.088 0.300 . 1 . . . . 75 PHE CB . 11087 1 916 . 1 1 75 75 PHE CD1 C 13 131.867 0.300 . 1 . . . . 75 PHE CD1 . 11087 1 917 . 1 1 75 75 PHE CD2 C 13 131.867 0.300 . 1 . . . . 75 PHE CD2 . 11087 1 918 . 1 1 75 75 PHE CE1 C 13 130.312 0.300 . 1 . . . . 75 PHE CE1 . 11087 1 919 . 1 1 75 75 PHE CE2 C 13 130.312 0.300 . 1 . . . . 75 PHE CE2 . 11087 1 920 . 1 1 75 75 PHE CZ C 13 129.775 0.300 . 1 . . . . 75 PHE CZ . 11087 1 921 . 1 1 75 75 PHE N N 15 126.420 0.300 . 1 . . . . 75 PHE N . 11087 1 922 . 1 1 76 76 CYS H H 1 7.673 0.030 . 1 . . . . 76 CYS H . 11087 1 923 . 1 1 76 76 CYS HA H 1 5.848 0.030 . 1 . . . . 76 CYS HA . 11087 1 924 . 1 1 76 76 CYS HB2 H 1 3.333 0.030 . 2 . . . . 76 CYS HB2 . 11087 1 925 . 1 1 76 76 CYS HB3 H 1 3.171 0.030 . 2 . . . . 76 CYS HB3 . 11087 1 926 . 1 1 76 76 CYS C C 13 172.239 0.300 . 1 . . . . 76 CYS C . 11087 1 927 . 1 1 76 76 CYS CA C 13 56.573 0.300 . 1 . . . . 76 CYS CA . 11087 1 928 . 1 1 76 76 CYS CB C 13 29.615 0.300 . 1 . . . . 76 CYS CB . 11087 1 929 . 1 1 76 76 CYS N N 15 121.237 0.300 . 1 . . . . 76 CYS N . 11087 1 930 . 1 1 77 77 ILE H H 1 9.412 0.030 . 1 . . . . 77 ILE H . 11087 1 931 . 1 1 77 77 ILE HA H 1 4.183 0.030 . 1 . . . . 77 ILE HA . 11087 1 932 . 1 1 77 77 ILE HB H 1 1.821 0.030 . 1 . . . . 77 ILE HB . 11087 1 933 . 1 1 77 77 ILE HD11 H 1 0.774 0.030 . 1 . . . . 77 ILE HD1 . 11087 1 934 . 1 1 77 77 ILE HD12 H 1 0.774 0.030 . 1 . . . . 77 ILE HD1 . 11087 1 935 . 1 1 77 77 ILE HD13 H 1 0.774 0.030 . 1 . . . . 77 ILE HD1 . 11087 1 936 . 1 1 77 77 ILE HG12 H 1 1.101 0.030 . 2 . . . . 77 ILE HG12 . 11087 1 937 . 1 1 77 77 ILE HG13 H 1 1.784 0.030 . 2 . . . . 77 ILE HG13 . 11087 1 938 . 1 1 77 77 ILE HG21 H 1 0.806 0.030 . 1 . . . . 77 ILE HG2 . 11087 1 939 . 1 1 77 77 ILE HG22 H 1 0.806 0.030 . 1 . . . . 77 ILE HG2 . 11087 1 940 . 1 1 77 77 ILE HG23 H 1 0.806 0.030 . 1 . . . . 77 ILE HG2 . 11087 1 941 . 1 1 77 77 ILE C C 13 174.101 0.300 . 1 . . . . 77 ILE C . 11087 1 942 . 1 1 77 77 ILE CA C 13 61.112 0.300 . 1 . . . . 77 ILE CA . 11087 1 943 . 1 1 77 77 ILE CB C 13 41.761 0.300 . 1 . . . . 77 ILE CB . 11087 1 944 . 1 1 77 77 ILE CD1 C 13 14.803 0.300 . 1 . . . . 77 ILE CD1 . 11087 1 945 . 1 1 77 77 ILE CG1 C 13 28.191 0.300 . 1 . . . . 77 ILE CG1 . 11087 1 946 . 1 1 77 77 ILE CG2 C 13 17.625 0.300 . 1 . . . . 77 ILE CG2 . 11087 1 947 . 1 1 77 77 ILE N N 15 126.320 0.300 . 1 . . . . 77 ILE N . 11087 1 948 . 1 1 78 78 LYS H H 1 8.983 0.030 . 1 . . . . 78 LYS H . 11087 1 949 . 1 1 78 78 LYS HA H 1 4.617 0.030 . 1 . . . . 78 LYS HA . 11087 1 950 . 1 1 78 78 LYS HB2 H 1 1.694 0.030 . 2 . . . . 78 LYS HB2 . 11087 1 951 . 1 1 78 78 LYS HB3 H 1 1.437 0.030 . 2 . . . . 78 LYS HB3 . 11087 1 952 . 1 1 78 78 LYS HD2 H 1 1.282 0.030 . 2 . . . . 78 LYS HD2 . 11087 1 953 . 1 1 78 78 LYS HD3 H 1 1.427 0.030 . 2 . . . . 78 LYS HD3 . 11087 1 954 . 1 1 78 78 LYS HE2 H 1 2.485 0.030 . 2 . . . . 78 LYS HE2 . 11087 1 955 . 1 1 78 78 LYS HE3 H 1 2.591 0.030 . 2 . . . . 78 LYS HE3 . 11087 1 956 . 1 1 78 78 LYS HG2 H 1 0.574 0.030 . 2 . . . . 78 LYS HG2 . 11087 1 957 . 1 1 78 78 LYS HG3 H 1 0.400 0.030 . 2 . . . . 78 LYS HG3 . 11087 1 958 . 1 1 78 78 LYS C C 13 174.359 0.300 . 1 . . . . 78 LYS C . 11087 1 959 . 1 1 78 78 LYS CA C 13 55.377 0.300 . 1 . . . . 78 LYS CA . 11087 1 960 . 1 1 78 78 LYS CB C 13 33.331 0.300 . 1 . . . . 78 LYS CB . 11087 1 961 . 1 1 78 78 LYS CD C 13 29.775 0.300 . 1 . . . . 78 LYS CD . 11087 1 962 . 1 1 78 78 LYS CE C 13 41.985 0.300 . 1 . . . . 78 LYS CE . 11087 1 963 . 1 1 78 78 LYS CG C 13 24.680 0.300 . 1 . . . . 78 LYS CG . 11087 1 964 . 1 1 78 78 LYS N N 15 127.883 0.300 . 1 . . . . 78 LYS N . 11087 1 965 . 1 1 79 79 LEU H H 1 9.015 0.030 . 1 . . . . 79 LEU H . 11087 1 966 . 1 1 79 79 LEU HA H 1 5.202 0.030 . 1 . . . . 79 LEU HA . 11087 1 967 . 1 1 79 79 LEU HB2 H 1 1.923 0.030 . 2 . . . . 79 LEU HB2 . 11087 1 968 . 1 1 79 79 LEU HB3 H 1 1.046 0.030 . 2 . . . . 79 LEU HB3 . 11087 1 969 . 1 1 79 79 LEU HD11 H 1 0.855 0.030 . 1 . . . . 79 LEU HD1 . 11087 1 970 . 1 1 79 79 LEU HD12 H 1 0.855 0.030 . 1 . . . . 79 LEU HD1 . 11087 1 971 . 1 1 79 79 LEU HD13 H 1 0.855 0.030 . 1 . . . . 79 LEU HD1 . 11087 1 972 . 1 1 79 79 LEU HD21 H 1 0.745 0.030 . 1 . . . . 79 LEU HD2 . 11087 1 973 . 1 1 79 79 LEU HD22 H 1 0.745 0.030 . 1 . . . . 79 LEU HD2 . 11087 1 974 . 1 1 79 79 LEU HD23 H 1 0.745 0.030 . 1 . . . . 79 LEU HD2 . 11087 1 975 . 1 1 79 79 LEU HG H 1 1.565 0.030 . 1 . . . . 79 LEU HG . 11087 1 976 . 1 1 79 79 LEU C C 13 175.557 0.300 . 1 . . . . 79 LEU C . 11087 1 977 . 1 1 79 79 LEU CA C 13 53.055 0.300 . 1 . . . . 79 LEU CA . 11087 1 978 . 1 1 79 79 LEU CB C 13 44.104 0.300 . 1 . . . . 79 LEU CB . 11087 1 979 . 1 1 79 79 LEU CD1 C 13 25.646 0.300 . 2 . . . . 79 LEU CD1 . 11087 1 980 . 1 1 79 79 LEU CD2 C 13 25.865 0.300 . 2 . . . . 79 LEU CD2 . 11087 1 981 . 1 1 79 79 LEU CG C 13 26.600 0.300 . 1 . . . . 79 LEU CG . 11087 1 982 . 1 1 79 79 LEU N N 15 125.198 0.300 . 1 . . . . 79 LEU N . 11087 1 983 . 1 1 80 80 LEU H H 1 8.447 0.030 . 1 . . . . 80 LEU H . 11087 1 984 . 1 1 80 80 LEU HA H 1 5.034 0.030 . 1 . . . . 80 LEU HA . 11087 1 985 . 1 1 80 80 LEU HB2 H 1 1.740 0.030 . 2 . . . . 80 LEU HB2 . 11087 1 986 . 1 1 80 80 LEU HB3 H 1 1.607 0.030 . 2 . . . . 80 LEU HB3 . 11087 1 987 . 1 1 80 80 LEU HD11 H 1 0.817 0.030 . 1 . . . . 80 LEU HD1 . 11087 1 988 . 1 1 80 80 LEU HD12 H 1 0.817 0.030 . 1 . . . . 80 LEU HD1 . 11087 1 989 . 1 1 80 80 LEU HD13 H 1 0.817 0.030 . 1 . . . . 80 LEU HD1 . 11087 1 990 . 1 1 80 80 LEU HG H 1 1.462 0.030 . 1 . . . . 80 LEU HG . 11087 1 991 . 1 1 80 80 LEU C C 13 176.451 0.300 . 1 . . . . 80 LEU C . 11087 1 992 . 1 1 80 80 LEU CA C 13 54.110 0.300 . 1 . . . . 80 LEU CA . 11087 1 993 . 1 1 80 80 LEU CB C 13 42.442 0.300 . 1 . . . . 80 LEU CB . 11087 1 994 . 1 1 80 80 LEU CD1 C 13 25.026 0.300 . 2 . . . . 80 LEU CD1 . 11087 1 995 . 1 1 80 80 LEU CD2 C 13 25.026 0.300 . 2 . . . . 80 LEU CD2 . 11087 1 996 . 1 1 80 80 LEU CG C 13 27.771 0.300 . 1 . . . . 80 LEU CG . 11087 1 997 . 1 1 80 80 LEU N N 15 123.640 0.300 . 1 . . . . 80 LEU N . 11087 1 998 . 1 1 81 81 VAL H H 1 8.954 0.030 . 1 . . . . 81 VAL H . 11087 1 999 . 1 1 81 81 VAL HA H 1 4.580 0.030 . 1 . . . . 81 VAL HA . 11087 1 1000 . 1 1 81 81 VAL HB H 1 2.053 0.030 . 1 . . . . 81 VAL HB . 11087 1 1001 . 1 1 81 81 VAL HG11 H 1 1.000 0.030 . 1 . . . . 81 VAL HG1 . 11087 1 1002 . 1 1 81 81 VAL HG12 H 1 1.000 0.030 . 1 . . . . 81 VAL HG1 . 11087 1 1003 . 1 1 81 81 VAL HG13 H 1 1.000 0.030 . 1 . . . . 81 VAL HG1 . 11087 1 1004 . 1 1 81 81 VAL HG21 H 1 0.810 0.030 . 1 . . . . 81 VAL HG2 . 11087 1 1005 . 1 1 81 81 VAL HG22 H 1 0.810 0.030 . 1 . . . . 81 VAL HG2 . 11087 1 1006 . 1 1 81 81 VAL HG23 H 1 0.810 0.030 . 1 . . . . 81 VAL HG2 . 11087 1 1007 . 1 1 81 81 VAL C C 13 173.862 0.300 . 1 . . . . 81 VAL C . 11087 1 1008 . 1 1 81 81 VAL CA C 13 59.072 0.300 . 1 . . . . 81 VAL CA . 11087 1 1009 . 1 1 81 81 VAL CB C 13 34.565 0.300 . 1 . . . . 81 VAL CB . 11087 1 1010 . 1 1 81 81 VAL CG1 C 13 21.339 0.300 . 2 . . . . 81 VAL CG1 . 11087 1 1011 . 1 1 81 81 VAL CG2 C 13 21.257 0.300 . 2 . . . . 81 VAL CG2 . 11087 1 1012 . 1 1 81 81 VAL N N 15 125.525 0.300 . 1 . . . . 81 VAL N . 11087 1 1013 . 1 1 82 82 PRO HA H 1 4.785 0.030 . 1 . . . . 82 PRO HA . 11087 1 1014 . 1 1 82 82 PRO HB2 H 1 2.284 0.030 . 2 . . . . 82 PRO HB2 . 11087 1 1015 . 1 1 82 82 PRO HB3 H 1 1.964 0.030 . 2 . . . . 82 PRO HB3 . 11087 1 1016 . 