data_16619 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16619 _Entry.Title ; Sequence-specific 1H, 13C, and 15N resonance assignments of Diva (Boo), an apoptosis regulator of the Bcl-2 family ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-11-27 _Entry.Accession_date 2009-11-27 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Lorenzo Sborgi . . . 16619 2 Eva 'de Alba' . . . 16619 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16619 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 699 16619 '15N chemical shifts' 162 16619 '1H chemical shifts' 1096 16619 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 . . 2010-05-18 2009-11-27 update BMRB 'complete entry citation' 16619 1 . . 2010-02-08 2009-11-27 original author 'original release' 16619 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16619 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 20127209 _Citation.Full_citation . _Citation.Title 'Sequence-specific 1H, 13C, and 15N resonance assignments of Diva (Boo), an apoptosis regulator of the Bcl-2 family.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 4 _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 65 _Citation.Page_last 68 _Citation.Year 2010 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Lorenzo Sborgi . . . 16619 1 2 Eva 'de Alba' . . . 16619 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID apoptosis 16619 1 'Bcl-2 family' 16619 1 Boo 16619 1 Diva 16619 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16619 _Assembly.ID 1 _Assembly.Name 'Diva (Boo)' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Diva (Boo)' 1 $Diva_(Boo) A . yes native no no . . . 16619 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Diva_(Boo) _Entity.Sf_category entity _Entity.Sf_framecode Diva_(Boo) _Entity.Entry_ID 16619 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Diva_(Boo) _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 ; MADSQDPLHERTRRLLSDYI FFCAREPDTPEPPPTSVEAA LLRSVTRQIQQEHQEFFSSF CESRGNRLELVKQMADKLLS KDQDFSWSQLVMLLAFAGTL MNQGPYMAVKQKRDLGNRVI VTRDCCLIVNFLYNLLMGRR HRARLEALGGWDGFCRFFKN ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 160 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2KUA . "Solution Structure Of A Divergent Bcl-2 Protein" . . . . . 100.00 170 100.00 100.00 5.64e-114 . . . . 16619 1 2 no DBJ BAE22856 . "unnamed protein product [Mus musculus]" . . . . . 100.00 191 100.00 100.00 1.35e-113 . . . . 16619 1 3 no DBJ BAE26403 . "unnamed protein product [Mus musculus]" . . . . . 100.00 191 100.00 100.00 1.35e-113 . . . . 16619 1 4 no DBJ BAE36742 . "unnamed protein product [Mus musculus]" . . . . . 100.00 191 100.00 100.00 1.35e-113 . . . . 16619 1 5 no GB AAC83150 . "Bcl-2 homolog [Mus musculus]" . . . . . 100.00 191 100.00 100.00 1.35e-113 . . . . 16619 1 6 no GB AAD08703 . "Bcl-2 homolog [Mus musculus]" . . . . . 100.00 191 100.00 100.00 1.35e-113 . . . . 16619 1 7 no GB AAH52690 . "Bcl2l10 protein [Mus musculus]" . . . . . 100.00 191 99.38 99.38 1.45e-112 . . . . 16619 1 8 no GB EDL26315 . "Bcl2-like 10 [Mus musculus]" . . . . . 100.00 191 100.00 100.00 1.35e-113 . . . . 16619 1 9 no REF NP_038507 . "bcl-2-like protein 10 [Mus musculus]" . . . . . 100.00 191 100.00 100.00 1.35e-113 . . . . 16619 1 10 no SP Q9Z0F3 . "RecName: Full=Bcl-2-like protein 10; Short=Bcl2-L-10; AltName: Full=Anti-apoptotic protein Boo; AltName: Full=Apoptosis regulat" . . . . . 100.00 191 100.00 100.00 1.35e-113 . . . . 16619 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 . MET . 16619 1 2 . ALA . 16619 1 3 . ASP . 16619 1 4 . SER . 16619 1 5 . GLN . 16619 1 6 . ASP . 16619 1 7 . PRO . 16619 1 8 . LEU . 16619 1 9 . HIS . 16619 1 10 . GLU . 16619 1 11 . ARG . 16619 1 12 . THR . 16619 1 13 . ARG . 16619 1 14 . ARG . 16619 1 15 . LEU . 16619 1 16 . LEU . 16619 1 17 . SER . 16619 1 18 . ASP . 16619 1 19 . TYR . 16619 1 20 . ILE . 16619 1 21 . PHE . 16619 1 22 . PHE . 16619 1 23 . CYS . 16619 1 24 . ALA . 16619 1 25 . ARG . 16619 1 26 . GLU . 16619 1 27 . PRO . 16619 1 28 . ASP . 16619 1 29 . THR . 16619 1 30 . PRO . 16619 1 31 . GLU . 16619 1 32 . PRO . 16619 1 33 . PRO . 16619 1 34 . PRO . 16619 1 35 . THR . 16619 1 36 . SER . 16619 1 37 . VAL . 16619 1 38 . GLU . 16619 1 39 . ALA . 16619 1 40 . ALA . 16619 1 41 . LEU . 16619 1 42 . LEU . 16619 1 43 . ARG . 16619 1 44 . SER . 16619 1 45 . VAL . 16619 1 46 . THR . 16619 1 47 . ARG . 16619 1 48 . GLN . 16619 1 49 . ILE . 16619 1 50 . GLN . 16619 1 51 . GLN . 16619 1 52 . GLU . 16619 1 53 . HIS . 16619 1 54 . GLN . 16619 1 55 . GLU . 16619 1 56 . PHE . 16619 1 57 . PHE . 16619 1 58 . SER . 16619 1 59 . SER . 16619 1 60 . PHE . 16619 1 61 . CYS . 16619 1 62 . GLU . 16619 1 63 . SER . 16619 1 64 . ARG . 16619 1 65 . GLY . 16619 1 66 . ASN . 16619 1 67 . ARG . 16619 1 68 . LEU . 16619 1 69 . GLU . 16619 1 70 . LEU . 16619 1 71 . VAL . 16619 1 72 . LYS . 16619 1 73 . GLN . 16619 1 74 . MET . 16619 1 75 . ALA . 16619 1 76 . ASP . 16619 1 77 . LYS . 16619 1 78 . LEU . 16619 1 79 . LEU . 16619 1 80 . SER . 16619 1 81 . LYS . 16619 1 82 . ASP . 16619 1 83 . GLN . 16619 1 84 . ASP . 16619 1 85 . PHE . 16619 1 86 . SER . 16619 1 87 . TRP . 16619 1 88 . SER . 16619 1 89 . GLN . 16619 1 90 . LEU . 16619 1 91 . VAL . 16619 1 92 . MET . 16619 1 93 . LEU . 16619 1 94 . LEU . 16619 1 95 . ALA . 16619 1 96 . PHE . 16619 1 97 . ALA . 16619 1 98 . GLY . 16619 1 99 . THR . 16619 1 100 . LEU . 16619 1 101 . MET . 16619 1 102 . ASN . 16619 1 103 . GLN . 16619 1 104 . GLY . 16619 1 105 . PRO . 16619 1 106 . TYR . 16619 1 107 . MET . 16619 1 108 . ALA . 16619 1 109 . VAL . 16619 1 110 . LYS . 16619 1 111 . GLN . 16619 1 112 . LYS . 16619 1 113 . ARG . 16619 1 114 . ASP . 16619 1 115 . LEU . 16619 1 116 . GLY . 16619 1 117 . ASN . 16619 1 118 . ARG . 16619 1 119 . VAL . 16619 1 120 . ILE . 16619 1 121 . VAL . 16619 1 122 . THR . 16619 1 123 . ARG . 16619 1 124 . ASP . 16619 1 125 . CYS . 16619 1 126 . CYS . 16619 1 127 . LEU . 16619 1 128 . ILE . 16619 1 129 . VAL . 16619 1 130 . ASN . 16619 1 131 . PHE . 16619 1 132 . LEU . 16619 1 133 . TYR . 16619 1 134 . ASN . 16619 1 135 . LEU . 16619 1 136 . LEU . 16619 1 137 . MET . 16619 1 138 . GLY . 16619 1 139 . ARG . 16619 1 140 . ARG . 16619 1 141 . HIS . 16619 1 142 . ARG . 16619 1 143 . ALA . 16619 1 144 . ARG . 16619 1 145 . LEU . 16619 1 146 . GLU . 16619 1 147 . ALA . 16619 1 148 . LEU . 16619 1 149 . GLY . 16619 1 150 . GLY . 16619 1 151 . TRP . 16619 1 152 . ASP . 16619 1 153 . GLY . 16619 1 154 . PHE . 16619 1 155 . CYS . 16619 1 156 . ARG . 16619 1 157 . PHE . 16619 1 158 . PHE . 16619 1 159 . LYS . 16619 1 160 . ASN . 16619 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 . MET 1 1 16619 1 . ALA 2 2 16619 1 . ASP 3 3 16619 1 . SER 4 4 16619 1 . GLN 5 5 16619 1 . ASP 6 6 16619 1 . PRO 7 7 16619 1 . LEU 8 8 16619 1 . HIS 9 9 16619 1 . GLU 10 10 16619 1 . ARG 11 11 16619 1 . THR 12 12 16619 1 . ARG 13 13 16619 1 . ARG 14 14 16619 1 . LEU 15 15 16619 1 . LEU 16 16 16619 1 . SER 17 17 16619 1 . ASP 18 18 16619 1 . TYR 19 19 16619 1 . ILE 20 20 16619 1 . PHE 21 21 16619 1 . PHE 22 22 16619 1 . CYS 23 23 16619 1 . ALA 24 24 16619 1 . ARG 25 25 16619 1 . GLU 26 26 16619 1 . PRO 27 27 16619 1 . ASP 28 28 16619 1 . THR 29 29 16619 1 . PRO 30 30 16619 1 . GLU 31 31 16619 1 . PRO 32 32 16619 1 . PRO 33 33 16619 1 . PRO 34 34 16619 1 . THR 35 35 16619 1 . SER 36 36 16619 1 . VAL 37 37 16619 1 . GLU 38 38 16619 1 . ALA 39 39 16619 1 . ALA 40 40 16619 1 . LEU 41 41 16619 1 . LEU 42 42 16619 1 . ARG 43 43 16619 1 . SER 44 44 16619 1 . VAL 45 45 16619 1 . THR 46 46 16619 1 . ARG 47 47 16619 1 . GLN 48 48 16619 1 . ILE 49 49 16619 1 . GLN 50 50 16619 1 . GLN 51 51 16619 1 . GLU 52 52 16619 1 . HIS 53 53 16619 1 . GLN 54 54 16619 1 . GLU 55 55 16619 1 . PHE 56 56 16619 1 . PHE 57 57 16619 1 . SER 58 58 16619 1 . SER 59 59 16619 1 . PHE 60 60 16619 1 . CYS 61 61 16619 1 . GLU 62 62 16619 1 . SER 63 63 16619 1 . ARG 64 64 16619 1 . GLY 65 65 16619 1 . ASN 66 66 16619 1 . ARG 67 67 16619 1 . LEU 68 68 16619 1 . GLU 69 69 16619 1 . LEU 70 70 16619 1 . VAL 71 71 16619 1 . LYS 72 72 16619 1 . GLN 73 73 16619 1 . MET 74 74 16619 1 . ALA 75 75 16619 1 . ASP 76 76 16619 1 . LYS 77 77 16619 1 . LEU 78 78 16619 1 . LEU 79 79 16619 1 . SER 80 80 16619 1 . LYS 81 81 16619 1 . ASP 82 82 16619 1 . GLN 83 83 16619 1 . ASP 84 84 16619 1 . PHE 85 85 16619 1 . SER 86 86 16619 1 . TRP 87 87 16619 1 . SER 88 88 16619 1 . GLN 89 89 16619 1 . LEU 90 90 16619 1 . VAL 91 91 16619 1 . MET 92 92 16619 1 . LEU 93 93 16619 1 . LEU 94 94 16619 1 . ALA 95 95 16619 1 . PHE 96 96 16619 1 . ALA 97 97 16619 1 . GLY 98 98 16619 1 . THR 99 99 16619 1 . LEU 100 100 16619 1 . MET 101 101 16619 1 . ASN 102 102 16619 1 . GLN 103 103 16619 1 . GLY 104 104 16619 1 . PRO 105 105 16619 1 . TYR 106 106 16619 1 . MET 107 107 16619 1 . ALA 108 108 16619 1 . VAL 109 109 16619 1 . LYS 110 110 16619 1 . GLN 111 111 16619 1 . LYS 112 112 16619 1 . ARG 113 113 16619 1 . ASP 114 114 16619 1 . LEU 115 115 16619 1 . GLY 116 116 16619 1 . ASN 117 117 16619 1 . ARG 118 118 16619 1 . VAL 119 119 16619 1 . ILE 120 120 16619 1 . VAL 121 121 16619 1 . THR 122 122 16619 1 . ARG 123 123 16619 1 . ASP 124 124 16619 1 . CYS 125 125 16619 1 . CYS 126 126 16619 1 . LEU 127 127 16619 1 . ILE 128 128 16619 1 . VAL 129 129 16619 1 . ASN 130 130 16619 1 . PHE 131 131 16619 1 . LEU 132 132 16619 1 . TYR 133 133 16619 1 . ASN 134 134 16619 1 . LEU 135 135 16619 1 . LEU 136 136 16619 1 . MET 137 137 16619 1 . GLY 138 138 16619 1 . ARG 139 139 16619 1 . ARG 140 140 16619 1 . HIS 141 141 16619 1 . ARG 142 142 16619 1 . ALA 143 143 16619 1 . ARG 144 144 16619 1 . LEU 145 145 16619 1 . GLU 146 146 16619 1 . ALA 147 147 16619 1 . LEU 148 148 16619 1 . GLY 149 149 16619 1 . GLY 150 150 16619 1 . TRP 151 151 16619 1 . ASP 152 152 16619 1 . GLY 153 153 16619 1 . PHE 154 154 16619 1 . CYS 155 155 16619 1 . ARG 156 156 16619 1 . PHE 157 157 16619 1 . PHE 158 158 16619 1 . LYS 159 159 16619 1 . ASN 160 160 16619 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 16619 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Diva_(Boo) . 10090 organism . 'Mus musculus' Mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 16619 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 16619 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Diva_(Boo) . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pBAT4 . . . . . . 16619 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16619 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Diva (Boo)' '[U-13C; U-15N]' . . 1 $Diva_(Boo) . . ~0.2 . . mM . . . . 16619 1 2 'sodium acetate' [U-2H] . . . . . . 20 . . mM . . . . 16619 1 3 'sodium azide' 'natural abundance' . . . . . . 0.1 . . mM . . . . 16619 1 4 TCEP [U-2H] . . . . . . 5 . . mM . . . . 16619 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 16619 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 'Diva (Boo)' '[U-13C; U-15N]' . . 1 $Diva_(Boo) . . ~0.1 . . mM . . . . 16619 2 2 'sodium acetate' [U-2H] . . . . . . 20 . . mM . . . . 16619 2 3 'sodium azide' 'natural abundance' . . . . . . 0.1 . . mM . . . . 16619 2 4 TCEP [U-2H] . . . . . . 5 . . mM . . . . 16619 2 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 16619 _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 pH 5.4 . pH 16619 1 pressure 1 . atm 16619 1 temperature 308 . K 16619 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 16619 _Sample_condition_list.ID 2 _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 pH* 5 . pH 16619 2 pressure 1 . atm 16619 2 temperature 308 . K 16619 2 stop_ save_ ############################ # Computer software used # ############################ save_PIPP _Software.Sf_category software _Software.Sf_framecode PIPP _Software.Entry_ID 16619 _Software.ID 1 _Software.Name PIPP _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Garrett . . 16619 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 16619 1 'peak picking' 16619 1 stop_ save_ save_NMRDraw _Software.Sf_category software _Software.Sf_framecode NMRDraw _Software.Entry_ID 16619 _Software.ID 2 _Software.Name NMRDraw _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 16619 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 16619 2 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 16619 _Software.ID 3 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 16619 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 16619 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 16619 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'Avance III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 16619 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'equipped with cryogenic probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _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 16619 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker 'Avance III' . 600 . . . 16619 1 2 spectrometer_2 Bruker Avance . 600 'equipped with cryogenic probe' . . 16619 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 16619 _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 . . . . . . . . . . . . . . . . . . . . . 16619 1 2 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16619 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16619 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16619 1 5 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16619 1 6 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16619 1 7 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16619 1 8 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16619 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . . . . . . . . . . . . . . . . . . . 16619 1 10 '4D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . . . . . . . . . . . . . . . . . . . 16619 1 11 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . . . . . . . . . . . . . . . . . . . 16619 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 16619 _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.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 TSP 'methyl protons' . . . . ppm 0.00 external indirect 0.251449530 . . . . . . . . . 16619 1 H 1 TSP 'methyl protons' . . . . ppm 0.00 external direct 1.000000000 . . . . . . . . . 16619 1 N 15 TSP 'methyl protons' . . . . ppm 0.00 external indirect 0.101329118 . . . . . . . . . 16619 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 16619 _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' . . . 16619 1 2 '3D HNCACB' . . . 16619 1 3 '3D CBCA(CO)NH' . . . 16619 1 4 '3D HNCO' . . . 16619 1 5 '3D C(CO)NH' . . . 16619 1 6 '3D HBHA(CO)NH' . . . 16619 1 7 '3D H(CCO)NH' . . . 16619 1 8 '3D 1H-15N NOESY' . . . 16619 1 9 '3D HCCH-TOCSY' . . . 16619 1 10 '4D 1H-13C NOESY' . . . 16619 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4.3510 0.05 . 1 . . . . 1 MET HA . 16619 1 2 . 1 1 1 1 MET HB2 H 1 2.0940 0.05 . 2 . . . . 1 MET HB1|HB2 . 16619 1 3 . 1 1 1 1 MET HB3 H 1 1.8750 0.05 . 2 . . . . 1 MET HB2|HB1 . 16619 1 4 . 1 1 1 1 MET HE1 H 1 2.0620 0.05 . 1 . . . . 1 MET HE# . 16619 1 5 . 1 1 1 1 MET HE2 H 1 2.0620 0.05 . 1 . . . . 1 MET HE# . 16619 1 6 . 1 1 1 1 MET HE3 H 1 2.0620 0.05 . 1 . . . . 1 MET HE# . 16619 1 7 . 1 1 1 1 MET HG2 H 1 2.4900 0.05 . 2 . . . . 1 MET HG1|HG2 . 16619 1 8 . 1 1 1 1 MET HG3 H 1 2.5580 0.05 . 2 . . . . 1 MET HG2|HG1 . 16619 1 9 . 1 1 1 1 MET C C 13 175.8780 0.04 . 1 . . . . 1 MET C . 16619 1 10 . 1 1 1 1 MET CA C 13 55.6290 0.5 . 1 . . . . 1 MET CA . 16619 1 11 . 1 1 1 1 MET CB C 13 32.8770 0.5 . 1 . . . . 1 MET CB . 16619 1 12 . 1 1 1 1 MET CE C 13 17.2290 0.5 . 1 . . . . 1 MET CE . 16619 1 13 . 1 1 1 1 MET CG C 13 32.3780 0.5 . 1 . . . . 1 MET CG . 16619 1 14 . 1 1 2 2 ALA H H 1 8.0952 0.006 . 1 . . . . 2 ALA HN . 16619 1 15 . 1 1 2 2 ALA HA H 1 4.3348 0.05 . 1 . . . . 2 ALA HA . 16619 1 16 . 1 1 2 2 ALA HB1 H 1 1.4064 0.05 . 1 . . . . 2 ALA HB# . 16619 1 17 . 1 1 2 2 ALA HB2 H 1 1.4064 0.05 . 1 . . . . 2 ALA HB# . 16619 1 18 . 1 1 2 2 ALA HB3 H 1 1.4064 0.05 . 1 . . . . 2 ALA HB# . 16619 1 19 . 1 1 2 2 ALA CA C 13 53.2260 0.5 . 1 . . . . 2 ALA CA . 16619 1 20 . 1 1 2 2 ALA CB C 13 18.9000 0.5 . 1 . . . . 2 ALA CB . 16619 1 21 . 1 1 2 2 ALA N N 15 123.8907 0.1 . 1 . . . . 2 ALA N . 16619 1 22 . 1 1 3 3 ASP HA H 1 4.6820 0.05 . 1 . . . . 3 ASP HA . 16619 1 23 . 1 1 3 3 ASP HB2 H 1 2.7080 0.05 . 2 . . . . 3 ASP HB1|HB2 . 16619 1 24 . 1 1 3 3 ASP HB3 H 1 2.6410 0.05 . 2 . . . . 3 ASP HB2|HB1 . 16619 1 25 . 1 1 3 3 ASP C C 13 176.1130 0.04 . 1 . . . . 3 ASP C . 16619 1 26 . 1 1 3 3 ASP CA C 13 54.5680 0.5 . 1 . . . . 3 ASP CA . 16619 1 27 . 1 1 3 3 ASP CB C 13 41.5270 0.5 . 1 . . . . 3 ASP CB . 16619 1 28 . 1 1 4 4 SER H H 1 8.3365 0.006 . 1 . . . . 4 SER HN . 16619 1 29 . 1 1 4 4 SER HA H 1 4.3920 0.05 . 1 . . . . 4 SER HA . 16619 1 30 . 1 1 4 4 SER HB2 H 1 3.8370 0.05 . 2 . . . . 4 SER HB# . 16619 1 31 . 1 1 4 4 SER HB3 H 1 3.8370 0.05 . 2 . . . . 4 SER HB# . 16619 1 32 . 1 1 4 4 SER C C 13 174.4930 0.04 . 1 . . . . 4 SER C . 16619 1 33 . 1 1 4 4 SER CA C 13 58.7340 0.5 . 1 . . . . 4 SER CA . 16619 1 34 . 1 1 4 4 SER CB C 13 63.9630 0.5 . 1 . . . . 4 SER CB . 16619 1 35 . 1 1 4 4 SER N N 15 115.9116 0.1 . 1 . . . . 4 SER N . 16619 1 36 . 1 1 5 5 GLN H H 1 8.4319 0.006 . 1 . . . . 5 GLN HN . 16619 1 37 . 1 1 5 5 GLN HA H 1 4.4240 0.05 . 1 . . . . 5 GLN HA . 16619 1 38 . 1 1 5 5 GLN HB2 H 1 2.1670 0.05 . 2 . . . . 5 GLN HB1|HB2 . 16619 1 39 . 1 1 5 5 GLN HB3 H 1 1.9830 0.05 . 2 . . . . 5 GLN HB2|HB1 . 16619 1 40 . 1 1 5 5 GLN HE21 H 1 7.4150 0.05 . 2 . . . . 5 GLN HE21 . 16619 1 41 . 1 1 5 5 GLN HE22 H 1 6.7090 0.05 . 2 . . . . 5 GLN HE22 . 16619 1 42 . 1 1 5 5 GLN HG2 H 1 2.4230 0.05 . 2 . . . . 5 GLN HG# . 16619 1 43 . 1 1 5 5 GLN HG3 H 1 2.4230 0.05 . 2 . . . . 5 GLN HG# . 16619 1 44 . 1 1 5 5 GLN C C 13 175.3970 0.04 . 1 . . . . 