data_27159 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27159 _Entry.Title ; LRT2 Cyclophilin of rice ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2017-06-22 _Entry.Accession_date 2017-06-22 _Entry.Last_release_date 2017-06-23 _Entry.Original_release_date 2017-06-23 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _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.ORCID _Entry_author.Entry_ID 1 Lucila Acevedo . A. . . 27159 2 Linda Nicholson . K. . . 27159 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27159 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 638 27159 '15N chemical shifts' 164 27159 '1H chemical shifts' 983 27159 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 2 . . 2018-04-06 2017-06-22 update BMRB 'update entry citation' 27159 1 . . 2018-02-02 2017-06-22 original author 'original release' 27159 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27159 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 29353448 _Citation.Full_citation . _Citation.Title ; 1H, 13C and 15N NMR assignments of cyclophilin LRT2 (OsCYP2) from rice ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 12 _Citation.Journal_issue 1 _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 171 _Citation.Page_last 174 _Citation.Year 2018 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Lucila Acevedo . A. . . 27159 1 2 Linda Nicholson . K. . . 27159 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27159 _Assembly.ID 1 _Assembly.Name 'LRT2 monomer' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 18686.36 _Assembly.Enzyme_commission_number 5.2.1.8 _Assembly.Details monomer _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 LRT2 1 $LRT2 A . yes native no no . . . 27159 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_LRT2 _Entity.Sf_category entity _Entity.Sf_framecode LRT2 _Entity.Entry_ID 27159 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name LRT2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GHMMSNTRVFFDMTVGGAPA GRIVMELYAKDVPRTAENFR ALCTGEKGVGKSGKPLHYKG STFHRVIPEFMCQGGDFTRG NGTGGESIYGEKFADEVFKF KHDSPGILSMANAGPNTNGS QFFICTVPCSWLDGKHVVFG RVVEGMDVVKAIEKVGSRGG STAKPVVIADCGQLS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'residue 1 is left after TEV cleavage and residues 2 and 3 represent cloning artifacts' _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 175 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state unknown _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number 5.2.1.8 _Entity.Calc_isoelectric_point . _Entity.Formula_weight 18686.36 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 yes NCBI BAS76709 . Os02g0121300 . . . . . . . . . . . . . . 27159 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Peptidyl Prolyl Isomerase' 27159 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 -2 GLY . 27159 1 2 -1 HIS . 27159 1 3 0 MET . 27159 1 4 1 MET . 27159 1 5 2 SER . 27159 1 6 3 ASN . 27159 1 7 4 THR . 27159 1 8 5 ARG . 27159 1 9 6 VAL . 27159 1 10 7 PHE . 27159 1 11 8 PHE . 27159 1 12 9 ASP . 27159 1 13 10 MET . 27159 1 14 11 THR . 27159 1 15 12 VAL . 27159 1 16 13 GLY . 27159 1 17 14 GLY . 27159 1 18 15 ALA . 27159 1 19 16 PRO . 27159 1 20 17 ALA . 27159 1 21 18 GLY . 27159 1 22 19 ARG . 27159 1 23 20 ILE . 27159 1 24 21 VAL . 27159 1 25 22 MET . 27159 1 26 23 GLU . 27159 1 27 24 LEU . 27159 1 28 25 TYR . 27159 1 29 26 ALA . 27159 1 30 27 LYS . 27159 1 31 28 ASP . 27159 1 32 29 VAL . 27159 1 33 30 PRO . 27159 1 34 31 ARG . 27159 1 35 32 THR . 27159 1 36 33 ALA . 27159 1 37 34 GLU . 27159 1 38 35 ASN . 27159 1 39 36 PHE . 27159 1 40 37 ARG . 27159 1 41 38 ALA . 27159 1 42 39 LEU . 27159 1 43 40 CYS . 27159 1 44 41 THR . 27159 1 45 42 GLY . 27159 1 46 43 GLU . 27159 1 47 44 LYS . 27159 1 48 45 GLY . 27159 1 49 46 VAL . 27159 1 50 47 GLY . 27159 1 51 48 LYS . 27159 1 52 49 SER . 27159 1 53 50 GLY . 27159 1 54 51 LYS . 27159 1 55 52 PRO . 27159 1 56 53 LEU . 27159 1 57 54 HIS . 27159 1 58 55 TYR . 27159 1 59 56 LYS . 27159 1 60 57 GLY . 27159 1 61 58 SER . 27159 1 62 59 THR . 27159 1 63 60 PHE . 27159 1 64 61 HIS . 27159 1 65 62 ARG . 27159 1 66 63 VAL . 27159 1 67 64 ILE . 27159 1 68 65 PRO . 27159 1 69 66 GLU . 27159 1 70 67 PHE . 27159 1 71 68 MET . 27159 1 72 69 CYS . 27159 1 73 70 GLN . 27159 1 74 71 GLY . 27159 1 75 72 GLY . 27159 1 76 73 ASP . 27159 1 77 74 PHE . 27159 1 78 75 THR . 27159 1 79 76 ARG . 27159 1 80 77 GLY . 27159 1 81 78 ASN . 27159 1 82 79 GLY . 27159 1 83 80 THR . 27159 1 84 81 GLY . 27159 1 85 82 GLY . 27159 1 86 83 GLU . 27159 1 87 84 SER . 27159 1 88 85 ILE . 27159 1 89 86 TYR . 27159 1 90 87 GLY . 27159 1 91 88 GLU . 27159 1 92 89 LYS . 27159 1 93 90 PHE . 27159 1 94 91 ALA . 27159 1 95 92 ASP . 27159 1 96 93 GLU . 27159 1 97 94 VAL . 27159 1 98 95 PHE . 27159 1 99 96 LYS . 27159 1 100 97 PHE . 27159 1 101 98 LYS . 27159 1 102 99 HIS . 27159 1 103 100 ASP . 27159 1 104 101 SER . 27159 1 105 102 PRO . 27159 1 106 103 GLY . 27159 1 107 104 ILE . 27159 1 108 105 LEU . 27159 1 109 106 SER . 27159 1 110 107 MET . 27159 1 111 108 ALA . 27159 1 112 109 ASN . 27159 1 113 110 ALA . 27159 1 114 111 GLY . 27159 1 115 112 PRO . 27159 1 116 113 ASN . 27159 1 117 114 THR . 27159 1 118 115 ASN . 27159 1 119 116 GLY . 27159 1 120 117 SER . 27159 1 121 118 GLN . 27159 1 122 119 PHE . 27159 1 123 120 PHE . 27159 1 124 121 ILE . 27159 1 125 122 CYS . 27159 1 126 123 THR . 27159 1 127 124 VAL . 27159 1 128 125 PRO . 27159 1 129 126 CYS . 27159 1 130 127 SER . 27159 1 131 128 TRP . 27159 1 132 129 LEU . 27159 1 133 130 ASP . 27159 1 134 131 GLY . 27159 1 135 132 LYS . 27159 1 136 133 HIS . 27159 1 137 134 VAL . 27159 1 138 135 VAL . 27159 1 139 136 PHE . 27159 1 140 137 GLY . 27159 1 141 138 ARG . 27159 1 142 139 VAL . 27159 1 143 140 VAL . 27159 1 144 141 GLU . 27159 1 145 142 GLY . 27159 1 146 143 MET . 27159 1 147 144 ASP . 27159 1 148 145 VAL . 27159 1 149 146 VAL . 27159 1 150 147 LYS . 27159 1 151 148 ALA . 27159 1 152 149 ILE . 27159 1 153 150 GLU . 27159 1 154 151 LYS . 27159 1 155 152 VAL . 27159 1 156 153 GLY . 27159 1 157 154 SER . 27159 1 158 155 ARG . 27159 1 159 156 GLY . 27159 1 160 157 GLY . 27159 1 161 158 SER . 27159 1 162 159 THR . 27159 1 163 160 ALA . 27159 1 164 161 LYS . 27159 1 165 162 PRO . 27159 1 166 163 VAL . 27159 1 167 164 VAL . 27159 1 168 165 ILE . 27159 1 169 166 ALA . 27159 1 170 167 ASP . 27159 1 171 168 CYS . 27159 1 172 169 GLY . 27159 1 173 170 GLN . 27159 1 174 171 LEU . 27159 1 175 172 SER . 27159 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 27159 1 . HIS 2 2 27159 1 . MET 3 3 27159 1 . MET 4 4 27159 1 . SER 5 5 27159 1 . ASN 6 6 27159 1 . THR 7 7 27159 1 . ARG 8 8 27159 1 . VAL 9 9 27159 1 . PHE 10 10 27159 1 . PHE 11 11 27159 1 . ASP 12 12 27159 1 . MET 13 13 27159 1 . THR 14 14 27159 1 . VAL 15 15 27159 1 . GLY 16 16 27159 1 . GLY 17 17 27159 1 . ALA 18 18 27159 1 . PRO 19 19 27159 1 . ALA 20 20 27159 1 . GLY 21 21 27159 1 . ARG 22 22 27159 1 . ILE 23 23 27159 1 . VAL 24 24 27159 1 . MET 25 25 27159 1 . GLU 26 26 27159 1 . LEU 27 27 27159 1 . TYR 28 28 27159 1 . ALA 29 29 27159 1 . LYS 30 30 27159 1 . ASP 31 31 27159 1 . VAL 32 32 27159 1 . PRO 33 33 27159 1 . ARG 34 34 27159 1 . THR 35 35 27159 1 . ALA 36 36 27159 1 . GLU 37 37 27159 1 . ASN 38 38 27159 1 . PHE 39 39 27159 1 . ARG 40 40 27159 1 . ALA 41 41 27159 1 . LEU 42 42 27159 1 . CYS 43 43 27159 1 . THR 44 44 27159 1 . GLY 45 45 27159 1 . GLU 46 46 27159 1 . LYS 47 47 27159 1 . GLY 48 48 27159 1 . VAL 49 49 27159 1 . GLY 50 50 27159 1 . LYS 51 51 27159 1 . SER 52 52 27159 1 . GLY 53 53 27159 1 . LYS 54 54 27159 1 . PRO 55 55 27159 1 . LEU 56 56 27159 1 . HIS 57 57 27159 1 . TYR 58 58 27159 1 . LYS 59 59 27159 1 . GLY 60 60 27159 1 . SER 61 61 27159 1 . THR 62 62 27159 1 . PHE 63 63 27159 1 . HIS 64 64 27159 1 . ARG 65 65 27159 1 . VAL 66 66 27159 1 . ILE 67 67 27159 1 . PRO 68 68 27159 1 . GLU 69 69 27159 1 . PHE 70 70 27159 1 . MET 71 71 27159 1 . CYS 72 72 27159 1 . GLN 73 73 27159 1 . GLY 74 74 27159 1 . GLY 75 75 27159 1 . ASP 76 76 27159 1 . PHE 77 77 27159 1 . THR 78 78 27159 1 . ARG 79 79 27159 1 . GLY 80 80 27159 1 . ASN 81 81 27159 1 . GLY 82 82 27159 1 . THR 83 83 27159 1 . GLY 84 84 27159 1 . GLY 85 85 27159 1 . GLU 86 86 27159 1 . SER 87 87 27159 1 . ILE 88 88 27159 1 . TYR 89 89 27159 1 . GLY 90 90 27159 1 . GLU 91 91 27159 1 . LYS 92 92 27159 1 . PHE 93 93 27159 1 . ALA 94 94 27159 1 . ASP 95 95 27159 1 . GLU 96 96 27159 1 . VAL 97 97 27159 1 . PHE 98 98 27159 1 . LYS 99 99 27159 1 . PHE 100 100 27159 1 . LYS 101 101 27159 1 . HIS 102 102 27159 1 . ASP 103 103 27159 1 . SER 104 104 27159 1 . PRO 105 105 27159 1 . GLY 106 106 27159 1 . ILE 107 107 27159 1 . LEU 108 108 27159 1 . SER 109 109 27159 1 . MET 110 110 27159 1 . ALA 111 111 27159 1 . ASN 112 112 27159 1 . ALA 113 113 27159 1 . GLY 114 114 27159 1 . PRO 115 115 27159 1 . ASN 116 116 27159 1 . THR 117 117 27159 1 . ASN 118 118 27159 1 . GLY 119 119 27159 1 . SER 120 120 27159 1 . GLN 121 121 27159 1 . PHE 122 122 27159 1 . PHE 123 123 27159 1 . ILE 124 124 27159 1 . CYS 125 125 27159 1 . THR 126 126 27159 1 . VAL 127 127 27159 1 . PRO 128 128 27159 1 . CYS 129 129 27159 1 . SER 130 130 27159 1 . TRP 131 131 27159 1 . LEU 132 132 27159 1 . ASP 133 133 27159 1 . GLY 134 134 27159 1 . LYS 135 135 27159 1 . HIS 136 136 27159 1 . VAL 137 137 27159 1 . VAL 138 138 27159 1 . PHE 139 139 27159 1 . GLY 140 140 27159 1 . ARG 141 141 27159 1 . VAL 142 142 27159 1 . VAL 143 143 27159 1 . GLU 144 144 27159 1 . GLY 145 145 27159 1 . MET 146 146 27159 1 . ASP 147 147 27159 1 . VAL 148 148 27159 1 . VAL 149 149 27159 1 . LYS 150 150 27159 1 . ALA 151 151 27159 1 . ILE 152 152 27159 1 . GLU 153 153 27159 1 . LYS 154 154 27159 1 . VAL 155 155 27159 1 . GLY 156 156 27159 1 . SER 157 157 27159 1 . ARG 158 158 27159 1 . GLY 159 159 27159 1 . GLY 160 160 27159 1 . SER 161 161 27159 1 . THR 162 162 27159 1 . ALA 163 163 27159 1 . LYS 164 164 27159 1 . PRO 165 165 27159 1 . VAL 166 166 27159 1 . VAL 167 167 27159 1 . ILE 168 168 27159 1 . ALA 169 169 27159 1 . ASP 170 170 27159 1 . CYS 171 171 27159 1 . GLY 172 172 27159 1 . GLN 173 173 27159 1 . LEU 174 174 27159 1 . SER 175 175 27159 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 27159 _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $LRT2 . 4530 organism . 'Oryza sativa' rice . . Eukaryota Viridiplantae Oryza sativa Japonica . . . . . . . . . . Os02g0121300 'gene sequence corresponds to LOC_Os02g02890.1 in MSU rice genome annotation project release 7' 27159 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 27159 _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $LRT2 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 . . . . . Pet28 . . . 27159 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27159 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 LRT2 '[U-99% 13C; U-99% 15N]' . . 1 $LRT2 . . 1.16 . . mM . . . . 27159 1 2 'potassium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 27159 1 3 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 27159 1 4 TCEP 'natural abundance' . . . . . . 1 . . mM . . . . 27159 1 5 'sodium azide' 'natural abundance' . . . . . . 5 . . mM . . . . 27159 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 27159 _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' 94.76 . mM 27159 1 pH 6.7 . pH 27159 1 pressure 1 . atm 27159 1 temperature 298 . K 27159 1 stop_ save_ ############################ # Computer software used # ############################ save_PINE _Software.Sf_category software _Software.Sf_framecode PINE _Software.Entry_ID 27159 _Software.ID 1 _Software.Type . _Software.Name PINE _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bahrami, Markley, Assadi, and Eghbalnia' . . 27159 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 27159 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 27159 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 27159 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 27159 2 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 27159 _Software.ID 3 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 27159 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 27159 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 27159 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 27159 _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 Varian INOVA . 600 . . . 27159 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 27159 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27159 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27159 1 3 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27159 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27159 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27159 1 6 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27159 1 7 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27159 1 8 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27159 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 27159 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 27159 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27159 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27159 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 27159 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _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 '2D 1H-15N HSQC' . . . 27159 1 2 '2D 1H-13C HSQC' . . . 27159 1 3 '3D C(CO)NH' . . . 27159 1 4 '3D HNCO' . . . 27159 1 5 '3D HNCA' . . . 27159 1 6 '3D HNCACB' . . . 27159 1 7 '3D H(CCO)NH' . . . 27159 1 8 '3D HCCH-TOCSY' . . . 27159 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.Ambiguity_set_ID _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 4 4 MET H H 1 8.576 0.006 . 1 . . . . . 4 MET H . 27159 1 2 . 1 1 4 4 MET HA H 1 4.555 0.002 . 1 . . . . . 4 MET HA . 27159 1 3 . 1 1 4 4 MET HB2 H 1 2.085 0.002 . 1 . . . . . 4 MET HB2 . 27159 1 4 . 1 1 4 4 MET HB3 H 1 2.054 0.002 . 1 . . . . . 4 MET HB3 . 27159 1 5 . 1 1 4 4 MET HG2 H 1 2.541 0.002 . 1 . . . . . 4 MET HG2 . 27159 1 6 . 1 1 4 4 MET HG3 H 1 2.602 0.002 . 1 . . . . . 4 MET HG3 . 27159 1 7 . 1 1 4 4 MET C C 13 175.816 0.002 . 1 . . . . . 4 MET C . 27159 1 8 . 1 1 4 4 MET CA C 13 55.629 0.096 . 1 . . . . . 4 MET CA . 27159 1 9 . 1 1 4 4 MET CB C 13 33.126 0.002 . 1 . . . . . 4 MET CB . 27159 1 10 . 1 1 4 4 MET CG C 13 32.147 0.002 . 1 . . . . . 4 MET CG . 27159 1 11 . 1 1 4 4 MET N N 15 122.277 0.035 . 1 . . . . . 4 MET N . 27159 1 12 . 1 1 5 5 SER H H 1 8.216 0.002 . 1 . . . . . 5 SER H . 27159 1 13 . 1 1 5 5 SER HA H 1 4.563 0.005 . 1 . . . . . 5 SER HA . 27159 1 14 . 1 1 5 5 SER HB2 H 1 3.903 0.003 . 1 . . . . . 5 SER HB2 . 27159 1 15 . 1 1 5 5 SER HB3 H 1 3.686 0.012 . 1 . . . . . 5 SER HB3 . 27159 1 16 . 1 1 5 5 SER C C 13 173.723 0.002 . 1 . . . . . 5 SER C . 27159 1 17 . 1 1 5 5 SER CA C 13 58.06 0.077 . 1 . . . . . 5 SER CA . 27159 1 18 . 1 1 5 5 SER CB C 13 64.511 0.096 . 1 . . . . . 5 SER CB . 27159 1 19 . 1 1 5 5 SER N N 15 116.492 0.023 . 1 . . . . . 5 SER N . 27159 1 20 . 1 1 6 6 ASN H H 1 8.453 0.002 . 1 . . . . . 6 ASN H . 27159 1 21 . 1 1 6 6 ASN HA H 1 5.053 0.004 . 1 . . . . . 6 ASN HA . 27159 1 22 . 1 1 6 6 ASN HB2 H 1 2.812 0.001 . 1 . . . . . 6 ASN HB2 . 27159 1 23 . 1 1 6 6 ASN HB3 H 1 3.258 0.002 . 1 . . . . . 6 ASN HB3 . 27159 1 24 . 1 1 6 6 ASN C C 13 175.501 0.002 . 1 . . . . . 6 ASN C . 27159 1 25 . 1 1 6 6 ASN CA C 13 53.551 0.162 . 1 . . . . . 6 ASN CA . 27159 1 26 . 1 1 6 6 ASN CB C 13 38.905 0.025 . 1 . . . . . 6 ASN CB . 27159 1 27 . 1 1 6 6 ASN N N 15 120.804 0.026 . 1 . . . . . 6 ASN N . 27159 1 28 . 1 1 7 7 THR H H 1 8.048 0.003 . 1 . . . . . 7 THR H . 27159 1 29 . 1 1 7 7 THR HA H 1 4.573 0.007 . 1 . . . . . 7 THR HA . 27159 1 30 . 1 1 7 7 THR HB H 1 4.18 0.004 . 1 . . . . . 7 THR HB . 27159 1 31 . 1 1 7 7 THR HG21 H 1 1.246 0.022 . 1 . . . . . 7 THR MG . 27159 1 32 . 1 1 7 7 THR HG22 H 1 1.246 0.022 . 1 . . . . . 7 THR MG . 27159 1 33 . 1 1 7 7 THR HG23 H 1 1.246 0.022 . 1 . . . . . 7 THR MG . 27159 1 34 . 1 1 7 7 THR C C 13 173.647 0.002 . 1 . . . . . 7 THR C . 27159 1 35 . 1 1 7 7 THR CA C 13 61.499 0.114 . 1 . . . . . 7 THR CA . 27159 1 36 . 1 1 7 7 THR CB C 13 70.801 0.07 . 1 . . . . . 7 THR CB . 27159 1 37 . 1 1 7 7 THR CG2 C 13 22.575 0.005 . 1 . . . . . 7 THR CG2 . 27159 1 38 . 1 1 7 7 THR N N 15 115.222 0.024 . 1 . . . . . 7 THR N . 27159 1 39 . 1 1 8 8 ARG H H 1 8.915 0.002 . 1 . . . . . 8 ARG H . 27159 1 40 . 1 1 8 8 ARG HA H 1 5.805 0.002 . 1 . . . . . 8 ARG HA . 27159 1 41 . 1 1 8 8 ARG HB2 H 1 1.932 0.002 . 1 . . . . . 8 ARG HB2 . 27159 1 42 . 1 1 8 8 ARG HB3 H 1 1.588 0.002 . 1 . . . . . 8 ARG HB3 . 27159 1 43 . 1 1 8 8 ARG HG2 H 1 1.714 0.012 . 1 . . . . . 8 ARG HG2 . 27159 1 44 . 1 1 8 8 ARG HG3 H 1 1.507 0.012 . 1 . . . . . 8 ARG HG3 . 27159 1 45 . 1 1 8 8 ARG HD2 H 1 3.119 0.002 . 1 . . . . . 8 ARG HD2 . 27159 1 46 . 1 1 8 8 ARG HD3 H 1 3.302 0.002 . 1 . . . . . 8 ARG HD3 . 27159 1 47 . 1 1 8 8 ARG C C 13 176.045 0.002 . 1 . . . . . 8 ARG C . 27159 1 48 . 1 1 8 8 ARG CA C 13 55.011 0.112 . 1 . . . . . 8 ARG CA . 27159 1 49 . 1 1 8 8 ARG CB C 13 34.7 0.029 . 1 . . . . . 8 ARG CB . 27159 1 50 . 1 1 8 8 ARG CG C 13 28.554 0.091 . 1 . . . . . 8 ARG CG . 27159 1 51 . 1 1 8 8 ARG CD C 13 43.755 0.15 . 1 . . . . . 8 ARG CD . 27159 1 52 . 1 1 8 8 ARG N N 15 122.187 0.051 . 1 . . . . . 8 ARG N . 27159 1 53 . 1 1 9 9 VAL H H 1 9.092 0.003 . 1 . . . . . 9 VAL H . 27159 1 54 . 1 1 9 9 VAL HA H 1 5.319 0.006 . 1 . . . . . 9 VAL HA . 27159 1 55 . 1 1 9 9 VAL HB H 1 2.67 0.012 . 1 . . . . . 9 VAL HB . 27159 1 56 . 1 1 9 9 VAL HG11 H 1 0.965 0.017 . 1 . . . . . 9 VAL MG1 . 27159 1 57 . 1 1 9 9 VAL HG12 H 1 0.965 0.017 . 1 . . . . . 9 VAL MG1 . 27159 1 58 . 1 1 9 9 VAL HG13 H 1 0.965 0.017 . 1 . . . . . 9 VAL MG1 . 27159 1 59 . 1 1 9 9 VAL HG21 H 1 0.944 0.002 . 1 . . . . . 9 VAL MG2 . 27159 1 60 . 1 1 9 9 VAL HG22 H 1 0.944 0.002 . 1 . . . . . 9 VAL MG2 . 27159 1 61 . 1 1 9 9 VAL HG23 H 1 0.944 0.002 . 1 . . . . . 9 VAL MG2 . 27159 1 62 . 1 1 9 9 VAL C C 13 173.355 0.002 . 1 . . . . . 9 VAL C . 27159 1 63 . 1 1 9 9 VAL CA C 13 58.681 0.061 . 1 . . . . . 9 VAL CA . 27159 1 64 . 1 1 9 9 VAL CB C 13 36.228 0.122 . 1 . . . . . 9 VAL CB . 27159 1 65 . 1 1 9 9 VAL CG1 C 13 22.021 0.077 . 1 . . . . . 9 VAL CG1 . 27159 1 66 . 1 1 9 9 VAL CG2 C 13 19.123 0.109 . 1 . . . . . 9 VAL CG2 . 27159 1 67 . 1 1 9 9 VAL N N 15 115.204 0.027 . 1 . . . . . 