1 1 82 82 PRO HD2 H 1 3.897 0.030 . 1 . . . . 82 PRO HD2 . 11087 1 1017 . 1 1 82 82 PRO HD3 H 1 3.897 0.030 . 1 . . . . 82 PRO HD3 . 11087 1 1018 . 1 1 82 82 PRO HG2 H 1 2.123 0.030 . 2 . . . . 82 PRO HG2 . 11087 1 1019 . 1 1 82 82 PRO HG3 H 1 1.931 0.030 . 2 . . . . 82 PRO HG3 . 11087 1 1020 . 1 1 82 82 PRO C C 13 175.739 0.300 . 1 . . . . 82 PRO C . 11087 1 1021 . 1 1 82 82 PRO CA C 13 63.786 0.300 . 1 . . . . 82 PRO CA . 11087 1 1022 . 1 1 82 82 PRO CB C 13 32.427 0.300 . 1 . . . . 82 PRO CB . 11087 1 1023 . 1 1 82 82 PRO CD C 13 51.395 0.300 . 1 . . . . 82 PRO CD . 11087 1 1024 . 1 1 82 82 PRO CG C 13 27.304 0.300 . 1 . . . . 82 PRO CG . 11087 1 1025 . 1 1 83 83 SER H H 1 8.214 0.030 . 1 . . . . 83 SER H . 11087 1 1026 . 1 1 83 83 SER HA H 1 5.008 0.030 . 1 . . . . 83 SER HA . 11087 1 1027 . 1 1 83 83 SER HB2 H 1 3.913 0.030 . 2 . . . . 83 SER HB2 . 11087 1 1028 . 1 1 83 83 SER HB3 H 1 4.199 0.030 . 2 . . . . 83 SER HB3 . 11087 1 1029 . 1 1 83 83 SER C C 13 173.717 0.300 . 1 . . . . 83 SER C . 11087 1 1030 . 1 1 83 83 SER CA C 13 57.453 0.300 . 1 . . . . 83 SER CA . 11087 1 1031 . 1 1 83 83 SER CB C 13 65.376 0.300 . 1 . . . . 83 SER CB . 11087 1 1032 . 1 1 83 83 SER N N 15 118.998 0.300 . 1 . . . . 83 SER N . 11087 1 1033 . 1 1 84 84 PRO HA H 1 4.378 0.030 . 1 . . . . 84 PRO HA . 11087 1 1034 . 1 1 84 84 PRO HB2 H 1 1.919 0.030 . 2 . . . . 84 PRO HB2 . 11087 1 1035 . 1 1 84 84 PRO HB3 H 1 2.438 0.030 . 2 . . . . 84 PRO HB3 . 11087 1 1036 . 1 1 84 84 PRO HD2 H 1 3.904 0.030 . 2 . . . . 84 PRO HD2 . 11087 1 1037 . 1 1 84 84 PRO HD3 H 1 3.828 0.030 . 2 . . . . 84 PRO HD3 . 11087 1 1038 . 1 1 84 84 PRO HG2 H 1 2.168 0.030 . 2 . . . . 84 PRO HG2 . 11087 1 1039 . 1 1 84 84 PRO HG3 H 1 1.996 0.030 . 2 . . . . 84 PRO HG3 . 11087 1 1040 . 1 1 84 84 PRO C C 13 177.551 0.300 . 1 . . . . 84 PRO C . 11087 1 1041 . 1 1 84 84 PRO CA C 13 65.229 0.300 . 1 . . . . 84 PRO CA . 11087 1 1042 . 1 1 84 84 PRO CB C 13 31.851 0.300 . 1 . . . . 84 PRO CB . 11087 1 1043 . 1 1 84 84 PRO CD C 13 50.939 0.300 . 1 . . . . 84 PRO CD . 11087 1 1044 . 1 1 84 84 PRO CG C 13 27.986 0.300 . 1 . . . . 84 PRO CG . 11087 1 1045 . 1 1 85 85 GLU H H 1 8.057 0.030 . 1 . . . . 85 GLU H . 11087 1 1046 . 1 1 85 85 GLU HA H 1 4.357 0.030 . 1 . . . . 85 GLU HA . 11087 1 1047 . 1 1 85 85 GLU HB2 H 1 1.857 0.030 . 2 . . . . 85 GLU HB2 . 11087 1 1048 . 1 1 85 85 GLU HB3 H 1 2.115 0.030 . 2 . . . . 85 GLU HB3 . 11087 1 1049 . 1 1 85 85 GLU HG2 H 1 2.244 0.030 . 2 . . . . 85 GLU HG2 . 11087 1 1050 . 1 1 85 85 GLU HG3 H 1 2.144 0.030 . 2 . . . . 85 GLU HG3 . 11087 1 1051 . 1 1 85 85 GLU C C 13 175.731 0.300 . 1 . . . . 85 GLU C . 11087 1 1052 . 1 1 85 85 GLU CA C 13 56.327 0.300 . 1 . . . . 85 GLU CA . 11087 1 1053 . 1 1 85 85 GLU CB C 13 29.690 0.300 . 1 . . . . 85 GLU CB . 11087 1 1054 . 1 1 85 85 GLU CG C 13 36.538 0.300 . 1 . . . . 85 GLU CG . 11087 1 1055 . 1 1 85 85 GLU N N 15 114.118 0.300 . 1 . . . . 85 GLU N . 11087 1 1056 . 1 1 86 86 GLY H H 1 7.710 0.030 . 1 . . . . 86 GLY H . 11087 1 1057 . 1 1 86 86 GLY HA2 H 1 3.699 0.030 . 2 . . . . 86 GLY HA2 . 11087 1 1058 . 1 1 86 86 GLY HA3 H 1 4.463 0.030 . 2 . . . . 86 GLY HA3 . 11087 1 1059 . 1 1 86 86 GLY C C 13 173.102 0.300 . 1 . . . . 86 GLY C . 11087 1 1060 . 1 1 86 86 GLY CA C 13 44.633 0.300 . 1 . . . . 86 GLY CA . 11087 1 1061 . 1 1 86 86 GLY N N 15 109.956 0.300 . 1 . . . . 86 GLY N . 11087 1 1062 . 1 1 87 87 MET H H 1 8.485 0.030 . 1 . . . . 87 MET H . 11087 1 1063 . 1 1 87 87 MET HA H 1 4.739 0.030 . 1 . . . . 87 MET HA . 11087 1 1064 . 1 1 87 87 MET HB2 H 1 1.978 0.030 . 2 . . . . 87 MET HB2 . 11087 1 1065 . 1 1 87 87 MET HB3 H 1 1.827 0.030 . 2 . . . . 87 MET HB3 . 11087 1 1066 . 1 1 87 87 MET HE1 H 1 2.002 0.030 . 1 . . . . 87 MET HE . 11087 1 1067 . 1 1 87 87 MET HE2 H 1 2.002 0.030 . 1 . . . . 87 MET HE . 11087 1 1068 . 1 1 87 87 MET HE3 H 1 2.002 0.030 . 1 . . . . 87 MET HE . 11087 1 1069 . 1 1 87 87 MET HG2 H 1 2.521 0.030 . 2 . . . . 87 MET HG2 . 11087 1 1070 . 1 1 87 87 MET HG3 H 1 2.334 0.030 . 2 . . . . 87 MET HG3 . 11087 1 1071 . 1 1 87 87 MET C C 13 176.545 0.300 . 1 . . . . 87 MET C . 11087 1 1072 . 1 1 87 87 MET CA C 13 54.955 0.300 . 1 . . . . 87 MET CA . 11087 1 1073 . 1 1 87 87 MET CB C 13 33.249 0.300 . 1 . . . . 87 MET CB . 11087 1 1074 . 1 1 87 87 MET CE C 13 17.166 0.300 . 1 . . . . 87 MET CE . 11087 1 1075 . 1 1 87 87 MET CG C 13 31.903 0.300 . 1 . . . . 87 MET CG . 11087 1 1076 . 1 1 87 87 MET N N 15 122.324 0.300 . 1 . . . . 87 MET N . 11087 1 1077 . 1 1 88 88 SER H H 1 8.905 0.030 . 1 . . . . 88 SER H . 11087 1 1078 . 1 1 88 88 SER HA H 1 4.774 0.030 . 1 . . . . 88 SER HA . 11087 1 1079 . 1 1 88 88 SER HB2 H 1 3.739 0.030 . 1 . . . . 88 SER HB2 . 11087 1 1080 . 1 1 88 88 SER HB3 H 1 3.739 0.030 . 1 . . . . 88 SER HB3 . 11087 1 1081 . 1 1 88 88 SER C C 13 172.468 0.300 . 1 . . . . 88 SER C . 11087 1 1082 . 1 1 88 88 SER CA C 13 57.875 0.300 . 1 . . . . 88 SER CA . 11087 1 1083 . 1 1 88 88 SER CB C 13 64.712 0.300 . 1 . . . . 88 SER CB . 11087 1 1084 . 1 1 88 88 SER N N 15 122.099 0.300 . 1 . . . . 88 SER N . 11087 1 1085 . 1 1 89 89 GLU H H 1 8.197 0.030 . 1 . . . . 89 GLU H . 11087 1 1086 . 1 1 89 89 GLU HA H 1 5.293 0.030 . 1 . . . . 89 GLU HA . 11087 1 1087 . 1 1 89 89 GLU HB2 H 1 1.823 0.030 . 2 . . . . 89 GLU HB2 . 11087 1 1088 . 1 1 89 89 GLU HB3 H 1 1.726 0.030 . 2 . . . . 89 GLU HB3 . 11087 1 1089 . 1 1 89 89 GLU HG2 H 1 1.974 0.030 . 2 . . . . 89 GLU HG2 . 11087 1 1090 . 1 1 89 89 GLU HG3 H 1 2.106 0.030 . 2 . . . . 89 GLU HG3 . 11087 1 1091 . 1 1 89 89 GLU C C 13 175.279 0.300 . 1 . . . . 89 GLU C . 11087 1 1092 . 1 1 89 89 GLU CA C 13 54.884 0.300 . 1 . . . . 89 GLU CA . 11087 1 1093 . 1 1 89 89 GLU CB C 13 32.647 0.300 . 1 . . . . 89 GLU CB . 11087 1 1094 . 1 1 89 89 GLU CG C 13 36.703 0.300 . 1 . . . . 89 GLU CG . 11087 1 1095 . 1 1 89 89 GLU N N 15 125.136 0.300 . 1 . . . . 89 GLU N . 11087 1 1096 . 1 1 90 90 ILE H H 1 8.845 0.030 . 1 . . . . 90 ILE H . 11087 1 1097 . 1 1 90 90 ILE HA H 1 4.522 0.030 . 1 . . . . 90 ILE HA . 11087 1 1098 . 1 1 90 90 ILE HB H 1 1.619 0.030 . 1 . . . . 90 ILE HB . 11087 1 1099 . 1 1 90 90 ILE HD11 H 1 0.617 0.030 . 1 . . . . 90 ILE HD1 . 11087 1 1100 . 1 1 90 90 ILE HD12 H 1 0.617 0.030 . 1 . . . . 90 ILE HD1 . 11087 1 1101 . 1 1 90 90 ILE HD13 H 1 0.617 0.030 . 1 . . . . 90 ILE HD1 . 11087 1 1102 . 1 1 90 90 ILE HG12 H 1 1.315 0.030 . 2 . . . . 90 ILE HG12 . 11087 1 1103 . 1 1 90 90 ILE HG13 H 1 0.873 0.030 . 2 . . . . 90 ILE HG13 . 11087 1 1104 . 1 1 90 90 ILE HG21 H 1 0.667 0.030 . 1 . . . . 90 ILE HG2 . 11087 1 1105 . 1 1 90 90 ILE HG22 H 1 0.667 0.030 . 1 . . . . 90 ILE HG2 . 11087 1 1106 . 1 1 90 90 ILE HG23 H 1 0.667 0.030 . 1 . . . . 90 ILE HG2 . 11087 1 1107 . 1 1 90 90 ILE C C 13 172.505 0.300 . 1 . . . . 90 ILE C . 11087 1 1108 . 1 1 90 90 ILE CA C 13 60.233 0.300 . 1 . . . . 90 ILE CA . 11087 1 1109 . 1 1 90 90 ILE CB C 13 41.719 0.300 . 1 . . . . 90 ILE CB . 11087 1 1110 . 1 1 90 90 ILE CD1 C 13 14.112 0.300 . 1 . . . . 90 ILE CD1 . 11087 1 1111 . 1 1 90 90 ILE CG1 C 13 27.979 0.300 . 1 . . . . 90 ILE CG1 . 11087 1 1112 . 1 1 90 90 ILE CG2 C 13 17.214 0.300 . 1 . . . . 90 ILE CG2 . 11087 1 1113 . 1 1 90 90 ILE N N 15 123.958 0.300 . 1 . . . . 90 ILE N . 11087 1 1114 . 1 1 91 91 TYR H H 1 8.836 0.030 . 1 . . . . 91 TYR H . 11087 1 1115 . 1 1 91 91 TYR HA H 1 5.628 0.030 . 1 . . . . 91 TYR HA . 11087 1 1116 . 1 1 91 91 TYR HB2 H 1 3.269 0.030 . 2 . . . . 