5 GLN C . 16619 1 45 . 1 1 5 5 GLN CA C 13 55.6380 0.5 . 1 . . . . 5 GLN CA . 16619 1 46 . 1 1 5 5 GLN CB C 13 29.4810 0.5 . 1 . . . . 5 GLN CB . 16619 1 47 . 1 1 5 5 GLN CG C 13 34.2060 0.5 . 1 . . . . 5 GLN CG . 16619 1 48 . 1 1 5 5 GLN N N 15 121.6042 0.1 . 1 . . . . 5 GLN N . 16619 1 49 . 1 1 5 5 GLN NE2 N 15 113.1110 0.1 . 1 . . . . 5 GLN NE2 . 16619 1 50 . 1 1 6 6 ASP H H 1 8.2901 0.006 . 1 . . . . 6 ASP HN . 16619 1 51 . 1 1 6 6 ASP HA H 1 4.9000 0.05 . 1 . . . . 6 ASP HA . 16619 1 52 . 1 1 6 6 ASP HB2 H 1 2.9820 0.05 . 2 . . . . 6 ASP HB1|HB2 . 16619 1 53 . 1 1 6 6 ASP HB3 H 1 2.6980 0.05 . 2 . . . . 6 ASP HB2|HB1 . 16619 1 54 . 1 1 6 6 ASP CA C 13 52.5590 0.5 . 1 . . . . 6 ASP CA . 16619 1 55 . 1 1 6 6 ASP CB C 13 41.2270 0.5 . 1 . . . . 6 ASP CB . 16619 1 56 . 1 1 6 6 ASP N N 15 122.5219 0.1 . 1 . . . . 6 ASP N . 16619 1 57 . 1 1 7 7 PRO HA H 1 4.5270 0.05 . 1 . . . . 7 PRO HA . 16619 1 58 . 1 1 7 7 PRO HB2 H 1 2.5390 0.05 . 2 . . . . 7 PRO HB1|HB2 . 16619 1 59 . 1 1 7 7 PRO HB3 H 1 2.0970 0.05 . 2 . . . . 7 PRO HB2|HB1 . 16619 1 60 . 1 1 7 7 PRO HD2 H 1 3.7500 0.05 . 2 . . . . 7 PRO HD# . 16619 1 61 . 1 1 7 7 PRO HD3 H 1 3.7500 0.05 . 2 . . . . 7 PRO HD# . 16619 1 62 . 1 1 7 7 PRO HG2 H 1 2.1600 0.05 . 2 . . . . 7 PRO HG# . 16619 1 63 . 1 1 7 7 PRO HG3 H 1 2.1600 0.05 . 2 . . . . 7 PRO HG# . 16619 1 64 . 1 1 7 7 PRO C C 13 178.4640 0.04 . 1 . . . . 7 PRO C . 16619 1 65 . 1 1 7 7 PRO CA C 13 65.5210 0.5 . 1 . . . . 7 PRO CA . 16619 1 66 . 1 1 7 7 PRO CB C 13 32.3900 0.5 . 1 . . . . 7 PRO CB . 16619 1 67 . 1 1 7 7 PRO CD C 13 50.3010 0.5 . 1 . . . . 7 PRO CD . 16619 1 68 . 1 1 7 7 PRO CG C 13 27.3100 0.5 . 1 . . . . 7 PRO CG . 16619 1 69 . 1 1 8 8 LEU H H 1 8.3829 0.006 . 1 . . . . 8 LEU NH . 16619 1 70 . 1 1 8 8 LEU HA H 1 4.1440 0.05 . 1 . . . . 8 LEU HA . 16619 1 71 . 1 1 8 8 LEU HD11 H 1 0.9851 0.05 . 2 . . . . 8 LEU HD1#|HD2# . 16619 1 72 . 1 1 8 8 LEU HD12 H 1 0.9851 0.05 . 2 . . . . 8 LEU HD1#|HD2# . 16619 1 73 . 1 1 8 8 LEU HD13 H 1 0.9851 0.05 . 2 . . . . 8 LEU HD1#|HD2# . 16619 1 74 . 1 1 8 8 LEU HD21 H 1 0.9851 0.05 . 2 . . . . 8 LEU HD2#|HD1# . 16619 1 75 . 1 1 8 8 LEU HD22 H 1 0.9851 0.05 . 2 . . . . 8 LEU HD2#|HD1# . 16619 1 76 . 1 1 8 8 LEU HD23 H 1 0.9851 0.05 . 2 . . . . 8 LEU HD2#|HD1# . 16619 1 77 . 1 1 8 8 LEU CA C 13 58.3730 0.5 . 1 . . . . 8 LEU CA . 16619 1 78 . 1 1 8 8 LEU CB C 13 41.5080 0.5 . 1 . . . . 8 LEU CB . 16619 1 79 . 1 1 8 8 LEU N N 15 119.3972 0.1 . 1 . . . . 8 LEU N . 16619 1 80 . 1 1 9 9 HIS HA H 1 4.7470 0.05 . 1 . . . . 9 HIS HA . 16619 1 81 . 1 1 9 9 HIS HB2 H 1 3.7480 0.05 . 2 . . . . 9 HIS HB# . 16619 1 82 . 1 1 9 9 HIS HB3 H 1 3.7480 0.05 . 2 . . . . 9 HIS HB# . 16619 1 83 . 1 1 9 9 HIS C C 13 177.3240 0.04 . 1 . . . . 9 HIS C . 16619 1 84 . 1 1 9 9 HIS CA C 13 59.9880 0.5 . 1 . . . . 9 HIS CA . 16619 1 85 . 1 1 9 9 HIS CB C 13 28.5140 0.5 . 1 . . . . 9 HIS CB . 16619 1 86 . 1 1 10 10 GLU H H 1 8.2196 0.006 . 1 . . . . 10 GLU HN . 16619 1 87 . 1 1 10 10 GLU HA H 1 4.1920 0.05 . 1 . . . . 10 GLU HA . 16619 1 88 . 1 1 10 10 GLU HB2 H 1 2.0990 0.05 . 2 . . . . 10 GLU HB# . 16619 1 89 . 1 1 10 10 GLU HB3 H 1 2.0990 0.05 . 2 . . . . 10 GLU HB# . 16619 1 90 . 1 1 10 10 GLU HG2 H 1 2.3340 0.05 . 2 . . . . 10 GLU HG# . 16619 1 91 . 1 1 10 10 GLU HG3 H 1 2.3340 0.05 . 2 . . . . 10 GLU HG# . 16619 1 92 . 1 1 10 10 GLU C C 13 178.8990 0.04 . 1 . . . . 10 GLU C . 16619 1 93 . 1 1 10 10 GLU CA C 13 59.7030 0.5 . 1 . . . . 10 GLU CA . 16619 1 94 . 1 1 10 10 GLU CB C 13 29.6430 0.5 . 1 . . . . 10 GLU CB . 16619 1 95 . 1 1 10 10 GLU CG C 13 35.8770 0.5 . 1 . . . . 10 GLU CG . 16619 1 96 . 1 1 10 10 GLU N N 15 120.4332 0.1 . 1 . . . . 10 GLU N . 16619 1 97 . 1 1 11 11 ARG H H 1 8.8266 0.006 . 1 . . . . 11 ARG HN . 16619 1 98 . 1 1 11 11 ARG HA H 1 4.0000 0.05 . 1 . . . . 11 ARG HA . 16619 1 99 . 1 1 11 11 ARG HB2 H 1 2.1020 0.05 . 2 . . . . 11 ARG HB# . 16619 1 100 . 1 1 11 11 ARG HB3 H 1 2.1020 0.05 . 2 . . . . 11 ARG HB# . 16619 1 101 . 1 1 11 11 ARG HD2 H 1 3.1490 0.05 . 2 . . . . 11 ARG HD# . 16619 1 102 . 1 1 11 11 ARG HD3 H 1 3.1490 0.05 . 2 . . . . 11 ARG HD# . 16619 1 103 . 1 1 11 11 ARG HG2 H 1 1.5787 0.05 . 2 . . . . 11 ARG HG1|HG2 . 16619 1 104 . 1 1 11 11 ARG C C 13 179.9790 0.04 . 1 . . . . 11 ARG C . 16619 1 105 . 1 1 11 11 ARG CA C 13 60.0300 0.5 . 1 . . . . 11 ARG CA . 16619 1 106 . 1 1 11 11 ARG CB C 13 31.5240 0.5 . 1 . . . . 11 ARG CB . 16619 1 107 . 1 1 11 11 ARG CD C 13 43.3040 0.5 . 1 . . . . 11 ARG CD . 16619 1 108 . 1 1 11 11 ARG CG C 13 27.4630 0.5 . 1 . . . . 11 ARG CG . 16619 1 109 . 1 1 11 11 ARG N N 15 118.9656 0.1 . 1 . . . . 11 ARG N . 16619 1 110 . 1 1 12 12 THR H H 1 8.2791 0.006 . 1 . . . . 12 THR HN . 16619 1 111 . 1 1 12 12 THR HA H 1 3.7530 0.05 . 1 . . . . 12 THR HA . 16619 1 112 . 1 1 12 12 THR HB H 1 4.6850 0.05 . 1 . . . . 12 THR HB . 16619 1 113 . 1 1 12 12 THR HG21 H 1 1.4730 0.05 . 1 . . . . 12 THR HG2# . 16619 1 114 . 1 1 12 12 THR HG22 H 1 1.4730 0.05 . 1 . . . . 12 THR HG2# . 16619 1 115 . 1 1 12 12 THR HG23 H 1 1.4730 0.05 . 1 . . . . 12 THR HG2# . 16619 1 116 . 1 1 12 12 THR C C 13 175.1320 0.04 . 1 . . . . 12 THR C . 16619 1 117 . 1 1 12 12 THR CA C 13 67.6980 0.5 . 1 . . . . 12 THR CA . 16619 1 118 . 1 1 12 12 THR CB C 13 68.8900 0.5 . 1 . . . . 12 THR CB . 16619 1 119 . 1 1 12 12 THR CG2 C 13 22.1700 0.5 . 1 . . . . 12 THR CG2 . 16619 1 120 . 1 1 12 12 THR N N 15 115.7474 0.1 . 1 . . . . 12 THR N . 16619 1 121 . 1 1 13 13 ARG H H 1 8.4360 0.006 . 1 . . . . 13 ARG HN . 16619 1 122 . 1 1 13 13 ARG HA H 1 3.6340 0.05 . 1 . . . . 13 ARG HA . 16619 1 123 . 1 1 13 13 ARG HB2 H 1 1.7730 0.05 . 2 . . . . 13 ARG HB# . 16619 1 124 . 1 1 13 13 ARG HB3 H 1 1.7730 0.05 . 2 . . . . 13 ARG HB# . 16619 1 125 . 1 1 13 13 ARG HD2 H 1 2.8326 0.05 . 2 . . . . 13 ARG HD# . 16619 1 126 . 1 1 13 13 ARG HD3 H 1 2.8326 0.05 . 2 . . . . 13 ARG HD# . 16619 1 127 . 1 1 13 13 ARG HG2 H 1 1.4710 0.05 . 2 . . . . 13 ARG HG# . 16619 1 128 . 1 1 13 13 ARG HG3 H 1 1.4710 0.05 . 2 . . . . 13 ARG HG# . 16619 1 129 . 1 1 13 13 ARG C C 13 178.4820 0.04 . 1 . . . . 13 ARG C . 16619 1 130 . 1 1 13 13 ARG CA C 13 61.2530 0.5 . 1 . . . . 13 ARG CA . 16619 1 131 . 1 1 13 13 ARG CB C 13 29.4810 0.5 . 1 . . . . 13 ARG CB . 16619 1 132 . 1 1 13 13 ARG CD C 13 42.6990 0.5 . 1 . . . . 13 ARG CD . 16619 1 133 . 1 1 13 13 ARG CG C 13 27.2710 0.5 . 1 . . . . 13 ARG CG . 16619 1 134 . 1 1 13 13 ARG N N 15 122.2886 0.1 . 1 . . . . 13 ARG N . 16619 1 135 . 1 1 14 14 ARG H H 1 8.3163 0.006 . 1 . . . . 14 ARG HN . 16619 1 136 . 1 1 14 14 ARG HA H 1 3.9020 0.05 . 1 . . . . 14 ARG HA . 16619 1 137 . 1 1 14 14 ARG HB2 H 1 1.7750 0.05 . 2 . . . . 14 ARG HB# . 16619 1 138 . 1 1 14 14 ARG HB3 H 1 1.7750 0.05 . 2 . . . . 14 ARG HB# . 16619 1 139 . 1 1 14 14 ARG HD2 H 1 3.1770 0.05 . 2 . . . . 14 ARG HD# . 16619 1 140 . 1 1 14 14 ARG HD3 H 1 3.1770 0.05 . 2 . . . . 14 ARG HD# . 16619 1 141 . 1 1 14 14 ARG HG2 H 1 1.5940 0.05 . 2 . . . . 14 ARG HG1|HG2 . 16619 1 142 . 1 1 14 14 ARG HG3 H 1 1.8440 0.05 . 2 . . . . 14 ARG HG2|HG1 . 16619 1 143 . 1 1 14 14 ARG C C 13 178.2310 0.04 . 1 . . . . 14 ARG C . 16619 1 144 . 1 1 14 14 ARG CA C 13 59.5910 0.5 . 1 . . . . 14 ARG CA . 16619 1 145 . 1 1 14 14 ARG CB C 13 30.2620 0.5 . 1 . . . . 14 ARG CB . 16619 1 146 . 1 1 14 14 ARG CD C 13 43.6250 0.5 . 1 . . . . 14 ARG CD . 16619 1 147 . 1 1 14 14 ARG CG C 13 28.2250 0.5 . 1 . . . . 14 ARG CG . 16619 1 148 . 1 1 14 14 ARG N N 15 117.8780 0.1 . 1 . . . . 14 ARG N . 16619 1 149 . 1 1 15 15 LEU H H 1 7.3366 0.006 . 1 . . . . 15 LEU NH . 16619 1 150 . 1 1 15 15 LEU HA H 1 4.0520 0.05 . 1 . . . . 15 LEU HA . 16619 1 151 . 1 1 15 15 LEU HB2 H 1 1.1200 0.05 . 2 . . . . 15 LEU HB1|HB2 . 16619 1 152 . 1 1 15 15 LEU HB3 H 1 1.3400 0.05 . 2 . . . . 15 LEU HB2|HB1 . 16619 1 153 . 1 1 15 15 LEU HD11 H 1 0.3300 0.05 . 2 . . . . 15 LEU HD1#|HD2# . 16619 1 154 . 1 1 15 15 LEU HD12 H 1 0.3300 0.05 . 2 . . . . 15 LEU HD1#|HD2# . 16619 1 155 . 1 1 15 15 LEU HD13 H 1 0.3300 0.05 . 2 . . . . 15 LEU HD1#|HD2# . 16619 1 156 . 1 1 15 15 LEU HD21 H 1 -0.5700 0.05 . 2 . . . . 15 LEU HD2#|HD1# . 16619 1 157 . 1 1 15 15 LEU HD22 H 1 -0.5700 0.05 . 2 . . . . 15 LEU HD2#|HD1# . 16619 1 158 . 1 1 15 15 LEU HD23 H 1 -0.5700 0.05 . 2 . . . . 15 LEU HD2#|HD1# . 16619 1 159 . 1 1 15 15 LEU HG H 1 0.5861 0.05 . 1 . . . . 15 LEU HG . 16619 1 160 . 1 1 15 15 LEU C C 13 177.7960 0.04 . 1 . . . . 15 LEU C . 16619 1 161 . 1 1 15 15 LEU CA C 13 57.3720 0.5 . 1 . . . . 15 LEU CA . 16619 1 162 . 1 1 15 15 LEU CB C 13 41.1960 0.5 . 1 . . . . 15 LEU CB . 16619 1 163 . 1 1 15 15 LEU CD1 C 13 23.0000 0.5 . 2 . . . . 15 LEU CD1 . 16619 1 164 . 1 1 15 15 LEU CD2 C 13 23.1130 0.5 . 2 . . . . 15 LEU CD2 . 16619 1 165 . 1 1 15 15 LEU CG C 13 26.4900 0.5 . 1 . . . . 15 LEU CG . 16619 1 166 . 1 1 15 15 LEU N N 15 120.7764 0.1 . 1 . . . . 15 LEU N . 16619 1 167 . 1 1 16 16 LEU H H 1 7.9037 0.006 . 1 . . . . 16 LEU NH . 16619 1 168 . 1 1 16 16 LEU HA H 1 3.8490 0.05 . 1 . . . . 16 LEU HA . 16619 1 169 . 1 1 16 16 LEU HB2 H 1 1.9960 0.05 . 2 . . . . 16 LEU HB1|HB2 . 16619 1 170 . 1 1 16 16 LEU HB3 H 1 1.3040 0.05 . 2 . . . . 16 LEU HB2|HB1 . 16619 1 171 . 1 1 16 16 LEU HD11 H 1 0.9890 0.05 . 2 . . . . 16 LEU HD1#|HD2# . 16619 1 172 . 1 1 16 16 LEU HD12 H 1 0.9890 0.05 . 2 . . . . 16 LEU HD1#|HD2# . 16619 1 173 . 1 1 16 16 LEU HD13 H 1 0.9890 0.05 . 2 . . . . 16 LEU HD1#|HD2# . 16619 1 174 . 1 1 16 16 LEU HD21 H 1 0.7530 0.05 . 2 . . . . 16 LEU HD2#|HD1# . 16619 1 175 . 1 1 16 16 LEU HD22 H 1 0.7530 0.05 . 2 . . . . 16 LEU HD2#|HD1# . 16619 1 176 . 1 1 16 16 LEU HD23 H 1 0.7530 0.05 . 2 . . . . 16 LEU HD2#|HD1# . 16619 1 177 . 1 1 16 16 LEU HG H 1 2.0070 0.05 . 1 . . . . 16 LEU HG . 16619 1 178 . 1 1 16 16 LEU C C 13 178.2920 0.04 . 1 . . . . 16 LEU C . 16619 1 179 . 1 1 16 16 LEU CA C 13 57.9790 0.5 . 1 . . . . 16 LEU CA . 16619 1 180 . 1 1 16 16 LEU CB C 13 43.4670 0.5 . 1 . . . . 16 LEU CB . 16619 1 181 . 1 1 16 16 LEU CD1 C 13 26.7900 0.5 . 2 . . . . 16 LEU CD1 . 16619 1 182 . 1 1 16 16 LEU CD2 C 13 22.6330 0.5 . 2 . . . . 16 LEU CD2 . 16619 1 183 . 1 1 16 16 LEU CG C 13 26.8820 0.5 . 1 . . . . 16 LEU CG . 16619 1 184 . 1 1 16 16 LEU N N 15 116.4359 0.1 . 1 . . . . 16 LEU N . 16619 1 185 . 1 1 17 17 SER H H 1 8.2399 0.006 . 1 . . . . 17 SER HN . 16619 1 186 . 1 1 17 17 SER HA H 1 4.1650 0.05 . 1 . . . . 17 SER HA . 16619 1 187 . 1 1 17 17 SER HB2 H 1 3.9080 0.05 . 2 . . . . 17 SER HB# . 16619 1 188 . 1 1 17 17 SER HB3 H 1 3.9080 0.05 . 2 . . . . 17 SER HB# . 16619 1 189 . 1 1 17 17 SER C C 13 175.5100 0.04 . 1 . . . . 17 SER C . 16619 1 190 . 1 1 17 17 SER CA C 13 62.4160 0.5 . 1 . . . . 17 SER CA . 16619 1 191 . 1 1 17 17 SER CB C 13 63.0170 0.5 . 1 . . . . 17 SER CB . 16619 1 192 . 1 1 17 17 SER N N 15 112.7115 0.1 . 1 . . . . 17 SER N . 16619 1 193 . 1 1 18 18 ASP H H 1 7.9494 0.006 . 1 . . . . 18 ASP HN . 16619 1 194 . 1 1 18 18 ASP HA H 1 4.1890 0.05 . 1 . . . . 18 ASP HA . 16619 1 195 . 1 1 18 18 ASP HB2 H 1 2.6380 0.05 . 2 . . . . 18 ASP HB1|HB2 . 16619 1 196 . 1 1 18 18 ASP HB3 H 1 2.9630 0.05 . 2 . . . . 18 ASP HB2|HB1 . 16619 1 197 . 1 1 18 18 ASP C C 13 178.6220 0.04 . 1 . . . . 18 ASP C . 16619 1 198 . 1 1 18 18 ASP CA C 13 57.7860 0.5 . 1 . . . . 18 ASP CA . 16619 1 199 . 1 1 18 18 ASP CB C 13 43.3340 0.5 . 1 . . . . 18 ASP CB . 16619 1 200 . 1 1 18 18 ASP N N 15 120.6469 0.1 . 1 . . . . 18 ASP N . 16619 1 201 . 1 1 19 19 TYR H H 1 8.3839 0.006 . 1 . . . . 19 TYR HN . 16619 1 202 . 1 1 19 19 TYR HA H 1 4.5310 0.05 . 1 . . . . 19 TYR HA . 16619 1 203 . 1 1 19 19 TYR HB2 H 1 3.4000 0.05 . 2 . . . . 19 TYR HB# . 16619 1 204 . 1 1 19 19 TYR HB3 H 1 3.4000 0.05 . 2 . . . . 19 TYR HB# . 16619 1 205 . 1 1 19 19 TYR C C 13 178.0930 0.04 . 1 . . . . 19 TYR C . 16619 1 206 . 1 1 19 19 TYR CA C 13 62.3620 0.5 . 1 . . . . 19 TYR CA . 16619 1 207 . 1 1 19 19 TYR CB C 13 40.0410 0.5 . 1 . . . . 19 TYR CB . 16619 1 208 . 1 1 19 19 TYR N N 15 116.2116 0.1 . 1 . . . . 19 TYR N . 16619 1 209 . 1 1 20 20 ILE H H 1 8.7975 0.006 . 1 . . . . 20 ILE HN . 16619 1 210 . 1 1 20 20 ILE HA H 1 3.4600 0.05 . 1 . . . . 20 ILE HA . 16619 1 211 . 1 1 20 20 ILE HB H 1 2.0630 0.05 . 1 . . . . 20 ILE HB . 16619 1 212 . 1 1 20 20 ILE HD11 H 1 0.6282 0.05 . 1 . . . . 20 ILE HD1# . 16619 1 213 . 1 1 20 20 ILE HD12 H 1 0.6282 0.05 . 1 . . . . 20 ILE HD1# . 16619 1 214 . 1 1 20 20 ILE HD13 H 1 0.6282 0.05 . 1 . . . . 20 ILE HD1# . 16619 1 215 . 1 1 20 20 ILE HG12 H 1 2.0210 0.05 . 2 . . . . 20 ILE HG11|HG12 . 16619 1 216 . 1 1 20 20 ILE HG13 H 1 1.2300 0.05 . 2 . . . . 20 ILE HG12|HG11 . 16619 1 217 . 1 1 20 20 ILE HG21 H 1 0.6925 0.05 . 1 . . . . 20 ILE HG2# . 16619 1 218 . 1 1 20 20 ILE HG22 H 1 0.6925 0.05 . 1 . . . . 20 ILE HG2# . 16619 1 219 . 1 1 20 20 ILE HG23 H 1 0.6925 0.05 . 1 . . . . 20 ILE HG2# . 16619 1 220 . 1 1 20 20 ILE C C 13 177.8960 0.04 . 1 . . . . 20 ILE C . 16619 1 221 . 1 1 20 20 ILE CA C 13 62.6130 0.5 . 1 . . . . 20 ILE CA . 16619 1 222 . 1 1 20 20 ILE CB C 13 34.1860 0.5 . 1 . . . . 20 ILE CB . 16619 1 223 . 1 1 20 20 ILE CD1 C 13 8.2240 0.5 . 1 . . . . 20 ILE CD1 . 16619 1 224 . 1 1 20 20 ILE CG1 C 13 27.5030 0.5 . 1 . . . . 20 ILE CG1 . 16619 1 225 . 1 1 20 20 ILE CG2 C 13 17.3020 0.5 . 1 . . . . 20 ILE CG2 . 16619 1 226 . 1 1 20 20 ILE N N 15 119.2731 0.1 . 1 . . . . 20 ILE N . 16619 1 227 . 1 1 21 21 PHE H H 1 7.9745 0.006 . 1 . . . . 21 PHE HN . 16619 1 228 . 1 1 21 21 PHE HA H 1 4.1720 0.05 . 1 . . . . 21 PHE HA . 16619 1 229 . 1 1 21 21 PHE HB2 H 1 2.9850 0.05 . 2 . . . . 21 PHE HB1|HB2 . 16619 1 230 . 1 1 21 21 PHE HB3 H 1 3.2480 0.05 . 2 . . . . 21 PHE HB2|HB1 . 16619 1 231 . 1 1 21 21 PHE HD1 H 1 7.6326 0.05 . 3 . . . . 21 PHE HD1 . 16619 1 232 . 1 1 21 21 PHE HD2 H 1 7.6326 0.05 . 3 . . . . 21 PHE HD2 . 16619 1 233 . 1 1 21 21 PHE HE1 H 1 7.2996 0.05 . 3 . . . . 21 PHE HE1 . 16619 1 234 . 1 1 21 21 PHE HE2 H 1 7.2996 0.05 . 3 . . . . 21 PHE HE2 . 16619 1 235 . 1 1 21 21 PHE HZ H 1 7.4127 0.05 . 1 . . . . 21 PHE HZ . 16619 1 236 . 1 1 21 21 PHE C C 13 179.5780 0.04 . 1 . . . . 21 PHE C . 16619 1 237 . 1 1 21 21 PHE CA C 13 63.0020 0.5 . 1 . . . . 21 PHE CA . 16619 1 238 . 1 1 21 21 PHE CB C 13 37.1960 0.5 . 1 . . . . 21 PHE CB . 16619 1 239 . 1 1 21 21 PHE CD1 C 13 132.1370 0.5 . 3 . . . . 21 PHE CD1 . 16619 1 240 . 1 1 21 21 PHE CD2 C 13 132.1370 0.5 . 3 . . . . 21 PHE CD2 . 16619 1 241 . 1 1 21 21 PHE CE1 C 13 131.0870 0.5 . 3 . . . . 21 PHE CE1 . 16619 1 242 . 1 1 21 21 PHE CE2 C 13 131.0870 0.5 . 3 . . . . 21 PHE CE2 . 16619 1 243 . 1 1 21 21 PHE CZ C 13 129.9870 0.5 . 1 . . . . 21 PHE CZ . 16619 1 244 . 1 1 21 21 PHE N N 15 115.0437 0.1 . 1 . . . . 21 PHE N . 16619 1 245 . 1 1 22 22 PHE H H 1 8.0723 0.006 . 1 . . . . 22 PHE HN . 16619 1 246 . 1 1 22 22 PHE HA H 1 4.1870 0.05 . 1 . . . . 22 PHE HA . 16619 1 247 . 1 1 22 22 PHE HB2 H 1 3.6510 0.05 . 2 . . . . 22 PHE HB1|HB2 . 16619 1 248 . 1 1 22 22 PHE HB3 H 1 3.4247 0.05 . 2 . . . . 22 PHE HB2|HB1 . 16619 1 249 . 1 1 22 22 PHE HD1 H 1 7.1921 0.05 . 3 . . . . 22 PHE HD1 . 16619 1 250 . 1 1 22 22 PHE HD2 H 1 7.1921 0.05 . 3 . . . . 22 PHE HD2 . 16619 1 251 . 1 1 22 22 PHE HE1 H 1 7.2996 0.05 . 3 . . . . 22 PHE HE1 . 16619 1 252 . 1 1 22 22 PHE HE2 H 1 7.2996 0.05 . 3 . . . . 22 PHE HE2 . 16619 1 253 . 1 1 22 22 PHE HZ H 1 7.4322 0.05 . 1 . . . . 22 PHE HZ . 16619 1 254 . 1 1 22 22 PHE C C 13 178.3540 0.04 . 1 . . . . 22 PHE C . 16619 1 255 . 1 1 22 22 PHE CA C 13 61.5820 0.5 . 1 . . . . 22 PHE CA . 16619 1 256 . 1 1 22 22 PHE CB C 13 38.1160 0.5 . 1 . . . . 22 PHE CB . 16619 1 257 . 1 1 22 22 PHE CD1 C 13 132.0850 0.5 . 3 . . . . 22 PHE CD1 . 16619 1 258 . 1 1 22 22 PHE CD2 C 13 132.0850 0.5 . 3 . . . . 22 PHE CD2 . 16619 1 259 . 1 1 22 22 PHE CE1 C 13 131.0870 0.5 . 3 . . . . 22 PHE CE1 . 16619 1 260 . 1 1 22 22 PHE CE2 C 13 131.0870 0.5 . 3 . . . . 22 PHE CE2 . 16619 1 261 . 1 1 22 22 PHE CZ C 13 129.9870 0.5 . 1 . . . . 22 PHE CZ . 16619 1 262 . 1 1 22 22 PHE N N 15 122.1315 0.1 . 1 . . . . 22 PHE N . 16619 1 263 . 1 1 23 23 CYS H H 1 8.0379 0.006 . 1 . . . . 23 CYS HN . 16619 1 264 . 1 1 23 23 CYS HA H 1 3.4560 0.05 . 1 . . . . 23 CYS HA . 16619 1 265 . 1 1 23 23 CYS HB2 H 1 2.6260 0.05 . 2 . . . . 23 CYS HB# . 16619 1 266 . 1 1 23 23 CYS HB3 H 1 2.6260 0.05 . 2 . . . . 23 CYS HB# . 16619 1 267 . 1 1 23 23 CYS C C 13 175.2400 0.04 . 1 . . . . 23 CYS C . 16619 1 268 . 1 1 23 23 CYS CA C 13 63.6390 0.5 . 1 . . . . 23 CYS CA . 16619 1 269 . 1 1 23 23 CYS CB C 13 27.2780 0.5 . 1 . . . . 23 CYS CB . 16619 1 270 . 1 1 23 23 CYS N N 15 119.7738 0.1 . 1 . . . . 23 CYS N . 16619 1 271 . 1 1 24 24 ALA H H 1 7.2921 0.006 . 1 . . . . 24 ALA HN . 16619 1 272 . 1 1 24 24 ALA HA H 1 4.3520 0.05 . 1 . . . . 24 ALA HA . 16619 1 273 . 1 1 24 24 ALA HB1 H 1 1.1620 0.05 . 1 . . . . 24 ALA HB# . 16619 1 274 . 1 1 24 24 ALA HB2 H 1 1.1620 0.05 . 1 . . . . 24 ALA HB# . 16619 1 275 . 1 1 24 24 ALA HB3 H 1 1.1620 0.05 . 1 . . . . 24 ALA HB# . 16619 1 276 . 1 1 24 24 ALA C C 13 176.1470 0.04 . 1 . . . . 24 ALA C . 16619 1 277 . 1 1 24 24 ALA CA C 13 51.2910 0.5 . 1 . . . . 24 ALA CA . 16619 1 278 . 1 1 24 24 ALA CB C 13 20.4000 0.5 . 1 . . . . 24 ALA CB . 16619 1 279 . 1 1 24 24 ALA N N 15 119.6180 0.1 . 1 . . . . 24 ALA N . 16619 1 280 . 1 1 25 25 ARG H H 1 6.7204 0.006 . 1 . . . . 25 ARG HN . 16619 1 281 . 1 1 25 25 ARG HA H 1 4.1910 0.05 . 1 . . . . 25 ARG HA . 16619 1 282 . 1 1 25 25 ARG HB2 H 1 1.8710 0.05 . 2 . . . . 25 ARG HB1|HB2 . 16619 1 283 . 1 1 25 25 ARG HB3 H 1 1.6560 0.05 . 2 . . . . 25 ARG HB2|HB1 . 16619 1 284 . 1 1 25 25 ARG HD2 H 1 2.8900 0.05 . 2 . . . . 25 ARG HD# . 16619 1 285 . 1 1 25 25 ARG HD3 H 1 2.8900 0.05 . 2 . . . . 25 ARG HD# . 16619 1 286 . 1 1 25 25 ARG HG2 H 1 1.5900 0.05 . 2 . . . . 25 ARG HG# . 16619 1 287 . 1 1 25 25 ARG HG3 H 1 1.5900 0.05 . 2 . . . . 25 ARG HG# . 16619 1 288 . 1 1 25 25 ARG C C 13 175.2210 0.04 . 1 . . . . 25 ARG C . 16619 1 289 . 1 1 25 25 ARG CA C 13 55.9500 0.5 . 