9 VAL N . 27159 1 68 . 1 1 10 10 PHE H H 1 8.619 0.003 . 1 . . . . . 10 PHE H . 27159 1 69 . 1 1 10 10 PHE HA H 1 6.079 0.006 . 1 . . . . . 10 PHE HA . 27159 1 70 . 1 1 10 10 PHE HB2 H 1 2.877 0.002 . 1 . . . . . 10 PHE HB2 . 27159 1 71 . 1 1 10 10 PHE HB3 H 1 2.671 0.011 . 1 . . . . . 10 PHE HB3 . 27159 1 72 . 1 1 10 10 PHE C C 13 172.714 0.002 . 1 . . . . . 10 PHE C . 27159 1 73 . 1 1 10 10 PHE CA C 13 55.61 0.106 . 1 . . . . . 10 PHE CA . 27159 1 74 . 1 1 10 10 PHE CB C 13 43.958 0.161 . 1 . . . . . 10 PHE CB . 27159 1 75 . 1 1 10 10 PHE N N 15 115.882 0.04 . 1 . . . . . 10 PHE N . 27159 1 76 . 1 1 11 11 PHE H H 1 8.97 0.003 . 1 . . . . . 11 PHE H . 27159 1 77 . 1 1 11 11 PHE HA H 1 5.379 0.005 . 1 . . . . . 11 PHE HA . 27159 1 78 . 1 1 11 11 PHE HB2 H 1 3.513 0.002 . 1 . . . . . 11 PHE HB2 . 27159 1 79 . 1 1 11 11 PHE HB3 H 1 3.133 0 . 1 . . . . . 11 PHE HB3 . 27159 1 80 . 1 1 11 11 PHE C C 13 175.599 0 . 1 . . . . . 11 PHE C . 27159 1 81 . 1 1 11 11 PHE CA C 13 53.143 0.158 . 1 . . . . . 11 PHE CA . 27159 1 82 . 1 1 11 11 PHE CB C 13 43.973 0.046 . 1 . . . . . 11 PHE CB . 27159 1 83 . 1 1 11 11 PHE N N 15 115.761 0.035 . 1 . . . . . 11 PHE N . 27159 1 84 . 1 1 12 12 ASP H H 1 9.276 0.005 . 1 . . . . . 12 ASP H . 27159 1 85 . 1 1 12 12 ASP HA H 1 5.508 0.012 . 1 . . . . . 12 ASP HA . 27159 1 86 . 1 1 12 12 ASP HB2 H 1 2.513 0 . 1 . . . . . 12 ASP HB2 . 27159 1 87 . 1 1 12 12 ASP HB3 H 1 2.728 0.013 . 1 . . . . . 12 ASP HB3 . 27159 1 88 . 1 1 12 12 ASP C C 13 175.25 0.128 . 1 . . . . . 12 ASP C . 27159 1 89 . 1 1 12 12 ASP CA C 13 54.942 0.155 . 1 . . . . . 12 ASP CA . 27159 1 90 . 1 1 12 12 ASP CB C 13 42.048 0.084 . 1 . . . . . 12 ASP CB . 27159 1 91 . 1 1 12 12 ASP N N 15 124.719 0.057 . 1 . . . . . 12 ASP N . 27159 1 92 . 1 1 13 13 MET H H 1 8.649 0.003 . 1 . . . . . 13 MET H . 27159 1 93 . 1 1 13 13 MET HA H 1 5.751 0.003 . 1 . . . . . 13 MET HA . 27159 1 94 . 1 1 13 13 MET HB2 H 1 2.579 0 . 1 . . . . . 13 MET HB2 . 27159 1 95 . 1 1 13 13 MET HB3 H 1 2.539 0 . 1 . . . . . 13 MET HB3 . 27159 1 96 . 1 1 13 13 MET HG2 H 1 2.52 0 . 1 . . . . . 13 MET HG2 . 27159 1 97 . 1 1 13 13 MET HG3 H 1 2.031 0.007 . 1 . . . . . 13 MET HG3 . 27159 1 98 . 1 1 13 13 MET C C 13 179.108 0 . 1 . . . . . 13 MET C . 27159 1 99 . 1 1 13 13 MET CA C 13 52.195 0.195 . 1 . . . . . 13 MET CA . 27159 1 100 . 1 1 13 13 MET CB C 13 31.291 0.037 . 1 . . . . . 13 MET CB . 27159 1 101 . 1 1 13 13 MET CG C 13 30.284 0.106 . 1 . . . . . 13 MET CG . 27159 1 102 . 1 1 13 13 MET N N 15 118.478 0.06 . 1 . . . . . 13 MET N . 27159 1 103 . 1 1 14 14 THR H H 1 9.666 0.004 . 1 . . . . . 14 THR H . 27159 1 104 . 1 1 14 14 THR HA H 1 5.068 0.004 . 1 . . . . . 14 THR HA . 27159 1 105 . 1 1 14 14 THR HB H 1 3.676 0.002 . 1 . . . . . 14 THR HB . 27159 1 106 . 1 1 14 14 THR HG21 H 1 1.261 0 . 1 . . . . . 14 THR MG . 27159 1 107 . 1 1 14 14 THR HG22 H 1 1.261 0 . 1 . . . . . 14 THR MG . 27159 1 108 . 1 1 14 14 THR HG23 H 1 1.261 0 . 1 . . . . . 14 THR MG . 27159 1 109 . 1 1 14 14 THR C C 13 173.663 0 . 1 . . . . . 14 THR C . 27159 1 110 . 1 1 14 14 THR CA C 13 60.075 0.083 . 1 . . . . . 14 THR CA . 27159 1 111 . 1 1 14 14 THR CB C 13 71.786 0.202 . 1 . . . . . 14 THR CB . 27159 1 112 . 1 1 14 14 THR CG2 C 13 20.926 0.233 . 1 . . . . . 14 THR CG2 . 27159 1 113 . 1 1 14 14 THR N N 15 114.412 0.041 . 1 . . . . . 14 THR N . 27159 1 114 . 1 1 15 15 VAL H H 1 8.653 0.004 . 1 . . . . . 15 VAL H . 27159 1 115 . 1 1 15 15 VAL HA H 1 4.805 0 . 1 . . . . . 15 VAL HA . 27159 1 116 . 1 1 15 15 VAL HB H 1 2.031 0.004 . 1 . . . . . 15 VAL HB . 27159 1 117 . 1 1 15 15 VAL HG11 H 1 0.788 0 . 1 . . . . . 15 VAL MG1 . 27159 1 118 . 1 1 15 15 VAL HG12 H 1 0.788 0 . 1 . . . . . 15 VAL MG1 . 27159 1 119 . 1 1 15 15 VAL HG13 H 1 0.788 0 . 1 . . . . . 15 VAL MG1 . 27159 1 120 . 1 1 15 15 VAL HG21 H 1 0.84 0 . 1 . . . . . 15 VAL MG2 . 27159 1 121 . 1 1 15 15 VAL HG22 H 1 0.84 0 . 1 . . . . . 15 VAL MG2 . 27159 1 122 . 1 1 15 15 VAL HG23 H 1 0.84 0 . 1 . . . . . 15 VAL MG2 . 27159 1 123 . 1 1 15 15 VAL C C 13 178.08 0 . 1 . . . . . 15 VAL C . 27159 1 124 . 1 1 15 15 VAL CA C 13 61.347 0.077 . 1 . . . . . 15 VAL CA . 27159 1 125 . 1 1 15 15 VAL CB C 13 34.269 0.069 . 1 . . . . . 15 VAL CB . 27159 1 126 . 1 1 15 15 VAL CG1 C 13 21.246 0 . 1 . . . . . 15 VAL CG1 . 27159 1 127 . 1 1 15 15 VAL CG2 C 13 22.081 0 . 1 . . . . . 15 VAL CG2 . 27159 1 128 . 1 1 15 15 VAL N N 15 120.757 0.024 . 1 . . . . . 15 VAL N . 27159 1 129 . 1 1 16 16 GLY H H 1 9.498 0.004 . 1 . . . . . 16 GLY H . 27159 1 130 . 1 1 16 16 GLY HA2 H 1 3.958 0.005 . 1 . . . . . 16 GLY HA2 . 27159 1 131 . 1 1 16 16 GLY HA3 H 1 3.946 0 . 1 . . . . . 16 GLY HA3 . 27159 1 132 . 1 1 16 16 GLY C C 13 174.524 0 . 1 . . . . . 16 GLY C . 27159 1 133 . 1 1 16 16 GLY CA C 13 47.693 0.074 . 1 . . . . . 16 GLY CA . 27159 1 134 . 1 1 16 16 GLY N N 15 117.507 0.052 . 1 . . . . . 16 GLY N . 27159 1 135 . 1 1 17 17 GLY H H 1 8.972 0.004 . 1 . . . . . 17 GLY H . 27159 1 136 . 1 1 17 17 GLY HA2 H 1 3.465 0 . 1 . . . . . 17 GLY HA2 . 27159 1 137 . 1 1 17 17 GLY HA3 H 1 4.34 0 . 1 . . . . . 17 GLY HA3 . 27159 1 138 . 1 1 17 17 GLY C C 13 172.291 0 . 1 . . . . . 17 GLY C . 27159 1 139 . 1 1 17 17 GLY CA C 13 44.74 0.017 . 1 . . . . . 17 GLY CA . 27159 1 140 . 1 1 17 17 GLY N N 15 104.759 0.017 . 1 . . . . . 17 GLY N . 27159 1 141 . 1 1 18 18 ALA H H 1 7.49 0.001 . 1 . . . . . 18 ALA H . 27159 1 142 . 1 1 18 18 ALA HA H 1 4.99 0.002 . 1 . . . . . 18 ALA HA . 27159 1 143 . 1 1 18 18 ALA HB1 H 1 1.448 0 . 1 . . . . . 18 ALA MB . 27159 1 144 . 1 1 18 18 ALA HB2 H 1 1.448 0 . 1 . . . . . 18 ALA MB . 27159 1 145 . 1 1 18 18 ALA HB3 H 1 1.448 0 . 1 . . . . . 18 ALA MB . 27159 1 146 . 1 1 18 18 ALA CA C 13 48.974 0.068 . 1 . . . . . 18 ALA CA . 27159 1 147 . 1 1 18 18 ALA CB C 13 19.361 0 . 1 . . . . . 18 ALA CB . 27159 1 148 . 1 1 18 18 ALA N N 15 124.443 0.026 . 1 . . . . . 18 ALA N . 27159 1 149 . 1 1 19 19 PRO HA H 1 4.398 0.008 . 1 . . . . . 19 PRO HA . 27159 1 150 . 1 1 19 19 PRO HB2 H 1 2.382 0 . 1 . . . . . 19 PRO HB2 . 27159 1 151 . 1 1 19 19 PRO HB3 H 1 1.995 0.019 . 1 . . . . . 19 PRO HB3 . 27159 1 152 . 1 1 19 19 PRO HG2 H 1 2.208 0.002 . 1 . . . . . 19 PRO HG2 . 27159 1 153 . 1 1 19 19 PRO HG3 H 1 2.041 0 . 1 . . . . . 19 PRO HG3 . 27159 1 154 . 1 1 19 19 PRO HD2 H 1 3.947 0 . 1 . . . . . 19 PRO HD2 . 27159 1 155 . 1 1 19 19 PRO HD3 H 1 3.696 0.028 . 1 . . . . . 19 PRO HD3 . 27159 1 156 . 1 1 19 19 PRO C C 13 176.835 0 . 1 . . . . . 19 PRO C . 27159 1 157 . 1 1 19 19 PRO CA C 13 64.179 0.18 . 1 . . . . . 19 PRO CA . 27159 1 158 . 1 1 19 19 PRO CB C 13 32.05 0.142 . 1 . . . . . 19 PRO CB . 27159 1 159 . 1 1 19 19 PRO CG C 13 27.792 0.091 . 1 . . . . . 19 PRO CG . 27159 1 160 . 1 1 19 19 PRO CD C 13 50.975 0 . 1 . . . . . 19 PRO CD . 27159 1 161 . 1 1 20 20 ALA H H 1 8.835 0.004 . 1 . . . . . 20 ALA H . 27159 1 162 . 1 1 20 20 ALA HA H 1 4.692 0.019 . 1 . . . . . 20 ALA HA . 27159 1 163 . 1 1 20 20 ALA HB1 H 1 1.25 0 . 1 . . . . . 20 ALA MB . 27159 1 164 . 1 1 20 20 ALA HB2 H 1 1.25 0 . 1 . . . . . 20 ALA MB . 27159 1 165 . 1 1 20 20 ALA HB3 H 1 1.25 0 . 1 . . . . . 20 ALA MB . 27159 1 166 . 1 1 20 20 ALA C C 13 175.89 0 . 1 . . . . . 20 ALA C . 27159 1 167 . 1 1 20 20 ALA CA C 13 51.273 0.07 . 1 . . . . . 20 ALA CA . 27159 1 168 . 1 1 20 20 ALA CB C 13 20.912 0 . 1 . . . . . 20 ALA CB . 27159 1 169 . 1 1 20 20 ALA N N 15 126.486 0.035 . 1 . . . . . 20 ALA N . 27159 1 170 . 1 1 21 21 GLY H H 1 7.604 0.002 . 1 . . . . . 21 GLY H . 27159 1 171 . 1 1 21 21 GLY HA2 H 1 4.674 0 . 1 . . . . . 21 GLY HA2 . 27159 1 172 . 1 1 21 21 GLY HA3 H 1 3.776 0 . 1 . . . . . 21 GLY HA3 . 27159 1 173 . 1 1 21 21 GLY C C 13 171.315 0 . 1 . . . . . 21 GLY C . 27159 1 174 . 1 1 21 21 GLY CA C 13 44.089 0.051 . 1 . . . . . 21 GLY CA . 27159 1 175 . 1 1 21 21 GLY N N 15 105.63 0.041 . 1 . . . . . 21 GLY N . 27159 1 176 . 1 1 22 22 ARG H H 1 8.183 0.003 . 1 . . . . . 22 ARG H . 27159 1 177 . 1 1 22 22 ARG HA H 1 5.654 0.008 . 1 . . . . . 22 ARG HA . 27159 1 178 . 1 1 22 22 ARG HB2 H 1 2.034 0 . 1 . . . . . 22 ARG HB2 . 27159 1 179 . 1 1 22 22 ARG HB3 H 1 1.664 0 . 1 . . . . . 22 ARG HB3 . 27159 1 180 . 1 1 22 22 ARG HG2 H 1 1.65 0 . 1 . . . . . 22 ARG HG2 . 27159 1 181 . 1 1 22 22 ARG HG3 H 1 1.421 0 . 1 . . . . . 22 ARG HG3 . 27159 1 182 . 1 1 22 22 ARG HD2 H 1 2.743 0 . 1 . . . . . 22 ARG HD2 . 27159 1 183 . 1 1 22 22 ARG HD3 H 1 2.817 0 . 1 . . . . . 22 ARG HD3 . 27159 1 184 . 1 1 22 22 ARG C C 13 175.602 0 . 1 . . . . . 22 ARG C . 27159 1 185 . 1 1 22 22 ARG CA C 13 54.705 0.158 . 1 . . . . . 22 ARG CA . 27159 1 186 . 1 1 22 22 ARG CB C 13 34.17 0.091 . 1 . . . . . 22 ARG CB . 27159 1 187 . 1 1 22 22 ARG CG C 13 27.462 0.132 . 1 . . . . . 22 ARG CG . 27159 1 188 . 1 1 22 22 ARG CD C 13 41.573 0.018 . 1 . . . . . 22 ARG CD . 27159 1 189 . 1 1 22 22 ARG N N 15 119.737 0.034 . 1 . . . . . 22 ARG N . 27159 1 190 . 1 1 23 23 ILE H H 1 9.477 0.002 . 1 . . . . . 23 ILE H . 27159 1 191 . 1 1 23 23 ILE HA H 1 4.626 0.006 . 1 . . . . . 23 ILE HA . 27159 1 192 . 1 1 23 23 ILE HB H 1 1.805 0.001 . 1 . . . . . 23 ILE HB . 27159 1 193 . 1 1 23 23 ILE HG12 H 1 1.552 0 . 1 . . . . . 23 ILE HG12 . 27159 1 194 . 1 1 23 23 ILE HG13 H 1 1.378 0 . 1 . . . . . 23 ILE HG13 . 27159 1 195 . 1 1 23 23 ILE HG21 H 1 0.984 0 . 1 . . . . . 23 ILE MG . 27159 1 196 . 1 1 23 23 ILE HG22 H 1 0.984 0 . 1 . . . . . 23 ILE MG . 27159 1 197 . 1 1 23 23 ILE HG23 H 1 0.984 0 . 1 . . . . . 23 ILE MG . 27159 1 198 . 1 1 23 23 ILE HD11 H 1 0.998 0 . 1 . . . . . 23 ILE MD . 27159 1 199 . 1 1 23 23 ILE HD12 H 1 0.998 0 . 1 . . . . . 23 ILE MD . 27159 1 200 . 1 1 23 23 ILE HD13 H 1 0.998 0 . 1 . . . . . 23 ILE MD . 27159 1 201 . 1 1 23 23 ILE C C 13 175.543 0.164 . 1 . . . . . 23 ILE C . 27159 1 202 . 1 1 23 23 ILE CA C 13 60.684 0.062 . 1 . . . . . 23 ILE CA . 27159 1 203 . 1 1 23 23 ILE CB C 13 41.484 0.13 . 1 . . . . . 23 ILE CB . 27159 1 204 . 1 1 23 23 ILE CG1 C 13 26.251 0.014 . 1 . . . . . 23 ILE CG1 . 27159 1 205 . 1 1 23 23 ILE CG2 C 13 18.657 0 . 1 . . . . . 23 ILE CG2 . 27159 1 206 . 1 1 23 23 ILE CD1 C 13 14.56 0 . 1 . . . . . 23 ILE CD1 . 27159 1 207 . 1 1 23 23 ILE N N 15 126.087 0.066 . 1 . . . . . 23 ILE N . 27159 1 208 . 1 1 24 24 VAL H H 1 8.962 0.009 . 1 . . . . . 24 VAL H . 27159 1 209 . 1 1 24 24 VAL HA H 1 4.909 0.015 . 1 . . . . . 24 VAL HA . 27159 1 210 . 1 1 24 24 VAL HB H 1 1.906 0.014 . 1 . . . . . 24 VAL HB . 27159 1 211 . 1 1 24 24 VAL HG11 H 1 0.917 0.006 . 1 . . . . . 24 VAL MG1 . 27159 1 212 . 1 1 24 24 VAL HG12 H 1 0.917 0.006 . 1 . . . . . 24 VAL MG1 . 27159 1 213 . 1 1 24 24 VAL HG13 H 1 0.917 0.006 . 1 . . . . . 24 VAL MG1 . 27159 1 214 . 1 1 24 24 VAL HG21 H 1 0.794 0 . 1 . . . . . 24 VAL MG2 . 27159 1 215 . 1 1 24 24 VAL HG22 H 1 0.794 0 . 1 . . . . . 24 VAL MG2 . 27159 1 216 . 1 1 24 24 VAL HG23 H 1 0.794 0 . 1 . . . . . 24 VAL MG2 . 27159 1 217 . 1 1 24 24 VAL C C 13 175.974 0 . 1 . . . . . 24 VAL C . 27159 1 218 . 1 1 24 24 VAL CA C 13 61.696 0.068 . 1 . . . . . 24 VAL CA . 27159 1 219 . 1 1 24 24 VAL CB C 13 33.365 0.184 . 1 . . . . . 24 VAL CB . 27159 1 220 . 1 1 24 24 VAL CG1 C 13 21.235 0.026 . 1 . . . . . 24 VAL CG1 . 27159 1 221 . 1 1 24 24 VAL N N 15 126.898 0.032 . 1 . . . . . 24 VAL N . 27159 1 222 . 1 1 25 25 MET H H 1 9.393 0.004 . 1 . . . . . 25 MET H . 27159 1 223 . 1 1 25 25 MET HA H 1 4.951 0.001 . 1 . . . . . 25 MET HA . 27159 1 224 . 1 1 25 25 MET HB2 H 1 1.508 0 . 1 . . . . . 25 MET HB2 . 27159 1 225 . 1 1 25 25 MET HB3 H 1 1.322 0 . 1 . . . . . 25 MET HB3 . 27159 1 226 . 1 1 25 25 MET HG2 H 1 2.046 0.027 . 1 . . . . . 25 MET HG2 . 27159 1 227 . 1 1 25 25 MET HG3 H 1 1.823 0 . 1 . . . . . 25 MET HG3 . 27159 1 228 . 1 1 25 25 MET C C 13 175.591 0 . 1 . . . . . 25 MET C . 27159 1 229 . 1 1 25 25 MET CA C 13 54.277 0.12 . 1 . . . . . 25 MET CA . 27159 1 230 . 1 1 25 25 MET CB C 13 36.924 0.044 . 1 . . . . . 25 MET CB . 27159 1 231 . 1 1 25 25 MET CG C 13 32.255 0.24 . 1 . . . . . 25 MET CG . 27159 1 232 . 1 1 25 25 MET N N 15 127.559 0.049 . 1 . . . . . 25 MET N . 27159 1 233 . 1 1 26 26 GLU H H 1 8.913 0.006 . 1 . . . . . 26 GLU H . 27159 1 234 . 1 1 26 26 GLU HA H 1 5.228 0.01 . 1 . . . . . 26 GLU HA . 27159 1 235 . 1 1 26 26 GLU HB2 H 1 2.033 0 . 1 . . . . . 26 GLU HB2 . 27159 1 236 . 1 1 26 26 GLU HB3 H 1 1.871 0 . 1 . . . . . 26 GLU HB3 . 27159 1 237 . 1 1 26 26 GLU HG2 H 1 2.155 0 . 1 . . . . . 26 GLU HG2 . 27159 1 238 . 1 1 26 26 GLU HG3 H 1 2.194 0 . 1 . . . . . 26 GLU HG3 . 27159 1 239 . 1 1 26 26 GLU C C 13 174.209 0 . 1 . . . . . 26 GLU C . 27159 1 240 . 1 1 26 26 GLU CA C 13 54.105 0.146 . 1 . . . . . 26 GLU CA . 27159 1 241 . 1 1 26 26 GLU CB C 13 32.889 0.113 . 1 . . . . . 26 GLU CB . 27159 1 242 . 1 1 26 26 GLU CG C 13 37.332 0 . 1 . . . . . 26 GLU CG . 27159 1 243 . 1 1 26 26 GLU N N 15 122.865 0.092 . 1 . . . . . 26 GLU N . 27159 1 244 . 1 1 27 27 LEU H H 1 8.795 0.005 . 1 . . . . . 27 LEU H . 27159 1 245 . 1 1 27 27 LEU HA H 1 4.792 0.006 . 1 . . . . . 27 LEU HA . 27159 1 246 . 1 1 27 27 LEU HB2 H 1 2.173 0.003 . 1 . . . . . 27 LEU HB2 . 27159 1 247 . 1 1 27 27 LEU HB3 H 1 1.189 0.011 . 1 . . . . . 27 LEU HB3 . 27159 1 248 . 1 1 27 27 LEU HG H 1 1.624 0.01 . 1 . . . . . 27 LEU HG . 27159 1 249 . 1 1 27 27 LEU HD11 H 1 0.503 0.004 . 1 . . . . . 27 LEU MD1 . 27159 1 250 . 1 1 27 27 LEU HD12 H 1 0.503 0.004 . 1 . . . . . 27 LEU MD1 . 27159 1 251 . 1 1 27 27 LEU HD13 H 1 0.503 0.004 . 1 . . . . . 27 LEU MD1 . 27159 1 252 . 1 1 27 27 LEU HD21 H 1 0.592 0 . 1 . . . . . 27 LEU MD2 . 27159 1 253 . 1 1 27 27 LEU HD22 H 1 0.592 0 . 1 . . . . . 27 LEU MD2 . 27159 1 254 . 1 1 27 27 LEU HD23 H 1 0.592 0 . 1 . . . . . 27 LEU MD2 . 27159 1 255 . 1 1 27 27 LEU C C 13 178.617 0 . 1 . . . . . 27 LEU C . 27159 1 256 . 1 1 27 27 LEU CA C 13 52.165 0.182 . 1 . . . . . 27 LEU CA . 27159 1 257 . 1 1 27 27 LEU CB C 13 43.429 0.044 . 1 . . . . . 27 LEU CB . 27159 1 258 . 1 1 27 27 LEU CG C 13 27.041 0.055 . 1 . . . . . 27 LEU CG . 27159 1 259 . 1 1 27 27 LEU CD1 C 13 22.733 0.035 . 1 . . . . . 27 LEU CD1 . 27159 1 260 . 1 1 27 27 LEU CD2 C 13 22.031 0 . 1 . . . . . 27 LEU CD2 . 27159 1 261 . 1 1 27 27 LEU N N 15 121.241 0.042 . 1 . . . . . 27 LEU N . 27159 1 262 . 1 1 28 28 TYR H H 1 8.773 0.004 . 1 . . . . . 28 TYR H . 27159 1 263 . 1 1 28 28 TYR HA H 1 5.088 0.006 . 1 . . . . . 28 TYR HA . 27159 1 264 . 1 1 28 28 TYR HB2 H 1 2.722 0.009 . 1 . . . . . 28 TYR HB2 . 27159 1 265 . 1 1 28 28 TYR HB3 H 1 3.338 0.006 . 1 . . . . . 28 TYR HB3 . 27159 1 266 . 1 1 28 28 TYR C C 13 176.603 0 . 1 . . . . . 28 TYR C . 27159 1 267 . 1 1 28 28 TYR CA C 13 53.545 0.133 . 1 . . . . . 28 TYR CA . 27159 1 268 . 1 1 28 28 TYR CB C 13 34.27 0.082 . 1 . . . . . 28 TYR CB . 27159 1 269 . 1 1 28 28 TYR N N 15 125.611 0.044 . 1 . . . . . 28 TYR N . 27159 1 270 . 1 1 29 29 ALA H H 1 8.146 0.002 . 1 . . . . . 29 ALA H . 27159 1 271 . 1 1 29 29 ALA HA H 1 3.845 0 . 1 . . . . . 29 ALA HA . 27159 1 272 . 1 1 29 29 ALA HB1 H 1 1.584 0.009 . 1 . . . . . 29 ALA MB . 27159 1 273 . 1 1 29 29 ALA HB2 H 1 1.584 0.009 . 1 . . . . . 29 ALA MB . 27159 1 274 . 1 1 29 29 ALA HB3 H 1 1.584 0.009 . 1 . . . . . 29 ALA MB . 27159 1 275 . 1 1 29 29 ALA C C 13 177.938 0 . 1 . . . . . 29 ALA C . 27159 1 276 . 1 1 29 29 ALA CA C 13 54.71 0.137 . 1 . . . . . 29 ALA CA . 27159 1 277 . 1 1 29 29 ALA CB C 13 19.298 0.147 . 1 . . . . . 29 ALA CB . 27159 1 278 . 1 1 29 29 ALA N N 15 124.296 0.052 . 1 . . . . . 29 ALA N . 27159 1 279 . 1 1 30 30 LYS H H 1 8.235 0.004 . 1 . . . . . 30 LYS H . 27159 1 280 . 1 1 30 30 LYS HA H 1 4.293 0.004 . 1 . . . . . 30 LYS HA . 27159 1 281 . 1 1 30 30 LYS HB2 H 1 1.861 0 . 1 . . . . . 30 LYS HB2 . 27159 1 282 . 1 1 30 30 LYS HB3 H 1 1.656 0 . 1 . . . . . 30 LYS HB3 . 27159 1 283 . 1 1 30 30 LYS HG2 H 1 1.441 0.003 . 1 . . . . . 30 LYS HG2 . 27159 1 284 . 1 1 30 30 LYS HG3 H 1 1.416 0 . 1 . . . . . 30 LYS HG3 . 27159 1 285 . 1 1 30 30 LYS HD2 H 1 1.696 0.019 . 1 . . . . . 30 LYS HD2 . 27159 1 286 . 1 1 30 30 LYS HD3 H 1 1.718 0 . 1 . . . . . 30 LYS HD3 . 27159 1 287 . 1 1 30 30 LYS HE2 H 1 3.036 0 . 1 . . . . . 30 LYS HE2 . 27159 1 288 . 1 1 30 30 LYS HE3 H 1 3.031 0.01 . 1 . . . . . 30 LYS HE3 . 27159 1 289 . 1 1 30 30 LYS C C 13 177.525 0.126 . 1 . . . . . 30 LYS C . 27159 1 290 . 1 1 30 30 LYS CA C 13 57.867 0.28 . 1 . . . . . 30 LYS CA . 27159 1 291 . 1 1 30 30 LYS CB C 13 32.675 0.027 . 1 . . . . . 30 LYS CB . 27159 1 292 . 1 1 30 30 LYS CG C 13 24.686 0.006 . 1 . . . . . 30 LYS CG . 27159 1 293 . 1 1 30 30 LYS CD C 13 29.109 0.067 . 1 . . . . . 30 LYS CD . 27159 1 294 . 1 1 30 30 LYS CE C 13 42.059 0.084 . 1 . . . . . 30 LYS CE . 27159 1 295 . 1 1 30 30 LYS N N 15 114.11 0.047 . 1 . . . . . 30 LYS N . 27159 1 296 . 1 1 31 31 ASP H H 1 7.625 0.003 . 1 . . . . . 31 ASP H . 27159 1 297 . 1 1 31 31 ASP HA H 1 4.79 0.018 . 1 . . . . . 31 ASP HA . 27159 1 298 . 1 1 31 31 ASP HB2 H 1 2.739 0.002 . 1 . . . . . 31 ASP HB2 . 27159 1 299 . 1 1 31 31 ASP HB3 H 1 2.697 0 . 1 . . . . . 31 ASP HB3 . 27159 1 300 . 1 1 31 31 ASP C C 13 176.031 0 . 1 . . . . . 31 ASP C . 27159 1 301 . 1 1 31 31 ASP CA C 13 56.68 0.116 . 1 . . . . . 31 ASP CA . 27159 1 302 . 1 1 31 31 ASP CB C 13 45.449 0.02 . 1 . . . . . 31 ASP CB . 27159 1 303 . 1 1 31 31 ASP N N 15 116.281 0.061 . 1 . . . . . 31 ASP N . 27159 1 304 . 1 1 32 32 VAL H H 1 8.118 0.004 . 1 . . . . . 32 VAL H . 27159 1 305 . 1 1 32 32 VAL HA H 1 4.514 0.024 . 1 . . . . . 32 VAL HA . 27159 1 306 . 1 1 32 32 VAL HB H 1 2.657 0.007 . 1 . . . . . 32 VAL HB . 27159 1 307 . 1 1 32 32 VAL HG11 H 1 1.22 0.007 . 1 . . . . . 32 VAL MG1 . 27159 1 308 . 1 1 32 32 VAL HG12 H 1 1.22 0.007 . 1 . . . . . 32 VAL MG1 . 27159 1 309 . 1 1 32 32 VAL HG13 H 1 1.22 0.007 . 1 . . . . . 32 VAL MG1 . 27159 1 310 . 1 1 32 32 VAL HG21 H 1 1.48 0.006 . 1 . . . . . 32 VAL MG2 . 27159 1 311 . 1 1 32 32 VAL HG22 H 1 1.48 0.006 . 1 . . . . . 32 VAL MG2 . 27159 1 312 . 1 1 32 32 VAL HG23 H 1 1.48 0.006 . 1 . . . . . 32 VAL MG2 . 27159 1 313 . 1 1 32 32 VAL CA C 13 58.802 0.109 . 1 . . . . . 32 VAL CA . 27159 1 314 . 1 1 32 32 VAL CB C 13 31.618 0.038 . 1 . . . . . 32 VAL CB . 27159 1 315 . 1 1 32 32 VAL CG1 C 13 24.584 0 . 1 . . . . . 32 VAL CG1 . 27159 1 316 . 1 1 32 32 VAL CG2 C 13 20.567 0 . 1 . . . . . 32 VAL CG2 . 27159 1 317 . 1 1 32 32 VAL N N 15 115.911 0.051 . 1 . . . . . 32 VAL N . 27159 1 318 . 1 1 33 33 PRO HA H 1 4.443 0.002 . 1 . . . . . 33 PRO HA . 27159 1 319 . 1 1 33 33 PRO HB2 H 1 2.506 0 . 1 . . . . . 33 PRO HB2 . 27159 1 320 . 