91 TYR HB2 . 11087 1 1117 . 1 1 91 91 TYR HB3 H 1 3.144 0.030 . 2 . . . . 91 TYR HB3 . 11087 1 1118 . 1 1 91 91 TYR HD1 H 1 7.064 0.030 . 1 . . . . 91 TYR HD1 . 11087 1 1119 . 1 1 91 91 TYR HD2 H 1 7.064 0.030 . 1 . . . . 91 TYR HD2 . 11087 1 1120 . 1 1 91 91 TYR HE1 H 1 6.822 0.030 . 1 . . . . 91 TYR HE1 . 11087 1 1121 . 1 1 91 91 TYR HE2 H 1 6.822 0.030 . 1 . . . . 91 TYR HE2 . 11087 1 1122 . 1 1 91 91 TYR C C 13 175.303 0.300 . 1 . . . . 91 TYR C . 11087 1 1123 . 1 1 91 91 TYR CA C 13 55.096 0.300 . 1 . . . . 91 TYR CA . 11087 1 1124 . 1 1 91 91 TYR CB C 13 40.074 0.300 . 1 . . . . 91 TYR CB . 11087 1 1125 . 1 1 91 91 TYR CD1 C 13 132.403 0.300 . 1 . . . . 91 TYR CD1 . 11087 1 1126 . 1 1 91 91 TYR CD2 C 13 132.403 0.300 . 1 . . . . 91 TYR CD2 . 11087 1 1127 . 1 1 91 91 TYR CE1 C 13 118.113 0.300 . 1 . . . . 91 TYR CE1 . 11087 1 1128 . 1 1 91 91 TYR CE2 C 13 118.113 0.300 . 1 . . . . 91 TYR CE2 . 11087 1 1129 . 1 1 91 91 TYR N N 15 124.879 0.300 . 1 . . . . 91 TYR N . 11087 1 1130 . 1 1 92 92 LEU H H 1 9.514 0.030 . 1 . . . . 92 LEU H . 11087 1 1131 . 1 1 92 92 LEU HA H 1 5.043 0.030 . 1 . . . . 92 LEU HA . 11087 1 1132 . 1 1 92 92 LEU HB2 H 1 1.169 0.030 . 2 . . . . 92 LEU HB2 . 11087 1 1133 . 1 1 92 92 LEU HB3 H 1 1.819 0.030 . 2 . . . . 92 LEU HB3 . 11087 1 1134 . 1 1 92 92 LEU HD11 H 1 0.634 0.030 . 1 . . . . 92 LEU HD1 . 11087 1 1135 . 1 1 92 92 LEU HD12 H 1 0.634 0.030 . 1 . . . . 92 LEU HD1 . 11087 1 1136 . 1 1 92 92 LEU HD13 H 1 0.634 0.030 . 1 . . . . 92 LEU HD1 . 11087 1 1137 . 1 1 92 92 LEU HD21 H 1 0.491 0.030 . 1 . . . . 92 LEU HD2 . 11087 1 1138 . 1 1 92 92 LEU HD22 H 1 0.491 0.030 . 1 . . . . 92 LEU HD2 . 11087 1 1139 . 1 1 92 92 LEU HD23 H 1 0.491 0.030 . 1 . . . . 92 LEU HD2 . 11087 1 1140 . 1 1 92 92 LEU HG H 1 1.506 0.030 . 1 . . . . 92 LEU HG . 11087 1 1141 . 1 1 92 92 LEU C C 13 175.668 0.300 . 1 . . . . 92 LEU C . 11087 1 1142 . 1 1 92 92 LEU CA C 13 53.231 0.300 . 1 . . . . 92 LEU CA . 11087 1 1143 . 1 1 92 92 LEU CB C 13 43.611 0.300 . 1 . . . . 92 LEU CB . 11087 1 1144 . 1 1 92 92 LEU CD1 C 13 25.217 0.300 . 2 . . . . 92 LEU CD1 . 11087 1 1145 . 1 1 92 92 LEU CD2 C 13 24.358 0.300 . 2 . . . . 92 LEU CD2 . 11087 1 1146 . 1 1 92 92 LEU CG C 13 27.328 0.300 . 1 . . . . 92 LEU CG . 11087 1 1147 . 1 1 92 92 LEU N N 15 121.674 0.300 . 1 . . . . 92 LEU N . 11087 1 1148 . 1 1 93 93 ARG H H 1 9.655 0.030 . 1 . . . . 93 ARG H . 11087 1 1149 . 1 1 93 93 ARG HA H 1 5.101 0.030 . 1 . . . . 93 ARG HA . 11087 1 1150 . 1 1 93 93 ARG HB2 H 1 1.466 0.030 . 2 . . . . 93 ARG HB2 . 11087 1 1151 . 1 1 93 93 ARG HB3 H 1 1.619 0.030 . 2 . . . . 93 ARG HB3 . 11087 1 1152 . 1 1 93 93 ARG HD2 H 1 2.413 0.030 . 2 . . . . 93 ARG HD2 . 11087 1 1153 . 1 1 93 93 ARG HD3 H 1 2.232 0.030 . 2 . . . . 93 ARG HD3 . 11087 1 1154 . 1 1 93 93 ARG HG2 H 1 1.548 0.030 . 2 . . . . 93 ARG HG2 . 11087 1 1155 . 1 1 93 93 ARG HG3 H 1 1.395 0.030 . 2 . . . . 93 ARG HG3 . 11087 1 1156 . 1 1 93 93 ARG C C 13 176.383 0.300 . 1 . . . . 93 ARG C . 11087 1 1157 . 1 1 93 93 ARG CA C 13 55.874 0.300 . 1 . . . . 93 ARG CA . 11087 1 1158 . 1 1 93 93 ARG CB C 13 32.673 0.300 . 1 . . . . 93 ARG CB . 11087 1 1159 . 1 1 93 93 ARG CD C 13 43.611 0.300 . 1 . . . . 93 ARG CD . 11087 1 1160 . 1 1 93 93 ARG CG C 13 27.904 0.300 . 1 . . . . 93 ARG CG . 11087 1 1161 . 1 1 93 93 ARG N N 15 123.545 0.300 . 1 . . . . 93 ARG N . 11087 1 1162 . 1 1 94 94 CYS H H 1 8.809 0.030 . 1 . . . . 94 CYS H . 11087 1 1163 . 1 1 94 94 CYS HA H 1 4.742 0.030 . 1 . . . . 94 CYS HA . 11087 1 1164 . 1 1 94 94 CYS HB2 H 1 3.260 0.030 . 2 . . . . 94 CYS HB2 . 11087 1 1165 . 1 1 94 94 CYS HB3 H 1 3.034 0.030 . 2 . . . . 94 CYS HB3 . 11087 1 1166 . 1 1 94 94 CYS C C 13 174.439 0.300 . 1 . . . . 94 CYS C . 11087 1 1167 . 1 1 94 94 CYS CA C 13 58.227 0.300 . 1 . . . . 94 CYS CA . 11087 1 1168 . 1 1 94 94 CYS CB C 13 30.478 0.300 . 1 . . . . 94 CYS CB . 11087 1 1169 . 1 1 94 94 CYS N N 15 125.455 0.300 . 1 . . . . 94 CYS N . 11087 1 1170 . 1 1 95 95 GLN H H 1 9.441 0.030 . 1 . . . . 95 GLN H . 11087 1 1171 . 1 1 95 95 GLN HA H 1 4.231 0.030 . 1 . . . . 95 GLN HA . 11087 1 1172 . 1 1 95 95 GLN HB2 H 1 2.155 0.030 . 2 . . . . 95 GLN HB2 . 11087 1 1173 . 1 1 95 95 GLN HB3 H 1 2.021 0.030 . 2 . . . . 95 GLN HB3 . 11087 1 1174 . 1 1 95 95 GLN HE21 H 1 7.646 0.030 . 2 . . . . 95 GLN HE21 . 11087 1 1175 . 1 1 95 95 GLN HE22 H 1 6.938 0.030 . 2 . . . . 95 GLN HE22 . 11087 1 1176 . 1 1 95 95 GLN HG2 H 1 2.438 0.030 . 1 . . . . 95 GLN HG2 . 11087 1 1177 . 1 1 95 95 GLN HG3 H 1 2.438 0.030 . 1 . . . . 95 GLN HG3 . 11087 1 1178 . 1 1 95 95 GLN C C 13 175.458 0.300 . 1 . . . . 95 GLN C . 11087 1 1179 . 1 1 95 95 GLN CA C 13 57.787 0.300 . 1 . . . . 95 GLN CA . 11087 1 1180 . 1 1 95 95 GLN CB C 13 30.289 0.300 . 1 . . . . 95 GLN CB . 11087 1 1181 . 1 1 95 95 GLN CG C 13 33.457 0.300 . 1 . . . . 95 GLN CG . 11087 1 1182 . 1 1 95 95 GLN N N 15 119.730 0.300 . 1 . . . . 95 GLN N . 11087 1 1183 . 1 1 95 95 GLN NE2 N 15 112.177 0.300 . 1 . . . . 95 GLN NE2 . 11087 1 1184 . 1 1 96 96 ASP H H 1 7.160 0.030 . 1 . . . . 96 ASP H . 11087 1 1185 . 1 1 96 96 ASP HA H 1 4.231 0.030 . 1 . . . . 96 ASP HA . 11087 1 1186 . 1 1 96 96 ASP HB2 H 1 2.865 0.030 . 1 . . . . 96 ASP HB2 . 11087 1 1187 . 1 1 96 96 ASP HB3 H 1 2.865 0.030 . 1 . . . . 96 ASP HB3 . 11087 1 1188 . 1 1 96 96 ASP C C 13 174.276 0.300 . 1 . . . . 96 ASP C . 11087 1 1189 . 1 1 96 96 ASP CA C 13 52.351 0.300 . 1 . . . . 96 ASP CA . 11087 1 1190 . 1 1 96 96 ASP CB C 13 42.659 0.300 . 1 . . . . 96 ASP CB . 11087 1 1191 . 1 1 96 96 ASP N N 15 112.631 0.300 . 1 . . . . 96 ASP N . 11087 1 1192 . 1 1 97 97 GLU H H 1 9.168 0.030 . 1 . . . . 97 GLU H . 11087 1 1193 . 1 1 97 97 GLU HA H 1 3.084 0.030 . 1 . . . . 97 GLU HA . 11087 1 1194 . 1 1 97 97 GLU HB2 H 1 1.821 0.030 . 2 . . . . 97 GLU HB2 . 11087 1 1195 . 1 1 97 97 GLU HB3 H 1 1.750 0.030 . 2 . . . . 97 GLU HB3 . 11087 1 1196 . 1 1 97 97 GLU HG2 H 1 2.062 0.030 . 2 . . . . 97 GLU HG2 . 11087 1 1197 . 1 1 97 97 GLU HG3 H 1 2.237 0.030 . 2 . . . . 97 GLU HG3 . 11087 1 1198 . 1 1 97 97 GLU C C 13 176.995 0.300 . 1 . . . . 97 GLU C . 11087 1 1199 . 1 1 97 97 GLU CA C 13 59.705 0.300 . 1 . . . . 97 GLU CA . 11087 1 1200 . 1 1 97 97 GLU CB C 13 29.137 0.300 . 1 . . . . 97 GLU CB . 11087 1 1201 . 1 1 97 97 GLU CG C 13 36.621 0.300 . 1 . . . . 97 GLU CG . 11087 1 1202 . 1 1 97 97 GLU N N 15 117.849 0.300 . 1 . . . . 97 GLU N . 11087 1 1203 . 1 1 98 98 GLN H H 1 7.821 0.030 . 1 . . . . 98 GLN H . 11087 1 1204 . 1 1 98 98 GLN HA H 1 3.909 0.030 . 1 . . . . 98 GLN HA . 11087 1 1205 . 1 1 98 98 GLN HB2 H 1 2.143 0.030 . 1 . . . . 98 GLN HB2 . 11087 1 1206 . 1 1 98 98 GLN HB3 H 1 2.143 0.030 . 1 . . . . 98 GLN HB3 . 11087 1 1207 . 1 1 98 98 GLN HE21 H 1 7.705 0.030 . 2 . . . . 98 GLN HE21 . 11087 1 1208 . 1 1 98 98 GLN HE22 H 1 6.774 0.030 . 2 . . . . 98 GLN HE22 . 11087 1 1209 . 1 1 98 98 GLN HG2 H 1 2.438 0.030 . 1 . . . . 98 GLN HG2 . 11087 1 1210 . 1 1 98 98 GLN HG3 H 1 2.438 0.030 . 1 . . . . 98 GLN HG3 . 11087 1 1211 . 1 1 98 98 GLN C C 13 178.214 0.300 . 1 . . . . 98 GLN C . 11087 1 1212 . 1 1 98 98 GLN CA C 13 59.318 0.300 . 1 . . . . 98 GLN CA . 11087 1 1213 . 1 1 98 98 GLN CB C 13 27.575 0.300 . 1 . . . . 98 GLN CB . 11087 1 1214 . 1 1 98 98 GLN CG C 13 33.725 0.300 . 1 . . . . 98 GLN CG . 11087 1 1215 . 1 1 98 98 GLN N N 15 118.657 0.300 . 1 . . . . 98 GLN N . 11087 1 1216 . 1 1 98 98 GLN NE2 N 15 112.504 0.300 . 1 . . . . 98 GLN NE2 . 