data_11122 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11122 _Entry.Title ; The solution structure of the tetratrico peptide repeat of human Smooth muscle cell associated protein-1, isoform 2 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-03-31 _Entry.Accession_date 2010-03-31 _Entry.Last_release_date 2011-04-01 _Entry.Original_release_date 2011-04-01 _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 N. Tochio . . . 11122 2 A. Sasagawa . . . 11122 3 S. Koshiba . . . 11122 4 M. Inoue . . . 11122 5 T. Kigawa . . . 11122 6 S. Yokoyama . . . 11122 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)' . 11122 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11122 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 585 11122 '15N chemical shifts' 144 11122 '1H chemical shifts' 920 11122 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 . . 2011-04-01 2010-03-31 original author . 11122 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2DBA 'BMRB Entry Tracking System' 11122 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11122 _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 ; The solution structure of the tetratrico peptide repeat of human Smooth muscle cell associated protein-1, isoform 2 ; _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 N. Tochio . . . 11122 1 2 A. Sasagawa . . . 11122 1 3 S. Koshiba . . . 11122 1 4 M. Inoue . . . 11122 1 5 T. Kigawa . . . 11122 1 6 S. Yokoyama . . . 11122 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11122 _Assembly.ID 1 _Assembly.Name 'Smooth muscle cell associated protein-1, isoform 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 'TPR, Residues 8-142' 1 $entity_1 A . yes native no no . . . 11122 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 2dba . . . . . . 11122 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11122 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'TPR, Residues 8-142' _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 ; GSSGSSGMTVSGPGTPEPRP ATPGASSVEQLRKEGNELFK CGDYGGALAAYTQALGLDAT PQDQAVLHRNRAACHLKLED YDKAETEASKAIEKDGGDVK ALYRRSQALEKLGRLDQAVL DLQRCVSLEPKNKVFQEALR NISGPSSG ; _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 148 _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 2DBA . "The Solution Structure Of The Tetratrico Peptide Repeat Of Human Smooth Muscle Cell Associated Protein-1, Isoform 2" . . . . . 100.00 148 100.00 100.00 1.95e-101 . . . . 11122 1 2 no DBJ BAB20266 . "SMAP-1 [Homo sapiens]" . . . . . 81.08 929 99.17 99.17 1.19e-72 . . . . 11122 1 3 no DBJ BAB20273 . "SMAP-1b [Homo sapiens]" . . . . . 92.57 944 99.27 99.27 1.43e-86 . . . . 11122 1 4 no DBJ BAF84311 . "unnamed protein product [Homo sapiens]" . . . . . 81.08 929 99.17 99.17 1.19e-72 . . . . 11122 1 5 no DBJ BAG54239 . "unnamed protein product [Homo sapiens]" . . . . . 81.08 929 99.17 99.17 1.19e-72 . . . . 11122 1 6 no DBJ BAG57020 . "unnamed protein product [Homo sapiens]" . . . . . 56.76 134 100.00 100.00 7.37e-53 . . . . 11122 1 7 no EMBL CAH91170 . "hypothetical protein [Pongo abelii]" . . . . . 81.08 929 98.33 99.17 8.97e-72 . . . . 11122 1 8 no GB AAH06214 . "Unc-45 homolog A (C. elegans) [Homo sapiens]" . . . . . 92.57 944 99.27 99.27 1.43e-86 . . . . 11122 1 9 no GB AAH37992 . "Unc-45 homolog A (C. elegans) [Homo sapiens]" . . . . . 92.57 944 99.27 99.27 1.43e-86 . . . . 11122 1 10 no GB AAH45635 . "Unc-45 homolog A (C. elegans) [Homo sapiens]" . . . . . 81.08 929 99.17 99.17 1.19e-72 . . . . 11122 1 11 no GB ABM83879 . "unc-45 homolog A (C. elegans) [synthetic construct]" . . . . . 92.57 944 99.27 99.27 1.43e-86 . . . . 11122 1 12 no GB ABM87199 . "unc-45 homolog A (C. elegans) [synthetic construct]" . . . . . 92.57 944 99.27 99.27 1.43e-86 . . . . 11122 1 13 no REF NP_001034764 . "protein unc-45 homolog A isoform 3 [Homo sapiens]" . . . . . 81.08 929 99.17 99.17 1.19e-72 . . . . 11122 1 14 no REF NP_001127383 . "protein unc-45 homolog A [Pongo abelii]" . . . . . 81.08 929 98.33 99.17 8.97e-72 . . . . 11122 1 15 no REF NP_061141 . "protein unc-45 homolog A isoform 2 [Homo sapiens]" . . . . . 92.57 944 99.27 99.27 1.43e-86 . . . . 11122 1 16 no REF XP_003268606 . "PREDICTED: protein unc-45 homolog A [Nomascus leucogenys]" . . . . . 92.57 921 98.54 99.27 1.37e-86 . . . . 11122 1 17 no REF XP_003807756 . "PREDICTED: protein unc-45 homolog A isoform X1 [Pan paniscus]" . . . . . 92.57 944 98.54 99.27 2.27e-86 . . . . 11122 1 18 no SP Q5RAP0 . "RecName: Full=Protein unc-45 homolog A; Short=Unc-45A; AltName: Full=Smooth muscle cell-associated protein 1; Short=SMAP-1" . . . . . 81.08 929 98.33 99.17 8.97e-72 . . . . 11122 1 19 no SP Q9H3U1 . "RecName: Full=Protein unc-45 homolog A; Short=Unc-45A; AltName: Full=GCUNC-45; AltName: Full=Smooth muscle cell-associated prot" . . . . . 92.57 944 99.27 99.27 1.43e-86 . . . . 11122 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'TPR, Residues 8-142' . 11122 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 . 11122 1 2 . SER . 11122 1 3 . SER . 11122 1 4 . GLY . 11122 1 5 . SER . 11122 1 6 . SER . 11122 1 7 . GLY . 11122 1 8 . MET . 11122 1 9 . THR . 11122 1 10 . VAL . 11122 1 11 . SER . 11122 1 12 . GLY . 11122 1 13 . PRO . 11122 1 14 . GLY . 11122 1 15 . THR . 11122 1 16 . PRO . 11122 1 17 . GLU . 11122 1 18 . PRO . 11122 1 19 . ARG . 11122 1 20 . PRO . 11122 1 21 . ALA . 11122 1 22 . THR . 11122 1 23 . PRO . 11122 1 24 . GLY . 11122 1 25 . ALA . 11122 1 26 . SER . 11122 1 27 . SER . 11122 1 28 . VAL . 11122 1 29 . GLU . 11122 1 30 . GLN . 11122 1 31 . LEU . 11122 1 32 . ARG . 11122 1 33 . LYS . 11122 1 34 . GLU . 11122 1 35 . GLY . 11122 1 36 . ASN . 11122 1 37 . GLU . 11122 1 38 . LEU . 11122 1 39 . PHE . 11122 1 40 . LYS . 11122 1 41 . CYS . 11122 1 42 . GLY . 11122 1 43 . ASP . 11122 1 44 . TYR . 11122 1 45 . GLY . 11122 1 46 . GLY . 11122 1 47 . ALA . 11122 1 48 . LEU . 11122 1 49 . ALA . 11122 1 50 . ALA . 11122 1 51 . TYR . 11122 1 52 . THR . 11122 1 53 . GLN . 11122 1 54 . ALA . 11122 1 55 . LEU . 11122 1 56 . GLY . 11122 1 57 . LEU . 11122 1 58 . ASP . 11122 1 59 . ALA . 11122 1 60 . THR . 11122 1 61 . PRO . 11122 1 62 . GLN . 11122 1 63 . ASP . 11122 1 64 . GLN . 11122 1 65 . ALA . 11122 1 66 . VAL . 11122 1 67 . LEU . 11122 1 68 . HIS . 11122 1 69 . ARG . 11122 1 70 . ASN . 11122 1 71 . ARG . 11122 1 72 . ALA . 11122 1 73 . ALA . 11122 1 74 . CYS . 11122 1 75 . HIS . 11122 1 76 . LEU . 11122 1 77 . LYS . 11122 1 78 . LEU . 11122 1 79 . GLU . 11122 1 80 . ASP . 11122 1 81 . TYR . 11122 1 82 . ASP . 11122 1 83 . LYS . 11122 1 84 . ALA . 11122 1 85 . GLU . 11122 1 86 . THR . 11122 1 87 . GLU . 11122 1 88 . ALA . 11122 1 89 . SER . 11122 1 90 . LYS . 11122 1 91 . ALA . 11122 1 92 . ILE . 11122 1 93 . GLU . 11122 1 94 . LYS . 11122 1 95 . ASP . 11122 1 96 . GLY . 11122 1 97 . GLY . 11122 1 98 . ASP . 11122 1 99 . VAL . 11122 1 100 . LYS . 11122 1 101 . ALA . 11122 1 102 . LEU . 11122 1 103 . TYR . 11122 1 104 . ARG . 11122 1 105 . ARG . 11122 1 106 . SER . 11122 1 107 . GLN . 11122 1 108 . ALA . 11122 1 109 . LEU . 11122 1 110 . GLU . 11122 1 111 . LYS . 11122 1 112 . LEU . 11122 1 113 . GLY . 11122 1 114 . ARG . 11122 1 115 . LEU . 11122 1 116 . ASP . 11122 1 117 . GLN . 11122 1 118 . ALA . 11122 1 119 . VAL . 11122 1 120 . LEU . 11122 1 121 . ASP . 11122 1 122 . LEU . 11122 1 123 . GLN . 11122 1 124 . ARG . 11122 1 125 . CYS . 11122 1 126 . VAL . 11122 1 127 . SER . 11122 1 128 . LEU . 11122 1 129 . GLU . 11122 1 130 . PRO . 11122 1 131 . LYS . 11122 1 132 . ASN . 11122 1 133 . LYS . 11122 1 134 . VAL . 11122 1 135 . PHE . 11122 1 136 . GLN . 11122 1 137 . GLU . 11122 1 138 . ALA . 11122 1 139 . LEU . 11122 1 140 . ARG . 11122 1 141 . ASN . 11122 1 142 . ILE . 11122 1 143 . SER . 11122 1 144 . GLY . 11122 1 145 . PRO . 11122 1 146 . SER . 11122 1 147 . SER . 11122 1 148 . GLY . 11122 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 11122 1 . SER 2 2 11122 1 . SER 3 3 11122 1 . GLY 4 4 11122 1 . SER 5 5 11122 1 . SER 6 6 11122 1 . GLY 7 7 11122 1 . MET 8 8 11122 1 . THR 9 9 11122 1 . VAL 10 10 11122 1 . SER 11 11 11122 1 . GLY 12 12 11122 1 . PRO 13 13 11122 1 . GLY 14 14 11122 1 . THR 15 15 11122 1 . PRO 16 16 11122 1 . GLU 17 17 11122 1 . PRO 18 18 11122 1 . ARG 19 19 11122 1 . PRO 20 20 11122 1 . ALA 21 21 11122 1 . THR 22 22 11122 1 . PRO 23 23 11122 1 . GLY 24 24 11122 1 . ALA 25 25 11122 1 . SER 26 26 11122 1 . SER 27 27 11122 1 . VAL 28 28 11122 1 . GLU 29 29 11122 1 . GLN 30 30 11122 1 . LEU 31 31 11122 1 . ARG 32 32 11122 1 . LYS 33 33 11122 1 . GLU 34 34 11122 1 . GLY 35 35 11122 1 . ASN 36 36 11122 1 . GLU 37 37 11122 1 . LEU 38 38 11122 1 . PHE 39 39 11122 1 . LYS 40 40 11122 1 . CYS 41 41 11122 1 . GLY 42 42 11122 1 . ASP 43 43 11122 1 . TYR 44 44 11122 1 . GLY 45 45 11122 1 . GLY 46 46 11122 1 . ALA 47 47 11122 1 . LEU 48 48 11122 1 . ALA 49 49 11122 1 . ALA 50 50 11122 1 . TYR 51 51 11122 1 . THR 52 52 11122 1 . GLN 53 53 11122 1 . ALA 54 54 11122 1 . LEU 55 55 11122 1 . GLY 56 56 11122 1 . LEU 57 57 11122 1 . ASP 58 58 11122 1 . ALA 59 59 11122 1 . THR 60 60 11122 1 . PRO 61 61 11122 1 . GLN 62 62 11122 1 . ASP 63 63 11122 1 . GLN 64 64 11122 1 . ALA 65 65 11122 1 . VAL 66 66 11122 1 . LEU 67 67 11122 1 . HIS 68 68 11122 1 . ARG 69 69 11122 1 . ASN 70 70 11122 1 . ARG 71 71 11122 1 . ALA 72 72 11122 1 . ALA 73 73 11122 1 . CYS 74 74 11122 1 . HIS 75 75 11122 1 . LEU 76 76 11122 1 . LYS 77 77 11122 1 . LEU 78 78 11122 1 . GLU 79 79 11122 1 . ASP 80 80 11122 1 . TYR 81 81 11122 1 . ASP 82 82 11122 1 . LYS 83 83 11122 1 . ALA 84 84 11122 1 . GLU 85 85 11122 1 . THR 86 86 11122 1 . GLU 87 87 11122 1 . ALA 88 88 11122 1 . SER 89 89 11122 1 . LYS 90 90 11122 1 . ALA 91 91 11122 1 . ILE 92 92 11122 1 . GLU 93 93 11122 1 . LYS 94 94 11122 1 . ASP 95 95 11122 1 . GLY 96 96 11122 1 . GLY 97 97 11122 1 . ASP 98 98 11122 1 . VAL 99 99 11122 1 . LYS 100 100 11122 1 . ALA 101 101 11122 1 . LEU 102 102 11122 1 . TYR 103 103 11122 1 . ARG 104 104 11122 1 . ARG 105 105 11122 1 . SER 106 106 11122 1 . GLN 107 107 11122 1 . ALA 108 108 11122 1 . LEU 109 109 11122 1 . GLU 110 110 11122 1 . LYS 111 111 11122 1 . LEU 112 112 11122 1 . GLY 113 113 11122 1 . ARG 114 114 11122 1 . LEU 115 115 11122 1 . ASP 116 116 11122 1 . GLN 117 117 11122 1 . ALA 118 118 11122 1 . VAL 119 119 11122 1 . LEU 120 120 11122 1 . ASP 121 121 11122 1 . LEU 122 122 11122 1 . GLN 123 123 11122 1 . ARG 124 124 11122 1 . CYS 125 125 11122 1 . VAL 126 126 11122 1 . SER 127 127 11122 1 . LEU 128 128 11122 1 . GLU 129 129 11122 1 . PRO 130 130 11122 1 . LYS 131 131 11122 1 . ASN 132 132 11122 1 . LYS 133 133 11122 1 . VAL 134 134 11122 1 . PHE 135 135 11122 1 . GLN 136 136 11122 1 . GLU 137 137 11122 1 . ALA 138 138 11122 1 . LEU 139 139 11122 1 . ARG 140 140 11122 1 . ASN 141 141 11122 1 . ILE 142 142 11122 1 . SER 143 143 11122 1 . GLY 144 144 11122 1 . PRO 145 145 11122 1 . SER 146 146 11122 1 . SER 147 147 11122 1 . GLY 148 148 11122 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 11122 _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 . . . . . . . . . . . . . . . . . . . . . 11122 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 11122 _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 . . . . . . . . . . . . . . . . P050302-63 . . . . . . 11122 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11122 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.3mM TPRx3 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 'TPRx3 domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.3 . . mM . . . . 11122 1 2 'd-Tris HCl' 'natural abundance' . . . . . buffer 20 . . mM . . . . 11122 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11122 1 4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11122 1 5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11122 1 6 H2O . . . . . . solvent 90 . . % . . . . 11122 1 7 D2O . . . . . . solvent 10 . . % . . . . 11122 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 11122 _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 11122 1 pH 7.0 0.05 pH 11122 1 pressure 1 0.001 atm 11122 1 temperature 298 0.1 K 11122 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 11122 _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 . . 11122 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11122 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11122 _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.' . . 11122 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11122 2 stop_ save_ save_NMRVIEW _Software.Sf_category software _Software.Sf_framecode NMRVIEW _Software.Entry_ID 11122 _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.' . . 11122 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11122 3 stop_ save_ save_KUJIRA _Software.Sf_category software _Software.Sf_framecode KUJIRA _Software.Entry_ID 11122 _Software.ID 4 _Software.Name Kujira _Software.Version 0.932 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11122 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11122 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11122 _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.' . . 11122 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 11122 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 11122 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 11122 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker AVANCE . 900 . . . 11122 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 11122 _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 . . . . . . . . . . . . . . . . 11122 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11122 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 11122 _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 . . . . . . . . . 11122 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11122 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11122 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 11122 _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 11122 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11122 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 . . 11122 1 2 $NMRPipe . . 11122 1 3 $NMRVIEW . . 11122 1 4 $KUJIRA . . 11122 1 5 $CYANA . . 11122 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 8 8 MET H H 1 8.236 0.030 . 1 . . . . 8 MET H . 11122 1 2 . 1 1 8 8 MET HA H 1 4.548 0.030 . 1 . . . . 8 MET HA . 11122 1 3 . 1 1 8 8 MET HB2 H 1 2.092 0.030 . 2 . . . . 8 MET HB2 . 11122 1 4 . 1 1 8 8 MET HB3 H 1 2.006 0.030 . 2 . . . . 8 MET HB3 . 11122 1 5 . 1 1 8 8 MET HE1 H 1 2.091 0.030 . 1 . . . . 8 MET HE . 11122 1 6 . 1 1 8 8 MET HE2 H 1 2.091 0.030 . 1 . . . . 8 MET HE . 11122 1 7 . 1 1 8 8 MET HE3 H 1 2.091 0.030 . 1 . . . . 8 MET HE . 11122 1 8 . 1 1 8 8 MET HG2 H 1 2.585 0.030 . 2 . . . . 8 MET HG2 . 11122 1 9 . 1 1 8 8 MET HG3 H 1 2.517 0.030 . 2 . . . . 8 MET HG3 . 11122 1 10 . 1 1 8 8 MET C C 13 176.400 0.300 . 1 . . . . 8 MET C . 11122 1 11 . 1 1 8 8 MET CA C 13 55.541 0.300 . 1 . . . . 8 MET CA . 11122 1 12 . 1 1 8 8 MET CB C 13 33.110 0.300 . 1 . . . . 8 MET CB . 11122 1 13 . 1 1 8 8 MET CE C 13 16.989 0.300 . 1 . . . . 8 MET CE . 11122 1 14 . 1 1 8 8 MET CG C 13 32.020 0.300 . 1 . . . . 8 MET CG . 11122 1 15 . 1 1 8 8 MET N N 15 119.831 0.300 . 1 . . . . 8 MET N . 11122 1 16 . 1 1 9 9 THR H H 1 8.232 0.030 . 1 . . . . 9 THR H . 11122 1 17 . 1 1 9 9 THR HA H 1 4.378 0.030 . 1 . . . . 9 THR HA . 11122 1 18 . 1 1 9 9 THR HB H 1 4.150 0.030 . 1 . . . . 9 THR HB . 11122 1 19 . 1 1 9 9 THR HG21 H 1 1.213 0.030 . 1 . . . . 9 THR HG2 . 11122 1 20 . 1 1 9 9 THR HG22 H 1 1.213 0.030 . 1 . . . . 9 THR HG2 . 11122 1 21 . 1 1 9 9 THR HG23 H 1 1.213 0.030 . 1 . . . . 9 THR HG2 . 11122 1 22 . 1 1 9 9 THR C C 13 174.433 0.300 . 1 . . . . 9 THR C . 11122 1 23 . 1 1 9 9 THR CA C 13 61.966 0.300 . 1 . . . . 9 THR CA . 11122 1 24 . 1 1 9 9 THR CB C 13 69.974 0.300 . 1 . . . . 9 THR CB . 11122 1 25 . 1 1 9 9 THR CG2 C 13 21.554 0.300 . 1 . . . . 9 THR CG2 . 11122 1 26 . 1 1 9 9 THR N N 15 116.505 0.300 . 1 . . . . 9 THR N . 11122 1 27 . 1 1 10 10 VAL H H 1 8.268 0.030 . 1 . . . . 10 VAL H . 11122 1 28 . 1 1 10 10 VAL HA H 1 4.206 0.030 . 1 . . . . 10 VAL HA . 11122 1 29 . 1 1 10 10 VAL HB H 1 2.103 0.030 . 1 . . . . 10 VAL HB . 11122 1 30 . 1 1 10 10 VAL HG11 H 1 0.857 0.030 . 1 . . . . 10 VAL HG1 . 11122 1 31 . 1 1 10 10 VAL HG12 H 1 0.857 0.030 . 1 . . . . 10 VAL HG1 . 11122 1 32 . 1 1 10 10 VAL HG13 H 1 0.857 0.030 . 1 . . . . 10 VAL HG1 . 11122 1 33 . 1 1 10 10 VAL HG21 H 1 0.930 0.030 . 1 . . . . 10 VAL HG2 . 11122 1 34 . 1 1 10 10 VAL HG22 H 1 0.930 0.030 . 1 . . . . 10 VAL HG2 . 11122 1 35 . 1 1 10 10 VAL HG23 H 1 0.930 0.030 . 1 . . . . 10 VAL HG2 . 11122 1 36 . 1 1 10 10 VAL C C 13 176.012 0.300 . 1 . . . . 10 VAL C . 11122 1 37 . 1 1 10 10 VAL CA C 13 62.117 0.300 . 1 . . . . 10 VAL CA . 11122 1 38 . 1 1 10 10 VAL CB C 13 32.874 0.300 . 1 . . . . 10 VAL CB . 11122 1 39 . 1 1 10 10 VAL CG1 C 13 21.138 0.300 . 2 . . . . 10 VAL CG1 . 11122 1 40 . 1 1 10 10 VAL CG2 C 13 20.324 0.300 . 2 . . . . 10 VAL CG2 . 11122 1 41 . 1 1 10 10 VAL N N 15 122.697 0.300 . 