1 1 33 33 PRO HG2 H 1 2.156 0 . 1 . . . . . 33 PRO HG2 . 27159 1 321 . 1 1 33 33 PRO HD2 H 1 3.631 0.012 . 1 . . . . . 33 PRO HD2 . 27159 1 322 . 1 1 33 33 PRO C C 13 181.479 0 . 1 . . . . . 33 PRO C . 27159 1 323 . 1 1 33 33 PRO CA C 13 66.539 0.138 . 1 . . . . . 33 PRO CA . 27159 1 324 . 1 1 33 33 PRO CB C 13 32.226 0 . 1 . . . . . 33 PRO CB . 27159 1 325 . 1 1 33 33 PRO CG C 13 27.71 0 . 1 . . . . . 33 PRO CG . 27159 1 326 . 1 1 33 33 PRO CD C 13 50.236 0 . 1 . . . . . 33 PRO CD . 27159 1 327 . 1 1 34 34 ARG H H 1 11.121 0.002 . 1 . . . . . 34 ARG H . 27159 1 328 . 1 1 34 34 ARG HA H 1 4.073 0.007 . 1 . . . . . 34 ARG HA . 27159 1 329 . 1 1 34 34 ARG HB2 H 1 1.665 0 . 1 . . . . . 34 ARG HB2 . 27159 1 330 . 1 1 34 34 ARG HB3 H 1 1.444 0 . 1 . . . . . 34 ARG HB3 . 27159 1 331 . 1 1 34 34 ARG HG2 H 1 1.479 0.003 . 1 . . . . . 34 ARG HG2 . 27159 1 332 . 1 1 34 34 ARG HG3 H 1 1.419 0 . 1 . . . . . 34 ARG HG3 . 27159 1 333 . 1 1 34 34 ARG HD2 H 1 3.029 0 . 1 . . . . . 34 ARG HD2 . 27159 1 334 . 1 1 34 34 ARG HD3 H 1 3.122 0.002 . 1 . . . . . 34 ARG HD3 . 27159 1 335 . 1 1 34 34 ARG C C 13 181.864 0 . 1 . . . . . 34 ARG C . 27159 1 336 . 1 1 34 34 ARG CA C 13 60.152 0.047 . 1 . . . . . 34 ARG CA . 27159 1 337 . 1 1 34 34 ARG CB C 13 29.395 0.082 . 1 . . . . . 34 ARG CB . 27159 1 338 . 1 1 34 34 ARG CG C 13 28.271 0.064 . 1 . . . . . 34 ARG CG . 27159 1 339 . 1 1 34 34 ARG CD C 13 43.285 0 . 1 . . . . . 34 ARG CD . 27159 1 340 . 1 1 34 34 ARG N N 15 123.065 0.068 . 1 . . . . . 34 ARG N . 27159 1 341 . 1 1 35 35 THR H H 1 10.341 0.005 . 1 . . . . . 35 THR H . 27159 1 342 . 1 1 35 35 THR HA H 1 4.063 0.008 . 1 . . . . . 35 THR HA . 27159 1 343 . 1 1 35 35 THR HB H 1 4.216 0.004 . 1 . . . . . 35 THR HB . 27159 1 344 . 1 1 35 35 THR HG21 H 1 0.91 0 . 1 . . . . . 35 THR MG . 27159 1 345 . 1 1 35 35 THR HG22 H 1 0.91 0 . 1 . . . . . 35 THR MG . 27159 1 346 . 1 1 35 35 THR HG23 H 1 0.91 0 . 1 . . . . . 35 THR MG . 27159 1 347 . 1 1 35 35 THR C C 13 177.7 0 . 1 . . . . . 35 THR C . 27159 1 348 . 1 1 35 35 THR CA C 13 67.072 0.136 . 1 . . . . . 35 THR CA . 27159 1 349 . 1 1 35 35 THR CB C 13 68.577 0.122 . 1 . . . . . 35 THR CB . 27159 1 350 . 1 1 35 35 THR CG2 C 13 22.787 0 . 1 . . . . . 35 THR CG2 . 27159 1 351 . 1 1 35 35 THR N N 15 123.883 0.04 . 1 . . . . . 35 THR N . 27159 1 352 . 1 1 36 36 ALA H H 1 9.115 0.003 . 1 . . . . . 36 ALA H . 27159 1 353 . 1 1 36 36 ALA HA H 1 4.126 0.003 . 1 . . . . . 36 ALA HA . 27159 1 354 . 1 1 36 36 ALA HB1 H 1 1.578 0 . 1 . . . . . 36 ALA MB . 27159 1 355 . 1 1 36 36 ALA HB2 H 1 1.578 0 . 1 . . . . . 36 ALA MB . 27159 1 356 . 1 1 36 36 ALA HB3 H 1 1.578 0 . 1 . . . . . 36 ALA MB . 27159 1 357 . 1 1 36 36 ALA C C 13 179.222 0 . 1 . . . . . 36 ALA C . 27159 1 358 . 1 1 36 36 ALA CA C 13 55.963 0.095 . 1 . . . . . 36 ALA CA . 27159 1 359 . 1 1 36 36 ALA CB C 13 18.725 0.056 . 1 . . . . . 36 ALA CB . 27159 1 360 . 1 1 36 36 ALA N N 15 125.632 0.037 . 1 . . . . . 36 ALA N . 27159 1 361 . 1 1 37 37 GLU H H 1 8.281 0.004 . 1 . . . . . 37 GLU H . 27159 1 362 . 1 1 37 37 GLU HA H 1 4.607 0.005 . 1 . . . . . 37 GLU HA . 27159 1 363 . 1 1 37 37 GLU HB2 H 1 2.059 0 . 1 . . . . . 37 GLU HB2 . 27159 1 364 . 1 1 37 37 GLU HB3 H 1 1.847 0 . 1 . . . . . 37 GLU HB3 . 27159 1 365 . 1 1 37 37 GLU HG2 H 1 2.063 0 . 1 . . . . . 37 GLU HG2 . 27159 1 366 . 1 1 37 37 GLU HG3 H 1 2.539 0 . 1 . . . . . 37 GLU HG3 . 27159 1 367 . 1 1 37 37 GLU C C 13 177.092 0 . 1 . . . . . 37 GLU C . 27159 1 368 . 1 1 37 37 GLU CA C 13 58.143 0.081 . 1 . . . . . 37 GLU CA . 27159 1 369 . 1 1 37 37 GLU CB C 13 28.323 0.141 . 1 . . . . . 37 GLU CB . 27159 1 370 . 1 1 37 37 GLU CG C 13 33.886 0.054 . 1 . . . . . 37 GLU CG . 27159 1 371 . 1 1 37 37 GLU N N 15 119.29 0.063 . 1 . . . . . 37 GLU N . 27159 1 372 . 1 1 38 38 ASN H H 1 7.31 0.004 . 1 . . . . . 38 ASN H . 27159 1 373 . 1 1 38 38 ASN HA H 1 4.038 0 . 1 . . . . . 38 ASN HA . 27159 1 374 . 1 1 38 38 ASN HB2 H 1 2.383 0.005 . 1 . . . . . 38 ASN HB2 . 27159 1 375 . 1 1 38 38 ASN HB3 H 1 2.891 0.003 . 1 . . . . . 38 ASN HB3 . 27159 1 376 . 1 1 38 38 ASN C C 13 174.516 0 . 1 . . . . . 38 ASN C . 27159 1 377 . 1 1 38 38 ASN CA C 13 56.817 0.075 . 1 . . . . . 38 ASN CA . 27159 1 378 . 1 1 38 38 ASN CB C 13 39.765 0.038 . 1 . . . . . 38 ASN CB . 27159 1 379 . 1 1 38 38 ASN N N 15 116.313 0.027 . 1 . . . . . 38 ASN N . 27159 1 380 . 1 1 39 39 PHE H H 1 7.152 0.003 . 1 . . . . . 39 PHE H . 27159 1 381 . 1 1 39 39 PHE HA H 1 4.14 0 . 1 . . . . . 39 PHE HA . 27159 1 382 . 1 1 39 39 PHE HB2 H 1 3.069 0.019 . 1 . . . . . 39 PHE HB2 . 27159 1 383 . 1 1 39 39 PHE HB3 H 1 2.998 0 . 1 . . . . . 39 PHE HB3 . 27159 1 384 . 1 1 39 39 PHE C C 13 177.766 0 . 1 . . . . . 39 PHE C . 27159 1 385 . 1 1 39 39 PHE CA C 13 62.12 0.067 . 1 . . . . . 39 PHE CA . 27159 1 386 . 1 1 39 39 PHE CB C 13 40.29 0.078 . 1 . . . . . 39 PHE CB . 27159 1 387 . 1 1 39 39 PHE N N 15 117.077 0.016 . 1 . . . . . 39 PHE N . 27159 1 388 . 1 1 40 40 ARG H H 1 8.485 0.003 . 1 . . . . . 40 ARG H . 27159 1 389 . 1 1 40 40 ARG HA H 1 3.703 0.02 . 1 . . . . . 40 ARG HA . 27159 1 390 . 1 1 40 40 ARG HB2 H 1 1.925 0.007 . 1 . . . . . 40 ARG HB2 . 27159 1 391 . 1 1 40 40 ARG HB3 H 1 1.937 0 . 1 . . . . . 40 ARG HB3 . 27159 1 392 . 1 1 40 40 ARG HG2 H 1 1.49 0 . 1 . . . . . 40 ARG HG2 . 27159 1 393 . 1 1 40 40 ARG HG3 H 1 1.277 0 . 1 . . . . . 40 ARG HG3 . 27159 1 394 . 1 1 40 40 ARG HD2 H 1 3.254 0.001 . 1 . . . . . 40 ARG HD2 . 27159 1 395 . 1 1 40 40 ARG HD3 H 1 3.258 0 . 1 . . . . . 40 ARG HD3 . 27159 1 396 . 1 1 40 40 ARG C C 13 178.545 0 . 1 . . . . . 40 ARG C . 27159 1 397 . 1 1 40 40 ARG CA C 13 60.572 0.226 . 1 . . . . . 40 ARG CA . 27159 1 398 . 1 1 40 40 ARG CB C 13 30.523 0.084 . 1 . . . . . 40 ARG CB . 27159 1 399 . 1 1 40 40 ARG CG C 13 27.109 0.047 . 1 . . . . . 40 ARG CG . 27159 1 400 . 1 1 40 40 ARG CD C 13 43.171 0.023 . 1 . . . . . 40 ARG CD . 27159 1 401 . 1 1 40 40 ARG N N 15 118.434 0.031 . 1 . . . . . 40 ARG N . 27159 1 402 . 1 1 41 41 ALA H H 1 8.607 0.005 . 1 . . . . . 41 ALA H . 27159 1 403 . 1 1 41 41 ALA HA H 1 3.849 0.017 . 1 . . . . . 41 ALA HA . 27159 1 404 . 1 1 41 41 ALA HB1 H 1 1.314 0.008 . 1 . . . . . 41 ALA MB . 27159 1 405 . 1 1 41 41 ALA HB2 H 1 1.314 0.008 . 1 . . . . . 41 ALA MB . 27159 1 406 . 1 1 41 41 ALA HB3 H 1 1.314 0.008 . 1 . . . . . 41 ALA MB . 27159 1 407 . 1 1 41 41 ALA C C 13 181.745 0 . 1 . . . . . 41 ALA C . 27159 1 408 . 1 1 41 41 ALA CA C 13 54.474 0.153 . 1 . . . . . 41 ALA CA . 27159 1 409 . 1 1 41 41 ALA CB C 13 18.416 0.055 . 1 . . . . . 41 ALA CB . 27159 1 410 . 1 1 41 41 ALA N N 15 118.693 0.072 . 1 . . . . . 41 ALA N . 27159 1 411 . 1 1 42 42 LEU H H 1 8.019 0.004 . 1 . . . . . 42 LEU H . 27159 1 412 . 1 1 42 42 LEU HA H 1 3.876 0.013 . 1 . . . . . 42 LEU HA . 27159 1 413 . 1 1 42 42 LEU HB2 H 1 1.482 0.006 . 1 . . . . . 42 LEU HB2 . 27159 1 414 . 1 1 42 42 LEU HB3 H 1 -0.33 0.013 . 1 . . . . . 42 LEU HB3 . 27159 1 415 . 1 1 42 42 LEU HG H 1 0.882 0.004 . 1 . . . . . 42 LEU HG . 27159 1 416 . 1 1 42 42 LEU HD11 H 1 0.345 0.002 . 1 . . . . . 42 LEU MD1 . 27159 1 417 . 1 1 42 42 LEU HD12 H 1 0.345 0.002 . 1 . . . . . 42 LEU MD1 . 27159 1 418 . 1 1 42 42 LEU HD13 H 1 0.345 0.002 . 1 . . . . . 42 LEU MD1 . 27159 1 419 . 1 1 42 42 LEU HD21 H 1 0.776 0.004 . 1 . . . . . 42 LEU MD2 . 27159 1 420 . 1 1 42 42 LEU HD22 H 1 0.776 0.004 . 1 . . . . . 42 LEU MD2 . 27159 1 421 . 1 1 42 42 LEU HD23 H 1 0.776 0.004 . 1 . . . . . 42 LEU MD2 . 27159 1 422 . 1 1 42 42 LEU C C 13 179.085 0 . 1 . . . . . 42 LEU C . 27159 1 423 . 1 1 42 42 LEU CA C 13 56.863 0.154 . 1 . . . . . 42 LEU CA . 27159 1 424 . 1 1 42 42 LEU CB C 13 40.992 0.124 . 1 . . . . . 42 LEU CB . 27159 1 425 . 1 1 42 42 LEU CG C 13 26.473 0.055 . 1 . . . . . 42 LEU CG . 27159 1 426 . 1 1 42 42 LEU CD1 C 13 23.356 0.073 . 1 . . . . . 42 LEU CD1 . 27159 1 427 . 1 1 42 42 LEU CD2 C 13 23.321 0.053 . 1 . . . . . 42 LEU CD2 . 27159 1 428 . 1 1 42 42 LEU N N 15 122.254 0.11 . 1 . . . . . 42 LEU N . 27159 1 429 . 1 1 43 43 CYS H H 1 7.866 0.003 . 1 . . . . . 43 CYS H . 27159 1 430 . 1 1 43 43 CYS HA H 1 4.723 0 . 1 . . . . . 43 CYS HA . 27159 1 431 . 1 1 43 43 CYS HB2 H 1 3.532 0.003 . 1 . . . . . 43 CYS HB2 . 27159 1 432 . 1 1 43 43 CYS HB3 H 1 2.298 0 . 1 . . . . . 43 CYS HB3 . 27159 1 433 . 1 1 43 43 CYS C C 13 176.982 0 . 1 . . . . . 43 CYS C . 27159 1 434 . 1 1 43 43 CYS CA C 13 63.833 0.031 . 1 . . . . . 43 CYS CA . 27159 1 435 . 1 1 43 43 CYS CB C 13 27.084 0.031 . 1 . . . . . 43 CYS CB . 27159 1 436 . 1 1 43 43 CYS N N 15 118.933 0.039 . 1 . . . . . 43 CYS N . 27159 1 437 . 1 1 44 44 THR H H 1 7.839 0.003 . 1 . . . . . 44 THR H . 27159 1 438 . 1 1 44 44 THR HA H 1 4.48 0.01 . 1 . . . . . 44 THR HA . 27159 1 439 . 1 1 44 44 THR HB H 1 4.497 0 . 1 . . . . . 44 THR HB . 27159 1 440 . 1 1 44 44 THR HG21 H 1 1.345 0.002 . 1 . . . . . 44 THR MG . 27159 1 441 . 1 1 44 44 THR HG22 H 1 1.345 0.002 . 1 . . . . . 44 THR MG . 27159 1 442 . 1 1 44 44 THR HG23 H 1 1.345 0.002 . 1 . . . . . 44 THR MG . 27159 1 443 . 1 1 44 44 THR C C 13 177.597 0 . 1 . . . . . 44 THR C . 27159 1 444 . 1 1 44 44 THR CA C 13 62.691 0.041 . 1 . . . . . 44 THR CA . 27159 1 445 . 1 1 44 44 THR CB C 13 69.529 0.116 . 1 . . . . . 44 THR CB . 27159 1 446 . 1 1 44 44 THR CG2 C 13 22.133 0.012 . 1 . . . . . 44 THR CG2 . 27159 1 447 . 1 1 44 44 THR N N 15 107.788 0.067 . 1 . . . . . 44 THR N . 27159 1 448 . 1 1 45 45 GLY H H 1 8.03 0.003 . 1 . . . . . 45 GLY H . 27159 1 449 . 1 1 45 45 GLY HA2 H 1 3.832 0.006 . 1 . . . . . 45 GLY HA2 . 27159 1 450 . 1 1 45 45 GLY HA3 H 1 2.653 0.001 . 1 . . . . . 45 GLY HA3 . 27159 1 451 . 1 1 45 45 GLY C C 13 177.426 0 . 1 . . . . . 45 GLY C . 27159 1 452 . 1 1 45 45 GLY CA C 13 45 0.128 . 1 . . . . . 45 GLY CA . 27159 1 453 . 1 1 45 45 GLY N N 15 110.773 0.059 . 1 . . . . . 45 GLY N . 27159 1 454 . 1 1 46 46 GLU H H 1 7.909 0.002 . 1 . . . . . 46 GLU H . 27159 1 455 . 1 1 46 46 GLU HA H 1 4.134 0.008 . 1 . . . . . 46 GLU HA . 27159 1 456 . 1 1 46 46 GLU HB2 H 1 1.832 0 . 1 . . . . . 46 GLU HB2 . 27159 1 457 . 1 1 46 46 GLU HG2 H 1 2.047 0 . 1 . . . . . 46 GLU HG2 . 27159 1 458 . 1 1 46 46 GLU HG3 H 1 1.814 0.003 . 1 . . . . . 46 GLU HG3 . 27159 1 459 . 1 1 46 46 GLU C C 13 176.38 0 . 1 . . . . . 46 GLU C . 27159 1 460 . 1 1 46 46 GLU CA C 13 58.027 0.072 . 1 . . . . . 46 GLU CA . 27159 1 461 . 1 1 46 46 GLU CB C 13 30.472 0 . 1 . . . . . 46 GLU CB . 27159 1 462 . 1 1 46 46 GLU CG C 13 35.433 0.169 . 1 . . . . . 46 GLU CG . 27159 1 463 . 1 1 46 46 GLU N N 15 116.823 0.055 . 1 . . . . . 46 GLU N . 27159 1 464 . 1 1 47 47 LYS H H 1 9.303 0.004 . 1 . . . . . 47 LYS H . 27159 1 465 . 1 1 47 47 LYS HA H 1 4.297 0.005 . 1 . . . . . 47 LYS HA . 27159 1 466 . 1 1 47 47 LYS HB2 H 1 1.896 0 . 1 . . . . . 47 LYS HB2 . 27159 1 467 . 1 1 47 47 LYS HB3 H 1 1.875 0.006 . 1 . . . . . 47 LYS HB3 . 27159 1 468 . 1 1 47 47 LYS HG2 H 1 1.216 0 . 1 . . . . . 47 LYS HG2 . 27159 1 469 . 1 1 47 47 LYS HG3 H 1 1.585 0.004 . 1 . . . . . 47 LYS HG3 . 27159 1 470 . 1 1 47 47 LYS HD2 H 1 1.636 0.004 . 1 . . . . . 47 LYS HD2 . 27159 1 471 . 1 1 47 47 LYS HD3 H 1 1.563 0 . 1 . . . . . 47 LYS HD3 . 27159 1 472 . 1 1 47 47 LYS HE2 H 1 3.023 0.001 . 1 . . . . . 47 LYS HE2 . 27159 1 473 . 1 1 47 47 LYS HE3 H 1 3.085 0 . 1 . . . . . 47 LYS HE3 . 27159 1 474 . 1 1 47 47 LYS C C 13 176.933 0 . 1 . . . . . 47 LYS C . 27159 1 475 . 1 1 47 47 LYS CA C 13 54.561 0.158 . 1 . . . . . 47 LYS CA . 27159 1 476 . 1 1 47 47 LYS CB C 13 30.611 0.088 . 1 . . . . . 47 LYS CB . 27159 1 477 . 1 1 47 47 LYS CG C 13 25.395 0.276 . 1 . . . . . 47 LYS CG . 27159 1 478 . 1 1 47 47 LYS CD C 13 27.226 0.125 . 1 . . . . . 47 LYS CD . 27159 1 479 . 1 1 47 47 LYS CE C 13 42.178 0 . 1 . . . . . 47 LYS CE . 27159 1 480 . 1 1 47 47 LYS N N 15 119.464 0.061 . 1 . . . . . 47 LYS N . 27159 1 481 . 1 1 48 48 GLY H H 1 7.355 0.004 . 1 . . . . . 48 GLY H . 27159 1 482 . 1 1 48 48 GLY HA2 H 1 4.123 0.003 . 1 . . . . . 48 GLY HA2 . 27159 1 483 . 1 1 48 48 GLY HA3 H 1 3.638 0 . 1 . . . . . 48 GLY HA3 . 27159 1 484 . 1 1 48 48 GLY C C 13 173.193 0 . 1 . . . . . 48 GLY C . 27159 1 485 . 1 1 48 48 GLY CA C 13 45.684 0.072 . 1 . . . . . 48 GLY CA . 27159 1 486 . 1 1 48 48 GLY N N 15 106.026 0.052 . 1 . . . . . 48 GLY N . 27159 1 487 . 1 1 49 49 VAL H H 1 8.542 0.001 . 1 . . . . . 49 VAL H . 27159 1 488 . 1 1 49 49 VAL HA H 1 3.99 0.006 . 1 . . . . . 49 VAL HA . 27159 1 489 . 1 1 49 49 VAL HB H 1 1.82 0.001 . 1 . . . . . 49 VAL HB . 27159 1 490 . 1 1 49 49 VAL HG11 H 1 0.842 0.001 . 1 . . . . . 49 VAL MG1 . 27159 1 491 . 1 1 49 49 VAL HG12 H 1 0.842 0.001 . 1 . . . . . 49 VAL MG1 . 27159 1 492 . 1 1 49 49 VAL HG13 H 1 0.842 0.001 . 1 . . . . . 49 VAL MG1 . 27159 1 493 . 1 1 49 49 VAL C C 13 176.427 0.133 . 1 . . . . . 49 VAL C . 27159 1 494 . 1 1 49 49 VAL CA C 13 62.545 0.048 . 1 . . . . . 49 VAL CA . 27159 1 495 . 1 1 49 49 VAL CB C 13 33.114 0.053 . 1 . . . . . 49 VAL CB . 27159 1 496 . 1 1 49 49 VAL CG1 C 13 21.126 0 . 1 . . . . . 49 VAL CG1 . 27159 1 497 . 1 1 49 49 VAL N N 15 124.085 0.031 . 1 . . . . . 49 VAL N . 27159 1 498 . 1 1 50 50 GLY H H 1 8.203 0.003 . 1 . . . . . 50 GLY H . 27159 1 499 . 1 1 50 50 GLY HA2 H 1 4.432 0 . 1 . . . . . 50 GLY HA2 . 27159 1 500 . 1 1 50 50 GLY HA3 H 1 3.945 0 . 1 . . . . . 50 GLY HA3 . 27159 1 501 . 1 1 50 50 GLY C C 13 176.188 0 . 1 . . . . . 50 GLY C . 27159 1 502 . 1 1 50 50 GLY CA C 13 44.348 0.025 . 1 . . . . . 50 GLY CA . 27159 1 503 . 1 1 50 50 GLY N N 15 112.838 0.044 . 1 . . . . . 50 GLY N . 27159 1 504 . 1 1 51 51 LYS H H 1 10.625 0.004 . 1 . . . . . 51 LYS H . 27159 1 505 . 1 1 51 51 LYS HA H 1 4.084 0.005 . 1 . . . . . 51 LYS HA . 27159 1 506 . 1 1 51 51 LYS HB2 H 1 1.918 0 . 1 . . . . . 51 LYS HB2 . 27159 1 507 . 1 1 51 51 LYS HB3 H 1 1.906 0 . 1 . . . . . 51 LYS HB3 . 27159 1 508 . 1 1 51 51 LYS HG2 H 1 1.594 0 . 1 . . . . . 51 LYS HG2 . 27159 1 509 . 1 1 51 51 LYS HG3 H 1 1.6 0 . 1 . . . . . 51 LYS HG3 . 27159 1 510 . 1 1 51 51 LYS HD2 H 1 1.748 0 . 1 . . . . . 51 LYS HD2 . 27159 1 511 . 1 1 51 51 LYS HD3 H 1 1.716 0 . 1 . . . . . 51 LYS HD3 . 27159 1 512 . 1 1 51 51 LYS HE2 H 1 3.075 0 . 1 . . . . . 51 LYS HE2 . 27159 1 513 . 1 1 51 51 LYS HE3 H 1 3.076 0 . 1 . . . . . 51 LYS HE3 . 27159 1 514 . 1 1 51 51 LYS C C 13 179.56 0 . 1 . . . . . 51 LYS C . 27159 1 515 . 1 1 51 51 LYS CA C 13 58.886 0.07 . 1 . . . . . 51 LYS CA . 27159 1 516 . 1 1 51 51 LYS CB C 13 31.945 0.021 . 1 . . . . . 51 LYS CB . 27159 1 517 . 1 1 51 51 LYS CG C 13 25.215 0.059 . 1 . . . . . 51 LYS CG . 27159 1 518 . 1 1 51 51 LYS CD C 13 28.842 0.047 . 1 . . . . . 51 LYS CD . 27159 1 519 . 1 1 51 51 LYS CE C 13 42.559 0 . 1 . . . . . 51 LYS CE . 27159 1 520 . 1 1 51 51 LYS N N 15 125.733 0.024 . 1 . . . . . 51 LYS N . 27159 1 521 . 1 1 52 52 SER H H 1 9.304 0.003 . 1 . . . . . 52 SER H . 27159 1 522 . 1 1 52 52 SER HA H 1 4.298 0.005 . 1 . . . . . 52 SER HA . 27159 1 523 . 1 1 52 52 SER HB2 H 1 4.045 0.004 . 1 . . . . . 52 SER HB2 . 27159 1 524 . 1 1 52 52 SER HB3 H 1 4.143 0 . 1 . . . . . 52 SER HB3 . 27159 1 525 . 1 1 52 52 SER C C 13 175.699 0 . 1 . . . . . 52 SER C . 27159 1 526 . 1 1 52 52 SER CA C 13 59.539 0.107 . 1 . . . . . 52 SER CA . 27159 1 527 . 1 1 52 52 SER CB C 13 64.049 0.067 . 1 . . . . . 52 SER CB . 27159 1 528 . 1 1 52 52 SER N N 15 113.731 0.062 . 1 . . . . . 52 SER N . 27159 1 529 . 1 1 53 53 GLY H H 1 7.917 0.004 . 1 . . . . . 53 GLY H . 27159 1 530 . 1 1 53 53 GLY HA2 H 1 4.333 0 . 1 . . . . . 53 GLY HA2 . 27159 1 531 . 1 1 53 53 GLY HA3 H 1 3.538 0 . 1 . . . . . 53 GLY HA3 . 27159 1 532 . 1 1 53 53 GLY C C 13 173.346 0 . 1 . . . . . 53 GLY C . 27159 1 533 . 1 1 53 53 GLY CA C 13 45.266 0.095 . 1 . . . . . 53 GLY CA . 27159 1 534 . 1 1 53 53 GLY N N 15 108.824 0.048 . 1 . . . . . 53 GLY N . 27159 1 535 . 1 1 54 54 LYS H H 1 7.736 0.004 . 1 . . . . . 54 LYS H . 27159 1 536 . 1 1 54 54 LYS HA H 1 4.938 0.006 . 1 . . . . . 54 LYS HA . 27159 1 537 . 1 1 54 54 LYS HB2 H 1 2.017 0 . 1 . . . . . 54 LYS HB2 . 27159 1 538 . 1 1 54 54 LYS HB3 H 1 1.812 0 . 1 . . . . . 54 LYS HB3 . 27159 1 539 . 1 1 54 54 LYS HG2 H 1 1.558 0 . 1 . . . . . 54 LYS HG2 . 27159 1 540 . 1 1 54 54 LYS HG3 H 1 1.767 0 . 1 . . . . . 54 LYS HG3 . 27159 1 541 . 1 1 54 54 LYS HD2 H 1 2.206 0 . 1 . . . . . 54 LYS HD2 . 27159 1 542 . 1 1 54 54 LYS HD3 H 1 1.829 0 . 1 . . . . . 54 LYS HD3 . 27159 1 543 . 1 1 54 54 LYS HE2 H 1 3.023 0 . 1 . . . . . 54 LYS HE2 . 27159 1 544 . 1 1 54 54 LYS HE3 H 1 2.856 0 . 1 . . . . . 54 LYS HE3 . 27159 1 545 . 1 1 54 54 LYS CA C 13 52.243 0.234 . 1 . . . . . 54 LYS CA . 27159 1 546 . 1 1 54 54 LYS CB C 13 32.303 0.058 . 1 . . . . . 54 LYS CB . 27159 1 547 . 1 1 54 54 LYS CG C 13 25.048 0 . 1 . . . . . 54 LYS CG . 27159 1 548 . 1 1 54 54 LYS CD C 13 28.028 0.351 . 1 . . . . . 54 LYS CD . 27159 1 549 . 1 1 54 54 LYS CE C 13 43.803 0.035 . 1 . . . . . 54 LYS CE . 27159 1 550 . 1 1 54 54 LYS N N 15 119.449 0.039 . 1 . . . . . 54 LYS N . 27159 1 551 . 1 1 55 55 PRO HA H 1 4.186 0 . 1 . . . . . 55 PRO HA . 27159 1 552 . 1 1 55 55 PRO HB2 H 1 2.341 0 . 1 . . . . . 55 PRO HB2 . 27159 1 553 . 1 1 55 55 PRO HG2 H 1 1.93 0 . 1 . . . . . 55 PRO HG2 . 27159 1 554 . 1 1 55 55 PRO C C 13 176.369 0 . 1 . . . . . 55 PRO C . 27159 1 555 . 1 1 55 55 PRO CA C 13 63.56 0.03 . 1 . . . . . 55 PRO CA . 27159 1 556 . 1 1 55 55 PRO CB C 13 32.403 0.017 . 1 . . . . . 55 PRO CB . 27159 1 557 . 1 1 55 55 PRO CG C 13 28.096 0 . 1 . . . . . 55 PRO CG . 27159 1 558 . 1 1 55 55 PRO CD C 13 50.737 0 . 1 . . . . . 55 PRO CD . 27159 1 559 . 1 1 56 56 LEU H H 1 8.504 0.002 . 1 . . . . . 56 LEU H . 27159 1 560 . 1 1 56 56 LEU HA H 1 3.737 0.005 . 1 . . . . . 56 LEU HA . 27159 1 561 . 1 1 56 56 LEU HB2 H 1 1.406 0 . 1 . . . . . 56 LEU HB2 . 27159 1 562 . 1 1 56 56 LEU HB3 H 1 0.92 0 . 1 . . . . . 56 LEU HB3 . 27159 1 563 . 1 1 56 56 LEU HG H 1 0.575 0 . 1 . . . . . 56 LEU HG . 27159 1 564 . 1 1 56 56 LEU HD11 H 1 0.781 0 . 1 . . . . . 56 LEU MD1 . 27159 1 565 . 1 1 56 56 LEU HD12 H 1 0.781 0 . 1 . . . . . 56 LEU MD1 . 27159 1 566 . 1 1 56 56 LEU HD13 H 1 0.781 0 . 1 . . . . . 56 LEU MD1 . 27159 1 567 . 1 1 56 56 LEU C C 13 174.326 0 . 1 . . . . . 56 LEU C . 27159 1 568 . 1 1 56 56 LEU CA C 13 52.75 0.158 . 1 . . . . . 56 LEU CA . 27159 1 569 . 1 1 56 56 LEU CB C 13 39.192 0.104 . 1 . . . . . 56 LEU CB . 27159 1 570 . 1 1 56 56 LEU CG C 13 26.572 0.112 . 1 . . . . . 56 LEU CG . 27159 1 571 . 1 1 56 56 LEU CD1 C 13 23.693 0.031 . 1 . . . . . 56 LEU CD1 . 27159 1 572 . 