11087 1 1217 . 1 1 99 99 GLN H H 1 8.639 0.030 . 1 . . . . 99 GLN H . 11087 1 1218 . 1 1 99 99 GLN HA H 1 4.242 0.030 . 1 . . . . 99 GLN HA . 11087 1 1219 . 1 1 99 99 GLN HB2 H 1 2.421 0.030 . 2 . . . . 99 GLN HB2 . 11087 1 1220 . 1 1 99 99 GLN HB3 H 1 2.078 0.030 . 2 . . . . 99 GLN HB3 . 11087 1 1221 . 1 1 99 99 GLN HE21 H 1 7.021 0.030 . 2 . . . . 99 GLN HE21 . 11087 1 1222 . 1 1 99 99 GLN HE22 H 1 7.319 0.030 . 2 . . . . 99 GLN HE22 . 11087 1 1223 . 1 1 99 99 GLN HG2 H 1 2.703 0.030 . 2 . . . . 99 GLN HG2 . 11087 1 1224 . 1 1 99 99 GLN HG3 H 1 2.207 0.030 . 2 . . . . 99 GLN HG3 . 11087 1 1225 . 1 1 99 99 GLN C C 13 178.307 0.300 . 1 . . . . 99 GLN C . 11087 1 1226 . 1 1 99 99 GLN CA C 13 59.634 0.300 . 1 . . . . 99 GLN CA . 11087 1 1227 . 1 1 99 99 GLN CB C 13 31.687 0.300 . 1 . . . . 99 GLN CB . 11087 1 1228 . 1 1 99 99 GLN CG C 13 36.039 0.300 . 1 . . . . 99 GLN CG . 11087 1 1229 . 1 1 99 99 GLN N N 15 121.192 0.300 . 1 . . . . 99 GLN N . 11087 1 1230 . 1 1 99 99 GLN NE2 N 15 112.686 0.300 . 1 . . . . 99 GLN NE2 . 11087 1 1231 . 1 1 100 100 TYR H H 1 8.261 0.030 . 1 . . . . 100 TYR H . 11087 1 1232 . 1 1 100 100 TYR HA H 1 4.702 0.030 . 1 . . . . 100 TYR HA . 11087 1 1233 . 1 1 100 100 TYR HB2 H 1 2.893 0.030 . 2 . . . . 100 TYR HB2 . 11087 1 1234 . 1 1 100 100 TYR HB3 H 1 2.804 0.030 . 2 . . . . 100 TYR HB3 . 11087 1 1235 . 1 1 100 100 TYR HD1 H 1 6.809 0.030 . 1 . . . . 100 TYR HD1 . 11087 1 1236 . 1 1 100 100 TYR HD2 H 1 6.809 0.030 . 1 . . . . 100 TYR HD2 . 11087 1 1237 . 1 1 100 100 TYR HE1 H 1 6.755 0.030 . 1 . . . . 100 TYR HE1 . 11087 1 1238 . 1 1 100 100 TYR HE2 H 1 6.755 0.030 . 1 . . . . 100 TYR HE2 . 11087 1 1239 . 1 1 100 100 TYR C C 13 176.119 0.300 . 1 . . . . 100 TYR C . 11087 1 1240 . 1 1 100 100 TYR CA C 13 61.499 0.300 . 1 . . . . 100 TYR CA . 11087 1 1241 . 1 1 100 100 TYR CB C 13 39.067 0.300 . 1 . . . . 100 TYR CB . 11087 1 1242 . 1 1 100 100 TYR CD1 C 13 132.623 0.300 . 1 . . . . 100 TYR CD1 . 11087 1 1243 . 1 1 100 100 TYR CD2 C 13 132.623 0.300 . 1 . . . . 100 TYR CD2 . 11087 1 1244 . 1 1 100 100 TYR CE1 C 13 118.556 0.300 . 1 . . . . 100 TYR CE1 . 11087 1 1245 . 1 1 100 100 TYR CE2 C 13 118.556 0.300 . 1 . . . . 100 TYR CE2 . 11087 1 1246 . 1 1 100 100 TYR N N 15 117.153 0.300 . 1 . . . . 100 TYR N . 11087 1 1247 . 1 1 101 101 ALA H H 1 8.627 0.030 . 1 . . . . 101 ALA H . 11087 1 1248 . 1 1 101 101 ALA HA H 1 3.768 0.030 . 1 . . . . 101 ALA HA . 11087 1 1249 . 1 1 101 101 ALA HB1 H 1 1.583 0.030 . 1 . . . . 101 ALA HB . 11087 1 1250 . 1 1 101 101 ALA HB2 H 1 1.583 0.030 . 1 . . . . 101 ALA HB . 11087 1 1251 . 1 1 101 101 ALA HB3 H 1 1.583 0.030 . 1 . . . . 101 ALA HB . 11087 1 1252 . 1 1 101 101 ALA C C 13 179.139 0.300 . 1 . . . . 101 ALA C . 11087 1 1253 . 1 1 101 101 ALA CA C 13 56.010 0.300 . 1 . . . . 101 ALA CA . 11087 1 1254 . 1 1 101 101 ALA CB C 13 19.076 0.300 . 1 . . . . 101 ALA CB . 11087 1 1255 . 1 1 101 101 ALA N N 15 120.850 0.300 . 1 . . . . 101 ALA N . 11087 1 1256 . 1 1 102 102 ARG H H 1 7.620 0.030 . 1 . . . . 102 ARG H . 11087 1 1257 . 1 1 102 102 ARG HA H 1 4.045 0.030 . 1 . . . . 102 ARG HA . 11087 1 1258 . 1 1 102 102 ARG HB2 H 1 1.770 0.030 . 2 . . . . 102 ARG HB2 . 11087 1 1259 . 1 1 102 102 ARG HB3 H 1 2.033 0.030 . 2 . . . . 102 ARG HB3 . 11087 1 1260 . 1 1 102 102 ARG HD2 H 1 3.291 0.030 . 1 . . . . 102 ARG HD2 . 11087 1 1261 . 1 1 102 102 ARG HD3 H 1 3.291 0.030 . 1 . . . . 102 ARG HD3 . 11087 1 1262 . 1 1 102 102 ARG HG2 H 1 1.712 0.030 . 2 . . . . 102 ARG HG2 . 11087 1 1263 . 1 1 102 102 ARG HG3 H 1 1.970 0.030 . 2 . . . . 102 ARG HG3 . 11087 1 1264 . 1 1 102 102 ARG C C 13 180.339 0.300 . 1 . . . . 102 ARG C . 11087 1 1265 . 1 1 102 102 ARG CA C 13 59.529 0.300 . 1 . . . . 102 ARG CA . 11087 1 1266 . 1 1 102 102 ARG CB C 13 30.367 0.300 . 1 . . . . 102 ARG CB . 11087 1 1267 . 1 1 102 102 ARG CD C 13 43.693 0.300 . 1 . . . . 102 ARG CD . 11087 1 1268 . 1 1 102 102 ARG CG C 13 28.457 0.300 . 1 . . . . 102 ARG CG . 11087 1 1269 . 1 1 102 102 ARG N N 15 114.097 0.300 . 1 . . . . 102 ARG N . 11087 1 1270 . 1 1 103 103 TRP H H 1 8.214 0.030 . 1 . . . . 103 TRP H . 11087 1 1271 . 1 1 103 103 TRP HA H 1 3.820 0.030 . 1 . . . . 103 TRP HA . 11087 1 1272 . 1 1 103 103 TRP HB2 H 1 3.010 0.030 . 2 . . . . 103 TRP HB2 . 11087 1 1273 . 1 1 103 103 TRP HB3 H 1 2.756 0.030 . 2 . . . . 103 TRP HB3 . 11087 1 1274 . 1 1 103 103 TRP HD1 H 1 7.819 0.030 . 1 . . . . 103 TRP HD1 . 11087 1 1275 . 1 1 103 103 TRP HE1 H 1 11.181 0.030 . 1 . . . . 103 TRP HE1 . 11087 1 1276 . 1 1 103 103 TRP HE3 H 1 6.899 0.030 . 1 . . . . 103 TRP HE3 . 11087 1 1277 . 1 1 103 103 TRP HH2 H 1 6.644 0.030 . 1 . . . . 103 TRP HH2 . 11087 1 1278 . 1 1 103 103 TRP HZ2 H 1 6.934 0.030 . 1 . . . . 103 TRP HZ2 . 11087 1 1279 . 1 1 103 103 TRP HZ3 H 1 6.620 0.030 . 1 . . . . 103 TRP HZ3 . 11087 1 1280 . 1 1 103 103 TRP C C 13 178.216 0.300 . 1 . . . . 103 TRP C . 11087 1 1281 . 1 1 103 103 TRP CA C 13 61.475 0.300 . 1 . . . . 103 TRP CA . 11087 1 1282 . 1 1 103 103 TRP CB C 13 28.065 0.300 . 1 . . . . 103 TRP CB . 11087 1 1283 . 1 1 103 103 TRP CD1 C 13 127.086 0.300 . 1 . . . . 103 TRP CD1 . 11087 1 1284 . 1 1 103 103 TRP CE3 C 13 118.408 0.300 . 1 . . . . 103 TRP CE3 . 11087 1 1285 . 1 1 103 103 TRP CH2 C 13 124.338 0.300 . 1 . . . . 103 TRP CH2 . 11087 1 1286 . 1 1 103 103 TRP CZ2 C 13 114.477 0.300 . 1 . . . . 103 TRP CZ2 . 11087 1 1287 . 1 1 103 103 TRP CZ3 C 13 121.738 0.300 . 1 . . . . 103 TRP CZ3 . 11087 1 1288 . 1 1 103 103 TRP N N 15 120.813 0.300 . 1 . . . . 103 TRP N . 11087 1 1289 . 1 1 103 103 TRP NE1 N 15 129.860 0.300 . 1 . . . . 103 TRP NE1 . 11087 1 1290 . 1 1 104 104 MET H H 1 9.799 0.030 . 1 . . . . 104 MET H . 11087 1 1291 . 1 1 104 104 MET HA H 1 4.072 0.030 . 1 . . . . 104 MET HA . 11087 1 1292 . 1 1 104 104 MET HB2 H 1 1.591 0.030 . 2 . . . . 104 MET HB2 . 11087 1 1293 . 1 1 104 104 MET HB3 H 1 1.181 0.030 . 2 . . . . 104 MET HB3 . 11087 1 1294 . 1 1 104 104 MET HE1 H 1 2.002 0.030 . 1 . . . . 104 MET HE . 11087 1 1295 . 1 1 104 104 MET HE2 H 1 2.002 0.030 . 1 . . . . 104 MET HE . 11087 1 1296 . 1 1 104 104 MET HE3 H 1 2.002 0.030 . 1 . . . . 104 MET HE . 11087 1 1297 . 1 1 104 104 MET HG2 H 1 2.358 0.030 . 2 . . . . 104 MET HG2 . 11087 1 1298 . 1 1 104 104 MET HG3 H 1 2.140 0.030 . 2 . . . . 104 MET HG3 . 11087 1 1299 . 1 1 104 104 MET C C 13 178.013 0.300 . 1 . . . . 104 MET C . 11087 1 1300 . 1 1 104 104 MET CA C 13 58.403 0.300 . 1 . . . . 104 MET CA . 11087 1 1301 . 1 1 104 104 MET CB C 13 31.358 0.300 . 1 . . . . 104 MET CB . 11087 1 1302 . 1 1 104 104 MET CE C 13 19.203 0.300 . 1 . . . . 104 MET CE . 11087 1 1303 . 1 1 104 104 MET CG C 13 32.908 0.300 . 1 . . . . 104 MET CG . 11087 1 1304 . 1 1 104 104 MET N N 15 122.513 0.300 . 1 . . . . 104 MET N . 11087 1 1305 . 1 1 105 105 ALA H H 1 7.955 0.030 . 1 . . . . 105 ALA H . 11087 1 1306 . 1 1 105 105 ALA HA H 1 3.873 0.030 . 1 . . . . 105 ALA HA . 11087 1 1307 . 1 1 105 105 ALA HB1 H 1 1.258 0.030 . 1 . . . . 105 ALA HB . 11087 1 1308 . 1 1 105 105 ALA HB2 H 1 1.258 0.030 . 1 . . . . 105 ALA HB . 11087 1 1309 . 1 1 105 105 ALA HB3 H 1 1.258 0.030 . 1 . . . . 105 ALA HB . 11087 1 1310 . 1 1 105 105 ALA C C 13 179.712 0.300 . 1 . . . . 105 ALA C . 11087 1 1311 . 1 1 105 105 ALA CA C 13 55.792 0.300 . 1 . . . . 105 ALA CA . 11087 1 1312 . 1 1 105 105 ALA CB C 13 20.174 0.300 . 1 . . . . 105 ALA CB . 11087 1 1313 . 1 1 105 105 ALA N N 15 119.614 0.300 . 