1 . . . . 10 VAL N . 11122 1 42 . 1 1 11 11 SER H H 1 8.424 0.030 . 1 . . . . 11 SER H . 11122 1 43 . 1 1 11 11 SER HA H 1 4.537 0.030 . 1 . . . . 11 SER HA . 11122 1 44 . 1 1 11 11 SER HB2 H 1 3.873 0.030 . 1 . . . . 11 SER HB2 . 11122 1 45 . 1 1 11 11 SER HB3 H 1 3.873 0.030 . 1 . . . . 11 SER HB3 . 11122 1 46 . 1 1 11 11 SER C C 13 174.482 0.300 . 1 . . . . 11 SER C . 11122 1 47 . 1 1 11 11 SER CA C 13 58.222 0.300 . 1 . . . . 11 SER CA . 11122 1 48 . 1 1 11 11 SER CB C 13 64.125 0.300 . 1 . . . . 11 SER CB . 11122 1 49 . 1 1 11 11 SER N N 15 119.663 0.300 . 1 . . . . 11 SER N . 11122 1 50 . 1 1 12 12 GLY H H 1 8.266 0.030 . 1 . . . . 12 GLY H . 11122 1 51 . 1 1 12 12 GLY HA2 H 1 4.118 0.030 . 2 . . . . 12 GLY HA2 . 11122 1 52 . 1 1 12 12 GLY C C 13 171.908 0.300 . 1 . . . . 12 GLY C . 11122 1 53 . 1 1 12 12 GLY CA C 13 44.654 0.300 . 1 . . . . 12 GLY CA . 11122 1 54 . 1 1 12 12 GLY N N 15 110.851 0.300 . 1 . . . . 12 GLY N . 11122 1 55 . 1 1 13 13 PRO HA H 1 4.401 0.030 . 1 . . . . 13 PRO HA . 11122 1 56 . 1 1 13 13 PRO HB2 H 1 1.964 0.030 . 2 . . . . 13 PRO HB2 . 11122 1 57 . 1 1 13 13 PRO HB3 H 1 2.285 0.030 . 2 . . . . 13 PRO HB3 . 11122 1 58 . 1 1 13 13 PRO C C 13 177.614 0.300 . 1 . . . . 13 PRO C . 11122 1 59 . 1 1 13 13 PRO CA C 13 63.486 0.300 . 1 . . . . 13 PRO CA . 11122 1 60 . 1 1 13 13 PRO CB C 13 32.145 0.300 . 1 . . . . 13 PRO CB . 11122 1 61 . 1 1 13 13 PRO CG C 13 27.239 0.300 . 1 . . . . 13 PRO CG . 11122 1 62 . 1 1 14 14 GLY H H 1 8.513 0.030 . 1 . . . . 14 GLY H . 11122 1 63 . 1 1 14 14 GLY HA2 H 1 3.951 0.030 . 1 . . . . 14 GLY HA2 . 11122 1 64 . 1 1 14 14 GLY HA3 H 1 3.951 0.030 . 1 . . . . 14 GLY HA3 . 11122 1 65 . 1 1 14 14 GLY C C 13 173.972 0.300 . 1 . . . . 14 GLY C . 11122 1 66 . 1 1 14 14 GLY CA C 13 45.219 0.300 . 1 . . . . 14 GLY CA . 11122 1 67 . 1 1 14 14 GLY N N 15 109.739 0.300 . 1 . . . . 14 GLY N . 11122 1 68 . 1 1 15 15 THR H H 1 8.029 0.030 . 1 . . . . 15 THR H . 11122 1 69 . 1 1 15 15 THR HA H 1 4.586 0.030 . 1 . . . . 15 THR HA . 11122 1 70 . 1 1 15 15 THR HB H 1 4.139 0.030 . 1 . . . . 15 THR HB . 11122 1 71 . 1 1 15 15 THR HG21 H 1 1.220 0.030 . 1 . . . . 15 THR HG2 . 11122 1 72 . 1 1 15 15 THR HG22 H 1 1.220 0.030 . 1 . . . . 15 THR HG2 . 11122 1 73 . 1 1 15 15 THR HG23 H 1 1.220 0.030 . 1 . . . . 15 THR HG2 . 11122 1 74 . 1 1 15 15 THR C C 13 172.879 0.300 . 1 . . . . 15 THR C . 11122 1 75 . 1 1 15 15 THR CA C 13 59.724 0.300 . 1 . . . . 15 THR CA . 11122 1 76 . 1 1 15 15 THR CB C 13 69.799 0.300 . 1 . . . . 15 THR CB . 11122 1 77 . 1 1 15 15 THR CG2 C 13 20.850 0.300 . 1 . . . . 15 THR CG2 . 11122 1 78 . 1 1 15 15 THR N N 15 116.428 0.300 . 1 . . . . 15 THR N . 11122 1 79 . 1 1 16 16 PRO HA H 1 4.432 0.030 . 1 . . . . 16 PRO HA . 11122 1 80 . 1 1 16 16 PRO HD2 H 1 3.846 0.030 . 2 . . . . 16 PRO HD2 . 11122 1 81 . 1 1 16 16 PRO HD3 H 1 3.704 0.030 . 2 . . . . 16 PRO HD3 . 11122 1 82 . 1 1 16 16 PRO CA C 13 63.099 0.300 . 1 . . . . 16 PRO CA . 11122 1 83 . 1 1 16 16 PRO CB C 13 32.136 0.300 . 1 . . . . 16 PRO CB . 11122 1 84 . 1 1 16 16 PRO CD C 13 51.073 0.300 . 1 . . . . 16 PRO CD . 11122 1 85 . 1 1 16 16 PRO CG C 13 27.411 0.300 . 1 . . . . 16 PRO CG . 11122 1 86 . 1 1 17 17 GLU H H 1 8.471 0.030 . 1 . . . . 17 GLU H . 11122 1 87 . 1 1 17 17 GLU HA H 1 4.532 0.030 . 1 . . . . 17 GLU HA . 11122 1 88 . 1 1 17 17 GLU HB2 H 1 2.017 0.030 . 2 . . . . 17 GLU HB2 . 11122 1 89 . 1 1 17 17 GLU HB3 H 1 1.892 0.030 . 2 . . . . 17 GLU HB3 . 11122 1 90 . 1 1 17 17 GLU HG2 H 1 2.309 0.030 . 1 . . . . 17 GLU HG2 . 11122 1 91 . 1 1 17 17 GLU HG3 H 1 2.309 0.030 . 1 . . . . 17 GLU HG3 . 11122 1 92 . 1 1 17 17 GLU CA C 13 54.333 0.300 . 1 . . . . 17 GLU CA . 11122 1 93 . 1 1 17 17 GLU CB C 13 29.755 0.300 . 1 . . . . 17 GLU CB . 11122 1 94 . 1 1 17 17 GLU CG C 13 36.029 0.300 . 1 . . . . 17 GLU CG . 11122 1 95 . 1 1 17 17 GLU N N 15 123.028 0.300 . 1 . . . . 17 GLU N . 11122 1 96 . 1 1 18 18 PRO HA H 1 4.435 0.030 . 1 . . . . 18 PRO HA . 11122 1 97 . 1 1 18 18 PRO HB2 H 1 2.290 0.030 . 2 . . . . 18 PRO HB2 . 11122 1 98 . 1 1 18 18 PRO HB3 H 1 1.895 0.030 . 2 . . . . 18 PRO HB3 . 11122 1 99 . 1 1 18 18 PRO HD2 H 1 3.813 0.030 . 2 . . . . 18 PRO HD2 . 11122 1 100 . 1 1 18 18 PRO HD3 H 1 3.675 0.030 . 2 . . . . 18 PRO HD3 . 11122 1 101 . 1 1 18 18 PRO C C 13 176.667 0.300 . 1 . . . . 18 PRO C . 11122 1 102 . 1 1 18 18 PRO CA C 13 63.051 0.300 . 1 . . . . 18 PRO CA . 11122 1 103 . 1 1 18 18 PRO CB C 13 32.100 0.300 . 1 . . . . 18 PRO CB . 11122 1 104 . 1 1 18 18 PRO CD C 13 50.683 0.300 . 1 . . . . 18 PRO CD . 11122 1 105 . 1 1 18 18 PRO CG C 13 27.321 0.300 . 1 . . . . 18 PRO CG . 11122 1 106 . 1 1 19 19 ARG H H 1 8.422 0.030 . 1 . . . . 19 ARG H . 11122 1 107 . 1 1 19 19 ARG HA H 1 4.609 0.030 . 1 . . . . 19 ARG HA . 11122 1 108 . 1 1 19 19 ARG HB2 H 1 1.833 0.030 . 2 . . . . 19 ARG HB2 . 11122 1 109 . 1 1 19 19 ARG HB3 H 1 1.715 0.030 . 2 . . . . 19 ARG HB3 . 11122 1 110 . 1 1 19 19 ARG HD2 H 1 3.212 0.030 . 2 . . . . 19 ARG HD2 . 11122 1 111 . 1 1 19 19 ARG HG2 H 1 1.693 0.030 . 2 . . . . 19 ARG HG2 . 11122 1 112 . 1 1 19 19 ARG C C 13 174.239 0.300 . 1 . . . . 19 ARG C . 11122 1 113 . 1 1 19 19 ARG CA C 13 53.710 0.300 . 1 . . . . 19 ARG CA . 11122 1 114 . 1 1 19 19 ARG CB C 13 30.279 0.300 . 1 . . . . 19 ARG CB . 11122 1 115 . 1 1 19 19 ARG CD C 13 43.337 0.300 . 1 . . . . 19 ARG CD . 11122 1 116 . 1 1 19 19 ARG CG C 13 26.811 0.300 . 1 . . . . 19 ARG CG . 11122 1 117 . 1 1 19 19 ARG N N 15 122.588 0.300 . 1 . . . . 19 ARG N . 11122 1 118 . 1 1 20 20 PRO HA H 1 4.406 0.030 . 1 . . . . 20 PRO HA . 11122 1 119 . 1 1 20 20 PRO HB2 H 1 1.885 0.030 . 2 . . . . 20 PRO HB2 . 11122 1 120 . 1 1 20 20 PRO HB3 H 1 2.284 0.030 . 2 . . . . 20 PRO HB3 . 11122 1 121 . 1 1 20 20 PRO HD2 H 1 3.792 0.030 . 2 . . . . 20 PRO HD2 . 11122 1 122 . 1 1 20 20 PRO HD3 H 1 3.606 0.030 . 2 . . . . 20 PRO HD3 . 11122 1 123 . 1 1 20 20 PRO HG2 H 1 1.999 0.030 . 1 . . . . 20 PRO HG2 . 11122 1 124 . 1 1 20 20 PRO HG3 H 1 1.999 0.030 . 1 . . . . 20 PRO HG3 . 11122 1 125 . 1 1 20 20 PRO C C 13 176.522 0.300 . 1 . . . . 20 PRO C . 11122 1 126 . 1 1 20 20 PRO CA C 13 63.015 0.300 . 1 . . . . 20 PRO CA . 11122 1 127 . 1 1 20 20 PRO CB C 13 32.143 0.300 . 1 . . . . 20 PRO CB . 11122 1 128 . 1 1 20 20 PRO CD C 13 50.597 0.300 . 1 . . . . 20 PRO CD . 11122 1 129 . 1 1 20 20 PRO CG C 13 27.431 0.300 . 1 . . . . 20 PRO CG . 11122 1 130 . 1 1 21 21 ALA H H 1 8.484 0.030 . 1 . . . . 21 ALA H . 11122 1 131 . 1 1 21 21 ALA HA H 1 4.326 0.030 . 1 . . . . 21 ALA HA . 11122 1 132 . 1 1 21 21 ALA HB1 H 1 1.376 0.030 . 1 . . . . 21 ALA HB . 11122 1 133 . 1 1 21 21 ALA HB2 H 1 1.376 0.030 . 1 . . . . 21 ALA HB . 11122 1 134 . 1 1 21 21 ALA HB3 H 1 1.376 0.030 . 1 . . . . 21 ALA HB . 11122 1 135 . 1 1 21 21 ALA C C 13 177.760 0.300 . 1 . . . . 21 ALA C . 11122 1 136 . 1 1 21 21 ALA CA C 13 52.373 0.300 . 1 . . . . 21 ALA CA . 11122 1 137 . 1 1 21 21 ALA CB C 13 19.249 0.300 . 1 . . . . 21 ALA CB . 11122 1 138 . 1 1 21 21 ALA N N 15 124.820 0.300 . 1 . . . . 21 ALA N . 11122 1 139 . 1 1 22 22 THR H H 1 8.219 0.030 . 1 . . . . 22 THR H . 11122 1 140 . 1 1 22 22 THR HA H 1 4.585 0.030 . 1 . . . . 22 THR HA . 11122 1 141 . 1 1 22 22 THR HB H 1 4.150 0.030 . 1 . . . . 22 THR HB . 11122 1 142 . 1 1 22 22 THR HG21 H 1 1.221 0.030 . 1 . . . . 22 THR HG2 . 11122 1 143 . 1 1 22 22 THR HG22 H 1 1.221 0.030 . 1 . . . . 22 THR HG2 . 11122 1 144 . 1 1 22 22 THR HG23 H 1 1.221 0.030 . 1 . . . . 22 THR HG2 . 11122 1 145 . 1 1 22 22 THR C C 13 173.001 0.300 . 1 . . . . 22 THR C . 11122 1 146 . 1 1 22 22 THR CA C 13 59.632 0.300 . 1 . . . . 22 THR CA . 11122 1 147 . 1 1 22 22 THR CB C 13 69.808 0.300 . 1 . . . . 22 THR CB . 11122 1 148 . 1 1 22 22 THR CG2 C 13 20.927 0.300 . 1 . . . . 22 THR CG2 . 11122 1 149 . 1 1 22 22 THR N N 15 115.934 0.300 . 1 . . . . 22 THR N . 11122 1 150 . 1 1 23 23 PRO HA H 1 4.405 0.030 . 1 . . . . 23 PRO HA . 11122 1 151 . 1 1 23 23 PRO HB2 H 1 2.008 0.030 . 2 . . . . 23 PRO HB2 . 11122 1 152 . 1 1 23 23 PRO HB3 H 1 2.302 0.030 . 2 . . . . 23 PRO HB3 . 11122 1 153 . 1 1 23 23 PRO HD2 H 1 3.847 0.030 . 2 . . . . 23 PRO HD2 . 11122 1 154 . 1 1 23 23 PRO HD3 H 1 3.704 0.030 . 2 . . . . 23 PRO HD3 . 11122 1 155 . 1 1 23 23 PRO C C 13 177.687 0.300 . 1 . . . . 23 PRO C . 11122 1 156 . 1 1 23 23 PRO CA C 13 63.615 0.300 . 1 . . . . 23 PRO CA . 11122 1 157 . 1 1 23 23 PRO CB C 13 31.993 0.300 . 1 . . . . 23 PRO CB . 11122 1 158 . 1 1 23 23 PRO CD C 13 51.051 0.300 . 1 . . . . 23 PRO CD . 11122 1 159 . 1 1 23 23 PRO CG C 13 26.992 0.300 . 1 . . . . 23 PRO CG . 11122 1 160 . 1 1 24 24 GLY H H 1 8.519 0.030 . 1 . . . . 24 GLY H . 11122 1 161 . 1 1 24 24 GLY HA2 H 1 3.947 0.030 . 1 . . . . 24 GLY HA2 . 11122 1 162 . 1 1 24 24 GLY HA3 H 1 3.947 0.030 . 1 . . . . 24 GLY HA3 . 11122 1 163 . 1 1 24 24 GLY C C 13 173.923 0.300 . 1 . . . . 24 GLY C . 11122 1 164 . 1 1 24 24 GLY CA C 13 45.182 0.300 . 1 . . . . 24 GLY CA . 11122 1 165 . 1 1 24 24 GLY N N 15 109.460 0.300 . 1 . . . . 24 GLY N . 11122 1 166 . 1 1 25 25 ALA H H 1 8.126 0.030 . 1 . . . . 25 ALA H . 11122 1 167 . 1 1 25 25 ALA HA H 1 4.360 0.030 . 1 . . . . 25 ALA HA . 11122 1 168 . 1 1 25 25 ALA HB1 H 1 1.393 0.030 . 1 . . . . 25 ALA HB . 11122 1 169 . 1 1 25 25 ALA HB2 H 1 1.393 0.030 . 1 . . . . 25 ALA HB . 11122 1 170 . 1 1 25 25 ALA HB3 H 1 1.393 0.030 . 1 . . . . 25 ALA HB . 11122 1 171 . 1 1 25 25 ALA C C 13 177.906 0.300 . 1 . . . . 25 ALA C . 11122 1 172 . 1 1 25 25 ALA CA C 13 52.521 0.300 . 1 . . . . 25 ALA CA . 11122 1 173 . 1 1 25 25 ALA CB C 13 19.489 0.300 . 1 . . . . 25 ALA CB . 11122 1 174 . 1 1 25 25 ALA N N 15 123.705 0.300 . 1 . . . . 25 ALA N . 11122 1 175 . 1 1 26 26 SER H H 1 8.331 0.030 . 1 . . . . 26 SER H . 11122 1 176 . 1 1 26 26 SER HA H 1 4.586 0.030 . 1 . . . . 26 SER HA . 11122 1 177 . 1 1 26 26 SER HB2 H 1 3.843 0.030 . 1 . . . . 26 SER HB2 . 11122 1 178 . 1 1 26 26 SER HB3 H 1 3.843 0.030 . 1 . . . . 26 SER HB3 . 11122 1 179 . 1 1 26 26 SER C C 13 173.875 0.300 . 1 . . . . 26 SER C . 11122 1 180 . 1 1 26 26 SER CA C 13 58.098 0.300 . 1 . . . . 26 SER CA . 11122 1 181 . 1 1 26 26 SER CB C 13 64.125 0.300 . 1 . . . . 26 SER CB . 11122 1 182 . 1 1 26 26 SER N N 15 115.465 0.300 . 1 . . . . 26 SER N . 11122 1 183 . 1 1 27 27 SER H H 1 8.229 0.030 . 1 . . . . 27 SER H . 11122 1 184 . 1 1 27 27 SER HA H 1 4.653 0.030 . 1 . . . . 27 SER HA . 11122 1 185 . 1 1 27 27 SER HB2 H 1 3.966 0.030 . 2 . . . . 27 SER HB2 . 11122 1 186 . 1 1 27 27 SER HB3 H 1 4.196 0.030 . 2 . . . . 27 SER HB3 . 11122 1 187 . 1 1 27 27 SER C C 13 174.676 0.300 . 1 . . . . 27 SER C . 11122 1 188 . 1 1 27 27 SER CA C 13 57.588 0.300 . 1 . . . . 27 SER CA . 11122 1 189 . 1 1 27 27 SER CB C 13 65.365 0.300 . 1 . . . . 27 SER CB . 11122 1 190 . 1 1 27 27 SER N N 15 116.763 0.300 . 1 . . . . 27 SER N . 11122 1 191 . 1 1 28 28 VAL H H 1 8.739 0.030 . 1 . . . . 28 VAL H . 11122 1 192 . 1 1 28 28 VAL HA H 1 3.486 0.030 . 1 . . . . 28 VAL HA . 11122 1 193 . 1 1 28 28 VAL HB H 1 2.107 0.030 . 1 . . . . 28 VAL HB . 11122 1 194 . 1 1 28 28 VAL HG11 H 1 1.168 0.030 . 1 . . . . 28 VAL HG1 . 11122 1 195 . 1 1 28 28 VAL HG12 H 1 1.168 0.030 . 1 . . . . 28 VAL HG1 . 11122 1 196 . 1 1 28 28 VAL HG13 H 1 1.168 0.030 . 1 . . . . 28 VAL HG1 . 11122 1 197 . 1 1 28 28 VAL HG21 H 1 0.906 0.030 . 1 . . . . 28 VAL HG2 . 11122 1 198 . 1 1 28 28 VAL HG22 H 1 0.906 0.030 . 1 . . . . 28 VAL HG2 . 11122 1 199 . 1 1 28 28 VAL HG23 H 1 0.906 0.030 . 1 . . . . 28 VAL HG2 . 11122 1 200 . 1 1 28 28 VAL C C 13 177.274 0.300 . 1 . . . . 28 VAL C . 11122 1 201 . 1 1 28 28 VAL CA C 13 67.403 0.300 . 1 . . . . 28 VAL CA . 11122 1 202 . 1 1 28 28 VAL CB C 13 32.026 0.300 . 1 . . . . 28 VAL CB . 11122 1 203 . 1 1 28 28 VAL CG1 C 13 23.750 0.300 . 2 . . . . 28 VAL CG1 . 11122 1 204 . 1 1 28 28 VAL CG2 C 13 21.166 0.300 . 2 . . . . 28 VAL CG2 . 11122 1 205 . 1 1 28 28 VAL N N 15 122.542 0.300 . 1 . . . . 28 VAL N . 11122 1 206 . 1 1 29 29 GLU H H 1 8.337 0.030 . 1 . . . . 29 GLU H . 11122 1 207 . 1 1 29 29 GLU HA H 1 3.993 0.030 . 1 . . . . 29 GLU HA . 11122 1 208 . 1 1 29 29 GLU HB2 H 1 1.958 0.030 . 2 . . . . 29 GLU HB2 . 11122 1 209 . 1 1 29 29 GLU HB3 H 1 2.143 0.030 . 2 . . . . 29 GLU HB3 . 11122 1 210 . 1 1 29 29 GLU C C 13 178.707 0.300 . 1 . . . . 29 GLU C . 11122 1 211 . 1 1 29 29 GLU CA C 13 59.632 0.300 . 1 . . . . 29 GLU CA . 11122 1 212 . 1 1 29 29 GLU CB C 13 29.356 0.300 . 1 . . . . 29 GLU CB . 11122 1 213 . 1 1 29 29 GLU CG C 13 36.054 0.300 . 1 . . . . 29 GLU CG . 11122 1 214 . 1 1 29 29 GLU N N 15 118.206 0.300 . 1 . . . . 29 GLU N . 11122 1 215 . 1 1 30 30 GLN H H 1 7.918 0.030 . 1 . . . . 30 GLN H . 11122 1 216 . 1 1 30 30 GLN HA H 1 3.986 0.030 . 1 . . . . 30 GLN HA . 11122 1 217 . 1 1 30 30 GLN HB2 H 1 2.178 0.030 . 2 . . . . 30 GLN HB2 . 11122 1 218 . 1 1 30 30 GLN HB3 H 1 2.114 0.030 . 2 . . . . 30 GLN HB3 . 11122 1 219 . 1 1 30 30 GLN HE21 H 1 6.849 0.030 . 2 . . . . 30 GLN HE21 . 11122 1 220 . 1 1 30 30 GLN HE22 H 1 7.744 0.030 . 2 . . . . 30 GLN HE22 . 11122 1 221 . 1 1 30 30 GLN HG2 H 1 2.402 0.030 . 1 . . . . 30 GLN HG2 . 11122 1 222 . 1 1 30 30 GLN HG3 H 1 2.402 0.030 . 1 . . . . 30 GLN HG3 . 11122 1 223 . 1 1 30 30 GLN C C 13 178.901 0.300 . 1 . . . . 30 GLN C . 11122 1 224 . 1 1 30 30 GLN CA C 13 58.975 0.300 . 1 . . . . 30 GLN CA . 11122 1 225 . 1 1 30 30 GLN CB C 13 28.507 0.300 . 1 . . . . 30 GLN CB . 11122 1 226 . 1 1 30 30 GLN CG C 13 33.611 0.300 . 1 . . . . 30 GLN CG . 11122 1 227 . 1 1 30 30 GLN N N 15 118.905 0.300 . 1 . . . . 30 GLN N . 11122 1 228 . 1 1 30 30 GLN NE2 N 15 112.458 0.300 . 1 . . . . 30 GLN NE2 . 11122 1 229 . 1 1 31 31 LEU H H 1 8.096 0.030 . 1 . . . . 31 LEU H . 11122 1 230 . 1 1 31 31 LEU HA H 1 4.095 0.030 . 1 . . . . 31 LEU HA . 11122 1 231 . 1 1 31 31 LEU HB2 H 1 1.835 0.030 . 2 . . . . 31 LEU HB2 . 11122 1 232 . 1 1 31 31 LEU HB3 H 1 1.502 0.030 . 2 . . . . 31 LEU HB3 . 11122 1 233 . 1 1 31 31 LEU HD11 H 1 0.904 0.030 . 1 . . . . 31 LEU HD1 . 11122 1 234 . 1 1 31 31 LEU HD12 H 1 0.904 0.030 . 1 . . . . 31 LEU HD1 . 11122 1 235 . 1 1 31 31 LEU HD13 H 1 0.904 0.030 . 1 . . . . 31 LEU HD1 . 11122 1 236 . 1 1 31 31 LEU HD21 H 1 0.728 0.030 . 1 . . . . 31 LEU HD2 . 11122 1 237 . 1 1 31 31 LEU HD22 H 1 0.728 0.030 . 1 . . . . 31 LEU HD2 . 11122 1 238 . 1 1 31 31 LEU HD23 H 1 0.728 0.030 . 1 . . . . 31 LEU HD2 . 11122 1 239 . 1 1 31 31 LEU HG H 1 1.696 0.030 . 1 . . . . 31 LEU HG . 11122 1 240 . 1 1 31 31 LEU C C 13 179.120 0.300 . 1 . . . . 31 LEU C . 11122 1 241 . 1 1 31 31 LEU CA C 13 57.870 0.300 . 1 . . . . 31 LEU CA . 11122 1 242 . 1 1 31 31 LEU CB C 13 43.035 0.300 . 1 . . . . 31 LEU CB . 11122 1 243 . 1 1 31 31 LEU CD1 C 13 22.662 0.300 . 2 . . . . 31 LEU CD1 . 11122 1 244 . 1 1 31 31 LEU CD2 C 13 25.597 0.300 . 2 . . . . 31 LEU CD2 . 11122 1 245 . 1 1 31 31 LEU CG C 13 27.644 0.300 . 1 . . . . 31 LEU CG . 11122 1 246 . 1 1 31 31 LEU N N 15 121.084 0.300 . 1 . . . . 31 LEU N . 11122 1 247 . 1 1 32 32 ARG H H 1 8.788 0.030 . 1 . . . . 32 ARG H . 11122 1 248 . 1 1 32 32 ARG HA H 1 3.871 0.030 . 1 . . . . 32 ARG HA . 11122 1 249 . 1 1 32 32 ARG HB2 H 1 2.157 0.030 . 2 . . . . 32 ARG HB2 . 11122 1 250 . 1 1 32 32 ARG HB3 H 1 1.757 0.030 . 2 . . . . 32 ARG HB3 . 11122 1 251 . 1 1 32 32 ARG HD2 H 1 3.038 0.030 . 2 . . . . 32 ARG HD2 . 11122 1 252 . 1 1 32 32 ARG HD3 H 1 3.289 0.030 . 2 . . . . 32 ARG HD3 . 11122 1 253 . 1 1 32 32 ARG HG2 H 1 1.645 0.030 . 2 . . . . 32 ARG HG2 . 11122 1 254 . 1 1 32 32 ARG HG3 H 1 1.492 0.030 . 2 . . . . 32 ARG HG3 . 11122 1 255 . 1 1 32 32 ARG C C 13 177.736 0.300 . 1 . . . . 32 ARG C . 11122 1 256 . 1 1 32 32 ARG CA C 13 60.584 0.300 . 1 . . . . 32 ARG CA . 11122 1 257 . 1 1 32 32 ARG CB C 13 30.690 0.300 . 1 . . . . 32 ARG CB . 11122 1 258 . 1 1 32 32 ARG CD C 13 43.627 0.300 . 1 . . . . 32 ARG CD . 11122 1 259 . 1 1 32 32 ARG CG C 13 27.842 0.300 . 1 . . . . 32 ARG CG . 11122 1 260 . 1 1 32 32 ARG N N 15 120.053 0.300 . 1 . . . . 32 ARG N . 11122 1 261 . 1 1 33 33 LYS H H 1 7.983 0.030 . 1 . . . . 33 LYS H . 11122 1 262 . 1 1 33 33 LYS HA H 1 3.985 0.030 . 1 . . . . 33 LYS HA . 11122 1 263 . 1 1 33 33 LYS HB2 H 1 1.971 0.030 . 1 . . . . 33 LYS HB2 . 11122 1 264 . 1 1 33 33 LYS HB3 H 1 1.971 0.030 . 1 . . . . 33 LYS HB3 . 11122 1 265 . 1 1 33 33 LYS HD2 H 1 1.701 0.030 . 2 . . . . 33 LYS HD2 . 11122 1 266 . 1 1 33 33 LYS HE2 H 1 2.973 0.030 . 2 . . . . 33 LYS HE2 . 11122 1 267 . 1 1 33 33 LYS HG2 H 1 1.405 0.030 . 2 . . . . 33 LYS HG2 . 11122 1 268 . 1 1 33 33 LYS HG3 H 1 1.673 0.030 . 2 . . . . 33 LYS HG3 . 11122 1 269 . 1 1 33 33 LYS C C 13 179.362 0.300 . 1 . . . . 33 LYS C . 11122 1 270 . 1 1 33 33 LYS CA C 13 60.327 0.300 . 1 . . . . 33 LYS CA . 11122 1 271 . 1 1 33 33 LYS CB C 13 32.255 0.300 . 1 . . . . 33 LYS CB . 11122 1 272 . 1 1 33 33 LYS CD C 13 29.695 0.300 . 1 . . . . 33 LYS CD . 11122 1 273 . 1 1 33 33 LYS CE C 13 42.086 0.300 . 1 . . . . 33 LYS CE . 11122 1 274 . 1 1 33 33 LYS CG C 13 25.639 0.300 . 1 . . . . 33 LYS CG . 11122 1 275 . 1 1 33 33 LYS N N 15 118.694 0.300 . 1 . . . . 33 LYS N . 11122 1 276 . 1 1 34 34 GLU H H 1 8.358 0.030 . 1 . . . . 34 GLU H . 11122 1 277 . 1 1 34 34 GLU HA H 1 3.999 0.030 . 