1 1 56 56 LEU N N 15 124.797 0.055 . 1 . . . . . 56 LEU N . 27159 1 573 . 1 1 57 57 HIS H H 1 6.661 0.001 . 1 . . . . . 57 HIS H . 27159 1 574 . 1 1 57 57 HIS HA H 1 5.22 0.007 . 1 . . . . . 57 HIS HA . 27159 1 575 . 1 1 57 57 HIS HB2 H 1 2.896 0 . 1 . . . . . 57 HIS HB2 . 27159 1 576 . 1 1 57 57 HIS HB3 H 1 2.559 0 . 1 . . . . . 57 HIS HB3 . 27159 1 577 . 1 1 57 57 HIS C C 13 175.602 0 . 1 . . . . . 57 HIS C . 27159 1 578 . 1 1 57 57 HIS CA C 13 51.711 0.156 . 1 . . . . . 57 HIS CA . 27159 1 579 . 1 1 57 57 HIS CB C 13 36.299 0.002 . 1 . . . . . 57 HIS CB . 27159 1 580 . 1 1 57 57 HIS N N 15 122.97 0.052 . 1 . . . . . 57 HIS N . 27159 1 581 . 1 1 58 58 TYR H H 1 8.538 0.003 . 1 . . . . . 58 TYR H . 27159 1 582 . 1 1 58 58 TYR HB2 H 1 2.986 0 . 1 . . . . . 58 TYR HB2 . 27159 1 583 . 1 1 58 58 TYR HB3 H 1 2.886 0 . 1 . . . . . 58 TYR HB3 . 27159 1 584 . 1 1 58 58 TYR C C 13 176.763 0 . 1 . . . . . 58 TYR C . 27159 1 585 . 1 1 58 58 TYR CA C 13 57.303 0.114 . 1 . . . . . 58 TYR CA . 27159 1 586 . 1 1 58 58 TYR CB C 13 38.346 0.063 . 1 . . . . . 58 TYR CB . 27159 1 587 . 1 1 58 58 TYR N N 15 121.512 0.079 . 1 . . . . . 58 TYR N . 27159 1 588 . 1 1 59 59 LYS H H 1 5.884 0.002 . 1 . . . . . 59 LYS H . 27159 1 589 . 1 1 59 59 LYS HA H 1 3.317 0.006 . 1 . . . . . 59 LYS HA . 27159 1 590 . 1 1 59 59 LYS HB2 H 1 0.683 0 . 1 . . . . . 59 LYS HB2 . 27159 1 591 . 1 1 59 59 LYS HB3 H 1 0.71 0.005 . 1 . . . . . 59 LYS HB3 . 27159 1 592 . 1 1 59 59 LYS HG2 H 1 1.536 0 . 1 . . . . . 59 LYS HG2 . 27159 1 593 . 1 1 59 59 LYS HG3 H 1 1.159 0.012 . 1 . . . . . 59 LYS HG3 . 27159 1 594 . 1 1 59 59 LYS HD2 H 1 1.704 0 . 1 . . . . . 59 LYS HD2 . 27159 1 595 . 1 1 59 59 LYS HE2 H 1 3.009 0 . 1 . . . . . 59 LYS HE2 . 27159 1 596 . 1 1 59 59 LYS HE3 H 1 3.058 0 . 1 . . . . . 59 LYS HE3 . 27159 1 597 . 1 1 59 59 LYS C C 13 175.889 0 . 1 . . . . . 59 LYS C . 27159 1 598 . 1 1 59 59 LYS CA C 13 58.985 0.064 . 1 . . . . . 59 LYS CA . 27159 1 599 . 1 1 59 59 LYS CB C 13 31.992 0.084 . 1 . . . . . 59 LYS CB . 27159 1 600 . 1 1 59 59 LYS CG C 13 25.048 0.047 . 1 . . . . . 59 LYS CG . 27159 1 601 . 1 1 59 59 LYS CD C 13 30.484 0 . 1 . . . . . 59 LYS CD . 27159 1 602 . 1 1 59 59 LYS CE C 13 42.491 0 . 1 . . . . . 59 LYS CE . 27159 1 603 . 1 1 59 59 LYS N N 15 123.744 0.04 . 1 . . . . . 59 LYS N . 27159 1 604 . 1 1 60 60 GLY H H 1 9.615 0.007 . 1 . . . . . 60 GLY H . 27159 1 605 . 1 1 60 60 GLY HA2 H 1 4.314 0.015 . 1 . . . . . 60 GLY HA2 . 27159 1 606 . 1 1 60 60 GLY HA3 H 1 3.518 0 . 1 . . . . . 60 GLY HA3 . 27159 1 607 . 1 1 60 60 GLY C C 13 173.719 0 . 1 . . . . . 60 GLY C . 27159 1 608 . 1 1 60 60 GLY CA C 13 45.234 0.153 . 1 . . . . . 60 GLY CA . 27159 1 609 . 1 1 60 60 GLY N N 15 118.01 0.07 . 1 . . . . . 60 GLY N . 27159 1 610 . 1 1 61 61 SER H H 1 8.191 0.002 . 1 . . . . . 61 SER H . 27159 1 611 . 1 1 61 61 SER HA H 1 4.772 0.003 . 1 . . . . . 61 SER HA . 27159 1 612 . 1 1 61 61 SER HB2 H 1 4.25 0.017 . 1 . . . . . 61 SER HB2 . 27159 1 613 . 1 1 61 61 SER HB3 H 1 4.219 0.007 . 1 . . . . . 61 SER HB3 . 27159 1 614 . 1 1 61 61 SER C C 13 172.279 0 . 1 . . . . . 61 SER C . 27159 1 615 . 1 1 61 61 SER CA C 13 58.439 0.1 . 1 . . . . . 61 SER CA . 27159 1 616 . 1 1 61 61 SER CB C 13 65.187 0.058 . 1 . . . . . 61 SER CB . 27159 1 617 . 1 1 61 61 SER N N 15 115.518 0.07 . 1 . . . . . 61 SER N . 27159 1 618 . 1 1 62 62 THR H H 1 8.768 0.004 . 1 . . . . . 62 THR H . 27159 1 619 . 1 1 62 62 THR HA H 1 5.65 0.007 . 1 . . . . . 62 THR HA . 27159 1 620 . 1 1 62 62 THR HB H 1 4.313 0.009 . 1 . . . . . 62 THR HB . 27159 1 621 . 1 1 62 62 THR HG21 H 1 1.232 0.006 . 1 . . . . . 62 THR MG . 27159 1 622 . 1 1 62 62 THR HG22 H 1 1.232 0.006 . 1 . . . . . 62 THR MG . 27159 1 623 . 1 1 62 62 THR HG23 H 1 1.232 0.006 . 1 . . . . . 62 THR MG . 27159 1 624 . 1 1 62 62 THR C C 13 178.631 0 . 1 . . . . . 62 THR C . 27159 1 625 . 1 1 62 62 THR CA C 13 60.429 0.108 . 1 . . . . . 62 THR CA . 27159 1 626 . 1 1 62 62 THR CB C 13 72.809 0.27 . 1 . . . . . 62 THR CB . 27159 1 627 . 1 1 62 62 THR CG2 C 13 21.446 0 . 1 . . . . . 62 THR CG2 . 27159 1 628 . 1 1 62 62 THR N N 15 106.797 0.095 . 1 . . . . . 62 THR N . 27159 1 629 . 1 1 63 63 PHE H H 1 8.321 0.003 . 1 . . . . . 63 PHE H . 27159 1 630 . 1 1 63 63 PHE HA H 1 5.273 0 . 1 . . . . . 63 PHE HA . 27159 1 631 . 1 1 63 63 PHE HB2 H 1 2.928 0 . 1 . . . . . 63 PHE HB2 . 27159 1 632 . 1 1 63 63 PHE HB3 H 1 2.677 0 . 1 . . . . . 63 PHE HB3 . 27159 1 633 . 1 1 63 63 PHE C C 13 174.605 0 . 1 . . . . . 63 PHE C . 27159 1 634 . 1 1 63 63 PHE CA C 13 56.253 0.107 . 1 . . . . . 63 PHE CA . 27159 1 635 . 1 1 63 63 PHE CB C 13 36.789 0.029 . 1 . . . . . 63 PHE CB . 27159 1 636 . 1 1 63 63 PHE N N 15 122.203 0.061 . 1 . . . . . 63 PHE N . 27159 1 637 . 1 1 64 64 HIS H H 1 7.604 0.003 . 1 . . . . . 64 HIS H . 27159 1 638 . 1 1 64 64 HIS HA H 1 4.683 0.006 . 1 . . . . . 64 HIS HA . 27159 1 639 . 1 1 64 64 HIS HB2 H 1 3.244 0 . 1 . . . . . 64 HIS HB2 . 27159 1 640 . 1 1 64 64 HIS HB3 H 1 2.791 0 . 1 . . . . . 64 HIS HB3 . 27159 1 641 . 1 1 64 64 HIS C C 13 175.325 0 . 1 . . . . . 64 HIS C . 27159 1 642 . 1 1 64 64 HIS CA C 13 57.191 0.145 . 1 . . . . . 64 HIS CA . 27159 1 643 . 1 1 64 64 HIS CB C 13 31.507 0.088 . 1 . . . . . 64 HIS CB . 27159 1 644 . 1 1 64 64 HIS N N 15 120.375 0.059 . 1 . . . . . 64 HIS N . 27159 1 645 . 1 1 65 65 ARG H H 1 7.025 0.005 . 1 . . . . . 65 ARG H . 27159 1 646 . 1 1 65 65 ARG HA H 1 5 0.014 . 1 . . . . . 65 ARG HA . 27159 1 647 . 1 1 65 65 ARG HB2 H 1 1.268 0.01 . 1 . . . . . 65 ARG HB2 . 27159 1 648 . 1 1 65 65 ARG HG2 H 1 1.534 0.001 . 1 . . . . . 65 ARG HG2 . 27159 1 649 . 1 1 65 65 ARG HG3 H 1 1.265 0 . 1 . . . . . 65 ARG HG3 . 27159 1 650 . 1 1 65 65 ARG HD2 H 1 3.136 0 . 1 . . . . . 65 ARG HD2 . 27159 1 651 . 1 1 65 65 ARG HD3 H 1 3.124 0 . 1 . . . . . 65 ARG HD3 . 27159 1 652 . 1 1 65 65 ARG C C 13 173.501 0 . 1 . . . . . 65 ARG C . 27159 1 653 . 1 1 65 65 ARG CA C 13 54.964 0.124 . 1 . . . . . 65 ARG CA . 27159 1 654 . 1 1 65 65 ARG CB C 13 33.52 0.135 . 1 . . . . . 65 ARG CB . 27159 1 655 . 1 1 65 65 ARG CG C 13 28.009 0.226 . 1 . . . . . 65 ARG CG . 27159 1 656 . 1 1 65 65 ARG CD C 13 43.508 0.102 . 1 . . . . . 65 ARG CD . 27159 1 657 . 1 1 65 65 ARG N N 15 122.68 0.028 . 1 . . . . . 65 ARG N . 27159 1 658 . 1 1 66 66 VAL H H 1 9.484 0.002 . 1 . . . . . 66 VAL H . 27159 1 659 . 1 1 66 66 VAL HA H 1 4.446 0 . 1 . . . . . 66 VAL HA . 27159 1 660 . 1 1 66 66 VAL HB H 1 1.857 0.01 . 1 . . . . . 66 VAL HB . 27159 1 661 . 1 1 66 66 VAL HG11 H 1 1.054 0 . 1 . . . . . 66 VAL MG1 . 27159 1 662 . 1 1 66 66 VAL HG12 H 1 1.054 0 . 1 . . . . . 66 VAL MG1 . 27159 1 663 . 1 1 66 66 VAL HG13 H 1 1.054 0 . 1 . . . . . 66 VAL MG1 . 27159 1 664 . 1 1 66 66 VAL HG21 H 1 0.843 0.001 . 1 . . . . . 66 VAL MG2 . 27159 1 665 . 1 1 66 66 VAL HG22 H 1 0.843 0.001 . 1 . . . . . 66 VAL MG2 . 27159 1 666 . 1 1 66 66 VAL HG23 H 1 0.843 0.001 . 1 . . . . . 66 VAL MG2 . 27159 1 667 . 1 1 66 66 VAL C C 13 173.145 0 . 1 . . . . . 66 VAL C . 27159 1 668 . 1 1 66 66 VAL CA C 13 62.263 0.01 . 1 . . . . . 66 VAL CA . 27159 1 669 . 1 1 66 66 VAL CB C 13 35.35 0.056 . 1 . . . . . 66 VAL CB . 27159 1 670 . 1 1 66 66 VAL CG1 C 13 21.938 0 . 1 . . . . . 66 VAL CG1 . 27159 1 671 . 1 1 66 66 VAL CG2 C 13 21.483 0 . 1 . . . . . 66 VAL CG2 . 27159 1 672 . 1 1 66 66 VAL N N 15 127.779 0.052 . 1 . . . . . 66 VAL N . 27159 1 673 . 1 1 67 67 ILE H H 1 8.728 0.005 . 1 . . . . . 67 ILE H . 27159 1 674 . 1 1 67 67 ILE HA H 1 5.214 0.009 . 1 . . . . . 67 ILE HA . 27159 1 675 . 1 1 67 67 ILE HB H 1 1.936 0 . 1 . . . . . 67 ILE HB . 27159 1 676 . 1 1 67 67 ILE HG12 H 1 1.481 0 . 1 . . . . . 67 ILE HG12 . 27159 1 677 . 1 1 67 67 ILE HG13 H 1 1.247 0 . 1 . . . . . 67 ILE HG13 . 27159 1 678 . 1 1 67 67 ILE HG21 H 1 1.208 0 . 1 . . . . . 67 ILE MG . 27159 1 679 . 1 1 67 67 ILE HG22 H 1 1.208 0 . 1 . . . . . 67 ILE MG . 27159 1 680 . 1 1 67 67 ILE HG23 H 1 1.208 0 . 1 . . . . . 67 ILE MG . 27159 1 681 . 1 1 67 67 ILE HD11 H 1 0.976 0 . 1 . . . . . 67 ILE MD . 27159 1 682 . 1 1 67 67 ILE HD12 H 1 0.976 0 . 1 . . . . . 67 ILE MD . 27159 1 683 . 1 1 67 67 ILE HD13 H 1 0.976 0 . 1 . . . . . 67 ILE MD . 27159 1 684 . 1 1 67 67 ILE CA C 13 57.406 0.149 . 1 . . . . . 67 ILE CA . 27159 1 685 . 1 1 67 67 ILE CB C 13 40.657 0.018 . 1 . . . . . 67 ILE CB . 27159 1 686 . 1 1 67 67 ILE CG1 C 13 27.23 0.139 . 1 . . . . . 67 ILE CG1 . 27159 1 687 . 1 1 67 67 ILE CG2 C 13 17.779 0 . 1 . . . . . 67 ILE CG2 . 27159 1 688 . 1 1 67 67 ILE CD1 C 13 14.454 0 . 1 . . . . . 67 ILE CD1 . 27159 1 689 . 1 1 67 67 ILE N N 15 127.633 0.053 . 1 . . . . . 67 ILE N . 27159 1 690 . 1 1 68 68 PRO HA H 1 4.263 0.004 . 1 . . . . . 68 PRO HA . 27159 1 691 . 1 1 68 68 PRO HB2 H 1 2.339 0 . 1 . . . . . 68 PRO HB2 . 27159 1 692 . 1 1 68 68 PRO HB3 H 1 2.031 0 . 1 . . . . . 68 PRO HB3 . 27159 1 693 . 1 1 68 68 PRO HG2 H 1 1.91 0 . 1 . . . . . 68 PRO HG2 . 27159 1 694 . 1 1 68 68 PRO HG3 H 1 2.003 0 . 1 . . . . . 68 PRO HG3 . 27159 1 695 . 1 1 68 68 PRO HD2 H 1 3.427 0.005 . 1 . . . . . 68 PRO HD2 . 27159 1 696 . 1 1 68 68 PRO HD3 H 1 3.974 0.004 . 1 . . . . . 68 PRO HD3 . 27159 1 697 . 1 1 68 68 PRO C C 13 176.137 0 . 1 . . . . . 68 PRO C . 27159 1 698 . 1 1 68 68 PRO CA C 13 62.957 0.014 . 1 . . . . . 68 PRO CA . 27159 1 699 . 1 1 68 68 PRO CB C 13 32.448 0.009 . 1 . . . . . 68 PRO CB . 27159 1 700 . 1 1 68 68 PRO CG C 13 27.399 0.013 . 1 . . . . . 68 PRO CG . 27159 1 701 . 1 1 68 68 PRO CD C 13 51.969 0.081 . 1 . . . . . 68 PRO CD . 27159 1 702 . 1 1 69 69 GLU H H 1 9.269 0.005 . 1 . . . . . 69 GLU H . 27159 1 703 . 1 1 69 69 GLU HA H 1 3.756 0.026 . 1 . . . . . 69 GLU HA . 27159 1 704 . 1 1 69 69 GLU HB2 H 1 2.244 0.001 . 1 . . . . . 69 GLU HB2 . 27159 1 705 . 1 1 69 69 GLU HG2 H 1 2.162 0 . 1 . . . . . 69 GLU HG2 . 27159 1 706 . 1 1 69 69 GLU C C 13 173.885 0 . 1 . . . . . 69 GLU C . 27159 1 707 . 1 1 69 69 GLU CA C 13 57.344 0.166 . 1 . . . . . 69 GLU CA . 27159 1 708 . 1 1 69 69 GLU CB C 13 26.823 0.005 . 1 . . . . . 69 GLU CB . 27159 1 709 . 1 1 69 69 GLU CG C 13 36.976 0 . 1 . . . . . 69 GLU CG . 27159 1 710 . 1 1 69 69 GLU N N 15 116.443 0.029 . 1 . . . . . 69 GLU N . 27159 1 711 . 1 1 70 70 PHE H H 1 7.618 0.002 . 1 . . . . . 70 PHE H . 27159 1 712 . 1 1 70 70 PHE HA H 1 5.087 0 . 1 . . . . . 70 PHE HA . 27159 1 713 . 1 1 70 70 PHE HB2 H 1 3.279 0 . 1 . . . . . 70 PHE HB2 . 27159 1 714 . 1 1 70 70 PHE HB3 H 1 2.954 0 . 1 . . . . . 70 PHE HB3 . 27159 1 715 . 1 1 70 70 PHE C C 13 173.172 0 . 1 . . . . . 70 PHE C . 27159 1 716 . 1 1 70 70 PHE CA C 13 57.829 0.104 . 1 . . . . . 70 PHE CA . 27159 1 717 . 1 1 70 70 PHE CB C 13 38.781 0.125 . 1 . . . . . 70 PHE CB . 27159 1 718 . 1 1 70 70 PHE N N 15 114.221 0.056 . 1 . . . . . 70 PHE N . 27159 1 719 . 1 1 71 71 MET H H 1 8.12 0.004 . 1 . . . . . 71 MET H . 27159 1 720 . 1 1 71 71 MET HA H 1 5.402 0.008 . 1 . . . . . 71 MET HA . 27159 1 721 . 1 1 71 71 MET HB2 H 1 2.139 0 . 1 . . . . . 71 MET HB2 . 27159 1 722 . 1 1 71 71 MET HB3 H 1 1.657 0 . 1 . . . . . 71 MET HB3 . 27159 1 723 . 1 1 71 71 MET HG2 H 1 1.037 0.006 . 1 . . . . . 71 MET HG2 . 27159 1 724 . 1 1 71 71 MET HG3 H 1 1.026 0 . 1 . . . . . 71 MET HG3 . 27159 1 725 . 1 1 71 71 MET C C 13 173.81 0 . 1 . . . . . 71 MET C . 27159 1 726 . 1 1 71 71 MET CA C 13 55.097 0.105 . 1 . . . . . 71 MET CA . 27159 1 727 . 1 1 71 71 MET CB C 13 35.467 0.036 . 1 . . . . . 71 MET CB . 27159 1 728 . 1 1 71 71 MET CG C 13 28.407 0.109 . 1 . . . . . 71 MET CG . 27159 1 729 . 1 1 71 71 MET N N 15 112.387 0.116 . 1 . . . . . 71 MET N . 27159 1 730 . 1 1 72 72 CYS H H 1 8.477 0.004 . 1 . . . . . 72 CYS H . 27159 1 731 . 1 1 72 72 CYS HA H 1 4.918 0.003 . 1 . . . . . 72 CYS HA . 27159 1 732 . 1 1 72 72 CYS HB2 H 1 2.51 0 . 1 . . . . . 72 CYS HB2 . 27159 1 733 . 1 1 72 72 CYS HB3 H 1 2.841 0.003 . 1 . . . . . 72 CYS HB3 . 27159 1 734 . 1 1 72 72 CYS C C 13 172.557 0 . 1 . . . . . 72 CYS C . 27159 1 735 . 1 1 72 72 CYS CA C 13 57.174 0.131 . 1 . . . . . 72 CYS CA . 27159 1 736 . 1 1 72 72 CYS CB C 13 30.793 0.134 . 1 . . . . . 72 CYS CB . 27159 1 737 . 1 1 72 72 CYS N N 15 115.135 0.034 . 1 . . . . . 72 CYS N . 27159 1 738 . 1 1 73 73 GLN H H 1 9.374 0.004 . 1 . . . . . 73 GLN H . 27159 1 739 . 1 1 73 73 GLN HA H 1 5.199 0.007 . 1 . . . . . 73 GLN HA . 27159 1 740 . 1 1 73 73 GLN HB2 H 1 1.933 0 . 1 . . . . . 73 GLN HB2 . 27159 1 741 . 1 1 73 73 GLN HB3 H 1 1.97 0 . 1 . . . . . 73 GLN HB3 . 27159 1 742 . 1 1 73 73 GLN HG2 H 1 2.482 0.004 . 1 . . . . . 73 GLN HG2 . 27159 1 743 . 1 1 73 73 GLN HG3 H 1 1.964 0.017 . 1 . . . . . 73 GLN HG3 . 27159 1 744 . 1 1 73 73 GLN C C 13 173.975 0 . 1 . . . . . 73 GLN C . 27159 1 745 . 1 1 73 73 GLN CA C 13 54.09 0.146 . 1 . . . . . 73 GLN CA . 27159 1 746 . 1 1 73 73 GLN CB C 13 31.319 0.16 . 1 . . . . . 73 GLN CB . 27159 1 747 . 1 1 73 73 GLN CG C 13 33.257 0.063 . 1 . . . . . 73 GLN CG . 27159 1 748 . 1 1 73 73 GLN N N 15 125.206 0.063 . 1 . . . . . 73 GLN N . 27159 1 749 . 1 1 74 74 GLY H H 1 7.28 0.003 . 1 . . . . . 74 GLY H . 27159 1 750 . 1 1 74 74 GLY HA2 H 1 4.854 0.009 . 1 . . . . . 74 GLY HA2 . 27159 1 751 . 1 1 74 74 GLY HA3 H 1 2.958 0.005 . 1 . . . . . 74 GLY HA3 . 27159 1 752 . 1 1 74 74 GLY C C 13 173.083 0 . 1 . . . . . 74 GLY C . 27159 1 753 . 1 1 74 74 GLY CA C 13 45.195 0.125 . 1 . . . . . 74 GLY CA . 27159 1 754 . 1 1 74 74 GLY N N 15 109.69 0.035 . 1 . . . . . 74 GLY N . 27159 1 755 . 1 1 75 75 GLY H H 1 9.318 0.004 . 1 . . . . . 75 GLY H . 27159 1 756 . 1 1 75 75 GLY HA2 H 1 3.947 0.005 . 1 . . . . . 75 GLY HA2 . 27159 1 757 . 1 1 75 75 GLY HA3 H 1 4.915 0 . 1 . . . . . 75 GLY HA3 . 27159 1 758 . 1 1 75 75 GLY C C 13 175.206 0 . 1 . . . . . 75 GLY C . 27159 1 759 . 1 1 75 75 GLY CA C 13 46.777 0.045 . 1 . . . . . 75 GLY CA . 27159 1 760 . 1 1 75 75 GLY N N 15 106.122 0.086 . 1 . . . . . 75 GLY N . 27159 1 761 . 1 1 76 76 ASP H H 1 10.073 0.002 . 1 . . . . . 76 ASP H . 27159 1 762 . 1 1 76 76 ASP HA H 1 4.434 0.002 . 1 . . . . . 76 ASP HA . 27159 1 763 . 1 1 76 76 ASP HB2 H 1 2.952 0 . 1 . . . . . 76 ASP HB2 . 27159 1 764 . 1 1 76 76 ASP HB3 H 1 1.743 0 . 1 . . . . . 76 ASP HB3 . 27159 1 765 . 1 1 76 76 ASP C C 13 176.574 0 . 1 . . . . . 76 ASP C . 27159 1 766 . 1 1 76 76 ASP CA C 13 51.951 0.183 . 1 . . . . . 76 ASP CA . 27159 1 767 . 1 1 76 76 ASP CB C 13 39.142 0.08 . 1 . . . . . 76 ASP CB . 27159 1 768 . 1 1 76 76 ASP N N 15 123.896 0.015 . 1 . . . . . 76 ASP N . 27159 1 769 . 1 1 77 77 PHE H H 1 6.785 0.002 . 1 . . . . . 77 PHE H . 27159 1 770 . 1 1 77 77 PHE HA H 1 4.954 0 . 1 . . . . . 77 PHE HA . 27159 1 771 . 1 1 77 77 PHE HB2 H 1 2.755 0.005 . 1 . . . . . 77 PHE HB2 . 27159 1 772 . 1 1 77 77 PHE HB3 H 1 4.061 0.001 . 1 . . . . . 77 PHE HB3 . 27159 1 773 . 1 1 77 77 PHE C C 13 175.381 0 . 1 . . . . . 77 PHE C . 27159 1 774 . 1 1 77 77 PHE CA C 13 56.201 0.105 . 1 . . . . . 77 PHE CA . 27159 1 775 . 1 1 77 77 PHE CB C 13 39.148 0.055 . 1 . . . . . 77 PHE CB . 27159 1 776 . 1 1 77 77 PHE N N 15 116.425 0.025 . 1 . . . . . 77 PHE N . 27159 1 777 . 1 1 78 78 THR H H 1 7.625 0.006 . 1 . . . . . 78 THR H . 27159 1 778 . 1 1 78 78 THR HA H 1 4.756 0 . 1 . . . . . 78 THR HA . 27159 1 779 . 1 1 78 78 THR HB H 1 4.288 0.018 . 1 . . . . . 78 THR HB . 27159 1 780 . 1 1 78 78 THR HG21 H 1 0.889 0.007 . 1 . . . . . 78 THR MG . 27159 1 781 . 1 1 78 78 THR HG22 H 1 0.889 0.007 . 1 . . . . . 78 THR MG . 27159 1 782 . 1 1 78 78 THR HG23 H 1 0.889 0.007 . 1 . . . . . 78 THR MG . 27159 1 783 . 1 1 78 78 THR C C 13 175.592 0 . 1 . . . . . 78 THR C . 27159 1 784 . 1 1 78 78 THR CA C 13 62.508 0.079 . 1 . . . . . 78 THR CA . 27159 1 785 . 1 1 78 78 THR CB C 13 68.737 0.076 . 1 . . . . . 78 THR CB . 27159 1 786 . 1 1 78 78 THR CG2 C 13 23.592 0.033 . 1 . . . . . 78 THR CG2 . 27159 1 787 . 1 1 78 78 THR N N 15 109.737 0.037 . 1 . . . . . 78 THR N . 27159 1 788 . 1 1 79 79 ARG H H 1 8.897 0.005 . 1 . . . . . 79 ARG H . 27159 1 789 . 1 1 79 79 ARG HA H 1 4.547 0.006 . 1 . . . . . 79 ARG HA . 27159 1 790 . 1 1 79 79 ARG HB2 H 1 1.592 0.008 . 1 . . . . . 79 ARG HB2 . 27159 1 791 . 1 1 79 79 ARG HB3 H 1 1.917 0.003 . 1 . . . . . 79 ARG HB3 . 27159 1 792 . 1 1 79 79 ARG HG2 H 1 1.524 0.013 . 1 . . . . . 79 ARG HG2 . 27159 1 793 . 1 1 79 79 ARG HG3 H 1 1.546 0 . 1 . . . . . 79 ARG HG3 . 27159 1 794 . 1 1 79 79 ARG HD2 H 1 3.118 0 . 1 . . . . . 79 ARG HD2 . 27159 1 795 . 1 1 79 79 ARG HD3 H 1 3.092 0 . 1 . . . . . 79 ARG HD3 . 27159 1 796 . 1 1 79 79 ARG C C 13 177.592 0 . 1 . . . . . 79 ARG C . 27159 1 797 . 1 1 79 79 ARG CA C 13 55.631 0.113 . 1 . . . . . 79 ARG CA . 27159 1 798 . 1 1 79 79 ARG CB C 13 32.608 0.142 . 1 . . . . . 79 ARG CB . 27159 1 799 . 1 1 79 79 ARG CG C 13 26.697 0.123 . 1 . . . . . 79 ARG CG . 27159 1 800 . 1 1 79 79 ARG CD C 13 42.911 0 . 1 . . . . . 79 ARG CD . 27159 1 801 . 1 1 79 79 ARG N N 15 122.058 0.04 . 1 . . . . . 79 ARG N . 27159 1 802 . 1 1 80 80 GLY H H 1 7.245 0.006 . 1 . . . . . 80 GLY H . 27159 1 803 . 1 1 80 80 GLY HA2 H 1 4.096 0 . 1 . . . . . 80 GLY HA2 . 27159 1 804 . 1 1 80 80 GLY HA3 H 1 3.95 0 . 1 . . . . . 80 GLY HA3 . 27159 1 805 . 1 1 80 80 GLY C C 13 173.078 0 . 1 . . . . . 80 GLY C . 27159 1 806 . 1 1 80 80 GLY CA C 13 46.623 0.069 . 1 . . . . . 80 GLY CA . 27159 1 807 . 1 1 80 80 GLY N N 15 105.57 0.085 . 1 . . . . . 80 GLY N . 27159 1 808 . 1 1 81 81 ASN H H 1 7.329 0.002 . 1 . . . . . 81 ASN H . 27159 1 809 . 1 1 81 81 ASN HA H 1 4.715 0 . 1 . . . . . 81 ASN HA . 27159 1 810 . 1 1 81 81 ASN HB2 H 1 3.202 0 . 1 . . . . . 81 ASN HB2 . 27159 1 811 . 1 1 81 81 ASN HB3 H 1 2.663 0 . 1 . . . . . 81 ASN HB3 . 27159 1 812 . 1 1 81 81 ASN C C 13 175.68 0 . 1 . . . . . 81 ASN C . 27159 1 813 . 1 1 81 81 ASN CA C 13 51.987 0.199 . 1 . . . . . 81 ASN CA . 27159 1 814 . 1 1 81 81 ASN CB C 13 39.149 0.038 . 1 . . . . . 81 ASN CB . 27159 1 815 . 1 1 81 81 ASN N N 15 113.193 0.048 . 1 . . . . . 81 ASN N . 27159 1 816 . 1 1 82 82 GLY H H 1 9.593 0.003 . 1 . . . . . 82 GLY H . 27159 1 817 . 1 1 82 82 GLY HA2 H 1 4.537 0 . 1 . . . . . 82 GLY HA2 . 27159 1 818 . 1 1 82 82 GLY HA3 H 1 3.361 0 . 1 . . . . . 82 GLY HA3 . 27159 1 819 . 1 1 82 82 GLY C C 13 175.895 0 . 1 . . . . . 82 GLY C . 27159 1 820 . 1 1 82 82 GLY CA C 13 45.065 0.102 . 1 . . . . . 82 GLY CA . 27159 1 821 . 1 1 82 82 GLY N N 15 110.359 0.028 . 1 . . . . . 82 GLY N . 27159 1 822 . 1 1 83 83 THR H H 1 7.911 0.004 . 1 . . . . . 83 THR H . 27159 1 823 . 1 1 83 83 THR HA H 1 4.529 0.022 . 1 . . . . . 83 THR HA . 27159 1 824 . 1 1 83 83 THR HB H 1 4.33 0.001 . 