1 . . . . 25 ARG CA . 16619 1 290 . 1 1 25 25 ARG CB C 13 29.9130 0.5 . 1 . . . . 25 ARG CB . 16619 1 291 . 1 1 25 25 ARG CD C 13 43.6280 0.5 . 1 . . . . 25 ARG CD . 16619 1 292 . 1 1 25 25 ARG CG C 13 27.7120 0.5 . 1 . . . . 25 ARG CG . 16619 1 293 . 1 1 25 25 ARG N N 15 118.6250 0.1 . 1 . . . . 25 ARG N . 16619 1 294 . 1 1 26 26 GLU H H 1 8.6358 0.006 . 1 . . . . 26 GLU HN . 16619 1 295 . 1 1 26 26 GLU HA H 1 4.3552 0.05 . 1 . . . . 26 GLU HA . 16619 1 296 . 1 1 26 26 GLU HB2 H 1 2.1320 0.05 . 2 . . . . 26 GLU HB# . 16619 1 297 . 1 1 26 26 GLU HB3 H 1 2.1320 0.05 . 2 . . . . 26 GLU HB# . 16619 1 298 . 1 1 26 26 GLU HG2 H 1 2.3850 0.05 . 2 . . . . 26 GLU HG# . 16619 1 299 . 1 1 26 26 GLU HG3 H 1 2.3850 0.05 . 2 . . . . 26 GLU HG# . 16619 1 300 . 1 1 26 26 GLU CA C 13 55.2990 0.5 . 1 . . . . 26 GLU CA . 16619 1 301 . 1 1 26 26 GLU CB C 13 28.9670 0.5 . 1 . . . . 26 GLU CB . 16619 1 302 . 1 1 26 26 GLU CG C 13 36.3600 0.5 . 1 . . . . 26 GLU CG . 16619 1 303 . 1 1 26 26 GLU N N 15 122.4771 0.1 . 1 . . . . 26 GLU N . 16619 1 304 . 1 1 27 27 PRO HA H 1 4.2790 0.05 . 1 . . . . 27 PRO HA . 16619 1 305 . 1 1 27 27 PRO HB2 H 1 2.2740 0.05 . 2 . . . . 27 PRO HB1|HB2 . 16619 1 306 . 1 1 27 27 PRO HB3 H 1 1.8770 0.05 . 2 . . . . 27 PRO HB2|HB1 . 16619 1 307 . 1 1 27 27 PRO HD2 H 1 3.7260 0.05 . 2 . . . . 27 PRO HD1|HD2 . 16619 1 308 . 1 1 27 27 PRO HD3 H 1 3.6390 0.05 . 2 . . . . 27 PRO HD2|HD1 . 16619 1 309 . 1 1 27 27 PRO HG2 H 1 1.9190 0.05 . 2 . . . . 27 PRO HG# . 16619 1 310 . 1 1 27 27 PRO HG3 H 1 1.9190 0.05 . 2 . . . . 27 PRO HG# . 16619 1 311 . 1 1 27 27 PRO C C 13 176.3980 0.04 . 1 . . . . 27 PRO C . 16619 1 312 . 1 1 27 27 PRO CA C 13 64.2990 0.5 . 1 . . . . 27 PRO CA . 16619 1 313 . 1 1 27 27 PRO CB C 13 31.9800 0.5 . 1 . . . . 27 PRO CB . 16619 1 314 . 1 1 27 27 PRO CD C 13 50.9510 0.5 . 1 . . . . 27 PRO CD . 16619 1 315 . 1 1 27 27 PRO CG C 13 27.8370 0.5 . 1 . . . . 27 PRO CG . 16619 1 316 . 1 1 28 28 ASP H H 1 8.5438 0.006 . 1 . . . . 28 ASP HN . 16619 1 317 . 1 1 28 28 ASP HA H 1 4.4610 0.05 . 1 . . . . 28 ASP HA . 16619 1 318 . 1 1 28 28 ASP HB2 H 1 2.7970 0.05 . 2 . . . . 28 ASP HB# . 16619 1 319 . 1 1 28 28 ASP HB3 H 1 2.7970 0.05 . 2 . . . . 28 ASP HB# . 16619 1 320 . 1 1 28 28 ASP C C 13 175.6060 0.04 . 1 . . . . 28 ASP C . 16619 1 321 . 1 1 28 28 ASP CA C 13 54.8100 0.5 . 1 . . . . 28 ASP CA . 16619 1 322 . 1 1 28 28 ASP CB C 13 39.5320 0.5 . 1 . . . . 28 ASP CB . 16619 1 323 . 1 1 28 28 ASP N N 15 115.4512 0.1 . 1 . . . . 28 ASP N . 16619 1 324 . 1 1 29 29 THR H H 1 7.4946 0.006 . 1 . . . . 29 THR HN . 16619 1 325 . 1 1 29 29 THR HA H 1 4.7410 0.05 . 1 . . . . 29 THR HA . 16619 1 326 . 1 1 29 29 THR HB H 1 4.2290 0.05 . 1 . . . . 29 THR HB . 16619 1 327 . 1 1 29 29 THR HG21 H 1 1.2660 0.05 . 1 . . . . 29 THR HG2# . 16619 1 328 . 1 1 29 29 THR HG22 H 1 1.2660 0.05 . 1 . . . . 29 THR HG2# . 16619 1 329 . 1 1 29 29 THR HG23 H 1 1.2660 0.05 . 1 . . . . 29 THR HG2# . 16619 1 330 . 1 1 29 29 THR CA C 13 59.6560 0.5 . 1 . . . . 29 THR CA . 16619 1 331 . 1 1 29 29 THR CB C 13 70.4610 0.5 . 1 . . . . 29 THR CB . 16619 1 332 . 1 1 29 29 THR CG2 C 13 22.0730 0.5 . 1 . . . . 29 THR CG2 . 16619 1 333 . 1 1 29 29 THR N N 15 111.8918 0.1 . 1 . . . . 29 THR N . 16619 1 334 . 1 1 30 30 PRO HA H 1 4.4100 0.05 . 1 . . . . 30 PRO HA . 16619 1 335 . 1 1 30 30 PRO HB2 H 1 2.3330 0.05 . 2 . . . . 30 PRO HB1|HB2 . 16619 1 336 . 1 1 30 30 PRO HB3 H 1 1.8180 0.05 . 2 . . . . 30 PRO HB2|HB1 . 16619 1 337 . 1 1 30 30 PRO HD2 H 1 3.8790 0.05 . 2 . . . . 30 PRO HD1|HD2 . 16619 1 338 . 1 1 30 30 PRO HD3 H 1 3.6680 0.05 . 2 . . . . 30 PRO HD2|HD1 . 16619 1 339 . 1 1 30 30 PRO HG2 H 1 2.0020 0.05 . 2 . . . . 30 PRO HG# . 16619 1 340 . 1 1 30 30 PRO HG3 H 1 2.0020 0.05 . 2 . . . . 30 PRO HG# . 16619 1 341 . 1 1 30 30 PRO C C 13 176.7500 0.04 . 1 . . . . 30 PRO C . 16619 1 342 . 1 1 30 30 PRO CA C 13 62.8900 0.5 . 1 . . . . 30 PRO CA . 16619 1 343 . 1 1 30 30 PRO CB C 13 31.9610 0.5 . 1 . . . . 30 PRO CB . 16619 1 344 . 1 1 30 30 PRO CD C 13 51.0010 0.5 . 1 . . . . 30 PRO CD . 16619 1 345 . 1 1 30 30 PRO CG C 13 27.8630 0.5 . 1 . . . . 30 PRO CG . 16619 1 346 . 1 1 31 31 GLU H H 1 8.8180 0.006 . 1 . . . . 31 GLU HN . 16619 1 347 . 1 1 31 31 GLU HA H 1 4.4004 0.05 . 1 . . . . 31 GLU HA . 16619 1 348 . 1 1 31 31 GLU HB2 H 1 2.1600 0.05 . 2 . . . . 31 GLU HB# . 16619 1 349 . 1 1 31 31 GLU HB3 H 1 2.1600 0.05 . 2 . . . . 31 GLU HB# . 16619 1 350 . 1 1 31 31 GLU HG2 H 1 2.3600 0.05 . 2 . . . . 31 GLU HG# . 16619 1 351 . 1 1 31 31 GLU HG3 H 1 2.3600 0.05 . 2 . . . . 31 GLU HG# . 16619 1 352 . 1 1 31 31 GLU CA C 13 55.0550 0.5 . 1 . . . . 31 GLU CA . 16619 1 353 . 1 1 31 31 GLU CB C 13 29.7030 0.5 . 1 . . . . 31 GLU CB . 16619 1 354 . 1 1 31 31 GLU CG C 13 33.9920 0.5 . 1 . . . . 31 GLU CG . 16619 1 355 . 1 1 31 31 GLU N N 15 124.0993 0.1 . 1 . . . . 31 GLU N . 16619 1 356 . 1 1 34 34 PRO HA H 1 4.6650 0.05 . 1 . . . . 34 PRO HA . 16619 1 357 . 1 1 34 34 PRO HB2 H 1 2.0410 0.05 . 2 . . . . 34 PRO HB1|HB2 . 16619 1 358 . 1 1 34 34 PRO HB3 H 1 1.8020 0.05 . 2 . . . . 34 PRO HB2|HB1 . 16619 1 359 . 1 1 34 34 PRO HD2 H 1 3.6350 0.05 . 2 . . . . 34 PRO HD# . 16619 1 360 . 1 1 34 34 PRO HD3 H 1 3.6350 0.05 . 2 . . . . 34 PRO HD# . 16619 1 361 . 1 1 34 34 PRO HG2 H 1 2.0470 0.05 . 2 . . . . 34 PRO HG# . 16619 1 362 . 1 1 34 34 PRO HG3 H 1 2.0470 0.05 . 2 . . . . 34 PRO HG# . 16619 1 363 . 1 1 34 34 PRO C C 13 178.5030 0.04 . 1 . . . . 34 PRO C . 16619 1 364 . 1 1 34 34 PRO CA C 13 62.5223 0.5 . 1 . . . . 34 PRO CA . 16619 1 365 . 1 1 34 34 PRO CB C 13 31.9750 0.5 . 1 . . . . 34 PRO CB . 16619 1 366 . 1 1 34 34 PRO CD C 13 51.0700 0.5 . 1 . . . . 34 PRO CD . 16619 1 367 . 1 1 34 34 PRO CG C 13 27.6920 0.5 . 1 . . . . 34 PRO CG . 16619 1 368 . 1 1 35 35 THR H H 1 8.3825 0.006 . 1 . . . . 35 THR HN . 16619 1 369 . 1 1 35 35 THR HA H 1 4.1974 0.05 . 1 . . . . 35 THR HA . 16619 1 370 . 1 1 35 35 THR HB H 1 4.4810 0.05 . 1 . . . . 35 THR HB . 16619 1 371 . 1 1 35 35 THR HG21 H 1 1.3090 0.05 . 1 . . . . 35 THR HG2# . 16619 1 372 . 1 1 35 35 THR HG22 H 1 1.3090 0.05 . 1 . . . . 35 THR HG2# . 16619 1 373 . 1 1 35 35 THR HG23 H 1 1.3090 0.05 . 1 . . . . 35 THR HG2# . 16619 1 374 . 1 1 35 35 THR C C 13 173.6870 0.04 . 1 . . . . 35 THR C . 16619 1 375 . 1 1 35 35 THR CA C 13 62.6180 0.5 . 1 . . . . 35 THR CA . 16619 1 376 . 1 1 35 35 THR CB C 13 70.7400 0.5 . 1 . . . . 35 THR CB . 16619 1 377 . 1 1 35 35 THR CG2 C 13 22.2320 0.5 . 1 . . . . 35 THR CG2 . 16619 1 378 . 1 1 35 35 THR N N 15 110.9868 0.1 . 1 . . . . 35 THR N . 16619 1 379 . 1 1 36 36 SER H H 1 7.3126 0.006 . 1 . . . . 36 SER HN . 16619 1 380 . 1 1 36 36 SER HA H 1 4.6030 0.05 . 1 . . . . 36 SER HA . 16619 1 381 . 1 1 36 36 SER HB2 H 1 3.9300 0.05 . 2 . . . . 36 SER HB# . 16619 1 382 . 1 1 36 36 SER HB3 H 1 3.9300 0.05 . 2 . . . . 36 SER HB# . 16619 1 383 . 1 1 36 36 SER C C 13 174.8720 0.04 . 1 . . . . 36 SER C . 16619 1 384 . 1 1 36 36 SER CA C 13 57.8510 0.5 . 1 . . . . 36 SER CA . 16619 1 385 . 1 1 36 36 SER CB C 13 66.1050 0.5 . 1 . . . . 36 SER CB . 16619 1 386 . 1 1 36 36 SER N N 15 112.5239 0.1 . 1 . . . . 36 SER N . 16619 1 387 . 1 1 37 37 VAL H H 1 8.7928 0.006 . 1 . . . . 37 VAL HN . 16619 1 388 . 1 1 37 37 VAL HA H 1 3.8670 0.05 . 1 . . . . 37 VAL HA . 16619 1 389 . 1 1 37 37 VAL HB H 1 2.1820 0.05 . 1 . . . . 37 VAL HB . 16619 1 390 . 1 1 37 37 VAL HG11 H 1 1.1295 0.05 . 2 . . . . 37 VAL HG1#|HG2# . 16619 1 391 . 1 1 37 37 VAL HG12 H 1 1.1295 0.05 . 2 . . . . 37 VAL HG1#|HG2# . 16619 1 392 . 1 1 37 37 VAL HG13 H 1 1.1295 0.05 . 2 . . . . 37 VAL HG1#|HG2# . 16619 1 393 . 1 1 37 37 VAL HG21 H 1 1.1295 0.05 . 2 . . . . 37 VAL HG2#|HG1# . 16619 1 394 . 1 1 37 37 VAL HG22 H 1 1.1295 0.05 . 2 . . . . 37 VAL HG2#|HG1# . 16619 1 395 . 1 1 37 37 VAL HG23 H 1 1.1295 0.05 . 2 . . . . 37 VAL HG2#|HG1# . 16619 1 396 . 1 1 37 37 VAL C C 13 178.9810 0.04 . 1 . . . . 37 VAL C . 16619 1 397 . 1 1 37 37 VAL CA C 13 66.5210 0.5 . 1 . . . . 37 VAL CA . 16619 1 398 . 1 1 37 37 VAL CB C 13 31.5900 0.5 . 1 . . . . 37 VAL CB . 16619 1 399 . 1 1 37 37 VAL CG1 C 13 21.5450 0.5 . 2 . . . . 37 VAL CG1|CG2 . 16619 1 400 . 1 1 37 37 VAL CG2 C 13 21.5450 0.5 . 2 . . . . 37 VAL CG2|CG1 . 16619 1 401 . 1 1 37 37 VAL N N 15 121.9759 0.1 . 1 . . . . 37 VAL N . 16619 1 402 . 1 1 38 38 GLU H H 1 9.6196 0.006 . 1 . . . . 38 GLU HN . 16619 1 403 . 1 1 38 38 GLU HA H 1 4.3680 0.05 . 1 . . . . 38 GLU HA . 16619 1 404 . 1 1 38 38 GLU C C 13 177.2140 0.04 . 1 . . . . 38 GLU C . 16619 1 405 . 1 1 38 38 GLU CA C 13 59.9160 0.5 . 1 . . . . 38 GLU CA . 16619 1 406 . 1 1 38 38 GLU CB C 13 26.6360 0.5 . 1 . . . . 38 GLU CB . 16619 1 407 . 1 1 38 38 GLU N N 15 119.8163 0.1 . 1 . . . . 38 GLU N . 16619 1 408 . 1 1 39 39 ALA H H 1 8.3028 0.006 . 1 . . . . 39 ALA HN . 16619 1 409 . 1 1 39 39 ALA HA H 1 3.7290 0.05 . 1 . . . . 39 ALA HA . 16619 1 410 . 1 1 39 39 ALA HB1 H 1 1.3910 0.05 . 1 . . . . 39 ALA HB# . 16619 1 411 . 1 1 39 39 ALA HB2 H 1 1.3910 0.05 . 1 . . . . 39 ALA HB# . 16619 1 412 . 1 1 39 39 ALA HB3 H 1 1.3910 0.05 . 1 . . . . 39 ALA HB# . 16619 1 413 . 1 1 39 39 ALA C C 13 180.1020 0.04 . 1 . . . . 39 ALA C . 16619 1 414 . 1 1 39 39 ALA CA C 13 55.2690 0.5 . 1 . . . . 39 ALA CA . 16619 1 415 . 1 1 39 39 ALA CB C 13 18.3670 0.5 . 1 . . . . 39 ALA CB . 16619 1 416 . 1 1 39 39 ALA N N 15 124.1037 0.1 . 1 . . . . 39 ALA N . 16619 1 417 . 1 1 40 40 ALA H H 1 7.6746 0.006 . 1 . . . . 40 ALA HN . 16619 1 418 . 1 1 40 40 ALA HA H 1 3.8110 0.05 . 1 . . . . 40 ALA HA . 16619 1 419 . 1 1 40 40 ALA HB1 H 1 1.5550 0.05 . 1 . . . . 40 ALA HB# . 16619 1 420 . 1 1 40 40 ALA HB2 H 1 1.5550 0.05 . 1 . . . . 40 ALA HB# . 16619 1 421 . 1 1 40 40 ALA HB3 H 1 1.5550 0.05 . 1 . . . . 40 ALA HB# . 16619 1 422 . 1 1 40 40 ALA C C 13 180.6330 0.04 . 1 . . . . 40 ALA C . 16619 1 423 . 1 1 40 40 ALA CA C 13 55.2300 0.5 . 1 . . . . 40 ALA CA . 16619 1 424 . 1 1 40 40 ALA CB C 13 18.4970 0.5 . 1 . . . . 40 ALA CB . 16619 1 425 . 1 1 40 40 ALA N N 15 122.0115 0.1 . 1 . . . . 40 ALA N . 16619 1 426 . 1 1 41 41 LEU H H 1 8.5162 0.006 . 1 . . . . 41 LEU NH . 16619 1 427 . 1 1 41 41 LEU HA H 1 4.1820 0.05 . 1 . . . . 41 LEU HA . 16619 1 428 . 1 1 41 41 LEU HB2 H 1 1.8145 0.05 . 2 . . . . 41 LEU HB1|HB2 . 16619 1 429 . 1 1 41 41 LEU HB3 H 1 1.5910 0.05 . 2 . . . . 41 LEU HB2|HB1 . 16619 1 430 . 1 1 41 41 LEU HD11 H 1 0.9000 0.05 . 2 . . . . 41 LEU HD1#|HD2# . 16619 1 431 . 1 1 41 41 LEU HD12 H 1 0.9000 0.05 . 2 . . . . 41 LEU HD1#|HD2# . 16619 1 432 . 1 1 41 41 LEU HD13 H 1 0.9000 0.05 . 2 . . . . 41 LEU HD1#|HD2# . 16619 1 433 . 1 1 41 41 LEU HD21 H 1 0.8100 0.05 . 2 . . . . 41 LEU HD2#|HD1# . 16619 1 434 . 1 1 41 41 LEU HD22 H 1 0.8100 0.05 . 2 . . . . 41 LEU HD2#|HD1# . 16619 1 435 . 1 1 41 41 LEU HD23 H 1 0.8100 0.05 . 2 . . . . 41 LEU HD2#|HD1# . 16619 1 436 . 1 1 41 41 LEU HG H 1 1.5910 0.05 . 1 . . . . 41 LEU HG . 16619 1 437 . 1 1 41 41 LEU C C 13 179.1530 0.04 . 1 . . . . 41 LEU C . 16619 1 438 . 1 1 41 41 LEU CA C 13 57.5140 0.5 . 1 . . . . 41 LEU CA . 16619 1 439 . 1 1 41 41 LEU CB C 13 42.8240 0.5 . 1 . . . . 41 LEU CB . 16619 1 440 . 1 1 41 41 LEU CD1 C 13 25.1200 0.5 . 2 . . . . 41 LEU CD1 . 16619 1 441 . 1 1 41 41 LEU CD2 C 13 25.8100 0.5 . 2 . . . . 41 LEU CD2 . 16619 1 442 . 1 1 41 41 LEU CG C 13 27.0020 0.5 . 1 . . . . 41 LEU CG . 16619 1 443 . 1 1 41 41 LEU N N 15 120.5339 0.1 . 1 . . . . 41 LEU N . 16619 1 444 . 1 1 42 42 LEU H H 1 8.7270 0.006 . 1 . . . . 42 LEU NH . 16619 1 445 . 1 1 42 42 LEU HA H 1 4.0310 0.05 . 1 . . . . 42 LEU HA . 16619 1 446 . 1 1 42 42 LEU HB2 H 1 1.5420 0.05 . 2 . . . . 42 LEU HB# . 16619 1 447 . 1 1 42 42 LEU HB3 H 1 1.5420 0.05 . 2 . . . . 42 LEU HB# . 16619 1 448 . 1 1 42 42 LEU HD11 H 1 0.6000 0.05 . 2 . . . . 42 LEU HD1#|HD2# . 16619 1 449 . 1 1 42 42 LEU HD12 H 1 0.6000 0.05 . 2 . . . . 42 LEU HD1#|HD2# . 16619 1 450 . 1 1 42 42 LEU HD13 H 1 0.6000 0.05 . 2 . . . . 42 LEU HD1#|HD2# . 16619 1 451 . 1 1 42 42 LEU HD21 H 1 0.2730 0.05 . 2 . . . . 42 LEU HD2#|HD1# . 16619 1 452 . 1 1 42 42 LEU HD22 H 1 0.2730 0.05 . 2 . . . . 42 LEU HD2#|HD1# . 16619 1 453 . 1 1 42 42 LEU HD23 H 1 0.2730 0.05 . 2 . . . . 42 LEU HD2#|HD1# . 16619 1 454 . 1 1 42 42 LEU HG H 1 1.6590 0.05 . 1 . . . . 42 LEU HG . 16619 1 455 . 1 1 42 42 LEU C C 13 179.9450 0.04 . 1 . . . . 42 LEU C . 16619 1 456 . 1 1 42 42 LEU CA C 13 58.0030 0.5 . 1 . . . . 42 LEU CA . 16619 1 457 . 1 1 42 42 LEU CB C 13 41.5670 0.5 . 1 . . . . 42 LEU CB . 16619 1 458 . 1 1 42 42 LEU CD1 C 13 24.0930 0.5 . 2 . . . . 42 LEU CD1 . 16619 1 459 . 1 1 42 42 LEU CD2 C 13 26.9620 0.5 . 2 . . . . 42 LEU CD2 . 16619 1 460 . 1 1 42 42 LEU CG C 13 27.2230 0.5 . 1 . . . . 42 LEU CG . 16619 1 461 . 1 1 42 42 LEU N N 15 118.1024 0.1 . 1 . . . . 42 LEU N . 16619 1 462 . 1 1 43 43 ARG H H 1 7.3810 0.006 . 1 . . . . 43 ARG HN . 16619 1 463 . 1 1 43 43 ARG HA H 1 3.9310 0.05 . 1 . . . . 43 ARG HA . 16619 1 464 . 1 1 43 43 ARG HB2 H 1 1.8320 0.05 . 2 . . . . 43 ARG HB# . 16619 1 465 . 1 1 43 43 ARG HB3 H 1 1.8320 0.05 . 2 . . . . 43 ARG HB# . 16619 1 466 . 1 1 43 43 ARG HD2 H 1 3.1870 0.05 . 2 . . . . 43 ARG HD# . 16619 1 467 . 1 1 43 43 ARG HD3 H 1 3.1870 0.05 . 2 . . . . 43 ARG HD# . 16619 1 468 . 1 1 43 43 ARG HG2 H 1 1.6300 0.05 . 2 . . . . 43 ARG HG# . 16619 1 469 . 1 1 43 43 ARG HG3 H 1 1.6300 0.05 . 2 . . . . 43 ARG HG# . 16619 1 470 . 1 1 43 43 ARG C C 13 177.3940 0.04 . 1 . . . . 43 ARG C . 16619 1 471 . 1 1 43 43 ARG CA C 13 60.9400 0.5 . 1 . . . . 43 ARG CA . 16619 1 472 . 1 1 43 43 ARG CB C 13 29.8850 0.5 . 1 . . . . 43 ARG CB . 16619 1 473 . 1 1 43 43 ARG CD C 13 43.3350 0.5 . 1 . . . . 43 ARG CD . 16619 1 474 . 1 1 43 43 ARG CG C 13 26.8040 0.5 . 1 . . . . 43 ARG CG . 16619 1 475 . 1 1 43 43 ARG N N 15 117.6705 0.1 . 1 . . . . 43 ARG N . 16619 1 476 . 1 1 44 44 SER H H 1 7.2861 0.006 . 1 . . . . 44 SER HN . 16619 1 477 . 1 1 44 44 SER HA H 1 4.3120 0.05 . 1 . . . . 44 SER HA . 16619 1 478 . 1 1 44 44 SER HB2 H 1 4.0400 0.05 . 2 . . . . 44 SER HB# . 16619 1 479 . 1 1 44 44 SER HB3 H 1 4.0400 0.05 . 2 . . . . 44 SER HB# . 16619 1 480 . 1 1 44 44 SER C C 13 177.5730 0.04 . 1 . . . . 44 SER C . 16619 1 481 . 1 1 44 44 SER CA C 13 61.6240 0.5 . 1 . . . . 44 SER CA . 16619 1 482 . 1 1 44 44 SER CB C 13 63.0770 0.5 . 1 . . . . 44 SER CB . 16619 1 483 . 1 1 44 44 SER N N 15 113.3850 0.1 . 1 . . . . 44 SER N . 16619 1 484 . 1 1 45 45 VAL H H 1 8.6722 0.006 . 1 . . . . 45 VAL HN . 16619 1 485 . 1 1 45 45 VAL HA H 1 3.9250 0.05 . 1 . . . . 45 VAL HA . 16619 1 486 . 1 1 45 45 VAL HB H 1 1.7890 0.05 . 1 . . . . 45 VAL HB . 16619 1 487 . 1 1 45 45 VAL HG11 H 1 0.6810 0.05 . 2 . . . . 45 VAL HG1#|HG2# . 16619 1 488 . 1 1 45 45 VAL HG12 H 1 0.6810 0.05 . 2 . . . . 45 VAL HG1#|HG2# . 16619 1 489 . 1 1 45 45 VAL HG13 H 1 0.6810 0.05 . 2 . . . . 45 VAL HG1#|HG2# . 16619 1 490 . 1 1 45 45 VAL HG21 H 1 0.5610 0.05 . 2 . . . . 45 VAL HG2#|HG1# . 16619 1 491 . 1 1 45 45 VAL HG22 H 1 0.5610 0.05 . 2 . . . . 45 VAL HG2#|HG1# . 16619 1 492 . 1 1 45 45 VAL HG23 H 1 0.5610 0.05 . 2 . . . . 45 VAL HG2#|HG1# . 16619 1 493 . 1 1 45 45 VAL C C 13 179.1100 0.04 . 1 . . . . 45 VAL C . 16619 1 494 . 1 1 45 45 VAL CA C 13 65.9260 0.5 . 1 . . . . 45 VAL CA . 16619 1 495 . 1 1 45 45 VAL CB C 13 32.2970 0.5 . 1 . . . . 45 VAL CB . 16619 1 496 . 1 1 45 45 VAL CG1 C 13 21.5490 0.5 . 2 . . . . 45 VAL CG1|CG2 . 16619 1 497 . 1 1 45 45 VAL CG2 C 13 21.1130 0.5 . 2 . . . . 45 VAL CG2|CG1 . 16619 1 498 . 1 1 45 45 VAL N N 15 120.1784 0.1 . 1 . . . . 45 VAL N . 16619 1 499 . 1 1 46 46 THR H H 1 8.0368 0.006 . 1 . . . . 46 THR HN . 16619 1 500 . 1 1 46 46 THR HA H 1 3.9170 0.05 . 1 . . . . 46 THR HA . 16619 1 501 . 1 1 46 46 THR HB H 1 4.1410 0.05 . 1 . . . . 46 THR HB . 16619 1 502 . 1 1 46 46 THR HG21 H 1 1.2030 0.05 . 1 . . . . 46 THR HG2# . 16619 1 503 . 1 1 46 46 THR HG22 H 1 1.2030 0.05 . 1 . . . . 46 THR HG2# . 16619 1 504 . 1 1 46 46 THR HG23 H 1 1.2030 0.05 . 1 . . . . 46 THR HG2# . 16619 1 505 . 1 1 46 46 THR C C 13 176.9930 0.04 . 1 . . . . 46 THR C . 16619 1 506 . 1 1 46 46 THR CA C 13 66.0150 0.5 . 1 . . . . 46 THR CA . 16619 1 507 . 1 1 46 46 THR CB C 13 69.9710 0.5 . 1 . . . . 46 THR CB . 16619 1 508 . 1 1 46 46 THR CG2 C 13 22.1720 0.5 . 1 . . . . 46 THR CG2 . 16619 1 509 . 1 1 46 46 THR N N 15 109.0789 0.1 . 1 . . . . 46 THR N . 16619 1 510 . 1 1 47 47 ARG H H 1 7.4717 0.006 . 1 . . . . 47 ARG HN . 16619 1 511 . 1 1 47 47 ARG HA H 1 4.3230 0.05 . 1 . . . . 47 ARG HA . 16619 1 512 . 1 1 47 47 ARG HB3 H 1 2.0890 0.05 . 2 . . . . 47 ARG HB2|HB1 . 16619 1 513 . 1 1 47 47 ARG HD2 H 1 3.3480 0.05 . 2 . . . . 47 ARG HD# . 16619 1 514 . 1 1 47 47 ARG HD3 H 1 3.3480 0.05 . 2 . . . . 47 ARG HD# . 16619 1 515 . 1 1 47 47 ARG HG2 H 1 1.8780 0.05 . 2 . . . . 47 ARG HG1|HG2 . 16619 1 516 . 1 1 47 47 ARG HG3 H 1 2.1570 0.05 . 2 . . . . 47 ARG HG2|HG1 . 16619 1 517 . 1 1 47 47 ARG C C 13 178.6860 0.04 . 1 . . . . 47 ARG C . 16619 1 518 . 1 1 47 47 ARG CA C 13 59.8510 0.5 . 1 . . . . 47 ARG CA . 16619 1 519 . 1 1 47 47 ARG CB C 13 29.7650 0.5 . 1 . . . . 47 ARG CB . 16619 1 520 . 1 1 47 47 ARG CD C 13 43.5200 0.5 . 1 . . . . 47 ARG CD . 16619 1 521 . 1 1 47 47 ARG CG C 13 27.4210 0.5 . 1 . . . . 47 ARG CG . 16619 1 522 . 1 1 47 47 ARG N N 15 123.0247 0.1 . 1 . . . . 47 ARG N . 16619 1 523 . 1 1 48 48 GLN H H 1 7.3856 0.006 . 1 . . . . 48 GLN HN . 16619 1 524 . 1 1 48 48 GLN HA H 1 4.1790 0.05 . 1 . . . . 48 GLN HA . 16619 1 525 . 1 1 48 48 GLN HB2 H 1 2.2700 0.05 . 2 . . . . 48 GLN HB# . 16619 1 526 . 1 1 48 48 GLN HB3 H 1 2.2700 0.05 . 2 . . . . 48 GLN HB# . 16619 1 527 . 1 1 48 48 GLN HG2 H 1 2.5230 0.05 . 2 . . . . 48 GLN HG1|HG2 . 16619 1 528 . 1 1 48 48 GLN HG3 H 1 2.4260 0.05 . 2 . . . . 48 GLN HG2|HG1 . 16619 1 529 . 1 1 48 48 GLN C C 13 178.5040 0.04 . 1 . . . . 48 GLN C . 16619 1 530 . 1 1 48 48 GLN CA C 13 59.1850 0.5 . 1 . . . . 48 GLN CA . 16619 1 531 . 1 1 48 48 GLN CB C 13 28.3080 0.5 . 