1 . . . . 34 GLU HA . 11122 1 278 . 1 1 34 34 GLU HB2 H 1 2.121 0.030 . 2 . . . . 34 GLU HB2 . 11122 1 279 . 1 1 34 34 GLU HB3 H 1 1.978 0.030 . 2 . . . . 34 GLU HB3 . 11122 1 280 . 1 1 34 34 GLU HG2 H 1 2.362 0.030 . 2 . . . . 34 GLU HG2 . 11122 1 281 . 1 1 34 34 GLU HG3 H 1 2.113 0.030 . 2 . . . . 34 GLU HG3 . 11122 1 282 . 1 1 34 34 GLU C C 13 179.848 0.300 . 1 . . . . 34 GLU C . 11122 1 283 . 1 1 34 34 GLU CA C 13 59.403 0.300 . 1 . . . . 34 GLU CA . 11122 1 284 . 1 1 34 34 GLU CB C 13 29.378 0.300 . 1 . . . . 34 GLU CB . 11122 1 285 . 1 1 34 34 GLU CG C 13 36.049 0.300 . 1 . . . . 34 GLU CG . 11122 1 286 . 1 1 34 34 GLU N N 15 120.794 0.300 . 1 . . . . 34 GLU N . 11122 1 287 . 1 1 35 35 GLY H H 1 8.795 0.030 . 1 . . . . 35 GLY H . 11122 1 288 . 1 1 35 35 GLY HA2 H 1 3.018 0.030 . 2 . . . . 35 GLY HA2 . 11122 1 289 . 1 1 35 35 GLY HA3 H 1 3.306 0.030 . 2 . . . . 35 GLY HA3 . 11122 1 290 . 1 1 35 35 GLY C C 13 174.531 0.300 . 1 . . . . 35 GLY C . 11122 1 291 . 1 1 35 35 GLY CA C 13 47.931 0.300 . 1 . . . . 35 GLY CA . 11122 1 292 . 1 1 35 35 GLY N N 15 106.818 0.300 . 1 . . . . 35 GLY N . 11122 1 293 . 1 1 36 36 ASN H H 1 8.722 0.030 . 1 . . . . 36 ASN H . 11122 1 294 . 1 1 36 36 ASN HA H 1 4.473 0.030 . 1 . . . . 36 ASN HA . 11122 1 295 . 1 1 36 36 ASN HB2 H 1 3.249 0.030 . 2 . . . . 36 ASN HB2 . 11122 1 296 . 1 1 36 36 ASN HB3 H 1 2.927 0.030 . 2 . . . . 36 ASN HB3 . 11122 1 297 . 1 1 36 36 ASN HD21 H 1 7.875 0.030 . 2 . . . . 36 ASN HD21 . 11122 1 298 . 1 1 36 36 ASN HD22 H 1 6.941 0.030 . 2 . . . . 36 ASN HD22 . 11122 1 299 . 1 1 36 36 ASN C C 13 178.658 0.300 . 1 . . . . 36 ASN C . 11122 1 300 . 1 1 36 36 ASN CA C 13 55.636 0.300 . 1 . . . . 36 ASN CA . 11122 1 301 . 1 1 36 36 ASN CB C 13 37.219 0.300 . 1 . . . . 36 ASN CB . 11122 1 302 . 1 1 36 36 ASN N N 15 120.101 0.300 . 1 . . . . 36 ASN N . 11122 1 303 . 1 1 36 36 ASN ND2 N 15 110.895 0.300 . 1 . . . . 36 ASN ND2 . 11122 1 304 . 1 1 37 37 GLU H H 1 8.234 0.030 . 1 . . . . 37 GLU H . 11122 1 305 . 1 1 37 37 GLU HA H 1 4.143 0.030 . 1 . . . . 37 GLU HA . 11122 1 306 . 1 1 37 37 GLU HB2 H 1 2.171 0.030 . 2 . . . . 37 GLU HB2 . 11122 1 307 . 1 1 37 37 GLU HG2 H 1 2.373 0.030 . 2 . . . . 37 GLU HG2 . 11122 1 308 . 1 1 37 37 GLU C C 13 179.387 0.300 . 1 . . . . 37 GLU C . 11122 1 309 . 1 1 37 37 GLU CA C 13 59.346 0.300 . 1 . . . . 37 GLU CA . 11122 1 310 . 1 1 37 37 GLU CB C 13 28.832 0.300 . 1 . . . . 37 GLU CB . 11122 1 311 . 1 1 37 37 GLU CG C 13 35.922 0.300 . 1 . . . . 37 GLU CG . 11122 1 312 . 1 1 37 37 GLU N N 15 122.435 0.300 . 1 . . . . 37 GLU N . 11122 1 313 . 1 1 38 38 LEU H H 1 8.203 0.030 . 1 . . . . 38 LEU H . 11122 1 314 . 1 1 38 38 LEU HA H 1 4.120 0.030 . 1 . . . . 38 LEU HA . 11122 1 315 . 1 1 38 38 LEU HB2 H 1 1.721 0.030 . 2 . . . . 38 LEU HB2 . 11122 1 316 . 1 1 38 38 LEU HB3 H 1 1.594 0.030 . 2 . . . . 38 LEU HB3 . 11122 1 317 . 1 1 38 38 LEU HD11 H 1 0.575 0.030 . 1 . . . . 38 LEU HD1 . 11122 1 318 . 1 1 38 38 LEU HD12 H 1 0.575 0.030 . 1 . . . . 38 LEU HD1 . 11122 1 319 . 1 1 38 38 LEU HD13 H 1 0.575 0.030 . 1 . . . . 38 LEU HD1 . 11122 1 320 . 1 1 38 38 LEU HD21 H 1 0.884 0.030 . 1 . . . . 38 LEU HD2 . 11122 1 321 . 1 1 38 38 LEU HD22 H 1 0.884 0.030 . 1 . . . . 38 LEU HD2 . 11122 1 322 . 1 1 38 38 LEU HD23 H 1 0.884 0.030 . 1 . . . . 38 LEU HD2 . 11122 1 323 . 1 1 38 38 LEU HG H 1 1.779 0.030 . 1 . . . . 38 LEU HG . 11122 1 324 . 1 1 38 38 LEU C C 13 178.828 0.300 . 1 . . . . 38 LEU C . 11122 1 325 . 1 1 38 38 LEU CA C 13 58.011 0.300 . 1 . . . . 38 LEU CA . 11122 1 326 . 1 1 38 38 LEU CB C 13 40.768 0.300 . 1 . . . . 38 LEU CB . 11122 1 327 . 1 1 38 38 LEU CD1 C 13 25.857 0.300 . 2 . . . . 38 LEU CD1 . 11122 1 328 . 1 1 38 38 LEU CD2 C 13 22.322 0.300 . 2 . . . . 38 LEU CD2 . 11122 1 329 . 1 1 38 38 LEU CG C 13 26.617 0.300 . 1 . . . . 38 LEU CG . 11122 1 330 . 1 1 38 38 LEU N N 15 121.872 0.300 . 1 . . . . 38 LEU N . 11122 1 331 . 1 1 39 39 PHE H H 1 8.972 0.030 . 1 . . . . 39 PHE H . 11122 1 332 . 1 1 39 39 PHE HA H 1 3.588 0.030 . 1 . . . . 39 PHE HA . 11122 1 333 . 1 1 39 39 PHE HB2 H 1 3.468 0.030 . 2 . . . . 39 PHE HB2 . 11122 1 334 . 1 1 39 39 PHE HB3 H 1 3.185 0.030 . 2 . . . . 39 PHE HB3 . 11122 1 335 . 1 1 39 39 PHE HD1 H 1 7.455 0.030 . 1 . . . . 39 PHE HD1 . 11122 1 336 . 1 1 39 39 PHE HD2 H 1 7.455 0.030 . 1 . . . . 39 PHE HD2 . 11122 1 337 . 1 1 39 39 PHE HE1 H 1 7.296 0.030 . 1 . . . . 39 PHE HE1 . 11122 1 338 . 1 1 39 39 PHE HE2 H 1 7.296 0.030 . 1 . . . . 39 PHE HE2 . 11122 1 339 . 1 1 39 39 PHE HZ H 1 7.293 0.030 . 1 . . . . 39 PHE HZ . 11122 1 340 . 1 1 39 39 PHE C C 13 179.460 0.300 . 1 . . . . 39 PHE C . 11122 1 341 . 1 1 39 39 PHE CA C 13 62.297 0.300 . 1 . . . . 39 PHE CA . 11122 1 342 . 1 1 39 39 PHE CB C 13 39.838 0.300 . 1 . . . . 39 PHE CB . 11122 1 343 . 1 1 39 39 PHE CD1 C 13 132.329 0.300 . 1 . . . . 39 PHE CD1 . 11122 1 344 . 1 1 39 39 PHE CD2 C 13 132.329 0.300 . 1 . . . . 39 PHE CD2 . 11122 1 345 . 1 1 39 39 PHE CE1 C 13 131.620 0.300 . 1 . . . . 39 PHE CE1 . 11122 1 346 . 1 1 39 39 PHE CE2 C 13 131.620 0.300 . 1 . . . . 39 PHE CE2 . 11122 1 347 . 1 1 39 39 PHE CZ C 13 130.201 0.300 . 1 . . . . 39 PHE CZ . 11122 1 348 . 1 1 39 39 PHE N N 15 121.270 0.300 . 1 . . . . 39 PHE N . 11122 1 349 . 1 1 40 40 LYS H H 1 8.201 0.030 . 1 . . . . 40 LYS H . 11122 1 350 . 1 1 40 40 LYS HA H 1 4.076 0.030 . 1 . . . . 40 LYS HA . 11122 1 351 . 1 1 40 40 LYS HB2 H 1 2.107 0.030 . 1 . . . . 40 LYS HB2 . 11122 1 352 . 1 1 40 40 LYS HB3 H 1 2.107 0.030 . 1 . . . . 40 LYS HB3 . 11122 1 353 . 1 1 40 40 LYS HD2 H 1 1.768 0.030 . 1 . . . . 40 LYS HD2 . 11122 1 354 . 1 1 40 40 LYS HD3 H 1 1.768 0.030 . 1 . . . . 40 LYS HD3 . 11122 1 355 . 1 1 40 40 LYS HE2 H 1 2.995 0.030 . 1 . . . . 40 LYS HE2 . 11122 1 356 . 1 1 40 40 LYS HE3 H 1 2.995 0.030 . 1 . . . . 40 LYS HE3 . 11122 1 357 . 1 1 40 40 LYS HG2 H 1 1.756 0.030 . 2 . . . . 40 LYS HG2 . 11122 1 358 . 1 1 40 40 LYS HG3 H 1 1.586 0.030 . 2 . . . . 40 LYS HG3 . 11122 1 359 . 1 1 40 40 LYS C C 13 177.930 0.300 . 1 . . . . 40 LYS C . 11122 1 360 . 1 1 40 40 LYS CA C 13 59.562 0.300 . 1 . . . . 40 LYS CA . 11122 1 361 . 1 1 40 40 LYS CB C 13 32.505 0.300 . 1 . . . . 40 LYS CB . 11122 1 362 . 1 1 40 40 LYS CD C 13 29.612 0.300 . 1 . . . . 40 LYS CD . 11122 1 363 . 1 1 40 40 LYS CE C 13 42.094 0.300 . 1 . . . . 40 LYS CE . 11122 1 364 . 1 1 40 40 LYS CG C 13 25.184 0.300 . 1 . . . . 40 LYS CG . 11122 1 365 . 1 1 40 40 LYS N N 15 120.588 0.300 . 1 . . . . 40 LYS N . 11122 1 366 . 1 1 41 41 CYS H H 1 7.471 0.030 . 1 . . . . 41 CYS H . 11122 1 367 . 1 1 41 41 CYS HA H 1 4.566 0.030 . 1 . . . . 41 CYS HA . 11122 1 368 . 1 1 41 41 CYS HB2 H 1 3.056 0.030 . 2 . . . . 41 CYS HB2 . 11122 1 369 . 1 1 41 41 CYS HB3 H 1 3.017 0.030 . 2 . . . . 41 CYS HB3 . 11122 1 370 . 1 1 41 41 CYS C C 13 174.700 0.300 . 1 . . . . 41 CYS C . 11122 1 371 . 1 1 41 41 CYS CA C 13 59.047 0.300 . 1 . . . . 41 CYS CA . 11122 1 372 . 1 1 41 41 CYS CB C 13 27.571 0.300 . 1 . . . . 41 CYS CB . 11122 1 373 . 1 1 41 41 CYS N N 15 113.444 0.300 . 1 . . . . 41 CYS N . 11122 1 374 . 1 1 42 42 GLY H H 1 7.554 0.030 . 1 . . . . 42 GLY H . 11122 1 375 . 1 1 42 42 GLY HA2 H 1 2.768 0.030 . 2 . . . . 42 GLY HA2 . 11122 1 376 . 1 1 42 42 GLY HA3 H 1 3.855 0.030 . 2 . . . . 42 GLY HA3 . 11122 1 377 . 1 1 42 42 GLY C C 13 172.685 0.300 . 1 . . . . 42 GLY C . 11122 1 378 . 1 1 42 42 GLY CA C 13 44.548 0.300 . 1 . . . . 42 GLY CA . 11122 1 379 . 1 1 42 42 GLY N N 15 108.685 0.300 . 1 . . . . 42 GLY N . 11122 1 380 . 1 1 43 43 ASP H H 1 7.853 0.030 . 1 . . . . 43 ASP H . 11122 1 381 . 1 1 43 43 ASP HA H 1 4.650 0.030 . 1 . . . . 43 ASP HA . 11122 1 382 . 1 1 43 43 ASP HB2 H 1 2.741 0.030 . 2 . . . . 43 ASP HB2 . 11122 1 383 . 1 1 43 43 ASP HB3 H 1 2.243 0.030 . 2 . . . . 43 ASP HB3 . 11122 1 384 . 1 1 43 43 ASP C C 13 175.915 0.300 . 1 . . . . 43 ASP C . 11122 1 385 . 1 1 43 43 ASP CA C 13 50.856 0.300 . 1 . . . . 43 ASP CA . 11122 1 386 . 1 1 43 43 ASP CB C 13 38.561 0.300 . 1 . . . . 43 ASP CB . 11122 1 387 . 1 1 43 43 ASP N N 15 120.770 0.300 . 1 . . . . 43 ASP N . 11122 1 388 . 1 1 44 44 TYR H H 1 6.938 0.030 . 1 . . . . 44 TYR H . 11122 1 389 . 1 1 44 44 TYR HA H 1 4.162 0.030 . 1 . . . . 44 TYR HA . 11122 1 390 . 1 1 44 44 TYR HB2 H 1 3.009 0.030 . 2 . . . . 44 TYR HB2 . 11122 1 391 . 1 1 44 44 TYR HB3 H 1 2.690 0.030 . 2 . . . . 44 TYR HB3 . 11122 1 392 . 1 1 44 44 TYR HD1 H 1 6.882 0.030 . 1 . . . . 44 TYR HD1 . 11122 1 393 . 1 1 44 44 TYR HD2 H 1 6.882 0.030 . 1 . . . . 44 TYR HD2 . 11122 1 394 . 1 1 44 44 TYR HE1 H 1 6.222 0.030 . 1 . . . . 44 TYR HE1 . 11122 1 395 . 1 1 44 44 TYR HE2 H 1 6.222 0.030 . 1 . . . . 44 TYR HE2 . 11122 1 396 . 1 1 44 44 TYR C C 13 178.367 0.300 . 1 . . . . 44 TYR C . 11122 1 397 . 1 1 44 44 TYR CA C 13 61.314 0.300 . 1 . . . . 44 TYR CA . 11122 1 398 . 1 1 44 44 TYR CB C 13 37.584 0.300 . 1 . . . . 44 TYR CB . 11122 1 399 . 1 1 44 44 TYR CD1 C 13 132.297 0.300 . 1 . . . . 44 TYR CD1 . 11122 1 400 . 1 1 44 44 TYR CD2 C 13 132.297 0.300 . 1 . . . . 44 TYR CD2 . 11122 1 401 . 1 1 44 44 TYR CE1 C 13 119.270 0.300 . 1 . . . . 44 TYR CE1 . 11122 1 402 . 1 1 44 44 TYR CE2 C 13 119.270 0.300 . 1 . . . . 44 TYR CE2 . 11122 1 403 . 1 1 44 44 TYR N N 15 121.298 0.300 . 1 . . . . 44 TYR N . 11122 1 404 . 1 1 45 45 GLY H H 1 9.126 0.030 . 1 . . . . 45 GLY H . 11122 1 405 . 1 1 45 45 GLY HA2 H 1 3.837 0.030 . 2 . . . . 45 GLY HA2 . 11122 1 406 . 1 1 45 45 GLY HA3 H 1 3.998 0.030 . 2 . . . . 45 GLY HA3 . 11122 1 407 . 1 1 45 45 GLY C C 13 177.371 0.300 . 1 . . . . 45 GLY C . 11122 1 408 . 1 1 45 45 GLY CA C 13 46.768 0.300 . 1 . . . . 45 GLY CA . 11122 1 409 . 1 1 45 45 GLY N N 15 107.512 0.300 . 1 . . . . 45 GLY N . 11122 1 410 . 1 1 46 46 GLY H H 1 8.373 0.030 . 1 . . . . 46 GLY H . 11122 1 411 . 1 1 46 46 GLY HA2 H 1 3.604 0.030 . 2 . . . . 46 GLY HA2 . 11122 1 412 . 1 1 46 46 GLY HA3 H 1 3.813 0.030 . 2 . . . . 46 GLY HA3 . 11122 1 413 . 1 1 46 46 GLY C C 13 177.153 0.300 . 1 . . . . 46 GLY C . 11122 1 414 . 1 1 46 46 GLY CA C 13 47.262 0.300 . 1 . . . . 46 GLY CA . 11122 1 415 . 1 1 46 46 GLY N N 15 113.770 0.300 . 1 . . . . 46 GLY N . 11122 1 416 . 1 1 47 47 ALA H H 1 8.514 0.030 . 1 . . . . 47 ALA H . 11122 1 417 . 1 1 47 47 ALA HA H 1 3.737 0.030 . 1 . . . . 47 ALA HA . 11122 1 418 . 1 1 47 47 ALA HB1 H 1 1.602 0.030 . 1 . . . . 47 ALA HB . 11122 1 419 . 1 1 47 47 ALA HB2 H 1 1.602 0.030 . 1 . . . . 47 ALA HB . 11122 1 420 . 1 1 47 47 ALA HB3 H 1 1.602 0.030 . 1 . . . . 47 ALA HB . 11122 1 421 . 1 1 47 47 ALA C C 13 177.493 0.300 . 1 . . . . 47 ALA C . 11122 1 422 . 1 1 47 47 ALA CA C 13 55.640 0.300 . 1 . . . . 47 ALA CA . 11122 1 423 . 1 1 47 47 ALA CB C 13 18.525 0.300 . 1 . . . . 47 ALA CB . 11122 1 424 . 1 1 47 47 ALA N N 15 127.047 0.300 . 1 . . . . 47 ALA N . 11122 1 425 . 1 1 48 48 LEU H H 1 8.311 0.030 . 1 . . . . 48 LEU H . 11122 1 426 . 1 1 48 48 LEU HA H 1 4.003 0.030 . 1 . . . . 48 LEU HA . 11122 1 427 . 1 1 48 48 LEU HB2 H 1 1.825 0.030 . 1 . . . . 48 LEU HB2 . 11122 1 428 . 1 1 48 48 LEU HB3 H 1 1.825 0.030 . 1 . . . . 48 LEU HB3 . 11122 1 429 . 1 1 48 48 LEU HD11 H 1 0.762 0.030 . 1 . . . . 48 LEU HD1 . 11122 1 430 . 1 1 48 48 LEU HD12 H 1 0.762 0.030 . 1 . . . . 48 LEU HD1 . 11122 1 431 . 1 1 48 48 LEU HD13 H 1 0.762 0.030 . 1 . . . . 48 LEU HD1 . 11122 1 432 . 1 1 48 48 LEU HD21 H 1 0.698 0.030 . 1 . . . . 48 LEU HD2 . 11122 1 433 . 1 1 48 48 LEU HD22 H 1 0.698 0.030 . 1 . . . . 48 LEU HD2 . 11122 1 434 . 1 1 48 48 LEU HD23 H 1 0.698 0.030 . 1 . . . . 48 LEU HD2 . 11122 1 435 . 1 1 48 48 LEU HG H 1 1.665 0.030 . 1 . . . . 48 LEU HG . 11122 1 436 . 1 1 48 48 LEU C C 13 180.237 0.300 . 1 . . . . 48 LEU C . 11122 1 437 . 1 1 48 48 LEU CA C 13 58.716 0.300 . 1 . . . . 48 LEU CA . 11122 1 438 . 1 1 48 48 LEU CB C 13 42.374 0.300 . 1 . . . . 48 LEU CB . 11122 1 439 . 1 1 48 48 LEU CD1 C 13 25.292 0.300 . 2 . . . . 48 LEU CD1 . 11122 1 440 . 1 1 48 48 LEU CD2 C 13 24.503 0.300 . 2 . . . . 48 LEU CD2 . 11122 1 441 . 1 1 48 48 LEU CG C 13 26.911 0.300 . 1 . . . . 48 LEU CG . 11122 1 442 . 1 1 48 48 LEU N N 15 117.848 0.300 . 1 . . . . 48 LEU N . 11122 1 443 . 1 1 49 49 ALA H H 1 7.813 0.030 . 1 . . . . 49 ALA H . 11122 1 444 . 1 1 49 49 ALA HA H 1 4.133 0.030 . 1 . . . . 49 ALA HA . 11122 1 445 . 1 1 49 49 ALA HB1 H 1 1.503 0.030 . 1 . . . . 49 ALA HB . 11122 1 446 . 1 1 49 49 ALA HB2 H 1 1.503 0.030 . 1 . . . . 49 ALA HB . 11122 1 447 . 1 1 49 49 ALA HB3 H 1 1.503 0.030 . 1 . . . . 49 ALA HB . 11122 1 448 . 1 1 49 49 ALA C C 13 179.994 0.300 . 1 . . . . 49 ALA C . 11122 1 449 . 1 1 49 49 ALA CA C 13 55.494 0.300 . 1 . . . . 49 ALA CA . 11122 1 450 . 1 1 49 49 ALA CB C 13 17.790 0.300 . 1 . . . . 49 ALA CB . 11122 1 451 . 1 1 49 49 ALA N N 15 123.537 0.300 . 1 . . . . 49 ALA N . 11122 1 452 . 1 1 50 50 ALA H H 1 7.624 0.030 . 1 . . . . 50 ALA H . 11122 1 453 . 1 1 50 50 ALA HA H 1 4.146 0.030 . 1 . . . . 50 ALA HA . 11122 1 454 . 1 1 50 50 ALA HB1 H 1 1.263 0.030 . 1 . . . . 50 ALA HB . 11122 1 455 . 1 1 50 50 ALA HB2 H 1 1.263 0.030 . 1 . . . . 50 ALA HB . 11122 1 456 . 1 1 50 50 ALA HB3 H 1 1.263 0.030 . 1 . . . . 50 ALA HB . 11122 1 457 . 1 1 50 50 ALA C C 13 179.994 0.300 . 1 . . . . 50 ALA C . 11122 1 458 . 1 1 50 50 ALA CA C 13 55.575 0.300 . 1 . . . . 50 ALA CA . 11122 1 459 . 1 1 50 50 ALA CB C 13 16.869 0.300 . 1 . . . . 50 ALA CB . 11122 1 460 . 1 1 50 50 ALA N N 15 123.869 0.300 . 1 . . . . 50 ALA N . 11122 1 461 . 1 1 51 51 TYR H H 1 8.495 0.030 . 1 . . . . 51 TYR H . 11122 1 462 . 1 1 51 51 TYR HA H 1 4.348 0.030 . 1 . . . . 51 TYR HA . 11122 1 463 . 1 1 51 51 TYR HB2 H 1 3.028 0.030 . 2 . . . . 51 TYR HB2 . 11122 1 464 . 1 1 51 51 TYR HB3 H 1 2.854 0.030 . 2 . . . . 51 TYR HB3 . 11122 1 465 . 1 1 51 51 TYR HD1 H 1 6.793 0.030 . 1 . . . . 51 TYR HD1 . 11122 1 466 . 1 1 51 51 TYR HD2 H 1 6.793 0.030 . 1 . . . . 51 TYR HD2 . 11122 1 467 . 1 1 51 51 TYR HE1 H 1 6.666 0.030 . 1 . . . . 51 TYR HE1 . 11122 1 468 . 1 1 51 51 TYR HE2 H 1 6.666 0.030 . 1 . . . . 51 TYR HE2 . 11122 1 469 . 1 1 51 51 TYR C C 13 178.440 0.300 . 1 . . . . 51 TYR C . 11122 1 470 . 1 1 51 51 TYR CA C 13 58.564 0.300 . 1 . . . . 51 TYR CA . 11122 1 471 . 1 1 51 51 TYR CB C 13 38.481 0.300 . 1 . . . . 51 TYR CB . 11122 1 472 . 1 1 51 51 TYR CD1 C 13 132.041 0.300 . 1 . . . . 51 TYR CD1 . 11122 1 473 . 1 1 51 51 TYR CD2 C 13 132.041 0.300 . 1 . . . . 51 TYR CD2 . 11122 1 474 . 1 1 51 51 TYR CE1 C 13 117.689 0.300 . 1 . . . . 51 TYR CE1 . 11122 1 475 . 1 1 51 51 TYR CE2 C 13 117.689 0.300 . 1 . . . . 51 TYR CE2 . 11122 1 476 . 1 1 51 51 TYR N N 15 115.230 0.300 . 1 . . . . 51 TYR N . 11122 1 477 . 1 1 52 52 THR H H 1 8.481 0.030 . 1 . . . . 52 THR H . 11122 1 478 . 1 1 52 52 THR HA H 1 3.845 0.030 . 1 . . . . 52 THR HA . 11122 1 479 . 1 1 52 52 THR HB H 1 4.432 0.030 . 1 . . . . 52 THR HB . 11122 1 480 . 1 1 52 52 THR HG21 H 1 1.218 0.030 . 1 . . . . 52 THR HG2 . 11122 1 481 . 1 1 52 52 THR HG22 H 1 1.218 0.030 . 1 . . . . 52 THR HG2 . 11122 1 482 . 1 1 52 52 THR HG23 H 1 1.218 0.030 . 1 . . . . 52 THR HG2 . 11122 1 483 . 1 1 52 52 THR C C 13 176.279 0.300 . 1 . . . . 52 THR C . 11122 1 484 . 1 1 52 52 THR CA C 13 67.296 0.300 . 1 . . . . 52 THR CA . 11122 1 485 . 1 1 52 52 THR CB C 13 68.753 0.300 . 1 . . . . 52 THR CB . 11122 1 486 . 1 1 52 52 THR CG2 C 13 20.863 0.300 . 1 . . . . 52 THR CG2 . 11122 1 487 . 1 1 52 52 THR N N 15 115.079 0.300 . 1 . . . . 52 THR N . 11122 1 488 . 1 1 53 53 GLN H H 1 8.209 0.030 . 1 . . . . 53 GLN H . 11122 1 489 . 1 1 53 53 GLN HA H 1 3.999 0.030 . 1 . . . . 53 GLN HA . 11122 1 490 . 1 1 53 53 GLN HB2 H 1 2.106 0.030 . 2 . . . . 53 GLN HB2 . 11122 1 491 . 1 1 53 53 GLN HB3 H 1 2.285 0.030 . 2 . . . . 53 GLN HB3 . 11122 1 492 . 1 1 53 53 GLN HE21 H 1 7.265 0.030 . 2 . . . . 53 GLN HE21 . 11122 1 493 . 1 1 53 53 GLN HE22 H 1 6.839 0.030 . 2 . . . . 53 GLN HE22 . 11122 1 494 . 1 1 53 53 GLN HG2 H 1 2.506 0.030 . 2 . . . . 53 GLN HG2 . 11122 1 495 . 1 1 53 53 GLN HG3 H 1 2.285 0.030 . 2 . . . . 53 GLN HG3 . 11122 1 496 . 1 1 53 53 GLN C C 13 179.630 0.300 . 1 . . . . 53 GLN C . 11122 1 497 . 1 1 53 53 GLN CA C 13 59.106 0.300 . 1 . . . . 53 GLN CA . 11122 1 498 . 1 1 53 53 GLN CB C 13 28.369 0.300 . 1 . . . . 53 GLN CB . 11122 1 499 . 1 1 53 53 GLN CG C 13 34.162 0.300 . 1 . . . . 53 GLN CG . 11122 1 500 . 1 1 53 53 GLN N N 15 123.293 0.300 . 1 . . . . 53 GLN N . 11122 1 501 . 1 1 53 53 GLN NE2 N 15 110.558 0.300 . 1 . . . . 53 GLN NE2 . 11122 1 502 . 1 1 54 54 ALA H H 1 8.059 0.030 . 1 . . . . 54 ALA H . 11122 1 503 . 1 1 54 54 ALA HA H 1 3.908 0.030 . 1 . . . . 54 ALA HA . 11122 1 504 . 1 1 54 54 ALA HB1 H 1 1.645 0.030 . 1 . . . . 54 ALA HB . 11122 1 505 . 1 1 54 54 ALA HB2 H 1 1.645 0.030 . 1 . . . . 54 ALA HB . 11122 1 506 . 1 1 54 54 ALA HB3 H 1 1.645 0.030 . 1 . . . . 54 ALA HB . 11122 1 507 . 1 1 54 54 ALA C C 13 178.294 0.300 . 1 . . . . 54 ALA C . 11122 1 508 . 1 1 54 54 ALA CA C 13 55.121 0.300 . 1 . . . . 54 ALA CA . 11122 1 509 . 1 1 54 54 ALA CB C 13 18.923 0.300 . 1 . . . . 54 ALA CB . 11122 1 510 . 1 1 54 54 ALA N N 15 122.085 0.300 . 1 . . . . 54 ALA N . 11122 1 511 . 1 1 55 55 LEU H H 1 7.506 0.030 . 1 . . . . 55 LEU H . 