1 . . . . . 83 THR HB . 27159 1 825 . 1 1 83 83 THR HG21 H 1 1.104 0 . 1 . . . . . 83 THR MG . 27159 1 826 . 1 1 83 83 THR HG22 H 1 1.104 0 . 1 . . . . . 83 THR MG . 27159 1 827 . 1 1 83 83 THR HG23 H 1 1.104 0 . 1 . . . . . 83 THR MG . 27159 1 828 . 1 1 83 83 THR C C 13 175.881 0 . 1 . . . . . 83 THR C . 27159 1 829 . 1 1 83 83 THR CA C 13 62.317 0.051 . 1 . . . . . 83 THR CA . 27159 1 830 . 1 1 83 83 THR CB C 13 70.516 0.04 . 1 . . . . . 83 THR CB . 27159 1 831 . 1 1 83 83 THR CG2 C 13 21.015 0 . 1 . . . . . 83 THR CG2 . 27159 1 832 . 1 1 83 83 THR N N 15 111.791 0.048 . 1 . . . . . 83 THR N . 27159 1 833 . 1 1 84 84 GLY H H 1 8.733 0.003 . 1 . . . . . 84 GLY H . 27159 1 834 . 1 1 84 84 GLY HA2 H 1 4.556 0.002 . 1 . . . . . 84 GLY HA2 . 27159 1 835 . 1 1 84 84 GLY HA3 H 1 3.672 0.005 . 1 . . . . . 84 GLY HA3 . 27159 1 836 . 1 1 84 84 GLY C C 13 175.263 0 . 1 . . . . . 84 GLY C . 27159 1 837 . 1 1 84 84 GLY CA C 13 44.993 0.134 . 1 . . . . . 84 GLY CA . 27159 1 838 . 1 1 84 84 GLY N N 15 113.909 0.019 . 1 . . . . . 84 GLY N . 27159 1 839 . 1 1 85 85 GLY H H 1 8.363 0.006 . 1 . . . . . 85 GLY H . 27159 1 840 . 1 1 85 85 GLY HA2 H 1 4.753 0 . 1 . . . . . 85 GLY HA2 . 27159 1 841 . 1 1 85 85 GLY HA3 H 1 2.675 0.003 . 1 . . . . . 85 GLY HA3 . 27159 1 842 . 1 1 85 85 GLY C C 13 171.997 0 . 1 . . . . . 85 GLY C . 27159 1 843 . 1 1 85 85 GLY CA C 13 43.49 0.1 . 1 . . . . . 85 GLY CA . 27159 1 844 . 1 1 85 85 GLY N N 15 109.79 0.044 . 1 . . . . . 85 GLY N . 27159 1 845 . 1 1 86 86 GLU H H 1 6.983 0.002 . 1 . . . . . 86 GLU H . 27159 1 846 . 1 1 86 86 GLU HA H 1 4.496 0.006 . 1 . . . . . 86 GLU HA . 27159 1 847 . 1 1 86 86 GLU HB2 H 1 1.979 0 . 1 . . . . . 86 GLU HB2 . 27159 1 848 . 1 1 86 86 GLU HB3 H 1 2.026 0.006 . 1 . . . . . 86 GLU HB3 . 27159 1 849 . 1 1 86 86 GLU HG2 H 1 2.416 0 . 1 . . . . . 86 GLU HG2 . 27159 1 850 . 1 1 86 86 GLU HG3 H 1 2.143 0 . 1 . . . . . 86 GLU HG3 . 27159 1 851 . 1 1 86 86 GLU C C 13 172.988 0 . 1 . . . . . 86 GLU C . 27159 1 852 . 1 1 86 86 GLU CA C 13 56.743 0.08 . 1 . . . . . 86 GLU CA . 27159 1 853 . 1 1 86 86 GLU CB C 13 32.908 0.113 . 1 . . . . . 86 GLU CB . 27159 1 854 . 1 1 86 86 GLU CG C 13 36.092 0 . 1 . . . . . 86 GLU CG . 27159 1 855 . 1 1 86 86 GLU N N 15 119.462 0.029 . 1 . . . . . 86 GLU N . 27159 1 856 . 1 1 87 87 SER H H 1 8.178 0.003 . 1 . . . . . 87 SER H . 27159 1 857 . 1 1 87 87 SER HA H 1 5.058 0.006 . 1 . . . . . 87 SER HA . 27159 1 858 . 1 1 87 87 SER HB2 H 1 4.316 0.005 . 1 . . . . . 87 SER HB2 . 27159 1 859 . 1 1 87 87 SER C C 13 175.909 0 . 1 . . . . . 87 SER C . 27159 1 860 . 1 1 87 87 SER CA C 13 57.389 0.087 . 1 . . . . . 87 SER CA . 27159 1 861 . 1 1 87 87 SER CB C 13 68.659 0.024 . 1 . . . . . 87 SER CB . 27159 1 862 . 1 1 87 87 SER N N 15 116.784 0.053 . 1 . . . . . 87 SER N . 27159 1 863 . 1 1 88 88 ILE H H 1 8.67 0.002 . 1 . . . . . 88 ILE H . 27159 1 864 . 1 1 88 88 ILE HA H 1 3.987 0.008 . 1 . . . . . 88 ILE HA . 27159 1 865 . 1 1 88 88 ILE HB H 1 1.742 0.008 . 1 . . . . . 88 ILE HB . 27159 1 866 . 1 1 88 88 ILE HG12 H 1 0.768 0 . 1 . . . . . 88 ILE HG12 . 27159 1 867 . 1 1 88 88 ILE HG13 H 1 -0.351 0.003 . 1 . . . . . 88 ILE HG13 . 27159 1 868 . 1 1 88 88 ILE HG21 H 1 0.796 0.013 . 1 . . . . . 88 ILE MG . 27159 1 869 . 1 1 88 88 ILE HG22 H 1 0.796 0.013 . 1 . . . . . 88 ILE MG . 27159 1 870 . 1 1 88 88 ILE HG23 H 1 0.796 0.013 . 1 . . . . . 88 ILE MG . 27159 1 871 . 1 1 88 88 ILE HD11 H 1 0.508 0.013 . 1 . . . . . 88 ILE MD . 27159 1 872 . 1 1 88 88 ILE HD12 H 1 0.508 0.013 . 1 . . . . . 88 ILE MD . 27159 1 873 . 1 1 88 88 ILE HD13 H 1 0.508 0.013 . 1 . . . . . 88 ILE MD . 27159 1 874 . 1 1 88 88 ILE C C 13 175.895 0 . 1 . . . . . 88 ILE C . 27159 1 875 . 1 1 88 88 ILE CA C 13 63.83 0.095 . 1 . . . . . 88 ILE CA . 27159 1 876 . 1 1 88 88 ILE CB C 13 37.174 0.099 . 1 . . . . . 88 ILE CB . 27159 1 877 . 1 1 88 88 ILE CG1 C 13 23.101 0.095 . 1 . . . . . 88 ILE CG1 . 27159 1 878 . 1 1 88 88 ILE CG2 C 13 17.587 0.025 . 1 . . . . . 88 ILE CG2 . 27159 1 879 . 1 1 88 88 ILE CD1 C 13 14.436 0.119 . 1 . . . . . 88 ILE CD1 . 27159 1 880 . 1 1 88 88 ILE N N 15 112.095 0.031 . 1 . . . . . 88 ILE N . 27159 1 881 . 1 1 89 89 TYR H H 1 7.874 0.003 . 1 . . . . . 89 TYR H . 27159 1 882 . 1 1 89 89 TYR HA H 1 4.703 0 . 1 . . . . . 89 TYR HA . 27159 1 883 . 1 1 89 89 TYR HB2 H 1 3.474 0.021 . 1 . . . . . 89 TYR HB2 . 27159 1 884 . 1 1 89 89 TYR HB3 H 1 2.457 0.008 . 1 . . . . . 89 TYR HB3 . 27159 1 885 . 1 1 89 89 TYR C C 13 175.768 0 . 1 . . . . . 89 TYR C . 27159 1 886 . 1 1 89 89 TYR CA C 13 56.412 0.077 . 1 . . . . . 89 TYR CA . 27159 1 887 . 1 1 89 89 TYR CB C 13 38.661 0.018 . 1 . . . . . 89 TYR CB . 27159 1 888 . 1 1 89 89 TYR N N 15 120.113 0.044 . 1 . . . . . 89 TYR N . 27159 1 889 . 1 1 90 90 GLY H H 1 7.315 0.004 . 1 . . . . . 90 GLY H . 27159 1 890 . 1 1 90 90 GLY HA2 H 1 4.584 0 . 1 . . . . . 90 GLY HA2 . 27159 1 891 . 1 1 90 90 GLY HA3 H 1 3.943 0 . 1 . . . . . 90 GLY HA3 . 27159 1 892 . 1 1 90 90 GLY CA C 13 44.581 0 . 1 . . . . . 90 GLY CA . 27159 1 893 . 1 1 90 90 GLY N N 15 107.264 0.034 . 1 . . . . . 90 GLY N . 27159 1 894 . 1 1 91 91 GLU HA H 1 4.225 0.001 . 1 . . . . . 91 GLU HA . 27159 1 895 . 1 1 91 91 GLU HB2 H 1 2.349 0.01 . 1 . . . . . 91 GLU HB2 . 27159 1 896 . 1 1 91 91 GLU HB3 H 1 2.358 0.024 . 1 . . . . . 91 GLU HB3 . 27159 1 897 . 1 1 91 91 GLU HG2 H 1 2.213 0 . 1 . . . . . 91 GLU HG2 . 27159 1 898 . 1 1 91 91 GLU C C 13 175.747 0 . 1 . . . . . 91 GLU C . 27159 1 899 . 1 1 91 91 GLU CA C 13 59.041 0.041 . 1 . . . . . 91 GLU CA . 27159 1 900 . 1 1 91 91 GLU CB C 13 30.968 0.032 . 1 . . . . . 91 GLU CB . 27159 1 901 . 1 1 91 91 GLU CG C 13 36.34 0.022 . 1 . . . . . 91 GLU CG . 27159 1 902 . 1 1 92 92 LYS H H 1 8.092 0.003 . 1 . . . . . 92 LYS H . 27159 1 903 . 1 1 92 92 LYS HA H 1 5.392 0.009 . 1 . . . . . 92 LYS HA . 27159 1 904 . 1 1 92 92 LYS HB2 H 1 1.644 0.01 . 1 . . . . . 92 LYS HB2 . 27159 1 905 . 1 1 92 92 LYS HB3 H 1 2.152 0 . 1 . . . . . 92 LYS HB3 . 27159 1 906 . 1 1 92 92 LYS HG2 H 1 1.339 0.001 . 1 . . . . . 92 LYS HG2 . 27159 1 907 . 1 1 92 92 LYS HG3 H 1 1.31 0.005 . 1 . . . . . 92 LYS HG3 . 27159 1 908 . 1 1 92 92 LYS HD2 H 1 1.622 0.001 . 1 . . . . . 92 LYS HD2 . 27159 1 909 . 1 1 92 92 LYS HD3 H 1 1.593 0 . 1 . . . . . 92 LYS HD3 . 27159 1 910 . 1 1 92 92 LYS HE2 H 1 2.553 0 . 1 . . . . . 92 LYS HE2 . 27159 1 911 . 1 1 92 92 LYS HE3 H 1 3.016 0 . 1 . . . . . 92 LYS HE3 . 27159 1 912 . 1 1 92 92 LYS C C 13 176.033 0 . 1 . . . . . 92 LYS C . 27159 1 913 . 1 1 92 92 LYS CA C 13 54.95 0.109 . 1 . . . . . 92 LYS CA . 27159 1 914 . 1 1 92 92 LYS CB C 13 35.536 0.075 . 1 . . . . . 92 LYS CB . 27159 1 915 . 1 1 92 92 LYS CG C 13 24.697 0.045 . 1 . . . . . 92 LYS CG . 27159 1 916 . 1 1 92 92 LYS CD C 13 29.312 0.135 . 1 . . . . . 92 LYS CD . 27159 1 917 . 1 1 92 92 LYS CE C 13 41.453 0 . 1 . . . . . 92 LYS CE . 27159 1 918 . 1 1 92 92 LYS N N 15 115.154 0.097 . 1 . . . . . 92 LYS N . 27159 1 919 . 1 1 93 93 PHE H H 1 9.11 0.004 . 1 . . . . . 93 PHE H . 27159 1 920 . 1 1 93 93 PHE HA H 1 5.097 0.013 . 1 . . . . . 93 PHE HA . 27159 1 921 . 1 1 93 93 PHE HB2 H 1 3.054 0.018 . 1 . . . . . 93 PHE HB2 . 27159 1 922 . 1 1 93 93 PHE HB3 H 1 2.99 0 . 1 . . . . . 93 PHE HB3 . 27159 1 923 . 1 1 93 93 PHE C C 13 173.632 0 . 1 . . . . . 93 PHE C . 27159 1 924 . 1 1 93 93 PHE CA C 13 55.692 0.12 . 1 . . . . . 93 PHE CA . 27159 1 925 . 1 1 93 93 PHE CB C 13 42.325 0.026 . 1 . . . . . 93 PHE CB . 27159 1 926 . 1 1 93 93 PHE N N 15 117.006 0.025 . 1 . . . . . 93 PHE N . 27159 1 927 . 1 1 94 94 ALA H H 1 8.409 0.005 . 1 . . . . . 94 ALA H . 27159 1 928 . 1 1 94 94 ALA HA H 1 3.867 0.002 . 1 . . . . . 94 ALA HA . 27159 1 929 . 1 1 94 94 ALA HB1 H 1 1.382 0.002 . 1 . . . . . 94 ALA MB . 27159 1 930 . 1 1 94 94 ALA HB2 H 1 1.382 0.002 . 1 . . . . . 94 ALA MB . 27159 1 931 . 1 1 94 94 ALA HB3 H 1 1.382 0.002 . 1 . . . . . 94 ALA MB . 27159 1 932 . 1 1 94 94 ALA C C 13 175.336 0 . 1 . . . . . 94 ALA C . 27159 1 933 . 1 1 94 94 ALA CA C 13 52.409 0.155 . 1 . . . . . 94 ALA CA . 27159 1 934 . 1 1 94 94 ALA CB C 13 19.39 0.037 . 1 . . . . . 94 ALA CB . 27159 1 935 . 1 1 94 94 ALA N N 15 122.204 0.049 . 1 . . . . . 94 ALA N . 27159 1 936 . 1 1 95 95 ASP H H 1 8.908 0.001 . 1 . . . . . 95 ASP H . 27159 1 937 . 1 1 95 95 ASP HA H 1 4.337 0.026 . 1 . . . . . 95 ASP HA . 27159 1 938 . 1 1 95 95 ASP HB2 H 1 2.511 0.025 . 1 . . . . . 95 ASP HB2 . 27159 1 939 . 1 1 95 95 ASP HB3 H 1 2.248 0.005 . 1 . . . . . 95 ASP HB3 . 27159 1 940 . 1 1 95 95 ASP C C 13 176.966 0 . 1 . . . . . 95 ASP C . 27159 1 941 . 1 1 95 95 ASP CA C 13 55.291 0.099 . 1 . . . . . 95 ASP CA . 27159 1 942 . 1 1 95 95 ASP CB C 13 41.314 0.065 . 1 . . . . . 95 ASP CB . 27159 1 943 . 1 1 95 95 ASP N N 15 119.396 0.058 . 1 . . . . . 95 ASP N . 27159 1 944 . 1 1 96 96 GLU H H 1 8.557 0.003 . 1 . . . . . 96 GLU H . 27159 1 945 . 1 1 96 96 GLU HA H 1 4.131 0.007 . 1 . . . . . 96 GLU HA . 27159 1 946 . 1 1 96 96 GLU HB2 H 1 2.506 0.015 . 1 . . . . . 96 GLU HB2 . 27159 1 947 . 1 1 96 96 GLU HB3 H 1 2.539 0 . 1 . . . . . 96 GLU HB3 . 27159 1 948 . 1 1 96 96 GLU HG2 H 1 2.492 0 . 1 . . . . . 96 GLU HG2 . 27159 1 949 . 1 1 96 96 GLU HG3 H 1 2.314 0 . 1 . . . . . 96 GLU HG3 . 27159 1 950 . 1 1 96 96 GLU C C 13 174.169 0 . 1 . . . . . 96 GLU C . 27159 1 951 . 1 1 96 96 GLU CA C 13 58.137 0.071 . 1 . . . . . 96 GLU CA . 27159 1 952 . 1 1 96 96 GLU CB C 13 31.985 0.071 . 1 . . . . . 96 GLU CB . 27159 1 953 . 1 1 96 96 GLU CG C 13 37.655 0.061 . 1 . . . . . 96 GLU CG . 27159 1 954 . 1 1 96 96 GLU N N 15 127.758 0.043 . 1 . . . . . 96 GLU N . 27159 1 955 . 1 1 97 97 VAL H H 1 6.818 0.002 . 1 . . . . . 97 VAL H . 27159 1 956 . 1 1 97 97 VAL HA H 1 4.06 0.001 . 1 . . . . . 97 VAL HA . 27159 1 957 . 1 1 97 97 VAL HB H 1 2.324 0.003 . 1 . . . . . 97 VAL HB . 27159 1 958 . 1 1 97 97 VAL HG11 H 1 1.103 0.002 . 1 . . . . . 97 VAL MG1 . 27159 1 959 . 1 1 97 97 VAL HG12 H 1 1.103 0.002 . 1 . . . . . 97 VAL MG1 . 27159 1 960 . 1 1 97 97 VAL HG13 H 1 1.103 0.002 . 1 . . . . . 97 VAL MG1 . 27159 1 961 . 1 1 97 97 VAL HG21 H 1 1.077 0 . 1 . . . . . 97 VAL MG2 . 27159 1 962 . 1 1 97 97 VAL HG22 H 1 1.077 0 . 1 . . . . . 97 VAL MG2 . 27159 1 963 . 1 1 97 97 VAL HG23 H 1 1.077 0 . 1 . . . . . 97 VAL MG2 . 27159 1 964 . 1 1 97 97 VAL C C 13 174.184 0 . 1 . . . . . 97 VAL C . 27159 1 965 . 1 1 97 97 VAL CA C 13 61.356 0.044 . 1 . . . . . 97 VAL CA . 27159 1 966 . 1 1 97 97 VAL CB C 13 33.276 0.039 . 1 . . . . . 97 VAL CB . 27159 1 967 . 1 1 97 97 VAL CG1 C 13 21.144 0.014 . 1 . . . . . 97 VAL CG1 . 27159 1 968 . 1 1 97 97 VAL CG2 C 13 21.16 0 . 1 . . . . . 97 VAL CG2 . 27159 1 969 . 1 1 97 97 VAL N N 15 111.272 0.04 . 1 . . . . . 97 VAL N . 27159 1 970 . 1 1 98 98 PHE H H 1 8.531 0.002 . 1 . . . . . 98 PHE H . 27159 1 971 . 1 1 98 98 PHE HA H 1 5.322 0.006 . 1 . . . . . 98 PHE HA . 27159 1 972 . 1 1 98 98 PHE HB2 H 1 2.893 0.007 . 1 . . . . . 98 PHE HB2 . 27159 1 973 . 1 1 98 98 PHE HB3 H 1 3.427 0.02 . 1 . . . . . 98 PHE HB3 . 27159 1 974 . 1 1 98 98 PHE C C 13 176.169 0 . 1 . . . . . 98 PHE C . 27159 1 975 . 1 1 98 98 PHE CA C 13 56.611 0.203 . 1 . . . . . 98 PHE CA . 27159 1 976 . 1 1 98 98 PHE CB C 13 37.021 0.069 . 1 . . . . . 98 PHE CB . 27159 1 977 . 1 1 98 98 PHE N N 15 125.663 0.029 . 1 . . . . . 98 PHE N . 27159 1 978 . 1 1 99 99 LYS H H 1 7.026 0.002 . 1 . . . . . 99 LYS H . 27159 1 979 . 1 1 99 99 LYS HA H 1 3.976 0.005 . 1 . . . . . 99 LYS HA . 27159 1 980 . 1 1 99 99 LYS HB2 H 1 1.172 0.01 . 1 . . . . . 99 LYS HB2 . 27159 1 981 . 1 1 99 99 LYS HB3 H 1 1.527 0.017 . 1 . . . . . 99 LYS HB3 . 27159 1 982 . 1 1 99 99 LYS HG2 H 1 0.885 0.007 . 1 . . . . . 99 LYS HG2 . 27159 1 983 . 1 1 99 99 LYS HG3 H 1 0.377 0.001 . 1 . . . . . 99 LYS HG3 . 27159 1 984 . 1 1 99 99 LYS HD2 H 1 1.413 0 . 1 . . . . . 99 LYS HD2 . 27159 1 985 . 1 1 99 99 LYS HD3 H 1 1.23 0 . 1 . . . . . 99 LYS HD3 . 27159 1 986 . 1 1 99 99 LYS HE2 H 1 2.709 0.001 . 1 . . . . . 99 LYS HE2 . 27159 1 987 . 1 1 99 99 LYS HE3 H 1 2.709 0.001 . 1 . . . . . 99 LYS HE3 . 27159 1 988 . 1 1 99 99 LYS C C 13 176.098 0 . 1 . . . . . 99 LYS C . 27159 1 989 . 1 1 99 99 LYS CA C 13 58.144 0.075 . 1 . . . . . 99 LYS CA . 27159 1 990 . 1 1 99 99 LYS CB C 13 34.494 0.025 . 1 . . . . . 99 LYS CB . 27159 1 991 . 1 1 99 99 LYS CG C 13 24.666 0.057 . 1 . . . . . 99 LYS CG . 27159 1 992 . 1 1 99 99 LYS CD C 13 29.499 0.042 . 1 . . . . . 99 LYS CD . 27159 1 993 . 1 1 99 99 LYS CE C 13 41.951 0.031 . 1 . . . . . 99 LYS CE . 27159 1 994 . 1 1 99 99 LYS N N 15 120.625 0.029 . 1 . . . . . 99 LYS N . 27159 1 995 . 1 1 100 100 PHE H H 1 7.711 0.002 . 1 . . . . . 100 PHE H . 27159 1 996 . 1 1 100 100 PHE HA H 1 4.814 0 . 1 . . . . . 100 PHE HA . 27159 1 997 . 1 1 100 100 PHE HB2 H 1 2.695 0.007 . 1 . . . . . 100 PHE HB2 . 27159 1 998 . 1 1 100 100 PHE HB3 H 1 3.433 0.021 . 1 . . . . . 100 PHE HB3 . 27159 1 999 . 1 1 100 100 PHE C C 13 174.648 0 . 1 . . . . . 100 PHE C . 27159 1 1000 . 1 1 100 100 PHE CA C 13 57.144 0.09 . 1 . . . . . 100 PHE CA . 27159 1 1001 . 1 1 100 100 PHE CB C 13 40.913 0.126 . 1 . . . . . 100 PHE CB . 27159 1 1002 . 1 1 100 100 PHE N N 15 115.471 0.038 . 1 . . . . . 100 PHE N . 27159 1 1003 . 1 1 101 101 LYS H H 1 8.538 0.003 . 1 . . . . . 101 LYS H . 27159 1 1004 . 1 1 101 101 LYS HA H 1 4.611 0.007 . 1 . . . . . 101 LYS HA . 27159 1 1005 . 1 1 101 101 LYS HB2 H 1 1.704 0 . 1 . . . . . 101 LYS HB2 . 27159 1 1006 . 1 1 101 101 LYS HB3 H 1 1.652 0.009 . 1 . . . . . 101 LYS HB3 . 27159 1 1007 . 1 1 101 101 LYS HG2 H 1 1.492 0 . 1 . . . . . 101 LYS HG2 . 27159 1 1008 . 1 1 101 101 LYS HG3 H 1 1.343 0.009 . 1 . . . . . 101 LYS HG3 . 27159 1 1009 . 1 1 101 101 LYS HD2 H 1 1.722 0 . 1 . . . . . 101 LYS HD2 . 27159 1 1010 . 1 1 101 101 LYS HD3 H 1 1.717 0 . 1 . . . . . 101 LYS HD3 . 27159 1 1011 . 1 1 101 101 LYS HE2 H 1 3.038 0.025 . 1 . . . . . 101 LYS HE2 . 27159 1 1012 . 1 1 101 101 LYS HE3 H 1 3.039 0 . 1 . . . . . 101 LYS HE3 . 27159 1 1013 . 1 1 101 101 LYS C C 13 176.885 0 . 1 . . . . . 101 LYS C . 27159 1 1014 . 1 1 101 101 LYS CA C 13 55.381 0.094 . 1 . . . . . 101 LYS CA . 27159 1 1015 . 1 1 101 101 LYS CB C 13 35.524 0.144 . 1 . . . . . 101 LYS CB . 27159 1 1016 . 1 1 101 101 LYS CG C 13 25.731 0.056 . 1 . . . . . 101 LYS CG . 27159 1 1017 . 1 1 101 101 LYS CD C 13 28.947 0.091 . 1 . . . . . 101 LYS CD . 27159 1 1018 . 1 1 101 101 LYS CE C 13 39.394 0 . 1 . . . . . 101 LYS CE . 27159 1 1019 . 1 1 101 101 LYS N N 15 120.358 0.054 . 1 . . . . . 101 LYS N . 27159 1 1020 . 1 1 102 102 HIS H H 1 10.689 0.007 . 1 . . . . . 102 HIS H . 27159 1 1021 . 1 1 102 102 HIS HA H 1 4.61 0.001 . 1 . . . . . 102 HIS HA . 27159 1 1022 . 1 1 102 102 HIS HB2 H 1 3.131 0.016 . 1 . . . . . 102 HIS HB2 . 27159 1 1023 . 1 1 102 102 HIS HB3 H 1 3.082 0.007 . 1 . . . . . 102 HIS HB3 . 27159 1 1024 . 1 1 102 102 HIS C C 13 178.158 0 . 1 . . . . . 102 HIS C . 27159 1 1025 . 1 1 102 102 HIS CA C 13 55.505 0.091 . 1 . . . . . 102 HIS CA . 27159 1 1026 . 1 1 102 102 HIS CB C 13 25.569 0.018 . 1 . . . . . 102 HIS CB . 27159 1 1027 . 1 1 102 102 HIS N N 15 123.42 0.071 . 1 . . . . . 102 HIS N . 27159 1 1028 . 1 1 103 103 ASP H H 1 7.957 0.006 . 1 . . . . . 103 ASP H . 27159 1 1029 . 1 1 103 103 ASP HA H 1 4.674 0.002 . 1 . . . . . 103 ASP HA . 27159 1 1030 . 1 1 103 103 ASP HB2 H 1 2.532 0.014 . 1 . . . . . 103 ASP HB2 . 27159 1 1031 . 1 1 103 103 ASP HB3 H 1 3.133 0.007 . 1 . . . . . 103 ASP HB3 . 27159 1 1032 . 1 1 103 103 ASP C C 13 176.08 0 . 1 . . . . . 103 ASP C . 27159 1 1033 . 1 1 103 103 ASP CA C 13 53.538 0.111 . 1 . . . . . 103 ASP CA . 27159 1 1034 . 1 1 103 103 ASP CB C 13 41.71 0.152 . 1 . . . . . 103 ASP CB . 27159 1 1035 . 1 1 103 103 ASP N N 15 118.152 0.047 . 1 . . . . . 103 ASP N . 27159 1 1036 . 1 1 104 104 SER H H 1 7.402 0.002 . 1 . . . . . 104 SER H . 27159 1 1037 . 1 1 104 104 SER HA H 1 4.963 0.01 . 1 . . . . . 104 SER HA . 27159 1 1038 . 1 1 104 104 SER HB2 H 1 3.859 0.001 . 1 . . . . . 104 SER HB2 . 27159 1 1039 . 1 1 104 104 SER HB3 H 1 3.675 0.02 . 1 . . . . . 104 SER HB3 . 27159 1 1040 . 1 1 104 104 SER CA C 13 56.452 0.12 . 1 . . . . . 104 SER CA . 27159 1 1041 . 1 1 104 104 SER CB C 13 64.512 0.132 . 1 . . . . . 104 SER CB . 27159 1 1042 . 1 1 104 104 SER N N 15 111.971 0.067 . 1 . . . . . 104 SER N . 27159 1 1043 . 1 1 105 105 PRO HA H 1 3.851 0.007 . 1 . . . . . 105 PRO HA . 27159 1 1044 . 1 1 105 105 PRO HB2 H 1 2.253 0 . 1 . . . . . 105 PRO HB2 . 27159 1 1045 . 1 1 105 105 PRO HB3 H 1 1.869 0.008 . 1 . . . . . 105 PRO HB3 . 27159 1 1046 . 1 1 105 105 PRO HG2 H 1 1.963 0 . 1 . . . . . 105 PRO HG2 . 27159 1 1047 . 1 1 105 105 PRO HG3 H 1 2.236 0.01 . 1 . . . . . 105 PRO HG3 . 27159 1 1048 . 1 1 105 105 PRO C C 13 177.353 0 . 1 . . . . . 105 PRO C . 27159 1 1049 . 1 1 105 105 PRO CA C 13 63.39 0.03 . 1 . . . . . 105 PRO CA . 27159 1 1050 . 1 1 105 105 PRO CB C 13 32.317 0.108 . 1 . . . . . 105 PRO CB . 27159 1 1051 . 1 1 105 105 PRO CG C 13 28.431 0.121 . 1 . . . . . 105 PRO CG . 27159 1 1052 . 1 1 106 106 GLY H H 1 9.323 0.005 . 1 . . . . . 106 GLY H . 27159 1 1053 . 1 1 106 106 GLY HA2 H 1 4.427 0 . 1 . . . . . 106 GLY HA2 . 27159 1 1054 . 1 1 106 106 GLY HA3 H 1 3.292 0 . 1 . . . . . 106 GLY HA3 . 27159 1 1055 . 1 1 106 106 GLY C C 13 172.945 0 . 1 . . . . . 106 GLY C . 27159 1 1056 . 1 1 106 106 GLY CA C 13 45.959 0.066 . 1 . . . . . 106 GLY CA . 27159 1 1057 . 1 1 106 106 GLY N N 15 111.076 0.054 . 1 . . . . . 106 GLY N . 27159 1 1058 . 1 1 107 107 ILE H H 1 6.789 0.002 . 1 . . . . . 107 ILE H . 27159 1 1059 . 1 1 107 107 ILE HA H 1 3.955 0 . 1 . . . . . 107 ILE HA . 27159 1 1060 . 1 1 107 107 ILE HB H 1 2.109 0 . 1 . . . . . 107 ILE HB . 27159 1 1061 . 1 1 107 107 ILE HG12 H 1 1.929 0 . 1 . . . . . 107 ILE HG12 . 27159 1 1062 . 1 1 107 107 ILE HG13 H 1 1.875 0 . 1 . . . . . 107 ILE HG13 . 27159 1 1063 . 1 1 107 107 ILE HG21 H 1 0.709 0 . 1 . . . . . 107 ILE MG . 27159 1 1064 . 1 1 107 107 ILE HG22 H 1 0.709 0 . 1 . . . . . 107 ILE MG . 27159 1 1065 . 1 1 107 107 ILE HG23 H 1 0.709 0 . 1 . . . . . 107 ILE MG . 27159 1 1066 . 1 1 107 107 ILE HD11 H 1 0.942 0.007 . 1 . . . . . 107 ILE MD . 27159 1 1067 . 1 1 107 107 ILE HD12 H 1 0.942 0.007 . 1 . . . . . 107 ILE MD . 27159 1 1068 . 1 1 107 107 ILE HD13 H 1 0.942 0.007 . 1 . . . . . 107 ILE MD . 27159 1 1069 . 1 1 107 107 ILE C C 13 173.122 0 . 1 . . . . . 107 ILE C . 27159 1 1070 . 1 1 107 107 ILE CA C 13 59.932 0.048 . 1 . . . . . 107 ILE CA . 27159 1 1071 . 1 1 107 107 ILE CB C 13 38.09 0.005 . 