1 . . . . 105 ALA N . 11087 1 1314 . 1 1 106 106 GLY H H 1 7.447 0.030 . 1 . . . . 106 GLY H . 11087 1 1315 . 1 1 106 106 GLY HA2 H 1 3.630 0.030 . 2 . . . . 106 GLY HA2 . 11087 1 1316 . 1 1 106 106 GLY HA3 H 1 3.567 0.030 . 2 . . . . 106 GLY HA3 . 11087 1 1317 . 1 1 106 106 GLY C C 13 175.238 0.300 . 1 . . . . 106 GLY C . 11087 1 1318 . 1 1 106 106 GLY CA C 13 47.214 0.300 . 1 . . . . 106 GLY CA . 11087 1 1319 . 1 1 106 106 GLY N N 15 103.199 0.300 . 1 . . . . 106 GLY N . 11087 1 1320 . 1 1 107 107 CYS H H 1 8.645 0.030 . 1 . . . . 107 CYS H . 11087 1 1321 . 1 1 107 107 CYS HA H 1 3.908 0.030 . 1 . . . . 107 CYS HA . 11087 1 1322 . 1 1 107 107 CYS HB2 H 1 2.366 0.030 . 2 . . . . 107 CYS HB2 . 11087 1 1323 . 1 1 107 107 CYS HB3 H 1 3.062 0.030 . 2 . . . . 107 CYS HB3 . 11087 1 1324 . 1 1 107 107 CYS C C 13 176.463 0.300 . 1 . . . . 107 CYS C . 11087 1 1325 . 1 1 107 107 CYS CA C 13 64.877 0.300 . 1 . . . . 107 CYS CA . 11087 1 1326 . 1 1 107 107 CYS CB C 13 27.015 0.300 . 1 . . . . 107 CYS CB . 11087 1 1327 . 1 1 107 107 CYS N N 15 120.940 0.300 . 1 . . . . 107 CYS N . 11087 1 1328 . 1 1 108 108 ARG H H 1 8.617 0.030 . 1 . . . . 108 ARG H . 11087 1 1329 . 1 1 108 108 ARG HA H 1 3.792 0.030 . 1 . . . . 108 ARG HA . 11087 1 1330 . 1 1 108 108 ARG HB2 H 1 1.835 0.030 . 1 . . . . 108 ARG HB2 . 11087 1 1331 . 1 1 108 108 ARG HB3 H 1 1.835 0.030 . 1 . . . . 108 ARG HB3 . 11087 1 1332 . 1 1 108 108 ARG HD2 H 1 3.099 0.030 . 2 . . . . 108 ARG HD2 . 11087 1 1333 . 1 1 108 108 ARG HD3 H 1 3.007 0.030 . 2 . . . . 108 ARG HD3 . 11087 1 1334 . 1 1 108 108 ARG HG2 H 1 1.589 0.030 . 2 . . . . 108 ARG HG2 . 11087 1 1335 . 1 1 108 108 ARG HG3 H 1 1.835 0.030 . 2 . . . . 108 ARG HG3 . 11087 1 1336 . 1 1 108 108 ARG C C 13 180.174 0.300 . 1 . . . . 108 ARG C . 11087 1 1337 . 1 1 108 108 ARG CA C 13 60.197 0.300 . 1 . . . . 108 ARG CA . 11087 1 1338 . 1 1 108 108 ARG CB C 13 30.371 0.300 . 1 . . . . 108 ARG CB . 11087 1 1339 . 1 1 108 108 ARG CD C 13 44.022 0.300 . 1 . . . . 108 ARG CD . 11087 1 1340 . 1 1 108 108 ARG CG C 13 27.973 0.300 . 1 . . . . 108 ARG CG . 11087 1 1341 . 1 1 108 108 ARG N N 15 118.932 0.300 . 1 . . . . 108 ARG N . 11087 1 1342 . 1 1 109 109 LEU H H 1 7.822 0.030 . 1 . . . . 109 LEU H . 11087 1 1343 . 1 1 109 109 LEU HA H 1 3.880 0.030 . 1 . . . . 109 LEU HA . 11087 1 1344 . 1 1 109 109 LEU HB2 H 1 1.714 0.030 . 2 . . . . 109 LEU HB2 . 11087 1 1345 . 1 1 109 109 LEU HB3 H 1 1.290 0.030 . 2 . . . . 109 LEU HB3 . 11087 1 1346 . 1 1 109 109 LEU HD11 H 1 0.890 0.030 . 1 . . . . 109 LEU HD1 . 11087 1 1347 . 1 1 109 109 LEU HD12 H 1 0.890 0.030 . 1 . . . . 109 LEU HD1 . 11087 1 1348 . 1 1 109 109 LEU HD13 H 1 0.890 0.030 . 1 . . . . 109 LEU HD1 . 11087 1 1349 . 1 1 109 109 LEU HD21 H 1 0.807 0.030 . 1 . . . . 109 LEU HD2 . 11087 1 1350 . 1 1 109 109 LEU HD22 H 1 0.807 0.030 . 1 . . . . 109 LEU HD2 . 11087 1 1351 . 1 1 109 109 LEU HD23 H 1 0.807 0.030 . 1 . . . . 109 LEU HD2 . 11087 1 1352 . 1 1 109 109 LEU HG H 1 1.637 0.030 . 1 . . . . 109 LEU HG . 11087 1 1353 . 1 1 109 109 LEU C C 13 179.315 0.300 . 1 . . . . 109 LEU C . 11087 1 1354 . 1 1 109 109 LEU CA C 13 59.318 0.300 . 1 . . . . 109 LEU CA . 11087 1 1355 . 1 1 109 109 LEU CB C 13 40.442 0.300 . 1 . . . . 109 LEU CB . 11087 1 1356 . 1 1 109 109 LEU CD1 C 13 24.961 0.300 . 2 . . . . 109 LEU CD1 . 11087 1 1357 . 1 1 109 109 LEU CD2 C 13 24.303 0.300 . 2 . . . . 109 LEU CD2 . 11087 1 1358 . 1 1 109 109 LEU CG C 13 29.549 0.300 . 1 . . . . 109 LEU CG . 11087 1 1359 . 1 1 109 109 LEU N N 15 121.458 0.300 . 1 . . . . 109 LEU N . 11087 1 1360 . 1 1 110 110 ALA H H 1 8.361 0.030 . 1 . . . . 110 ALA H . 11087 1 1361 . 1 1 110 110 ALA HA H 1 4.620 0.030 . 1 . . . . 110 ALA HA . 11087 1 1362 . 1 1 110 110 ALA HB1 H 1 1.669 0.030 . 1 . . . . 110 ALA HB . 11087 1 1363 . 1 1 110 110 ALA HB2 H 1 1.669 0.030 . 1 . . . . 110 ALA HB . 11087 1 1364 . 1 1 110 110 ALA HB3 H 1 1.669 0.030 . 1 . . . . 110 ALA HB . 11087 1 1365 . 1 1 110 110 ALA C C 13 181.554 0.300 . 1 . . . . 110 ALA C . 11087 1 1366 . 1 1 110 110 ALA CA C 13 54.955 0.300 . 1 . . . . 110 ALA CA . 11087 1 1367 . 1 1 110 110 ALA CB C 13 19.568 0.300 . 1 . . . . 110 ALA CB . 11087 1 1368 . 1 1 110 110 ALA N N 15 122.819 0.300 . 1 . . . . 110 ALA N . 11087 1 1369 . 1 1 111 111 SER H H 1 8.232 0.030 . 1 . . . . 111 SER H . 11087 1 1370 . 1 1 111 111 SER HA H 1 4.883 0.030 . 1 . . . . 111 SER HA . 11087 1 1371 . 1 1 111 111 SER HB2 H 1 3.998 0.030 . 2 . . . . 111 SER HB2 . 11087 1 1372 . 1 1 111 111 SER HB3 H 1 4.314 0.030 . 2 . . . . 111 SER HB3 . 11087 1 1373 . 1 1 111 111 SER C C 13 177.533 0.300 . 1 . . . . 111 SER C . 11087 1 1374 . 1 1 111 111 SER CA C 13 60.936 0.300 . 1 . . . . 111 SER CA . 11087 1 1375 . 1 1 111 111 SER CB C 13 63.375 0.300 . 1 . . . . 111 SER CB . 11087 1 1376 . 1 1 111 111 SER N N 15 114.116 0.300 . 1 . . . . 111 SER N . 11087 1 1377 . 1 1 112 112 LYS H H 1 7.372 0.030 . 1 . . . . 112 LYS H . 11087 1 1378 . 1 1 112 112 LYS HA H 1 4.611 0.030 . 1 . . . . 112 LYS HA . 11087 1 1379 . 1 1 112 112 LYS HB2 H 1 1.901 0.030 . 2 . . . . 112 LYS HB2 . 11087 1 1380 . 1 1 112 112 LYS HB3 H 1 2.197 0.030 . 2 . . . . 112 LYS HB3 . 11087 1 1381 . 1 1 112 112 LYS HD2 H 1 1.700 0.030 . 2 . . . . 112 LYS HD2 . 11087 1 1382 . 1 1 112 112 LYS HD3 H 1 1.625 0.030 . 2 . . . . 112 LYS HD3 . 11087 1 1383 . 1 1 112 112 LYS HE2 H 1 2.946 0.030 . 1 . . . . 112 LYS HE2 . 11087 1 1384 . 1 1 112 112 LYS HE3 H 1 2.946 0.030 . 1 . . . . 112 LYS HE3 . 11087 1 1385 . 1 1 112 112 LYS HG2 H 1 1.593 0.030 . 1 . . . . 112 LYS HG2 . 11087 1 1386 . 1 1 112 112 LYS HG3 H 1 1.593 0.030 . 1 . . . . 112 LYS HG3 . 11087 1 1387 . 1 1 112 112 LYS C C 13 176.641 0.300 . 1 . . . . 112 LYS C . 11087 1 1388 . 1 1 112 112 LYS CA C 13 55.025 0.300 . 1 . . . . 112 LYS CA . 11087 1 1389 . 1 1 112 112 LYS CB C 13 32.345 0.300 . 1 . . . . 112 LYS CB . 11087 1 1390 . 1 1 112 112 LYS CD C 13 28.726 0.300 . 1 . . . . 112 LYS CD . 11087 1 1391 . 1 1 112 112 LYS CE C 13 42.541 0.300 . 1 . . . . 112 LYS CE . 11087 1 1392 . 1 1 112 112 LYS CG C 13 24.688 0.300 . 1 . . . . 112 LYS CG . 11087 1 1393 . 1 1 112 112 LYS N N 15 119.766 0.300 . 1 . . . . 112 LYS N . 11087 1 1394 . 1 1 113 113 GLY H H 1 8.469 0.030 . 1 . . . . 113 GLY H . 11087 1 1395 . 1 1 113 113 GLY HA2 H 1 3.538 0.030 . 2 . . . . 113 GLY HA2 . 11087 1 1396 . 1 1 113 113 GLY HA3 H 1 4.260 0.030 . 2 . . . . 113 GLY HA3 . 11087 1 1397 . 1 1 113 113 GLY C C 13 173.445 0.300 . 1 . . . . 113 GLY C . 11087 1 1398 . 1 1 113 113 GLY CA C 13 45.771 0.300 . 1 . . . . 113 GLY CA . 11087 1 1399 . 1 1 113 113 GLY N N 15 107.932 0.300 . 1 . . . . 113 GLY N . 11087 1 1400 . 1 1 114 114 ARG H H 1 8.177 0.030 . 1 . . . . 114 ARG H . 11087 1 1401 . 1 1 114 114 ARG HA H 1 4.614 0.030 . 1 . . . . 114 ARG HA . 11087 1 1402 . 1 1 114 114 ARG HB2 H 1 1.893 0.030 . 2 . . . . 114 ARG HB2 . 11087 1 1403 . 1 1 114 114 ARG HB3 H 1 1.540 0.030 . 2 . . . . 114 ARG HB3 . 11087 1 1404 . 1 1 114 114 ARG HD2 H 1 3.080 0.030 . 1 . . . . 114 ARG HD2 . 11087 1 1405 . 1 1 114 114 ARG HD3 H 1 3.080 0.030 . 1 . . . . 114 ARG HD3 . 11087 1 1406 . 1 1 114 114 ARG HG2 H 1 1.637 0.030 . 2 . . . . 114 ARG HG2 . 11087 1 1407 . 1 1 114 114 ARG HG3 H 1 1.560 0.030 . 2 . . . . 114 ARG HG3 . 11087 1 1408 . 1 1 114 114 ARG C C 13 173.674 0.300 . 1 . . . . 114 ARG C . 11087 1 1409 . 1 1 114 114 ARG CA C 13 54.321 0.300 . 1 . . . . 114 ARG CA . 11087 1 1410 . 