1 . . . . 48 GLN CB . 16619 1 532 . 1 1 48 48 GLN CG C 13 33.6900 0.5 . 1 . . . . 48 GLN CG . 16619 1 533 . 1 1 48 48 GLN N N 15 118.0871 0.1 . 1 . . . . 48 GLN N . 16619 1 534 . 1 1 48 48 GLN NE2 N 15 111.3160 0.1 . 1 . . . . 48 GLN NE2 . 16619 1 535 . 1 1 49 49 ILE H H 1 7.7896 0.006 . 1 . . . . 49 ILE HN . 16619 1 536 . 1 1 49 49 ILE HA H 1 4.0610 0.05 . 1 . . . . 49 ILE HA . 16619 1 537 . 1 1 49 49 ILE HB H 1 2.0390 0.05 . 1 . . . . 49 ILE HB . 16619 1 538 . 1 1 49 49 ILE HD11 H 1 0.9100 0.05 . 1 . . . . 49 ILE HD1# . 16619 1 539 . 1 1 49 49 ILE HD12 H 1 0.9100 0.05 . 1 . . . . 49 ILE HD1# . 16619 1 540 . 1 1 49 49 ILE HD13 H 1 0.9100 0.05 . 1 . . . . 49 ILE HD1# . 16619 1 541 . 1 1 49 49 ILE HG12 H 1 1.7080 0.05 . 2 . . . . 49 ILE HG11|HG12 . 16619 1 542 . 1 1 49 49 ILE HG13 H 1 1.6180 0.05 . 2 . . . . 49 ILE HG12|HG11 . 16619 1 543 . 1 1 49 49 ILE HG21 H 1 1.1270 0.05 . 1 . . . . 49 ILE HG2# . 16619 1 544 . 1 1 49 49 ILE HG22 H 1 1.1270 0.05 . 1 . . . . 49 ILE HG2# . 16619 1 545 . 1 1 49 49 ILE HG23 H 1 1.1270 0.05 . 1 . . . . 49 ILE HG2# . 16619 1 546 . 1 1 49 49 ILE C C 13 178.7250 0.04 . 1 . . . . 49 ILE C . 16619 1 547 . 1 1 49 49 ILE CA C 13 64.3100 0.5 . 1 . . . . 49 ILE CA . 16619 1 548 . 1 1 49 49 ILE CB C 13 37.6390 0.5 . 1 . . . . 49 ILE CB . 16619 1 549 . 1 1 49 49 ILE CD1 C 13 13.2100 0.5 . 1 . . . . 49 ILE CD1 . 16619 1 550 . 1 1 49 49 ILE CG1 C 13 28.6530 0.5 . 1 . . . . 49 ILE CG1 . 16619 1 551 . 1 1 49 49 ILE CG2 C 13 19.3320 0.5 . 1 . . . . 49 ILE CG2 . 16619 1 552 . 1 1 49 49 ILE N N 15 119.5536 0.1 . 1 . . . . 49 ILE N . 16619 1 553 . 1 1 50 50 GLN H H 1 8.6348 0.006 . 1 . . . . 50 GLN HN . 16619 1 554 . 1 1 50 50 GLN HA H 1 3.9680 0.05 . 1 . . . . 50 GLN HA . 16619 1 555 . 1 1 50 50 GLN HB2 H 1 2.4290 0.05 . 2 . . . . 50 GLN HB1|HB2 . 16619 1 556 . 1 1 50 50 GLN HB3 H 1 2.1010 0.05 . 2 . . . . 50 GLN HB2|HB1 . 16619 1 557 . 1 1 50 50 GLN HG2 H 1 2.6180 0.05 . 2 . . . . 50 GLN HG1|HG2 . 16619 1 558 . 1 1 50 50 GLN HG3 H 1 2.0760 0.05 . 2 . . . . 50 GLN HG2|HG1 . 16619 1 559 . 1 1 50 50 GLN C C 13 177.9170 0.04 . 1 . . . . 50 GLN C . 16619 1 560 . 1 1 50 50 GLN CA C 13 59.5870 0.5 . 1 . . . . 50 GLN CA . 16619 1 561 . 1 1 50 50 GLN CB C 13 27.7320 0.5 . 1 . . . . 50 GLN CB . 16619 1 562 . 1 1 50 50 GLN CG C 13 34.5210 0.5 . 1 . . . . 50 GLN CG . 16619 1 563 . 1 1 50 50 GLN N N 15 119.5549 0.1 . 1 . . . . 50 GLN N . 16619 1 564 . 1 1 51 51 GLN H H 1 7.6837 0.006 . 1 . . . . 51 GLN HN . 16619 1 565 . 1 1 51 51 GLN HA H 1 4.1760 0.05 . 1 . . . . 51 GLN HA . 16619 1 566 . 1 1 51 51 GLN HB2 H 1 2.3030 0.05 . 2 . . . . 51 GLN HB1|HB2 . 16619 1 567 . 1 1 51 51 GLN HB3 H 1 2.2420 0.05 . 2 . . . . 51 GLN HB2|HB1 . 16619 1 568 . 1 1 51 51 GLN HG2 H 1 2.4830 0.05 . 2 . . . . 51 GLN HG1|HG2 . 16619 1 569 . 1 1 51 51 GLN HG3 H 1 2.5780 0.05 . 2 . . . . 51 GLN HG2|HG1 . 16619 1 570 . 1 1 51 51 GLN C C 13 177.6330 0.04 . 1 . . . . 51 GLN C . 16619 1 571 . 1 1 51 51 GLN CA C 13 58.6590 0.5 . 1 . . . . 51 GLN CA . 16619 1 572 . 1 1 51 51 GLN CB C 13 28.6430 0.5 . 1 . . . . 51 GLN CB . 16619 1 573 . 1 1 51 51 GLN CG C 13 34.3160 0.5 . 1 . . . . 51 GLN CG . 16619 1 574 . 1 1 51 51 GLN N N 15 116.2990 0.1 . 1 . . . . 51 GLN N . 16619 1 575 . 1 1 52 52 GLU H H 1 7.9514 0.006 . 1 . . . . 52 GLU HN . 16619 1 576 . 1 1 52 52 GLU HA H 1 4.1270 0.05 . 1 . . . . 52 GLU HA . 16619 1 577 . 1 1 52 52 GLU HB2 H 1 1.9990 0.05 . 2 . . . . 52 GLU HB1|HB2 . 16619 1 578 . 1 1 52 52 GLU HB3 H 1 1.8050 0.05 . 2 . . . . 52 GLU HB2|HB1 . 16619 1 579 . 1 1 52 52 GLU HG2 H 1 2.3980 0.05 . 2 . . . . 52 GLU HG# . 16619 1 580 . 1 1 52 52 GLU HG3 H 1 2.3980 0.05 . 2 . . . . 52 GLU HG# . 16619 1 581 . 1 1 52 52 GLU C C 13 177.4880 0.04 . 1 . . . . 52 GLU C . 16619 1 582 . 1 1 52 52 GLU CA C 13 58.2900 0.5 . 1 . . . . 52 GLU CA . 16619 1 583 . 1 1 52 52 GLU CB C 13 30.4840 0.5 . 1 . . . . 52 GLU CB . 16619 1 584 . 1 1 52 52 GLU CG C 13 36.2390 0.5 . 1 . . . . 52 GLU CG . 16619 1 585 . 1 1 52 52 GLU N N 15 117.7718 0.1 . 1 . . . . 52 GLU N . 16619 1 586 . 1 1 53 53 HIS H H 1 7.8779 0.006 . 1 . . . . 53 HIS HN . 16619 1 587 . 1 1 53 53 HIS HA H 1 5.0580 0.05 . 1 . . . . 53 HIS HA . 16619 1 588 . 1 1 53 53 HIS HB2 H 1 2.4450 0.05 . 2 . . . . 53 HIS HB1|HB2 . 16619 1 589 . 1 1 53 53 HIS HB3 H 1 2.9920 0.05 . 2 . . . . 53 HIS HB2|HB1 . 16619 1 590 . 1 1 53 53 HIS HD2 H 1 7.4180 0.05 . 1 . . . . 53 HIS HD2 . 16619 1 591 . 1 1 53 53 HIS C C 13 174.6450 0.04 . 1 . . . . 53 HIS C . 16619 1 592 . 1 1 53 53 HIS CA C 13 54.7880 0.5 . 1 . . . . 53 HIS CA . 16619 1 593 . 1 1 53 53 HIS CB C 13 28.0750 0.5 . 1 . . . . 53 HIS CB . 16619 1 594 . 1 1 53 53 HIS CD2 C 13 120.5280 0.5 . 1 . . . . 53 HIS CD2 . 16619 1 595 . 1 1 53 53 HIS N N 15 115.3895 0.1 . 1 . . . . 53 HIS N . 16619 1 596 . 1 1 54 54 GLN H H 1 7.5190 0.006 . 1 . . . . 54 GLN HN . 16619 1 597 . 1 1 54 54 GLN HA H 1 4.1770 0.05 . 1 . . . . 54 GLN HA . 16619 1 598 . 1 1 54 54 GLN HB2 H 1 2.4120 0.05 . 2 . . . . 54 GLN HB1|HB2 . 16619 1 599 . 1 1 54 54 GLN HB3 H 1 2.2070 0.05 . 2 . . . . 54 GLN HB2|HB1 . 16619 1 600 . 1 1 54 54 GLN HG2 H 1 2.5080 0.05 . 2 . . . . 54 GLN HG# . 16619 1 601 . 1 1 54 54 GLN HG3 H 1 2.5080 0.05 . 2 . . . . 54 GLN HG# . 16619 1 602 . 1 1 54 54 GLN C C 13 178.2260 0.04 . 1 . . . . 54 GLN C . 16619 1 603 . 1 1 54 54 GLN CA C 13 60.2240 0.5 . 1 . . . . 54 GLN CA . 16619 1 604 . 1 1 54 54 GLN CB C 13 28.9100 0.5 . 1 . . . . 54 GLN CB . 16619 1 605 . 1 1 54 54 GLN CG C 13 33.8260 0.5 . 1 . . . . 54 GLN CG . 16619 1 606 . 1 1 54 54 GLN N N 15 121.0125 0.1 . 1 . . . . 54 GLN N . 16619 1 607 . 1 1 55 55 GLU H H 1 9.0745 0.006 . 1 . . . . 55 GLU HN . 16619 1 608 . 1 1 55 55 GLU HA H 1 4.2040 0.05 . 1 . . . . 55 GLU HA . 16619 1 609 . 1 1 55 55 GLU HB2 H 1 2.1300 0.05 . 2 . . . . 55 GLU HB# . 16619 1 610 . 1 1 55 55 GLU HB3 H 1 2.1300 0.05 . 2 . . . . 55 GLU HB# . 16619 1 611 . 1 1 55 55 GLU HG2 H 1 2.4450 0.05 . 2 . . . . 55 GLU HG1|HG2 . 16619 1 612 . 1 1 55 55 GLU HG3 H 1 2.3580 0.05 . 2 . . . . 55 GLU HG2|HG1 . 16619 1 613 . 1 1 55 55 GLU C C 13 178.7620 0.04 . 1 . . . . 55 GLU C . 16619 1 614 . 1 1 55 55 GLU CA C 13 59.9940 0.5 . 1 . . . . 55 GLU CA . 16619 1 615 . 1 1 55 55 GLU CB C 13 28.5690 0.5 . 1 . . . . 55 GLU CB . 16619 1 616 . 1 1 55 55 GLU CG C 13 36.5680 0.5 . 1 . . . . 55 GLU CG . 16619 1 617 . 1 1 55 55 GLU N N 15 119.9066 0.1 . 1 . . . . 55 GLU N . 16619 1 618 . 1 1 56 56 PHE H H 1 8.0690 0.006 . 1 . . . . 56 PHE HN . 16619 1 619 . 1 1 56 56 PHE HA H 1 4.6130 0.05 . 1 . . . . 56 PHE HA . 16619 1 620 . 1 1 56 56 PHE HB2 H 1 3.4620 0.05 . 2 . . . . 56 PHE HB1|HB2 . 16619 1 621 . 1 1 56 56 PHE HB3 H 1 2.9920 0.05 . 2 . . . . 56 PHE HB2|HB1 . 16619 1 622 . 1 1 56 56 PHE HD1 H 1 7.1100 0.05 . 3 . . . . 56 PHE HD1 . 16619 1 623 . 1 1 56 56 PHE HD2 H 1 7.1100 0.05 . 3 . . . . 56 PHE HD2 . 16619 1 624 . 1 1 56 56 PHE HE1 H 1 7.2476 0.05 . 3 . . . . 56 PHE HE1 . 16619 1 625 . 1 1 56 56 PHE HE2 H 1 7.2476 0.05 . 3 . . . . 56 PHE HE2 . 16619 1 626 . 1 1 56 56 PHE HZ H 1 7.0200 0.05 . 1 . . . . 56 PHE HZ . 16619 1 627 . 1 1 56 56 PHE C C 13 177.7670 0.04 . 1 . . . . 56 PHE C . 16619 1 628 . 1 1 56 56 PHE CA C 13 60.0280 0.5 . 1 . . . . 56 PHE CA . 16619 1 629 . 1 1 56 56 PHE CB C 13 39.3850 0.5 . 1 . . . . 56 PHE CB . 16619 1 630 . 1 1 56 56 PHE CD1 C 13 131.9450 0.5 . 3 . . . . 56 PHE CD1 . 16619 1 631 . 1 1 56 56 PHE CD2 C 13 131.9450 0.5 . 3 . . . . 56 PHE CD2 . 16619 1 632 . 1 1 56 56 PHE CE1 C 13 131.1960 0.5 . 3 . . . . 56 PHE CE1 . 16619 1 633 . 1 1 56 56 PHE CE2 C 13 131.1960 0.5 . 3 . . . . 56 PHE CE2 . 16619 1 634 . 1 1 56 56 PHE CZ C 13 129.5170 0.5 . 1 . . . . 56 PHE CZ . 16619 1 635 . 1 1 56 56 PHE N N 15 121.6975 0.1 . 1 . . . . 56 PHE N . 16619 1 636 . 1 1 57 57 PHE H H 1 8.3783 0.006 . 1 . . . . 57 PHE HN . 16619 1 637 . 1 1 57 57 PHE HA H 1 4.3910 0.05 . 1 . . . . 57 PHE HA . 16619 1 638 . 1 1 57 57 PHE HB2 H 1 3.4810 0.05 . 2 . . . . 57 PHE HB1|HB2 . 16619 1 639 . 1 1 57 57 PHE HB3 H 1 3.4430 0.05 . 2 . . . . 57 PHE HB2|HB1 . 16619 1 640 . 1 1 57 57 PHE HD1 H 1 7.4200 0.05 . 3 . . . . 57 PHE HD1 . 16619 1 641 . 1 1 57 57 PHE HD2 H 1 7.4200 0.05 . 3 . . . . 57 PHE HD2 . 16619 1 642 . 1 1 57 57 PHE HE1 H 1 7.2846 0.05 . 3 . . . . 57 PHE HE1 . 16619 1 643 . 1 1 57 57 PHE HE2 H 1 7.2846 0.05 . 3 . . . . 57 PHE HE2 . 16619 1 644 . 1 1 57 57 PHE HZ H 1 7.4100 0.05 . 1 . . . . 57 PHE HZ . 16619 1 645 . 1 1 57 57 PHE C C 13 178.1420 0.04 . 1 . . . . 57 PHE C . 16619 1 646 . 1 1 57 57 PHE CA C 13 59.0590 0.5 . 1 . . . . 57 PHE CA . 16619 1 647 . 1 1 57 57 PHE CB C 13 37.6400 0.5 . 1 . . . . 57 PHE CB . 16619 1 648 . 1 1 57 57 PHE CD1 C 13 131.8500 0.5 . 3 . . . . 57 PHE CD1 . 16619 1 649 . 1 1 57 57 PHE CD2 C 13 131.8500 0.5 . 3 . . . . 57 PHE CD2 . 16619 1 650 . 1 1 57 57 PHE CE1 C 13 131.1260 0.5 . 3 . . . . 57 PHE CE1 . 16619 1 651 . 1 1 57 57 PHE CE2 C 13 131.1260 0.5 . 3 . . . . 57 PHE CE2 . 16619 1 652 . 1 1 57 57 PHE CZ C 13 129.9370 0.5 . 1 . . . . 57 PHE CZ . 16619 1 653 . 1 1 57 57 PHE N N 15 116.8810 0.1 . 1 . . . . 57 PHE N . 16619 1 654 . 1 1 58 58 SER H H 1 8.6123 0.006 . 1 . . . . 58 SER HN . 16619 1 655 . 1 1 58 58 SER HA H 1 4.3800 0.05 . 1 . . . . 58 SER HA . 16619 1 656 . 1 1 58 58 SER HB2 H 1 4.0560 0.05 . 2 . . . . 58 SER HB# . 16619 1 657 . 1 1 58 58 SER HB3 H 1 4.0560 0.05 . 2 . . . . 58 SER HB# . 16619 1 658 . 1 1 58 58 SER C C 13 176.9410 0.04 . 1 . . . . 58 SER C . 16619 1 659 . 1 1 58 58 SER CA C 13 61.8460 0.5 . 1 . . . . 58 SER CA . 16619 1 660 . 1 1 58 58 SER CB C 13 63.3260 0.5 . 1 . . . . 58 SER CB . 16619 1 661 . 1 1 58 58 SER N N 15 114.5908 0.1 . 1 . . . . 58 SER N . 16619 1 662 . 1 1 59 59 SER H H 1 8.0854 0.006 . 1 . . . . 59 SER HN . 16619 1 663 . 1 1 59 59 SER HA H 1 4.3190 0.05 . 1 . . . . 59 SER HA . 16619 1 664 . 1 1 59 59 SER HB2 H 1 3.9400 0.05 . 2 . . . . 59 SER HB# . 16619 1 665 . 1 1 59 59 SER HB3 H 1 3.9400 0.05 . 2 . . . . 59 SER HB# . 16619 1 666 . 1 1 59 59 SER C C 13 176.1610 0.04 . 1 . . . . 59 SER C . 16619 1 667 . 1 1 59 59 SER CA C 13 61.3270 0.5 . 1 . . . . 59 SER CA . 16619 1 668 . 1 1 59 59 SER CB C 13 63.2480 0.5 . 1 . . . . 59 SER CB . 16619 1 669 . 1 1 59 59 SER N N 15 117.1220 0.1 . 1 . . . . 59 SER N . 16619 1 670 . 1 1 60 60 PHE H H 1 7.9091 0.006 . 1 . . . . 60 PHE HN . 16619 1 671 . 1 1 60 60 PHE HA H 1 4.3190 0.05 . 1 . . . . 60 PHE HA . 16619 1 672 . 1 1 60 60 PHE HB2 H 1 3.0590 0.05 . 2 . . . . 60 PHE HB1|HB2 . 16619 1 673 . 1 1 60 60 PHE HB3 H 1 2.8730 0.05 . 2 . . . . 60 PHE HB2|HB1 . 16619 1 674 . 1 1 60 60 PHE HD1 H 1 7.1178 0.05 . 3 . . . . 60 PHE HD1 . 16619 1 675 . 1 1 60 60 PHE HD2 H 1 7.1178 0.05 . 3 . . . . 60 PHE HD2 . 16619 1 676 . 1 1 60 60 PHE HZ H 1 7.0400 0.05 . 1 . . . . 60 PHE HZ . 16619 1 677 . 1 1 60 60 PHE C C 13 176.8080 0.04 . 1 . . . . 60 PHE C . 16619 1 678 . 1 1 60 60 PHE CA C 13 60.1660 0.5 . 1 . . . . 60 PHE CA . 16619 1 679 . 1 1 60 60 PHE CB C 13 39.6960 0.5 . 1 . . . . 60 PHE CB . 16619 1 680 . 1 1 60 60 PHE CD1 C 13 131.9250 0.5 . 3 . . . . 60 PHE CD1 . 16619 1 681 . 1 1 60 60 PHE CD2 C 13 131.9250 0.5 . 3 . . . . 60 PHE CD2 . 16619 1 682 . 1 1 60 60 PHE CZ C 13 129.5600 0.5 . 1 . . . . 60 PHE CZ . 16619 1 683 . 1 1 60 60 PHE N N 15 121.6228 0.1 . 1 . . . . 60 PHE N . 16619 1 684 . 1 1 61 61 CYS H H 1 7.7170 0.006 . 1 . . . . 61 CYS HN . 16619 1 685 . 1 1 61 61 CYS HA H 1 4.3600 0.05 . 1 . . . . 61 CYS HA . 16619 1 686 . 1 1 61 61 CYS HB2 H 1 3.0800 0.05 . 2 . . . . 61 CYS HB1 . 16619 1 687 . 1 1 61 61 CYS HB3 H 1 3.0020 0.05 . 2 . . . . 61 CYS HB2 . 16619 1 688 . 1 1 61 61 CYS C C 13 174.8320 0.04 . 1 . . . . 61 CYS C . 16619 1 689 . 1 1 61 61 CYS CA C 13 60.6010 0.5 . 1 . . . . 61 CYS CA . 16619 1 690 . 1 1 61 61 CYS CB C 13 27.5810 0.5 . 1 . . . . 61 CYS CB . 16619 1 691 . 1 1 61 61 CYS N N 15 115.4153 0.1 . 1 . . . . 61 CYS N . 16619 1 692 . 1 1 62 62 GLU H H 1 7.7868 0.006 . 1 . . . . 62 GLU HN . 16619 1 693 . 1 1 62 62 GLU HA H 1 4.2410 0.05 . 1 . . . . 62 GLU HA . 16619 1 694 . 1 1 62 62 GLU HB2 H 1 2.1500 0.05 . 2 . . . . 62 GLU HB1|HB2 . 16619 1 695 . 1 1 62 62 GLU HB3 H 1 2.0330 0.05 . 2 . . . . 62 GLU HB2|HB1 . 16619 1 696 . 1 1 62 62 GLU HG2 H 1 2.4300 0.05 . 2 . . . . 62 GLU HG1|HG2 . 16619 1 697 . 1 1 62 62 GLU HG3 H 1 2.3390 0.05 . 2 . . . . 62 GLU HG2|HG1 . 16619 1 698 . 1 1 62 62 GLU C C 13 176.6450 0.04 . 1 . . . . 62 GLU C . 16619 1 699 . 1 1 62 62 GLU CA C 13 57.4530 0.5 . 1 . . . . 62 GLU CA . 16619 1 700 . 1 1 62 62 GLU CB C 13 29.4090 0.5 . 1 . . . . 62 GLU CB . 16619 1 701 . 1 1 62 62 GLU CG C 13 36.1650 0.5 . 1 . . . . 62 GLU CG . 16619 1 702 . 1 1 62 62 GLU N N 15 119.8671 0.1 . 1 . . . . 62 GLU N . 16619 1 703 . 1 1 63 63 SER H H 1 7.9125 0.006 . 1 . . . . 63 SER HN . 16619 1 704 . 1 1 63 63 SER HA H 1 4.3240 0.05 . 1 . . . . 63 SER HA . 16619 1 705 . 1 1 63 63 SER HB2 H 1 3.9030 0.05 . 2 . . . . 63 SER HB# . 16619 1 706 . 1 1 63 63 SER HB3 H 1 3.9030 0.05 . 2 . . . . 63 SER HB# . 16619 1 707 . 1 1 63 63 SER C C 13 174.4200 0.04 . 1 . . . . 63 SER C . 16619 1 708 . 1 1 63 63 SER CA C 13 59.1280 0.5 . 1 . . . . 63 SER CA . 16619 1 709 . 1 1 63 63 SER CB C 13 63.8590 0.5 . 1 . . . . 63 SER CB . 16619 1 710 . 1 1 63 63 SER N N 15 114.9118 0.1 . 1 . . . . 63 SER N . 16619 1 711 . 1 1 64 64 ARG H H 1 8.1739 0.006 . 1 . . . . 64 ARG HN . 16619 1 712 . 1 1 64 64 ARG HA H 1 4.3230 0.05 . 1 . . . . 64 ARG HA . 16619 1 713 . 1 1 64 64 ARG HB2 H 1 1.9190 0.05 . 2 . . . . 64 ARG HB1|HB2 . 16619 1 714 . 1 1 64 64 ARG HB3 H 1 1.8030 0.05 . 2 . . . . 64 ARG HB2|HB1 . 16619 1 715 . 1 1 64 64 ARG HD2 H 1 3.1860 0.05 . 2 . . . . 64 ARG HD# . 16619 1 716 . 1 1 64 64 ARG HD3 H 1 3.1860 0.05 . 2 . . . . 64 ARG HD# . 16619 1 717 . 1 1 64 64 ARG HG2 H 1 1.6760 0.05 . 2 . . . . 64 ARG HG1|HG2 . 16619 1 718 . 1 1 64 64 ARG HG3 H 1 1.3950 0.05 . 2 . . . . 64 ARG HG2|HG1 . 16619 1 719 . 1 1 64 64 ARG C C 13 176.2740 0.04 . 1 . . . . 64 ARG C . 16619 1 720 . 1 1 64 64 ARG CA C 13 56.4530 0.5 . 1 . . . . 64 ARG CA . 16619 1 721 . 1 1 64 64 ARG CB C 13 30.2780 0.5 . 1 . . . . 64 ARG CB . 16619 1 722 . 1 1 64 64 ARG CD C 13 43.5370 0.5 . 1 . . . . 64 ARG CD . 16619 1 723 . 1 1 64 64 ARG CG C 13 27.5900 0.5 . 1 . . . . 64 ARG CG . 16619 1 724 . 1 1 64 64 ARG N N 15 120.6933 0.1 . 1 . . . . 64 ARG N . 16619 1 725 . 1 1 65 65 GLY H H 1 8.0788 0.006 . 1 . . . . 65 GLY HN . 16619 1 726 . 1 1 65 65 GLY HA2 H 1 3.8710 0.05 . 2 . . . . 65 GLY HA# . 16619 1 727 . 1 1 65 65 GLY HA3 H 1 3.8710 0.05 . 2 . . . . 65 GLY HA# . 16619 1 728 . 1 1 65 65 GLY C C 13 173.2000 0.04 . 1 . . . . 65 GLY C . 16619 1 729 . 1 1 65 65 GLY CA C 13 45.2000 0.5 . 1 . . . . 65 GLY CA . 16619 1 730 . 1 1 65 65 GLY N N 15 107.7533 0.1 . 1 . . . . 65 GLY N . 16619 1 731 . 1 1 66 66 ASN H H 1 8.2514 0.006 . 1 . . . . 66 ASN HN . 16619 1 732 . 1 1 66 66 ASN HA H 1 4.6950 0.05 . 1 . . . . 66 ASN HA . 16619 1 733 . 1 1 66 66 ASN HB2 H 1 2.9250 0.05 . 2 . . . . 66 ASN HB# . 16619 1 734 . 1 1 66 66 ASN HB3 H 1 2.9250 0.05 . 2 . . . . 66 ASN HB# . 16619 1 735 . 1 1 66 66 ASN HD21 H 1 7.6060 0.05 . 2 . . . . 66 ASN HD21 . 16619 1 736 . 1 1 66 66 ASN HD22 H 1 6.9063 0.05 . 2 . . . . 66 ASN HD22 . 16619 1 737 . 1 1 66 66 ASN C C 13 175.461 0.04 . 1 . . . . 66 ASN C . 16619 1 738 . 1 1 66 66 ASN CA C 13 52.8930 0.5 . 1 . . . . 66 ASN CA . 16619 1 739 . 1 1 66 66 ASN CB C 13 38.6930 0.5 . 1 . . . . 66 ASN CB . 16619 1 740 . 1 1 66 66 ASN N N 15 118.7899 0.1 . 1 . . . . 66 ASN N . 16619 1 741 . 1 1 66 66 ASN ND2 N 15 112.7890 0.1 . 1 . . . . 66 ASN ND2 . 16619 1 742 . 1 1 67 67 ARG H H 1 8.6883 0.006 . 1 . . . . 67 ARG HN . 16619 1 743 . 1 1 67 67 ARG HA H 1 3.8676 0.05 . 1 . . . . 67 ARG HA . 16619 1 744 . 1 1 67 67 ARG HB2 H 1 1.4740 0.05 . 2 . . . . 67 ARG HB# . 16619 1 745 . 1 1 67 67 ARG HB3 H 1 1.4740 0.05 . 2 . . . . 67 ARG HB# . 16619 1 746 . 1 1 67 67 ARG C C 13 177.5090 0.04 . 1 . . . . 67 ARG C . 16619 1 747 . 1 1 67 67 ARG CA C 13 61.2470 0.5 . 1 . . . . 67 ARG CA . 16619 1 748 . 1 1 67 67 ARG CB C 13 30.7280 0.5 . 1 . . . . 67 ARG CB . 16619 1 749 . 1 1 67 67 ARG CD C 13 43.3600 0.5 . 1 . . . . 67 ARG CD . 16619 1 750 . 1 1 67 67 ARG CG C 13 26.5900 0.5 . 1 . . . . 67 ARG CG . 16619 1 751 . 1 1 67 67 ARG N N 15 121.0786 0.1 . 1 . . . . 67 ARG N . 16619 1 752 . 1 1 68 68 LEU H H 1 8.2829 0.006 . 1 . . . . 68 LEU NH . 16619 1 753 . 1 1 68 68 LEU HA H 1 3.8020 0.05 . 1 . . . . 68 LEU HA . 16619 1 754 . 1 1 68 68 LEU HB2 H 1 1.8400 0.05 . 2 . . . . 68 LEU HB# . 16619 1 755 . 1 1 68 68 LEU HB3 H 1 1.8400 0.05 . 2 . . . . 68 LEU HB# . 16619 1 756 . 1 1 68 68 LEU HD11 H 1 0.9340 0.05 . 2 . . . . 68 LEU HD1#|HD2# . 16619 1 757 . 1 1 68 68 LEU HD12 H 1 0.9340 0.05 . 2 . . . . 68 LEU HD1#|HD2# . 16619 1 758 . 1 1 68 68 LEU HD13 H 1 0.9340 0.05 . 2 . . . . 68 LEU HD1#|HD2# . 16619 1 759 . 1 1 68 68 LEU HD21 H 1 0.6890 0.05 . 2 . . . . 68 LEU HD2#|HD1# . 16619 1 760 . 1 1 68 68 LEU HD22 H 1 0.6890 0.05 . 2 . . . . 68 LEU HD2#|HD1# . 16619 1 761 . 1 1 68 68 LEU HD23 H 1 0.6890 0.05 . 2 . . . . 68 LEU HD2#|HD1# . 16619 1 762 . 1 1 68 68 LEU HG H 1 1.3450 0.05 . 1 . . . . 68 LEU HG . 16619 1 763 . 1 1 68 68 LEU C C 13 178.1840 0.04 . 1 . . . . 68 LEU C . 16619 1 764 . 1 1 68 68 LEU CA C 13 58.1410 0.5 . 1 . . . . 68 LEU CA . 16619 1 765 . 1 1 68 68 LEU CB C 13 40.9440 0.5 . 1 . . . . 68 LEU CB . 16619 1 766 . 1 1 68 68 LEU CD1 C 13 25.8850 0.5 . 2 . . . . 68 LEU CD1 . 16619 1 767 . 1 1 68 68 LEU CD2 C 13 23.2230 0.5 . 2 . . . . 68 LEU CD2 . 16619 1 768 . 1 1 68 68 LEU CG C 13 27.3930 0.5 . 1 . . . . 68 LEU CG . 16619 1 769 . 1 1 68 68 LEU N N 15 118.2144 0.1 . 1 . . . . 68 LEU N . 16619 1 770 . 1 1 69 69 GLU H H 1 7.8159 0.006 . 1 . . . . 69 GLU HN . 16619 1 771 . 1 1 69 69 GLU HA H 1 3.7930 0.05 . 1 . . . . 69 GLU HA . 16619 1 772 . 1 1 69 69 GLU HB2 H 1 2.0240 0.05 . 2 . . . . 69 GLU HB# . 16619 1 773 . 1 1 69 69 GLU HB3 H 1 2.0240 0.05 . 2 . . . . 69 GLU HB# . 16619 1 774 . 1 1 69 69 GLU HG2 H 1 2.2930 0.05 . 