1 . . . . . 107 ILE CB . 27159 1 1072 . 1 1 107 107 ILE CG1 C 13 28.845 0 . 1 . . . . . 107 ILE CG1 . 27159 1 1073 . 1 1 107 107 ILE CG2 C 13 20.539 0 . 1 . . . . . 107 ILE CG2 . 27159 1 1074 . 1 1 107 107 ILE CD1 C 13 13.817 0.048 . 1 . . . . . 107 ILE CD1 . 27159 1 1075 . 1 1 107 107 ILE N N 15 121.409 0.02 . 1 . . . . . 107 ILE N . 27159 1 1076 . 1 1 108 108 LEU H H 1 7.623 0.006 . 1 . . . . . 108 LEU H . 27159 1 1077 . 1 1 108 108 LEU HA H 1 4.893 0.002 . 1 . . . . . 108 LEU HA . 27159 1 1078 . 1 1 108 108 LEU HB2 H 1 0.175 0.012 . 1 . . . . . 108 LEU HB2 . 27159 1 1079 . 1 1 108 108 LEU HB3 H 1 0.076 0 . 1 . . . . . 108 LEU HB3 . 27159 1 1080 . 1 1 108 108 LEU HG H 1 0.461 0 . 1 . . . . . 108 LEU HG . 27159 1 1081 . 1 1 108 108 LEU HD11 H 1 0.155 0.003 . 1 . . . . . 108 LEU MD1 . 27159 1 1082 . 1 1 108 108 LEU HD12 H 1 0.155 0.003 . 1 . . . . . 108 LEU MD1 . 27159 1 1083 . 1 1 108 108 LEU HD13 H 1 0.155 0.003 . 1 . . . . . 108 LEU MD1 . 27159 1 1084 . 1 1 108 108 LEU HD21 H 1 -0.132 0.002 . 1 . . . . . 108 LEU MD2 . 27159 1 1085 . 1 1 108 108 LEU HD22 H 1 -0.132 0.002 . 1 . . . . . 108 LEU MD2 . 27159 1 1086 . 1 1 108 108 LEU HD23 H 1 -0.132 0.002 . 1 . . . . . 108 LEU MD2 . 27159 1 1087 . 1 1 108 108 LEU C C 13 174.185 0 . 1 . . . . . 108 LEU C . 27159 1 1088 . 1 1 108 108 LEU CA C 13 53.257 0.149 . 1 . . . . . 108 LEU CA . 27159 1 1089 . 1 1 108 108 LEU CB C 13 43.634 0.026 . 1 . . . . . 108 LEU CB . 27159 1 1090 . 1 1 108 108 LEU CG C 13 26.35 0.206 . 1 . . . . . 108 LEU CG . 27159 1 1091 . 1 1 108 108 LEU CD1 C 13 24.439 0.019 . 1 . . . . . 108 LEU CD1 . 27159 1 1092 . 1 1 108 108 LEU CD2 C 13 25.962 0.087 . 1 . . . . . 108 LEU CD2 . 27159 1 1093 . 1 1 108 108 LEU N N 15 128.162 0.044 . 1 . . . . . 108 LEU N . 27159 1 1094 . 1 1 109 109 SER H H 1 8.404 0.002 . 1 . . . . . 109 SER H . 27159 1 1095 . 1 1 109 109 SER HA H 1 5.275 0.006 . 1 . . . . . 109 SER HA . 27159 1 1096 . 1 1 109 109 SER HB2 H 1 3.25 0.021 . 1 . . . . . 109 SER HB2 . 27159 1 1097 . 1 1 109 109 SER HB3 H 1 2.809 0.011 . 1 . . . . . 109 SER HB3 . 27159 1 1098 . 1 1 109 109 SER C C 13 174.682 0 . 1 . . . . . 109 SER C . 27159 1 1099 . 1 1 109 109 SER CA C 13 55.075 0.127 . 1 . . . . . 109 SER CA . 27159 1 1100 . 1 1 109 109 SER CB C 13 65.334 0.136 . 1 . . . . . 109 SER CB . 27159 1 1101 . 1 1 109 109 SER N N 15 118.409 0.086 . 1 . . . . . 109 SER N . 27159 1 1102 . 1 1 110 110 MET H H 1 8.123 0.004 . 1 . . . . . 110 MET H . 27159 1 1103 . 1 1 110 110 MET HA H 1 5.419 0.015 . 1 . . . . . 110 MET HA . 27159 1 1104 . 1 1 110 110 MET HB2 H 1 2.577 0.011 . 1 . . . . . 110 MET HB2 . 27159 1 1105 . 1 1 110 110 MET HB3 H 1 2.764 0 . 1 . . . . . 110 MET HB3 . 27159 1 1106 . 1 1 110 110 MET HG2 H 1 2.817 0.02 . 1 . . . . . 110 MET HG2 . 27159 1 1107 . 1 1 110 110 MET HG3 H 1 2.566 0 . 1 . . . . . 110 MET HG3 . 27159 1 1108 . 1 1 110 110 MET C C 13 177.852 0 . 1 . . . . . 110 MET C . 27159 1 1109 . 1 1 110 110 MET CA C 13 53.735 0.116 . 1 . . . . . 110 MET CA . 27159 1 1110 . 1 1 110 110 MET CB C 13 31.416 0.323 . 1 . . . . . 110 MET CB . 27159 1 1111 . 1 1 110 110 MET CG C 13 32.465 0.024 . 1 . . . . . 110 MET CG . 27159 1 1112 . 1 1 110 110 MET N N 15 122.474 0.057 . 1 . . . . . 110 MET N . 27159 1 1113 . 1 1 111 111 ALA H H 1 8.022 0.004 . 1 . . . . . 111 ALA H . 27159 1 1114 . 1 1 111 111 ALA HA H 1 4.254 0 . 1 . . . . . 111 ALA HA . 27159 1 1115 . 1 1 111 111 ALA HB1 H 1 1.137 0.008 . 1 . . . . . 111 ALA MB . 27159 1 1116 . 1 1 111 111 ALA HB2 H 1 1.137 0.008 . 1 . . . . . 111 ALA MB . 27159 1 1117 . 1 1 111 111 ALA HB3 H 1 1.137 0.008 . 1 . . . . . 111 ALA MB . 27159 1 1118 . 1 1 111 111 ALA C C 13 175.21 0 . 1 . . . . . 111 ALA C . 27159 1 1119 . 1 1 111 111 ALA CA C 13 51.84 0.219 . 1 . . . . . 111 ALA CA . 27159 1 1120 . 1 1 111 111 ALA CB C 13 19.503 0.059 . 1 . . . . . 111 ALA CB . 27159 1 1121 . 1 1 111 111 ALA N N 15 126.868 0.061 . 1 . . . . . 111 ALA N . 27159 1 1122 . 1 1 112 112 ASN H H 1 8.195 0.005 . 1 . . . . . 112 ASN H . 27159 1 1123 . 1 1 112 112 ASN HA H 1 4.621 0.004 . 1 . . . . . 112 ASN HA . 27159 1 1124 . 1 1 112 112 ASN HB2 H 1 2.925 0 . 1 . . . . . 112 ASN HB2 . 27159 1 1125 . 1 1 112 112 ASN HB3 H 1 3.309 0 . 1 . . . . . 112 ASN HB3 . 27159 1 1126 . 1 1 112 112 ASN C C 13 173.888 0 . 1 . . . . . 112 ASN C . 27159 1 1127 . 1 1 112 112 ASN CA C 13 54.168 0.125 . 1 . . . . . 112 ASN CA . 27159 1 1128 . 1 1 112 112 ASN CB C 13 40.512 0.019 . 1 . . . . . 112 ASN CB . 27159 1 1129 . 1 1 112 112 ASN N N 15 113.884 0.05 . 1 . . . . . 112 ASN N . 27159 1 1130 . 1 1 113 113 ALA H H 1 8.819 0.004 . 1 . . . . . 113 ALA H . 27159 1 1131 . 1 1 113 113 ALA HA H 1 4.832 0 . 1 . . . . . 113 ALA HA . 27159 1 1132 . 1 1 113 113 ALA HB1 H 1 1.361 0.001 . 1 . . . . . 113 ALA MB . 27159 1 1133 . 1 1 113 113 ALA HB2 H 1 1.361 0.001 . 1 . . . . . 113 ALA MB . 27159 1 1134 . 1 1 113 113 ALA HB3 H 1 1.361 0.001 . 1 . . . . . 113 ALA MB . 27159 1 1135 . 1 1 113 113 ALA C C 13 176.888 0 . 1 . . . . . 113 ALA C . 27159 1 1136 . 1 1 113 113 ALA CA C 13 50.649 0.208 . 1 . . . . . 113 ALA CA . 27159 1 1137 . 1 1 113 113 ALA CB C 13 19.301 0.04 . 1 . . . . . 113 ALA CB . 27159 1 1138 . 1 1 113 113 ALA N N 15 123.449 0.051 . 1 . . . . . 113 ALA N . 27159 1 1139 . 1 1 114 114 GLY H H 1 8.127 0.004 . 1 . . . . . 114 GLY H . 27159 1 1140 . 1 1 114 114 GLY HA2 H 1 4.65 0 . 1 . . . . . 114 GLY HA2 . 27159 1 1141 . 1 1 114 114 GLY HA3 H 1 3.771 0 . 1 . . . . . 114 GLY HA3 . 27159 1 1142 . 1 1 114 114 GLY CA C 13 43.609 0 . 1 . . . . . 114 GLY CA . 27159 1 1143 . 1 1 114 114 GLY N N 15 109.197 0.052 . 1 . . . . . 114 GLY N . 27159 1 1144 . 1 1 115 115 PRO HA H 1 4.386 0 . 1 . . . . . 115 PRO HA . 27159 1 1145 . 1 1 115 115 PRO HB2 H 1 2.329 0 . 1 . . . . . 115 PRO HB2 . 27159 1 1146 . 1 1 115 115 PRO HB3 H 1 1.86 0.002 . 1 . . . . . 115 PRO HB3 . 27159 1 1147 . 1 1 115 115 PRO HD2 H 1 3.993 0 . 1 . . . . . 115 PRO HD2 . 27159 1 1148 . 1 1 115 115 PRO HD3 H 1 3.74 0 . 1 . . . . . 115 PRO HD3 . 27159 1 1149 . 1 1 115 115 PRO C C 13 176.287 0 . 1 . . . . . 115 PRO C . 27159 1 1150 . 1 1 115 115 PRO CA C 13 64.005 0.044 . 1 . . . . . 115 PRO CA . 27159 1 1151 . 1 1 115 115 PRO CB C 13 32.158 0.099 . 1 . . . . . 115 PRO CB . 27159 1 1152 . 1 1 115 115 PRO CD C 13 51.027 0.16 . 1 . . . . . 115 PRO CD . 27159 1 1153 . 1 1 116 116 ASN H H 1 8.874 0.004 . 1 . . . . . 116 ASN H . 27159 1 1154 . 1 1 116 116 ASN HA H 1 4.115 0 . 1 . . . . . 116 ASN HA . 27159 1 1155 . 1 1 116 116 ASN HB2 H 1 3.168 0 . 1 . . . . . 116 ASN HB2 . 27159 1 1156 . 1 1 116 116 ASN HB3 H 1 2.719 0 . 1 . . . . . 116 ASN HB3 . 27159 1 1157 . 1 1 116 116 ASN C C 13 174.874 0 . 1 . . . . . 116 ASN C . 27159 1 1158 . 1 1 116 116 ASN CA C 13 54.535 0.12 . 1 . . . . . 116 ASN CA . 27159 1 1159 . 1 1 116 116 ASN CB C 13 37.081 0.117 . 1 . . . . . 116 ASN CB . 27159 1 1160 . 1 1 116 116 ASN N N 15 118.79 0.046 . 1 . . . . . 116 ASN N . 27159 1 1161 . 1 1 117 117 THR H H 1 10.145 0.005 . 1 . . . . . 117 THR H . 27159 1 1162 . 1 1 117 117 THR HA H 1 4.473 0.015 . 1 . . . . . 117 THR HA . 27159 1 1163 . 1 1 117 117 THR HB H 1 4.454 0.011 . 1 . . . . . 117 THR HB . 27159 1 1164 . 1 1 117 117 THR HG21 H 1 0.945 0.002 . 1 . . . . . 117 THR MG . 27159 1 1165 . 1 1 117 117 THR HG22 H 1 0.945 0.002 . 1 . . . . . 117 THR MG . 27159 1 1166 . 1 1 117 117 THR HG23 H 1 0.945 0.002 . 1 . . . . . 117 THR MG . 27159 1 1167 . 1 1 117 117 THR C C 13 173.567 0 . 1 . . . . . 117 THR C . 27159 1 1168 . 1 1 117 117 THR CA C 13 60.289 0.075 . 1 . . . . . 117 THR CA . 27159 1 1169 . 1 1 117 117 THR CB C 13 68.854 0.266 . 1 . . . . . 117 THR CB . 27159 1 1170 . 1 1 117 117 THR CG2 C 13 21.273 0.076 . 1 . . . . . 117 THR CG2 . 27159 1 1171 . 1 1 117 117 THR N N 15 110.046 0.112 . 1 . . . . . 117 THR N . 27159 1 1172 . 1 1 118 118 ASN H H 1 7.311 0.003 . 1 . . . . . 118 ASN H . 27159 1 1173 . 1 1 118 118 ASN HA H 1 4.223 0 . 1 . . . . . 118 ASN HA . 27159 1 1174 . 1 1 118 118 ASN HB2 H 1 1.513 0.016 . 1 . . . . . 118 ASN HB2 . 27159 1 1175 . 1 1 118 118 ASN HB3 H 1 0.843 0.008 . 1 . . . . . 118 ASN HB3 . 27159 1 1176 . 1 1 118 118 ASN C C 13 173.984 0 . 1 . . . . . 118 ASN C . 27159 1 1177 . 1 1 118 118 ASN CA C 13 55.955 0.099 . 1 . . . . . 118 ASN CA . 27159 1 1178 . 1 1 118 118 ASN CB C 13 39.414 0.021 . 1 . . . . . 118 ASN CB . 27159 1 1179 . 1 1 118 118 ASN N N 15 120.393 0.06 . 1 . . . . . 118 ASN N . 27159 1 1180 . 1 1 119 119 GLY H H 1 9.085 0.005 . 1 . . . . . 119 GLY H . 27159 1 1181 . 1 1 119 119 GLY HA2 H 1 3.682 0.027 . 1 . . . . . 119 GLY HA2 . 27159 1 1182 . 1 1 119 119 GLY HA3 H 1 4.621 0.004 . 1 . . . . . 119 GLY HA3 . 27159 1 1183 . 1 1 119 119 GLY C C 13 171.297 0 . 1 . . . . . 119 GLY C . 27159 1 1184 . 1 1 119 119 GLY CA C 13 45.789 0.081 . 1 . . . . . 119 GLY CA . 27159 1 1185 . 1 1 119 119 GLY N N 15 110.827 0.045 . 1 . . . . . 119 GLY N . 27159 1 1186 . 1 1 120 120 SER H H 1 8.763 0.004 . 1 . . . . . 120 SER H . 27159 1 1187 . 1 1 120 120 SER HA H 1 4.775 0 . 1 . . . . . 120 SER HA . 27159 1 1188 . 1 1 120 120 SER HB2 H 1 4.188 0 . 1 . . . . . 120 SER HB2 . 27159 1 1189 . 1 1 120 120 SER HB3 H 1 4.201 0.015 . 1 . . . . . 120 SER HB3 . 27159 1 1190 . 1 1 120 120 SER C C 13 175.942 0 . 1 . . . . . 120 SER C . 27159 1 1191 . 1 1 120 120 SER CA C 13 57.824 0.068 . 1 . . . . . 120 SER CA . 27159 1 1192 . 1 1 120 120 SER CB C 13 66.46 0.052 . 1 . . . . . 120 SER CB . 27159 1 1193 . 1 1 120 120 SER N N 15 117.307 0.031 . 1 . . . . . 120 SER N . 27159 1 1194 . 1 1 121 121 GLN H H 1 8.403 0.002 . 1 . . . . . 121 GLN H . 27159 1 1195 . 1 1 121 121 GLN HA H 1 5.24 0.013 . 1 . . . . . 121 GLN HA . 27159 1 1196 . 1 1 121 121 GLN HB2 H 1 2.466 0 . 1 . . . . . 121 GLN HB2 . 27159 1 1197 . 1 1 121 121 GLN HB3 H 1 1.882 0 . 1 . . . . . 121 GLN HB3 . 27159 1 1198 . 1 1 121 121 GLN HG2 H 1 2.432 0 . 1 . . . . . 121 GLN HG2 . 27159 1 1199 . 1 1 121 121 GLN HG3 H 1 2.141 0 . 1 . . . . . 121 GLN HG3 . 27159 1 1200 . 1 1 121 121 GLN C C 13 175.017 0 . 1 . . . . . 121 GLN C . 27159 1 1201 . 1 1 121 121 GLN CA C 13 57.569 0.093 . 1 . . . . . 121 GLN CA . 27159 1 1202 . 1 1 121 121 GLN CB C 13 32.259 0.013 . 1 . . . . . 121 GLN CB . 27159 1 1203 . 1 1 121 121 GLN CG C 13 35.794 0.22 . 1 . . . . . 121 GLN CG . 27159 1 1204 . 1 1 121 121 GLN N N 15 124.373 0.061 . 1 . . . . . 121 GLN N . 27159 1 1205 . 1 1 122 122 PHE H H 1 8.086 0.003 . 1 . . . . . 122 PHE H . 27159 1 1206 . 1 1 122 122 PHE HA H 1 5.814 0.006 . 1 . . . . . 122 PHE HA . 27159 1 1207 . 1 1 122 122 PHE HB2 H 1 3.332 0.011 . 1 . . . . . 122 PHE HB2 . 27159 1 1208 . 1 1 122 122 PHE HB3 H 1 3.316 0 . 1 . . . . . 122 PHE HB3 . 27159 1 1209 . 1 1 122 122 PHE C C 13 172.073 0 . 1 . . . . . 122 PHE C . 27159 1 1210 . 1 1 122 122 PHE CA C 13 55.322 0.122 . 1 . . . . . 122 PHE CA . 27159 1 1211 . 1 1 122 122 PHE CB C 13 43.6 0.021 . 1 . . . . . 122 PHE CB . 27159 1 1212 . 1 1 122 122 PHE N N 15 118.587 0.076 . 1 . . . . . 122 PHE N . 27159 1 1213 . 1 1 123 123 PHE H H 1 9.783 0.002 . 1 . . . . . 123 PHE H . 27159 1 1214 . 1 1 123 123 PHE HA H 1 5.677 0 . 1 . . . . . 123 PHE HA . 27159 1 1215 . 1 1 123 123 PHE HB2 H 1 2.857 0.004 . 1 . . . . . 123 PHE HB2 . 27159 1 1216 . 1 1 123 123 PHE HB3 H 1 2.86 0 . 1 . . . . . 123 PHE HB3 . 27159 1 1217 . 1 1 123 123 PHE C C 13 174.627 0 . 1 . . . . . 123 PHE C . 27159 1 1218 . 1 1 123 123 PHE CA C 13 54.64 0.124 . 1 . . . . . 123 PHE CA . 27159 1 1219 . 1 1 123 123 PHE CB C 13 42.996 0.146 . 1 . . . . . 123 PHE CB . 27159 1 1220 . 1 1 123 123 PHE N N 15 116.606 0.027 . 1 . . . . . 123 PHE N . 27159 1 1221 . 1 1 124 124 ILE H H 1 8.923 0.004 . 1 . . . . . 124 ILE H . 27159 1 1222 . 1 1 124 124 ILE HA H 1 4.904 0.015 . 1 . . . . . 124 ILE HA . 27159 1 1223 . 1 1 124 124 ILE HB H 1 1.639 0.012 . 1 . . . . . 124 ILE HB . 27159 1 1224 . 1 1 124 124 ILE HG12 H 1 1.808 0 . 1 . . . . . 124 ILE HG12 . 27159 1 1225 . 1 1 124 124 ILE HG13 H 1 0.881 0.008 . 1 . . . . . 124 ILE HG13 . 27159 1 1226 . 1 1 124 124 ILE HG21 H 1 0.713 0.005 . 1 . . . . . 124 ILE MG . 27159 1 1227 . 1 1 124 124 ILE HG22 H 1 0.713 0.005 . 1 . . . . . 124 ILE MG . 27159 1 1228 . 1 1 124 124 ILE HG23 H 1 0.713 0.005 . 1 . . . . . 124 ILE MG . 27159 1 1229 . 1 1 124 124 ILE HD11 H 1 0.988 0.003 . 1 . . . . . 124 ILE MD . 27159 1 1230 . 1 1 124 124 ILE HD12 H 1 0.988 0.003 . 1 . . . . . 124 ILE MD . 27159 1 1231 . 1 1 124 124 ILE HD13 H 1 0.988 0.003 . 1 . . . . . 124 ILE MD . 27159 1 1232 . 1 1 124 124 ILE C C 13 177.343 0 . 1 . . . . . 124 ILE C . 27159 1 1233 . 1 1 124 124 ILE CA C 13 60.222 0.072 . 1 . . . . . 124 ILE CA . 27159 1 1234 . 1 1 124 124 ILE CB C 13 40.483 0.155 . 1 . . . . . 124 ILE CB . 27159 1 1235 . 1 1 124 124 ILE CG1 C 13 27.677 0.06 . 1 . . . . . 124 ILE CG1 . 27159 1 1236 . 1 1 124 124 ILE CG2 C 13 17.508 0.045 . 1 . . . . . 124 ILE CG2 . 27159 1 1237 . 1 1 124 124 ILE CD1 C 13 13.769 0.161 . 1 . . . . . 124 ILE CD1 . 27159 1 1238 . 1 1 124 124 ILE N N 15 118.497 0.043 . 1 . . . . . 124 ILE N . 27159 1 1239 . 1 1 125 125 CYS H H 1 9.228 0.004 . 1 . . . . . 125 CYS H . 27159 1 1240 . 1 1 125 125 CYS HA H 1 4.806 0.001 . 1 . . . . . 125 CYS HA . 27159 1 1241 . 1 1 125 125 CYS HB2 H 1 3.493 0 . 1 . . . . . 125 CYS HB2 . 27159 1 1242 . 1 1 125 125 CYS HB3 H 1 3.018 0.006 . 1 . . . . . 125 CYS HB3 . 27159 1 1243 . 1 1 125 125 CYS C C 13 176.826 0 . 1 . . . . . 125 CYS C . 27159 1 1244 . 1 1 125 125 CYS CA C 13 60.098 0.068 . 1 . . . . . 125 CYS CA . 27159 1 1245 . 1 1 125 125 CYS CB C 13 29.207 0.142 . 1 . . . . . 125 CYS CB . 27159 1 1246 . 1 1 125 125 CYS N N 15 126.071 0.063 . 1 . . . . . 125 CYS N . 27159 1 1247 . 1 1 126 126 THR H H 1 9.02 0.002 . 1 . . . . . 126 THR H . 27159 1 1248 . 1 1 126 126 THR HA H 1 4.2 0.011 . 1 . . . . . 126 THR HA . 27159 1 1249 . 1 1 126 126 THR HB H 1 4.346 0.004 . 1 . . . . . 126 THR HB . 27159 1 1250 . 1 1 126 126 THR HG21 H 1 0.983 0.003 . 1 . . . . . 126 THR MG . 27159 1 1251 . 1 1 126 126 THR HG22 H 1 0.983 0.003 . 1 . . . . . 126 THR MG . 27159 1 1252 . 1 1 126 126 THR HG23 H 1 0.983 0.003 . 1 . . . . . 126 THR MG . 27159 1 1253 . 1 1 126 126 THR C C 13 172.387 0 . 1 . . . . . 126 THR C . 27159 1 1254 . 1 1 126 126 THR CA C 13 62.703 0.077 . 1 . . . . . 126 THR CA . 27159 1 1255 . 1 1 126 126 THR CB C 13 67.741 0.204 . 1 . . . . . 126 THR CB . 27159 1 1256 . 1 1 126 126 THR CG2 C 13 23.187 0 . 1 . . . . . 126 THR CG2 . 27159 1 1257 . 1 1 126 126 THR N N 15 116.209 0.059 . 1 . . . . . 126 THR N . 27159 1 1258 . 1 1 127 127 VAL H H 1 7.521 0.002 . 1 . . . . . 127 VAL H . 27159 1 1259 . 1 1 127 127 VAL HA H 1 4.662 0.002 . 1 . . . . . 127 VAL HA . 27159 1 1260 . 1 1 127 127 VAL HB H 1 2.376 0.004 . 1 . . . . . 127 VAL HB . 27159 1 1261 . 1 1 127 127 VAL HG11 H 1 0.951 0.003 . 1 . . . . . 127 VAL MG1 . 27159 1 1262 . 1 1 127 127 VAL HG12 H 1 0.951 0.003 . 1 . . . . . 127 VAL MG1 . 27159 1 1263 . 1 1 127 127 VAL HG13 H 1 0.951 0.003 . 1 . . . . . 127 VAL MG1 . 27159 1 1264 . 1 1 127 127 VAL CA C 13 58.19 0.127 . 1 . . . . . 127 VAL CA . 27159 1 1265 . 1 1 127 127 VAL CB C 13 34.461 0.127 . 1 . . . . . 127 VAL CB . 27159 1 1266 . 1 1 127 127 VAL CG1 C 13 22.601 0.023 . 1 . . . . . 127 VAL CG1 . 27159 1 1267 . 1 1 127 127 VAL N N 15 113.702 0.095 . 1 . . . . . 127 VAL N . 27159 1 1268 . 1 1 128 128 PRO HA H 1 4.228 0.006 . 1 . . . . . 128 PRO HA . 27159 1 1269 . 1 1 128 128 PRO HB2 H 1 2.149 0 . 1 . . . . . 128 PRO HB2 . 27159 1 1270 . 1 1 128 128 PRO HG2 H 1 1.657 0 . 1 . . . . . 128 PRO HG2 . 27159 1 1271 . 1 1 128 128 PRO HD2 H 1 3.737 0 . 1 . . . . . 128 PRO HD2 . 27159 1 1272 . 1 1 128 128 PRO HD3 H 1 3.517 0 . 1 . . . . . 128 PRO HD3 . 27159 1 1273 . 1 1 128 128 PRO C C 13 176.468 0 . 1 . . . . . 128 PRO C . 27159 1 1274 . 1 1 128 128 PRO CA C 13 63.63 0.119 . 1 . . . . . 128 PRO CA . 27159 1 1275 . 1 1 128 128 PRO CB C 13 31.416 0.378 . 1 . . . . . 128 PRO CB . 27159 1 1276 . 1 1 128 128 PRO CG C 13 27.149 0 . 1 . . . . . 128 PRO CG . 27159 1 1277 . 1 1 129 129 CYS H H 1 8.103 0.003 . 1 . . . . . 129 CYS H . 27159 1 1278 . 1 1 129 129 CYS HA H 1 4.077 0 . 1 . . . . . 129 CYS HA . 27159 1 1279 . 1 1 129 129 CYS HB2 H 1 2.218 0.002 . 1 . . . . . 129 CYS HB2 . 27159 1 1280 . 1 1 129 129 CYS HB3 H 1 1.412 0.001 . 1 . . . . . 129 CYS HB3 . 27159 1 1281 . 1 1 129 129 CYS C C 13 175.379 0 . 1 . . . . . 129 CYS C . 27159 1 1282 . 1 1 129 129 CYS CA C 13 55.863 0.14 . 1 . . . . . 129 CYS CA . 27159 1 1283 . 1 1 129 129 CYS CB C 13 28.336 0.084 . 1 . . . . . 129 CYS CB . 27159 1 1284 . 1 1 129 129 CYS N N 15 122.967 0.059 . 1 . . . . . 129 CYS N . 27159 1 1285 . 1 1 130 130 SER H H 1 8.849 0.001 . 1 . . . . . 130 SER H . 27159 1 1286 . 1 1 130 130 SER HA H 1 4.18 0.012 . 1 . . . . . 130 SER HA . 27159 1 1287 . 1 1 130 130 SER HB2 H 1 4.047 0.005 . 1 . . . . . 130 SER HB2 . 27159 1 1288 . 1 1 130 130 SER C C 13 176.086 0.154 . 1 . . . . . 130 SER C . 27159 1 1289 . 1 1 130 130 SER CA C 13 61.398 0.067 . 1 . . . . . 130 SER CA . 27159 1 1290 . 1 1 130 130 SER CB C 13 62.88 0.06 . 1 . . . . . 130 SER CB . 27159 1 1291 . 1 1 130 130 SER N N 15 119.464 0.038 . 1 . . . . . 130 SER N . 27159 1 1292 . 1 1 131 131 TRP H H 1 7.352 0.002 . 1 . . . . . 131 TRP H . 27159 1 1293 . 1 1 131 131 TRP HA H 1 4.646 0.026 . 1 . . . . . 131 TRP HA . 27159 1 1294 . 1 1 131 131 TRP HB2 H 1 3.442 0.002 . 1 . . . . . 131 TRP HB2 . 27159 1 1295 . 1 1 131 131 TRP HB3 H 1 3.354 0 . 1 . . . . . 131 TRP HB3 . 27159 1 1296 . 1 1 131 131 TRP HE1 H 1 9.756 0 . 1 . . . . . 131 TRP HE1 . 27159 1 1297 . 1 1 131 131 TRP C C 13 176.497 0 . 1 . . . . . 131 TRP C . 27159 1 1298 . 1 1 131 131 TRP CA C 13 59.661 0.031 . 1 . . . . . 131 TRP CA . 27159 1 1299 . 1 1 131 131 TRP CB C 13 27.332 0.028 . 1 . . . . . 131 TRP CB . 27159 1 1300 . 1 1 131 131 TRP N N 15 119.317 0.095 . 1 . . . . . 131 TRP N . 27159 1 1301 . 1 1 131 131 TRP NE1 N 15 129.867 0 . 1 . . . . . 131 TRP NE1 . 27159 1 1302 . 1 1 132 132 LEU H H 1 7.239 0.006 . 1 . . . . . 132 LEU H . 27159 1 1303 . 1 1 132 132 LEU HA H 1 4.239 0 . 1 . . . . . 132 LEU HA . 27159 1 1304 . 1 1 132 132 LEU HB2 H 1 0.937 0.01 . 1 . . . . . 132 LEU HB2 . 27159 1 1305 . 1 1 132 132 LEU HB3 H 1 0.491 0.013 . 1 . . . . . 132 LEU HB3 . 27159 1 1306 . 1 1 132 132 LEU HG H 1 0.338 0.01 . 1 . . . . . 132 LEU HG . 27159 1 1307 . 1 1 132 132 LEU HD11 H 1 0.645 0 . 1 . . . . . 132 LEU MD1 . 27159 1 1308 . 1 1 132 132 LEU HD12 H 1 0.645 0 . 1 . . . . . 132 LEU MD1 . 27159 1 1309 . 