1 1 114 114 ARG CB C 13 32.673 0.300 . 1 . . . . 114 ARG CB . 11087 1 1411 . 1 1 114 114 ARG CD C 13 43.632 0.300 . 1 . . . . 114 ARG CD . 11087 1 1412 . 1 1 114 114 ARG CG C 13 27.082 0.300 . 1 . . . . 114 ARG CG . 11087 1 1413 . 1 1 114 114 ARG N N 15 121.243 0.300 . 1 . . . . 114 ARG N . 11087 1 1414 . 1 1 115 115 THR H H 1 7.979 0.030 . 1 . . . . 115 THR H . 11087 1 1415 . 1 1 115 115 THR HA H 1 4.655 0.030 . 1 . . . . 115 THR HA . 11087 1 1416 . 1 1 115 115 THR HB H 1 4.511 0.030 . 1 . . . . 115 THR HB . 11087 1 1417 . 1 1 115 115 THR HG21 H 1 1.069 0.030 . 1 . . . . 115 THR HG2 . 11087 1 1418 . 1 1 115 115 THR HG22 H 1 1.069 0.030 . 1 . . . . 115 THR HG2 . 11087 1 1419 . 1 1 115 115 THR HG23 H 1 1.069 0.030 . 1 . . . . 115 THR HG2 . 11087 1 1420 . 1 1 115 115 THR C C 13 175.400 0.300 . 1 . . . . 115 THR C . 11087 1 1421 . 1 1 115 115 THR CA C 13 59.318 0.300 . 1 . . . . 115 THR CA . 11087 1 1422 . 1 1 115 115 THR CB C 13 72.097 0.300 . 1 . . . . 115 THR CB . 11087 1 1423 . 1 1 115 115 THR CG2 C 13 20.759 0.300 . 1 . . . . 115 THR CG2 . 11087 1 1424 . 1 1 115 115 THR N N 15 107.439 0.300 . 1 . . . . 115 THR N . 11087 1 1425 . 1 1 116 116 MET H H 1 9.118 0.030 . 1 . . . . 116 MET H . 11087 1 1426 . 1 1 116 116 MET HA H 1 3.517 0.030 . 1 . . . . 116 MET HA . 11087 1 1427 . 1 1 116 116 MET HB2 H 1 1.153 0.030 . 2 . . . . 116 MET HB2 . 11087 1 1428 . 1 1 116 116 MET HB3 H 1 1.323 0.030 . 2 . . . . 116 MET HB3 . 11087 1 1429 . 1 1 116 116 MET HE1 H 1 1.288 0.030 . 1 . . . . 116 MET HE . 11087 1 1430 . 1 1 116 116 MET HE2 H 1 1.288 0.030 . 1 . . . . 116 MET HE . 11087 1 1431 . 1 1 116 116 MET HE3 H 1 1.288 0.030 . 1 . . . . 116 MET HE . 11087 1 1432 . 1 1 116 116 MET HG2 H 1 2.309 0.030 . 2 . . . . 116 MET HG2 . 11087 1 1433 . 1 1 116 116 MET HG3 H 1 1.375 0.030 . 2 . . . . 116 MET HG3 . 11087 1 1434 . 1 1 116 116 MET C C 13 174.489 0.300 . 1 . . . . 116 MET C . 11087 1 1435 . 1 1 116 116 MET CA C 13 57.575 0.300 . 1 . . . . 116 MET CA . 11087 1 1436 . 1 1 116 116 MET CB C 13 33.202 0.300 . 1 . . . . 116 MET CB . 11087 1 1437 . 1 1 116 116 MET CE C 13 15.915 0.300 . 1 . . . . 116 MET CE . 11087 1 1438 . 1 1 116 116 MET CG C 13 32.033 0.300 . 1 . . . . 116 MET CG . 11087 1 1439 . 1 1 116 116 MET N N 15 116.428 0.300 . 1 . . . . 116 MET N . 11087 1 1440 . 1 1 117 117 ALA H H 1 7.745 0.030 . 1 . . . . 117 ALA H . 11087 1 1441 . 1 1 117 117 ALA HA H 1 4.157 0.030 . 1 . . . . 117 ALA HA . 11087 1 1442 . 1 1 117 117 ALA HB1 H 1 1.260 0.030 . 1 . . . . 117 ALA HB . 11087 1 1443 . 1 1 117 117 ALA HB2 H 1 1.260 0.030 . 1 . . . . 117 ALA HB . 11087 1 1444 . 1 1 117 117 ALA HB3 H 1 1.260 0.030 . 1 . . . . 117 ALA HB . 11087 1 1445 . 1 1 117 117 ALA C C 13 177.797 0.300 . 1 . . . . 117 ALA C . 11087 1 1446 . 1 1 117 117 ALA CA C 13 52.175 0.300 . 1 . . . . 117 ALA CA . 11087 1 1447 . 1 1 117 117 ALA CB C 13 18.940 0.300 . 1 . . . . 117 ALA CB . 11087 1 1448 . 1 1 117 117 ALA N N 15 118.448 0.300 . 1 . . . . 117 ALA N . 11087 1 1449 . 1 1 118 118 ASP H H 1 7.878 0.030 . 1 . . . . 118 ASP H . 11087 1 1450 . 1 1 118 118 ASP HA H 1 4.404 0.030 . 1 . . . . 118 ASP HA . 11087 1 1451 . 1 1 118 118 ASP HB2 H 1 3.072 0.030 . 2 . . . . 118 ASP HB2 . 11087 1 1452 . 1 1 118 118 ASP HB3 H 1 2.688 0.030 . 2 . . . . 118 ASP HB3 . 11087 1 1453 . 1 1 118 118 ASP C C 13 177.908 0.300 . 1 . . . . 118 ASP C . 11087 1 1454 . 1 1 118 118 ASP CA C 13 55.412 0.300 . 1 . . . . 118 ASP CA . 11087 1 1455 . 1 1 118 118 ASP CB C 13 44.186 0.300 . 1 . . . . 118 ASP CB . 11087 1 1456 . 1 1 118 118 ASP N N 15 120.882 0.300 . 1 . . . . 118 ASP N . 11087 1 1457 . 1 1 119 119 SER HA H 1 4.274 0.030 . 1 . . . . 119 SER HA . 11087 1 1458 . 1 1 119 119 SER HB2 H 1 4.021 0.030 . 1 . . . . 119 SER HB2 . 11087 1 1459 . 1 1 119 119 SER HB3 H 1 4.021 0.030 . 1 . . . . 119 SER HB3 . 11087 1 1460 . 1 1 119 119 SER C C 13 175.519 0.300 . 1 . . . . 119 SER C . 11087 1 1461 . 1 1 119 119 SER CA C 13 61.253 0.300 . 1 . . . . 119 SER CA . 11087 1 1462 . 1 1 119 119 SER CB C 13 62.853 0.300 . 1 . . . . 119 SER CB . 11087 1 1463 . 1 1 120 120 SER H H 1 9.004 0.030 . 1 . . . . 120 SER H . 11087 1 1464 . 1 1 120 120 SER HA H 1 4.489 0.030 . 1 . . . . 120 SER HA . 11087 1 1465 . 1 1 120 120 SER HB2 H 1 4.032 0.030 . 2 . . . . 120 SER HB2 . 11087 1 1466 . 1 1 120 120 SER HB3 H 1 3.936 0.030 . 2 . . . . 120 SER HB3 . 11087 1 1467 . 1 1 120 120 SER C C 13 175.354 0.300 . 1 . . . . 120 SER C . 11087 1 1468 . 1 1 120 120 SER CA C 13 59.951 0.300 . 1 . . . . 120 SER CA . 11087 1 1469 . 1 1 120 120 SER CB C 13 64.333 0.300 . 1 . . . . 120 SER CB . 11087 1 1470 . 1 1 120 120 SER N N 15 117.165 0.300 . 1 . . . . 120 SER N . 11087 1 1471 . 1 1 121 121 TYR H H 1 8.072 0.030 . 1 . . . . 121 TYR H . 11087 1 1472 . 1 1 121 121 TYR HA H 1 3.947 0.030 . 1 . . . . 121 TYR HA . 11087 1 1473 . 1 1 121 121 TYR HB2 H 1 3.054 0.030 . 1 . . . . 121 TYR HB2 . 11087 1 1474 . 1 1 121 121 TYR HB3 H 1 3.054 0.030 . 1 . . . . 121 TYR HB3 . 11087 1 1475 . 1 1 121 121 TYR HD1 H 1 6.894 0.030 . 1 . . . . 121 TYR HD1 . 11087 1 1476 . 1 1 121 121 TYR HD2 H 1 6.894 0.030 . 1 . . . . 121 TYR HD2 . 11087 1 1477 . 1 1 121 121 TYR HE1 H 1 6.588 0.030 . 1 . . . . 121 TYR HE1 . 11087 1 1478 . 1 1 121 121 TYR HE2 H 1 6.588 0.030 . 1 . . . . 121 TYR HE2 . 11087 1 1479 . 1 1 121 121 TYR C C 13 176.465 0.300 . 1 . . . . 121 TYR C . 11087 1 1480 . 1 1 121 121 TYR CA C 13 63.223 0.300 . 1 . . . . 121 TYR CA . 11087 1 1481 . 1 1 121 121 TYR CB C 13 38.076 0.300 . 1 . . . . 121 TYR CB . 11087 1 1482 . 1 1 121 121 TYR CD1 C 13 132.578 0.300 . 1 . . . . 121 TYR CD1 . 11087 1 1483 . 1 1 121 121 TYR CD2 C 13 132.578 0.300 . 1 . . . . 121 TYR CD2 . 11087 1 1484 . 1 1 121 121 TYR CE1 C 13 117.872 0.300 . 1 . . . . 121 TYR CE1 . 11087 1 1485 . 1 1 121 121 TYR CE2 C 13 117.872 0.300 . 1 . . . . 121 TYR CE2 . 11087 1 1486 . 1 1 121 121 TYR N N 15 123.637 0.300 . 1 . . . . 121 TYR N . 11087 1 1487 . 1 1 122 122 THR H H 1 8.415 0.030 . 1 . . . . 122 THR H . 11087 1 1488 . 1 1 122 122 THR HA H 1 3.543 0.030 . 1 . . . . 122 THR HA . 11087 1 1489 . 1 1 122 122 THR HB H 1 4.210 0.030 . 1 . . . . 122 THR HB . 11087 1 1490 . 1 1 122 122 THR HG21 H 1 1.280 0.030 . 1 . . . . 122 THR HG2 . 11087 1 1491 . 1 1 122 122 THR HG22 H 1 1.280 0.030 . 1 . . . . 122 THR HG2 . 11087 1 1492 . 1 1 122 122 THR HG23 H 1 1.280 0.030 . 1 . . . . 122 THR HG2 . 11087 1 1493 . 1 1 122 122 THR C C 13 176.983 0.300 . 1 . . . . 122 THR C . 11087 1 1494 . 1 1 122 122 THR CA C 13 66.617 0.300 . 1 . . . . 122 THR CA . 11087 1 1495 . 1 1 122 122 THR CB C 13 68.227 0.300 . 1 . . . . 122 THR CB . 11087 1 1496 . 1 1 122 122 THR CG2 C 13 21.983 0.300 . 1 . . . . 122 THR CG2 . 11087 1 1497 . 1 1 122 122 THR N N 15 112.165 0.300 . 1 . . . . 122 THR N . 11087 1 1498 . 1 1 123 123 SER H H 1 7.809 0.030 . 1 . . . . 123 SER H . 11087 1 1499 . 1 1 123 123 SER HA H 1 4.202 0.030 . 1 . . . . 123 SER HA . 11087 1 1500 . 1 1 123 123 SER HB2 H 1 3.959 0.030 . 2 . . . . 123 SER HB2 . 11087 1 1501 . 1 1 123 123 SER HB3 H 1 3.920 0.030 . 2 . . . . 123 SER HB3 . 11087 1 1502 . 1 1 123 123 SER C C 13 176.985 0.300 . 1 . . . . 123 SER C . 11087 1 1503 . 1 1 123 123 SER CA C 13 61.359 0.300 . 1 . . . . 123 SER CA . 11087 1 1504 . 1 1 123 123 SER CB C 13 62.438 0.300 . 1 . . . . 123 SER CB . 11087 1 1505 . 1 1 123 123 SER N N 15 116.899 0.300 . 1 . . . . 123 SER N . 11087 1 1506 . 1 1 124 124 GLU H H 1 8.238 0.030 . 1 . . . . 124 GLU H . 