11122 1 512 . 1 1 55 55 LEU HA H 1 3.961 0.030 . 1 . . . . 55 LEU HA . 11122 1 513 . 1 1 55 55 LEU HB2 H 1 1.505 0.030 . 2 . . . . 55 LEU HB2 . 11122 1 514 . 1 1 55 55 LEU HB3 H 1 1.859 0.030 . 2 . . . . 55 LEU HB3 . 11122 1 515 . 1 1 55 55 LEU HD11 H 1 0.385 0.030 . 1 . . . . 55 LEU HD1 . 11122 1 516 . 1 1 55 55 LEU HD12 H 1 0.385 0.030 . 1 . . . . 55 LEU HD1 . 11122 1 517 . 1 1 55 55 LEU HD13 H 1 0.385 0.030 . 1 . . . . 55 LEU HD1 . 11122 1 518 . 1 1 55 55 LEU HD21 H 1 0.582 0.030 . 1 . . . . 55 LEU HD2 . 11122 1 519 . 1 1 55 55 LEU HD22 H 1 0.582 0.030 . 1 . . . . 55 LEU HD2 . 11122 1 520 . 1 1 55 55 LEU HD23 H 1 0.582 0.030 . 1 . . . . 55 LEU HD2 . 11122 1 521 . 1 1 55 55 LEU HG H 1 1.538 0.030 . 1 . . . . 55 LEU HG . 11122 1 522 . 1 1 55 55 LEU C C 13 177.930 0.300 . 1 . . . . 55 LEU C . 11122 1 523 . 1 1 55 55 LEU CA C 13 56.601 0.300 . 1 . . . . 55 LEU CA . 11122 1 524 . 1 1 55 55 LEU CB C 13 42.456 0.300 . 1 . . . . 55 LEU CB . 11122 1 525 . 1 1 55 55 LEU CD1 C 13 24.044 0.300 . 2 . . . . 55 LEU CD1 . 11122 1 526 . 1 1 55 55 LEU CD2 C 13 23.671 0.300 . 2 . . . . 55 LEU CD2 . 11122 1 527 . 1 1 55 55 LEU CG C 13 27.420 0.300 . 1 . . . . 55 LEU CG . 11122 1 528 . 1 1 55 55 LEU N N 15 115.991 0.300 . 1 . . . . 55 LEU N . 11122 1 529 . 1 1 56 56 GLY H H 1 7.558 0.030 . 1 . . . . 56 GLY H . 11122 1 530 . 1 1 56 56 GLY HA2 H 1 3.731 0.030 . 2 . . . . 56 GLY HA2 . 11122 1 531 . 1 1 56 56 GLY HA3 H 1 4.291 0.030 . 2 . . . . 56 GLY HA3 . 11122 1 532 . 1 1 56 56 GLY C C 13 174.093 0.300 . 1 . . . . 56 GLY C . 11122 1 533 . 1 1 56 56 GLY CA C 13 45.147 0.300 . 1 . . . . 56 GLY CA . 11122 1 534 . 1 1 56 56 GLY N N 15 106.000 0.300 . 1 . . . . 56 GLY N . 11122 1 535 . 1 1 57 57 LEU H H 1 7.228 0.030 . 1 . . . . 57 LEU H . 11122 1 536 . 1 1 57 57 LEU HA H 1 4.598 0.030 . 1 . . . . 57 LEU HA . 11122 1 537 . 1 1 57 57 LEU HB2 H 1 1.542 0.030 . 2 . . . . 57 LEU HB2 . 11122 1 538 . 1 1 57 57 LEU HB3 H 1 1.885 0.030 . 2 . . . . 57 LEU HB3 . 11122 1 539 . 1 1 57 57 LEU HD11 H 1 0.796 0.030 . 1 . . . . 57 LEU HD1 . 11122 1 540 . 1 1 57 57 LEU HD12 H 1 0.796 0.030 . 1 . . . . 57 LEU HD1 . 11122 1 541 . 1 1 57 57 LEU HD13 H 1 0.796 0.030 . 1 . . . . 57 LEU HD1 . 11122 1 542 . 1 1 57 57 LEU HD21 H 1 0.829 0.030 . 1 . . . . 57 LEU HD2 . 11122 1 543 . 1 1 57 57 LEU HD22 H 1 0.829 0.030 . 1 . . . . 57 LEU HD2 . 11122 1 544 . 1 1 57 57 LEU HD23 H 1 0.829 0.030 . 1 . . . . 57 LEU HD2 . 11122 1 545 . 1 1 57 57 LEU HG H 1 1.789 0.030 . 1 . . . . 57 LEU HG . 11122 1 546 . 1 1 57 57 LEU C C 13 175.963 0.300 . 1 . . . . 57 LEU C . 11122 1 547 . 1 1 57 57 LEU CA C 13 53.419 0.300 . 1 . . . . 57 LEU CA . 11122 1 548 . 1 1 57 57 LEU CB C 13 41.948 0.300 . 1 . . . . 57 LEU CB . 11122 1 549 . 1 1 57 57 LEU CD1 C 13 26.311 0.300 . 2 . . . . 57 LEU CD1 . 11122 1 550 . 1 1 57 57 LEU CD2 C 13 22.378 0.300 . 2 . . . . 57 LEU CD2 . 11122 1 551 . 1 1 57 57 LEU CG C 13 26.565 0.300 . 1 . . . . 57 LEU CG . 11122 1 552 . 1 1 57 57 LEU N N 15 121.906 0.300 . 1 . . . . 57 LEU N . 11122 1 553 . 1 1 58 58 ASP H H 1 8.223 0.030 . 1 . . . . 58 ASP H . 11122 1 554 . 1 1 58 58 ASP HA H 1 4.572 0.030 . 1 . . . . 58 ASP HA . 11122 1 555 . 1 1 58 58 ASP HB2 H 1 2.689 0.030 . 2 . . . . 58 ASP HB2 . 11122 1 556 . 1 1 58 58 ASP HB3 H 1 2.600 0.030 . 2 . . . . 58 ASP HB3 . 11122 1 557 . 1 1 58 58 ASP C C 13 175.477 0.300 . 1 . . . . 58 ASP C . 11122 1 558 . 1 1 58 58 ASP CA C 13 54.516 0.300 . 1 . . . . 58 ASP CA . 11122 1 559 . 1 1 58 58 ASP CB C 13 39.651 0.300 . 1 . . . . 58 ASP CB . 11122 1 560 . 1 1 58 58 ASP N N 15 119.833 0.300 . 1 . . . . 58 ASP N . 11122 1 561 . 1 1 59 59 ALA H H 1 7.859 0.030 . 1 . . . . 59 ALA H . 11122 1 562 . 1 1 59 59 ALA HA H 1 4.714 0.030 . 1 . . . . 59 ALA HA . 11122 1 563 . 1 1 59 59 ALA HB1 H 1 1.395 0.030 . 1 . . . . 59 ALA HB . 11122 1 564 . 1 1 59 59 ALA HB2 H 1 1.395 0.030 . 1 . . . . 59 ALA HB . 11122 1 565 . 1 1 59 59 ALA HB3 H 1 1.395 0.030 . 1 . . . . 59 ALA HB . 11122 1 566 . 1 1 59 59 ALA C C 13 178.003 0.300 . 1 . . . . 59 ALA C . 11122 1 567 . 1 1 59 59 ALA CA C 13 51.209 0.300 . 1 . . . . 59 ALA CA . 11122 1 568 . 1 1 59 59 ALA CB C 13 20.380 0.300 . 1 . . . . 59 ALA CB . 11122 1 569 . 1 1 59 59 ALA N N 15 124.625 0.300 . 1 . . . . 59 ALA N . 11122 1 570 . 1 1 60 60 THR H H 1 9.249 0.030 . 1 . . . . 60 THR H . 11122 1 571 . 1 1 60 60 THR HA H 1 4.632 0.030 . 1 . . . . 60 THR HA . 11122 1 572 . 1 1 60 60 THR HB H 1 4.798 0.030 . 1 . . . . 60 THR HB . 11122 1 573 . 1 1 60 60 THR HG21 H 1 1.499 0.030 . 1 . . . . 60 THR HG2 . 11122 1 574 . 1 1 60 60 THR HG22 H 1 1.499 0.030 . 1 . . . . 60 THR HG2 . 11122 1 575 . 1 1 60 60 THR HG23 H 1 1.499 0.030 . 1 . . . . 60 THR HG2 . 11122 1 576 . 1 1 60 60 THR C C 13 173.802 0.300 . 1 . . . . 60 THR C . 11122 1 577 . 1 1 60 60 THR CA C 13 60.767 0.300 . 1 . . . . 60 THR CA . 11122 1 578 . 1 1 60 60 THR CB C 13 68.610 0.300 . 1 . . . . 60 THR CB . 11122 1 579 . 1 1 60 60 THR CG2 C 13 22.066 0.300 . 1 . . . . 60 THR CG2 . 11122 1 580 . 1 1 60 60 THR N N 15 115.374 0.300 . 1 . . . . 60 THR N . 11122 1 581 . 1 1 61 61 PRO HA H 1 4.283 0.030 . 1 . . . . 61 PRO HA . 11122 1 582 . 1 1 61 61 PRO HB2 H 1 2.437 0.030 . 2 . . . . 61 PRO HB2 . 11122 1 583 . 1 1 61 61 PRO HB3 H 1 2.013 0.030 . 2 . . . . 61 PRO HB3 . 11122 1 584 . 1 1 61 61 PRO HD2 H 1 3.993 0.030 . 2 . . . . 61 PRO HD2 . 11122 1 585 . 1 1 61 61 PRO HD3 H 1 3.937 0.030 . 2 . . . . 61 PRO HD3 . 11122 1 586 . 1 1 61 61 PRO HG2 H 1 2.286 0.030 . 2 . . . . 61 PRO HG2 . 11122 1 587 . 1 1 61 61 PRO HG3 H 1 2.108 0.030 . 2 . . . . 61 PRO HG3 . 11122 1 588 . 1 1 61 61 PRO C C 13 178.488 0.300 . 1 . . . . 61 PRO C . 11122 1 589 . 1 1 61 61 PRO CA C 13 66.261 0.300 . 1 . . . . 61 PRO CA . 11122 1 590 . 1 1 61 61 PRO CB C 13 31.772 0.300 . 1 . . . . 61 PRO CB . 11122 1 591 . 1 1 61 61 PRO CD C 13 50.256 0.300 . 1 . . . . 61 PRO CD . 11122 1 592 . 1 1 61 61 PRO CG C 13 28.310 0.300 . 1 . . . . 61 PRO CG . 11122 1 593 . 1 1 62 62 GLN H H 1 8.266 0.030 . 1 . . . . 62 GLN H . 11122 1 594 . 1 1 62 62 GLN HA H 1 4.055 0.030 . 1 . . . . 62 GLN HA . 11122 1 595 . 1 1 62 62 GLN HB2 H 1 2.111 0.030 . 2 . . . . 62 GLN HB2 . 11122 1 596 . 1 1 62 62 GLN HB3 H 1 2.016 0.030 . 2 . . . . 62 GLN HB3 . 11122 1 597 . 1 1 62 62 GLN HE21 H 1 7.623 0.030 . 2 . . . . 62 GLN HE21 . 11122 1 598 . 1 1 62 62 GLN HE22 H 1 6.972 0.030 . 2 . . . . 62 GLN HE22 . 11122 1 599 . 1 1 62 62 GLN HG2 H 1 2.536 0.030 . 2 . . . . 62 GLN HG2 . 11122 1 600 . 1 1 62 62 GLN HG3 H 1 2.438 0.030 . 2 . . . . 62 GLN HG3 . 11122 1 601 . 1 1 62 62 GLN C C 13 178.658 0.300 . 1 . . . . 62 GLN C . 11122 1 602 . 1 1 62 62 GLN CA C 13 59.879 0.300 . 1 . . . . 62 GLN CA . 11122 1 603 . 1 1 62 62 GLN CB C 13 27.914 0.300 . 1 . . . . 62 GLN CB . 11122 1 604 . 1 1 62 62 GLN CG C 13 34.566 0.300 . 1 . . . . 62 GLN CG . 11122 1 605 . 1 1 62 62 GLN N N 15 115.450 0.300 . 1 . . . . 62 GLN N . 11122 1 606 . 1 1 62 62 GLN NE2 N 15 112.617 0.300 . 1 . . . . 62 GLN NE2 . 11122 1 607 . 1 1 63 63 ASP H H 1 7.777 0.030 . 1 . . . . 63 ASP H . 11122 1 608 . 1 1 63 63 ASP HA H 1 4.425 0.030 . 1 . . . . 63 ASP HA . 11122 1 609 . 1 1 63 63 ASP HB2 H 1 2.985 0.030 . 2 . . . . 63 ASP HB2 . 11122 1 610 . 1 1 63 63 ASP HB3 H 1 2.308 0.030 . 2 . . . . 63 ASP HB3 . 11122 1 611 . 1 1 63 63 ASP C C 13 179.338 0.300 . 1 . . . . 63 ASP C . 11122 1 612 . 1 1 63 63 ASP CA C 13 57.412 0.300 . 1 . . . . 63 ASP CA . 11122 1 613 . 1 1 63 63 ASP CB C 13 40.891 0.300 . 1 . . . . 63 ASP CB . 11122 1 614 . 1 1 63 63 ASP N N 15 120.523 0.300 . 1 . . . . 63 ASP N . 11122 1 615 . 1 1 64 64 GLN H H 1 8.808 0.030 . 1 . . . . 64 GLN H . 11122 1 616 . 1 1 64 64 GLN HA H 1 3.691 0.030 . 1 . . . . 64 GLN HA . 11122 1 617 . 1 1 64 64 GLN HB2 H 1 2.344 0.030 . 2 . . . . 64 GLN HB2 . 11122 1 618 . 1 1 64 64 GLN HB3 H 1 1.969 0.030 . 2 . . . . 64 GLN HB3 . 11122 1 619 . 1 1 64 64 GLN HE21 H 1 7.435 0.030 . 2 . . . . 64 GLN HE21 . 11122 1 620 . 1 1 64 64 GLN HE22 H 1 6.907 0.030 . 2 . . . . 64 GLN HE22 . 11122 1 621 . 1 1 64 64 GLN HG2 H 1 2.521 0.030 . 2 . . . . 64 GLN HG2 . 11122 1 622 . 1 1 64 64 GLN HG3 H 1 2.230 0.030 . 2 . . . . 64 GLN HG3 . 11122 1 623 . 1 1 64 64 GLN C C 13 177.226 0.300 . 1 . . . . 64 GLN C . 11122 1 624 . 1 1 64 64 GLN CA C 13 59.591 0.300 . 1 . . . . 64 GLN CA . 11122 1 625 . 1 1 64 64 GLN CB C 13 28.298 0.300 . 1 . . . . 64 GLN CB . 11122 1 626 . 1 1 64 64 GLN CG C 13 34.514 0.300 . 1 . . . . 64 GLN CG . 11122 1 627 . 1 1 64 64 GLN N N 15 118.416 0.300 . 1 . . . . 64 GLN N . 11122 1 628 . 1 1 64 64 GLN NE2 N 15 112.121 0.300 . 1 . . . . 64 GLN NE2 . 11122 1 629 . 1 1 65 65 ALA H H 1 8.164 0.030 . 1 . . . . 65 ALA H . 11122 1 630 . 1 1 65 65 ALA HA H 1 4.003 0.030 . 1 . . . . 65 ALA HA . 11122 1 631 . 1 1 65 65 ALA HB1 H 1 1.734 0.030 . 1 . . . . 65 ALA HB . 11122 1 632 . 1 1 65 65 ALA HB2 H 1 1.734 0.030 . 1 . . . . 65 ALA HB . 11122 1 633 . 1 1 65 65 ALA HB3 H 1 1.734 0.030 . 1 . . . . 65 ALA HB . 11122 1 634 . 1 1 65 65 ALA C C 13 179.047 0.300 . 1 . . . . 65 ALA C . 11122 1 635 . 1 1 65 65 ALA CA C 13 56.716 0.300 . 1 . . . . 65 ALA CA . 11122 1 636 . 1 1 65 65 ALA CB C 13 18.711 0.300 . 1 . . . . 65 ALA CB . 11122 1 637 . 1 1 65 65 ALA N N 15 120.663 0.300 . 1 . . . . 65 ALA N . 11122 1 638 . 1 1 66 66 VAL H H 1 7.205 0.030 . 1 . . . . 66 VAL H . 11122 1 639 . 1 1 66 66 VAL HA H 1 3.308 0.030 . 1 . . . . 66 VAL HA . 11122 1 640 . 1 1 66 66 VAL HB H 1 2.104 0.030 . 1 . . . . 66 VAL HB . 11122 1 641 . 1 1 66 66 VAL HG11 H 1 1.091 0.030 . 1 . . . . 66 VAL HG1 . 11122 1 642 . 1 1 66 66 VAL HG12 H 1 1.091 0.030 . 1 . . . . 66 VAL HG1 . 11122 1 643 . 1 1 66 66 VAL HG13 H 1 1.091 0.030 . 1 . . . . 66 VAL HG1 . 11122 1 644 . 1 1 66 66 VAL HG21 H 1 0.817 0.030 . 1 . . . . 66 VAL HG2 . 11122 1 645 . 1 1 66 66 VAL HG22 H 1 0.817 0.030 . 1 . . . . 66 VAL HG2 . 11122 1 646 . 1 1 66 66 VAL HG23 H 1 0.817 0.030 . 1 . . . . 66 VAL HG2 . 11122 1 647 . 1 1 66 66 VAL C C 13 177.687 0.300 . 1 . . . . 66 VAL C . 11122 1 648 . 1 1 66 66 VAL CA C 13 66.328 0.300 . 1 . . . . 66 VAL CA . 11122 1 649 . 1 1 66 66 VAL CB C 13 31.986 0.300 . 1 . . . . 66 VAL CB . 11122 1 650 . 1 1 66 66 VAL CG1 C 13 22.543 0.300 . 2 . . . . 66 VAL CG1 . 11122 1 651 . 1 1 66 66 VAL CG2 C 13 21.350 0.300 . 2 . . . . 66 VAL CG2 . 11122 1 652 . 1 1 66 66 VAL N N 15 116.159 0.300 . 1 . . . . 66 VAL N . 11122 1 653 . 1 1 67 67 LEU H H 1 7.933 0.030 . 1 . . . . 67 LEU H . 11122 1 654 . 1 1 67 67 LEU HA H 1 3.567 0.030 . 1 . . . . 67 LEU HA . 11122 1 655 . 1 1 67 67 LEU HB2 H 1 1.895 0.030 . 2 . . . . 67 LEU HB2 . 11122 1 656 . 1 1 67 67 LEU HB3 H 1 1.015 0.030 . 2 . . . . 67 LEU HB3 . 11122 1 657 . 1 1 67 67 LEU HD11 H 1 0.698 0.030 . 1 . . . . 67 LEU HD1 . 11122 1 658 . 1 1 67 67 LEU HD12 H 1 0.698 0.030 . 1 . . . . 67 LEU HD1 . 11122 1 659 . 1 1 67 67 LEU HD13 H 1 0.698 0.030 . 1 . . . . 67 LEU HD1 . 11122 1 660 . 1 1 67 67 LEU HD21 H 1 0.908 0.030 . 1 . . . . 67 LEU HD2 . 11122 1 661 . 1 1 67 67 LEU HD22 H 1 0.908 0.030 . 1 . . . . 67 LEU HD2 . 11122 1 662 . 1 1 67 67 LEU HD23 H 1 0.908 0.030 . 1 . . . . 67 LEU HD2 . 11122 1 663 . 1 1 67 67 LEU HG H 1 1.772 0.030 . 1 . . . . 67 LEU HG . 11122 1 664 . 1 1 67 67 LEU C C 13 179.775 0.300 . 1 . . . . 67 LEU C . 11122 1 665 . 1 1 67 67 LEU CA C 13 58.416 0.300 . 1 . . . . 67 LEU CA . 11122 1 666 . 1 1 67 67 LEU CB C 13 41.100 0.300 . 1 . . . . 67 LEU CB . 11122 1 667 . 1 1 67 67 LEU CD1 C 13 25.344 0.300 . 2 . . . . 67 LEU CD1 . 11122 1 668 . 1 1 67 67 LEU CD2 C 13 23.111 0.300 . 2 . . . . 67 LEU CD2 . 11122 1 669 . 1 1 67 67 LEU CG C 13 27.438 0.300 . 1 . . . . 67 LEU CG . 11122 1 670 . 1 1 67 67 LEU N N 15 119.293 0.300 . 1 . . . . 67 LEU N . 11122 1 671 . 1 1 68 68 HIS H H 1 8.914 0.030 . 1 . . . . 68 HIS H . 11122 1 672 . 1 1 68 68 HIS HA H 1 4.501 0.030 . 1 . . . . 68 HIS HA . 11122 1 673 . 1 1 68 68 HIS HB2 H 1 2.985 0.030 . 2 . . . . 68 HIS HB2 . 11122 1 674 . 1 1 68 68 HIS HB3 H 1 3.633 0.030 . 2 . . . . 68 HIS HB3 . 11122 1 675 . 1 1 68 68 HIS HD2 H 1 6.408 0.030 . 1 . . . . 68 HIS HD2 . 11122 1 676 . 1 1 68 68 HIS HE1 H 1 7.888 0.030 . 1 . . . . 68 HIS HE1 . 11122 1 677 . 1 1 68 68 HIS C C 13 178.124 0.300 . 1 . . . . 68 HIS C . 11122 1 678 . 1 1 68 68 HIS CA C 13 60.609 0.300 . 1 . . . . 68 HIS CA . 11122 1 679 . 1 1 68 68 HIS CB C 13 28.075 0.300 . 1 . . . . 68 HIS CB . 11122 1 680 . 1 1 68 68 HIS CD2 C 13 127.859 0.300 . 1 . . . . 68 HIS CD2 . 11122 1 681 . 1 1 68 68 HIS CE1 C 13 138.499 0.300 . 1 . . . . 68 HIS CE1 . 11122 1 682 . 1 1 68 68 HIS N N 15 118.314 0.300 . 1 . . . . 68 HIS N . 11122 1 683 . 1 1 69 69 ARG H H 1 8.468 0.030 . 1 . . . . 69 ARG H . 11122 1 684 . 1 1 69 69 ARG HA H 1 3.820 0.030 . 1 . . . . 69 ARG HA . 11122 1 685 . 1 1 69 69 ARG HB2 H 1 1.916 0.030 . 2 . . . . 69 ARG HB2 . 11122 1 686 . 1 1 69 69 ARG HB3 H 1 1.848 0.030 . 2 . . . . 69 ARG HB3 . 11122 1 687 . 1 1 69 69 ARG HD2 H 1 3.442 0.030 . 2 . . . . 69 ARG HD2 . 11122 1 688 . 1 1 69 69 ARG HD3 H 1 2.916 0.030 . 2 . . . . 69 ARG HD3 . 11122 1 689 . 1 1 69 69 ARG HG2 H 1 1.520 0.030 . 2 . . . . 69 ARG HG2 . 11122 1 690 . 1 1 69 69 ARG HG3 H 1 1.833 0.030 . 2 . . . . 69 ARG HG3 . 11122 1 691 . 1 1 69 69 ARG C C 13 178.780 0.300 . 1 . . . . 69 ARG C . 11122 1 692 . 1 1 69 69 ARG CA C 13 59.844 0.300 . 1 . . . . 69 ARG CA . 11122 1 693 . 1 1 69 69 ARG CB C 13 29.484 0.300 . 1 . . . . 69 ARG CB . 11122 1 694 . 1 1 69 69 ARG CD C 13 44.859 0.300 . 1 . . . . 69 ARG CD . 11122 1 695 . 1 1 69 69 ARG CG C 13 26.349 0.300 . 1 . . . . 69 ARG CG . 11122 1 696 . 1 1 69 69 ARG N N 15 119.428 0.300 . 1 . . . . 69 ARG N . 11122 1 697 . 1 1 70 70 ASN H H 1 8.549 0.030 . 1 . . . . 70 ASN H . 11122 1 698 . 1 1 70 70 ASN HA H 1 4.221 0.030 . 1 . . . . 70 ASN HA . 11122 1 699 . 1 1 70 70 ASN HB2 H 1 1.912 0.030 . 2 . . . . 70 ASN HB2 . 11122 1 700 . 1 1 70 70 ASN HB3 H 1 1.743 0.030 . 2 . . . . 70 ASN HB3 . 11122 1 701 . 1 1 70 70 ASN HD21 H 1 6.985 0.030 . 2 . . . . 70 ASN HD21 . 11122 1 702 . 1 1 70 70 ASN HD22 H 1 5.385 0.030 . 2 . . . . 70 ASN HD22 . 11122 1 703 . 1 1 70 70 ASN C C 13 178.634 0.300 . 1 . . . . 70 ASN C . 11122 1 704 . 1 1 70 70 ASN CA C 13 55.368 0.300 . 1 . . . . 70 ASN CA . 11122 1 705 . 1 1 70 70 ASN CB C 13 35.145 0.300 . 1 . . . . 70 ASN CB . 11122 1 706 . 1 1 70 70 ASN N N 15 123.498 0.300 . 1 . . . . 70 ASN N . 11122 1 707 . 1 1 70 70 ASN ND2 N 15 105.930 0.300 . 1 . . . . 70 ASN ND2 . 11122 1 708 . 1 1 71 71 ARG H H 1 8.678 0.030 . 1 . . . . 71 ARG H . 11122 1 709 . 1 1 71 71 ARG HA H 1 3.956 0.030 . 1 . . . . 71 ARG HA . 11122 1 710 . 1 1 71 71 ARG HB2 H 1 2.722 0.030 . 2 . . . . 71 ARG HB2 . 11122 1 711 . 1 1 71 71 ARG HB3 H 1 1.557 0.030 . 2 . . . . 71 ARG HB3 . 11122 1 712 . 1 1 71 71 ARG HD2 H 1 3.096 0.030 . 2 . . . . 71 ARG HD2 . 11122 1 713 . 1 1 71 71 ARG HD3 H 1 2.959 0.030 . 2 . . . . 71 ARG HD3 . 11122 1 714 . 1 1 71 71 ARG HE H 1 7.317 0.030 . 1 . . . . 71 ARG HE . 11122 1 715 . 1 1 71 71 ARG HG2 H 1 2.306 0.030 . 2 . . . . 71 ARG HG2 . 11122 1 716 . 1 1 71 71 ARG HG3 H 1 1.426 0.030 . 2 . . . . 71 ARG HG3 . 11122 1 717 . 1 1 71 71 ARG C C 13 178.124 0.300 . 1 . . . . 71 ARG C . 11122 1 718 . 1 1 71 71 ARG CA C 13 63.167 0.300 . 1 . . . . 71 ARG CA . 11122 1 719 . 1 1 71 71 ARG CB C 13 29.160 0.300 . 1 . . . . 71 ARG CB . 11122 1 720 . 1 1 71 71 ARG CD C 13 44.790 0.300 . 1 . . . . 71 ARG CD . 11122 1 721 . 1 1 71 71 ARG CG C 13 28.405 0.300 . 1 . . . . 71 ARG CG . 11122 1 722 . 1 1 71 71 ARG N N 15 121.235 0.300 . 1 . . . . 71 ARG N . 11122 1 723 . 1 1 71 71 ARG NE N 15 83.387 0.300 . 1 . . . . 71 ARG NE . 11122 1 724 . 1 1 72 72 ALA H H 1 8.605 0.030 . 1 . . . . 72 ALA H . 11122 1 725 . 1 1 72 72 ALA HA H 1 4.114 0.030 . 1 . . . . 72 ALA HA . 11122 1 726 . 1 1 72 72 ALA HB1 H 1 1.657 0.030 . 1 . . . . 72 ALA HB . 11122 1 727 . 1 1 72 72 ALA HB2 H 1 1.657 0.030 . 1 . . . . 72 ALA HB . 11122 1 728 . 1 1 72 72 ALA HB3 H 1 1.657 0.030 . 1 . . . . 72 ALA HB . 11122 1 729 . 1 1 72 72 ALA C C 13 178.683 0.300 . 1 . . . . 72 ALA C . 11122 1 730 . 1 1 72 72 ALA CA C 13 56.495 0.300 . 1 . . . . 72 ALA CA . 11122 1 731 . 1 1 72 72 ALA CB C 13 17.642 0.300 . 1 . . . . 72 ALA CB . 11122 1 732 . 1 1 72 72 ALA N N 15 120.110 0.300 . 1 . . . . 72 ALA N . 11122 1 733 . 1 1 73 73 ALA H H 1 7.553 0.030 . 1 . . . . 73 ALA H . 11122 1 734 . 1 1 73 73 ALA HA H 1 4.125 0.030 . 1 . . . . 73 ALA HA . 11122 1 735 . 1 1 73 73 ALA HB1 H 1 1.534 0.030 . 1 . . . . 73 ALA HB . 11122 1 736 . 1 1 73 73 ALA HB2 H 1 1.534 0.030 . 1 . . . . 73 ALA HB . 11122 1 737 . 1 1 73 73 ALA HB3 H 1 1.534 0.030 . 1 . . . . 73 ALA HB . 11122 1 738 . 1 1 73 73 ALA C C 13 180.601 0.300 . 1 . . . . 73 ALA C . 11122 1 739 . 1 1 73 73 ALA CA C 13 55.404 0.300 . 1 . . . . 73 ALA CA . 11122 1 740 . 1 1 73 73 ALA CB C 13 18.391 0.300 . 1 . . . . 73 ALA CB . 11122 1 741 . 1 1 73 73 ALA N N 15 117.512 0.300 . 1 . . . . 73 ALA N . 11122 1 742 . 1 1 74 74 CYS H H 1 7.650 0.030 . 1 . . . . 74 CYS H . 11122 1 743 . 1 1 74 74 CYS HA H 1 4.111 0.030 . 1 . . . . 74 CYS HA . 11122 1 744 . 1 1 74 74 CYS HB2 H 1 3.458 0.030 . 2 . . . . 74 CYS HB2 . 11122 1 745 . 1 1 74 74 CYS HB3 H 1 2.562 0.030 . 2 . . . . 74 CYS HB3 . 11122 1 746 . 1 1 74 74 CYS C C 13 176.206 0.300 . 