1 1 132 132 LEU HD13 H 1 0.645 0 . 1 . . . . . 132 LEU MD1 . 27159 1 1310 . 1 1 132 132 LEU C C 13 177.663 0 . 1 . . . . . 132 LEU C . 27159 1 1311 . 1 1 132 132 LEU CA C 13 55.009 0.106 . 1 . . . . . 132 LEU CA . 27159 1 1312 . 1 1 132 132 LEU CB C 13 39.163 0.097 . 1 . . . . . 132 LEU CB . 27159 1 1313 . 1 1 132 132 LEU CG C 13 26.183 0.025 . 1 . . . . . 132 LEU CG . 27159 1 1314 . 1 1 132 132 LEU CD1 C 13 21.788 0.017 . 1 . . . . . 132 LEU CD1 . 27159 1 1315 . 1 1 132 132 LEU N N 15 120.376 0.07 . 1 . . . . . 132 LEU N . 27159 1 1316 . 1 1 133 133 ASP H H 1 7.531 0.001 . 1 . . . . . 133 ASP H . 27159 1 1317 . 1 1 133 133 ASP HA H 1 5.027 0.017 . 1 . . . . . 133 ASP HA . 27159 1 1318 . 1 1 133 133 ASP HB2 H 1 2.959 0 . 1 . . . . . 133 ASP HB2 . 27159 1 1319 . 1 1 133 133 ASP HB3 H 1 2.79 0 . 1 . . . . . 133 ASP HB3 . 27159 1 1320 . 1 1 133 133 ASP C C 13 178.081 0 . 1 . . . . . 133 ASP C . 27159 1 1321 . 1 1 133 133 ASP CA C 13 56.264 0.103 . 1 . . . . . 133 ASP CA . 27159 1 1322 . 1 1 133 133 ASP CB C 13 39.233 0.029 . 1 . . . . . 133 ASP CB . 27159 1 1323 . 1 1 133 133 ASP N N 15 121.523 0.053 . 1 . . . . . 133 ASP N . 27159 1 1324 . 1 1 134 134 GLY H H 1 9.487 0.004 . 1 . . . . . 134 GLY H . 27159 1 1325 . 1 1 134 134 GLY HA2 H 1 3.963 0 . 1 . . . . . 134 GLY HA2 . 27159 1 1326 . 1 1 134 134 GLY HA3 H 1 2.917 0 . 1 . . . . . 134 GLY HA3 . 27159 1 1327 . 1 1 134 134 GLY C C 13 172.451 0 . 1 . . . . . 134 GLY C . 27159 1 1328 . 1 1 134 134 GLY CA C 13 45.147 0.076 . 1 . . . . . 134 GLY CA . 27159 1 1329 . 1 1 134 134 GLY N N 15 110.621 0.035 . 1 . . . . . 134 GLY N . 27159 1 1330 . 1 1 135 135 LYS H H 1 7.672 0.004 . 1 . . . . . 135 LYS H . 27159 1 1331 . 1 1 135 135 LYS HA H 1 4.211 0.005 . 1 . . . . . 135 LYS HA . 27159 1 1332 . 1 1 135 135 LYS HB2 H 1 1.843 0.006 . 1 . . . . . 135 LYS HB2 . 27159 1 1333 . 1 1 135 135 LYS HB3 H 1 1.717 0 . 1 . . . . . 135 LYS HB3 . 27159 1 1334 . 1 1 135 135 LYS HG2 H 1 1.255 0.011 . 1 . . . . . 135 LYS HG2 . 27159 1 1335 . 1 1 135 135 LYS HG3 H 1 1.267 0 . 1 . . . . . 135 LYS HG3 . 27159 1 1336 . 1 1 135 135 LYS HD2 H 1 1.711 0 . 1 . . . . . 135 LYS HD2 . 27159 1 1337 . 1 1 135 135 LYS HD3 H 1 1.718 0 . 1 . . . . . 135 LYS HD3 . 27159 1 1338 . 1 1 135 135 LYS HE2 H 1 3.027 0 . 1 . . . . . 135 LYS HE2 . 27159 1 1339 . 1 1 135 135 LYS HE3 H 1 3.058 0 . 1 . . . . . 135 LYS HE3 . 27159 1 1340 . 1 1 135 135 LYS C C 13 175.474 0 . 1 . . . . . 135 LYS C . 27159 1 1341 . 1 1 135 135 LYS CA C 13 56.322 0.107 . 1 . . . . . 135 LYS CA . 27159 1 1342 . 1 1 135 135 LYS CB C 13 35.397 0.037 . 1 . . . . . 135 LYS CB . 27159 1 1343 . 1 1 135 135 LYS CG C 13 25.215 0.012 . 1 . . . . . 135 LYS CG . 27159 1 1344 . 1 1 135 135 LYS CD C 13 29.176 0.105 . 1 . . . . . 135 LYS CD . 27159 1 1345 . 1 1 135 135 LYS CE C 13 42.408 0 . 1 . . . . . 135 LYS CE . 27159 1 1346 . 1 1 135 135 LYS N N 15 115.232 0.035 . 1 . . . . . 135 LYS N . 27159 1 1347 . 1 1 136 136 HIS H H 1 7.446 0.004 . 1 . . . . . 136 HIS H . 27159 1 1348 . 1 1 136 136 HIS HA H 1 4.029 0 . 1 . . . . . 136 HIS HA . 27159 1 1349 . 1 1 136 136 HIS HB2 H 1 3.308 0.003 . 1 . . . . . 136 HIS HB2 . 27159 1 1350 . 1 1 136 136 HIS HB3 H 1 4.058 0 . 1 . . . . . 136 HIS HB3 . 27159 1 1351 . 1 1 136 136 HIS C C 13 174.226 0 . 1 . . . . . 136 HIS C . 27159 1 1352 . 1 1 136 136 HIS CA C 13 54.964 0.114 . 1 . . . . . 136 HIS CA . 27159 1 1353 . 1 1 136 136 HIS CB C 13 31.994 0.03 . 1 . . . . . 136 HIS CB . 27159 1 1354 . 1 1 136 136 HIS N N 15 118.89 0.04 . 1 . . . . . 136 HIS N . 27159 1 1355 . 1 1 137 137 VAL H H 1 8.704 0.003 . 1 . . . . . 137 VAL H . 27159 1 1356 . 1 1 137 137 VAL HA H 1 3.972 0.007 . 1 . . . . . 137 VAL HA . 27159 1 1357 . 1 1 137 137 VAL HG11 H 1 0.847 0 . 1 . . . . . 137 VAL MG1 . 27159 1 1358 . 1 1 137 137 VAL HG12 H 1 0.847 0 . 1 . . . . . 137 VAL MG1 . 27159 1 1359 . 1 1 137 137 VAL HG13 H 1 0.847 0 . 1 . . . . . 137 VAL MG1 . 27159 1 1360 . 1 1 137 137 VAL HG21 H 1 1.151 0 . 1 . . . . . 137 VAL MG2 . 27159 1 1361 . 1 1 137 137 VAL HG22 H 1 1.151 0 . 1 . . . . . 137 VAL MG2 . 27159 1 1362 . 1 1 137 137 VAL HG23 H 1 1.151 0 . 1 . . . . . 137 VAL MG2 . 27159 1 1363 . 1 1 137 137 VAL C C 13 174.736 0 . 1 . . . . . 137 VAL C . 27159 1 1364 . 1 1 137 137 VAL CA C 13 64.383 0.121 . 1 . . . . . 137 VAL CA . 27159 1 1365 . 1 1 137 137 VAL CB C 13 33.226 0 . 1 . . . . . 137 VAL CB . 27159 1 1366 . 1 1 137 137 VAL CG1 C 13 22.028 0 . 1 . . . . . 137 VAL CG1 . 27159 1 1367 . 1 1 137 137 VAL CG2 C 13 21.49 0 . 1 . . . . . 137 VAL CG2 . 27159 1 1368 . 1 1 137 137 VAL N N 15 125.071 0.021 . 1 . . . . . 137 VAL N . 27159 1 1369 . 1 1 138 138 VAL H H 1 8.599 0.003 . 1 . . . . . 138 VAL H . 27159 1 1370 . 1 1 138 138 VAL HA H 1 4.379 0.013 . 1 . . . . . 138 VAL HA . 27159 1 1371 . 1 1 138 138 VAL HB H 1 1.944 0.001 . 1 . . . . . 138 VAL HB . 27159 1 1372 . 1 1 138 138 VAL HG11 H 1 0.982 0.001 . 1 . . . . . 138 VAL MG1 . 27159 1 1373 . 1 1 138 138 VAL HG12 H 1 0.982 0.001 . 1 . . . . . 138 VAL MG1 . 27159 1 1374 . 1 1 138 138 VAL HG13 H 1 0.982 0.001 . 1 . . . . . 138 VAL MG1 . 27159 1 1375 . 1 1 138 138 VAL HG21 H 1 0.22 0.005 . 1 . . . . . 138 VAL MG2 . 27159 1 1376 . 1 1 138 138 VAL HG22 H 1 0.22 0.005 . 1 . . . . . 138 VAL MG2 . 27159 1 1377 . 1 1 138 138 VAL HG23 H 1 0.22 0.005 . 1 . . . . . 138 VAL MG2 . 27159 1 1378 . 1 1 138 138 VAL C C 13 177.643 0 . 1 . . . . . 138 VAL C . 27159 1 1379 . 1 1 138 138 VAL CA C 13 62.836 0.016 . 1 . . . . . 138 VAL CA . 27159 1 1380 . 1 1 138 138 VAL CB C 13 32.391 0.118 . 1 . . . . . 138 VAL CB . 27159 1 1381 . 1 1 138 138 VAL CG1 C 13 22.122 0.039 . 1 . . . . . 138 VAL CG1 . 27159 1 1382 . 1 1 138 138 VAL CG2 C 13 20.227 0.052 . 1 . . . . . 138 VAL CG2 . 27159 1 1383 . 1 1 138 138 VAL N N 15 131.8 0.045 . 1 . . . . . 138 VAL N . 27159 1 1384 . 1 1 139 139 PHE H H 1 7.946 0.007 . 1 . . . . . 139 PHE H . 27159 1 1385 . 1 1 139 139 PHE HA H 1 5.184 0.014 . 1 . . . . . 139 PHE HA . 27159 1 1386 . 1 1 139 139 PHE HB2 H 1 3.231 0.004 . 1 . . . . . 139 PHE HB2 . 27159 1 1387 . 1 1 139 139 PHE HB3 H 1 2.54 0 . 1 . . . . . 139 PHE HB3 . 27159 1 1388 . 1 1 139 139 PHE C C 13 171.719 0 . 1 . . . . . 139 PHE C . 27159 1 1389 . 1 1 139 139 PHE CA C 13 55.74 0.096 . 1 . . . . . 139 PHE CA . 27159 1 1390 . 1 1 139 139 PHE CB C 13 41.256 0.01 . 1 . . . . . 139 PHE CB . 27159 1 1391 . 1 1 139 139 PHE N N 15 119.712 0.058 . 1 . . . . . 139 PHE N . 27159 1 1392 . 1 1 140 140 GLY H H 1 6.928 0.005 . 1 . . . . . 140 GLY H . 27159 1 1393 . 1 1 140 140 GLY HA2 H 1 2.206 0 . 1 . . . . . 140 GLY HA2 . 27159 1 1394 . 1 1 140 140 GLY HA3 H 1 3.527 0.016 . 1 . . . . . 140 GLY HA3 . 27159 1 1395 . 1 1 140 140 GLY C C 13 170.437 0 . 1 . . . . . 140 GLY C . 27159 1 1396 . 1 1 140 140 GLY CA C 13 45.819 0.134 . 1 . . . . . 140 GLY CA . 27159 1 1397 . 1 1 140 140 GLY N N 15 110.611 0.072 . 1 . . . . . 140 GLY N . 27159 1 1398 . 1 1 141 141 ARG H H 1 8.341 0.002 . 1 . . . . . 141 ARG H . 27159 1 1399 . 1 1 141 141 ARG HA H 1 4.948 0.003 . 1 . . . . . 141 ARG HA . 27159 1 1400 . 1 1 141 141 ARG HB2 H 1 1.768 0.002 . 1 . . . . . 141 ARG HB2 . 27159 1 1401 . 1 1 141 141 ARG HB3 H 1 2.012 0 . 1 . . . . . 141 ARG HB3 . 27159 1 1402 . 1 1 141 141 ARG HG2 H 1 1.531 0.011 . 1 . . . . . 141 ARG HG2 . 27159 1 1403 . 1 1 141 141 ARG HG3 H 1 1.153 0 . 1 . . . . . 141 ARG HG3 . 27159 1 1404 . 1 1 141 141 ARG HD2 H 1 3.071 0.009 . 1 . . . . . 141 ARG HD2 . 27159 1 1405 . 1 1 141 141 ARG C C 13 174.693 0 . 1 . . . . . 141 ARG C . 27159 1 1406 . 1 1 141 141 ARG CA C 13 54.721 0.122 . 1 . . . . . 141 ARG CA . 27159 1 1407 . 1 1 141 141 ARG CB C 13 32.838 0.134 . 1 . . . . . 141 ARG CB . 27159 1 1408 . 1 1 141 141 ARG CG C 13 26.222 0.087 . 1 . . . . . 141 ARG CG . 27159 1 1409 . 1 1 141 141 ARG CD C 13 43.603 0.006 . 1 . . . . . 141 ARG CD . 27159 1 1410 . 1 1 141 141 ARG N N 15 113.417 0.027 . 1 . . . . . 141 ARG N . 27159 1 1411 . 1 1 142 142 VAL H H 1 9.054 0.004 . 1 . . . . . 142 VAL H . 27159 1 1412 . 1 1 142 142 VAL HA H 1 3.914 0.009 . 1 . . . . . 142 VAL HA . 27159 1 1413 . 1 1 142 142 VAL HB H 1 1.986 0.014 . 1 . . . . . 142 VAL HB . 27159 1 1414 . 1 1 142 142 VAL HG11 H 1 0.847 0 . 1 . . . . . 142 VAL MG1 . 27159 1 1415 . 1 1 142 142 VAL HG12 H 1 0.847 0 . 1 . . . . . 142 VAL MG1 . 27159 1 1416 . 1 1 142 142 VAL HG13 H 1 0.847 0 . 1 . . . . . 142 VAL MG1 . 27159 1 1417 . 1 1 142 142 VAL HG21 H 1 0.851 0.014 . 1 . . . . . 142 VAL MG2 . 27159 1 1418 . 1 1 142 142 VAL HG22 H 1 0.851 0.014 . 1 . . . . . 142 VAL MG2 . 27159 1 1419 . 1 1 142 142 VAL HG23 H 1 0.851 0.014 . 1 . . . . . 142 VAL MG2 . 27159 1 1420 . 1 1 142 142 VAL C C 13 176.217 0 . 1 . . . . . 142 VAL C . 27159 1 1421 . 1 1 142 142 VAL CA C 13 63.837 0.187 . 1 . . . . . 142 VAL CA . 27159 1 1422 . 1 1 142 142 VAL CB C 13 33.116 0 . 1 . . . . . 142 VAL CB . 27159 1 1423 . 1 1 142 142 VAL CG1 C 13 21.85 0 . 1 . . . . . 142 VAL CG1 . 27159 1 1424 . 1 1 142 142 VAL CG2 C 13 22.12 0.016 . 1 . . . . . 142 VAL CG2 . 27159 1 1425 . 1 1 142 142 VAL N N 15 122.723 0.031 . 1 . . . . . 142 VAL N . 27159 1 1426 . 1 1 143 143 VAL H H 1 9.08 0.005 . 1 . . . . . 143 VAL H . 27159 1 1427 . 1 1 143 143 VAL HA H 1 4.585 0.007 . 1 . . . . . 143 VAL HA . 27159 1 1428 . 1 1 143 143 VAL HB H 1 2.257 0 . 1 . . . . . 143 VAL HB . 27159 1 1429 . 1 1 143 143 VAL HG11 H 1 0.924 0 . 1 . . . . . 143 VAL MG1 . 27159 1 1430 . 1 1 143 143 VAL HG12 H 1 0.924 0 . 1 . . . . . 143 VAL MG1 . 27159 1 1431 . 1 1 143 143 VAL HG13 H 1 0.924 0 . 1 . . . . . 143 VAL MG1 . 27159 1 1432 . 1 1 143 143 VAL HG21 H 1 0.781 0 . 1 . . . . . 143 VAL MG2 . 27159 1 1433 . 1 1 143 143 VAL HG22 H 1 0.781 0 . 1 . . . . . 143 VAL MG2 . 27159 1 1434 . 1 1 143 143 VAL HG23 H 1 0.781 0 . 1 . . . . . 143 VAL MG2 . 27159 1 1435 . 1 1 143 143 VAL C C 13 175.889 0 . 1 . . . . . 143 VAL C . 27159 1 1436 . 1 1 143 143 VAL CA C 13 61.616 0.054 . 1 . . . . . 143 VAL CA . 27159 1 1437 . 1 1 143 143 VAL CB C 13 33.431 0.154 . 1 . . . . . 143 VAL CB . 27159 1 1438 . 1 1 143 143 VAL CG1 C 13 22.72 0 . 1 . . . . . 143 VAL CG1 . 27159 1 1439 . 1 1 143 143 VAL CG2 C 13 19.001 0 . 1 . . . . . 143 VAL CG2 . 27159 1 1440 . 1 1 143 143 VAL N N 15 121.32 0.061 . 1 . . . . . 143 VAL N . 27159 1 1441 . 1 1 144 144 GLU H H 1 7.943 0.003 . 1 . . . . . 144 GLU H . 27159 1 1442 . 1 1 144 144 GLU HA H 1 4.724 0 . 1 . . . . . 144 GLU HA . 27159 1 1443 . 1 1 144 144 GLU HB2 H 1 2.06 0 . 1 . . . . . 144 GLU HB2 . 27159 1 1444 . 1 1 144 144 GLU HB3 H 1 1.857 0 . 1 . . . . . 144 GLU HB3 . 27159 1 1445 . 1 1 144 144 GLU HG2 H 1 2.366 0.003 . 1 . . . . . 144 GLU HG2 . 27159 1 1446 . 1 1 144 144 GLU HG3 H 1 2.207 0.008 . 1 . . . . . 144 GLU HG3 . 27159 1 1447 . 1 1 144 144 GLU C C 13 175.548 0 . 1 . . . . . 144 GLU C . 27159 1 1448 . 1 1 144 144 GLU CA C 13 56.398 0.097 . 1 . . . . . 144 GLU CA . 27159 1 1449 . 1 1 144 144 GLU CB C 13 33.642 0 . 1 . . . . . 144 GLU CB . 27159 1 1450 . 1 1 144 144 GLU CG C 13 36.397 0.031 . 1 . . . . . 144 GLU CG . 27159 1 1451 . 1 1 144 144 GLU N N 15 120.834 0.031 . 1 . . . . . 144 GLU N . 27159 1 1452 . 1 1 145 145 GLY H H 1 8.831 0.004 . 1 . . . . . 145 GLY H . 27159 1 1453 . 1 1 145 145 GLY HA2 H 1 5.013 0.005 . 1 . . . . . 145 GLY HA2 . 27159 1 1454 . 1 1 145 145 GLY HA3 H 1 4.128 0.004 . 1 . . . . . 145 GLY HA3 . 27159 1 1455 . 1 1 145 145 GLY C C 13 177.505 0 . 1 . . . . . 145 GLY C . 27159 1 1456 . 1 1 145 145 GLY CA C 13 46.289 0.082 . 1 . . . . . 145 GLY CA . 27159 1 1457 . 1 1 145 145 GLY N N 15 109.63 0.028 . 1 . . . . . 145 GLY N . 27159 1 1458 . 1 1 146 146 MET H H 1 9 0.002 . 1 . . . . . 146 MET H . 27159 1 1459 . 1 1 146 146 MET HA H 1 4.607 0.001 . 1 . . . . . 146 MET HA . 27159 1 1460 . 1 1 146 146 MET HB2 H 1 2.104 0 . 1 . . . . . 146 MET HB2 . 27159 1 1461 . 1 1 146 146 MET HB3 H 1 2.092 0 . 1 . . . . . 146 MET HB3 . 27159 1 1462 . 1 1 146 146 MET HG2 H 1 2.737 0.01 . 1 . . . . . 146 MET HG2 . 27159 1 1463 . 1 1 146 146 MET HG3 H 1 2.577 0.011 . 1 . . . . . 146 MET HG3 . 27159 1 1464 . 1 1 146 146 MET C C 13 178.72 0 . 1 . . . . . 146 MET C . 27159 1 1465 . 1 1 146 146 MET CA C 13 56.762 0.076 . 1 . . . . . 146 MET CA . 27159 1 1466 . 1 1 146 146 MET CB C 13 29.291 0.164 . 1 . . . . . 146 MET CB . 27159 1 1467 . 1 1 146 146 MET CG C 13 33.07 0.017 . 1 . . . . . 146 MET CG . 27159 1 1468 . 1 1 146 146 MET N N 15 122.059 0.022 . 1 . . . . . 146 MET N . 27159 1 1469 . 1 1 147 147 ASP H H 1 9.201 0.002 . 1 . . . . . 147 ASP H . 27159 1 1470 . 1 1 147 147 ASP HA H 1 4.318 0 . 1 . . . . . 147 ASP HA . 27159 1 1471 . 1 1 147 147 ASP HB2 H 1 2.732 0.004 . 1 . . . . . 147 ASP HB2 . 27159 1 1472 . 1 1 147 147 ASP HB3 H 1 2.726 0 . 1 . . . . . 147 ASP HB3 . 27159 1 1473 . 1 1 147 147 ASP C C 13 178.229 0 . 1 . . . . . 147 ASP C . 27159 1 1474 . 1 1 147 147 ASP CA C 13 56.877 0.091 . 1 . . . . . 147 ASP CA . 27159 1 1475 . 1 1 147 147 ASP CB C 13 39.151 0.127 . 1 . . . . . 147 ASP CB . 27159 1 1476 . 1 1 147 147 ASP N N 15 116.985 0.021 . 1 . . . . . 147 ASP N . 27159 1 1477 . 1 1 148 148 VAL H H 1 7.595 0.002 . 1 . . . . . 148 VAL H . 27159 1 1478 . 1 1 148 148 VAL HA H 1 3.702 0.008 . 1 . . . . . 148 VAL HA . 27159 1 1479 . 1 1 148 148 VAL HB H 1 2.453 0 . 1 . . . . . 148 VAL HB . 27159 1 1480 . 1 1 148 148 VAL HG11 H 1 1.014 0 . 1 . . . . . 148 VAL MG1 . 27159 1 1481 . 1 1 148 148 VAL HG12 H 1 1.014 0 . 1 . . . . . 148 VAL MG1 . 27159 1 1482 . 1 1 148 148 VAL HG13 H 1 1.014 0 . 1 . . . . . 148 VAL MG1 . 27159 1 1483 . 1 1 148 148 VAL HG21 H 1 0.716 0 . 1 . . . . . 148 VAL MG2 . 27159 1 1484 . 1 1 148 148 VAL HG22 H 1 0.716 0 . 1 . . . . . 148 VAL MG2 . 27159 1 1485 . 1 1 148 148 VAL HG23 H 1 0.716 0 . 1 . . . . . 148 VAL MG2 . 27159 1 1486 . 1 1 148 148 VAL C C 13 178.21 0 . 1 . . . . . 148 VAL C . 27159 1 1487 . 1 1 148 148 VAL CA C 13 65.459 0.124 . 1 . . . . . 148 VAL CA . 27159 1 1488 . 1 1 148 148 VAL CB C 13 31.17 0 . 1 . . . . . 148 VAL CB . 27159 1 1489 . 1 1 148 148 VAL CG1 C 13 21.156 0.053 . 1 . . . . . 148 VAL CG1 . 27159 1 1490 . 1 1 148 148 VAL CG2 C 13 20.244 0.046 . 1 . . . . . 148 VAL CG2 . 27159 1 1491 . 1 1 148 148 VAL N N 15 125.154 0.026 . 1 . . . . . 148 VAL N . 27159 1 1492 . 1 1 149 149 VAL H H 1 7.439 0.004 . 1 . . . . . 149 VAL H . 27159 1 1493 . 1 1 149 149 VAL HA H 1 3.455 0.002 . 1 . . . . . 149 VAL HA . 27159 1 1494 . 1 1 149 149 VAL HB H 1 2.588 0 . 1 . . . . . 149 VAL HB . 27159 1 1495 . 1 1 149 149 VAL HG11 H 1 1.157 0.006 . 1 . . . . . 149 VAL MG1 . 27159 1 1496 . 1 1 149 149 VAL HG12 H 1 1.157 0.006 . 1 . . . . . 149 VAL MG1 . 27159 1 1497 . 1 1 149 149 VAL HG13 H 1 1.157 0.006 . 1 . . . . . 149 VAL MG1 . 27159 1 1498 . 1 1 149 149 VAL HG21 H 1 0.91 0.021 . 1 . . . . . 149 VAL MG2 . 27159 1 1499 . 1 1 149 149 VAL HG22 H 1 0.91 0.021 . 1 . . . . . 149 VAL MG2 . 27159 1 1500 . 1 1 149 149 VAL HG23 H 1 0.91 0.021 . 1 . . . . . 149 VAL MG2 . 27159 1 1501 . 1 1 149 149 VAL C C 13 177.875 0 . 1 . . . . . 149 VAL C . 27159 1 1502 . 1 1 149 149 VAL CA C 13 67.182 0.148 . 1 . . . . . 149 VAL CA . 27159 1 1503 . 1 1 149 149 VAL CB C 13 31.147 0.197 . 1 . . . . . 149 VAL CB . 27159 1 1504 . 1 1 149 149 VAL CG1 C 13 23.363 0.004 . 1 . . . . . 149 VAL CG1 . 27159 1 1505 . 1 1 149 149 VAL CG2 C 13 22.36 0 . 1 . . . . . 149 VAL CG2 . 27159 1 1506 . 1 1 149 149 VAL N N 15 119.696 0.03 . 1 . . . . . 149 VAL N . 27159 1 1507 . 1 1 150 150 LYS H H 1 8.258 0.002 . 1 . . . . . 150 LYS H . 27159 1 1508 . 1 1 150 150 LYS HA H 1 4.238 0.006 . 1 . . . . . 150 LYS HA . 27159 1 1509 . 1 1 150 150 LYS HB2 H 1 1.932 0.013 . 1 . . . . . 150 LYS HB2 . 27159 1 1510 . 1 1 150 150 LYS HB3 H 1 1.929 0 . 1 . . . . . 150 LYS HB3 . 27159 1 1511 . 1 1 150 150 LYS HG2 H 1 1.472 0 . 1 . . . . . 150 LYS HG2 . 27159 1 1512 . 1 1 150 150 LYS HG3 H 1 1.662 0 . 1 . . . . . 150 LYS HG3 . 27159 1 1513 . 1 1 150 150 LYS HD2 H 1 1.702 0 . 1 . . . . . 150 LYS HD2 . 27159 1 1514 . 1 1 150 150 LYS HD3 H 1 1.724 0 . 1 . . . . . 150 LYS HD3 . 27159 1 1515 . 1 1 150 150 LYS HE2 H 1 3.023 0 . 1 . . . . . 150 LYS HE2 . 27159 1 1516 . 1 1 150 150 LYS HE3 H 1 2.986 0 . 1 . . . . . 150 LYS HE3 . 27159 1 1517 . 1 1 150 150 LYS C C 13 179.096 0 . 1 . . . . . 150 LYS C . 27159 1 1518 . 1 1 150 150 LYS CA C 13 58.297 0.067 . 1 . . . . . 150 LYS CA . 27159 1 1519 . 1 1 150 150 LYS CB C 13 30.697 0.117 . 1 . . . . . 150 LYS CB . 27159 1 1520 . 1 1 150 150 LYS CG C 13 24.555 0.023 . 1 . . . . . 150 LYS CG . 27159 1 1521 . 1 1 150 150 LYS CD C 13 27.358 0.067 . 1 . . . . . 150 LYS CD . 27159 1 1522 . 1 1 150 150 LYS CE C 13 42.2 0 . 1 . . . . . 150 LYS CE . 27159 1 1523 . 1 1 150 150 LYS N N 15 117.187 0.057 . 1 . . . . . 150 LYS N . 27159 1 1524 . 1 1 151 151 ALA H H 1 7.713 0.002 . 1 . . . . . 151 ALA H . 27159 1 1525 . 1 1 151 151 ALA HA H 1 4.169 0.003 . 1 . . . . . 151 ALA HA . 27159 1 1526 . 1 1 151 151 ALA HB1 H 1 1.603 0.002 . 1 . . . . . 151 ALA MB . 27159 1 1527 . 1 1 151 151 ALA HB2 H 1 1.603 0.002 . 1 . . . . . 151 ALA MB . 27159 1 1528 . 1 1 151 151 ALA HB3 H 1 1.603 0.002 . 1 . . . . . 151 ALA MB . 27159 1 1529 . 1 1 151 151 ALA C C 13 175.892 0 . 1 . . . . . 151 ALA C . 27159 1 1530 . 1 1 151 151 ALA CA C 13 55.312 0.118 . 1 . . . . . 151 ALA CA . 27159 1 1531 . 1 1 151 151 ALA CB C 13 17.744 0.052 . 1 . . . . . 151 ALA CB . 27159 1 1532 . 1 1 151 151 ALA N N 15 123.182 0.028 . 1 . . . . . 151 ALA N . 27159 1 1533 . 1 1 152 152 ILE H H 1 8.102 0.002 . 1 . . . . . 152 ILE H . 27159 1 1534 . 1 1 152 152 ILE HA H 1 3.551 0.007 . 1 . . . . . 152 ILE HA . 27159 1 1535 . 1 1 152 152 ILE HB H 1 2.255 0.019 . 1 . . . . . 152 ILE HB . 27159 1 1536 . 1 1 152 152 ILE HG12 H 1 2.276 0 . 1 . . . . . 152 ILE HG12 . 27159 1 1537 . 1 1 152 152 ILE HG13 H 1 1.868 0 . 1 . . . . . 152 ILE HG13 . 27159 1 1538 . 1 1 152 152 ILE HG21 H 1 0.95 0 . 1 . . . . . 152 ILE MG . 27159 1 1539 . 1 1 152 152 ILE HG22 H 1 0.95 0 . 1 . . . . . 152 ILE MG . 27159 1 1540 . 1 1 152 152 ILE HG23 H 1 0.95 0 . 1 . . . . . 152 ILE MG . 27159 1 1541 . 1 1 152 152 ILE HD11 H 1 0.536 0.011 . 1 . . . . . 152 ILE MD . 27159 1 1542 . 1 1 152 152 ILE HD12 H 1 0.536 0.011 . 1 . . . . . 152 ILE MD . 27159 1 1543 . 1 1 152 152 ILE HD13 H 1 0.536 0.011 . 1 . . . . . 152 ILE MD . 27159 1 1544 . 1 1 152 152 ILE C C 13 177.457 0 . 1 . . . . . 152 ILE C . 27159 1 1545 . 1 1 152 152 ILE CA C 13 65.197 0.164 . 1 . . . . . 152 ILE CA . 27159 1 1546 . 1 1 152 152 ILE CB C 13 37.911 0.129 . 1 . . . . . 152 ILE CB . 27159 1 1547 . 1 1 152 152 ILE CG1 C 13 26.934 0 . 1 . . . . . 152 ILE CG1 . 