2 . . . . 69 GLU HG# . 16619 1 775 . 1 1 69 69 GLU HG3 H 1 2.2930 0.05 . 2 . . . . 69 GLU HG# . 16619 1 776 . 1 1 69 69 GLU C C 13 179.3260 0.04 . 1 . . . . 69 GLU C . 16619 1 777 . 1 1 69 69 GLU CA C 13 59.1960 0.5 . 1 . . . . 69 GLU CA . 16619 1 778 . 1 1 69 69 GLU CB C 13 29.0260 0.5 . 1 . . . . 69 GLU CB . 16619 1 779 . 1 1 69 69 GLU CG C 13 36.4120 0.5 . 1 . . . . 69 GLU CG . 16619 1 780 . 1 1 69 69 GLU N N 15 117.7672 0.1 . 1 . . . . 69 GLU N . 16619 1 781 . 1 1 70 70 LEU H H 1 7.9419 0.006 . 1 . . . . 70 LEU NH . 16619 1 782 . 1 1 70 70 LEU HA H 1 4.1873 0.05 . 1 . . . . 70 LEU HA . 16619 1 783 . 1 1 70 70 LEU HB2 H 1 1.5015 0.05 . 2 . . . . 70 LEU HB1|HB2 . 16619 1 784 . 1 1 70 70 LEU HB3 H 1 2.1088 0.05 . 2 . . . . 70 LEU HB2|HB1 . 16619 1 785 . 1 1 70 70 LEU HD11 H 1 0.9740 0.05 . 2 . . . . 70 LEU HD1#|HD2# . 16619 1 786 . 1 1 70 70 LEU HD12 H 1 0.9740 0.05 . 2 . . . . 70 LEU HD1#|HD2# . 16619 1 787 . 1 1 70 70 LEU HD13 H 1 0.9740 0.05 . 2 . . . . 70 LEU HD1#|HD2# . 16619 1 788 . 1 1 70 70 LEU HD21 H 1 0.9740 0.05 . 2 . . . . 70 LEU HD2#|HD1# . 16619 1 789 . 1 1 70 70 LEU HD22 H 1 0.9740 0.05 . 2 . . . . 70 LEU HD2#|HD1# . 16619 1 790 . 1 1 70 70 LEU HD23 H 1 0.9740 0.05 . 2 . . . . 70 LEU HD2#|HD1# . 16619 1 791 . 1 1 70 70 LEU HG H 1 1.8559 0.05 . 1 . . . . 70 LEU HG . 16619 1 792 . 1 1 70 70 LEU C C 13 179.8010 0.04 . 1 . . . . 70 LEU C . 16619 1 793 . 1 1 70 70 LEU CA C 13 58.3100 0.5 . 1 . . . . 70 LEU CA . 16619 1 794 . 1 1 70 70 LEU CB C 13 42.5260 0.5 . 1 . . . . 70 LEU CB . 16619 1 795 . 1 1 70 70 LEU CD1 C 13 23.1040 0.5 . 2 . . . . 70 LEU CD1 . 16619 1 796 . 1 1 70 70 LEU CD2 C 13 23.1040 0.5 . 2 . . . . 70 LEU CD2 . 16619 1 797 . 1 1 70 70 LEU CG C 13 26.7510 0.5 . 1 . . . . 70 LEU CG . 16619 1 798 . 1 1 70 70 LEU N N 15 118.6857 0.1 . 1 . . . . 70 LEU N . 16619 1 799 . 1 1 71 71 VAL H H 1 7.9811 0.006 . 1 . . . . 71 VAL HN . 16619 1 800 . 1 1 71 71 VAL HA H 1 3.6170 0.05 . 1 . . . . 71 VAL HA . 16619 1 801 . 1 1 71 71 VAL HB H 1 2.1550 0.05 . 1 . . . . 71 VAL HB . 16619 1 802 . 1 1 71 71 VAL HG11 H 1 1.0580 0.05 . 2 . . . . 71 VAL HG1#|HG2# . 16619 1 803 . 1 1 71 71 VAL HG12 H 1 1.0580 0.05 . 2 . . . . 71 VAL HG1#|HG2# . 16619 1 804 . 1 1 71 71 VAL HG13 H 1 1.0580 0.05 . 2 . . . . 71 VAL HG1#|HG2# . 16619 1 805 . 1 1 71 71 VAL HG21 H 1 1.0580 0.05 . 2 . . . . 71 VAL HG2#|HG1# . 16619 1 806 . 1 1 71 71 VAL HG22 H 1 1.0580 0.05 . 2 . . . . 71 VAL HG2#|HG1# . 16619 1 807 . 1 1 71 71 VAL HG23 H 1 1.0580 0.05 . 2 . . . . 71 VAL HG2#|HG1# . 16619 1 808 . 1 1 71 71 VAL C C 13 177.1810 0.04 . 1 . . . . 71 VAL C . 16619 1 809 . 1 1 71 71 VAL CA C 13 68.0670 0.5 . 1 . . . . 71 VAL CA . 16619 1 810 . 1 1 71 71 VAL CB C 13 31.5220 0.5 . 1 . . . . 71 VAL CB . 16619 1 811 . 1 1 71 71 VAL CG1 C 13 22.2100 0.5 . 2 . . . . 71 VAL CG1|CG2 . 16619 1 812 . 1 1 71 71 VAL CG2 C 13 22.2100 0.5 . 2 . . . . 71 VAL CG2|CG1 . 16619 1 813 . 1 1 71 71 VAL N N 15 120.0750 0.1 . 1 . . . . 71 VAL N . 16619 1 814 . 1 1 72 72 LYS H H 1 8.2650 0.006 . 1 . . . . 72 LYS HN . 16619 1 815 . 1 1 72 72 LYS HA H 1 3.7200 0.05 . 1 . . . . 72 LYS HA . 16619 1 816 . 1 1 72 72 LYS HB2 H 1 1.7080 0.05 . 2 . . . . 72 LYS HB1|HB2 . 16619 1 817 . 1 1 72 72 LYS HB3 H 1 1.5610 0.05 . 2 . . . . 72 LYS HB2|HB1 . 16619 1 818 . 1 1 72 72 LYS HD2 H 1 1.4590 0.05 . 2 . . . . 72 LYS HD# . 16619 1 819 . 1 1 72 72 LYS HD3 H 1 1.4590 0.05 . 2 . . . . 72 LYS HD# . 16619 1 820 . 1 1 72 72 LYS HE2 H 1 2.8290 0.05 . 2 . . . . 72 LYS HE1|HE2 . 16619 1 821 . 1 1 72 72 LYS HE3 H 1 2.6780 0.05 . 2 . . . . 72 LYS HE2|HE1 . 16619 1 822 . 1 1 72 72 LYS HG2 H 1 1.0990 0.05 . 2 . . . . 72 LYS HG1|HG2 . 16619 1 823 . 1 1 72 72 LYS HG3 H 1 0.5210 0.05 . 2 . . . . 72 LYS HG2|HG1 . 16619 1 824 . 1 1 72 72 LYS C C 13 179.2480 0.04 . 1 . . . . 72 LYS C . 16619 1 825 . 1 1 72 72 LYS CA C 13 60.3350 0.5 . 1 . . . . 72 LYS CA . 16619 1 826 . 1 1 72 72 LYS CB C 13 31.9870 0.5 . 1 . . . . 72 LYS CB . 16619 1 827 . 1 1 72 72 LYS CD C 13 29.6870 0.5 . 1 . . . . 72 LYS CD . 16619 1 828 . 1 1 72 72 LYS CE C 13 41.8000 0.5 . 1 . . . . 72 LYS CE . 16619 1 829 . 1 1 72 72 LYS CG C 13 24.6200 0.5 . 1 . . . . 72 LYS CG . 16619 1 830 . 1 1 72 72 LYS N N 15 120.8146 0.1 . 1 . . . . 72 LYS N . 16619 1 831 . 1 1 73 73 GLN H H 1 8.2155 0.006 . 1 . . . . 73 GLN HN . 16619 1 832 . 1 1 73 73 GLN HA H 1 4.1690 0.05 . 1 . . . . 73 GLN HA . 16619 1 833 . 1 1 73 73 GLN HB2 H 1 2.2500 0.05 . 2 . . . . 73 GLN HB# . 16619 1 834 . 1 1 73 73 GLN HB3 H 1 2.2500 0.05 . 2 . . . . 73 GLN HB# . 16619 1 835 . 1 1 73 73 GLN HG2 H 1 2.4290 0.05 . 2 . . . . 73 GLN HG1|HG2 . 16619 1 836 . 1 1 73 73 GLN HG3 H 1 2.6820 0.05 . 2 . . . . 73 GLN HG2|HG1 . 16619 1 837 . 1 1 73 73 GLN C C 13 179.6780 0.04 . 1 . . . . 73 GLN C . 16619 1 838 . 1 1 73 73 GLN CA C 13 58.9820 0.5 . 1 . . . . 73 GLN CA . 16619 1 839 . 1 1 73 73 GLN CB C 13 28.5970 0.5 . 1 . . . . 73 GLN CB . 16619 1 840 . 1 1 73 73 GLN CG C 13 34.4540 0.5 . 1 . . . . 73 GLN CG . 16619 1 841 . 1 1 73 73 GLN N N 15 118.2120 0.1 . 1 . . . . 73 GLN N . 16619 1 842 . 1 1 74 74 MET H H 1 8.2803 0.006 . 1 . . . . 74 MET HN . 16619 1 843 . 1 1 74 74 MET HA H 1 4.2440 0.05 . 1 . . . . 74 MET HA . 16619 1 844 . 1 1 74 74 MET HB2 H 1 1.7960 0.05 . 2 . . . . 74 MET HB# . 16619 1 845 . 1 1 74 74 MET HB3 H 1 1.7960 0.05 . 2 . . . . 74 MET HB# . 16619 1 846 . 1 1 74 74 MET HE1 H 1 1.8400 0.05 . 1 . . . . 74 MET HE# . 16619 1 847 . 1 1 74 74 MET HE2 H 1 1.8400 0.05 . 1 . . . . 74 MET HE# . 16619 1 848 . 1 1 74 74 MET HE3 H 1 1.8400 0.05 . 1 . . . . 74 MET HE# . 16619 1 849 . 1 1 74 74 MET HG2 H 1 2.3271 0.05 . 2 . . . . 74 MET HG# . 16619 1 850 . 1 1 74 74 MET HG3 H 1 2.3271 0.05 . 2 . . . . 74 MET HG# . 16619 1 851 . 1 1 74 74 MET C C 13 178.3020 0.04 . 1 . . . . 74 MET C . 16619 1 852 . 1 1 74 74 MET CA C 13 56.6530 0.5 . 1 . . . . 74 MET CA . 16619 1 853 . 1 1 74 74 MET CB C 13 31.0560 0.5 . 1 . . . . 74 MET CB . 16619 1 854 . 1 1 74 74 MET CE C 13 15.4830 0.5 . 1 . . . . 74 MET CE . 16619 1 855 . 1 1 74 74 MET CG C 13 31.6030 0.5 . 1 . . . . 74 MET CG . 16619 1 856 . 1 1 74 74 MET N N 15 120.2812 0.1 . 1 . . . . 74 MET N . 16619 1 857 . 1 1 75 75 ALA H H 1 8.9202 0.006 . 1 . . . . 75 ALA HN . 16619 1 858 . 1 1 75 75 ALA HA H 1 3.8810 0.05 . 1 . . . . 75 ALA HA . 16619 1 859 . 1 1 75 75 ALA HB1 H 1 1.7020 0.05 . 1 . . . . 75 ALA HB# . 16619 1 860 . 1 1 75 75 ALA HB2 H 1 1.7020 0.05 . 1 . . . . 75 ALA HB# . 16619 1 861 . 1 1 75 75 ALA HB3 H 1 1.7020 0.05 . 1 . . . . 75 ALA HB# . 16619 1 862 . 1 1 75 75 ALA C C 13 179.1850 0.04 . 1 . . . . 75 ALA C . 16619 1 863 . 1 1 75 75 ALA CA C 13 56.0170 0.5 . 1 . . . . 75 ALA CA . 16619 1 864 . 1 1 75 75 ALA CB C 13 18.3470 0.5 . 1 . . . . 75 ALA CB . 16619 1 865 . 1 1 75 75 ALA N N 15 123.5391 0.1 . 1 . . . . 75 ALA N . 16619 1 866 . 1 1 76 76 ASP H H 1 7.8832 0.006 . 1 . . . . 76 ASP HN . 16619 1 867 . 1 1 76 76 ASP HA H 1 4.4700 0.05 . 1 . . . . 76 ASP HA . 16619 1 868 . 1 1 76 76 ASP HB2 H 1 2.8380 0.05 . 2 . . . . 76 ASP HB1|HB2 . 16619 1 869 . 1 1 76 76 ASP HB3 H 1 2.7340 0.05 . 2 . . . . 76 ASP HB2|HB1 . 16619 1 870 . 1 1 76 76 ASP C C 13 177.5820 0.04 . 1 . . . . 76 ASP C . 16619 1 871 . 1 1 76 76 ASP CA C 13 56.8870 0.5 . 1 . . . . 76 ASP CA . 16619 1 872 . 1 1 76 76 ASP CB C 13 40.8110 0.5 . 1 . . . . 76 ASP CB . 16619 1 873 . 1 1 76 76 ASP N N 15 117.2243 0.1 . 1 . . . . 76 ASP N . 16619 1 874 . 1 1 77 77 LYS H H 1 7.4211 0.006 . 1 . . . . 77 LYS HN . 16619 1 875 . 1 1 77 77 LYS HA H 1 4.2070 0.05 . 1 . . . . 77 LYS HA . 16619 1 876 . 1 1 77 77 LYS HB2 H 1 2.0020 0.05 . 2 . . . . 77 LYS HB# . 16619 1 877 . 1 1 77 77 LYS HB3 H 1 2.0020 0.05 . 2 . . . . 77 LYS HB# . 16619 1 878 . 1 1 77 77 LYS HD2 H 1 1.6070 0.05 . 2 . . . . 77 LYS HD# . 16619 1 879 . 1 1 77 77 LYS HD3 H 1 1.6070 0.05 . 2 . . . . 77 LYS HD# . 16619 1 880 . 1 1 77 77 LYS HE2 H 1 2.9849 0.05 . 2 . . . . 77 LYS HE# . 16619 1 881 . 1 1 77 77 LYS HE3 H 1 2.9849 0.05 . 2 . . . . 77 LYS HE# . 16619 1 882 . 1 1 77 77 LYS HG2 H 1 1.4600 0.05 . 2 . . . . 77 LYS HG# . 16619 1 883 . 1 1 77 77 LYS HG3 H 1 1.4600 0.05 . 2 . . . . 77 LYS HG# . 16619 1 884 . 1 1 77 77 LYS C C 13 178.4410 0.04 . 1 . . . . 77 LYS C . 16619 1 885 . 1 1 77 77 LYS CA C 13 58.2110 0.5 . 1 . . . . 77 LYS CA . 16619 1 886 . 1 1 77 77 LYS CB C 13 33.0750 0.5 . 1 . . . . 77 LYS CB . 16619 1 887 . 1 1 77 77 LYS CD C 13 29.0090 0.5 . 1 . . . . 77 LYS CD . 16619 1 888 . 1 1 77 77 LYS CE C 13 42.2410 0.5 . 1 . . . . 77 LYS CE . 16619 1 889 . 1 1 77 77 LYS CG C 13 24.9770 0.5 . 1 . . . . 77 LYS CG . 16619 1 890 . 1 1 77 77 LYS N N 15 117.6593 0.1 . 1 . . . . 77 LYS N . 16619 1 891 . 1 1 78 78 LEU H H 1 8.1852 0.006 . 1 . . . . 78 LEU NH . 16619 1 892 . 1 1 78 78 LEU HA H 1 4.3480 0.05 . 1 . . . . 78 LEU HA . 16619 1 893 . 1 1 78 78 LEU HB2 H 1 1.6050 0.05 . 2 . . . . 78 LEU HB1|HB2 . 16619 1 894 . 1 1 78 78 LEU HB3 H 1 1.3650 0.05 . 2 . . . . 78 LEU HB2|HB1 . 16619 1 895 . 1 1 78 78 LEU HD11 H 1 0.8590 0.05 . 2 . . . . 78 LEU HD1#|HD2# . 16619 1 896 . 1 1 78 78 LEU HD12 H 1 0.8590 0.05 . 2 . . . . 78 LEU HD1#|HD2# . 16619 1 897 . 1 1 78 78 LEU HD13 H 1 0.8590 0.05 . 2 . . . . 78 LEU HD1#|HD2# . 16619 1 898 . 1 1 78 78 LEU HD21 H 1 0.8590 0.05 . 2 . . . . 78 LEU HD2#|HD1# . 16619 1 899 . 1 1 78 78 LEU HD22 H 1 0.8590 0.05 . 2 . . . . 78 LEU HD2#|HD1# . 16619 1 900 . 1 1 78 78 LEU HD23 H 1 0.8590 0.05 . 2 . . . . 78 LEU HD2#|HD1# . 16619 1 901 . 1 1 78 78 LEU HG H 1 1.7700 0.05 . 1 . . . . 78 LEU HG . 16619 1 902 . 1 1 78 78 LEU C C 13 176.5930 0.04 . 1 . . . . 78 LEU C . 16619 1 903 . 1 1 78 78 LEU CA C 13 56.5760 0.5 . 1 . . . . 78 LEU CA . 16619 1 904 . 1 1 78 78 LEU CB C 13 44.1380 0.5 . 1 . . . . 78 LEU CB . 16619 1 905 . 1 1 78 78 LEU CD1 C 13 22.3830 0.5 . 2 . . . . 78 LEU CD1 . 16619 1 906 . 1 1 78 78 LEU CD2 C 13 22.3830 0.5 . 2 . . . . 78 LEU CD2 . 16619 1 907 . 1 1 78 78 LEU CG C 13 26.9630 0.5 . 1 . . . . 78 LEU CG . 16619 1 908 . 1 1 78 78 LEU N N 15 116.1052 0.1 . 1 . . . . 78 LEU N . 16619 1 909 . 1 1 79 79 LEU H H 1 8.2196 0.006 . 1 . . . . 79 LEU NH . 16619 1 910 . 1 1 79 79 LEU HA H 1 4.6130 0.05 . 1 . . . . 79 LEU HA . 16619 1 911 . 1 1 79 79 LEU HB2 H 1 1.7140 0.05 . 2 . . . . 79 LEU HB1|HB2 . 16619 1 912 . 1 1 79 79 LEU HB3 H 1 1.4160 0.05 . 2 . . . . 79 LEU HB2|HB1 . 16619 1 913 . 1 1 79 79 LEU HD11 H 1 0.1360 0.05 . 2 . . . . 79 LEU HD1#|HD2# . 16619 1 914 . 1 1 79 79 LEU HD12 H 1 0.1360 0.05 . 2 . . . . 79 LEU HD1#|HD2# . 16619 1 915 . 1 1 79 79 LEU HD13 H 1 0.1360 0.05 . 2 . . . . 79 LEU HD1#|HD2# . 16619 1 916 . 1 1 79 79 LEU HD21 H 1 0.3710 0.05 . 2 . . . . 79 LEU HD2#|HD1# . 16619 1 917 . 1 1 79 79 LEU HD22 H 1 0.3710 0.05 . 2 . . . . 79 LEU HD2#|HD1# . 16619 1 918 . 1 1 79 79 LEU HD23 H 1 0.3710 0.05 . 2 . . . . 79 LEU HD2#|HD1# . 16619 1 919 . 1 1 79 79 LEU HG H 1 1.2770 0.05 . 1 . . . . 79 LEU HG . 16619 1 920 . 1 1 79 79 LEU C C 13 176.8470 0.04 . 1 . . . . 79 LEU C . 16619 1 921 . 1 1 79 79 LEU CA C 13 54.2820 0.5 . 1 . . . . 79 LEU CA . 16619 1 922 . 1 1 79 79 LEU CB C 13 42.4460 0.5 . 1 . . . . 79 LEU CB . 16619 1 923 . 1 1 79 79 LEU CD1 C 13 24.0230 0.5 . 2 . . . . 79 LEU CD1 . 16619 1 924 . 1 1 79 79 LEU CD2 C 13 24.5430 0.5 . 2 . . . . 79 LEU CD2 . 16619 1 925 . 1 1 79 79 LEU CG C 13 29.0720 0.5 . 1 . . . . 79 LEU CG . 16619 1 926 . 1 1 79 79 LEU N N 15 120.4332 0.1 . 1 . . . . 79 LEU N . 16619 1 927 . 1 1 80 80 SER H H 1 7.7858 0.006 . 1 . . . . 80 SER HN . 16619 1 928 . 1 1 80 80 SER HA H 1 4.4480 0.05 . 1 . . . . 80 SER HA . 16619 1 929 . 1 1 80 80 SER HB2 H 1 4.0410 0.05 . 2 . . . . 80 SER HB1|HB2 . 16619 1 930 . 1 1 80 80 SER HB3 H 1 3.9470 0.05 . 2 . . . . 80 SER HB2|HB1 . 16619 1 931 . 1 1 80 80 SER C C 13 176.3280 0.04 . 1 . . . . 80 SER C . 16619 1 932 . 1 1 80 80 SER CA C 13 59.1200 0.5 . 1 . . . . 80 SER CA . 16619 1 933 . 1 1 80 80 SER CB C 13 63.9620 0.5 . 1 . . . . 80 SER CB . 16619 1 934 . 1 1 80 80 SER N N 15 114.9317 0.1 . 1 . . . . 80 SER N . 16619 1 935 . 1 1 81 81 LYS H H 1 8.5280 0.006 . 1 . . . . 81 LYS HN . 16619 1 936 . 1 1 81 81 LYS HA H 1 4.1770 0.05 . 1 . . . . 81 LYS HA . 16619 1 937 . 1 1 81 81 LYS HB2 H 1 1.8610 0.05 . 2 . . . . 81 LYS HB# . 16619 1 938 . 1 1 81 81 LYS HB3 H 1 1.8610 0.05 . 2 . . . . 81 LYS HB# . 16619 1 939 . 1 1 81 81 LYS HD2 H 1 1.6580 0.05 . 2 . . . . 81 LYS HD# . 16619 1 940 . 1 1 81 81 LYS HD3 H 1 1.6580 0.05 . 2 . . . . 81 LYS HD# . 16619 1 941 . 1 1 81 81 LYS HE2 H 1 2.9760 0.05 . 2 . . . . 81 LYS HE# . 16619 1 942 . 1 1 81 81 LYS HE3 H 1 2.9760 0.05 . 2 . . . . 81 LYS HE# . 16619 1 943 . 1 1 81 81 LYS HG2 H 1 1.4720 0.05 . 2 . . . . 81 LYS HG# . 16619 1 944 . 1 1 81 81 LYS HG3 H 1 1.4720 0.05 . 2 . . . . 81 LYS HG# . 16619 1 945 . 1 1 81 81 LYS C C 13 176.2680 0.04 . 1 . . . . 81 LYS C . 16619 1 946 . 1 1 81 81 LYS CA C 13 58.1980 0.5 . 1 . . . . 81 LYS CA . 16619 1 947 . 1 1 81 81 LYS CB C 13 32.4180 0.5 . 1 . . . . 81 LYS CB . 16619 1 948 . 1 1 81 81 LYS CD C 13 29.4650 0.5 . 1 . . . . 81 LYS CD . 16619 1 949 . 1 1 81 81 LYS CE C 13 42.4240 0.5 . 1 . . . . 81 LYS CE . 16619 1 950 . 1 1 81 81 LYS CG C 13 24.8850 0.5 . 1 . . . . 81 LYS CG . 16619 1 951 . 1 1 81 81 LYS N N 15 122.6469 0.1 . 1 . . . . 81 LYS N . 16619 1 952 . 1 1 82 82 ASP H H 1 8.1785 0.006 . 1 . . . . 82 ASP HN . 16619 1 953 . 1 1 82 82 ASP HA H 1 4.6300 0.05 . 1 . . . . 82 ASP HA . 16619 1 954 . 1 1 82 82 ASP HB2 H 1 2.7280 0.05 . 2 . . . . 82 ASP HB1|HB2 . 16619 1 955 . 1 1 82 82 ASP HB3 H 1 2.5610 0.05 . 2 . . . . 82 ASP HB2|HB1 . 16619 1 956 . 1 1 82 82 ASP C C 13 175.1780 0.04 . 1 . . . . 82 ASP C . 16619 1 957 . 1 1 82 82 ASP CA C 13 54.4100 0.5 . 1 . . . . 82 ASP CA . 16619 1 958 . 1 1 82 82 ASP CB C 13 41.6170 0.5 . 1 . . . . 82 ASP CB . 16619 1 959 . 1 1 82 82 ASP N N 15 117.6388 0.1 . 1 . . . . 82 ASP N . 16619 1 960 . 1 1 83 83 GLN H H 1 7.6418 0.006 . 1 . . . . 83 GLN HN . 16619 1 961 . 1 1 83 83 GLN HA H 1 4.4350 0.05 . 1 . . . . 83 GLN HA . 16619 1 962 . 1 1 83 83 GLN HB2 H 1 2.1020 0.05 . 2 . . . . 83 GLN HB1|HB2 . 16619 1 963 . 1 1 83 83 GLN HB3 H 1 1.8780 0.05 . 2 . . . . 83 GLN HB2|HB1 . 16619 1 964 . 1 1 83 83 GLN HE21 H 1 7.4962 0.05 . 2 . . . . 83 GLN HE21 . 16619 1 965 . 1 1 83 83 GLN HE22 H 1 6.7937 0.05 . 2 . . . . 83 GLN HE22 . 16619 1 966 . 1 1 83 83 GLN HG2 H 1 2.3600 0.05 . 2 . . . . 83 GLN HG# . 16619 1 967 . 1 1 83 83 GLN HG3 H 1 2.3600 0.05 . 2 . . . . 83 GLN HG# . 16619 1 968 . 1 1 83 83 GLN C C 13 175.4390 0.04 . 1 . . . . 83 GLN C . 16619 1 969 . 1 1 83 83 GLN CA C 13 55.0650 0.5 . 1 . . . . 83 GLN CA . 16619 1 970 . 1 1 83 83 GLN CB C 13 31.1360 0.5 . 1 . . . . 83 GLN CB . 16619 1 971 . 1 1 83 83 GLN CG C 13 33.6900 0.5 . 1 . . . . 83 GLN CG . 16619 1 972 . 1 1 83 83 GLN N N 15 117.0872 0.1 . 1 . . . . 83 GLN N . 16619 1 973 . 1 1 83 83 GLN NE2 N 15 112.1180 0.1 . 1 . . . . 83 GLN NE2 . 16619 1 974 . 1 1 84 84 ASP H H 1 8.4517 0.006 . 1 . . . . 84 ASP HN . 16619 1 975 . 1 1 84 84 ASP HA H 1 4.6930 0.05 . 1 . . . . 84 ASP HA . 16619 1 976 . 1 1 84 84 ASP HB2 H 1 2.3840 0.05 . 2 . . . . 84 ASP HB1|HB2 . 16619 1 977 . 1 1 84 84 ASP HB3 H 1 2.1280 0.05 . 2 . . . . 84 ASP HB2|HB1 . 16619 1 978 . 1 1 84 84 ASP C C 13 175.9290 0.04 . 1 . . . . 84 ASP C . 16619 1 979 . 1 1 84 84 ASP CA C 13 53.6030 0.5 . 1 . . . . 84 ASP CA . 16619 1 980 . 1 1 84 84 ASP CB C 13 40.6570 0.5 . 1 . . . . 84 ASP CB . 16619 1 981 . 1 1 84 84 ASP N N 15 121.8053 0.1 . 1 . . . . 84 ASP N . 16619 1 982 . 1 1 85 85 PHE H H 1 7.5530 0.006 . 1 . . . . 85 PHE HN . 16619 1 983 . 1 1 85 85 PHE HA H 1 4.9090 0.05 . 1 . . . . 85 PHE HA . 16619 1 984 . 1 1 85 85 PHE HB2 H 1 3.0550 0.05 . 2 . . . . 85 PHE HB1|HB2 . 16619 1 985 . 1 1 85 85 PHE HB3 H 1 3.2240 0.05 . 2 . . . . 85 PHE HB2|HB1 . 16619 1 986 . 1 1 85 85 PHE HD1 H 1 7.0600 0.05 . 3 . . . . 85 PHE HD1 . 16619 1 987 . 1 1 85 85 PHE HD2 H 1 7.0600 0.05 . 3 . . . . 85 PHE HD2 . 16619 1 988 . 1 1 85 85 PHE HE1 H 1 6.8300 0.05 . 3 . . . . 85 PHE HE1 . 16619 1 989 . 1 1 85 85 PHE HE2 H 1 6.8300 0.05 . 3 . . . . 85 PHE HE2 . 16619 1 990 . 1 1 85 85 PHE HZ H 1 6.6810 0.05 . 1 . . . . 85 PHE HZ . 16619 1 991 . 1 1 85 85 PHE C C 13 174.2890 0.04 . 1 . . . . 85 PHE C . 16619 1 992 . 1 1 85 85 PHE CA C 13 57.2840 0.5 . 1 . . . . 85 PHE CA . 16619 1 993 . 1 1 85 85 PHE CB C 13 39.8130 0.5 . 1 . . . . 85 PHE CB . 16619 1 994 . 1 1 85 85 PHE CD1 C 13 132.8560 0.5 . 3 . . . . 85 PHE CD1 . 16619 1 995 . 1 1 85 85 PHE CD2 C 13 132.8560 0.5 . 3 . . . . 85 PHE CD2 . 16619 1 996 . 1 1 85 85 PHE CE1 C 13 131.2300 0.5 . 3 . . . . 85 PHE CE1 . 16619 1 997 . 1 1 85 85 PHE CE2 C 13 131.2300 0.5 . 3 . . . . 85 PHE CE2 . 16619 1 998 . 1 1 85 85 PHE CZ C 13 128.5200 0.5 . 1 . . . . 85 PHE CZ . 16619 1 999 . 1 1 85 85 PHE N N 15 119.5083 0.1 . 1 . . . . 85 PHE N . 16619 1 1000 . 1 1 86 86 SER H H 1 8.5856 0.006 . 1 . . . . 86 SER HN . 16619 1 1001 . 1 1 86 86 SER HA H 1 4.6460 0.05 . 1 . . . . 86 SER HA . 16619 1 1002 . 1 1 86 86 SER HB2 H 1 3.9160 0.05 . 2 . . . . 86 SER HB1|HB2 . 16619 1 1003 . 1 1 86 86 SER HB3 H 1 4.2820 0.05 . 2 . . . . 86 SER HB2|HB1 . 16619 1 1004 . 1 1 86 86 SER C C 13 176.060 0.04 . 1 . . . . 86 SER C . 16619 1 1005 . 1 1 86 86 SER CA C 13 55.2750 0.5 . 1 . . . . 86 SER CA . 16619 1 1006 . 1 1 86 86 SER CB C 13 66.6580 0.5 . 1 . . . . 86 SER CB . 16619 1 1007 . 1 1 86 86 SER N N 15 116.0827 0.1 . 1 . . . . 86 SER N . 16619 1 1008 . 1 1 87 87 TRP H H 1 8.6883 0.006 . 1 . . . . 87 TRP HN . 16619 1 1009 . 1 1 87 87 TRP HA H 1 4.8830 0.05 . 1 . . . . 87 TRP HA . 16619 1 1010 . 1 1 87 87 TRP HB2 H 1 3.4110 0.05 . 2 . . . . 87 TRP HB# . 16619 1 1011 . 1 1 87 87 TRP HB3 H 1 3.4110 0.05 . 2 . . . . 87 TRP HB# . 16619 1 1012 . 1 1 87 87 TRP HD1 H 1 7.0200 0.05 . 1 . . . . 87 TRP HD1 . 16619 1 1013 . 1 1 87 87 TRP HE1 H 1 10.4770 0.05 . 1 . . . . 87 TRP HE1 . 16619 1 1014 . 1 1 87 87 TRP HE3 H 1 7.7110 0.05 . 1 . . . . 87 TRP HE3 . 16619 1 1015 . 1 1 87 87 TRP HH2 H 1 6.2510 0.05 . 1 . . . . 