1 . . . . 74 CYS C . 11122 1 747 . 1 1 74 74 CYS CA C 13 64.248 0.300 . 1 . . . . 74 CYS CA . 11122 1 748 . 1 1 74 74 CYS CB C 13 27.745 0.300 . 1 . . . . 74 CYS CB . 11122 1 749 . 1 1 74 74 CYS N N 15 116.316 0.300 . 1 . . . . 74 CYS N . 11122 1 750 . 1 1 75 75 HIS H H 1 8.424 0.030 . 1 . . . . 75 HIS H . 11122 1 751 . 1 1 75 75 HIS HA H 1 4.445 0.030 . 1 . . . . 75 HIS HA . 11122 1 752 . 1 1 75 75 HIS HB2 H 1 3.622 0.030 . 2 . . . . 75 HIS HB2 . 11122 1 753 . 1 1 75 75 HIS HB3 H 1 2.793 0.030 . 2 . . . . 75 HIS HB3 . 11122 1 754 . 1 1 75 75 HIS HD2 H 1 6.150 0.030 . 1 . . . . 75 HIS HD2 . 11122 1 755 . 1 1 75 75 HIS HE1 H 1 7.668 0.030 . 1 . . . . 75 HIS HE1 . 11122 1 756 . 1 1 75 75 HIS C C 13 178.318 0.300 . 1 . . . . 75 HIS C . 11122 1 757 . 1 1 75 75 HIS CA C 13 59.775 0.300 . 1 . . . . 75 HIS CA . 11122 1 758 . 1 1 75 75 HIS CB C 13 29.846 0.300 . 1 . . . . 75 HIS CB . 11122 1 759 . 1 1 75 75 HIS CE1 C 13 139.906 0.300 . 1 . . . . 75 HIS CE1 . 11122 1 760 . 1 1 76 76 LEU H H 1 8.369 0.030 . 1 . . . . 76 LEU H . 11122 1 761 . 1 1 76 76 LEU HA H 1 3.808 0.030 . 1 . . . . 76 LEU HA . 11122 1 762 . 1 1 76 76 LEU HB2 H 1 2.006 0.030 . 2 . . . . 76 LEU HB2 . 11122 1 763 . 1 1 76 76 LEU HB3 H 1 1.614 0.030 . 2 . . . . 76 LEU HB3 . 11122 1 764 . 1 1 76 76 LEU HD11 H 1 0.981 0.030 . 1 . . . . 76 LEU HD1 . 11122 1 765 . 1 1 76 76 LEU HD12 H 1 0.981 0.030 . 1 . . . . 76 LEU HD1 . 11122 1 766 . 1 1 76 76 LEU HD13 H 1 0.981 0.030 . 1 . . . . 76 LEU HD1 . 11122 1 767 . 1 1 76 76 LEU HD21 H 1 0.926 0.030 . 1 . . . . 76 LEU HD2 . 11122 1 768 . 1 1 76 76 LEU HD22 H 1 0.926 0.030 . 1 . . . . 76 LEU HD2 . 11122 1 769 . 1 1 76 76 LEU HD23 H 1 0.926 0.030 . 1 . . . . 76 LEU HD2 . 11122 1 770 . 1 1 76 76 LEU HG H 1 1.839 0.030 . 1 . . . . 76 LEU HG . 11122 1 771 . 1 1 76 76 LEU C C 13 180.746 0.300 . 1 . . . . 76 LEU C . 11122 1 772 . 1 1 76 76 LEU CA C 13 58.821 0.300 . 1 . . . . 76 LEU CA . 11122 1 773 . 1 1 76 76 LEU CB C 13 41.962 0.300 . 1 . . . . 76 LEU CB . 11122 1 774 . 1 1 76 76 LEU CD1 C 13 25.391 0.300 . 2 . . . . 76 LEU CD1 . 11122 1 775 . 1 1 76 76 LEU CD2 C 13 23.270 0.300 . 2 . . . . 76 LEU CD2 . 11122 1 776 . 1 1 76 76 LEU CG C 13 27.194 0.300 . 1 . . . . 76 LEU CG . 11122 1 777 . 1 1 76 76 LEU N N 15 118.875 0.300 . 1 . . . . 76 LEU N . 11122 1 778 . 1 1 77 77 LYS H H 1 7.262 0.030 . 1 . . . . 77 LYS H . 11122 1 779 . 1 1 77 77 LYS HA H 1 3.903 0.030 . 1 . . . . 77 LYS HA . 11122 1 780 . 1 1 77 77 LYS HB2 H 1 1.321 0.030 . 2 . . . . 77 LYS HB2 . 11122 1 781 . 1 1 77 77 LYS HB3 H 1 0.770 0.030 . 2 . . . . 77 LYS HB3 . 11122 1 782 . 1 1 77 77 LYS HD2 H 1 1.278 0.030 . 2 . . . . 77 LYS HD2 . 11122 1 783 . 1 1 77 77 LYS HD3 H 1 1.616 0.030 . 2 . . . . 77 LYS HD3 . 11122 1 784 . 1 1 77 77 LYS HE2 H 1 2.947 0.030 . 2 . . . . 77 LYS HE2 . 11122 1 785 . 1 1 77 77 LYS HE3 H 1 2.876 0.030 . 2 . . . . 77 LYS HE3 . 11122 1 786 . 1 1 77 77 LYS HG2 H 1 0.591 0.030 . 2 . . . . 77 LYS HG2 . 11122 1 787 . 1 1 77 77 LYS HG3 H 1 1.441 0.030 . 2 . . . . 77 LYS HG3 . 11122 1 788 . 1 1 77 77 LYS C C 13 178.658 0.300 . 1 . . . . 77 LYS C . 11122 1 789 . 1 1 77 77 LYS CA C 13 56.811 0.300 . 1 . . . . 77 LYS CA . 11122 1 790 . 1 1 77 77 LYS CB C 13 30.993 0.300 . 1 . . . . 77 LYS CB . 11122 1 791 . 1 1 77 77 LYS CD C 13 27.968 0.300 . 1 . . . . 77 LYS CD . 11122 1 792 . 1 1 77 77 LYS CE C 13 42.155 0.300 . 1 . . . . 77 LYS CE . 11122 1 793 . 1 1 77 77 LYS CG C 13 24.407 0.300 . 1 . . . . 77 LYS CG . 11122 1 794 . 1 1 77 77 LYS N N 15 118.987 0.300 . 1 . . . . 77 LYS N . 11122 1 795 . 1 1 78 78 LEU H H 1 7.581 0.030 . 1 . . . . 78 LEU H . 11122 1 796 . 1 1 78 78 LEU HA H 1 4.239 0.030 . 1 . . . . 78 LEU HA . 11122 1 797 . 1 1 78 78 LEU HB2 H 1 1.759 0.030 . 2 . . . . 78 LEU HB2 . 11122 1 798 . 1 1 78 78 LEU HD11 H 1 0.751 0.030 . 1 . . . . 78 LEU HD1 . 11122 1 799 . 1 1 78 78 LEU HD12 H 1 0.751 0.030 . 1 . . . . 78 LEU HD1 . 11122 1 800 . 1 1 78 78 LEU HD13 H 1 0.751 0.030 . 1 . . . . 78 LEU HD1 . 11122 1 801 . 1 1 78 78 LEU HD21 H 1 1.008 0.030 . 1 . . . . 78 LEU HD2 . 11122 1 802 . 1 1 78 78 LEU HD22 H 1 1.008 0.030 . 1 . . . . 78 LEU HD2 . 11122 1 803 . 1 1 78 78 LEU HD23 H 1 1.008 0.030 . 1 . . . . 78 LEU HD2 . 11122 1 804 . 1 1 78 78 LEU HG H 1 1.585 0.030 . 1 . . . . 78 LEU HG . 11122 1 805 . 1 1 78 78 LEU C C 13 175.259 0.300 . 1 . . . . 78 LEU C . 11122 1 806 . 1 1 78 78 LEU CA C 13 55.023 0.300 . 1 . . . . 78 LEU CA . 11122 1 807 . 1 1 78 78 LEU CB C 13 41.666 0.300 . 1 . . . . 78 LEU CB . 11122 1 808 . 1 1 78 78 LEU CD1 C 13 25.499 0.300 . 2 . . . . 78 LEU CD1 . 11122 1 809 . 1 1 78 78 LEU CD2 C 13 22.646 0.300 . 2 . . . . 78 LEU CD2 . 11122 1 810 . 1 1 78 78 LEU CG C 13 26.495 0.300 . 1 . . . . 78 LEU CG . 11122 1 811 . 1 1 78 78 LEU N N 15 118.375 0.300 . 1 . . . . 78 LEU N . 11122 1 812 . 1 1 79 79 GLU H H 1 7.481 0.030 . 1 . . . . 79 GLU H . 11122 1 813 . 1 1 79 79 GLU HA H 1 2.922 0.030 . 1 . . . . 79 GLU HA . 11122 1 814 . 1 1 79 79 GLU HB2 H 1 2.043 0.030 . 2 . . . . 79 GLU HB2 . 11122 1 815 . 1 1 79 79 GLU HB3 H 1 2.272 0.030 . 2 . . . . 79 GLU HB3 . 11122 1 816 . 1 1 79 79 GLU HG2 H 1 2.053 0.030 . 2 . . . . 79 GLU HG2 . 11122 1 817 . 1 1 79 79 GLU HG3 H 1 2.184 0.030 . 2 . . . . 79 GLU HG3 . 11122 1 818 . 1 1 79 79 GLU C C 13 173.802 0.300 . 1 . . . . 79 GLU C . 11122 1 819 . 1 1 79 79 GLU CA C 13 57.387 0.300 . 1 . . . . 79 GLU CA . 11122 1 820 . 1 1 79 79 GLU CB C 13 26.101 0.300 . 1 . . . . 79 GLU CB . 11122 1 821 . 1 1 79 79 GLU CG C 13 36.803 0.300 . 1 . . . . 79 GLU CG . 11122 1 822 . 1 1 79 79 GLU N N 15 113.560 0.300 . 1 . . . . 79 GLU N . 11122 1 823 . 1 1 80 80 ASP H H 1 8.139 0.030 . 1 . . . . 80 ASP H . 11122 1 824 . 1 1 80 80 ASP HA H 1 4.841 0.030 . 1 . . . . 80 ASP HA . 11122 1 825 . 1 1 80 80 ASP HB2 H 1 2.274 0.030 . 2 . . . . 80 ASP HB2 . 11122 1 826 . 1 1 80 80 ASP HB3 H 1 2.861 0.030 . 2 . . . . 80 ASP HB3 . 11122 1 827 . 1 1 80 80 ASP C C 13 176.424 0.300 . 1 . . . . 80 ASP C . 11122 1 828 . 1 1 80 80 ASP CA C 13 51.350 0.300 . 1 . . . . 80 ASP CA . 11122 1 829 . 1 1 80 80 ASP CB C 13 39.946 0.300 . 1 . . . . 80 ASP CB . 11122 1 830 . 1 1 80 80 ASP N N 15 119.558 0.300 . 1 . . . . 80 ASP N . 11122 1 831 . 1 1 81 81 TYR H H 1 7.216 0.030 . 1 . . . . 81 TYR H . 11122 1 832 . 1 1 81 81 TYR HA H 1 4.008 0.030 . 1 . . . . 81 TYR HA . 11122 1 833 . 1 1 81 81 TYR HB2 H 1 3.191 0.030 . 2 . . . . 81 TYR HB2 . 11122 1 834 . 1 1 81 81 TYR HB3 H 1 2.736 0.030 . 2 . . . . 81 TYR HB3 . 11122 1 835 . 1 1 81 81 TYR HD1 H 1 7.018 0.030 . 1 . . . . 81 TYR HD1 . 11122 1 836 . 1 1 81 81 TYR HD2 H 1 7.018 0.030 . 1 . . . . 81 TYR HD2 . 11122 1 837 . 1 1 81 81 TYR HE1 H 1 6.935 0.030 . 1 . . . . 81 TYR HE1 . 11122 1 838 . 1 1 81 81 TYR HE2 H 1 6.935 0.030 . 1 . . . . 81 TYR HE2 . 11122 1 839 . 1 1 81 81 TYR C C 13 177.056 0.300 . 1 . . . . 81 TYR C . 11122 1 840 . 1 1 81 81 TYR CA C 13 61.632 0.300 . 1 . . . . 81 TYR CA . 11122 1 841 . 1 1 81 81 TYR CB C 13 37.069 0.300 . 1 . . . . 81 TYR CB . 11122 1 842 . 1 1 81 81 TYR CD1 C 13 132.270 0.300 . 1 . . . . 81 TYR CD1 . 11122 1 843 . 1 1 81 81 TYR CD2 C 13 132.270 0.300 . 1 . . . . 81 TYR CD2 . 11122 1 844 . 1 1 81 81 TYR CE1 C 13 118.832 0.300 . 1 . . . . 81 TYR CE1 . 11122 1 845 . 1 1 81 81 TYR CE2 C 13 118.832 0.300 . 1 . . . . 81 TYR CE2 . 11122 1 846 . 1 1 81 81 TYR N N 15 121.112 0.300 . 1 . . . . 81 TYR N . 11122 1 847 . 1 1 82 82 ASP H H 1 8.554 0.030 . 1 . . . . 82 ASP H . 11122 1 848 . 1 1 82 82 ASP HA H 1 4.430 0.030 . 1 . . . . 82 ASP HA . 11122 1 849 . 1 1 82 82 ASP HB2 H 1 2.658 0.030 . 1 . . . . 82 ASP HB2 . 11122 1 850 . 1 1 82 82 ASP HB3 H 1 2.658 0.030 . 1 . . . . 82 ASP HB3 . 11122 1 851 . 1 1 82 82 ASP C C 13 178.658 0.300 . 1 . . . . 82 ASP C . 11122 1 852 . 1 1 82 82 ASP CA C 13 57.447 0.300 . 1 . . . . 82 ASP CA . 11122 1 853 . 1 1 82 82 ASP CB C 13 40.973 0.300 . 1 . . . . 82 ASP CB . 11122 1 854 . 1 1 82 82 ASP N N 15 118.573 0.300 . 1 . . . . 82 ASP N . 11122 1 855 . 1 1 83 83 LYS H H 1 7.297 0.030 . 1 . . . . 83 LYS H . 11122 1 856 . 1 1 83 83 LYS HA H 1 3.915 0.030 . 1 . . . . 83 LYS HA . 11122 1 857 . 1 1 83 83 LYS HB2 H 1 0.600 0.030 . 2 . . . . 83 LYS HB2 . 11122 1 858 . 1 1 83 83 LYS HB3 H 1 0.342 0.030 . 2 . . . . 83 LYS HB3 . 11122 1 859 . 1 1 83 83 LYS HD2 H 1 1.374 0.030 . 2 . . . . 83 LYS HD2 . 11122 1 860 . 1 1 83 83 LYS HD3 H 1 1.298 0.030 . 2 . . . . 83 LYS HD3 . 11122 1 861 . 1 1 83 83 LYS HE2 H 1 2.965 0.030 . 2 . . . . 83 LYS HE2 . 11122 1 862 . 1 1 83 83 LYS HE3 H 1 2.874 0.030 . 2 . . . . 83 LYS HE3 . 11122 1 863 . 1 1 83 83 LYS HG2 H 1 1.342 0.030 . 2 . . . . 83 LYS HG2 . 11122 1 864 . 1 1 83 83 LYS HG3 H 1 1.019 0.030 . 2 . . . . 83 LYS HG3 . 11122 1 865 . 1 1 83 83 LYS C C 13 178.731 0.300 . 1 . . . . 83 LYS C . 11122 1 866 . 1 1 83 83 LYS CA C 13 59.194 0.300 . 1 . . . . 83 LYS CA . 11122 1 867 . 1 1 83 83 LYS CB C 13 30.554 0.300 . 1 . . . . 83 LYS CB . 11122 1 868 . 1 1 83 83 LYS CD C 13 29.482 0.300 . 1 . . . . 83 LYS CD . 11122 1 869 . 1 1 83 83 LYS CE C 13 42.094 0.300 . 1 . . . . 83 LYS CE . 11122 1 870 . 1 1 83 83 LYS CG C 13 25.945 0.300 . 1 . . . . 83 LYS CG . 11122 1 871 . 1 1 83 83 LYS N N 15 118.702 0.300 . 1 . . . . 83 LYS N . 11122 1 872 . 1 1 84 84 ALA H H 1 7.950 0.030 . 1 . . . . 84 ALA H . 11122 1 873 . 1 1 84 84 ALA HA H 1 4.051 0.030 . 1 . . . . 84 ALA HA . 11122 1 874 . 1 1 84 84 ALA HB1 H 1 1.525 0.030 . 1 . . . . 84 ALA HB . 11122 1 875 . 1 1 84 84 ALA HB2 H 1 1.525 0.030 . 1 . . . . 84 ALA HB . 11122 1 876 . 1 1 84 84 ALA HB3 H 1 1.525 0.030 . 1 . . . . 84 ALA HB . 11122 1 877 . 1 1 84 84 ALA C C 13 178.634 0.300 . 1 . . . . 84 ALA C . 11122 1 878 . 1 1 84 84 ALA CA C 13 56.072 0.300 . 1 . . . . 84 ALA CA . 11122 1 879 . 1 1 84 84 ALA CB C 13 19.356 0.300 . 1 . . . . 84 ALA CB . 11122 1 880 . 1 1 84 84 ALA N N 15 119.895 0.300 . 1 . . . . 84 ALA N . 11122 1 881 . 1 1 85 85 GLU H H 1 8.106 0.030 . 1 . . . . 85 GLU H . 11122 1 882 . 1 1 85 85 GLU HA H 1 3.682 0.030 . 1 . . . . 85 GLU HA . 11122 1 883 . 1 1 85 85 GLU HB2 H 1 2.489 0.030 . 2 . . . . 85 GLU HB2 . 11122 1 884 . 1 1 85 85 GLU HB3 H 1 1.849 0.030 . 2 . . . . 85 GLU HB3 . 11122 1 885 . 1 1 85 85 GLU HG2 H 1 1.955 0.030 . 2 . . . . 85 GLU HG2 . 11122 1 886 . 1 1 85 85 GLU HG3 H 1 2.234 0.030 . 2 . . . . 85 GLU HG3 . 11122 1 887 . 1 1 85 85 GLU C C 13 178.440 0.300 . 1 . . . . 85 GLU C . 11122 1 888 . 1 1 85 85 GLU CA C 13 61.429 0.300 . 1 . . . . 85 GLU CA . 11122 1 889 . 1 1 85 85 GLU CB C 13 28.768 0.300 . 1 . . . . 85 GLU CB . 11122 1 890 . 1 1 85 85 GLU CG C 13 36.485 0.300 . 1 . . . . 85 GLU CG . 11122 1 891 . 1 1 85 85 GLU N N 15 118.258 0.300 . 1 . . . . 85 GLU N . 11122 1 892 . 1 1 86 86 THR H H 1 7.974 0.030 . 1 . . . . 86 THR H . 11122 1 893 . 1 1 86 86 THR HA H 1 3.801 0.030 . 1 . . . . 86 THR HA . 11122 1 894 . 1 1 86 86 THR HB H 1 4.170 0.030 . 1 . . . . 86 THR HB . 11122 1 895 . 1 1 86 86 THR HG21 H 1 1.219 0.030 . 1 . . . . 86 THR HG2 . 11122 1 896 . 1 1 86 86 THR HG22 H 1 1.219 0.030 . 1 . . . . 86 THR HG2 . 11122 1 897 . 1 1 86 86 THR HG23 H 1 1.219 0.030 . 1 . . . . 86 THR HG2 . 11122 1 898 . 1 1 86 86 THR C C 13 177.711 0.300 . 1 . . . . 86 THR C . 11122 1 899 . 1 1 86 86 THR CA C 13 66.575 0.300 . 1 . . . . 86 THR CA . 11122 1 900 . 1 1 86 86 THR CB C 13 68.738 0.300 . 1 . . . . 86 THR CB . 11122 1 901 . 1 1 86 86 THR CG2 C 13 21.719 0.300 . 1 . . . . 86 THR CG2 . 11122 1 902 . 1 1 86 86 THR N N 15 115.710 0.300 . 1 . . . . 86 THR N . 11122 1 903 . 1 1 87 87 GLU H H 1 8.461 0.030 . 1 . . . . 87 GLU H . 11122 1 904 . 1 1 87 87 GLU HA H 1 3.867 0.030 . 1 . . . . 87 GLU HA . 11122 1 905 . 1 1 87 87 GLU HB2 H 1 2.971 0.030 . 2 . . . . 87 GLU HB2 . 11122 1 906 . 1 1 87 87 GLU HB3 H 1 1.921 0.030 . 2 . . . . 87 GLU HB3 . 11122 1 907 . 1 1 87 87 GLU HG2 H 1 2.381 0.030 . 2 . . . . 87 GLU HG2 . 11122 1 908 . 1 1 87 87 GLU HG3 H 1 2.513 0.030 . 2 . . . . 87 GLU HG3 . 11122 1 909 . 1 1 87 87 GLU C C 13 178.294 0.300 . 1 . . . . 87 GLU C . 11122 1 910 . 1 1 87 87 GLU CA C 13 59.183 0.300 . 1 . . . . 87 GLU CA . 11122 1 911 . 1 1 87 87 GLU CB C 13 29.430 0.300 . 1 . . . . 87 GLU CB . 11122 1 912 . 1 1 87 87 GLU CG C 13 38.759 0.300 . 1 . . . . 87 GLU CG . 11122 1 913 . 1 1 87 87 GLU N N 15 120.547 0.300 . 1 . . . . 87 GLU N . 11122 1 914 . 1 1 88 88 ALA H H 1 8.520 0.030 . 1 . . . . 88 ALA H . 11122 1 915 . 1 1 88 88 ALA HA H 1 3.825 0.030 . 1 . . . . 88 ALA HA . 11122 1 916 . 1 1 88 88 ALA HB1 H 1 1.453 0.030 . 1 . . . . 88 ALA HB . 11122 1 917 . 1 1 88 88 ALA HB2 H 1 1.453 0.030 . 1 . . . . 88 ALA HB . 11122 1 918 . 1 1 88 88 ALA HB3 H 1 1.453 0.030 . 1 . . . . 88 ALA HB . 11122 1 919 . 1 1 88 88 ALA C C 13 179.897 0.300 . 1 . . . . 88 ALA C . 11122 1 920 . 1 1 88 88 ALA CA C 13 55.797 0.300 . 1 . . . . 88 ALA CA . 11122 1 921 . 1 1 88 88 ALA CB C 13 17.400 0.300 . 1 . . . . 88 ALA CB . 11122 1 922 . 1 1 88 88 ALA N N 15 121.680 0.300 . 1 . . . . 88 ALA N . 11122 1 923 . 1 1 89 89 SER H H 1 8.636 0.030 . 1 . . . . 89 SER H . 11122 1 924 . 1 1 89 89 SER HA H 1 4.128 0.030 . 1 . . . . 89 SER HA . 11122 1 925 . 1 1 89 89 SER HB2 H 1 3.776 0.030 . 2 . . . . 89 SER HB2 . 11122 1 926 . 1 1 89 89 SER HB3 H 1 4.153 0.030 . 2 . . . . 89 SER HB3 . 11122 1 927 . 1 1 89 89 SER C C 13 176.400 0.300 . 1 . . . . 89 SER C . 11122 1 928 . 1 1 89 89 SER CA C 13 63.273 0.300 . 1 . . . . 89 SER CA . 11122 1 929 . 1 1 89 89 SER CB C 13 62.608 0.300 . 1 . . . . 89 SER CB . 11122 1 930 . 1 1 89 89 SER N N 15 113.993 0.300 . 1 . . . . 89 SER N . 11122 1 931 . 1 1 90 90 LYS H H 1 7.707 0.030 . 1 . . . . 90 LYS H . 11122 1 932 . 1 1 90 90 LYS HA H 1 3.845 0.030 . 1 . . . . 90 LYS HA . 11122 1 933 . 1 1 90 90 LYS HB2 H 1 1.322 0.030 . 2 . . . . 90 LYS HB2 . 11122 1 934 . 1 1 90 90 LYS HB3 H 1 0.652 0.030 . 2 . . . . 90 LYS HB3 . 11122 1 935 . 1 1 90 90 LYS HD2 H 1 1.272 0.030 . 1 . . . . 90 LYS HD2 . 11122 1 936 . 1 1 90 90 LYS HD3 H 1 1.272 0.030 . 1 . . . . 90 LYS HD3 . 11122 1 937 . 1 1 90 90 LYS HE2 H 1 2.754 0.030 . 1 . . . . 90 LYS HE2 . 11122 1 938 . 1 1 90 90 LYS HE3 H 1 2.754 0.030 . 1 . . . . 90 LYS HE3 . 11122 1 939 . 1 1 90 90 LYS HG2 H 1 1.231 0.030 . 2 . . . . 90 LYS HG2 . 11122 1 940 . 1 1 90 90 LYS HG3 H 1 1.131 0.030 . 2 . . . . 90 LYS HG3 . 11122 1 941 . 1 1 90 90 LYS C C 13 178.950 0.300 . 1 . . . . 90 LYS C . 11122 1 942 . 1 1 90 90 LYS CA C 13 58.897 0.300 . 1 . . . . 90 LYS CA . 11122 1 943 . 1 1 90 90 LYS CB C 13 31.062 0.300 . 1 . . . . 90 LYS CB . 11122 1 944 . 1 1 90 90 LYS CD C 13 28.857 0.300 . 1 . . . . 90 LYS CD . 11122 1 945 . 1 1 90 90 LYS CE C 13 42.127 0.300 . 1 . . . . 90 LYS CE . 11122 1 946 . 1 1 90 90 LYS CG C 13 24.924 0.300 . 1 . . . . 90 LYS CG . 11122 1 947 . 1 1 90 90 LYS N N 15 123.038 0.300 . 1 . . . . 90 LYS N . 11122 1 948 . 1 1 91 91 ALA H H 1 7.446 0.030 . 1 . . . . 91 ALA H . 11122 1 949 . 1 1 91 91 ALA HA H 1 4.051 0.030 . 1 . . . . 91 ALA HA . 11122 1 950 . 1 1 91 91 ALA HB1 H 1 1.666 0.030 . 1 . . . . 91 ALA HB . 11122 1 951 . 1 1 91 91 ALA HB2 H 1 1.666 0.030 . 1 . . . . 91 ALA HB . 11122 1 952 . 1 1 91 91 ALA HB3 H 1 1.666 0.030 . 1 . . . . 91 ALA HB . 11122 1 953 . 1 1 91 91 ALA C C 13 178.950 0.300 . 1 . . . . 91 ALA C . 11122 1 954 . 1 1 91 91 ALA CA C 13 55.770 0.300 . 1 . . . . 91 ALA CA . 11122 1 955 . 1 1 91 91 ALA CB C 13 18.810 0.300 . 1 . . . . 91 ALA CB . 11122 1 956 . 1 1 91 91 ALA N N 15 120.929 0.300 . 1 . . . . 91 ALA N . 11122 1 957 . 1 1 92 92 ILE H H 1 7.949 0.030 . 1 . . . . 92 ILE H . 11122 1 958 . 1 1 92 92 ILE HA H 1 3.789 0.030 . 1 . . . . 92 ILE HA . 11122 1 959 . 1 1 92 92 ILE HB H 1 1.657 0.030 . 1 . . . . 92 ILE HB . 11122 1 960 . 1 1 92 92 ILE HD11 H 1 0.614 0.030 . 1 . . . . 92 ILE HD1 . 11122 1 961 . 1 1 92 92 ILE HD12 H 1 0.614 0.030 . 1 . . . . 92 ILE HD1 . 11122 1 962 . 1 1 92 92 ILE HD13 H 1 0.614 0.030 . 1 . . . . 92 ILE HD1 . 11122 1 963 . 1 1 92 92 ILE HG12 H 1 1.752 0.030 . 2 . . . . 92 ILE HG12 . 11122 1 964 . 1 1 92 92 ILE HG13 H 1 0.811 0.030 . 2 . . . . 92 ILE HG13 . 11122 1 965 . 1 1 92 92 ILE HG21 H 1 0.881 0.030 . 1 . . . . 92 ILE HG2 . 11122 1 966 . 1 1 92 92 ILE HG22 H 1 0.881 0.030 . 1 . . . . 92 ILE HG2 . 11122 1 967 . 1 1 92 92 ILE HG23 H 1 0.881 0.030 . 1 . . . . 92 ILE HG2 . 11122 1 968 . 1 1 92 92 ILE C C 13 177.638 0.300 . 1 . . . . 92 ILE C . 11122 1 969 . 1 1 92 92 ILE CA C 13 63.275 0.300 . 1 . . . . 92 ILE CA . 11122 1 970 . 1 1 92 92 ILE CB C 13 39.316 0.300 . 1 . . . . 92 ILE CB . 11122 1 971 . 1 1 92 92 ILE CD1 C 13 14.041 0.300 . 1 . . . . 92 ILE CD1 . 11122 1 972 . 1 1 92 92 ILE CG1 C 13 30.695 0.300 . 1 . . . . 92 ILE CG1 . 11122 1 973 . 1 1 92 92 ILE CG2 C 13 17.686 0.300 . 1 . . . . 92 ILE CG2 . 11122 1 974 . 1 1 92 92 ILE N N 15 119.852 0.300 . 1 . . . . 92 ILE N . 11122 1 975 . 1 1 93 93 GLU H H 1 7.850 0.030 . 1 . . . . 93 GLU H . 11122 1 976 . 1 1 93 93 GLU HA H 1 3.895 0.030 . 1 . . . . 93 GLU HA . 11122 1 977 . 1 1 93 93 GLU HB2 H 1 2.038 0.030 . 1 . . . . 93 GLU HB2 . 11122 1 978 . 1 1 93 93 GLU HB3 H 1 2.038 0.030 . 1 . . . . 93 GLU HB3 . 11122 1 979 . 1 1 93 93 GLU HG2 H 1 2.184 0.030 . 2 . . . . 93 GLU HG2 . 11122 1 980 . 1 1 93 93 GLU HG3 H 1 2.364 0.030 . 2 . . . . 93 GLU HG3 . 11122 1 981 . 