27159 1 1548 . 1 1 152 152 ILE CG2 C 13 18.723 0 . 1 . . . . . 152 ILE CG2 . 27159 1 1549 . 1 1 152 152 ILE CD1 C 13 15.404 0.044 . 1 . . . . . 152 ILE CD1 . 27159 1 1550 . 1 1 152 152 ILE N N 15 120.987 0.051 . 1 . . . . . 152 ILE N . 27159 1 1551 . 1 1 153 153 GLU H H 1 8.338 0.002 . 1 . . . . . 153 GLU H . 27159 1 1552 . 1 1 153 153 GLU HA H 1 3.609 0.004 . 1 . . . . . 153 GLU HA . 27159 1 1553 . 1 1 153 153 GLU HB2 H 1 2.146 0.003 . 1 . . . . . 153 GLU HB2 . 27159 1 1554 . 1 1 153 153 GLU HB3 H 1 2.139 0 . 1 . . . . . 153 GLU HB3 . 27159 1 1555 . 1 1 153 153 GLU HG2 H 1 2.075 0.015 . 1 . . . . . 153 GLU HG2 . 27159 1 1556 . 1 1 153 153 GLU HG3 H 1 2.476 0.001 . 1 . . . . . 153 GLU HG3 . 27159 1 1557 . 1 1 153 153 GLU C C 13 178.637 0 . 1 . . . . . 153 GLU C . 27159 1 1558 . 1 1 153 153 GLU CA C 13 59.827 0.088 . 1 . . . . . 153 GLU CA . 27159 1 1559 . 1 1 153 153 GLU CB C 13 30.683 0.09 . 1 . . . . . 153 GLU CB . 27159 1 1560 . 1 1 153 153 GLU CG C 13 37.808 0.098 . 1 . . . . . 153 GLU CG . 27159 1 1561 . 1 1 153 153 GLU N N 15 118.939 0.03 . 1 . . . . . 153 GLU N . 27159 1 1562 . 1 1 154 154 LYS H H 1 7.36 0.002 . 1 . . . . . 154 LYS H . 27159 1 1563 . 1 1 154 154 LYS HA H 1 4.163 0.005 . 1 . . . . . 154 LYS HA . 27159 1 1564 . 1 1 154 154 LYS HB2 H 1 2.024 0.011 . 1 . . . . . 154 LYS HB2 . 27159 1 1565 . 1 1 154 154 LYS HB3 H 1 2.021 0.002 . 1 . . . . . 154 LYS HB3 . 27159 1 1566 . 1 1 154 154 LYS HG2 H 1 1.764 0.002 . 1 . . . . . 154 LYS HG2 . 27159 1 1567 . 1 1 154 154 LYS HG3 H 1 1.625 0 . 1 . . . . . 154 LYS HG3 . 27159 1 1568 . 1 1 154 154 LYS HD2 H 1 1.75 0 . 1 . . . . . 154 LYS HD2 . 27159 1 1569 . 1 1 154 154 LYS HD3 H 1 1.73 0 . 1 . . . . . 154 LYS HD3 . 27159 1 1570 . 1 1 154 154 LYS HE2 H 1 3.026 0 . 1 . . . . . 154 LYS HE2 . 27159 1 1571 . 1 1 154 154 LYS HE3 H 1 3.035 0 . 1 . . . . . 154 LYS HE3 . 27159 1 1572 . 1 1 154 154 LYS C C 13 178.557 0 . 1 . . . . . 154 LYS C . 27159 1 1573 . 1 1 154 154 LYS CA C 13 58.405 0.094 . 1 . . . . . 154 LYS CA . 27159 1 1574 . 1 1 154 154 LYS CB C 13 32.715 0.065 . 1 . . . . . 154 LYS CB . 27159 1 1575 . 1 1 154 154 LYS CG C 13 25.468 0.119 . 1 . . . . . 154 LYS CG . 27159 1 1576 . 1 1 154 154 LYS CD C 13 28.93 0.096 . 1 . . . . . 154 LYS CD . 27159 1 1577 . 1 1 154 154 LYS CE C 13 42.21 0.059 . 1 . . . . . 154 LYS CE . 27159 1 1578 . 1 1 154 154 LYS N N 15 114.59 0.021 . 1 . . . . . 154 LYS N . 27159 1 1579 . 1 1 155 155 VAL H H 1 7.802 0.004 . 1 . . . . . 155 VAL H . 27159 1 1580 . 1 1 155 155 VAL HA H 1 4.848 0.006 . 1 . . . . . 155 VAL HA . 27159 1 1581 . 1 1 155 155 VAL HB H 1 2.583 0.006 . 1 . . . . . 155 VAL HB . 27159 1 1582 . 1 1 155 155 VAL HG11 H 1 0.966 0.002 . 1 . . . . . 155 VAL MG1 . 27159 1 1583 . 1 1 155 155 VAL HG12 H 1 0.966 0.002 . 1 . . . . . 155 VAL MG1 . 27159 1 1584 . 1 1 155 155 VAL HG13 H 1 0.966 0.002 . 1 . . . . . 155 VAL MG1 . 27159 1 1585 . 1 1 155 155 VAL HG21 H 1 1.127 0 . 1 . . . . . 155 VAL MG2 . 27159 1 1586 . 1 1 155 155 VAL HG22 H 1 1.127 0 . 1 . . . . . 155 VAL MG2 . 27159 1 1587 . 1 1 155 155 VAL HG23 H 1 1.127 0 . 1 . . . . . 155 VAL MG2 . 27159 1 1588 . 1 1 155 155 VAL C C 13 176.281 0 . 1 . . . . . 155 VAL C . 27159 1 1589 . 1 1 155 155 VAL CA C 13 60.468 0.041 . 1 . . . . . 155 VAL CA . 27159 1 1590 . 1 1 155 155 VAL CB C 13 32.103 0.036 . 1 . . . . . 155 VAL CB . 27159 1 1591 . 1 1 155 155 VAL CG1 C 13 21.388 0.021 . 1 . . . . . 155 VAL CG1 . 27159 1 1592 . 1 1 155 155 VAL CG2 C 13 19.514 0 . 1 . . . . . 155 VAL CG2 . 27159 1 1593 . 1 1 155 155 VAL N N 15 109.767 0.042 . 1 . . . . . 155 VAL N . 27159 1 1594 . 1 1 156 156 GLY H H 1 7.696 0.005 . 1 . . . . . 156 GLY H . 27159 1 1595 . 1 1 156 156 GLY HA2 H 1 4.558 0.007 . 1 . . . . . 156 GLY HA2 . 27159 1 1596 . 1 1 156 156 GLY HA3 H 1 3.647 0.011 . 1 . . . . . 156 GLY HA3 . 27159 1 1597 . 1 1 156 156 GLY C C 13 171.735 0 . 1 . . . . . 156 GLY C . 27159 1 1598 . 1 1 156 156 GLY CA C 13 44.402 0.107 . 1 . . . . . 156 GLY CA . 27159 1 1599 . 1 1 156 156 GLY N N 15 107.905 0.081 . 1 . . . . . 156 GLY N . 27159 1 1600 . 1 1 157 157 SER H H 1 8.318 0.002 . 1 . . . . . 157 SER H . 27159 1 1601 . 1 1 157 157 SER HB2 H 1 4.109 0.009 . 1 . . . . . 157 SER HB2 . 27159 1 1602 . 1 1 157 157 SER C C 13 175.009 0 . 1 . . . . . 157 SER C . 27159 1 1603 . 1 1 157 157 SER CA C 13 57.917 0.059 . 1 . . . . . 157 SER CA . 27159 1 1604 . 1 1 157 157 SER CB C 13 66.386 0.058 . 1 . . . . . 157 SER CB . 27159 1 1605 . 1 1 157 157 SER N N 15 109.951 0.039 . 1 . . . . . 157 SER N . 27159 1 1606 . 1 1 158 158 ARG H H 1 8.943 0.003 . 1 . . . . . 158 ARG H . 27159 1 1607 . 1 1 158 158 ARG HA H 1 4.165 0.006 . 1 . . . . . 158 ARG HA . 27159 1 1608 . 1 1 158 158 ARG HB2 H 1 1.916 0 . 1 . . . . . 158 ARG HB2 . 27159 1 1609 . 1 1 158 158 ARG HB3 H 1 1.726 0 . 1 . . . . . 158 ARG HB3 . 27159 1 1610 . 1 1 158 158 ARG HG2 H 1 1.797 0 . 1 . . . . . 158 ARG HG2 . 27159 1 1611 . 1 1 158 158 ARG HG3 H 1 1.755 0 . 1 . . . . . 158 ARG HG3 . 27159 1 1612 . 1 1 158 158 ARG HD2 H 1 3.242 0.007 . 1 . . . . . 158 ARG HD2 . 27159 1 1613 . 1 1 158 158 ARG HD3 H 1 3.257 0.001 . 1 . . . . . 158 ARG HD3 . 27159 1 1614 . 1 1 158 158 ARG C C 13 177.744 0 . 1 . . . . . 158 ARG C . 27159 1 1615 . 1 1 158 158 ARG CA C 13 59.787 0.065 . 1 . . . . . 158 ARG CA . 27159 1 1616 . 1 1 158 158 ARG CB C 13 30.089 0.32 . 1 . . . . . 158 ARG CB . 27159 1 1617 . 1 1 158 158 ARG CG C 13 27.106 0.077 . 1 . . . . . 158 ARG CG . 27159 1 1618 . 1 1 158 158 ARG CD C 13 43.056 0 . 1 . . . . . 158 ARG CD . 27159 1 1619 . 1 1 158 158 ARG N N 15 120.868 0.053 . 1 . . . . . 158 ARG N . 27159 1 1620 . 1 1 159 159 GLY H H 1 8.42 0.003 . 1 . . . . . 159 GLY H . 27159 1 1621 . 1 1 159 159 GLY HA2 H 1 4.184 0.01 . 1 . . . . . 159 GLY HA2 . 27159 1 1622 . 1 1 159 159 GLY HA3 H 1 3.935 0 . 1 . . . . . 159 GLY HA3 . 27159 1 1623 . 1 1 159 159 GLY C C 13 175.665 0 . 1 . . . . . 159 GLY C . 27159 1 1624 . 1 1 159 159 GLY CA C 13 45.453 0.121 . 1 . . . . . 159 GLY CA . 27159 1 1625 . 1 1 159 159 GLY N N 15 103.142 0.029 . 1 . . . . . 159 GLY N . 27159 1 1626 . 1 1 160 160 GLY H H 1 7.899 0.002 . 1 . . . . . 160 GLY H . 27159 1 1627 . 1 1 160 160 GLY HA2 H 1 4.285 0 . 1 . . . . . 160 GLY HA2 . 27159 1 1628 . 1 1 160 160 GLY HA3 H 1 3.853 0 . 1 . . . . . 160 GLY HA3 . 27159 1 1629 . 1 1 160 160 GLY C C 13 174.12 0 . 1 . . . . . 160 GLY C . 27159 1 1630 . 1 1 160 160 GLY CA C 13 44.878 0.054 . 1 . . . . . 160 GLY CA . 27159 1 1631 . 1 1 160 160 GLY N N 15 109.656 0.028 . 1 . . . . . 160 GLY N . 27159 1 1632 . 1 1 161 161 SER H H 1 7.621 0.003 . 1 . . . . . 161 SER H . 27159 1 1633 . 1 1 161 161 SER HA H 1 4.634 0.013 . 1 . . . . . 161 SER HA . 27159 1 1634 . 1 1 161 161 SER HB2 H 1 3.97 0.009 . 1 . . . . . 161 SER HB2 . 27159 1 1635 . 1 1 161 161 SER HB3 H 1 3.949 0 . 1 . . . . . 161 SER HB3 . 27159 1 1636 . 1 1 161 161 SER C C 13 175.744 0 . 1 . . . . . 161 SER C . 27159 1 1637 . 1 1 161 161 SER CA C 13 59.21 0.008 . 1 . . . . . 161 SER CA . 27159 1 1638 . 1 1 161 161 SER CB C 13 63.247 0.07 . 1 . . . . . 161 SER CB . 27159 1 1639 . 1 1 161 161 SER N N 15 114.492 0.041 . 1 . . . . . 161 SER N . 27159 1 1640 . 1 1 162 162 THR H H 1 8.639 0.003 . 1 . . . . . 162 THR H . 27159 1 1641 . 1 1 162 162 THR HA H 1 5.255 0.009 . 1 . . . . . 162 THR HA . 27159 1 1642 . 1 1 162 162 THR HB H 1 4.566 0.001 . 1 . . . . . 162 THR HB . 27159 1 1643 . 1 1 162 162 THR HG21 H 1 1.277 0 . 1 . . . . . 162 THR MG . 27159 1 1644 . 1 1 162 162 THR HG22 H 1 1.277 0 . 1 . . . . . 162 THR MG . 27159 1 1645 . 1 1 162 162 THR HG23 H 1 1.277 0 . 1 . . . . . 162 THR MG . 27159 1 1646 . 1 1 162 162 THR C C 13 176.28 0 . 1 . . . . . 162 THR C . 27159 1 1647 . 1 1 162 162 THR CA C 13 59.267 0.056 . 1 . . . . . 162 THR CA . 27159 1 1648 . 1 1 162 162 THR CB C 13 70.951 0.023 . 1 . . . . . 162 THR CB . 27159 1 1649 . 1 1 162 162 THR CG2 C 13 22.351 0 . 1 . . . . . 162 THR CG2 . 27159 1 1650 . 1 1 162 162 THR N N 15 112.727 0.018 . 1 . . . . . 162 THR N . 27159 1 1651 . 1 1 163 163 ALA H H 1 9.381 0.002 . 1 . . . . . 163 ALA H . 27159 1 1652 . 1 1 163 163 ALA HA H 1 4.229 0 . 1 . . . . . 163 ALA HA . 27159 1 1653 . 1 1 163 163 ALA HB1 H 1 1.577 0.012 . 1 . . . . . 163 ALA MB . 27159 1 1654 . 1 1 163 163 ALA HB2 H 1 1.577 0.012 . 1 . . . . . 163 ALA MB . 27159 1 1655 . 1 1 163 163 ALA HB3 H 1 1.577 0.012 . 1 . . . . . 163 ALA MB . 27159 1 1656 . 1 1 163 163 ALA C C 13 177.826 0 . 1 . . . . . 163 ALA C . 27159 1 1657 . 1 1 163 163 ALA CA C 13 53.752 0 . 1 . . . . . 163 ALA CA . 27159 1 1658 . 1 1 163 163 ALA CB C 13 19.691 0.103 . 1 . . . . . 163 ALA CB . 27159 1 1659 . 1 1 163 163 ALA N N 15 125.066 0.051 . 1 . . . . . 163 ALA N . 27159 1 1660 . 1 1 164 164 LYS H H 1 7.35 0.001 . 1 . . . . . 164 LYS H . 27159 1 1661 . 1 1 164 164 LYS HB2 H 1 1.399 0 . 1 . . . . . 164 LYS HB2 . 27159 1 1662 . 1 1 164 164 LYS HD2 H 1 1.748 0 . 1 . . . . . 164 LYS HD2 . 27159 1 1663 . 1 1 164 164 LYS HE2 H 1 3.014 0 . 1 . . . . . 164 LYS HE2 . 27159 1 1664 . 1 1 164 164 LYS CA C 13 52.47 0 . 1 . . . . . 164 LYS CA . 27159 1 1665 . 1 1 164 164 LYS CB C 13 36.975 0.071 . 1 . . . . . 164 LYS CB . 27159 1 1666 . 1 1 164 164 LYS N N 15 112.774 0.024 . 1 . . . . . 164 LYS N . 27159 1 1667 . 1 1 165 165 PRO HA H 1 4.331 0.002 . 1 . . . . . 165 PRO HA . 27159 1 1668 . 1 1 165 165 PRO HB2 H 1 2.048 0 . 1 . . . . . 165 PRO HB2 . 27159 1 1669 . 1 1 165 165 PRO C C 13 177.553 0 . 1 . . . . . 165 PRO C . 27159 1 1670 . 1 1 165 165 PRO CA C 13 63.371 0.021 . 1 . . . . . 165 PRO CA . 27159 1 1671 . 1 1 165 165 PRO CB C 13 32.451 0.171 . 1 . . . . . 165 PRO CB . 27159 1 1672 . 1 1 165 165 PRO CG C 13 28.306 0 . 1 . . . . . 165 PRO CG . 27159 1 1673 . 1 1 166 166 VAL H H 1 9.313 0.004 . 1 . . . . . 166 VAL H . 27159 1 1674 . 1 1 166 166 VAL HA H 1 4.764 0 . 1 . . . . . 166 VAL HA . 27159 1 1675 . 1 1 166 166 VAL HB H 1 2.372 0.003 . 1 . . . . . 166 VAL HB . 27159 1 1676 . 1 1 166 166 VAL HG11 H 1 0.645 0.006 . 1 . . . . . 166 VAL MG1 . 27159 1 1677 . 1 1 166 166 VAL HG12 H 1 0.645 0.006 . 1 . . . . . 166 VAL MG1 . 27159 1 1678 . 1 1 166 166 VAL HG13 H 1 0.645 0.006 . 1 . . . . . 166 VAL MG1 . 27159 1 1679 . 1 1 166 166 VAL HG21 H 1 1.195 0.008 . 1 . . . . . 166 VAL MG2 . 27159 1 1680 . 1 1 166 166 VAL HG22 H 1 1.195 0.008 . 1 . . . . . 166 VAL MG2 . 27159 1 1681 . 1 1 166 166 VAL HG23 H 1 1.195 0.008 . 1 . . . . . 166 VAL MG2 . 27159 1 1682 . 1 1 166 166 VAL C C 13 174.618 0 . 1 . . . . . 166 VAL C . 27159 1 1683 . 1 1 166 166 VAL CA C 13 62.29 0.116 . 1 . . . . . 166 VAL CA . 27159 1 1684 . 1 1 166 166 VAL CB C 13 32.962 0.068 . 1 . . . . . 166 VAL CB . 27159 1 1685 . 1 1 166 166 VAL CG1 C 13 23.621 0 . 1 . . . . . 166 VAL CG1 . 27159 1 1686 . 1 1 166 166 VAL CG2 C 13 21.39 0.019 . 1 . . . . . 166 VAL CG2 . 27159 1 1687 . 1 1 166 166 VAL N N 15 131.303 0.027 . 1 . . . . . 166 VAL N . 27159 1 1688 . 1 1 167 167 VAL H H 1 8.602 0.009 . 1 . . . . . 167 VAL H . 27159 1 1689 . 1 1 167 167 VAL HA H 1 4.4 0 . 1 . . . . . 167 VAL HA . 27159 1 1690 . 1 1 167 167 VAL HB H 1 1.881 0 . 1 . . . . . 167 VAL HB . 27159 1 1691 . 1 1 167 167 VAL HG11 H 1 0.656 0 . 1 . . . . . 167 VAL MG1 . 27159 1 1692 . 1 1 167 167 VAL HG12 H 1 0.656 0 . 1 . . . . . 167 VAL MG1 . 27159 1 1693 . 1 1 167 167 VAL HG13 H 1 0.656 0 . 1 . . . . . 167 VAL MG1 . 27159 1 1694 . 1 1 167 167 VAL HG21 H 1 0.609 0.001 . 1 . . . . . 167 VAL MG2 . 27159 1 1695 . 1 1 167 167 VAL HG22 H 1 0.609 0.001 . 1 . . . . . 167 VAL MG2 . 27159 1 1696 . 1 1 167 167 VAL HG23 H 1 0.609 0.001 . 1 . . . . . 167 VAL MG2 . 27159 1 1697 . 1 1 167 167 VAL C C 13 174.512 0 . 1 . . . . . 167 VAL C . 27159 1 1698 . 1 1 167 167 VAL CA C 13 61.219 0.067 . 1 . . . . . 167 VAL CA . 27159 1 1699 . 1 1 167 167 VAL CB C 13 36.218 0.107 . 1 . . . . . 167 VAL CB . 27159 1 1700 . 1 1 167 167 VAL CG1 C 13 22.043 0 . 1 . . . . . 167 VAL CG1 . 27159 1 1701 . 1 1 167 167 VAL CG2 C 13 20.103 0.021 . 1 . . . . . 167 VAL CG2 . 27159 1 1702 . 1 1 167 167 VAL N N 15 127.089 0.073 . 1 . . . . . 167 VAL N . 27159 1 1703 . 1 1 168 168 ILE H H 1 8.567 0.003 . 1 . . . . . 168 ILE H . 27159 1 1704 . 1 1 168 168 ILE HA H 1 4.255 0.012 . 1 . . . . . 168 ILE HA . 27159 1 1705 . 1 1 168 168 ILE HB H 1 1.756 0 . 1 . . . . . 168 ILE HB . 27159 1 1706 . 1 1 168 168 ILE HG12 H 1 1.239 0 . 1 . . . . . 168 ILE HG12 . 27159 1 1707 . 1 1 168 168 ILE HG13 H 1 0.186 0 . 1 . . . . . 168 ILE HG13 . 27159 1 1708 . 1 1 168 168 ILE HG21 H 1 0.308 0.005 . 1 . . . . . 168 ILE MG . 27159 1 1709 . 1 1 168 168 ILE HG22 H 1 0.308 0.005 . 1 . . . . . 168 ILE MG . 27159 1 1710 . 1 1 168 168 ILE HG23 H 1 0.308 0.005 . 1 . . . . . 168 ILE MG . 27159 1 1711 . 1 1 168 168 ILE HD11 H 1 -0.037 0.002 . 1 . . . . . 168 ILE MD . 27159 1 1712 . 1 1 168 168 ILE HD12 H 1 -0.037 0.002 . 1 . . . . . 168 ILE MD . 27159 1 1713 . 1 1 168 168 ILE HD13 H 1 -0.037 0.002 . 1 . . . . . 168 ILE MD . 27159 1 1714 . 1 1 168 168 ILE C C 13 173.582 0 . 1 . . . . . 168 ILE C . 27159 1 1715 . 1 1 168 168 ILE CA C 13 60.657 0.056 . 1 . . . . . 168 ILE CA . 27159 1 1716 . 1 1 168 168 ILE CB C 13 36.518 0.163 . 1 . . . . . 168 ILE CB . 27159 1 1717 . 1 1 168 168 ILE CG1 C 13 26.884 0.095 . 1 . . . . . 168 ILE CG1 . 27159 1 1718 . 1 1 168 168 ILE CG2 C 13 17.994 0.094 . 1 . . . . . 168 ILE CG2 . 27159 1 1719 . 1 1 168 168 ILE CD1 C 13 13.615 0.047 . 1 . . . . . 168 ILE CD1 . 27159 1 1720 . 1 1 168 168 ILE N N 15 126.709 0.069 . 1 . . . . . 168 ILE N . 27159 1 1721 . 1 1 169 169 ALA H H 1 8.783 0.005 . 1 . . . . . 169 ALA H . 27159 1 1722 . 1 1 169 169 ALA HA H 1 4.059 0.002 . 1 . . . . . 169 ALA HA . 27159 1 1723 . 1 1 169 169 ALA HB1 H 1 1.38 0 . 1 . . . . . 169 ALA MB . 27159 1 1724 . 1 1 169 169 ALA HB2 H 1 1.38 0 . 1 . . . . . 169 ALA MB . 27159 1 1725 . 1 1 169 169 ALA HB3 H 1 1.38 0 . 1 . . . . . 169 ALA MB . 27159 1 1726 . 1 1 169 169 ALA C C 13 178.516 0 . 1 . . . . . 169 ALA C . 27159 1 1727 . 1 1 169 169 ALA CA C 13 54.283 0.125 . 1 . . . . . 169 ALA CA . 27159 1 1728 . 1 1 169 169 ALA CB C 13 19.41 0.061 . 1 . . . . . 169 ALA CB . 27159 1 1729 . 1 1 169 169 ALA N N 15 135.162 0.093 . 1 . . . . . 169 ALA N . 27159 1 1730 . 1 1 170 170 ASP H H 1 8.292 0.002 . 1 . . . . . 170 ASP H . 27159 1 1731 . 1 1 170 170 ASP HA H 1 4.917 0.004 . 1 . . . . . 170 ASP HA . 27159 1 1732 . 1 1 170 170 ASP HB2 H 1 2.985 0 . 1 . . . . . 170 ASP HB2 . 27159 1 1733 . 1 1 170 170 ASP HB3 H 1 2.845 0 . 1 . . . . . 170 ASP HB3 . 27159 1 1734 . 1 1 170 170 ASP C C 13 173.248 0 . 1 . . . . . 170 ASP C . 27159 1 1735 . 1 1 170 170 ASP CA C 13 52.896 0.141 . 1 . . . . . 170 ASP CA . 27159 1 1736 . 1 1 170 170 ASP CB C 13 43.947 0.015 . 1 . . . . . 170 ASP CB . 27159 1 1737 . 1 1 170 170 ASP N N 15 112.11 0.026 . 1 . . . . . 170 ASP N . 27159 1 1738 . 1 1 171 171 CYS H H 1 8.852 0.002 . 1 . . . . . 171 CYS H . 27159 1 1739 . 1 1 171 171 CYS HA H 1 4.711 0.011 . 1 . . . . . 171 CYS HA . 27159 1 1740 . 1 1 171 171 CYS HB2 H 1 3.355 0.011 . 1 . . . . . 171 CYS HB2 . 27159 1 1741 . 1 1 171 171 CYS HB3 H 1 3.173 0.022 . 1 . . . . . 171 CYS HB3 . 27159 1 1742 . 1 1 171 171 CYS C C 13 172.468 0 . 1 . . . . . 171 CYS C . 27159 1 1743 . 1 1 171 171 CYS CA C 13 55.691 0.189 . 1 . . . . . 171 CYS CA . 27159 1 1744 . 1 1 171 171 CYS CB C 13 31.461 0.196 . 1 . . . . . 171 CYS CB . 27159 1 1745 . 1 1 171 171 CYS N N 15 115.612 0.046 . 1 . . . . . 171 CYS N . 27159 1 1746 . 1 1 172 172 GLY H H 1 6.744 0.005 . 1 . . . . . 172 GLY H . 27159 1 1747 . 1 1 172 172 GLY HA2 H 1 3.981 0.019 . 1 . . . . . 172 GLY HA2 . 27159 1 1748 . 1 1 172 172 GLY HA3 H 1 3.586 0 . 1 . . . . . 172 GLY HA3 . 27159 1 1749 . 1 1 172 172 GLY C C 13 169.916 0 . 1 . . . . . 172 GLY C . 27159 1 1750 . 1 1 172 172 GLY CA C 13 45.435 0.136 . 1 . . . . . 172 GLY CA . 27159 1 1751 . 1 1 172 172 GLY N N 15 103.438 0.036 . 1 . . . . . 172 GLY N . 27159 1 1752 . 1 1 173 173 GLN H H 1 9.065 0.003 . 1 . . . . . 173 GLN H . 27159 1 1753 . 1 1 173 173 GLN HA H 1 5.096 0.001 . 1 . . . . . 173 GLN HA . 27159 1 1754 . 1 1 173 173 GLN HB2 H 1 1.953 0.026 . 1 . . . . . 173 GLN HB2 . 27159 1 1755 . 1 1 173 173 GLN HB3 H 1 1.737 0 . 1 . . . . . 173 GLN HB3 . 27159 1 1756 . 1 1 173 173 GLN HG2 H 1 2.615 0.015 . 1 . . . . . 173 GLN HG2 . 27159 1 1757 . 1 1 173 173 GLN HG3 H 1 2.6 0 . 1 . . . . . 173 GLN HG3 . 27159 1 1758 . 1 1 173 173 GLN C C 13 175.042 0.111 . 1 . . . . . 173 GLN C . 27159 1 1759 . 1 1 173 173 GLN CA C 13 54.71 0.157 . 1 . . . . . 173 GLN CA . 27159 1 1760 . 1 1 173 173 GLN CB C 13 30.818 0.215 . 1 . . . . . 173 GLN CB . 27159 1 1761 . 1 1 173 173 GLN CG C 13 32.874 0.201 . 1 . . . . . 173 GLN CG . 27159 1 1762 . 1 1 173 173 GLN N N 15 120.735 0.05 . 1 . . . . . 173 GLN N . 27159 1 1763 . 1 1 174 174 LEU H H 1 8.916 0.004 . 1 . . . . . 174 LEU H . 27159 1 1764 . 1 1 174 174 LEU HA H 1 4.67 0 . 1 . . . . . 174 LEU HA . 27159 1 1765 . 1 1 174 174 LEU HB2 H 1 1.659 0.014 . 1 . . . . . 174 LEU HB2 . 27159 1 1766 . 1 1 174 174 LEU HB3 H 1 1.58 0 . 1 . . . . . 174 LEU HB3 . 27159 1 1767 . 1 1 174 174 LEU HD11 H 1 0.839 0 . 1 . . . . . 174 LEU MD1 . 27159 1 1768 . 1 1 174 174 LEU HD12 H 1 0.839 0 . 1 . . . . . 174 LEU MD1 . 27159 1 1769 . 1 1 174 174 LEU HD13 H 1 0.839 0 . 1 . . . . . 174 LEU MD1 . 27159 1 1770 . 1 1 174 174 LEU HD21 H 1 0.787 0 . 1 . . . . . 174 LEU MD2 . 27159 1 1771 . 1 1 174 174 LEU HD22 H 1 0.787 0 . 1 . . . . . 174 LEU MD2 . 27159 1 1772 . 1 1 174 174 LEU HD23 H 1 0.787 0 . 1 . . . . . 174 LEU MD2 . 27159 1 1773 . 1 1 174 174 LEU C C 13 176.278 0 . 1 . . . . . 174 LEU C . 27159 1 1774 . 1 1 174 174 LEU CA C 13 55.088 0.121 . 1 . . . . . 174 LEU CA . 27159 1 1775 . 1 1 174 174 LEU CB C 13 43.825 0.039 . 1 . . . . . 174 LEU CB . 27159 1 1776 . 1 1 174 174 LEU CG C 13 26.813 0 . 1 . . . . . 174 LEU CG . 27159 1 1777 . 1 1 174 174 LEU CD1 C 13 23.33 0 . 1 . . . . . 174 LEU CD1 . 27159 1 1778 . 1 1 174 174 LEU CD2 C 13 23.26 0 . 1 . . . . . 174 LEU CD2 . 27159 1 1779 . 1 1 174 174 LEU N N 15 126.833 0.045 . 1 . . . . . 174 LEU N . 27159 1 1780 . 1 1 175 175 SER H H 1 8.202 0.002 . 1 . . . . . 175 SER H . 27159 1 1781 . 1 1 175 175 SER HA H 1 4.346 0.002 . 1 . . . . . 175 SER HA . 27159 1 1782 . 1 1 175 175 SER HB2 H 1 3.947 0 . 1 . . . . . 175 SER HB2 . 27159 1 1783 . 1 1 175 175 SER CA C 13 60.417 0.05 . 1 . . . . . 175 SER CA . 27159 1 1784 . 1 1 175 175 SER CB C 13 64.566 0.093 . 1 . . . . . 175 SER CB . 27159 1 1785 . 1 1 175 175 SER N N 15 121.306 0.034 . 1 . . . . . 175 SER N . 27159 1 stop_ save_