87 TRP HH2 . 16619 1 1016 . 1 1 87 87 TRP HZ2 H 1 7.2650 0.05 . 1 . . . . 87 TRP HZ2 . 16619 1 1017 . 1 1 87 87 TRP HZ3 H 1 6.4700 0.05 . 1 . . . . 87 TRP HZ3 . 16619 1 1018 . 1 1 87 87 TRP C C 13 179.4510 0.04 . 1 . . . . 87 TRP C . 16619 1 1019 . 1 1 87 87 TRP CA C 13 60.0120 0.5 . 1 . . . . 87 TRP CA . 16619 1 1020 . 1 1 87 87 TRP CB C 13 31.0220 0.5 . 1 . . . . 87 TRP CB . 16619 1 1021 . 1 1 87 87 TRP CE3 C 13 119.1800 0.5 . 1 . . . . 87 TRP CE3 . 16619 1 1022 . 1 1 87 87 TRP CH2 C 13 124.6000 0.5 . 1 . . . . 87 TRP CH2 . 16619 1 1023 . 1 1 87 87 TRP CZ2 C 13 116.6600 0.5 . 1 . . . . 87 TRP CZ2 . 16619 1 1024 . 1 1 87 87 TRP CZ3 C 13 121.7600 0.5 . 1 . . . . 87 TRP CZ3 . 16619 1 1025 . 1 1 87 87 TRP N N 15 121.0786 0.1 . 1 . . . . 87 TRP N . 16619 1 1026 . 1 1 87 87 TRP NE1 N 15 127.5580 0.1 . 1 . . . . 87 TRP NE1 . 16619 1 1027 . 1 1 88 88 SER H H 1 8.4349 0.006 . 1 . . . . 88 SER HN . 16619 1 1028 . 1 1 88 88 SER HA H 1 4.3228 0.05 . 1 . . . . 88 SER HA . 16619 1 1029 . 1 1 88 88 SER HB2 H 1 4.0480 0.05 . 2 . . . . 88 SER HB# . 16619 1 1030 . 1 1 88 88 SER HB3 H 1 4.0480 0.05 . 2 . . . . 88 SER HB# . 16619 1 1031 . 1 1 88 88 SER C C 13 176.7630 0.04 . 1 . . . . 88 SER C . 16619 1 1032 . 1 1 88 88 SER CA C 13 62.5210 0.5 . 1 . . . . 88 SER CA . 16619 1 1033 . 1 1 88 88 SER CB C 13 62.5210 0.5 . 1 . . . . 88 SER CB . 16619 1 1034 . 1 1 88 88 SER N N 15 111.3971 0.1 . 1 . . . . 88 SER N . 16619 1 1035 . 1 1 89 89 GLN H H 1 7.6849 0.006 . 1 . . . . 89 GLN HN . 16619 1 1036 . 1 1 89 89 GLN HA H 1 4.0720 0.05 . 1 . . . . 89 GLN HA . 16619 1 1037 . 1 1 89 89 GLN HB2 H 1 2.0640 0.05 . 2 . . . . 89 GLN HB# . 16619 1 1038 . 1 1 89 89 GLN HB3 H 1 2.0640 0.05 . 2 . . . . 89 GLN HB# . 16619 1 1039 . 1 1 89 89 GLN HE21 H 1 7.5599 0.05 . 2 . . . . 89 GLN HE21 . 16619 1 1040 . 1 1 89 89 GLN HE22 H 1 6.8479 0.05 . 2 . . . . 89 GLN HE22 . 16619 1 1041 . 1 1 89 89 GLN HG2 H 1 2.4800 0.05 . 2 . . . . 89 GLN HG# . 16619 1 1042 . 1 1 89 89 GLN HG3 H 1 2.4800 0.05 . 2 . . . . 89 GLN HG# . 16619 1 1043 . 1 1 89 89 GLN C C 13 177.7020 0.04 . 1 . . . . 89 GLN C . 16619 1 1044 . 1 1 89 89 GLN CA C 13 59.5850 0.5 . 1 . . . . 89 GLN CA . 16619 1 1045 . 1 1 89 89 GLN CB C 13 29.0680 0.5 . 1 . . . . 89 GLN CB . 16619 1 1046 . 1 1 89 89 GLN CG C 13 35.2020 0.5 . 1 . . . . 89 GLN CG . 16619 1 1047 . 1 1 89 89 GLN N N 15 121.4801 0.1 . 1 . . . . 89 GLN N . 16619 1 1048 . 1 1 89 89 GLN NE2 N 15 111.4820 0.1 . 1 . . . . 89 GLN NE2 . 16619 1 1049 . 1 1 90 90 LEU H H 1 7.6444 0.006 . 1 . . . . 90 LEU NH . 16619 1 1050 . 1 1 90 90 LEU HA H 1 3.9240 0.05 . 1 . . . . 90 LEU HA . 16619 1 1051 . 1 1 90 90 LEU HB2 H 1 1.3300 0.05 . 2 . . . . 90 LEU HB1|HB2 . 16619 1 1052 . 1 1 90 90 LEU HB3 H 1 2.2440 0.05 . 2 . . . . 90 LEU HB2|HB1 . 16619 1 1053 . 1 1 90 90 LEU HD11 H 1 0.7600 0.05 . 2 . . . . 90 LEU HD1#|HD2# . 16619 1 1054 . 1 1 90 90 LEU HD12 H 1 0.7600 0.05 . 2 . . . . 90 LEU HD1#|HD2# . 16619 1 1055 . 1 1 90 90 LEU HD13 H 1 0.7600 0.05 . 2 . . . . 90 LEU HD1#|HD2# . 16619 1 1056 . 1 1 90 90 LEU HD21 H 1 1.0850 0.05 . 2 . . . . 90 LEU HD2#|HD1# . 16619 1 1057 . 1 1 90 90 LEU HD22 H 1 1.0850 0.05 . 2 . . . . 90 LEU HD2#|HD1# . 16619 1 1058 . 1 1 90 90 LEU HD23 H 1 1.0850 0.05 . 2 . . . . 90 LEU HD2#|HD1# . 16619 1 1059 . 1 1 90 90 LEU HG H 1 1.6140 0.05 . 1 . . . . 90 LEU HG . 16619 1 1060 . 1 1 90 90 LEU C C 13 179.0200 0.04 . 1 . . . . 90 LEU C . 16619 1 1061 . 1 1 90 90 LEU CA C 13 58.3350 0.5 . 1 . . . . 90 LEU CA . 16619 1 1062 . 1 1 90 90 LEU CB C 13 41.4760 0.5 . 1 . . . . 90 LEU CB . 16619 1 1063 . 1 1 90 90 LEU CD1 C 13 24.1330 0.5 . 2 . . . . 90 LEU CD1 . 16619 1 1064 . 1 1 90 90 LEU CD2 C 13 26.1220 0.5 . 2 . . . . 90 LEU CD2 . 16619 1 1065 . 1 1 90 90 LEU CG C 13 27.7800 0.5 . 1 . . . . 90 LEU CG . 16619 1 1066 . 1 1 90 90 LEU N N 15 117.9479 0.1 . 1 . . . . 90 LEU N . 16619 1 1067 . 1 1 91 91 VAL H H 1 9.0324 0.006 . 1 . . . . 91 VAL HN . 16619 1 1068 . 1 1 91 91 VAL HA H 1 3.7340 0.05 . 1 . . . . 91 VAL HA . 16619 1 1069 . 1 1 91 91 VAL HB H 1 2.2080 0.05 . 1 . . . . 91 VAL HB . 16619 1 1070 . 1 1 91 91 VAL HG11 H 1 1.2780 0.05 . 2 . . . . 91 VAL HG1#|HG2# . 16619 1 1071 . 1 1 91 91 VAL HG12 H 1 1.2780 0.05 . 2 . . . . 91 VAL HG1#|HG2# . 16619 1 1072 . 1 1 91 91 VAL HG13 H 1 1.2780 0.05 . 2 . . . . 91 VAL HG1#|HG2# . 16619 1 1073 . 1 1 91 91 VAL HG21 H 1 1.0210 0.05 . 2 . . . . 91 VAL HG2#|HG1# . 16619 1 1074 . 1 1 91 91 VAL HG22 H 1 1.0210 0.05 . 2 . . . . 91 VAL HG2#|HG1# . 16619 1 1075 . 1 1 91 91 VAL HG23 H 1 1.0210 0.05 . 2 . . . . 91 VAL HG2#|HG1# . 16619 1 1076 . 1 1 91 91 VAL C C 13 177.7590 0.04 . 1 . . . . 91 VAL C . 16619 1 1077 . 1 1 91 91 VAL CA C 13 67.1140 0.5 . 1 . . . . 91 VAL CA . 16619 1 1078 . 1 1 91 91 VAL CB C 13 31.2350 0.5 . 1 . . . . 91 VAL CB . 16619 1 1079 . 1 1 91 91 VAL CG1 C 13 22.7230 0.5 . 2 . . . . 91 VAL CG1|CG2 . 16619 1 1080 . 1 1 91 91 VAL CG2 C 13 23.2400 0.5 . 2 . . . . 91 VAL CG2|CG1 . 16619 1 1081 . 1 1 91 91 VAL N N 15 114.7511 0.1 . 1 . . . . 91 VAL N . 16619 1 1082 . 1 1 92 92 MET H H 1 8.0553 0.006 . 1 . . . . 92 MET HN . 16619 1 1083 . 1 1 92 92 MET HA H 1 4.2580 0.05 . 1 . . . . 92 MET HA . 16619 1 1084 . 1 1 92 92 MET HB2 H 1 2.3430 0.05 . 2 . . . . 92 MET HB# . 16619 1 1085 . 1 1 92 92 MET HB3 H 1 2.3430 0.05 . 2 . . . . 92 MET HB# . 16619 1 1086 . 1 1 92 92 MET HE1 H 1 2.1799 0.05 . 1 . . . . 92 MET HE# . 16619 1 1087 . 1 1 92 92 MET HE2 H 1 2.1799 0.05 . 1 . . . . 92 MET HE# . 16619 1 1088 . 1 1 92 92 MET HE3 H 1 2.1799 0.05 . 1 . . . . 92 MET HE# . 16619 1 1089 . 1 1 92 92 MET HG2 H 1 2.5410 0.05 . 2 . . . . 92 MET HG# . 16619 1 1090 . 1 1 92 92 MET HG3 H 1 2.5410 0.05 . 2 . . . . 92 MET HG# . 16619 1 1091 . 1 1 92 92 MET C C 13 177.3300 0.04 . 1 . . . . 92 MET C . 16619 1 1092 . 1 1 92 92 MET CA C 13 59.9780 0.5 . 1 . . . . 92 MET CA . 16619 1 1093 . 1 1 92 92 MET CB C 13 32.0890 0.5 . 1 . . . . 92 MET CB . 16619 1 1094 . 1 1 92 92 MET CE C 13 15.1990 0.5 . 1 . . . . 92 MET CE . 16619 1 1095 . 1 1 92 92 MET CG C 13 32.9610 0.5 . 1 . . . . 92 MET CG . 16619 1 1096 . 1 1 92 92 MET N N 15 121.4482 0.1 . 1 . . . . 92 MET N . 16619 1 1097 . 1 1 93 93 LEU H H 1 7.7316 0.006 . 1 . . . . 93 LEU NH . 16619 1 1098 . 1 1 93 93 LEU HA H 1 3.9900 0.05 . 1 . . . . 93 LEU HA . 16619 1 1099 . 1 1 93 93 LEU HB2 H 1 1.4245 0.05 . 2 . . . . 93 LEU HB# . 16619 1 1100 . 1 1 93 93 LEU HB3 H 1 1.4245 0.05 . 2 . . . . 93 LEU HB# . 16619 1 1101 . 1 1 93 93 LEU HD11 H 1 0.8350 0.05 . 2 . . . . 93 LEU HD1 . 16619 1 1102 . 1 1 93 93 LEU HD12 H 1 0.8350 0.05 . 2 . . . . 93 LEU HD1 . 16619 1 1103 . 1 1 93 93 LEU HD13 H 1 0.8350 0.05 . 2 . . . . 93 LEU HD1 . 16619 1 1104 . 1 1 93 93 LEU HD21 H 1 0.8350 0.05 . 2 . . . . 93 LEU HD2 . 16619 1 1105 . 1 1 93 93 LEU HD22 H 1 0.8350 0.05 . 2 . . . . 93 LEU HD2 . 16619 1 1106 . 1 1 93 93 LEU HD23 H 1 0.8350 0.05 . 2 . . . . 93 LEU HD2 . 16619 1 1107 . 1 1 93 93 LEU C C 13 178.3220 0.04 . 1 . . . . 93 LEU C . 16619 1 1108 . 1 1 93 93 LEU CA C 13 58.3450 0.5 . 1 . . . . 93 LEU CA . 16619 1 1109 . 1 1 93 93 LEU CB C 13 41.2020 0.5 . 1 . . . . 93 LEU CB . 16619 1 1110 . 1 1 93 93 LEU CD1 C 13 25.9090 0.5 . 2 . . . . 93 LEU CD1 . 16619 1 1111 . 1 1 93 93 LEU CD2 C 13 24.4842 0.5 . 2 . . . . 93 LEU CD2 . 16619 1 1112 . 1 1 93 93 LEU CG C 13 26.9690 0.5 . 1 . . . . 93 LEU CG . 16619 1 1113 . 1 1 93 93 LEU N N 15 119.7320 0.1 . 1 . . . . 93 LEU N . 16619 1 1114 . 1 1 94 94 LEU H H 1 8.3213 0.006 . 1 . . . . 94 LEU NH . 16619 1 1115 . 1 1 94 94 LEU HA H 1 4.0150 0.05 . 1 . . . . 94 LEU HA . 16619 1 1116 . 1 1 94 94 LEU HB2 H 1 1.7690 0.05 . 2 . . . . 94 LEU HB1|HB2 . 16619 1 1117 . 1 1 94 94 LEU HB3 H 1 1.1760 0.05 . 2 . . . . 94 LEU HB2|HB1 . 16619 1 1118 . 1 1 94 94 LEU HD11 H 1 0.7720 0.05 . 2 . . . . 94 LEU HD1#|HD2# . 16619 1 1119 . 1 1 94 94 LEU HD12 H 1 0.7720 0.05 . 2 . . . . 94 LEU HD1#|HD2# . 16619 1 1120 . 1 1 94 94 LEU HD13 H 1 0.7720 0.05 . 2 . . . . 94 LEU HD1#|HD2# . 16619 1 1121 . 1 1 94 94 LEU HD21 H 1 0.7720 0.05 . 2 . . . . 94 LEU HD2#|HD1# . 16619 1 1122 . 1 1 94 94 LEU HD22 H 1 0.7720 0.05 . 2 . . . . 94 LEU HD2#|HD1# . 16619 1 1123 . 1 1 94 94 LEU HD23 H 1 0.7720 0.05 . 2 . . . . 94 LEU HD2#|HD1# . 16619 1 1124 . 1 1 94 94 LEU HG H 1 1.9390 0.05 . 1 . . . . 94 LEU HG . 16619 1 1125 . 1 1 94 94 LEU C C 13 178.7000 0.04 . 1 . . . . 94 LEU C . 16619 1 1126 . 1 1 94 94 LEU CA C 13 58.5560 0.5 . 1 . . . . 94 LEU CA . 16619 1 1127 . 1 1 94 94 LEU CB C 13 40.3290 0.5 . 1 . . . . 94 LEU CB . 16619 1 1128 . 1 1 94 94 LEU CD1 C 13 25.4590 0.5 . 2 . . . . 94 LEU CD1 . 16619 1 1129 . 1 1 94 94 LEU CD2 C 13 24.1420 0.5 . 2 . . . . 94 LEU CD2 . 16619 1 1130 . 1 1 94 94 LEU CG C 13 27.1000 0.5 . 1 . . . . 94 LEU CG . 16619 1 1131 . 1 1 94 94 LEU N N 15 117.2606 0.1 . 1 . . . . 94 LEU N . 16619 1 1132 . 1 1 95 95 ALA H H 1 9.1959 0.006 . 1 . . . . 95 ALA HN . 16619 1 1133 . 1 1 95 95 ALA HA H 1 4.4200 0.05 . 1 . . . . 95 ALA HA . 16619 1 1134 . 1 1 95 95 ALA HB1 H 1 1.7290 0.05 . 1 . . . . 95 ALA HB# . 16619 1 1135 . 1 1 95 95 ALA HB2 H 1 1.7290 0.05 . 1 . . . . 95 ALA HB# . 16619 1 1136 . 1 1 95 95 ALA HB3 H 1 1.7290 0.05 . 1 . . . . 95 ALA HB# . 16619 1 1137 . 1 1 95 95 ALA C C 13 180.1710 0.04 . 1 . . . . 95 ALA C . 16619 1 1138 . 1 1 95 95 ALA CA C 13 54.6690 0.5 . 1 . . . . 95 ALA CA . 16619 1 1139 . 1 1 95 95 ALA CB C 13 18.9560 0.5 . 1 . . . . 95 ALA CB . 16619 1 1140 . 1 1 95 95 ALA N N 15 121.9617 0.1 . 1 . . . . 95 ALA N . 16619 1 1141 . 1 1 96 96 PHE H H 1 8.4296 0.006 . 1 . . . . 96 PHE HN . 16619 1 1142 . 1 1 96 96 PHE HA H 1 3.5690 0.05 . 1 . . . . 96 PHE HA . 16619 1 1143 . 1 1 96 96 PHE HB2 H 1 3.0950 0.05 . 2 . . . . 96 PHE HB1|HB2 . 16619 1 1144 . 1 1 96 96 PHE HB3 H 1 2.6840 0.05 . 2 . . . . 96 PHE HB2|HB1 . 16619 1 1145 . 1 1 96 96 PHE HD1 H 1 6.4900 0.05 . 3 . . . . 96 PHE HD1 . 16619 1 1146 . 1 1 96 96 PHE HD2 H 1 6.4900 0.05 . 3 . . . . 96 PHE HD2 . 16619 1 1147 . 1 1 96 96 PHE HE1 H 1 6.9590 0.05 . 3 . . . . 96 PHE HE1 . 16619 1 1148 . 1 1 96 96 PHE HE2 H 1 6.9590 0.05 . 3 . . . . 96 PHE HE2 . 16619 1 1149 . 1 1 96 96 PHE HZ H 1 7.1700 0.05 . 1 . . . . 96 PHE HZ . 16619 1 1150 . 1 1 96 96 PHE C C 13 176.2590 0.04 . 1 . . . . 96 PHE C . 16619 1 1151 . 1 1 96 96 PHE CA C 13 61.2780 0.5 . 1 . . . . 96 PHE CA . 16619 1 1152 . 1 1 96 96 PHE CB C 13 38.8100 0.5 . 1 . . . . 96 PHE CB . 16619 1 1153 . 1 1 96 96 PHE CD1 C 13 131.5960 0.5 . 3 . . . . 96 PHE CD1 . 16619 1 1154 . 1 1 96 96 PHE CD2 C 13 131.5960 0.5 . 3 . . . . 96 PHE CD2 . 16619 1 1155 . 1 1 96 96 PHE CE1 C 13 131.3940 0.5 . 3 . . . . 96 PHE CE1 . 16619 1 1156 . 1 1 96 96 PHE CE2 C 13 131.3940 0.5 . 3 . . . . 96 PHE CE2 . 16619 1 1157 . 1 1 96 96 PHE CZ C 13 129.3170 0.5 . 1 . . . . 96 PHE CZ . 16619 1 1158 . 1 1 96 96 PHE N N 15 120.4073 0.1 . 1 . . . . 96 PHE N . 16619 1 1159 . 1 1 97 97 ALA H H 1 8.3023 0.006 . 1 . . . . 97 ALA HN . 16619 1 1160 . 1 1 97 97 ALA HA H 1 3.5500 0.05 . 1 . . . . 97 ALA HA . 16619 1 1161 . 1 1 97 97 ALA HB1 H 1 1.4460 0.05 . 1 . . . . 97 ALA HB# . 16619 1 1162 . 1 1 97 97 ALA HB2 H 1 1.4460 0.05 . 1 . . . . 97 ALA HB# . 16619 1 1163 . 1 1 97 97 ALA HB3 H 1 1.4460 0.05 . 1 . . . . 97 ALA HB# . 16619 1 1164 . 1 1 97 97 ALA CA C 13 55.1420 0.5 . 1 . . . . 97 ALA CA . 16619 1 1165 . 1 1 97 97 ALA CB C 13 18.0180 0.5 . 1 . . . . 97 ALA CB . 16619 1 1166 . 1 1 97 97 ALA N N 15 120.7903 0.1 . 1 . . . . 97 ALA N . 16619 1 1167 . 1 1 98 98 GLY H H 1 8.5055 0.006 . 1 . . . . 98 GLY HN . 16619 1 1168 . 1 1 98 98 GLY HA2 H 1 3.5040 0.05 . 2 . . . . 98 GLY HA# . 16619 1 1169 . 1 1 98 98 GLY HA3 H 1 3.5040 0.05 . 2 . . . . 98 GLY HA# . 16619 1 1170 . 1 1 98 98 GLY C C 13 176.8540 0.04 . 1 . . . . 98 GLY C . 16619 1 1171 . 1 1 98 98 GLY CA C 13 48.5870 0.5 . 1 . . . . 98 GLY CA . 16619 1 1172 . 1 1 98 98 GLY N N 15 101.33 0.1 . 1 . . . . 98 GLY N . 16619 1 1173 . 1 1 99 99 THR H H 1 7.9514 0.006 . 1 . . . . 99 THR HN . 16619 1 1174 . 1 1 99 99 THR HA H 1 3.9920 0.05 . 1 . . . . 99 THR HA . 16619 1 1175 . 1 1 99 99 THR HB H 1 4.2280 0.05 . 1 . . . . 99 THR HB . 16619 1 1176 . 1 1 99 99 THR HG21 H 1 1.2580 0.05 . 1 . . . . 99 THR HG2# . 16619 1 1177 . 1 1 99 99 THR HG22 H 1 1.2580 0.05 . 1 . . . . 99 THR HG2# . 16619 1 1178 . 1 1 99 99 THR HG23 H 1 1.2580 0.05 . 1 . . . . 99 THR HG2# . 16619 1 1179 . 1 1 99 99 THR C C 13 176.6920 0.04 . 1 . . . . 99 THR C . 16619 1 1180 . 1 1 99 99 THR CA C 13 66.1270 0.5 . 1 . . . . 99 THR CA . 16619 1 1181 . 1 1 99 99 THR CB C 13 68.7780 0.5 . 1 . . . . 99 THR CB . 16619 1 1182 . 1 1 99 99 THR CG2 C 13 22.2030 0.5 . 1 . . . . 99 THR CG2 . 16619 1 1183 . 1 1 99 99 THR N N 15 117.7718 0.1 . 1 . . . . 99 THR N . 16619 1 1184 . 1 1 100 100 LEU H H 1 7.2985 0.006 . 1 . . . . 100 LEU NH . 16619 1 1185 . 1 1 100 100 LEU HA H 1 3.8930 0.05 . 1 . . . . 100 LEU HA . 16619 1 1186 . 1 1 100 100 LEU HB2 H 1 1.5440 0.05 . 2 . . . . 100 LEU HB1|HB2 . 16619 1 1187 . 1 1 100 100 LEU HB3 H 1 1.0700 0.05 . 2 . . . . 100 LEU HB2|HB1 . 16619 1 1188 . 1 1 100 100 LEU HD11 H 1 0.5400 0.05 . 2 . . . . 100 LEU HD1#|HD2# . 16619 1 1189 . 1 1 100 100 LEU HD12 H 1 0.5400 0.05 . 2 . . . . 100 LEU HD1#|HD2# . 16619 1 1190 . 1 1 100 100 LEU HD13 H 1 0.5400 0.05 . 2 . . . . 100 LEU HD1#|HD2# . 16619 1 1191 . 1 1 100 100 LEU HD21 H 1 0.5400 0.05 . 2 . . . . 100 LEU HD2#|HD1# . 16619 1 1192 . 1 1 100 100 LEU HD22 H 1 0.5400 0.05 . 2 . . . . 100 LEU HD2#|HD1# . 16619 1 1193 . 1 1 100 100 LEU HD23 H 1 0.5400 0.05 . 2 . . . . 100 LEU HD2#|HD1# . 16619 1 1194 . 1 1 100 100 LEU HG H 1 1.1500 0.05 . 1 . . . . 100 LEU HG . 16619 1 1195 . 1 1 100 100 LEU C C 13 178.5730 0.04 . 1 . . . . 100 LEU C . 16619 1 1196 . 1 1 100 100 LEU CA C 13 56.5810 0.5 . 1 . . . . 100 LEU CA . 16619 1 1197 . 1 1 100 100 LEU CB C 13 41.7744 0.5 . 1 . . . . 100 LEU CB . 16619 1 1198 . 1 1 100 100 LEU CD1 C 13 23.6130 0.5 . 2 . . . . 100 LEU CD1 . 16619 1 1199 . 1 1 100 100 LEU CD2 C 13 23.6130 0.5 . 2 . . . . 100 LEU CD2 . 16619 1 1200 . 1 1 100 100 LEU CG C 13 26.1130 0.5 . 1 . . . . 100 LEU CG . 16619 1 1201 . 1 1 100 100 LEU N N 15 119.0661 0.1 . 1 . . . . 100 LEU N . 16619 1 1202 . 1 1 101 101 MET H H 1 7.1846 0.006 . 1 . . . . 101 MET HN . 16619 1 1203 . 1 1 101 101 MET HA H 1 4.4240 0.05 . 1 . . . . 101 MET HA . 16619 1 1204 . 1 1 101 101 MET HB2 H 1 1.7020 0.05 . 2 . . . . 101 MET HB# . 16619 1 1205 . 1 1 101 101 MET HB3 H 1 1.7020 0.05 . 2 . . . . 101 MET HB# . 16619 1 1206 . 1 1 101 101 MET HE1 H 1 1.9300 0.05 . 1 . . . . 101 MET HE# . 16619 1 1207 . 1 1 101 101 MET HE2 H 1 1.9300 0.05 . 1 . . . . 101 MET HE# . 16619 1 1208 . 1 1 101 101 MET HE3 H 1 1.9300 0.05 . 1 . . . . 101 MET HE# . 16619 1 1209 . 1 1 101 101 MET HG2 H 1 2.4200 0.05 . 2 . . . . 101 MET HG# . 16619 1 1210 . 1 1 101 101 MET HG3 H 1 2.4200 0.05 . 2 . . . . 101 MET HG# . 16619 1 1211 . 1 1 101 101 MET C C 13 175.7600 0.04 . 1 . . . . 101 MET C . 16619 1 1212 . 1 1 101 101 MET CA C 13 53.8130 0.5 . 1 . . . . 101 MET CA . 16619 1 1213 . 1 1 101 101 MET CB C 13 34.1720 0.5 . 1 . . . . 101 MET CB . 16619 1 1214 . 1 1 101 101 MET CE C 13 16.2830 0.5 . 1 . . . . 101 MET CE . 16619 1 1215 . 1 1 101 101 MET CG C 13 33.9820 0.5 . 1 . . . . 101 MET CG . 16619 1 1216 . 1 1 101 101 MET N N 15 113.4304 0.1 . 1 . . . . 101 MET N . 16619 1 1217 . 1 1 102 102 ASN H H 1 7.2795 0.006 . 1 . . . . 102 ASN HN . 16619 1 1218 . 1 1 102 102 ASN HA H 1 4.5570 0.05 . 1 . . . . 102 ASN HA . 16619 1 1219 . 1 1 102 102 ASN HB2 H 1 2.8300 0.05 . 2 . . . . 102 ASN HB# . 16619 1 1220 . 1 1 102 102 ASN HB3 H 1 2.8300 0.05 . 2 . . . . 102 ASN HB# . 16619 1 1221 . 1 1 102 102 ASN HD21 H 1 6.8980 0.05 . 2 . . . . 102 ASN HD21 . 16619 1 1222 . 1 1 102 102 ASN HD22 H 1 7.6470 0.05 . 2 . . . . 102 ASN HD22 . 16619 1 1223 . 1 1 102 102 ASN C C 13 175.6230 0.04 . 1 . . . . 102 ASN C . 16619 1 1224 . 1 1 102 102 ASN CA C 13 54.2610 0.5 . 1 . . . . 102 ASN CA . 16619 1 1225 . 1 1 102 102 ASN CB C 13 39.9020 0.5 . 1 . . . . 102 ASN CB . 16619 1 1226 . 1 1 102 102 ASN N N 15 117.3545 0.1 . 1 . . . . 102 ASN N . 16619 1 1227 . 1 1 102 102 ASN ND2 N 15 112.3060 0.1 . 1 . . . . 102 ASN ND2 . 16619 1 1228 . 1 1 103 103 GLN H H 1 8.5742 0.006 . 1 . . . . 103 GLN HN . 16619 1 1229 . 1 1 103 103 GLN HA H 1 4.3750 0.05 . 1 . . . . 103 GLN HA . 16619 1 1230 . 1 1 103 103 GLN HB2 H 1 2.2540 0.05 . 2 . . . . 103 GLN HB1|HB2 . 16619 1 1231 . 1 1 103 103 GLN HB3 H 1 1.9480 0.05 . 2 . . . . 103 GLN HB2|HB1 . 16619 1 1232 . 1 1 103 103 GLN HG2 H 1 2.3600 0.05 . 2 . . . . 103 GLN HG# . 16619 1 1233 . 1 1 103 103 GLN HG3 H 1 2.3600 0.05 . 2 . . . . 103 GLN HG# . 16619 1 1234 . 1 1 103 103 GLN C C 13 176.1300 0.04 . 1 . . . . 103 GLN C . 16619 1 1235 . 1 1 103 103 GLN CA C 13 55.7070 0.5 . 1 . . . . 103 GLN CA . 16619 1 1236 . 1 1 103 103 GLN CB C 13 29.7880 0.5 . 1 . . . . 103 GLN CB . 16619 1 1237 . 1 1 103 103 GLN CG C 13 34.3220 0.5 . 1 . . . . 103 GLN CG . 16619 1 1238 . 1 1 103 103 GLN N N 15 121.5896 0.1 . 1 . . . . 103 GLN N . 16619 1 1239 . 1 1 104 104 GLY H H 1 8.1651 0.006 . 1 . . . . 104 GLY HN . 16619 1 1240 . 1 1 104 104 GLY HA2 H 1 3.9280 0.05 . 2 . . . . 104 GLY HA# . 16619 1 1241 . 1 1 104 104 GLY HA3 H 1 3.9280 0.05 . 2 . . . . 104 GLY HA# . 16619 1 1242 . 1 1 104 104 GLY CA C 13 45.5500 0.5 . 1 . . . . 104 GLY CA . 16619 1 1243 . 1 1 104 104 GLY N N 15 108.9472 0.1 . 1 . . . . 104 GLY N . 16619 1 1244 . 1 1 105 105 PRO HA H 1 4.3550 0.05 . 1 . . . . 105 PRO HA . 16619 1 1245 . 1 1 105 105 PRO HB2 H 1 2.1760 0.05 . 2 . . . . 105 PRO HB1|HB2 . 16619 1 1246 . 1 1 105 105 PRO HB3 H 1 1.7900 0.05 . 2 . . . . 105 PRO HB2|HB1 . 16619 1 1247 . 1 1 105 105 PRO HD2 H 1 3.5450 0.05 . 2 . . . . 105 PRO HD# . 16619 1 1248 . 1 1 105 105 PRO HD3 H 1 3.5450 0.05 . 2 . . . . 105 PRO HD# . 16619 1 1249 . 1 1 105 105 PRO HG2 H 1 1.9350 0.05 . 2 . . . . 105 PRO HG# . 16619 1 1250 . 1 1 105 105 PRO HG3 H 1 1.9350 0.05 . 2 . . . . 105 PRO HG# . 16619 1 1251 . 1 1 105 105 PRO C C 13 177.0370 0.04 . 