1 1 93 93 GLU C C 13 178.415 0.300 . 1 . . . . 93 GLU C . 11122 1 982 . 1 1 93 93 GLU CA C 13 58.779 0.300 . 1 . . . . 93 GLU CA . 11122 1 983 . 1 1 93 93 GLU CB C 13 29.867 0.300 . 1 . . . . 93 GLU CB . 11122 1 984 . 1 1 93 93 GLU CG C 13 36.466 0.300 . 1 . . . . 93 GLU CG . 11122 1 985 . 1 1 93 93 GLU N N 15 118.794 0.300 . 1 . . . . 93 GLU N . 11122 1 986 . 1 1 94 94 LYS H H 1 7.130 0.030 . 1 . . . . 94 LYS H . 11122 1 987 . 1 1 94 94 LYS HA H 1 4.202 0.030 . 1 . . . . 94 LYS HA . 11122 1 988 . 1 1 94 94 LYS HB2 H 1 1.962 0.030 . 1 . . . . 94 LYS HB2 . 11122 1 989 . 1 1 94 94 LYS HB3 H 1 1.962 0.030 . 1 . . . . 94 LYS HB3 . 11122 1 990 . 1 1 94 94 LYS HD2 H 1 1.815 0.030 . 2 . . . . 94 LYS HD2 . 11122 1 991 . 1 1 94 94 LYS HD3 H 1 1.599 0.030 . 2 . . . . 94 LYS HD3 . 11122 1 992 . 1 1 94 94 LYS HE2 H 1 3.061 0.030 . 2 . . . . 94 LYS HE2 . 11122 1 993 . 1 1 94 94 LYS HE3 H 1 2.972 0.030 . 2 . . . . 94 LYS HE3 . 11122 1 994 . 1 1 94 94 LYS HG2 H 1 1.654 0.030 . 2 . . . . 94 LYS HG2 . 11122 1 995 . 1 1 94 94 LYS HG3 H 1 1.551 0.030 . 2 . . . . 94 LYS HG3 . 11122 1 996 . 1 1 94 94 LYS C C 13 176.740 0.300 . 1 . . . . 94 LYS C . 11122 1 997 . 1 1 94 94 LYS CA C 13 57.040 0.300 . 1 . . . . 94 LYS CA . 11122 1 998 . 1 1 94 94 LYS CB C 13 33.204 0.300 . 1 . . . . 94 LYS CB . 11122 1 999 . 1 1 94 94 LYS CD C 13 28.776 0.300 . 1 . . . . 94 LYS CD . 11122 1 1000 . 1 1 94 94 LYS CE C 13 42.586 0.300 . 1 . . . . 94 LYS CE . 11122 1 1001 . 1 1 94 94 LYS CG C 13 25.653 0.300 . 1 . . . . 94 LYS CG . 11122 1 1002 . 1 1 94 94 LYS N N 15 116.229 0.300 . 1 . . . . 94 LYS N . 11122 1 1003 . 1 1 95 95 ASP H H 1 8.030 0.030 . 1 . . . . 95 ASP H . 11122 1 1004 . 1 1 95 95 ASP HA H 1 4.575 0.030 . 1 . . . . 95 ASP HA . 11122 1 1005 . 1 1 95 95 ASP HB2 H 1 2.480 0.030 . 2 . . . . 95 ASP HB2 . 11122 1 1006 . 1 1 95 95 ASP HB3 H 1 2.921 0.030 . 2 . . . . 95 ASP HB3 . 11122 1 1007 . 1 1 95 95 ASP C C 13 175.162 0.300 . 1 . . . . 95 ASP C . 11122 1 1008 . 1 1 95 95 ASP CA C 13 53.852 0.300 . 1 . . . . 95 ASP CA . 11122 1 1009 . 1 1 95 95 ASP CB C 13 41.290 0.300 . 1 . . . . 95 ASP CB . 11122 1 1010 . 1 1 95 95 ASP N N 15 119.101 0.300 . 1 . . . . 95 ASP N . 11122 1 1011 . 1 1 96 96 GLY H H 1 8.594 0.030 . 1 . . . . 96 GLY H . 11122 1 1012 . 1 1 96 96 GLY HA2 H 1 3.718 0.030 . 2 . . . . 96 GLY HA2 . 11122 1 1013 . 1 1 96 96 GLY HA3 H 1 4.144 0.030 . 2 . . . . 96 GLY HA3 . 11122 1 1014 . 1 1 96 96 GLY C C 13 174.312 0.300 . 1 . . . . 96 GLY C . 11122 1 1015 . 1 1 96 96 GLY CA C 13 46.663 0.300 . 1 . . . . 96 GLY CA . 11122 1 1016 . 1 1 96 96 GLY N N 15 112.267 0.300 . 1 . . . . 96 GLY N . 11122 1 1017 . 1 1 97 97 GLY H H 1 8.282 0.030 . 1 . . . . 97 GLY H . 11122 1 1018 . 1 1 97 97 GLY HA2 H 1 3.542 0.030 . 2 . . . . 97 GLY HA2 . 11122 1 1019 . 1 1 97 97 GLY HA3 H 1 4.332 0.030 . 2 . . . . 97 GLY HA3 . 11122 1 1020 . 1 1 97 97 GLY C C 13 173.948 0.300 . 1 . . . . 97 GLY C . 11122 1 1021 . 1 1 97 97 GLY CA C 13 44.336 0.300 . 1 . . . . 97 GLY CA . 11122 1 1022 . 1 1 97 97 GLY N N 15 106.324 0.300 . 1 . . . . 97 GLY N . 11122 1 1023 . 1 1 98 98 ASP H H 1 7.127 0.030 . 1 . . . . 98 ASP H . 11122 1 1024 . 1 1 98 98 ASP HA H 1 4.516 0.030 . 1 . . . . 98 ASP HA . 11122 1 1025 . 1 1 98 98 ASP HB2 H 1 2.580 0.030 . 2 . . . . 98 ASP HB2 . 11122 1 1026 . 1 1 98 98 ASP HB3 H 1 2.930 0.030 . 2 . . . . 98 ASP HB3 . 11122 1 1027 . 1 1 98 98 ASP C C 13 175.890 0.300 . 1 . . . . 98 ASP C . 11122 1 1028 . 1 1 98 98 ASP CA C 13 53.605 0.300 . 1 . . . . 98 ASP CA . 11122 1 1029 . 1 1 98 98 ASP CB C 13 40.396 0.300 . 1 . . . . 98 ASP CB . 11122 1 1030 . 1 1 98 98 ASP N N 15 118.990 0.300 . 1 . . . . 98 ASP N . 11122 1 1031 . 1 1 99 99 VAL H H 1 8.044 0.030 . 1 . . . . 99 VAL H . 11122 1 1032 . 1 1 99 99 VAL HA H 1 3.843 0.030 . 1 . . . . 99 VAL HA . 11122 1 1033 . 1 1 99 99 VAL HB H 1 2.205 0.030 . 1 . . . . 99 VAL HB . 11122 1 1034 . 1 1 99 99 VAL HG11 H 1 1.130 0.030 . 1 . . . . 99 VAL HG1 . 11122 1 1035 . 1 1 99 99 VAL HG12 H 1 1.130 0.030 . 1 . . . . 99 VAL HG1 . 11122 1 1036 . 1 1 99 99 VAL HG13 H 1 1.130 0.030 . 1 . . . . 99 VAL HG1 . 11122 1 1037 . 1 1 99 99 VAL HG21 H 1 1.197 0.030 . 1 . . . . 99 VAL HG2 . 11122 1 1038 . 1 1 99 99 VAL HG22 H 1 1.197 0.030 . 1 . . . . 99 VAL HG2 . 11122 1 1039 . 1 1 99 99 VAL HG23 H 1 1.197 0.030 . 1 . . . . 99 VAL HG2 . 11122 1 1040 . 1 1 99 99 VAL C C 13 177.226 0.300 . 1 . . . . 99 VAL C . 11122 1 1041 . 1 1 99 99 VAL CA C 13 64.783 0.300 . 1 . . . . 99 VAL CA . 11122 1 1042 . 1 1 99 99 VAL CB C 13 31.910 0.300 . 1 . . . . 99 VAL CB . 11122 1 1043 . 1 1 99 99 VAL CG1 C 13 23.367 0.300 . 2 . . . . 99 VAL CG1 . 11122 1 1044 . 1 1 99 99 VAL CG2 C 13 21.713 0.300 . 2 . . . . 99 VAL CG2 . 11122 1 1045 . 1 1 99 99 VAL N N 15 124.437 0.300 . 1 . . . . 99 VAL N . 11122 1 1046 . 1 1 100 100 LYS H H 1 8.048 0.030 . 1 . . . . 100 LYS H . 11122 1 1047 . 1 1 100 100 LYS HA H 1 4.204 0.030 . 1 . . . . 100 LYS HA . 11122 1 1048 . 1 1 100 100 LYS HB2 H 1 1.670 0.030 . 2 . . . . 100 LYS HB2 . 11122 1 1049 . 1 1 100 100 LYS HB3 H 1 1.931 0.030 . 2 . . . . 100 LYS HB3 . 11122 1 1050 . 1 1 100 100 LYS HE2 H 1 3.013 0.030 . 1 . . . . 100 LYS HE2 . 11122 1 1051 . 1 1 100 100 LYS HE3 H 1 3.013 0.030 . 1 . . . . 100 LYS HE3 . 11122 1 1052 . 1 1 100 100 LYS HG2 H 1 1.512 0.030 . 2 . . . . 100 LYS HG2 . 11122 1 1053 . 1 1 100 100 LYS HG3 H 1 1.684 0.030 . 2 . . . . 100 LYS HG3 . 11122 1 1054 . 1 1 100 100 LYS C C 13 179.484 0.300 . 1 . . . . 100 LYS C . 11122 1 1055 . 1 1 100 100 LYS CA C 13 59.938 0.300 . 1 . . . . 100 LYS CA . 11122 1 1056 . 1 1 100 100 LYS CB C 13 32.385 0.300 . 1 . . . . 100 LYS CB . 11122 1 1057 . 1 1 100 100 LYS CD C 13 29.465 0.300 . 1 . . . . 100 LYS CD . 11122 1 1058 . 1 1 100 100 LYS CE C 13 42.068 0.300 . 1 . . . . 100 LYS CE . 11122 1 1059 . 1 1 100 100 LYS CG C 13 26.474 0.300 . 1 . . . . 100 LYS CG . 11122 1 1060 . 1 1 100 100 LYS N N 15 120.165 0.300 . 1 . . . . 100 LYS N . 11122 1 1061 . 1 1 101 101 ALA H H 1 8.096 0.030 . 1 . . . . 101 ALA H . 11122 1 1062 . 1 1 101 101 ALA HA H 1 3.787 0.030 . 1 . . . . 101 ALA HA . 11122 1 1063 . 1 1 101 101 ALA HB1 H 1 1.470 0.030 . 1 . . . . 101 ALA HB . 11122 1 1064 . 1 1 101 101 ALA HB2 H 1 1.470 0.030 . 1 . . . . 101 ALA HB . 11122 1 1065 . 1 1 101 101 ALA HB3 H 1 1.470 0.030 . 1 . . . . 101 ALA HB . 11122 1 1066 . 1 1 101 101 ALA C C 13 179.095 0.300 . 1 . . . . 101 ALA C . 11122 1 1067 . 1 1 101 101 ALA CA C 13 55.607 0.300 . 1 . . . . 101 ALA CA . 11122 1 1068 . 1 1 101 101 ALA CB C 13 19.443 0.300 . 1 . . . . 101 ALA CB . 11122 1 1069 . 1 1 101 101 ALA N N 15 122.650 0.300 . 1 . . . . 101 ALA N . 11122 1 1070 . 1 1 102 102 LEU H H 1 7.998 0.030 . 1 . . . . 102 LEU H . 11122 1 1071 . 1 1 102 102 LEU HA H 1 3.778 0.030 . 1 . . . . 102 LEU HA . 11122 1 1072 . 1 1 102 102 LEU HB2 H 1 1.774 0.030 . 2 . . . . 102 LEU HB2 . 11122 1 1073 . 1 1 102 102 LEU HB3 H 1 1.173 0.030 . 2 . . . . 102 LEU HB3 . 11122 1 1074 . 1 1 102 102 LEU HD11 H 1 0.699 0.030 . 1 . . . . 102 LEU HD1 . 11122 1 1075 . 1 1 102 102 LEU HD12 H 1 0.699 0.030 . 1 . . . . 102 LEU HD1 . 11122 1 1076 . 1 1 102 102 LEU HD13 H 1 0.699 0.030 . 1 . . . . 102 LEU HD1 . 11122 1 1077 . 1 1 102 102 LEU HD21 H 1 0.833 0.030 . 1 . . . . 102 LEU HD2 . 11122 1 1078 . 1 1 102 102 LEU HD22 H 1 0.833 0.030 . 1 . . . . 102 LEU HD2 . 11122 1 1079 . 1 1 102 102 LEU HD23 H 1 0.833 0.030 . 1 . . . . 102 LEU HD2 . 11122 1 1080 . 1 1 102 102 LEU HG H 1 1.436 0.030 . 1 . . . . 102 LEU HG . 11122 1 1081 . 1 1 102 102 LEU C C 13 178.173 0.300 . 1 . . . . 102 LEU C . 11122 1 1082 . 1 1 102 102 LEU CA C 13 58.334 0.300 . 1 . . . . 102 LEU CA . 11122 1 1083 . 1 1 102 102 LEU CB C 13 44.156 0.300 . 1 . . . . 102 LEU CB . 11122 1 1084 . 1 1 102 102 LEU CD1 C 13 25.335 0.300 . 2 . . . . 102 LEU CD1 . 11122 1 1085 . 1 1 102 102 LEU CD2 C 13 24.531 0.300 . 2 . . . . 102 LEU CD2 . 11122 1 1086 . 1 1 102 102 LEU CG C 13 27.559 0.300 . 1 . . . . 102 LEU CG . 11122 1 1087 . 1 1 102 102 LEU N N 15 119.476 0.300 . 1 . . . . 102 LEU N . 11122 1 1088 . 1 1 103 103 TYR H H 1 8.441 0.030 . 1 . . . . 103 TYR H . 11122 1 1089 . 1 1 103 103 TYR HA H 1 4.068 0.030 . 1 . . . . 103 TYR HA . 11122 1 1090 . 1 1 103 103 TYR HB2 H 1 3.217 0.030 . 2 . . . . 103 TYR HB2 . 11122 1 1091 . 1 1 103 103 TYR HB3 H 1 3.018 0.030 . 2 . . . . 103 TYR HB3 . 11122 1 1092 . 1 1 103 103 TYR HD1 H 1 7.077 0.030 . 1 . . . . 103 TYR HD1 . 11122 1 1093 . 1 1 103 103 TYR HD2 H 1 7.077 0.030 . 1 . . . . 103 TYR HD2 . 11122 1 1094 . 1 1 103 103 TYR HE1 H 1 6.705 0.030 . 1 . . . . 103 TYR HE1 . 11122 1 1095 . 1 1 103 103 TYR HE2 H 1 6.705 0.030 . 1 . . . . 103 TYR HE2 . 11122 1 1096 . 1 1 103 103 TYR C C 13 179.872 0.300 . 1 . . . . 103 TYR C . 11122 1 1097 . 1 1 103 103 TYR CA C 13 60.619 0.300 . 1 . . . . 103 TYR CA . 11122 1 1098 . 1 1 103 103 TYR CB C 13 38.409 0.300 . 1 . . . . 103 TYR CB . 11122 1 1099 . 1 1 103 103 TYR CD1 C 13 132.882 0.300 . 1 . . . . 103 TYR CD1 . 11122 1 1100 . 1 1 103 103 TYR CD2 C 13 132.882 0.300 . 1 . . . . 103 TYR CD2 . 11122 1 1101 . 1 1 103 103 TYR CE1 C 13 117.953 0.300 . 1 . . . . 103 TYR CE1 . 11122 1 1102 . 1 1 103 103 TYR CE2 C 13 117.953 0.300 . 1 . . . . 103 TYR CE2 . 11122 1 1103 . 1 1 103 103 TYR N N 15 119.662 0.300 . 1 . . . . 103 TYR N . 11122 1 1104 . 1 1 104 104 ARG H H 1 8.264 0.030 . 1 . . . . 104 ARG H . 11122 1 1105 . 1 1 104 104 ARG HA H 1 4.000 0.030 . 1 . . . . 104 ARG HA . 11122 1 1106 . 1 1 104 104 ARG HB2 H 1 1.618 0.030 . 2 . . . . 104 ARG HB2 . 11122 1 1107 . 1 1 104 104 ARG HD2 H 1 3.126 0.030 . 2 . . . . 104 ARG HD2 . 11122 1 1108 . 1 1 104 104 ARG HD3 H 1 2.809 0.030 . 2 . . . . 104 ARG HD3 . 11122 1 1109 . 1 1 104 104 ARG HG2 H 1 1.945 0.030 . 2 . . . . 104 ARG HG2 . 11122 1 1110 . 1 1 104 104 ARG C C 13 178.148 0.300 . 1 . . . . 104 ARG C . 11122 1 1111 . 1 1 104 104 ARG CA C 13 58.998 0.300 . 1 . . . . 104 ARG CA . 11122 1 1112 . 1 1 104 104 ARG CB C 13 29.461 0.300 . 1 . . . . 104 ARG CB . 11122 1 1113 . 1 1 104 104 ARG CD C 13 43.793 0.300 . 1 . . . . 104 ARG CD . 11122 1 1114 . 1 1 104 104 ARG CG C 13 27.973 0.300 . 1 . . . . 104 ARG CG . 11122 1 1115 . 1 1 104 104 ARG N N 15 119.395 0.300 . 1 . . . . 104 ARG N . 11122 1 1116 . 1 1 105 105 ARG H H 1 8.768 0.030 . 1 . . . . 105 ARG H . 11122 1 1117 . 1 1 105 105 ARG HA H 1 3.611 0.030 . 1 . . . . 105 ARG HA . 11122 1 1118 . 1 1 105 105 ARG HB2 H 1 2.533 0.030 . 2 . . . . 105 ARG HB2 . 11122 1 1119 . 1 1 105 105 ARG HB3 H 1 1.529 0.030 . 2 . . . . 105 ARG HB3 . 11122 1 1120 . 1 1 105 105 ARG HD2 H 1 3.408 0.030 . 2 . . . . 105 ARG HD2 . 11122 1 1121 . 1 1 105 105 ARG HD3 H 1 2.772 0.030 . 2 . . . . 105 ARG HD3 . 11122 1 1122 . 1 1 105 105 ARG HE H 1 10.302 0.030 . 1 . . . . 105 ARG HE . 11122 1 1123 . 1 1 105 105 ARG HG2 H 1 1.992 0.030 . 2 . . . . 105 ARG HG2 . 11122 1 1124 . 1 1 105 105 ARG HG3 H 1 1.507 0.030 . 2 . . . . 105 ARG HG3 . 11122 1 1125 . 1 1 105 105 ARG C C 13 178.828 0.300 . 1 . . . . 105 ARG C . 11122 1 1126 . 1 1 105 105 ARG CA C 13 62.085 0.300 . 1 . . . . 105 ARG CA . 11122 1 1127 . 1 1 105 105 ARG CB C 13 29.985 0.300 . 1 . . . . 105 ARG CB . 11122 1 1128 . 1 1 105 105 ARG CD C 13 45.307 0.300 . 1 . . . . 105 ARG CD . 11122 1 1129 . 1 1 105 105 ARG CG C 13 28.250 0.300 . 1 . . . . 105 ARG CG . 11122 1 1130 . 1 1 105 105 ARG N N 15 120.101 0.300 . 1 . . . . 105 ARG N . 11122 1 1131 . 1 1 105 105 ARG NE N 15 86.181 0.300 . 1 . . . . 105 ARG NE . 11122 1 1132 . 1 1 106 106 SER H H 1 8.566 0.030 . 1 . . . . 106 SER H . 11122 1 1133 . 1 1 106 106 SER HB2 H 1 3.950 0.030 . 2 . . . . 106 SER HB2 . 11122 1 1134 . 1 1 106 106 SER HB3 H 1 4.143 0.030 . 2 . . . . 106 SER HB3 . 11122 1 1135 . 1 1 106 106 SER CB C 13 62.975 0.300 . 1 . . . . 106 SER CB . 11122 1 1136 . 1 1 106 106 SER N N 15 116.418 0.300 . 1 . . . . 106 SER N . 11122 1 1137 . 1 1 107 107 GLN H H 1 7.400 0.030 . 1 . . . . 107 GLN H . 11122 1 1138 . 1 1 107 107 GLN HA H 1 3.988 0.030 . 1 . . . . 107 GLN HA . 11122 1 1139 . 1 1 107 107 GLN HB2 H 1 1.872 0.030 . 2 . . . . 107 GLN HB2 . 11122 1 1140 . 1 1 107 107 GLN HB3 H 1 2.256 0.030 . 2 . . . . 107 GLN HB3 . 11122 1 1141 . 1 1 107 107 GLN HE21 H 1 6.590 0.030 . 2 . . . . 107 GLN HE21 . 11122 1 1142 . 1 1 107 107 GLN HE22 H 1 6.561 0.030 . 2 . . . . 107 GLN HE22 . 11122 1 1143 . 1 1 107 107 GLN HG2 H 1 1.934 0.030 . 2 . . . . 107 GLN HG2 . 11122 1 1144 . 1 1 107 107 GLN HG3 H 1 1.885 0.030 . 2 . . . . 107 GLN HG3 . 11122 1 1145 . 1 1 107 107 GLN C C 13 178.998 0.300 . 1 . . . . 107 GLN C . 11122 1 1146 . 1 1 107 107 GLN CA C 13 58.821 0.300 . 1 . . . . 107 GLN CA . 11122 1 1147 . 1 1 107 107 GLN CB C 13 29.949 0.300 . 1 . . . . 107 GLN CB . 11122 1 1148 . 1 1 107 107 GLN CG C 13 34.651 0.300 . 1 . . . . 107 GLN CG . 11122 1 1149 . 1 1 107 107 GLN N N 15 121.593 0.300 . 1 . . . . 107 GLN N . 11122 1 1150 . 1 1 107 107 GLN NE2 N 15 110.898 0.300 . 1 . . . . 107 GLN NE2 . 11122 1 1151 . 1 1 108 108 ALA H H 1 7.676 0.030 . 1 . . . . 108 ALA H . 11122 1 1152 . 1 1 108 108 ALA HA H 1 3.877 0.030 . 1 . . . . 108 ALA HA . 11122 1 1153 . 1 1 108 108 ALA HB1 H 1 1.624 0.030 . 1 . . . . 108 ALA HB . 11122 1 1154 . 1 1 108 108 ALA HB2 H 1 1.624 0.030 . 1 . . . . 108 ALA HB . 11122 1 1155 . 1 1 108 108 ALA HB3 H 1 1.624 0.030 . 1 . . . . 108 ALA HB . 11122 1 1156 . 1 1 108 108 ALA C C 13 178.658 0.300 . 1 . . . . 108 ALA C . 11122 1 1157 . 1 1 108 108 ALA CA C 13 55.297 0.300 . 1 . . . . 108 ALA CA . 11122 1 1158 . 1 1 108 108 ALA CB C 13 18.406 0.300 . 1 . . . . 108 ALA CB . 11122 1 1159 . 1 1 108 108 ALA N N 15 122.183 0.300 . 1 . . . . 108 ALA N . 11122 1 1160 . 1 1 109 109 LEU H H 1 8.962 0.030 . 1 . . . . 109 LEU H . 11122 1 1161 . 1 1 109 109 LEU HA H 1 3.807 0.030 . 1 . . . . 109 LEU HA . 11122 1 1162 . 1 1 109 109 LEU HB2 H 1 1.732 0.030 . 2 . . . . 109 LEU HB2 . 11122 1 1163 . 1 1 109 109 LEU HB3 H 1 1.561 0.030 . 2 . . . . 109 LEU HB3 . 11122 1 1164 . 1 1 109 109 LEU HD11 H 1 0.708 0.030 . 1 . . . . 109 LEU HD1 . 11122 1 1165 . 1 1 109 109 LEU HD12 H 1 0.708 0.030 . 1 . . . . 109 LEU HD1 . 11122 1 1166 . 1 1 109 109 LEU HD13 H 1 0.708 0.030 . 1 . . . . 109 LEU HD1 . 11122 1 1167 . 1 1 109 109 LEU HD21 H 1 0.823 0.030 . 1 . . . . 109 LEU HD2 . 11122 1 1168 . 1 1 109 109 LEU HD22 H 1 0.823 0.030 . 1 . . . . 109 LEU HD2 . 11122 1 1169 . 1 1 109 109 LEU HD23 H 1 0.823 0.030 . 1 . . . . 109 LEU HD2 . 11122 1 1170 . 1 1 109 109 LEU HG H 1 1.722 0.030 . 1 . . . . 109 LEU HG . 11122 1 1171 . 1 1 109 109 LEU C C 13 179.290 0.300 . 1 . . . . 109 LEU C . 11122 1 1172 . 1 1 109 109 LEU CA C 13 57.940 0.300 . 1 . . . . 109 LEU CA . 11122 1 1173 . 1 1 109 109 LEU CB C 13 41.467 0.300 . 1 . . . . 109 LEU CB . 11122 1 1174 . 1 1 109 109 LEU CD1 C 13 26.970 0.300 . 2 . . . . 109 LEU CD1 . 11122 1 1175 . 1 1 109 109 LEU CD2 C 13 23.137 0.300 . 2 . . . . 109 LEU CD2 . 11122 1 1176 . 1 1 109 109 LEU CG C 13 26.757 0.300 . 1 . . . . 109 LEU CG . 11122 1 1177 . 1 1 109 109 LEU N N 15 116.438 0.300 . 1 . . . . 109 LEU N . 11122 1 1178 . 1 1 110 110 GLU H H 1 8.195 0.030 . 1 . . . . 110 GLU H . 11122 1 1179 . 1 1 110 110 GLU HA H 1 3.620 0.030 . 1 . . . . 110 GLU HA . 11122 1 1180 . 1 1 110 110 GLU HB2 H 1 2.050 0.030 . 2 . . . . 110 GLU HB2 . 11122 1 1181 . 1 1 110 110 GLU HB3 H 1 1.903 0.030 . 2 . . . . 110 GLU HB3 . 11122 1 1182 . 1 1 110 110 GLU HG2 H 1 2.255 0.030 . 2 . . . . 110 GLU HG2 . 11122 1 1183 . 1 1 110 110 GLU HG3 H 1 1.920 0.030 . 2 . . . . 110 GLU HG3 . 11122 1 1184 . 1 1 110 110 GLU C C 13 180.067 0.300 . 1 . . . . 110 GLU C . 11122 1 1185 . 1 1 110 110 GLU CA C 13 60.225 0.300 . 1 . . . . 110 GLU CA . 11122 1 1186 . 1 1 110 110 GLU CB C 13 29.464 0.300 . 1 . . . . 110 GLU CB . 11122 1 1187 . 1 1 110 110 GLU CG C 13 36.000 0.300 . 1 . . . . 110 GLU CG . 11122 1 1188 . 1 1 110 110 GLU N N 15 119.420 0.300 . 1 . . . . 110 GLU N . 11122 1 1189 . 1 1 111 111 LYS H H 1 7.065 0.030 . 1 . . . . 111 LYS H . 11122 1 1190 . 1 1 111 111 LYS HA H 1 3.804 0.030 . 1 . . . . 111 LYS HA . 11122 1 1191 . 1 1 111 111 LYS HB2 H 1 1.162 0.030 . 2 . . . . 111 LYS HB2 . 11122 1 1192 . 1 1 111 111 LYS HB3 H 1 0.636 0.030 . 2 . . . . 111 LYS HB3 . 11122 1 1193 . 1 1 111 111 LYS HD2 H 1 1.473 0.030 . 2 . . . . 111 LYS HD2 . 11122 1 1194 . 1 1 111 111 LYS HD3 H 1 1.227 0.030 . 2 . . . . 111 LYS HD3 . 11122 1 1195 . 1 1 111 111 LYS HE2 H 1 2.931 0.030 . 2 . . . . 111 LYS HE2 . 11122 1 1196 . 1 1 111 111 LYS HE3 H 1 2.814 0.030 . 2 . . . . 111 LYS HE3 . 11122 1 1197 . 1 1 111 111 LYS HG2 H 1 1.181 0.030 . 2 . . . . 111 LYS HG2 . 11122 1 1198 . 1 1 111 111 LYS HG3 H 1 0.630 0.030 . 2 . . . . 111 LYS HG3 . 11122 1 1199 . 1 1 111 111 LYS C C 13 178.780 0.300 . 1 . . . . 111 LYS C . 11122 1 1200 . 1 1 111 111 LYS CA C 13 57.059 0.300 . 1 . . . . 111 LYS CA . 11122 1 1201 . 1 1 111 111 LYS CB C 13 30.776 0.300 . 1 . . . . 111 LYS CB . 11122 1 1202 . 1 1 111 111 LYS CD C 13 27.850 0.300 . 1 . . . . 111 LYS CD . 11122 1 1203 . 1 1 111 111 LYS CE C 13 42.242 0.300 . 1 . . . . 111 LYS CE . 11122 1 1204 . 1 1 111 111 LYS CG C 13 24.699 0.300 . 1 . . . . 111 LYS CG . 11122 1 1205 . 1 1 111 111 LYS N N 15 119.349 0.300 . 1 . . . . 111 LYS N . 11122 1 1206 . 