11087 1 1507 . 1 1 124 124 GLU HA H 1 4.143 0.030 . 1 . . . . 124 GLU HA . 11087 1 1508 . 1 1 124 124 GLU HB2 H 1 2.127 0.030 . 2 . . . . 124 GLU HB2 . 11087 1 1509 . 1 1 124 124 GLU HB3 H 1 1.992 0.030 . 2 . . . . 124 GLU HB3 . 11087 1 1510 . 1 1 124 124 GLU HG2 H 1 2.273 0.030 . 2 . . . . 124 GLU HG2 . 11087 1 1511 . 1 1 124 124 GLU HG3 H 1 2.155 0.030 . 2 . . . . 124 GLU HG3 . 11087 1 1512 . 1 1 124 124 GLU C C 13 178.838 0.300 . 1 . . . . 124 GLU C . 11087 1 1513 . 1 1 124 124 GLU CA C 13 59.142 0.300 . 1 . . . . 124 GLU CA . 11087 1 1514 . 1 1 124 124 GLU CB C 13 28.973 0.300 . 1 . . . . 124 GLU CB . 11087 1 1515 . 1 1 124 124 GLU CG C 13 35.417 0.300 . 1 . . . . 124 GLU CG . 11087 1 1516 . 1 1 124 124 GLU N N 15 125.692 0.300 . 1 . . . . 124 GLU N . 11087 1 1517 . 1 1 125 125 VAL H H 1 7.835 0.030 . 1 . . . . 125 VAL H . 11087 1 1518 . 1 1 125 125 VAL HA H 1 3.219 0.030 . 1 . . . . 125 VAL HA . 11087 1 1519 . 1 1 125 125 VAL HB H 1 1.954 0.030 . 1 . . . . 125 VAL HB . 11087 1 1520 . 1 1 125 125 VAL HG11 H 1 0.726 0.030 . 1 . . . . 125 VAL HG1 . 11087 1 1521 . 1 1 125 125 VAL HG12 H 1 0.726 0.030 . 1 . . . . 125 VAL HG1 . 11087 1 1522 . 1 1 125 125 VAL HG13 H 1 0.726 0.030 . 1 . . . . 125 VAL HG1 . 11087 1 1523 . 1 1 125 125 VAL HG21 H 1 0.371 0.030 . 1 . . . . 125 VAL HG2 . 11087 1 1524 . 1 1 125 125 VAL HG22 H 1 0.371 0.030 . 1 . . . . 125 VAL HG2 . 11087 1 1525 . 1 1 125 125 VAL HG23 H 1 0.371 0.030 . 1 . . . . 125 VAL HG2 . 11087 1 1526 . 1 1 125 125 VAL C C 13 178.238 0.300 . 1 . . . . 125 VAL C . 11087 1 1527 . 1 1 125 125 VAL CA C 13 67.137 0.300 . 1 . . . . 125 VAL CA . 11087 1 1528 . 1 1 125 125 VAL CB C 13 31.933 0.300 . 1 . . . . 125 VAL CB . 11087 1 1529 . 1 1 125 125 VAL CG1 C 13 21.227 0.300 . 2 . . . . 125 VAL CG1 . 11087 1 1530 . 1 1 125 125 VAL CG2 C 13 23.244 0.300 . 2 . . . . 125 VAL CG2 . 11087 1 1531 . 1 1 125 125 VAL N N 15 120.206 0.300 . 1 . . . . 125 VAL N . 11087 1 1532 . 1 1 126 126 GLN H H 1 7.720 0.030 . 1 . . . . 126 GLN H . 11087 1 1533 . 1 1 126 126 GLN HA H 1 3.888 0.030 . 1 . . . . 126 GLN HA . 11087 1 1534 . 1 1 126 126 GLN HB2 H 1 2.107 0.030 . 1 . . . . 126 GLN HB2 . 11087 1 1535 . 1 1 126 126 GLN HB3 H 1 2.107 0.030 . 1 . . . . 126 GLN HB3 . 11087 1 1536 . 1 1 126 126 GLN HE21 H 1 7.412 0.030 . 2 . . . . 126 GLN HE21 . 11087 1 1537 . 1 1 126 126 GLN HE22 H 1 6.843 0.030 . 2 . . . . 126 GLN HE22 . 11087 1 1538 . 1 1 126 126 GLN HG2 H 1 2.441 0.030 . 2 . . . . 126 GLN HG2 . 11087 1 1539 . 1 1 126 126 GLN HG3 H 1 2.510 0.030 . 2 . . . . 126 GLN HG3 . 11087 1 1540 . 1 1 126 126 GLN C C 13 178.796 0.300 . 1 . . . . 126 GLN C . 11087 1 1541 . 1 1 126 126 GLN CA C 13 58.579 0.300 . 1 . . . . 126 GLN CA . 11087 1 1542 . 1 1 126 126 GLN CB C 13 28.068 0.300 . 1 . . . . 126 GLN CB . 11087 1 1543 . 1 1 126 126 GLN CG C 13 33.742 0.300 . 1 . . . . 126 GLN CG . 11087 1 1544 . 1 1 126 126 GLN N N 15 115.404 0.300 . 1 . . . . 126 GLN N . 11087 1 1545 . 1 1 126 126 GLN NE2 N 15 112.209 0.300 . 1 . . . . 126 GLN NE2 . 11087 1 1546 . 1 1 127 127 ALA H H 1 8.297 0.030 . 1 . . . . 127 ALA H . 11087 1 1547 . 1 1 127 127 ALA HA H 1 4.207 0.030 . 1 . . . . 127 ALA HA . 11087 1 1548 . 1 1 127 127 ALA HB1 H 1 1.518 0.030 . 1 . . . . 127 ALA HB . 11087 1 1549 . 1 1 127 127 ALA HB2 H 1 1.518 0.030 . 1 . . . . 127 ALA HB . 11087 1 1550 . 1 1 127 127 ALA HB3 H 1 1.518 0.030 . 1 . . . . 127 ALA HB . 11087 1 1551 . 1 1 127 127 ALA C C 13 181.305 0.300 . 1 . . . . 127 ALA C . 11087 1 1552 . 1 1 127 127 ALA CA C 13 55.025 0.300 . 1 . . . . 127 ALA CA . 11087 1 1553 . 1 1 127 127 ALA CB C 13 18.036 0.300 . 1 . . . . 127 ALA CB . 11087 1 1554 . 1 1 127 127 ALA N N 15 123.196 0.300 . 1 . . . . 127 ALA N . 11087 1 1555 . 1 1 128 128 ILE H H 1 8.047 0.030 . 1 . . . . 128 ILE H . 11087 1 1556 . 1 1 128 128 ILE HA H 1 3.917 0.030 . 1 . . . . 128 ILE HA . 11087 1 1557 . 1 1 128 128 ILE HB H 1 2.015 0.030 . 1 . . . . 128 ILE HB . 11087 1 1558 . 1 1 128 128 ILE HD11 H 1 0.808 0.030 . 1 . . . . 128 ILE HD1 . 11087 1 1559 . 1 1 128 128 ILE HD12 H 1 0.808 0.030 . 1 . . . . 128 ILE HD1 . 11087 1 1560 . 1 1 128 128 ILE HD13 H 1 0.808 0.030 . 1 . . . . 128 ILE HD1 . 11087 1 1561 . 1 1 128 128 ILE HG12 H 1 1.022 0.030 . 2 . . . . 128 ILE HG12 . 11087 1 1562 . 1 1 128 128 ILE HG13 H 1 1.960 0.030 . 2 . . . . 128 ILE HG13 . 11087 1 1563 . 1 1 128 128 ILE HG21 H 1 1.141 0.030 . 1 . . . . 128 ILE HG2 . 11087 1 1564 . 1 1 128 128 ILE HG22 H 1 1.141 0.030 . 1 . . . . 128 ILE HG2 . 11087 1 1565 . 1 1 128 128 ILE HG23 H 1 1.141 0.030 . 1 . . . . 128 ILE HG2 . 11087 1 1566 . 1 1 128 128 ILE C C 13 178.319 0.300 . 1 . . . . 128 ILE C . 11087 1 1567 . 1 1 128 128 ILE CA C 13 65.475 0.300 . 1 . . . . 128 ILE CA . 11087 1 1568 . 1 1 128 128 ILE CB C 13 38.278 0.300 . 1 . . . . 128 ILE CB . 11087 1 1569 . 1 1 128 128 ILE CD1 C 13 14.940 0.300 . 1 . . . . 128 ILE CD1 . 11087 1 1570 . 1 1 128 128 ILE CG1 C 13 29.174 0.300 . 1 . . . . 128 ILE CG1 . 11087 1 1571 . 1 1 128 128 ILE CG2 C 13 18.118 0.300 . 1 . . . . 128 ILE CG2 . 11087 1 1572 . 1 1 128 128 ILE N N 15 121.293 0.300 . 1 . . . . 128 ILE N . 11087 1 1573 . 1 1 129 129 LEU H H 1 8.018 0.030 . 1 . . . . 129 LEU H . 11087 1 1574 . 1 1 129 129 LEU HA H 1 4.019 0.030 . 1 . . . . 129 LEU HA . 11087 1 1575 . 1 1 129 129 LEU HB2 H 1 1.484 0.030 . 2 . . . . 129 LEU HB2 . 11087 1 1576 . 1 1 129 129 LEU HB3 H 1 1.885 0.030 . 2 . . . . 129 LEU HB3 . 11087 1 1577 . 1 1 129 129 LEU HD11 H 1 0.865 0.030 . 1 . . . . 129 LEU HD1 . 11087 1 1578 . 1 1 129 129 LEU HD12 H 1 0.865 0.030 . 1 . . . . 129 LEU HD1 . 11087 1 1579 . 1 1 129 129 LEU HD13 H 1 0.865 0.030 . 1 . . . . 129 LEU HD1 . 11087 1 1580 . 1 1 129 129 LEU HD21 H 1 0.774 0.030 . 1 . . . . 129 LEU HD2 . 11087 1 1581 . 1 1 129 129 LEU HD22 H 1 0.774 0.030 . 1 . . . . 129 LEU HD2 . 11087 1 1582 . 1 1 129 129 LEU HD23 H 1 0.774 0.030 . 1 . . . . 129 LEU HD2 . 11087 1 1583 . 1 1 129 129 LEU HG H 1 1.690 0.030 . 1 . . . . 129 LEU HG . 11087 1 1584 . 1 1 129 129 LEU C C 13 180.191 0.300 . 1 . . . . 129 LEU C . 11087 1 1585 . 1 1 129 129 LEU CA C 13 58.438 0.300 . 1 . . . . 129 LEU CA . 11087 1 1586 . 1 1 129 129 LEU CB C 13 41.375 0.300 . 1 . . . . 129 LEU CB . 11087 1 1587 . 1 1 129 129 LEU CD1 C 13 25.967 0.300 . 2 . . . . 129 LEU CD1 . 11087 1 1588 . 1 1 129 129 LEU CD2 C 13 23.059 0.300 . 2 . . . . 129 LEU CD2 . 11087 1 1589 . 1 1 129 129 LEU CG C 13 26.641 0.300 . 1 . . . . 129 LEU CG . 11087 1 1590 . 1 1 129 129 LEU N N 15 119.479 0.300 . 1 . . . . 129 LEU N . 11087 1 1591 . 1 1 130 130 ALA H H 1 8.402 0.030 . 1 . . . . 130 ALA H . 11087 1 1592 . 1 1 130 130 ALA HA H 1 4.154 0.030 . 1 . . . . 130 ALA HA . 11087 1 1593 . 1 1 130 130 ALA HB1 H 1 1.516 0.030 . 1 . . . . 130 ALA HB . 11087 1 1594 . 1 1 130 130 ALA HB2 H 1 1.516 0.030 . 1 . . . . 130 ALA HB . 11087 1 1595 . 1 1 130 130 ALA HB3 H 1 1.516 0.030 . 1 . . . . 130 ALA HB . 11087 1 1596 . 1 1 130 130 ALA C C 13 180.406 0.300 . 1 . . . . 130 ALA C . 11087 1 1597 . 1 1 130 130 ALA CA C 13 55.131 0.300 . 1 . . . . 130 ALA CA . 11087 1 1598 . 1 1 130 130 ALA CB C 13 17.871 0.300 . 1 . . . . 130 ALA CB . 11087 1 1599 . 1 1 130 130 ALA N N 15 122.227 0.300 . 1 . . . . 130 ALA N . 11087 1 1600 . 1 1 131 131 PHE H H 1 8.011 0.030 . 1 . . . . 131 PHE H . 11087 1 1601 . 1 1 131 131 PHE HA H 1 4.401 0.030 . 1 . . . . 131 PHE HA . 11087 1 1602 . 1 1 131 131 PHE HB2 H 1 3.389 0.030 . 1 . . . . 131 PHE HB2 . 11087 1 1603 . 