1 . . . . 105 PRO C . 16619 1 1252 . 1 1 105 105 PRO CA C 13 63.7120 0.5 . 1 . . . . 105 PRO CA . 16619 1 1253 . 1 1 105 105 PRO CB C 13 32.2810 0.5 . 1 . . . . 105 PRO CB . 16619 1 1254 . 1 1 105 105 PRO CD C 13 50.2430 0.5 . 1 . . . . 105 PRO CD . 16619 1 1255 . 1 1 105 105 PRO CG C 13 27.2880 0.5 . 1 . . . . 105 PRO CG . 16619 1 1256 . 1 1 106 106 TYR H H 1 8.0188 0.006 . 1 . . . . 106 TYR HN . 16619 1 1257 . 1 1 106 106 TYR HA H 1 4.4970 0.05 . 1 . . . . 106 TYR HA . 16619 1 1258 . 1 1 106 106 TYR HB2 H 1 3.0920 0.05 . 2 . . . . 106 TYR HB1|HB2 . 16619 1 1259 . 1 1 106 106 TYR HB3 H 1 2.9900 0.05 . 2 . . . . 106 TYR HB2|HB1 . 16619 1 1260 . 1 1 106 106 TYR HD1 H 1 7.0900 0.05 . 3 . . . . 106 TYR HD1 . 16619 1 1261 . 1 1 106 106 TYR HD2 H 1 7.0900 0.05 . 3 . . . . 106 TYR HD2 . 16619 1 1262 . 1 1 106 106 TYR HE1 H 1 6.8300 0.05 . 3 . . . . 106 TYR HE1 . 16619 1 1263 . 1 1 106 106 TYR HE2 H 1 6.8300 0.05 . 3 . . . . 106 TYR HE2 . 16619 1 1264 . 1 1 106 106 TYR C C 13 175.9860 0.04 . 1 . . . . 106 TYR C . 16619 1 1265 . 1 1 106 106 TYR CA C 13 58.2480 0.5 . 1 . . . . 106 TYR CA . 16619 1 1266 . 1 1 106 106 TYR CB C 13 38.1930 0.5 . 1 . . . . 106 TYR CB . 16619 1 1267 . 1 1 106 106 TYR CD1 C 13 133.0970 0.5 . 3 . . . . 106 TYR CD1 . 16619 1 1268 . 1 1 106 106 TYR CD2 C 13 133.0970 0.5 . 3 . . . . 106 TYR CD2 . 16619 1 1269 . 1 1 106 106 TYR CE1 C 13 118.3470 0.5 . 3 . . . . 106 TYR CE1 . 16619 1 1270 . 1 1 106 106 TYR CE2 C 13 118.3470 0.5 . 3 . . . . 106 TYR CE2 . 16619 1 1271 . 1 1 106 106 TYR N N 15 118.6611 0.1 . 1 . . . . 106 TYR N . 16619 1 1272 . 1 1 107 107 MET H H 1 7.9292 0.006 . 1 . . . . 107 MET HN . 16619 1 1273 . 1 1 107 107 MET HA H 1 4.4080 0.05 . 1 . . . . 107 MET HA . 16619 1 1274 . 1 1 107 107 MET HB2 H 1 2.0360 0.05 . 2 . . . . 107 MET HB# . 16619 1 1275 . 1 1 107 107 MET HB3 H 1 2.0360 0.05 . 2 . . . . 107 MET HB# . 16619 1 1276 . 1 1 107 107 MET HE1 H 1 2.0800 0.05 . 1 . . . . 107 MET HE# . 16619 1 1277 . 1 1 107 107 MET HE2 H 1 2.0800 0.05 . 1 . . . . 107 MET HE# . 16619 1 1278 . 1 1 107 107 MET HE3 H 1 2.0800 0.05 . 1 . . . . 107 MET HE# . 16619 1 1279 . 1 1 107 107 MET HG2 H 1 2.5250 0.05 . 2 . . . . 107 MET HG1|HG2 . 16619 1 1280 . 1 1 107 107 MET HG3 H 1 2.4340 0.05 . 2 . . . . 107 MET HG2|HG1 . 16619 1 1281 . 1 1 107 107 MET C C 13 175.5040 0.04 . 1 . . . . 107 MET C . 16619 1 1282 . 1 1 107 107 MET CA C 13 55.7630 0.5 . 1 . . . . 107 MET CA . 16619 1 1283 . 1 1 107 107 MET CB C 13 32.9030 0.5 . 1 . . . . 107 MET CB . 16619 1 1284 . 1 1 107 107 MET CE C 13 16.0730 0.5 . 1 . . . . 107 MET CE . 16619 1 1285 . 1 1 107 107 MET CG C 13 32.4890 0.5 . 1 . . . . 107 MET CG . 16619 1 1286 . 1 1 107 107 MET N N 15 120.3468 0.1 . 1 . . . . 107 MET N . 16619 1 1287 . 1 1 108 108 ALA H H 1 8.1693 0.006 . 1 . . . . 108 ALA HN . 16619 1 1288 . 1 1 108 108 ALA HA H 1 4.2830 0.05 . 1 . . . . 108 ALA HA . 16619 1 1289 . 1 1 108 108 ALA HB1 H 1 1.4050 0.05 . 1 . . . . 108 ALA HB# . 16619 1 1290 . 1 1 108 108 ALA HB2 H 1 1.4050 0.05 . 1 . . . . 108 ALA HB# . 16619 1 1291 . 1 1 108 108 ALA HB3 H 1 1.4050 0.05 . 1 . . . . 108 ALA HB# . 16619 1 1292 . 1 1 108 108 ALA C C 13 177.9220 0.04 . 1 . . . . 108 ALA C . 16619 1 1293 . 1 1 108 108 ALA CA C 13 52.9860 0.5 . 1 . . . . 108 ALA CA . 16619 1 1294 . 1 1 108 108 ALA CB C 13 18.9840 0.5 . 1 . . . . 108 ALA CB . 16619 1 1295 . 1 1 108 108 ALA N N 15 124.1542 0.1 . 1 . . . . 108 ALA N . 16619 1 1296 . 1 1 109 109 VAL H H 1 7.8113 0.006 . 1 . . . . 109 VAL HN . 16619 1 1297 . 1 1 109 109 VAL HA H 1 4.0670 0.05 . 1 . . . . 109 VAL HA . 16619 1 1298 . 1 1 109 109 VAL HB H 1 2.1170 0.05 . 1 . . . . 109 VAL HB . 16619 1 1299 . 1 1 109 109 VAL HG11 H 1 0.9390 0.05 . 2 . . . . 109 VAL HG1#|HG2# . 16619 1 1300 . 1 1 109 109 VAL HG12 H 1 0.9390 0.05 . 2 . . . . 109 VAL HG1#|HG2# . 16619 1 1301 . 1 1 109 109 VAL HG13 H 1 0.9390 0.05 . 2 . . . . 109 VAL HG1#|HG2# . 16619 1 1302 . 1 1 109 109 VAL HG21 H 1 0.9390 0.05 . 2 . . . . 109 VAL HG2#|HG1# . 16619 1 1303 . 1 1 109 109 VAL HG22 H 1 0.9390 0.05 . 2 . . . . 109 VAL HG2#|HG1# . 16619 1 1304 . 1 1 109 109 VAL HG23 H 1 0.9390 0.05 . 2 . . . . 109 VAL HG2#|HG1# . 16619 1 1305 . 1 1 109 109 VAL C C 13 176.4520 0.04 . 1 . . . . 109 VAL C . 16619 1 1306 . 1 1 109 109 VAL CA C 13 62.8930 0.5 . 1 . . . . 109 VAL CA . 16619 1 1307 . 1 1 109 109 VAL CB C 13 32.5640 0.5 . 1 . . . . 109 VAL CB . 16619 1 1308 . 1 1 109 109 VAL CG1 C 13 20.9700 0.5 . 2 . . . . 109 VAL CG1|CG2 . 16619 1 1309 . 1 1 109 109 VAL CG2 C 13 20.9700 0.5 . 2 . . . . 109 VAL CG2|CG1 . 16619 1 1310 . 1 1 109 109 VAL N N 15 117.3342 0.1 . 1 . . . . 109 VAL N . 16619 1 1311 . 1 1 110 110 LYS H H 1 8.2639 0.006 . 1 . . . . 110 LYS HN . 16619 1 1312 . 1 1 110 110 LYS HA H 1 4.2300 0.05 . 1 . . . . 110 LYS HA . 16619 1 1313 . 1 1 110 110 LYS HB2 H 1 1.8310 0.05 . 2 . . . . 110 LYS HB1|HB2 . 16619 1 1314 . 1 1 110 110 LYS HB3 H 1 1.7880 0.05 . 2 . . . . 110 LYS HB2|HB1 . 16619 1 1315 . 1 1 110 110 LYS HD2 H 1 1.6810 0.05 . 2 . . . . 110 LYS HD# . 16619 1 1316 . 1 1 110 110 LYS HD3 H 1 1.6810 0.05 . 2 . . . . 110 LYS HD# . 16619 1 1317 . 1 1 110 110 LYS HE2 H 1 2.9900 0.05 . 2 . . . . 110 LYS HE# . 16619 1 1318 . 1 1 110 110 LYS HE3 H 1 2.9900 0.05 . 2 . . . . 110 LYS HE# . 16619 1 1319 . 1 1 110 110 LYS HG2 H 1 1.4530 0.05 . 2 . . . . 110 LYS HG1|HG2 . 16619 1 1320 . 1 1 110 110 LYS HG3 H 1 1.4120 0.05 . 2 . . . . 110 LYS HG2|HG1 . 16619 1 1321 . 1 1 110 110 LYS C C 13 176.6900 0.04 . 1 . . . . 110 LYS C . 16619 1 1322 . 1 1 110 110 LYS CA C 13 57.1460 0.5 . 1 . . . . 110 LYS CA . 16619 1 1323 . 1 1 110 110 LYS CB C 13 32.9340 0.5 . 1 . . . . 110 LYS CB . 16619 1 1324 . 1 1 110 110 LYS CD C 13 29.2750 0.5 . 1 . . . . 110 LYS CD . 16619 1 1325 . 1 1 110 110 LYS CE C 13 42.4310 0.5 . 1 . . . . 110 LYS CE . 16619 1 1326 . 1 1 110 110 LYS CG C 13 25.0930 0.5 . 1 . . . . 110 LYS CG . 16619 1 1327 . 1 1 110 110 LYS N N 15 122.9456 0.1 . 1 . . . . 110 LYS N . 16619 1 1328 . 1 1 111 111 GLN H H 1 8.0950 0.006 . 1 . . . . 111 GLN HN . 16619 1 1329 . 1 1 111 111 GLN HA H 1 4.3440 0.05 . 1 . . . . 111 GLN HA . 16619 1 1330 . 1 1 111 111 GLN HB2 H 1 2.0210 0.05 . 2 . . . . 111 GLN HB1|HB2 . 16619 1 1331 . 1 1 111 111 GLN HB3 H 1 2.0070 0.05 . 2 . . . . 111 GLN HB2|HB1 . 16619 1 1332 . 1 1 111 111 GLN HG2 H 1 2.3620 0.05 . 2 . . . . 111 GLN HG# . 16619 1 1333 . 1 1 111 111 GLN HG3 H 1 2.3620 0.05 . 2 . . . . 111 GLN HG# . 16619 1 1334 . 1 1 111 111 GLN C C 13 175.8640 0.04 . 1 . . . . 111 GLN C . 16619 1 1335 . 1 1 111 111 GLN CA C 13 56.0620 0.5 . 1 . . . . 111 GLN CA . 16619 1 1336 . 1 1 111 111 GLN CB C 13 29.4770 0.5 . 1 . . . . 111 GLN CB . 16619 1 1337 . 1 1 111 111 GLN CG C 13 34.0560 0.5 . 1 . . . . 111 GLN CG . 16619 1 1338 . 1 1 111 111 GLN N N 15 119.3556 0.1 . 1 . . . . 111 GLN N . 16619 1 1339 . 1 1 112 112 LYS H H 1 8.2089 0.006 . 1 . . . . 112 LYS HN . 16619 1 1340 . 1 1 112 112 LYS HA H 1 4.2970 0.05 . 1 . . . . 112 LYS HA . 16619 1 1341 . 1 1 112 112 LYS HB2 H 1 1.8110 0.05 . 2 . . . . 112 LYS HB# . 16619 1 1342 . 1 1 112 112 LYS HB3 H 1 1.8110 0.05 . 2 . . . . 112 LYS HB# . 16619 1 1343 . 1 1 112 112 LYS HD2 H 1 1.7150 0.05 . 2 . . . . 112 LYS HD# . 16619 1 1344 . 1 1 112 112 LYS HD3 H 1 1.7150 0.05 . 2 . . . . 112 LYS HD# . 16619 1 1345 . 1 1 112 112 LYS HE2 H 1 3.0210 0.05 . 2 . . . . 112 LYS HE# . 16619 1 1346 . 1 1 112 112 LYS HE3 H 1 3.0210 0.05 . 2 . . . . 112 LYS HE# . 16619 1 1347 . 1 1 112 112 LYS HG2 H 1 1.4630 0.05 . 2 . . . . 112 LYS HG# . 16619 1 1348 . 1 1 112 112 LYS HG3 H 1 1.4630 0.05 . 2 . . . . 112 LYS HG# . 16619 1 1349 . 1 1 112 112 LYS C C 13 176.7510 0.04 . 1 . . . . 112 LYS C . 16619 1 1350 . 1 1 112 112 LYS CA C 13 56.9740 0.5 . 1 . . . . 112 LYS CA . 16619 1 1351 . 1 1 112 112 LYS CB C 13 32.8220 0.5 . 1 . . . . 112 LYS CB . 16619 1 1352 . 1 1 112 112 LYS CD C 13 29.4840 0.5 . 1 . . . . 112 LYS CD . 16619 1 1353 . 1 1 112 112 LYS CE C 13 43.4740 0.5 . 1 . . . . 112 LYS CE . 16619 1 1354 . 1 1 112 112 LYS CG C 13 25.0600 0.5 . 1 . . . . 112 LYS CG . 16619 1 1355 . 1 1 112 112 LYS N N 15 121.5433 0.1 . 1 . . . . 112 LYS N . 16619 1 1356 . 1 1 113 113 ARG H H 1 8.3108 0.006 . 1 . . . . 113 ARG HN . 16619 1 1357 . 1 1 113 113 ARG HA H 1 4.3000 0.05 . 1 . . . . 113 ARG HA . 16619 1 1358 . 1 1 113 113 ARG HB2 H 1 1.8230 0.05 . 2 . . . . 113 ARG HB# . 16619 1 1359 . 1 1 113 113 ARG HB3 H 1 1.8230 0.05 . 2 . . . . 113 ARG HB# . 16619 1 1360 . 1 1 113 113 ARG HD2 H 1 3.1800 0.05 . 2 . . . . 113 ARG HD# . 16619 1 1361 . 1 1 113 113 ARG HD3 H 1 3.1800 0.05 . 2 . . . . 113 ARG HD# . 16619 1 1362 . 1 1 113 113 ARG HG2 H 1 1.6360 0.05 . 2 . . . . 113 ARG HG# . 16619 1 1363 . 1 1 113 113 ARG HG3 H 1 1.6360 0.05 . 2 . . . . 113 ARG HG# . 16619 1 1364 . 1 1 113 113 ARG C C 13 176.0150 0.04 . 1 . . . . 113 ARG C . 16619 1 1365 . 1 1 113 113 ARG CA C 13 56.5970 0.5 . 1 . . . . 113 ARG CA . 16619 1 1366 . 1 1 113 113 ARG CB C 13 30.7660 0.5 . 1 . . . . 113 ARG CB . 16619 1 1367 . 1 1 113 113 ARG CD C 13 43.5790 0.5 . 1 . . . . 113 ARG CD . 16619 1 1368 . 1 1 113 113 ARG CG C 13 27.4300 0.5 . 1 . . . . 113 ARG CG . 16619 1 1369 . 1 1 113 113 ARG N N 15 121.2937 0.1 . 1 . . . . 113 ARG N . 16619 1 1370 . 1 1 114 114 ASP H H 1 8.3007 0.006 . 1 . . . . 114 ASP HN . 16619 1 1371 . 1 1 114 114 ASP HA H 1 4.6370 0.05 . 1 . . . . 114 ASP HA . 16619 1 1372 . 1 1 114 114 ASP HB2 H 1 2.7410 0.05 . 2 . . . . 114 ASP HB# . 16619 1 1373 . 1 1 114 114 ASP HB3 H 1 2.7410 0.05 . 2 . . . . 114 ASP HB# . 16619 1 1374 . 1 1 114 114 ASP C C 13 176.6610 0.04 . 1 . . . . 114 ASP C . 16619 1 1375 . 1 1 114 114 ASP CA C 13 54.3550 0.5 . 1 . . . . 114 ASP CA . 16619 1 1376 . 1 1 114 114 ASP CB C 13 41.1900 0.5 . 1 . . . . 114 ASP CB . 16619 1 1377 . 1 1 114 114 ASP N N 15 121.2232 0.1 . 1 . . . . 114 ASP N . 16619 1 1378 . 1 1 115 115 LEU H H 1 8.2673 0.006 . 1 . . . . 115 LEU NH . 16619 1 1379 . 1 1 115 115 LEU HA H 1 4.2300 0.05 . 1 . . . . 115 LEU HA . 16619 1 1380 . 1 1 115 115 LEU HB2 H 1 1.7080 0.05 . 2 . . . . 115 LEU HB# . 16619 1 1381 . 1 1 115 115 LEU HB3 H 1 1.7080 0.05 . 2 . . . . 115 LEU HB# . 16619 1 1382 . 1 1 115 115 LEU HD11 H 1 0.9310 0.05 . 2 . . . . 115 LEU HD1#|HD2# . 16619 1 1383 . 1 1 115 115 LEU HD12 H 1 0.9310 0.05 . 2 . . . . 115 LEU HD1#|HD2# . 16619 1 1384 . 1 1 115 115 LEU HD13 H 1 0.9310 0.05 . 2 . . . . 115 LEU HD1#|HD2# . 16619 1 1385 . 1 1 115 115 LEU HD21 H 1 0.8760 0.05 . 2 . . . . 115 LEU HD2#|HD1# . 16619 1 1386 . 1 1 115 115 LEU HD22 H 1 0.8760 0.05 . 2 . . . . 115 LEU HD2#|HD1# . 16619 1 1387 . 1 1 115 115 LEU HD23 H 1 0.8760 0.05 . 2 . . . . 115 LEU HD2#|HD1# . 16619 1 1388 . 1 1 115 115 LEU HG H 1 1.6800 0.05 . 1 . . . . 115 LEU HG . 16619 1 1389 . 1 1 115 115 LEU C C 13 178.3540 0.04 . 1 . . . . 115 LEU C . 16619 1 1390 . 1 1 115 115 LEU CA C 13 56.5810 0.5 . 1 . . . . 115 LEU CA . 16619 1 1391 . 1 1 115 115 LEU CB C 13 42.0100 0.5 . 1 . . . . 115 LEU CB . 16619 1 1392 . 1 1 115 115 LEU CD1 C 13 23.4320 0.5 . 2 . . . . 115 LEU CD1 . 16619 1 1393 . 1 1 115 115 LEU CD2 C 13 23.6640 0.5 . 2 . . . . 115 LEU CD2 . 16619 1 1394 . 1 1 115 115 LEU CG C 13 27.2650 0.5 . 1 . . . . 115 LEU CG . 16619 1 1395 . 1 1 115 115 LEU N N 15 122.9136 0.1 . 1 . . . . 115 LEU N . 16619 1 1396 . 1 1 116 116 GLY H H 1 8.4519 0.006 . 1 . . . . 116 GLY HN . 16619 1 1397 . 1 1 116 116 GLY HA2 H 1 3.9430 0.05 . 2 . . . . 116 GLY HA# . 16619 1 1398 . 1 1 116 116 GLY HA3 H 1 3.9430 0.05 . 2 . . . . 116 GLY HA# . 16619 1 1399 . 1 1 116 116 GLY C C 13 174.9250 0.04 . 1 . . . . 116 GLY C . 16619 1 1400 . 1 1 116 116 GLY CA C 13 46.0150 0.5 . 1 . . . . 116 GLY CA . 16619 1 1401 . 1 1 116 116 GLY N N 15 107.7177 0.1 . 1 . . . . 116 GLY N . 16619 1 1402 . 1 1 117 117 ASN H H 1 7.9621 0.006 . 1 . . . . 117 ASN HN . 16619 1 1403 . 1 1 117 117 ASN HA H 1 4.6650 0.05 . 1 . . . . 117 ASN HA . 16619 1 1404 . 1 1 117 117 ASN HB2 H 1 2.9010 0.05 . 2 . . . . 117 ASN HB# . 16619 1 1405 . 1 1 117 117 ASN HB3 H 1 2.9010 0.05 . 2 . . . . 117 ASN HB# . 16619 1 1406 . 1 1 117 117 ASN HD21 H 1 7.7828 0.05 . 2 . . . . 117 ASN HD21 . 16619 1 1407 . 1 1 117 117 ASN HD22 H 1 6.9628 0.05 . 2 . . . . 117 ASN HD22 . 16619 1 1408 . 1 1 117 117 ASN C C 13 176.5220 0.04 . 1 . . . . 117 ASN C . 16619 1 1409 . 1 1 117 117 ASN CA C 13 54.3560 0.5 . 1 . . . . 117 ASN CA . 16619 1 1410 . 1 1 117 117 ASN CB C 13 39.0360 0.5 . 1 . . . . 117 ASN CB . 16619 1 1411 . 1 1 117 117 ASN N N 15 118.9684 0.1 . 1 . . . . 117 ASN N . 16619 1 1412 . 1 1 117 117 ASN ND2 N 15 113.1930 0.1 . 1 . . . . 117 ASN ND2 . 16619 1 1413 . 1 1 118 118 ARG H H 1 8.4853 0.006 . 1 . . . . 118 ARG HN . 16619 1 1414 . 1 1 118 118 ARG HA H 1 4.0970 0.05 . 1 . . . . 118 ARG HA . 16619 1 1415 . 1 1 118 118 ARG HB2 H 1 1.9955 0.05 . 2 . . . . 118 ARG HB# . 16619 1 1416 . 1 1 118 118 ARG HB3 H 1 1.9955 0.05 . 2 . . . . 118 ARG HB# . 16619 1 1417 . 1 1 118 118 ARG HD2 H 1 3.2390 0.05 . 2 . . . . 118 ARG HD# . 16619 1 1418 . 1 1 118 118 ARG HD3 H 1 3.2390 0.05 . 2 . . . . 118 ARG HD# . 16619 1 1419 . 1 1 118 118 ARG HG2 H 1 1.8040 0.05 . 2 . . . . 118 ARG HG# . 16619 1 1420 . 1 1 118 118 ARG HG3 H 1 1.8040 0.05 . 2 . . . . 118 ARG HG# . 16619 1 1421 . 1 1 118 118 ARG C C 13 178.2920 0.04 . 1 . . . . 118 ARG C . 16619 1 1422 . 1 1 118 118 ARG CA C 13 58.2600 0.5 . 1 . . . . 118 ARG CA . 16619 1 1423 . 1 1 118 118 ARG CB C 13 29.3290 0.5 . 1 . . . . 118 ARG CB . 16619 1 1424 . 1 1 118 118 ARG CD C 13 42.8840 0.5 . 1 . . . . 118 ARG CD . 16619 1 1425 . 1 1 118 118 ARG CG C 13 27.5900 0.5 . 1 . . . . 118 ARG CG . 16619 1 1426 . 1 1 118 118 ARG N N 15 121.2481 0.1 . 1 . . . . 118 ARG N . 16619 1 1427 . 1 1 119 119 VAL H H 1 7.9811 0.006 . 1 . . . . 119 VAL HN . 16619 1 1428 . 1 1 119 119 VAL HA H 1 3.8090 0.05 . 1 . . . . 119 VAL HA . 16619 1 1429 . 1 1 119 119 VAL HB H 1 2.1673 0.05 . 1 . . . . 119 VAL HB . 16619 1 1430 . 1 1 119 119 VAL HG11 H 1 1.0740 0.05 . 2 . . . . 119 VAL HG1#|HG2# . 16619 1 1431 . 1 1 119 119 VAL HG12 H 1 1.0740 0.05 . 2 . . . . 119 VAL HG1#|HG2# . 16619 1 1432 . 1 1 119 119 VAL HG13 H 1 1.0740 0.05 . 2 . . . . 119 VAL HG1#|HG2# . 16619 1 1433 . 1 1 119 119 VAL HG21 H 1 0.9710 0.05 . 2 . . . . 119 VAL HG2#|HG1# . 16619 1 1434 . 1 1 119 119 VAL HG22 H 1 0.9710 0.05 . 2 . . . . 119 VAL HG2#|HG1# . 16619 1 1435 . 1 1 119 119 VAL HG23 H 1 0.9710 0.05 . 2 . . . . 119 VAL HG2#|HG1# . 16619 1 1436 . 1 1 119 119 VAL C C 13 178.1290 0.04 . 1 . . . . 119 VAL C . 16619 1 1437 . 1 1 119 119 VAL CA C 13 66.1290 0.5 . 1 . . . . 119 VAL CA . 16619 1 1438 . 1 1 119 119 VAL CB C 13 31.5220 0.5 . 1 . . . . 119 VAL CB . 16619 1 1439 . 1 1 119 119 VAL CG1 C 13 22.2110 0.5 . 2 . . . . 119 VAL CG1|CG2 . 16619 1 1440 . 1 1 119 119 VAL CG2 C 13 21.0420 0.5 . 2 . . . . 119 VAL CG2|CG1 . 16619 1 1441 . 1 1 119 119 VAL N N 15 120.0757 0.1 . 1 . . . . 119 VAL N . 16619 1 1442 . 1 1 120 120 ILE H H 1 7.4305 0.006 . 1 . . . . 120 ILE HN . 16619 1 1443 . 1 1 120 120 ILE HA H 1 3.7980 0.05 . 1 . . . . 120 ILE HA . 16619 1 1444 . 1 1 120 120 ILE HB H 1 2.0720 0.05 . 1 . . . . 120 ILE HB . 16619 1 1445 . 1 1 120 120 ILE HD11 H 1 0.8670 0.05 . 1 . . . . 120 ILE HD1# . 16619 1 1446 . 1 1 120 120 ILE HD12 H 1 0.8670 0.05 . 1 . . . . 120 ILE HD1# . 16619 1 1447 . 1 1 120 120 ILE HD13 H 1 0.8670 0.05 . 1 . . . . 120 ILE HD1# . 16619 1 1448 . 1 1 120 120 ILE HG12 H 1 1.5960 0.05 . 2 . . . . 120 ILE HG11|HG12 . 16619 1 1449 . 1 1 120 120 ILE HG13 H 1 1.2880 0.05 . 2 . . . . 120 ILE HG12|HG11 . 16619 1 1450 . 1 1 120 120 ILE HG21 H 1 0.9250 0.05 . 1 . . . . 120 ILE HG2# . 16619 1 1451 . 1 1 120 120 ILE HG22 H 1 0.9250 0.05 . 1 . . . . 120 ILE HG2# . 16619 1 1452 . 1 1 120 120 ILE HG23 H 1 0.9250 0.05 . 1 . . . . 120 ILE HG2# . 16619 1 1453 . 1 1 120 120 ILE C C 13 177.6780 0.04 . 1 . . . . 120 ILE C . 16619 1 1454 . 1 1 120 120 ILE CA C 13 63.7340 0.5 . 1 . . . . 120 ILE CA . 16619 1 1455 . 1 1 120 120 ILE CB C 13 37.3290 0.5 . 1 . . . . 120 ILE CB . 16619 1 1456 . 1 1 120 120 ILE CD1 C 13 12.1200 0.5 . 1 . . . . 120 ILE CD1 . 16619 1 1457 . 1 1 120 120 ILE CG1 C 13 28.6610 0.5 . 1 . . . . 120 ILE CG1 . 16619 1 1458 . 1 1 120 120 ILE CG2 C 13 17.9990 0.5 . 1 . . . . 120 ILE CG2 . 16619 1 1459 . 1 1 120 120 ILE N N 15 121.0524 0.1 . 1 . . . . 120 ILE N . 16619 1 1460 . 1 1 121 121 VAL H H 1 7.9917 0.006 . 1 . . . . 121 VAL HN . 16619 1 1461 . 1 1 121 121 VAL HA H 1 3.6080 0.05 . 1 . . . . 121 VAL HA . 16619 1 1462 . 1 1 121 121 VAL HB H 1 2.1800 0.05 . 1 . . . . 121 VAL HB . 16619 1 1463 . 1 1 121 121 VAL HG11 H 1 1.0820 0.05 . 2 . . . . 121 VAL HG1#|HG2# . 16619 1 1464 . 1 1 121 121 VAL HG12 H 1 1.0820 0.05 . 2 . . . . 121 VAL HG1#|HG2# . 16619 1 1465 . 1 1 121 121 VAL HG13 H 1 1.0820 0.05 . 2 . . . . 121 VAL HG1#|HG2# . 16619 1 1466 . 1 1 121 121 VAL HG21 H 1 1.0820 0.05 . 2 . . . . 121 VAL HG2#|HG1# . 16619 1 1467 . 1 1 121 121 VAL HG22 H 1 1.0820 0.05 . 2 . . . . 121 VAL HG2#|HG1# . 16619 1 1468 . 1 1 121 121 VAL HG23 H 1 1.0820 0.05 . 2 . . . . 121 VAL HG2#|HG1# . 16619 1 1469 . 1 1 121 121 VAL C C 13 178.3300 0.04 . 1 . . . . 121 VAL C . 16619 1 1470 . 1 1 121 121 VAL CA C 13 66.9690 0.5 . 1 . . . . 121 VAL CA . 16619 1 1471 . 1 1 121 121 VAL CB C 13 32.0020 0.5 . 1 . . . . 121 VAL CB . 16619 1 1472 . 1 1 121 121 VAL CG1 C 13 22.5370 0.5 . 2 . . . . 121 VAL CG1|CG2 . 16619 1 1473 . 1 1 121 121 VAL CG2 C 13 22.5370 0.5 . 2 . . . . 121 VAL CG2|CG1 . 16619 1 1474 . 1 1 121 121 VAL N N 15 120.4816 0.1 . 1 . . . . 121 VAL N . 16619 1 1475 . 1 1 122 122 THR H H 1 8.2956 0.006 . 1 . . . . 122 THR HN . 16619 1 1476 . 1 1 122 122 THR HA H 1 3.8490 0.05 . 1 . . . . 122 THR HA . 16619 1 1477 . 1 1 122 122 THR HB H 1 4.3210 0.05 . 1 . . . . 122 THR HB . 16619 1 1478 . 1 1 122 122 THR HG21 H 1 1.3820 0.05 . 1 . . . . 122 THR HG2# . 16619 1 1479 . 1 1 122 122 THR HG22 H 1 1.3820 0.05 . 1 . . . . 122 THR HG2# . 16619 1 1480 . 1 1 122 122 THR HG23 H 1 1.3820 0.05 . 