1 1 112 112 LEU H H 1 7.689 0.030 . 1 . . . . 112 LEU H . 11122 1 1207 . 1 1 112 112 LEU HA H 1 4.268 0.030 . 1 . . . . 112 LEU HA . 11122 1 1208 . 1 1 112 112 LEU HB2 H 1 1.739 0.030 . 2 . . . . 112 LEU HB2 . 11122 1 1209 . 1 1 112 112 LEU HB3 H 1 1.636 0.030 . 2 . . . . 112 LEU HB3 . 11122 1 1210 . 1 1 112 112 LEU HD11 H 1 0.738 0.030 . 1 . . . . 112 LEU HD1 . 11122 1 1211 . 1 1 112 112 LEU HD12 H 1 0.738 0.030 . 1 . . . . 112 LEU HD1 . 11122 1 1212 . 1 1 112 112 LEU HD13 H 1 0.738 0.030 . 1 . . . . 112 LEU HD1 . 11122 1 1213 . 1 1 112 112 LEU HD21 H 1 0.934 0.030 . 1 . . . . 112 LEU HD2 . 11122 1 1214 . 1 1 112 112 LEU HD22 H 1 0.934 0.030 . 1 . . . . 112 LEU HD2 . 11122 1 1215 . 1 1 112 112 LEU HD23 H 1 0.934 0.030 . 1 . . . . 112 LEU HD2 . 11122 1 1216 . 1 1 112 112 LEU HG H 1 1.688 0.030 . 1 . . . . 112 LEU HG . 11122 1 1217 . 1 1 112 112 LEU C C 13 177.056 0.300 . 1 . . . . 112 LEU C . 11122 1 1218 . 1 1 112 112 LEU CA C 13 55.123 0.300 . 1 . . . . 112 LEU CA . 11122 1 1219 . 1 1 112 112 LEU CB C 13 43.033 0.300 . 1 . . . . 112 LEU CB . 11122 1 1220 . 1 1 112 112 LEU CD1 C 13 25.235 0.300 . 2 . . . . 112 LEU CD1 . 11122 1 1221 . 1 1 112 112 LEU CD2 C 13 23.014 0.300 . 2 . . . . 112 LEU CD2 . 11122 1 1222 . 1 1 112 112 LEU CG C 13 26.200 0.300 . 1 . . . . 112 LEU CG . 11122 1 1223 . 1 1 112 112 LEU N N 15 118.545 0.300 . 1 . . . . 112 LEU N . 11122 1 1224 . 1 1 113 113 GLY H H 1 7.742 0.030 . 1 . . . . 113 GLY H . 11122 1 1225 . 1 1 113 113 GLY HA2 H 1 3.690 0.030 . 2 . . . . 113 GLY HA2 . 11122 1 1226 . 1 1 113 113 GLY HA3 H 1 4.205 0.030 . 2 . . . . 113 GLY HA3 . 11122 1 1227 . 1 1 113 113 GLY C C 13 174.846 0.300 . 1 . . . . 113 GLY C . 11122 1 1228 . 1 1 113 113 GLY CA C 13 45.570 0.300 . 1 . . . . 113 GLY CA . 11122 1 1229 . 1 1 113 113 GLY N N 15 107.623 0.300 . 1 . . . . 113 GLY N . 11122 1 1230 . 1 1 114 114 ARG H H 1 8.136 0.030 . 1 . . . . 114 ARG H . 11122 1 1231 . 1 1 114 114 ARG HA H 1 4.680 0.030 . 1 . . . . 114 ARG HA . 11122 1 1232 . 1 1 114 114 ARG HB2 H 1 1.929 0.030 . 2 . . . . 114 ARG HB2 . 11122 1 1233 . 1 1 114 114 ARG HB3 H 1 1.579 0.030 . 2 . . . . 114 ARG HB3 . 11122 1 1234 . 1 1 114 114 ARG HD2 H 1 3.097 0.030 . 1 . . . . 114 ARG HD2 . 11122 1 1235 . 1 1 114 114 ARG HD3 H 1 3.097 0.030 . 1 . . . . 114 ARG HD3 . 11122 1 1236 . 1 1 114 114 ARG HG2 H 1 1.575 0.030 . 2 . . . . 114 ARG HG2 . 11122 1 1237 . 1 1 114 114 ARG HG3 H 1 1.451 0.030 . 2 . . . . 114 ARG HG3 . 11122 1 1238 . 1 1 114 114 ARG C C 13 176.352 0.300 . 1 . . . . 114 ARG C . 11122 1 1239 . 1 1 114 114 ARG CA C 13 54.028 0.300 . 1 . . . . 114 ARG CA . 11122 1 1240 . 1 1 114 114 ARG CB C 13 28.770 0.300 . 1 . . . . 114 ARG CB . 11122 1 1241 . 1 1 114 114 ARG CD C 13 44.237 0.300 . 1 . . . . 114 ARG CD . 11122 1 1242 . 1 1 114 114 ARG CG C 13 26.561 0.300 . 1 . . . . 114 ARG CG . 11122 1 1243 . 1 1 114 114 ARG N N 15 124.140 0.300 . 1 . . . . 114 ARG N . 11122 1 1244 . 1 1 115 115 LEU H H 1 7.558 0.030 . 1 . . . . 115 LEU H . 11122 1 1245 . 1 1 115 115 LEU HA H 1 3.737 0.030 . 1 . . . . 115 LEU HA . 11122 1 1246 . 1 1 115 115 LEU HB2 H 1 1.777 0.030 . 2 . . . . 115 LEU HB2 . 11122 1 1247 . 1 1 115 115 LEU HB3 H 1 1.584 0.030 . 2 . . . . 115 LEU HB3 . 11122 1 1248 . 1 1 115 115 LEU HD11 H 1 0.979 0.030 . 1 . . . . 115 LEU HD1 . 11122 1 1249 . 1 1 115 115 LEU HD12 H 1 0.979 0.030 . 1 . . . . 115 LEU HD1 . 11122 1 1250 . 1 1 115 115 LEU HD13 H 1 0.979 0.030 . 1 . . . . 115 LEU HD1 . 11122 1 1251 . 1 1 115 115 LEU HD21 H 1 0.907 0.030 . 1 . . . . 115 LEU HD2 . 11122 1 1252 . 1 1 115 115 LEU HD22 H 1 0.907 0.030 . 1 . . . . 115 LEU HD2 . 11122 1 1253 . 1 1 115 115 LEU HD23 H 1 0.907 0.030 . 1 . . . . 115 LEU HD2 . 11122 1 1254 . 1 1 115 115 LEU HG H 1 1.652 0.030 . 1 . . . . 115 LEU HG . 11122 1 1255 . 1 1 115 115 LEU C C 13 178.270 0.300 . 1 . . . . 115 LEU C . 11122 1 1256 . 1 1 115 115 LEU CA C 13 58.325 0.300 . 1 . . . . 115 LEU CA . 11122 1 1257 . 1 1 115 115 LEU CB C 13 41.320 0.300 . 1 . . . . 115 LEU CB . 11122 1 1258 . 1 1 115 115 LEU CD1 C 13 24.941 0.300 . 2 . . . . 115 LEU CD1 . 11122 1 1259 . 1 1 115 115 LEU CD2 C 13 23.756 0.300 . 2 . . . . 115 LEU CD2 . 11122 1 1260 . 1 1 115 115 LEU CG C 13 27.993 0.300 . 1 . . . . 115 LEU CG . 11122 1 1261 . 1 1 115 115 LEU N N 15 120.893 0.300 . 1 . . . . 115 LEU N . 11122 1 1262 . 1 1 116 116 ASP H H 1 8.557 0.030 . 1 . . . . 116 ASP H . 11122 1 1263 . 1 1 116 116 ASP HA H 1 4.200 0.030 . 1 . . . . 116 ASP HA . 11122 1 1264 . 1 1 116 116 ASP HB2 H 1 2.703 0.030 . 2 . . . . 116 ASP HB2 . 11122 1 1265 . 1 1 116 116 ASP HB3 H 1 2.595 0.030 . 2 . . . . 116 ASP HB3 . 11122 1 1266 . 1 1 116 116 ASP C C 13 179.120 0.300 . 1 . . . . 116 ASP C . 11122 1 1267 . 1 1 116 116 ASP CA C 13 57.024 0.300 . 1 . . . . 116 ASP CA . 11122 1 1268 . 1 1 116 116 ASP CB C 13 38.941 0.300 . 1 . . . . 116 ASP CB . 11122 1 1269 . 1 1 116 116 ASP N N 15 117.243 0.300 . 1 . . . . 116 ASP N . 11122 1 1270 . 1 1 117 117 GLN H H 1 7.816 0.030 . 1 . . . . 117 GLN H . 11122 1 1271 . 1 1 117 117 GLN HA H 1 3.937 0.030 . 1 . . . . 117 GLN HA . 11122 1 1272 . 1 1 117 117 GLN HB2 H 1 2.004 0.030 . 2 . . . . 117 GLN HB2 . 11122 1 1273 . 1 1 117 117 GLN HB3 H 1 2.068 0.030 . 2 . . . . 117 GLN HB3 . 11122 1 1274 . 1 1 117 117 GLN HE21 H 1 7.590 0.030 . 2 . . . . 117 GLN HE21 . 11122 1 1275 . 1 1 117 117 GLN HE22 H 1 6.918 0.030 . 2 . . . . 117 GLN HE22 . 11122 1 1276 . 1 1 117 117 GLN HG2 H 1 2.330 0.030 . 1 . . . . 117 GLN HG2 . 11122 1 1277 . 1 1 117 117 GLN HG3 H 1 2.330 0.030 . 1 . . . . 117 GLN HG3 . 11122 1 1278 . 1 1 117 117 GLN C C 13 177.833 0.300 . 1 . . . . 117 GLN C . 11122 1 1279 . 1 1 117 117 GLN CA C 13 58.154 0.300 . 1 . . . . 117 GLN CA . 11122 1 1280 . 1 1 117 117 GLN CB C 13 28.708 0.300 . 1 . . . . 117 GLN CB . 11122 1 1281 . 1 1 117 117 GLN CG C 13 34.492 0.300 . 1 . . . . 117 GLN CG . 11122 1 1282 . 1 1 117 117 GLN N N 15 119.514 0.300 . 1 . . . . 117 GLN N . 11122 1 1283 . 1 1 117 117 GLN NE2 N 15 113.509 0.300 . 1 . . . . 117 GLN NE2 . 11122 1 1284 . 1 1 118 118 ALA H H 1 8.036 0.030 . 1 . . . . 118 ALA H . 11122 1 1285 . 1 1 118 118 ALA HA H 1 3.835 0.030 . 1 . . . . 118 ALA HA . 11122 1 1286 . 1 1 118 118 ALA HB1 H 1 1.474 0.030 . 1 . . . . 118 ALA HB . 11122 1 1287 . 1 1 118 118 ALA HB2 H 1 1.474 0.030 . 1 . . . . 118 ALA HB . 11122 1 1288 . 1 1 118 118 ALA HB3 H 1 1.474 0.030 . 1 . . . . 118 ALA HB . 11122 1 1289 . 1 1 118 118 ALA C C 13 179.557 0.300 . 1 . . . . 118 ALA C . 11122 1 1290 . 1 1 118 118 ALA CA C 13 55.850 0.300 . 1 . . . . 118 ALA CA . 11122 1 1291 . 1 1 118 118 ALA CB C 13 18.326 0.300 . 1 . . . . 118 ALA CB . 11122 1 1292 . 1 1 118 118 ALA N N 15 123.842 0.300 . 1 . . . . 118 ALA N . 11122 1 1293 . 1 1 119 119 VAL H H 1 8.236 0.030 . 1 . . . . 119 VAL H . 11122 1 1294 . 1 1 119 119 VAL HA H 1 3.447 0.030 . 1 . . . . 119 VAL HA . 11122 1 1295 . 1 1 119 119 VAL HB H 1 2.140 0.030 . 1 . . . . 119 VAL HB . 11122 1 1296 . 1 1 119 119 VAL HG11 H 1 0.854 0.030 . 1 . . . . 119 VAL HG1 . 11122 1 1297 . 1 1 119 119 VAL HG12 H 1 0.854 0.030 . 1 . . . . 119 VAL HG1 . 11122 1 1298 . 1 1 119 119 VAL HG13 H 1 0.854 0.030 . 1 . . . . 119 VAL HG1 . 11122 1 1299 . 1 1 119 119 VAL HG21 H 1 1.044 0.030 . 1 . . . . 119 VAL HG2 . 11122 1 1300 . 1 1 119 119 VAL HG22 H 1 1.044 0.030 . 1 . . . . 119 VAL HG2 . 11122 1 1301 . 1 1 119 119 VAL HG23 H 1 1.044 0.030 . 1 . . . . 119 VAL HG2 . 11122 1 1302 . 1 1 119 119 VAL C C 13 177.371 0.300 . 1 . . . . 119 VAL C . 11122 1 1303 . 1 1 119 119 VAL CA C 13 67.058 0.300 . 1 . . . . 119 VAL CA . 11122 1 1304 . 1 1 119 119 VAL CB C 13 31.845 0.300 . 1 . . . . 119 VAL CB . 11122 1 1305 . 1 1 119 119 VAL CG1 C 13 21.143 0.300 . 2 . . . . 119 VAL CG1 . 11122 1 1306 . 1 1 119 119 VAL CG2 C 13 23.909 0.300 . 2 . . . . 119 VAL CG2 . 11122 1 1307 . 1 1 119 119 VAL N N 15 116.905 0.300 . 1 . . . . 119 VAL N . 11122 1 1308 . 1 1 120 120 LEU H H 1 7.165 0.030 . 1 . . . . 120 LEU H . 11122 1 1309 . 1 1 120 120 LEU HA H 1 4.060 0.030 . 1 . . . . 120 LEU HA . 11122 1 1310 . 1 1 120 120 LEU HB2 H 1 1.913 0.030 . 2 . . . . 120 LEU HB2 . 11122 1 1311 . 1 1 120 120 LEU HB3 H 1 1.485 0.030 . 2 . . . . 120 LEU HB3 . 11122 1 1312 . 1 1 120 120 LEU HD11 H 1 0.876 0.030 . 1 . . . . 120 LEU HD1 . 11122 1 1313 . 1 1 120 120 LEU HD12 H 1 0.876 0.030 . 1 . . . . 120 LEU HD1 . 11122 1 1314 . 1 1 120 120 LEU HD13 H 1 0.876 0.030 . 1 . . . . 120 LEU HD1 . 11122 1 1315 . 1 1 120 120 LEU HD21 H 1 0.868 0.030 . 1 . . . . 120 LEU HD2 . 11122 1 1316 . 1 1 120 120 LEU HD22 H 1 0.868 0.030 . 1 . . . . 120 LEU HD2 . 11122 1 1317 . 1 1 120 120 LEU HD23 H 1 0.868 0.030 . 1 . . . . 120 LEU HD2 . 11122 1 1318 . 1 1 120 120 LEU HG H 1 1.799 0.030 . 1 . . . . 120 LEU HG . 11122 1 1319 . 1 1 120 120 LEU C C 13 180.577 0.300 . 1 . . . . 120 LEU C . 11122 1 1320 . 1 1 120 120 LEU CA C 13 58.222 0.300 . 1 . . . . 120 LEU CA . 11122 1 1321 . 1 1 120 120 LEU CB C 13 41.446 0.300 . 1 . . . . 120 LEU CB . 11122 1 1322 . 1 1 120 120 LEU CD1 C 13 25.410 0.300 . 2 . . . . 120 LEU CD1 . 11122 1 1323 . 1 1 120 120 LEU CD2 C 13 22.872 0.300 . 2 . . . . 120 LEU CD2 . 11122 1 1324 . 1 1 120 120 LEU CG C 13 26.653 0.300 . 1 . . . . 120 LEU CG . 11122 1 1325 . 1 1 120 120 LEU N N 15 119.191 0.300 . 1 . . . . 120 LEU N . 11122 1 1326 . 1 1 121 121 ASP H H 1 7.639 0.030 . 1 . . . . 121 ASP H . 11122 1 1327 . 1 1 121 121 ASP HA H 1 4.390 0.030 . 1 . . . . 121 ASP HA . 11122 1 1328 . 1 1 121 121 ASP HB2 H 1 2.563 0.030 . 1 . . . . 121 ASP HB2 . 11122 1 1329 . 1 1 121 121 ASP HB3 H 1 2.563 0.030 . 1 . . . . 121 ASP HB3 . 11122 1 1330 . 1 1 121 121 ASP C C 13 179.393 0.300 . 1 . . . . 121 ASP C . 11122 1 1331 . 1 1 121 121 ASP CA C 13 57.914 0.300 . 1 . . . . 121 ASP CA . 11122 1 1332 . 1 1 121 121 ASP CB C 13 40.250 0.300 . 1 . . . . 121 ASP CB . 11122 1 1333 . 1 1 121 121 ASP N N 15 120.801 0.300 . 1 . . . . 121 ASP N . 11122 1 1334 . 1 1 122 122 LEU H H 1 8.090 0.030 . 1 . . . . 122 LEU H . 11122 1 1335 . 1 1 122 122 LEU HA H 1 3.987 0.030 . 1 . . . . 122 LEU HA . 11122 1 1336 . 1 1 122 122 LEU HB2 H 1 2.022 0.030 . 2 . . . . 122 LEU HB2 . 11122 1 1337 . 1 1 122 122 LEU HB3 H 1 1.328 0.030 . 2 . . . . 122 LEU HB3 . 11122 1 1338 . 1 1 122 122 LEU HD11 H 1 0.836 0.030 . 1 . . . . 122 LEU HD1 . 11122 1 1339 . 1 1 122 122 LEU HD12 H 1 0.836 0.030 . 1 . . . . 122 LEU HD1 . 11122 1 1340 . 1 1 122 122 LEU HD13 H 1 0.836 0.030 . 1 . . . . 122 LEU HD1 . 11122 1 1341 . 1 1 122 122 LEU HD21 H 1 1.128 0.030 . 1 . . . . 122 LEU HD2 . 11122 1 1342 . 1 1 122 122 LEU HD22 H 1 1.128 0.030 . 1 . . . . 122 LEU HD2 . 11122 1 1343 . 1 1 122 122 LEU HD23 H 1 1.128 0.030 . 1 . . . . 122 LEU HD2 . 11122 1 1344 . 1 1 122 122 LEU HG H 1 1.808 0.030 . 1 . . . . 122 LEU HG . 11122 1 1345 . 1 1 122 122 LEU C C 13 179.338 0.300 . 1 . . . . 122 LEU C . 11122 1 1346 . 1 1 122 122 LEU CA C 13 58.429 0.300 . 1 . . . . 122 LEU CA . 11122 1 1347 . 1 1 122 122 LEU CB C 13 43.630 0.300 . 1 . . . . 122 LEU CB . 11122 1 1348 . 1 1 122 122 LEU CD1 C 13 25.532 0.300 . 2 . . . . 122 LEU CD1 . 11122 1 1349 . 1 1 122 122 LEU CD2 C 13 23.421 0.300 . 2 . . . . 122 LEU CD2 . 11122 1 1350 . 1 1 122 122 LEU CG C 13 28.098 0.300 . 1 . . . . 122 LEU CG . 11122 1 1351 . 1 1 122 122 LEU N N 15 121.094 0.300 . 1 . . . . 122 LEU N . 11122 1 1352 . 1 1 123 123 GLN H H 1 9.058 0.030 . 1 . . . . 123 GLN H . 11122 1 1353 . 1 1 123 123 GLN HA H 1 3.931 0.030 . 1 . . . . 123 GLN HA . 11122 1 1354 . 1 1 123 123 GLN HB2 H 1 2.320 0.030 . 2 . . . . 123 GLN HB2 . 11122 1 1355 . 1 1 123 123 GLN HB3 H 1 1.945 0.030 . 2 . . . . 123 GLN HB3 . 11122 1 1356 . 1 1 123 123 GLN HE21 H 1 7.182 0.030 . 2 . . . . 123 GLN HE21 . 11122 1 1357 . 1 1 123 123 GLN HE22 H 1 6.633 0.030 . 2 . . . . 123 GLN HE22 . 11122 1 1358 . 1 1 123 123 GLN HG2 H 1 2.661 0.030 . 2 . . . . 123 GLN HG2 . 11122 1 1359 . 1 1 123 123 GLN HG3 H 1 2.334 0.030 . 2 . . . . 123 GLN HG3 . 11122 1 1360 . 1 1 123 123 GLN C C 13 179.848 0.300 . 1 . . . . 123 GLN C . 11122 1 1361 . 1 1 123 123 GLN CA C 13 59.291 0.300 . 1 . . . . 123 GLN CA . 11122 1 1362 . 1 1 123 123 GLN CB C 13 27.853 0.300 . 1 . . . . 123 GLN CB . 11122 1 1363 . 1 1 123 123 GLN CG C 13 34.868 0.300 . 1 . . . . 123 GLN CG . 11122 1 1364 . 1 1 123 123 GLN N N 15 119.132 0.300 . 1 . . . . 123 GLN N . 11122 1 1365 . 1 1 123 123 GLN NE2 N 15 110.000 0.300 . 1 . . . . 123 GLN NE2 . 11122 1 1366 . 1 1 124 124 ARG H H 1 7.764 0.030 . 1 . . . . 124 ARG H . 11122 1 1367 . 1 1 124 124 ARG HA H 1 4.104 0.030 . 1 . . . . 124 ARG HA . 11122 1 1368 . 1 1 124 124 ARG HB2 H 1 2.083 0.030 . 1 . . . . 124 ARG HB2 . 11122 1 1369 . 1 1 124 124 ARG HB3 H 1 2.083 0.030 . 1 . . . . 124 ARG HB3 . 11122 1 1370 . 1 1 124 124 ARG HD2 H 1 3.260 0.030 . 2 . . . . 124 ARG HD2 . 11122 1 1371 . 1 1 124 124 ARG HD3 H 1 3.164 0.030 . 2 . . . . 124 ARG HD3 . 11122 1 1372 . 1 1 124 124 ARG HE H 1 7.256 0.030 . 1 . . . . 124 ARG HE . 11122 1 1373 . 1 1 124 124 ARG HG2 H 1 1.824 0.030 . 2 . . . . 124 ARG HG2 . 11122 1 1374 . 1 1 124 124 ARG HG3 H 1 1.640 0.030 . 2 . . . . 124 ARG HG3 . 11122 1 1375 . 1 1 124 124 ARG C C 13 178.853 0.300 . 1 . . . . 124 ARG C . 11122 1 1376 . 1 1 124 124 ARG CA C 13 59.291 0.300 . 1 . . . . 124 ARG CA . 11122 1 1377 . 1 1 124 124 ARG CB C 13 29.457 0.300 . 1 . . . . 124 ARG CB . 11122 1 1378 . 1 1 124 124 ARG CD C 13 43.566 0.300 . 1 . . . . 124 ARG CD . 11122 1 1379 . 1 1 124 124 ARG CG C 13 27.404 0.300 . 1 . . . . 124 ARG CG . 11122 1 1380 . 1 1 124 124 ARG N N 15 121.212 0.300 . 1 . . . . 124 ARG N . 11122 1 1381 . 1 1 124 124 ARG NE N 15 84.478 0.300 . 1 . . . . 124 ARG NE . 11122 1 1382 . 1 1 125 125 CYS H H 1 8.091 0.030 . 1 . . . . 125 CYS H . 11122 1 1383 . 1 1 125 125 CYS HA H 1 3.707 0.030 . 1 . . . . 125 CYS HA . 11122 1 1384 . 1 1 125 125 CYS HB2 H 1 2.891 0.030 . 2 . . . . 125 CYS HB2 . 11122 1 1385 . 1 1 125 125 CYS HB3 H 1 1.451 0.030 . 2 . . . . 125 CYS HB3 . 11122 1 1386 . 1 1 125 125 CYS C C 13 176.109 0.300 . 1 . . . . 125 CYS C . 11122 1 1387 . 1 1 125 125 CYS CA C 13 65.369 0.300 . 1 . . . . 125 CYS CA . 11122 1 1388 . 1 1 125 125 CYS CB C 13 24.867 0.300 . 1 . . . . 125 CYS CB . 11122 1 1389 . 1 1 125 125 CYS N N 15 118.779 0.300 . 1 . . . . 125 CYS N . 11122 1 1390 . 1 1 126 126 VAL H H 1 8.133 0.030 . 1 . . . . 126 VAL H . 11122 1 1391 . 1 1 126 126 VAL HA H 1 3.843 0.030 . 1 . . . . 126 VAL HA . 11122 1 1392 . 1 1 126 126 VAL HB H 1 2.076 0.030 . 1 . . . . 126 VAL HB . 11122 1 1393 . 1 1 126 126 VAL HG11 H 1 0.971 0.030 . 1 . . . . 126 VAL HG1 . 11122 1 1394 . 1 1 126 126 VAL HG12 H 1 0.971 0.030 . 1 . . . . 126 VAL HG1 . 11122 1 1395 . 1 1 126 126 VAL HG13 H 1 0.971 0.030 . 1 . . . . 126 VAL HG1 . 11122 1 1396 . 1 1 126 126 VAL HG21 H 1 1.036 0.030 . 1 . . . . 126 VAL HG2 . 11122 1 1397 . 1 1 126 126 VAL HG22 H 1 1.036 0.030 . 1 . . . . 126 VAL HG2 . 11122 1 1398 . 1 1 126 126 VAL HG23 H 1 1.036 0.030 . 1 . . . . 126 VAL HG2 . 11122 1 1399 . 1 1 126 126 VAL C C 13 177.420 0.300 . 1 . . . . 126 VAL C . 11122 1 1400 . 1 1 126 126 VAL CA C 13 65.169 0.300 . 1 . . . . 126 VAL CA . 11122 1 1401 . 1 1 126 126 VAL CB C 13 32.061 0.300 . 1 . . . . 126 VAL CB . 11122 1 1402 . 1 1 126 126 VAL CG1 C 13 21.172 0.300 . 2 . . . . 126 VAL CG1 . 11122 1 1403 . 1 1 126 126 VAL CG2 C 13 22.672 0.300 . 2 . . . . 126 VAL CG2 . 11122 1 1404 . 1 1 126 126 VAL N N 15 116.806 0.300 . 1 . . . . 126 VAL N . 11122 1 1405 . 1 1 127 127 SER H H 1 7.624 0.030 . 1 . . . . 127 SER H . 11122 1 1406 . 1 1 127 127 SER HA H 1 4.181 0.030 . 1 . . . . 127 SER HA . 11122 1 1407 . 1 1 127 127 SER HB2 H 1 3.977 0.030 . 1 . . . . 127 SER HB2 . 11122 1 1408 . 1 1 127 127 SER HB3 H 1 3.977 0.030 . 1 . . . . 127 SER HB3 . 11122 1 1409 . 1 1 127 127 SER C C 13 176.497 0.300 . 1 . . . . 127 SER C . 11122 1 1410 . 1 1 127 127 SER CA C 13 61.218 0.300 . 1 . . . . 127 SER CA . 11122 1 1411 . 1 1 127 127 SER CB C 13 63.254 0.300 . 1 . . . . 127 SER CB . 11122 1 1412 . 1 1 127 127 SER N N 15 113.316 0.300 . 1 . . . . 127 SER N . 11122 1 1413 . 1 1 128 128 LEU H H 1 7.765 0.030 . 1 . . . . 128 LEU H . 11122 1 1414 . 1 1 128 128 LEU HA H 1 4.268 0.030 . 1 . . . . 128 LEU HA . 11122 1 1415 . 1 1 128 128 LEU HB2 H 1 1.498 0.030 . 2 . . . . 128 LEU HB2 . 11122 1 1416 . 1 1 128 128 LEU HB3 H 1 1.849 0.030 . 2 . . . . 128 LEU HB3 . 11122 1 1417 . 1 1 128 128 LEU HD11 H 1 0.776 0.030 . 1 . . . . 128 LEU HD1 . 11122 1 1418 . 1 1 128 128 LEU HD12 H 1 0.776 0.030 . 1 . . . . 128 LEU HD1 . 11122 1 1419 . 1 1 128 128 LEU HD13 H 1 0.776 0.030 . 1 . . . . 128 LEU HD1 . 11122 1 1420 . 1 1 128 128 LEU HD21 H 1 0.931 0.030 . 1 . . . . 128 LEU HD2 . 11122 1 1421 . 1 1 128 128 LEU HD22 H 1 0.931 0.030 . 1 . . . . 128 LEU HD2 . 11122 1 1422 . 1 1 128 128 LEU HD23 H 1 0.931 0.030 . 1 . . . . 128 LEU HD2 . 11122 1 1423 . 1 1 128 128 LEU HG H 1 1.760 0.030 . 1 . . . . 128 LEU HG . 11122 1 1424 . 1 1 128 128 LEU C C 13 178.294 0.300 . 1 . . . . 128 LEU C . 11122 1 1425 . 1 1 128 128 LEU CA C 13 56.918 0.300 . 1 . . . . 128 LEU CA . 11122 1 1426 . 1 1 128 128 LEU CB C 13 43.029 0.300 . 1 . . . . 128 LEU CB . 11122 1 1427 . 1 1 128 128 LEU CD1 C 13 25.585 0.300 . 2 . . . . 128 LEU CD1 . 11122 1 1428 . 