1 1 131 131 PHE HB3 H 1 3.389 0.030 . 1 . . . . 131 PHE HB3 . 11087 1 1604 . 1 1 131 131 PHE HD1 H 1 7.324 0.030 . 1 . . . . 131 PHE HD1 . 11087 1 1605 . 1 1 131 131 PHE HD2 H 1 7.324 0.030 . 1 . . . . 131 PHE HD2 . 11087 1 1606 . 1 1 131 131 PHE HE1 H 1 7.383 0.030 . 1 . . . . 131 PHE HE1 . 11087 1 1607 . 1 1 131 131 PHE HE2 H 1 7.383 0.030 . 1 . . . . 131 PHE HE2 . 11087 1 1608 . 1 1 131 131 PHE C C 13 178.627 0.300 . 1 . . . . 131 PHE C . 11087 1 1609 . 1 1 131 131 PHE CA C 13 60.866 0.300 . 1 . . . . 131 PHE CA . 11087 1 1610 . 1 1 131 131 PHE CB C 13 39.099 0.300 . 1 . . . . 131 PHE CB . 11087 1 1611 . 1 1 131 131 PHE CD1 C 13 132.049 0.300 . 1 . . . . 131 PHE CD1 . 11087 1 1612 . 1 1 131 131 PHE CD2 C 13 132.049 0.300 . 1 . . . . 131 PHE CD2 . 11087 1 1613 . 1 1 131 131 PHE CE1 C 13 131.593 0.300 . 1 . . . . 131 PHE CE1 . 11087 1 1614 . 1 1 131 131 PHE CE2 C 13 131.593 0.300 . 1 . . . . 131 PHE CE2 . 11087 1 1615 . 1 1 131 131 PHE N N 15 120.425 0.300 . 1 . . . . 131 PHE N . 11087 1 1616 . 1 1 132 132 LEU H H 1 8.575 0.030 . 1 . . . . 132 LEU H . 11087 1 1617 . 1 1 132 132 LEU HA H 1 3.953 0.030 . 1 . . . . 132 LEU HA . 11087 1 1618 . 1 1 132 132 LEU HB2 H 1 2.030 0.030 . 2 . . . . 132 LEU HB2 . 11087 1 1619 . 1 1 132 132 LEU HB3 H 1 1.520 0.030 . 2 . . . . 132 LEU HB3 . 11087 1 1620 . 1 1 132 132 LEU HD11 H 1 1.091 0.030 . 1 . . . . 132 LEU HD1 . 11087 1 1621 . 1 1 132 132 LEU HD12 H 1 1.091 0.030 . 1 . . . . 132 LEU HD1 . 11087 1 1622 . 1 1 132 132 LEU HD13 H 1 1.091 0.030 . 1 . . . . 132 LEU HD1 . 11087 1 1623 . 1 1 132 132 LEU HD21 H 1 0.986 0.030 . 1 . . . . 132 LEU HD2 . 11087 1 1624 . 1 1 132 132 LEU HD22 H 1 0.986 0.030 . 1 . . . . 132 LEU HD2 . 11087 1 1625 . 1 1 132 132 LEU HD23 H 1 0.986 0.030 . 1 . . . . 132 LEU HD2 . 11087 1 1626 . 1 1 132 132 LEU HG H 1 2.325 0.030 . 1 . . . . 132 LEU HG . 11087 1 1627 . 1 1 132 132 LEU C C 13 179.603 0.300 . 1 . . . . 132 LEU C . 11087 1 1628 . 1 1 132 132 LEU CA C 13 57.594 0.300 . 1 . . . . 132 LEU CA . 11087 1 1629 . 1 1 132 132 LEU CB C 13 41.556 0.300 . 1 . . . . 132 LEU CB . 11087 1 1630 . 1 1 132 132 LEU CD1 C 13 27.108 0.300 . 2 . . . . 132 LEU CD1 . 11087 1 1631 . 1 1 132 132 LEU CD2 C 13 23.052 0.300 . 2 . . . . 132 LEU CD2 . 11087 1 1632 . 1 1 132 132 LEU CG C 13 26.581 0.300 . 1 . . . . 132 LEU CG . 11087 1 1633 . 1 1 132 132 LEU N N 15 119.114 0.300 . 1 . . . . 132 LEU N . 11087 1 1634 . 1 1 133 133 SER H H 1 7.934 0.030 . 1 . . . . 133 SER H . 11087 1 1635 . 1 1 133 133 SER HA H 1 4.247 0.030 . 1 . . . . 133 SER HA . 11087 1 1636 . 1 1 133 133 SER HB2 H 1 4.016 0.030 . 1 . . . . 133 SER HB2 . 11087 1 1637 . 1 1 133 133 SER HB3 H 1 4.016 0.030 . 1 . . . . 133 SER HB3 . 11087 1 1638 . 1 1 133 133 SER C C 13 175.902 0.300 . 1 . . . . 133 SER C . 11087 1 1639 . 1 1 133 133 SER CA C 13 60.984 0.300 . 1 . . . . 133 SER CA . 11087 1 1640 . 1 1 133 133 SER CB C 13 63.182 0.300 . 1 . . . . 133 SER CB . 11087 1 1641 . 1 1 133 133 SER N N 15 114.096 0.300 . 1 . . . . 133 SER N . 11087 1 1642 . 1 1 134 134 LEU H H 1 7.405 0.030 . 1 . . . . 134 LEU H . 11087 1 1643 . 1 1 134 134 LEU HA H 1 4.245 0.030 . 1 . . . . 134 LEU HA . 11087 1 1644 . 1 1 134 134 LEU HB2 H 1 1.760 0.030 . 2 . . . . 134 LEU HB2 . 11087 1 1645 . 1 1 134 134 LEU HB3 H 1 1.577 0.030 . 2 . . . . 134 LEU HB3 . 11087 1 1646 . 1 1 134 134 LEU HD11 H 1 0.929 0.030 . 1 . . . . 134 LEU HD1 . 11087 1 1647 . 1 1 134 134 LEU HD12 H 1 0.929 0.030 . 1 . . . . 134 LEU HD1 . 11087 1 1648 . 1 1 134 134 LEU HD13 H 1 0.929 0.030 . 1 . . . . 134 LEU HD1 . 11087 1 1649 . 1 1 134 134 LEU HD21 H 1 0.876 0.030 . 1 . . . . 134 LEU HD2 . 11087 1 1650 . 1 1 134 134 LEU HD22 H 1 0.876 0.030 . 1 . . . . 134 LEU HD2 . 11087 1 1651 . 1 1 134 134 LEU HD23 H 1 0.876 0.030 . 1 . . . . 134 LEU HD2 . 11087 1 1652 . 1 1 134 134 LEU HG H 1 1.804 0.030 . 1 . . . . 134 LEU HG . 11087 1 1653 . 1 1 134 134 LEU C C 13 177.982 0.300 . 1 . . . . 134 LEU C . 11087 1 1654 . 1 1 134 134 LEU CA C 13 56.075 0.300 . 1 . . . . 134 LEU CA . 11087 1 1655 . 1 1 134 134 LEU CB C 13 41.966 0.300 . 1 . . . . 134 LEU CB . 11087 1 1656 . 1 1 134 134 LEU CD1 C 13 25.190 0.300 . 2 . . . . 134 LEU CD1 . 11087 1 1657 . 1 1 134 134 LEU CD2 C 13 22.970 0.300 . 2 . . . . 134 LEU CD2 . 11087 1 1658 . 1 1 134 134 LEU CG C 13 26.607 0.300 . 1 . . . . 134 LEU CG . 11087 1 1659 . 1 1 134 134 LEU N N 15 120.982 0.300 . 1 . . . . 134 LEU N . 11087 1 1660 . 1 1 135 135 GLN H H 1 7.655 0.030 . 1 . . . . 135 GLN H . 11087 1 1661 . 1 1 135 135 GLN HA H 1 4.229 0.030 . 1 . . . . 135 GLN HA . 11087 1 1662 . 1 1 135 135 GLN HB2 H 1 1.946 0.030 . 2 . . . . 135 GLN HB2 . 11087 1 1663 . 1 1 135 135 GLN HB3 H 1 2.213 0.030 . 2 . . . . 135 GLN HB3 . 11087 1 1664 . 1 1 135 135 GLN HE21 H 1 6.835 0.030 . 2 . . . . 135 GLN HE21 . 11087 1 1665 . 1 1 135 135 GLN HE22 H 1 6.646 0.030 . 2 . . . . 135 GLN HE22 . 11087 1 1666 . 1 1 135 135 GLN HG2 H 1 2.256 0.030 . 2 . . . . 135 GLN HG2 . 11087 1 1667 . 1 1 135 135 GLN HG3 H 1 2.188 0.030 . 2 . . . . 135 GLN HG3 . 11087 1 1668 . 1 1 135 135 GLN C C 13 175.744 0.300 . 1 . . . . 135 GLN C . 11087 1 1669 . 1 1 135 135 GLN CA C 13 55.623 0.300 . 1 . . . . 135 GLN CA . 11087 1 1670 . 1 1 135 135 GLN CB C 13 28.668 0.300 . 1 . . . . 135 GLN CB . 11087 1 1671 . 1 1 135 135 GLN CG C 13 33.660 0.300 . 1 . . . . 135 GLN CG . 11087 1 1672 . 1 1 135 135 GLN N N 15 117.302 0.300 . 1 . . . . 135 GLN N . 11087 1 1673 . 1 1 135 135 GLN NE2 N 15 113.234 0.300 . 1 . . . . 135 GLN NE2 . 11087 1 1674 . 1 1 136 136 ARG H H 1 7.747 0.030 . 1 . . . . 136 ARG H . 11087 1 1675 . 1 1 136 136 ARG HA H 1 4.365 0.030 . 1 . . . . 136 ARG HA . 11087 1 1676 . 1 1 136 136 ARG HB2 H 1 1.929 0.030 . 2 . . . . 136 ARG HB2 . 11087 1 1677 . 1 1 136 136 ARG HB3 H 1 1.815 0.030 . 2 . . . . 136 ARG HB3 . 11087 1 1678 . 1 1 136 136 ARG HD2 H 1 3.219 0.030 . 1 . . . . 136 ARG HD2 . 11087 1 1679 . 1 1 136 136 ARG HD3 H 1 3.219 0.030 . 1 . . . . 136 ARG HD3 . 11087 1 1680 . 1 1 136 136 ARG HG2 H 1 1.690 0.030 . 2 . . . . 136 ARG HG2 . 11087 1 1681 . 1 1 136 136 ARG HG3 H 1 1.629 0.030 . 2 . . . . 136 ARG HG3 . 11087 1 1682 . 1 1 136 136 ARG C C 13 175.559 0.300 . 1 . . . . 136 ARG C . 11087 1 1683 . 1 1 136 136 ARG CA C 13 56.397 0.300 . 1 . . . . 136 ARG CA . 11087 1 1684 . 1 1 136 136 ARG CB C 13 30.907 0.300 . 1 . . . . 136 ARG CB . 11087 1 1685 . 1 1 136 136 ARG CD C 13 43.446 0.300 . 1 . . . . 136 ARG CD . 11087 1 1686 . 1 1 136 136 ARG CG C 13 27.410 0.300 . 1 . . . . 136 ARG CG . 11087 1 1687 . 1 1 136 136 ARG N N 15 120.835 0.300 . 1 . . . . 136 ARG N . 11087 1 1688 . 1 1 137 137 THR H H 1 7.745 0.030 . 1 . . . . 137 THR H . 11087 1 1689 . 1 1 137 137 THR HA H 1 4.147 0.030 . 1 . . . . 137 THR HA . 11087 1 1690 . 1 1 137 137 THR HB H 1 4.242 0.030 . 1 . . . . 137 THR HB . 11087 1 1691 . 1 1 137 137 THR HG21 H 1 1.159 0.030 . 1 . . . . 137 THR HG2 . 11087 1 1692 . 1 1 137 137 THR HG22 H 1 1.159 0.030 . 1 . . . . 137 THR HG2 . 11087 1 1693 . 1 1 137 137 THR HG23 H 1 1.159 0.030 . 1 . . . . 137 THR HG2 . 11087 1 1694 . 1 1 137 137 THR C C 13 179.192 0.300 . 1 . . . . 137 THR C . 11087 1 1695 . 1 1 137 137 THR CA C 13 63.256 0.300 . 1 . . . . 137 THR CA . 11087 1 1696 . 1 1 137 137 THR CB C 13 70.764 0.300 . 1 . . . . 137 THR CB . 11087 1 1697 . 1 1 137 137 THR CG2 C 13 22.015 0.300 . 1 . . . . 137 THR CG2 . 11087 1 1698 . 1 1 137 137 THR N N 15 120.211 0.300 . 1 . . . . 137 THR N . 11087 1 stop_ save_