1 1 128 128 LEU CD2 C 13 22.657 0.300 . 2 . . . . 128 LEU CD2 . 11122 1 1429 . 1 1 128 128 LEU CG C 13 27.372 0.300 . 1 . . . . 128 LEU CG . 11122 1 1430 . 1 1 128 128 LEU N N 15 120.746 0.300 . 1 . . . . 128 LEU N . 11122 1 1431 . 1 1 129 129 GLU H H 1 8.239 0.030 . 1 . . . . 129 GLU H . 11122 1 1432 . 1 1 129 129 GLU HA H 1 4.911 0.030 . 1 . . . . 129 GLU HA . 11122 1 1433 . 1 1 129 129 GLU HB2 H 1 2.369 0.030 . 2 . . . . 129 GLU HB2 . 11122 1 1434 . 1 1 129 129 GLU HB3 H 1 2.128 0.030 . 2 . . . . 129 GLU HB3 . 11122 1 1435 . 1 1 129 129 GLU HG2 H 1 2.389 0.030 . 2 . . . . 129 GLU HG2 . 11122 1 1436 . 1 1 129 129 GLU HG3 H 1 2.329 0.030 . 2 . . . . 129 GLU HG3 . 11122 1 1437 . 1 1 129 129 GLU C C 13 173.826 0.300 . 1 . . . . 129 GLU C . 11122 1 1438 . 1 1 129 129 GLU CA C 13 54.479 0.300 . 1 . . . . 129 GLU CA . 11122 1 1439 . 1 1 129 129 GLU CB C 13 31.194 0.300 . 1 . . . . 129 GLU CB . 11122 1 1440 . 1 1 129 129 GLU CG C 13 37.113 0.300 . 1 . . . . 129 GLU CG . 11122 1 1441 . 1 1 129 129 GLU N N 15 119.586 0.300 . 1 . . . . 129 GLU N . 11122 1 1442 . 1 1 130 130 PRO HA H 1 4.822 0.030 . 1 . . . . 130 PRO HA . 11122 1 1443 . 1 1 130 130 PRO HB2 H 1 2.472 0.030 . 2 . . . . 130 PRO HB2 . 11122 1 1444 . 1 1 130 130 PRO HB3 H 1 1.916 0.030 . 2 . . . . 130 PRO HB3 . 11122 1 1445 . 1 1 130 130 PRO HD2 H 1 3.662 0.030 . 2 . . . . 130 PRO HD2 . 11122 1 1446 . 1 1 130 130 PRO HD3 H 1 3.411 0.030 . 2 . . . . 130 PRO HD3 . 11122 1 1447 . 1 1 130 130 PRO HG2 H 1 2.089 0.030 . 2 . . . . 130 PRO HG2 . 11122 1 1448 . 1 1 130 130 PRO HG3 H 1 1.903 0.030 . 2 . . . . 130 PRO HG3 . 11122 1 1449 . 1 1 130 130 PRO C C 13 178.367 0.300 . 1 . . . . 130 PRO C . 11122 1 1450 . 1 1 130 130 PRO CA C 13 65.024 0.300 . 1 . . . . 130 PRO CA . 11122 1 1451 . 1 1 130 130 PRO CB C 13 32.646 0.300 . 1 . . . . 130 PRO CB . 11122 1 1452 . 1 1 130 130 PRO CD C 13 50.377 0.300 . 1 . . . . 130 PRO CD . 11122 1 1453 . 1 1 130 130 PRO CG C 13 27.213 0.300 . 1 . . . . 130 PRO CG . 11122 1 1454 . 1 1 131 131 LYS H H 1 8.517 0.030 . 1 . . . . 131 LYS H . 11122 1 1455 . 1 1 131 131 LYS HA H 1 4.378 0.030 . 1 . . . . 131 LYS HA . 11122 1 1456 . 1 1 131 131 LYS HB2 H 1 1.733 0.030 . 2 . . . . 131 LYS HB2 . 11122 1 1457 . 1 1 131 131 LYS HB3 H 1 2.007 0.030 . 2 . . . . 131 LYS HB3 . 11122 1 1458 . 1 1 131 131 LYS HD2 H 1 1.661 0.030 . 1 . . . . 131 LYS HD2 . 11122 1 1459 . 1 1 131 131 LYS HD3 H 1 1.661 0.030 . 1 . . . . 131 LYS HD3 . 11122 1 1460 . 1 1 131 131 LYS HE2 H 1 2.874 0.030 . 2 . . . . 131 LYS HE2 . 11122 1 1461 . 1 1 131 131 LYS HG2 H 1 1.445 0.030 . 2 . . . . 131 LYS HG2 . 11122 1 1462 . 1 1 131 131 LYS HG3 H 1 1.360 0.030 . 2 . . . . 131 LYS HG3 . 11122 1 1463 . 1 1 131 131 LYS C C 13 176.473 0.300 . 1 . . . . 131 LYS C . 11122 1 1464 . 1 1 131 131 LYS CA C 13 55.360 0.300 . 1 . . . . 131 LYS CA . 11122 1 1465 . 1 1 131 131 LYS CB C 13 31.768 0.300 . 1 . . . . 131 LYS CB . 11122 1 1466 . 1 1 131 131 LYS CD C 13 28.937 0.300 . 1 . . . . 131 LYS CD . 11122 1 1467 . 1 1 131 131 LYS CE C 13 42.122 0.300 . 1 . . . . 131 LYS CE . 11122 1 1468 . 1 1 131 131 LYS CG C 13 25.326 0.300 . 1 . . . . 131 LYS CG . 11122 1 1469 . 1 1 131 131 LYS N N 15 115.196 0.300 . 1 . . . . 131 LYS N . 11122 1 1470 . 1 1 132 132 ASN H H 1 7.599 0.030 . 1 . . . . 132 ASN H . 11122 1 1471 . 1 1 132 132 ASN HA H 1 4.413 0.030 . 1 . . . . 132 ASN HA . 11122 1 1472 . 1 1 132 132 ASN HB2 H 1 3.026 0.030 . 2 . . . . 132 ASN HB2 . 11122 1 1473 . 1 1 132 132 ASN HB3 H 1 2.586 0.030 . 2 . . . . 132 ASN HB3 . 11122 1 1474 . 1 1 132 132 ASN HD21 H 1 7.209 0.030 . 2 . . . . 132 ASN HD21 . 11122 1 1475 . 1 1 132 132 ASN HD22 H 1 6.030 0.030 . 2 . . . . 132 ASN HD22 . 11122 1 1476 . 1 1 132 132 ASN C C 13 176.376 0.300 . 1 . . . . 132 ASN C . 11122 1 1477 . 1 1 132 132 ASN CA C 13 53.535 0.300 . 1 . . . . 132 ASN CA . 11122 1 1478 . 1 1 132 132 ASN CB C 13 38.612 0.300 . 1 . . . . 132 ASN CB . 11122 1 1479 . 1 1 132 132 ASN N N 15 118.453 0.300 . 1 . . . . 132 ASN N . 11122 1 1480 . 1 1 132 132 ASN ND2 N 15 113.737 0.300 . 1 . . . . 132 ASN ND2 . 11122 1 1481 . 1 1 133 133 LYS H H 1 8.829 0.030 . 1 . . . . 133 LYS H . 11122 1 1482 . 1 1 133 133 LYS HA H 1 3.850 0.030 . 1 . . . . 133 LYS HA . 11122 1 1483 . 1 1 133 133 LYS HB2 H 1 1.851 0.030 . 2 . . . . 133 LYS HB2 . 11122 1 1484 . 1 1 133 133 LYS HB3 H 1 1.803 0.030 . 2 . . . . 133 LYS HB3 . 11122 1 1485 . 1 1 133 133 LYS HD2 H 1 1.654 0.030 . 2 . . . . 133 LYS HD2 . 11122 1 1486 . 1 1 133 133 LYS HE2 H 1 2.961 0.030 . 2 . . . . 133 LYS HE2 . 11122 1 1487 . 1 1 133 133 LYS HG2 H 1 1.549 0.030 . 2 . . . . 133 LYS HG2 . 11122 1 1488 . 1 1 133 133 LYS HG3 H 1 1.440 0.030 . 2 . . . . 133 LYS HG3 . 11122 1 1489 . 1 1 133 133 LYS C C 13 178.100 0.300 . 1 . . . . 133 LYS C . 11122 1 1490 . 1 1 133 133 LYS CA C 13 58.935 0.300 . 1 . . . . 133 LYS CA . 11122 1 1491 . 1 1 133 133 LYS CB C 13 32.575 0.300 . 1 . . . . 133 LYS CB . 11122 1 1492 . 1 1 133 133 LYS CD C 13 29.051 0.300 . 1 . . . . 133 LYS CD . 11122 1 1493 . 1 1 133 133 LYS CE C 13 42.069 0.300 . 1 . . . . 133 LYS CE . 11122 1 1494 . 1 1 133 133 LYS CG C 13 25.097 0.300 . 1 . . . . 133 LYS CG . 11122 1 1495 . 1 1 133 133 LYS N N 15 129.035 0.300 . 1 . . . . 133 LYS N . 11122 1 1496 . 1 1 134 134 VAL H H 1 7.699 0.030 . 1 . . . . 134 VAL H . 11122 1 1497 . 1 1 134 134 VAL HA H 1 3.597 0.030 . 1 . . . . 134 VAL HA . 11122 1 1498 . 1 1 134 134 VAL HB H 1 1.636 0.030 . 1 . . . . 134 VAL HB . 11122 1 1499 . 1 1 134 134 VAL HG11 H 1 0.843 0.030 . 1 . . . . 134 VAL HG1 . 11122 1 1500 . 1 1 134 134 VAL HG12 H 1 0.843 0.030 . 1 . . . . 134 VAL HG1 . 11122 1 1501 . 1 1 134 134 VAL HG13 H 1 0.843 0.030 . 1 . . . . 134 VAL HG1 . 11122 1 1502 . 1 1 134 134 VAL HG21 H 1 0.627 0.030 . 1 . . . . 134 VAL HG2 . 11122 1 1503 . 1 1 134 134 VAL HG22 H 1 0.627 0.030 . 1 . . . . 134 VAL HG2 . 11122 1 1504 . 1 1 134 134 VAL HG23 H 1 0.627 0.030 . 1 . . . . 134 VAL HG2 . 11122 1 1505 . 1 1 134 134 VAL C C 13 179.654 0.300 . 1 . . . . 134 VAL C . 11122 1 1506 . 1 1 134 134 VAL CA C 13 66.054 0.300 . 1 . . . . 134 VAL CA . 11122 1 1507 . 1 1 134 134 VAL CB C 13 30.974 0.300 . 1 . . . . 134 VAL CB . 11122 1 1508 . 1 1 134 134 VAL CG1 C 13 22.410 0.300 . 2 . . . . 134 VAL CG1 . 11122 1 1509 . 1 1 134 134 VAL CG2 C 13 20.560 0.300 . 2 . . . . 134 VAL CG2 . 11122 1 1510 . 1 1 134 134 VAL N N 15 120.164 0.300 . 1 . . . . 134 VAL N . 11122 1 1511 . 1 1 135 135 PHE H H 1 6.854 0.030 . 1 . . . . 135 PHE H . 11122 1 1512 . 1 1 135 135 PHE HA H 1 4.454 0.030 . 1 . . . . 135 PHE HA . 11122 1 1513 . 1 1 135 135 PHE HB2 H 1 3.140 0.030 . 1 . . . . 135 PHE HB2 . 11122 1 1514 . 1 1 135 135 PHE HB3 H 1 3.140 0.030 . 1 . . . . 135 PHE HB3 . 11122 1 1515 . 1 1 135 135 PHE HD1 H 1 6.795 0.030 . 1 . . . . 135 PHE HD1 . 11122 1 1516 . 1 1 135 135 PHE HD2 H 1 6.795 0.030 . 1 . . . . 135 PHE HD2 . 11122 1 1517 . 1 1 135 135 PHE HE1 H 1 6.858 0.030 . 1 . . . . 135 PHE HE1 . 11122 1 1518 . 1 1 135 135 PHE HE2 H 1 6.858 0.030 . 1 . . . . 135 PHE HE2 . 11122 1 1519 . 1 1 135 135 PHE HZ H 1 6.947 0.030 . 1 . . . . 135 PHE HZ . 11122 1 1520 . 1 1 135 135 PHE C C 13 177.371 0.300 . 1 . . . . 135 PHE C . 11122 1 1521 . 1 1 135 135 PHE CA C 13 57.095 0.300 . 1 . . . . 135 PHE CA . 11122 1 1522 . 1 1 135 135 PHE CB C 13 37.183 0.300 . 1 . . . . 135 PHE CB . 11122 1 1523 . 1 1 135 135 PHE CD1 C 13 129.748 0.300 . 1 . . . . 135 PHE CD1 . 11122 1 1524 . 1 1 135 135 PHE CD2 C 13 129.748 0.300 . 1 . . . . 135 PHE CD2 . 11122 1 1525 . 1 1 135 135 PHE CE1 C 13 132.016 0.300 . 1 . . . . 135 PHE CE1 . 11122 1 1526 . 1 1 135 135 PHE CE2 C 13 132.016 0.300 . 1 . . . . 135 PHE CE2 . 11122 1 1527 . 1 1 135 135 PHE CZ C 13 129.970 0.300 . 1 . . . . 135 PHE CZ . 11122 1 1528 . 1 1 135 135 PHE N N 15 117.729 0.300 . 1 . . . . 135 PHE N . 11122 1 1529 . 1 1 136 136 GLN H H 1 7.249 0.030 . 1 . . . . 136 GLN H . 11122 1 1530 . 1 1 136 136 GLN HA H 1 3.928 0.030 . 1 . . . . 136 GLN HA . 11122 1 1531 . 1 1 136 136 GLN HB2 H 1 2.195 0.030 . 2 . . . . 136 GLN HB2 . 11122 1 1532 . 1 1 136 136 GLN HB3 H 1 2.033 0.030 . 2 . . . . 136 GLN HB3 . 11122 1 1533 . 1 1 136 136 GLN HE21 H 1 7.635 0.030 . 2 . . . . 136 GLN HE21 . 11122 1 1534 . 1 1 136 136 GLN HE22 H 1 6.777 0.030 . 2 . . . . 136 GLN HE22 . 11122 1 1535 . 1 1 136 136 GLN HG2 H 1 2.613 0.030 . 2 . . . . 136 GLN HG2 . 11122 1 1536 . 1 1 136 136 GLN HG3 H 1 2.464 0.030 . 2 . . . . 136 GLN HG3 . 11122 1 1537 . 1 1 136 136 GLN C C 13 179.338 0.300 . 1 . . . . 136 GLN C . 11122 1 1538 . 1 1 136 136 GLN CA C 13 59.139 0.300 . 1 . . . . 136 GLN CA . 11122 1 1539 . 1 1 136 136 GLN CB C 13 28.677 0.300 . 1 . . . . 136 GLN CB . 11122 1 1540 . 1 1 136 136 GLN CG C 13 33.073 0.300 . 1 . . . . 136 GLN CG . 11122 1 1541 . 1 1 136 136 GLN N N 15 116.159 0.300 . 1 . . . . 136 GLN N . 11122 1 1542 . 1 1 136 136 GLN NE2 N 15 111.715 0.300 . 1 . . . . 136 GLN NE2 . 11122 1 1543 . 1 1 137 137 GLU H H 1 8.324 0.030 . 1 . . . . 137 GLU H . 11122 1 1544 . 1 1 137 137 GLU HA H 1 4.029 0.030 . 1 . . . . 137 GLU HA . 11122 1 1545 . 1 1 137 137 GLU HB2 H 1 2.053 0.030 . 1 . . . . 137 GLU HB2 . 11122 1 1546 . 1 1 137 137 GLU HB3 H 1 2.053 0.030 . 1 . . . . 137 GLU HB3 . 11122 1 1547 . 1 1 137 137 GLU HG2 H 1 2.377 0.030 . 2 . . . . 137 GLU HG2 . 11122 1 1548 . 1 1 137 137 GLU HG3 H 1 2.279 0.030 . 2 . . . . 137 GLU HG3 . 11122 1 1549 . 1 1 137 137 GLU C C 13 178.173 0.300 . 1 . . . . 137 GLU C . 11122 1 1550 . 1 1 137 137 GLU CA C 13 59.280 0.300 . 1 . . . . 137 GLU CA . 11122 1 1551 . 1 1 137 137 GLU CB C 13 29.345 0.300 . 1 . . . . 137 GLU CB . 11122 1 1552 . 1 1 137 137 GLU CG C 13 36.203 0.300 . 1 . . . . 137 GLU CG . 11122 1 1553 . 1 1 137 137 GLU N N 15 120.059 0.300 . 1 . . . . 137 GLU N . 11122 1 1554 . 1 1 138 138 ALA H H 1 8.086 0.030 . 1 . . . . 138 ALA H . 11122 1 1555 . 1 1 138 138 ALA HA H 1 4.248 0.030 . 1 . . . . 138 ALA HA . 11122 1 1556 . 1 1 138 138 ALA HB1 H 1 1.792 0.030 . 1 . . . . 138 ALA HB . 11122 1 1557 . 1 1 138 138 ALA HB2 H 1 1.792 0.030 . 1 . . . . 138 ALA HB . 11122 1 1558 . 1 1 138 138 ALA HB3 H 1 1.792 0.030 . 1 . . . . 138 ALA HB . 11122 1 1559 . 1 1 138 138 ALA C C 13 180.382 0.300 . 1 . . . . 138 ALA C . 11122 1 1560 . 1 1 138 138 ALA CA C 13 55.121 0.300 . 1 . . . . 138 ALA CA . 11122 1 1561 . 1 1 138 138 ALA CB C 13 19.011 0.300 . 1 . . . . 138 ALA CB . 11122 1 1562 . 1 1 138 138 ALA N N 15 122.038 0.300 . 1 . . . . 138 ALA N . 11122 1 1563 . 1 1 139 139 LEU H H 1 8.025 0.030 . 1 . . . . 139 LEU H . 11122 1 1564 . 1 1 139 139 LEU HA H 1 4.110 0.030 . 1 . . . . 139 LEU HA . 11122 1 1565 . 1 1 139 139 LEU HB2 H 1 1.976 0.030 . 2 . . . . 139 LEU HB2 . 11122 1 1566 . 1 1 139 139 LEU HB3 H 1 1.542 0.030 . 2 . . . . 139 LEU HB3 . 11122 1 1567 . 1 1 139 139 LEU HD11 H 1 0.939 0.030 . 1 . . . . 139 LEU HD1 . 11122 1 1568 . 1 1 139 139 LEU HD12 H 1 0.939 0.030 . 1 . . . . 139 LEU HD1 . 11122 1 1569 . 1 1 139 139 LEU HD13 H 1 0.939 0.030 . 1 . . . . 139 LEU HD1 . 11122 1 1570 . 1 1 139 139 LEU HD21 H 1 0.964 0.030 . 1 . . . . 139 LEU HD2 . 11122 1 1571 . 1 1 139 139 LEU HD22 H 1 0.964 0.030 . 1 . . . . 139 LEU HD2 . 11122 1 1572 . 1 1 139 139 LEU HD23 H 1 0.964 0.030 . 1 . . . . 139 LEU HD2 . 11122 1 1573 . 1 1 139 139 LEU HG H 1 1.625 0.030 . 1 . . . . 139 LEU HG . 11122 1 1574 . 1 1 139 139 LEU C C 13 179.120 0.300 . 1 . . . . 139 LEU C . 11122 1 1575 . 1 1 139 139 LEU CA C 13 57.588 0.300 . 1 . . . . 139 LEU CA . 11122 1 1576 . 1 1 139 139 LEU CB C 13 41.765 0.300 . 1 . . . . 139 LEU CB . 11122 1 1577 . 1 1 139 139 LEU CD1 C 13 26.683 0.300 . 2 . . . . 139 LEU CD1 . 11122 1 1578 . 1 1 139 139 LEU CD2 C 13 24.073 0.300 . 2 . . . . 139 LEU CD2 . 11122 1 1579 . 1 1 139 139 LEU CG C 13 27.298 0.300 . 1 . . . . 139 LEU CG . 11122 1 1580 . 1 1 139 139 LEU N N 15 118.199 0.300 . 1 . . . . 139 LEU N . 11122 1 1581 . 1 1 140 140 ARG H H 1 7.986 0.030 . 1 . . . . 140 ARG H . 11122 1 1582 . 1 1 140 140 ARG HA H 1 4.028 0.030 . 1 . . . . 140 ARG HA . 11122 1 1583 . 1 1 140 140 ARG HB2 H 1 1.938 0.030 . 1 . . . . 140 ARG HB2 . 11122 1 1584 . 1 1 140 140 ARG HB3 H 1 1.938 0.030 . 1 . . . . 140 ARG HB3 . 11122 1 1585 . 1 1 140 140 ARG HD2 H 1 3.230 0.030 . 1 . . . . 140 ARG HD2 . 11122 1 1586 . 1 1 140 140 ARG HD3 H 1 3.230 0.030 . 1 . . . . 140 ARG HD3 . 11122 1 1587 . 1 1 140 140 ARG HG2 H 1 1.762 0.030 . 2 . . . . 140 ARG HG2 . 11122 1 1588 . 1 1 140 140 ARG HG3 H 1 1.647 0.030 . 2 . . . . 140 ARG HG3 . 11122 1 1589 . 1 1 140 140 ARG C C 13 178.780 0.300 . 1 . . . . 140 ARG C . 11122 1 1590 . 1 1 140 140 ARG CA C 13 59.087 0.300 . 1 . . . . 140 ARG CA . 11122 1 1591 . 1 1 140 140 ARG CB C 13 29.984 0.300 . 1 . . . . 140 ARG CB . 11122 1 1592 . 1 1 140 140 ARG CD C 13 43.451 0.300 . 1 . . . . 140 ARG CD . 11122 1 1593 . 1 1 140 140 ARG CG C 13 27.368 0.300 . 1 . . . . 140 ARG CG . 11122 1 1594 . 1 1 140 140 ARG N N 15 120.534 0.300 . 1 . . . . 140 ARG N . 11122 1 1595 . 1 1 141 141 ASN H H 1 8.084 0.030 . 1 . . . . 141 ASN H . 11122 1 1596 . 1 1 141 141 ASN HA H 1 4.528 0.030 . 1 . . . . 141 ASN HA . 11122 1 1597 . 1 1 141 141 ASN HB2 H 1 2.892 0.030 . 1 . . . . 141 ASN HB2 . 11122 1 1598 . 1 1 141 141 ASN HB3 H 1 2.892 0.030 . 1 . . . . 141 ASN HB3 . 11122 1 1599 . 1 1 141 141 ASN HD21 H 1 7.719 0.030 . 2 . . . . 141 ASN HD21 . 11122 1 1600 . 1 1 141 141 ASN HD22 H 1 6.954 0.030 . 2 . . . . 141 ASN HD22 . 11122 1 1601 . 1 1 141 141 ASN C C 13 176.886 0.300 . 1 . . . . 141 ASN C . 11122 1 1602 . 1 1 141 141 ASN CA C 13 55.407 0.300 . 1 . . . . 141 ASN CA . 11122 1 1603 . 1 1 141 141 ASN CB C 13 38.791 0.300 . 1 . . . . 141 ASN CB . 11122 1 1604 . 1 1 141 141 ASN N N 15 116.011 0.300 . 1 . . . . 141 ASN N . 11122 1 1605 . 1 1 141 141 ASN ND2 N 15 113.169 0.300 . 1 . . . . 141 ASN ND2 . 11122 1 1606 . 1 1 142 142 ILE H H 1 7.447 0.030 . 1 . . . . 142 ILE H . 11122 1 1607 . 1 1 142 142 ILE HA H 1 4.330 0.030 . 1 . . . . 142 ILE HA . 11122 1 1608 . 1 1 142 142 ILE HB H 1 1.924 0.030 . 1 . . . . 142 ILE HB . 11122 1 1609 . 1 1 142 142 ILE HD11 H 1 0.755 0.030 . 1 . . . . 142 ILE HD1 . 11122 1 1610 . 1 1 142 142 ILE HD12 H 1 0.755 0.030 . 1 . . . . 142 ILE HD1 . 11122 1 1611 . 1 1 142 142 ILE HD13 H 1 0.755 0.030 . 1 . . . . 142 ILE HD1 . 11122 1 1612 . 1 1 142 142 ILE HG12 H 1 1.497 0.030 . 2 . . . . 142 ILE HG12 . 11122 1 1613 . 1 1 142 142 ILE HG13 H 1 1.273 0.030 . 2 . . . . 142 ILE HG13 . 11122 1 1614 . 1 1 142 142 ILE HG21 H 1 0.928 0.030 . 1 . . . . 142 ILE HG2 . 11122 1 1615 . 1 1 142 142 ILE HG22 H 1 0.928 0.030 . 1 . . . . 142 ILE HG2 . 11122 1 1616 . 1 1 142 142 ILE HG23 H 1 0.928 0.030 . 1 . . . . 142 ILE HG2 . 11122 1 1617 . 1 1 142 142 ILE C C 13 175.987 0.300 . 1 . . . . 142 ILE C . 11122 1 1618 . 1 1 142 142 ILE CA C 13 62.409 0.300 . 1 . . . . 142 ILE CA . 11122 1 1619 . 1 1 142 142 ILE CB C 13 39.071 0.300 . 1 . . . . 142 ILE CB . 11122 1 1620 . 1 1 142 142 ILE CD1 C 13 14.971 0.300 . 1 . . . . 142 ILE CD1 . 11122 1 1621 . 1 1 142 142 ILE CG1 C 13 27.608 0.300 . 1 . . . . 142 ILE CG1 . 11122 1 1622 . 1 1 142 142 ILE CG2 C 13 17.686 0.300 . 1 . . . . 142 ILE CG2 . 11122 1 1623 . 1 1 142 142 ILE N N 15 115.101 0.300 . 1 . . . . 142 ILE N . 11122 1 1624 . 1 1 143 143 SER H H 1 7.816 0.030 . 1 . . . . 143 SER H . 11122 1 1625 . 1 1 143 143 SER HA H 1 4.457 0.030 . 1 . . . . 143 SER HA . 11122 1 1626 . 1 1 143 143 SER HB2 H 1 3.922 0.030 . 2 . . . . 143 SER HB2 . 11122 1 1627 . 1 1 143 143 SER HB3 H 1 3.844 0.030 . 2 . . . . 143 SER HB3 . 11122 1 1628 . 1 1 143 143 SER C C 13 174.506 0.300 . 1 . . . . 143 SER C . 11122 1 1629 . 1 1 143 143 SER CA C 13 59.244 0.300 . 1 . . . . 143 SER CA . 11122 1 1630 . 1 1 143 143 SER CB C 13 64.248 0.300 . 1 . . . . 143 SER CB . 11122 1 1631 . 1 1 143 143 SER N N 15 116.295 0.300 . 1 . . . . 143 SER N . 11122 1 1632 . 1 1 144 144 GLY H H 1 8.001 0.030 . 1 . . . . 144 GLY H . 11122 1 1633 . 1 1 144 144 GLY HA2 H 1 4.165 0.030 . 2 . . . . 144 GLY HA2 . 11122 1 1634 . 1 1 144 144 GLY HA3 H 1 4.113 0.030 . 2 . . . . 144 GLY HA3 . 11122 1 1635 . 1 1 144 144 GLY C C 13 171.860 0.300 . 1 . . . . 144 GLY C . 11122 1 1636 . 1 1 144 144 GLY CA C 13 44.936 0.300 . 1 . . . . 144 GLY CA . 11122 1 1637 . 1 1 144 144 GLY N N 15 110.080 0.300 . 1 . . . . 144 GLY N . 11122 1 1638 . 1 1 145 145 PRO HA H 1 4.459 0.030 . 1 . . . . 145 PRO HA . 11122 1 1639 . 1 1 145 145 PRO HB2 H 1 1.981 0.030 . 2 . . . . 145 PRO HB2 . 11122 1 1640 . 1 1 145 145 PRO HB3 H 1 2.287 0.030 . 2 . . . . 145 PRO HB3 . 11122 1 1641 . 1 1 145 145 PRO HD2 H 1 3.637 0.030 . 1 . . . . 145 PRO HD2 . 11122 1 1642 . 1 1 145 145 PRO HD3 H 1 3.637 0.030 . 1 . . . . 145 PRO HD3 . 11122 1 1643 . 1 1 145 145 PRO HG2 H 1 2.023 0.030 . 1 . . . . 145 PRO HG2 . 11122 1 1644 . 1 1 145 145 PRO HG3 H 1 2.023 0.030 . 1 . . . . 145 PRO HG3 . 11122 1 1645 . 1 1 145 145 PRO C C 13 177.469 0.300 . 1 . . . . 145 PRO C . 11122 1 1646 . 1 1 145 145 PRO CA C 13 63.403 0.300 . 1 . . . . 145 PRO CA . 11122 1 1647 . 1 1 145 145 PRO CB C 13 32.193 0.300 . 1 . . . . 145 PRO CB . 11122 1 1648 . 1 1 145 145 PRO CD C 13 49.847 0.300 . 1 . . . . 145 PRO CD . 11122 1 1649 . 1 1 145 145 PRO CG C 13 27.207 0.300 . 1 . . . . 145 PRO CG . 11122 1 stop_ save_