1 . . . . 122 THR HG2# . 16619 1 1481 . 1 1 122 122 THR C C 13 176.1980 0.04 . 1 . . . . 122 THR C . 16619 1 1482 . 1 1 122 122 THR CA C 13 67.8190 0.5 . 1 . . . . 122 THR CA . 16619 1 1483 . 1 1 122 122 THR CB C 13 68.7570 0.5 . 1 . . . . 122 THR CB . 16619 1 1484 . 1 1 122 122 THR CG2 C 13 22.0810 0.5 . 1 . . . . 122 THR CG2 . 16619 1 1485 . 1 1 122 122 THR N N 15 115.8489 0.1 . 1 . . . . 122 THR N . 16619 1 1486 . 1 1 123 123 ARG H H 1 7.9378 0.006 . 1 . . . . 123 ARG HN . 16619 1 1487 . 1 1 123 123 ARG HA H 1 4.0920 0.05 . 1 . . . . 123 ARG HA . 16619 1 1488 . 1 1 123 123 ARG HB2 H 1 2.0450 0.05 . 2 . . . . 123 ARG HB# . 16619 1 1489 . 1 1 123 123 ARG HB3 H 1 2.0450 0.05 . 2 . . . . 123 ARG HB# . 16619 1 1490 . 1 1 123 123 ARG HG2 H 1 1.5600 0.05 . 2 . . . . 123 ARG HG# . 16619 1 1491 . 1 1 123 123 ARG HG3 H 1 1.5600 0.05 . 2 . . . . 123 ARG HG# . 16619 1 1492 . 1 1 123 123 ARG C C 13 178.7130 0.04 . 1 . . . . 123 ARG C . 16619 1 1493 . 1 1 123 123 ARG CA C 13 59.9050 0.5 . 1 . . . . 123 ARG CA . 16619 1 1494 . 1 1 123 123 ARG CB C 13 29.7590 0.5 . 1 . . . . 123 ARG CB . 16619 1 1495 . 1 1 123 123 ARG CD C 13 43.8210 0.5 . 1 . . . . 123 ARG CD . 16619 1 1496 . 1 1 123 123 ARG CG C 13 27.4630 0.5 . 1 . . . . 123 ARG CG . 16619 1 1497 . 1 1 123 123 ARG N N 15 122.9288 0.1 . 1 . . . . 123 ARG N . 16619 1 1498 . 1 1 124 124 ASP H H 1 8.5162 0.006 . 1 . . . . 124 ASP HN . 16619 1 1499 . 1 1 124 124 ASP HA H 1 4.5230 0.05 . 1 . . . . 124 ASP HA . 16619 1 1500 . 1 1 124 124 ASP HB2 H 1 2.8550 0.05 . 2 . . . . 124 ASP HB1|HB2 . 16619 1 1501 . 1 1 124 124 ASP HB3 H 1 2.3740 0.05 . 2 . . . . 124 ASP HB2|HB1 . 16619 1 1502 . 1 1 124 124 ASP C C 13 178.7660 0.04 . 1 . . . . 124 ASP C . 16619 1 1503 . 1 1 124 124 ASP CA C 13 57.9150 0.5 . 1 . . . . 124 ASP CA . 16619 1 1504 . 1 1 124 124 ASP CB C 13 39.8390 0.5 . 1 . . . . 124 ASP CB . 16619 1 1505 . 1 1 124 124 ASP N N 15 120.5339 0.1 . 1 . . . . 124 ASP N . 16619 1 1506 . 1 1 125 125 CYS H H 1 8.4906 0.006 . 1 . . . . 125 CYS HN . 16619 1 1507 . 1 1 125 125 CYS HA H 1 3.6570 0.05 . 1 . . . . 125 CYS HA . 16619 1 1508 . 1 1 125 125 CYS HB2 H 1 2.9610 0.05 . 2 . . . . 125 CYS HB# . 16619 1 1509 . 1 1 125 125 CYS HB3 H 1 2.9610 0.05 . 2 . . . . 125 CYS HB# . 16619 1 1510 . 1 1 125 125 CYS C C 13 176.5190 0.04 . 1 . . . . 125 CYS C . 16619 1 1511 . 1 1 125 125 CYS CA C 13 64.7430 0.5 . 1 . . . . 125 CYS CA . 16619 1 1512 . 1 1 125 125 CYS CB C 13 27.2680 0.5 . 1 . . . . 125 CYS CB . 16619 1 1513 . 1 1 125 125 CYS N N 15 117.9677 0.1 . 1 . . . . 125 CYS N . 16619 1 1514 . 1 1 126 126 CYS H H 1 7.8475 0.006 . 1 . . . . 126 CYS HN . 16619 1 1515 . 1 1 126 126 CYS HA H 1 4.1150 0.05 . 1 . . . . 126 CYS HA . 16619 1 1516 . 1 1 126 126 CYS HB2 H 1 3.2201 0.05 . 2 . . . . 126 CYS HB1 . 16619 1 1517 . 1 1 126 126 CYS HB3 H 1 3.0137 0.05 . 2 . . . . 126 CYS HB2 . 16619 1 1518 . 1 1 126 126 CYS C C 13 177.5650 0.04 . 1 . . . . 126 CYS C . 16619 1 1519 . 1 1 126 126 CYS CA C 13 63.5680 0.5 . 1 . . . . 126 CYS CA . 16619 1 1520 . 1 1 126 126 CYS CB C 13 26.6880 0.5 . 1 . . . . 126 CYS CB . 16619 1 1521 . 1 1 126 126 CYS N N 15 117.0007 0.1 . 1 . . . . 126 CYS N . 16619 1 1522 . 1 1 127 127 LEU H H 1 8.3829 0.006 . 1 . . . . 127 LEU NH . 16619 1 1523 . 1 1 127 127 LEU HA H 1 4.1550 0.05 . 1 . . . . 127 LEU HA . 16619 1 1524 . 1 1 127 127 LEU HB2 H 1 1.5620 0.05 . 2 . . . . 127 LEU HB1|HB2 . 16619 1 1525 . 1 1 127 127 LEU HB3 H 1 2.1110 0.05 . 2 . . . . 127 LEU HB2|HB1 . 16619 1 1526 . 1 1 127 127 LEU HD11 H 1 0.9550 0.05 . 2 . . . . 127 LEU HD1#|HD2# . 16619 1 1527 . 1 1 127 127 LEU HD12 H 1 0.9550 0.05 . 2 . . . . 127 LEU HD1#|HD2# . 16619 1 1528 . 1 1 127 127 LEU HD13 H 1 0.9550 0.05 . 2 . . . . 127 LEU HD1#|HD2# . 16619 1 1529 . 1 1 127 127 LEU HD21 H 1 0.9550 0.05 . 2 . . . . 127 LEU HD2#|HD1# . 16619 1 1530 . 1 1 127 127 LEU HD22 H 1 0.9550 0.05 . 2 . . . . 127 LEU HD2#|HD1# . 16619 1 1531 . 1 1 127 127 LEU HD23 H 1 0.9550 0.05 . 2 . . . . 127 LEU HD2#|HD1# . 16619 1 1532 . 1 1 127 127 LEU C C 13 180.5580 0.04 . 1 . . . . 127 LEU C . 16619 1 1533 . 1 1 127 127 LEU CA C 13 58.3730 0.5 . 1 . . . . 127 LEU CA . 16619 1 1534 . 1 1 127 127 LEU CB C 13 42.7450 0.5 . 1 . . . . 127 LEU CB . 16619 1 1535 . 1 1 127 127 LEU CD1 C 13 22.9150 0.5 . 2 . . . . 127 LEU CD1 . 16619 1 1536 . 1 1 127 127 LEU CD2 C 13 22.9150 0.5 . 2 . . . . 127 LEU CD2 . 16619 1 1537 . 1 1 127 127 LEU CG C 13 26.9220 0.5 . 1 . . . . 127 LEU CG . 16619 1 1538 . 1 1 127 127 LEU N N 15 119.3972 0.1 . 1 . . . . 127 LEU N . 16619 1 1539 . 1 1 128 128 ILE H H 1 8.5901 0.006 . 1 . . . . 128 ILE HN . 16619 1 1540 . 1 1 128 128 ILE HA H 1 3.7500 0.05 . 1 . . . . 128 ILE HA . 16619 1 1541 . 1 1 128 128 ILE HB H 1 2.0198 0.05 . 1 . . . . 128 ILE HB . 16619 1 1542 . 1 1 128 128 ILE HD11 H 1 0.7200 0.05 . 1 . . . . 128 ILE HD1# . 16619 1 1543 . 1 1 128 128 ILE HD12 H 1 0.7200 0.05 . 1 . . . . 128 ILE HD1# . 16619 1 1544 . 1 1 128 128 ILE HD13 H 1 0.7200 0.05 . 1 . . . . 128 ILE HD1# . 16619 1 1545 . 1 1 128 128 ILE HG21 H 1 0.9300 0.05 . 1 . . . . 128 ILE HG2# . 16619 1 1546 . 1 1 128 128 ILE HG22 H 1 0.9300 0.05 . 1 . . . . 128 ILE HG2# . 16619 1 1547 . 1 1 128 128 ILE HG23 H 1 0.9300 0.05 . 1 . . . . 128 ILE HG2# . 16619 1 1548 . 1 1 128 128 ILE C C 13 177.8050 0.04 . 1 . . . . 128 ILE C . 16619 1 1549 . 1 1 128 128 ILE CA C 13 66.1780 0.5 . 1 . . . . 128 ILE CA . 16619 1 1550 . 1 1 128 128 ILE CB C 13 37.6850 0.5 . 1 . . . . 128 ILE CB . 16619 1 1551 . 1 1 128 128 ILE CD1 C 13 13.8400 0.5 . 1 . . . . 128 ILE CD1 . 16619 1 1552 . 1 1 128 128 ILE CG2 C 13 17.6830 0.5 . 1 . . . . 128 ILE CG2 . 16619 1 1553 . 1 1 128 128 ILE N N 15 120.9399 0.1 . 1 . . . . 128 ILE N . 16619 1 1554 . 1 1 129 129 VAL H H 1 8.6416 0.006 . 1 . . . . 129 VAL HN . 16619 1 1555 . 1 1 129 129 VAL HA H 1 4.1404 0.05 . 1 . . . . 129 VAL HA . 16619 1 1556 . 1 1 129 129 VAL HG11 H 1 1.0210 0.05 . 2 . . . . 129 VAL HG1#|HG2# . 16619 1 1557 . 1 1 129 129 VAL HG12 H 1 1.0210 0.05 . 2 . . . . 129 VAL HG1#|HG2# . 16619 1 1558 . 1 1 129 129 VAL HG13 H 1 1.0210 0.05 . 2 . . . . 129 VAL HG1#|HG2# . 16619 1 1559 . 1 1 129 129 VAL HG21 H 1 1.2760 0.05 . 2 . . . . 129 VAL HG2#|HG1# . 16619 1 1560 . 1 1 129 129 VAL HG22 H 1 1.2760 0.05 . 2 . . . . 129 VAL HG2#|HG1# . 16619 1 1561 . 1 1 129 129 VAL HG23 H 1 1.2760 0.05 . 2 . . . . 129 VAL HG2#|HG1# . 16619 1 1562 . 1 1 129 129 VAL C C 13 177.3690 0.04 . 1 . . . . 129 VAL C . 16619 1 1563 . 1 1 129 129 VAL CA C 13 68.3840 0.5 . 1 . . . . 129 VAL CA . 16619 1 1564 . 1 1 129 129 VAL CB C 13 31.5930 0.5 . 1 . . . . 129 VAL CB . 16619 1 1565 . 1 1 129 129 VAL CG1 C 13 23.3300 0.5 . 2 . . . . 129 VAL CG1|CG2 . 16619 1 1566 . 1 1 129 129 VAL CG2 C 13 22.9080 0.5 . 2 . . . . 129 VAL CG2|CG1 . 16619 1 1567 . 1 1 129 129 VAL N N 15 120.9903 0.1 . 1 . . . . 129 VAL N . 16619 1 1568 . 1 1 130 130 ASN H H 1 8.1668 0.006 . 1 . . . . 130 ASN HN . 16619 1 1569 . 1 1 130 130 ASN HA H 1 4.4650 0.05 . 1 . . . . 130 ASN HA . 16619 1 1570 . 1 1 130 130 ASN HB2 H 1 2.9500 0.05 . 2 . . . . 130 ASN HB# . 16619 1 1571 . 1 1 130 130 ASN HB3 H 1 2.9500 0.05 . 2 . . . . 130 ASN HB# . 16619 1 1572 . 1 1 130 130 ASN HD21 H 1 7.6516 0.05 . 2 . . . . 130 ASN HD21 . 16619 1 1573 . 1 1 130 130 ASN HD22 H 1 6.9668 0.05 . 2 . . . . 130 ASN HD22 . 16619 1 1574 . 1 1 130 130 ASN C C 13 177.4250 0.04 . 1 . . . . 130 ASN C . 16619 1 1575 . 1 1 130 130 ASN CA C 13 56.9050 0.5 . 1 . . . . 130 ASN CA . 16619 1 1576 . 1 1 130 130 ASN CB C 13 38.4340 0.5 . 1 . . . . 130 ASN CB . 16619 1 1577 . 1 1 130 130 ASN N N 15 116.0249 0.1 . 1 . . . . 130 ASN N . 16619 1 1578 . 1 1 130 130 ASN ND2 N 15 112.3320 0.1 . 1 . . . . 130 ASN ND2 . 16619 1 1579 . 1 1 131 131 PHE H H 1 8.3133 0.006 . 1 . . . . 131 PHE HN . 16619 1 1580 . 1 1 131 131 PHE HA H 1 4.3420 0.05 . 1 . . . . 131 PHE HA . 16619 1 1581 . 1 1 131 131 PHE HB2 H 1 3.0140 0.05 . 2 . . . . 131 PHE HB1|HB2 . 16619 1 1582 . 1 1 131 131 PHE HB3 H 1 3.4360 0.05 . 2 . . . . 131 PHE HB2|HB1 . 16619 1 1583 . 1 1 131 131 PHE HD1 H 1 6.9700 0.05 . 3 . . . . 131 PHE HD1 . 16619 1 1584 . 1 1 131 131 PHE HD2 H 1 6.9700 0.05 . 3 . . . . 131 PHE HD2 . 16619 1 1585 . 1 1 131 131 PHE HE1 H 1 7.1900 0.05 . 3 . . . . 131 PHE HE1 . 16619 1 1586 . 1 1 131 131 PHE HE2 H 1 7.1900 0.05 . 3 . . . . 131 PHE HE2 . 16619 1 1587 . 1 1 131 131 PHE HZ H 1 7.1700 0.05 . 1 . . . . 131 PHE HZ . 16619 1 1588 . 1 1 131 131 PHE C C 13 177.3250 0.04 . 1 . . . . 131 PHE C . 16619 1 1589 . 1 1 131 131 PHE CA C 13 61.8000 0.5 . 1 . . . . 131 PHE CA . 16619 1 1590 . 1 1 131 131 PHE CB C 13 39.8750 0.5 . 1 . . . . 131 PHE CB . 16619 1 1591 . 1 1 131 131 PHE CD1 C 13 132.4370 0.5 . 3 . . . . 131 PHE CD1 . 16619 1 1592 . 1 1 131 131 PHE CD2 C 13 132.4370 0.5 . 3 . . . . 131 PHE CD2 . 16619 1 1593 . 1 1 131 131 PHE CE1 C 13 131.9270 0.5 . 3 . . . . 131 PHE CE1 . 16619 1 1594 . 1 1 131 131 PHE CE2 C 13 131.9270 0.5 . 3 . . . . 131 PHE CE2 . 16619 1 1595 . 1 1 131 131 PHE CZ C 13 128.8370 0.5 . 1 . . . . 131 PHE CZ . 16619 1 1596 . 1 1 131 131 PHE N N 15 120.0394 0.1 . 1 . . . . 131 PHE N . 16619 1 1597 . 1 1 132 132 LEU H H 1 8.5991 0.006 . 1 . . . . 132 LEU NH . 16619 1 1598 . 1 1 132 132 LEU HA H 1 3.6270 0.05 . 1 . . . . 132 LEU HA . 16619 1 1599 . 1 1 132 132 LEU HB2 H 1 2.0990 0.05 . 2 . . . . 132 LEU HB1|HB2 . 16619 1 1600 . 1 1 132 132 LEU HB3 H 1 1.1690 0.05 . 2 . . . . 132 LEU HB2|HB1 . 16619 1 1601 . 1 1 132 132 LEU HD11 H 1 0.8220 0.05 . 2 . . . . 132 LEU HD1#|HD2# . 16619 1 1602 . 1 1 132 132 LEU HD12 H 1 0.8220 0.05 . 2 . . . . 132 LEU HD1#|HD2# . 16619 1 1603 . 1 1 132 132 LEU HD13 H 1 0.8220 0.05 . 2 . . . . 132 LEU HD1#|HD2# . 16619 1 1604 . 1 1 132 132 LEU HD21 H 1 0.8220 0.05 . 2 . . . . 132 LEU HD2#|HD1# . 16619 1 1605 . 1 1 132 132 LEU HD22 H 1 0.8220 0.05 . 2 . . . . 132 LEU HD2#|HD1# . 16619 1 1606 . 1 1 132 132 LEU HD23 H 1 0.8220 0.05 . 2 . . . . 132 LEU HD2#|HD1# . 16619 1 1607 . 1 1 132 132 LEU C C 13 177.5560 0.04 . 1 . . . . 132 LEU C . 16619 1 1608 . 1 1 132 132 LEU CA C 13 57.7530 0.5 . 1 . . . . 132 LEU CA . 16619 1 1609 . 1 1 132 132 LEU CB C 13 43.0430 0.5 . 1 . . . . 132 LEU CB . 16619 1 1610 . 1 1 132 132 LEU CD1 C 13 22.5330 0.5 . 2 . . . . 132 LEU CD1 . 16619 1 1611 . 1 1 132 132 LEU CD2 C 13 22.5330 0.5 . 2 . . . . 132 LEU CD2 . 16619 1 1612 . 1 1 132 132 LEU N N 15 119.1443 0.1 . 1 . . . . 132 LEU N . 16619 1 1613 . 1 1 133 133 TYR H H 1 8.9289 0.006 . 1 . . . . 133 TYR HN . 16619 1 1614 . 1 1 133 133 TYR HA H 1 3.7680 0.05 . 1 . . . . 133 TYR HA . 16619 1 1615 . 1 1 133 133 TYR HB2 H 1 2.9300 0.05 . 2 . . . . 133 TYR HB# . 16619 1 1616 . 1 1 133 133 TYR HB3 H 1 2.9300 0.05 . 2 . . . . 133 TYR HB# . 16619 1 1617 . 1 1 133 133 TYR HD1 H 1 6.8900 0.05 . 3 . . . . 133 TYR HD1 . 16619 1 1618 . 1 1 133 133 TYR HD2 H 1 6.8900 0.05 . 3 . . . . 133 TYR HD2 . 16619 1 1619 . 1 1 133 133 TYR HE1 H 1 7.1500 0.05 . 3 . . . . 133 TYR HE1 . 16619 1 1620 . 1 1 133 133 TYR HE2 H 1 7.1500 0.05 . 3 . . . . 133 TYR HE2 . 16619 1 1621 . 1 1 133 133 TYR C C 13 175.7060 0.04 . 1 . . . . 133 TYR C . 16619 1 1622 . 1 1 133 133 TYR CA C 13 62.2350 0.5 . 1 . . . . 133 TYR CA . 16619 1 1623 . 1 1 133 133 TYR CB C 13 38.9730 0.5 . 1 . . . . 133 TYR CB . 16619 1 1624 . 1 1 133 133 TYR CD1 C 13 132.5260 0.5 . 3 . . . . 133 TYR CD1 . 16619 1 1625 . 1 1 133 133 TYR CD2 C 13 132.5260 0.5 . 3 . . . . 133 TYR CD2 . 16619 1 1626 . 1 1 133 133 TYR CE1 C 13 118.6770 0.5 . 3 . . . . 133 TYR CE1 . 16619 1 1627 . 1 1 133 133 TYR CE2 C 13 118.6770 0.5 . 3 . . . . 133 TYR CE2 . 16619 1 1628 . 1 1 133 133 TYR N N 15 120.4618 0.1 . 1 . . . . 133 TYR N . 16619 1 1629 . 1 1 134 134 ASN H H 1 8.1551 0.006 . 1 . . . . 134 ASN HN . 16619 1 1630 . 1 1 134 134 ASN HA H 1 4.0120 0.05 . 1 . . . . 134 ASN HA . 16619 1 1631 . 1 1 134 134 ASN HB2 H 1 2.8590 0.05 . 2 . . . . 134 ASN HB1|HB2 . 16619 1 1632 . 1 1 134 134 ASN HB3 H 1 2.6180 0.05 . 2 . . . . 134 ASN HB2|HB1 . 16619 1 1633 . 1 1 134 134 ASN HD21 H 1 6.9438 0.05 . 2 . . . . 134 ASN HD21 . 16619 1 1634 . 1 1 134 134 ASN HD22 H 1 7.4814 0.05 . 2 . . . . 134 ASN HD22 . 16619 1 1635 . 1 1 134 134 ASN C C 13 177.9230 0.04 . 1 . . . . 134 ASN C . 16619 1 1636 . 1 1 134 134 ASN CA C 13 56.1110 0.5 . 1 . . . . 134 ASN CA . 16619 1 1637 . 1 1 134 134 ASN CB C 13 38.2430 0.5 . 1 . . . . 134 ASN CB . 16619 1 1638 . 1 1 134 134 ASN N N 15 116.5166 0.1 . 1 . . . . 134 ASN N . 16619 1 1639 . 1 1 134 134 ASN ND2 N 15 112.9940 0.1 . 1 . . . . 134 ASN ND2 . 16619 1 1640 . 1 1 135 135 LEU H H 1 7.9786 0.006 . 1 . . . . 135 LEU NH . 16619 1 1641 . 1 1 135 135 LEU HA H 1 3.9380 0.05 . 1 . . . . 135 LEU HA . 16619 1 1642 . 1 1 135 135 LEU HB2 H 1 0.8640 0.05 . 2 . . . . 135 LEU HB# . 16619 1 1643 . 1 1 135 135 LEU HB3 H 1 0.8640 0.05 . 2 . . . . 135 LEU HB# . 16619 1 1644 . 1 1 135 135 LEU HD11 H 1 0.9100 0.05 . 2 . . . . 135 LEU HD1#|HD2# . 16619 1 1645 . 1 1 135 135 LEU HD12 H 1 0.9100 0.05 . 2 . . . . 135 LEU HD1#|HD2# . 16619 1 1646 . 1 1 135 135 LEU HD13 H 1 0.9100 0.05 . 2 . . . . 135 LEU HD1#|HD2# . 16619 1 1647 . 1 1 135 135 LEU HD21 H 1 0.9100 0.05 . 2 . . . . 135 LEU HD2#|HD1# . 16619 1 1648 . 1 1 135 135 LEU HD22 H 1 0.9100 0.05 . 2 . . . . 135 LEU HD2#|HD1# . 16619 1 1649 . 1 1 135 135 LEU HD23 H 1 0.9100 0.05 . 2 . . . . 135 LEU HD2#|HD1# . 16619 1 1650 . 1 1 135 135 LEU C C 13 179.3660 0.04 . 1 . . . . 135 LEU C . 16619 1 1651 . 1 1 135 135 LEU CA C 13 57.8650 0.5 . 1 . . . . 135 LEU CA . 16619 1 1652 . 1 1 135 135 LEU CB C 13 42.4950 0.5 . 1 . . . . 135 LEU CB . 16619 1 1653 . 1 1 135 135 LEU CD1 C 13 23.7000 0.5 . 2 . . . . 135 LEU CD1 . 16619 1 1654 . 1 1 135 135 LEU CD2 C 13 23.7010 0.5 . 2 . . . . 135 LEU CD2 . 16619 1 1655 . 1 1 135 135 LEU CG C 13 27.3270 0.5 . 1 . . . . 135 LEU CG . 16619 1 1656 . 1 1 135 135 LEU N N 15 121.3188 0.1 . 1 . . . . 135 LEU N . 16619 1 1657 . 1 1 136 136 LEU H H 1 7.8515 0.006 . 1 . . . . 136 LEU NH . 16619 1 1658 . 1 1 136 136 LEU HA H 1 3.8760 0.05 . 1 . . . . 136 LEU HA . 16619 1 1659 . 1 1 136 136 LEU HB2 H 1 1.3370 0.05 . 2 . . . . 136 LEU HB# . 16619 1 1660 . 1 1 136 136 LEU HB3 H 1 1.3370 0.05 . 2 . . . . 136 LEU HB# . 16619 1 1661 . 1 1 136 136 LEU HD11 H 1 0.9040 0.05 . 2 . . . . 136 LEU HD1#|HD2# . 16619 1 1662 . 1 1 136 136 LEU HD12 H 1 0.9040 0.05 . 2 . . . . 136 LEU HD1#|HD2# . 16619 1 1663 . 1 1 136 136 LEU HD13 H 1 0.9040 0.05 . 2 . . . . 136 LEU HD1#|HD2# . 16619 1 1664 . 1 1 136 136 LEU HD21 H 1 0.5990 0.05 . 2 . . . . 136 LEU HD2#|HD1# . 16619 1 1665 . 1 1 136 136 LEU HD22 H 1 0.5990 0.05 . 2 . . . . 136 LEU HD2#|HD1# . 16619 1 1666 . 1 1 136 136 LEU HD23 H 1 0.5990 0.05 . 2 . . . . 136 LEU HD2#|HD1# . 16619 1 1667 . 1 1 136 136 LEU HG H 1 1.7900 0.05 . 1 . . . . 136 LEU HG . 16619 1 1668 . 1 1 136 136 LEU C C 13 175.1650 0.04 . 1 . . . . 136 LEU C . 16619 1 1669 . 1 1 136 136 LEU CA C 13 57.4130 0.5 . 1 . . . . 136 LEU CA . 16619 1 1670 . 1 1 136 136 LEU CB C 13 42.2040 0.5 . 1 . . . . 136 LEU CB . 16619 1 1671 . 1 1 136 136 LEU CD1 C 13 25.1930 0.5 . 2 . . . . 136 LEU CD1 . 16619 1 1672 . 1 1 136 136 LEU CD2 C 13 22.6390 0.5 . 2 . . . . 136 LEU CD2 . 16619 1 1673 . 1 1 136 136 LEU CG C 13 27.5120 0.5 . 1 . . . . 136 LEU CG . 16619 1 1674 . 1 1 136 136 LEU N N 15 117.4403 0.1 . 1 . . . . 136 LEU N . 16619 1 1675 . 1 1 137 137 MET H H 1 7.5046 0.006 . 1 . . . . 137 MET HN . 16619 1 1676 . 1 1 137 137 MET HA H 1 4.5300 0.05 . 1 . . . . 137 MET HA . 16619 1 1677 . 1 1 137 137 MET HB2 H 1 1.6841 0.05 . 2 . . . . 137 MET HB1|HB2 . 16619 1 1678 . 1 1 137 137 MET HB3 H 1 1.8635 0.05 . 2 . . . . 137 MET HB2|HB1 . 16619 1 1679 . 1 1 137 137 MET HE1 H 1 2.2500 0.05 . 1 . . . . 137 MET HE# . 16619 1 1680 . 1 1 137 137 MET HE2 H 1 2.2500 0.05 . 1 . . . . 137 MET HE# . 16619 1 1681 . 1 1 137 137 MET HE3 H 1 2.2500 0.05 . 1 . . . . 137 MET HE# . 16619 1 1682 . 1 1 137 137 MET HG2 H 1 2.6300 0.05 . 2 . . . . 137 MET HG# . 16619 1 1683 . 1 1 137 137 MET HG3 H 1 2.6300 0.05 . 2 . . . . 137 MET HG# . 16619 1 1684 . 1 1 137 137 MET C C 13 178.0780 0.04 . 1 . . . . 137 MET C . 16619 1 1685 . 1 1 137 137 MET CA C 13 53.5000 0.5 . 1 . . . . 137 MET CA . 16619 1 1686 . 1 1 137 137 MET CB C 13 33.7820 0.5 . 1 . . . . 137 MET CB . 16619 1 1687 . 1 1 137 137 MET CE C 13 17.2830 0.5 . 1 . . . . 137 MET CE . 16619 1 1688 . 1 1 137 137 MET N N 15 108.0069 0.1 . 1 . . . . 137 MET N . 16619 1 1689 . 1 1 138 138 GLY H H 1 7.3776 0.006 . 1 . . . . 138 GLY HN . 16619 1 1690 . 1 1 138 138 GLY HA2 H 1 4.1010 0.05 . 2 . . . . 138 GLY HA# . 16619 1 1691 . 1 1 138 138 GLY HA3 H 1 4.1010 0.05 . 2 . . . . 138 GLY HA# . 16619 1 1692 . 1 1 138 138 GLY C C 13 173.6510 0.04 . 1 . . . . 138 GLY C . 16619 1 1693 . 1 1 138 138 GLY CA C 13 45.3210 0.5 . 1 . . . . 138 GLY CA . 16619 1 1694 . 1 1 138 138 GLY N N 15 109.2008 0.1 . 1 . . . . 138 GLY N . 16619 1 1695 . 1 1 139 139 ARG H H 1 8.2870 0.006 . 1 . . . . 139 ARG HN . 16619 1 1696 . 1 1 139 139 ARG HA H 1 3.8820 0.05 . 1 . . . . 139 ARG HA . 16619 1 1697 . 1 1 139 139 ARG HB2 H 1 1.8750 0.05 . 2 . . . . 139 ARG HB# . 16619 1 1698 . 1 1 139 139 ARG HB3 H 1 1.8750 0.05 . 2 . . . . 139 ARG HB# . 16619 1 1699 . 1 1 139 139 ARG HD2 H 1 3.2510 0.05 . 2 . . . . 139 ARG HD# . 16619 1 1700 . 1 1 139 139 ARG HD3 H 1 3.2510 0.05 . 2 . . . . 139 ARG HD# . 16619 1 1701 . 1 1 139 139 ARG HG2 H 1 1.7100 0.05 . 2 . . . . 139 ARG HG# . 16619 1 1702 . 1 1 139 139 ARG HG3 H 1 1.7100 0.05 . 2 . . . . 139 ARG HG# . 16619 1 1703 . 1 1 139 139 ARG C C 13 178.5840 0.04 . 1 . . . . 139 ARG C . 16619 1 1704 . 1 1 139 139 ARG CA C 13 60.7610 0.5 . 1 . . . . 139 ARG CA . 16619 1 1705 . 1 1 139 139 ARG CB C 13 30.3140 0.5 . 1 . . . . 139 ARG CB . 16619 1 1706 . 1 1 139 139 ARG CD C 13 43.4760 0.5 . 1 . . . . 139 ARG CD . 16619 1 1707 . 1 1 139 139 ARG CG C 13 27.1200 0.5 . 1 . . . . 139 ARG CG . 16619 1 1708 . 1 1 139 139 ARG N N 15 119.2796 0.1 . 1 . . . . 139 ARG N . 16619 1 1709 . 1 1 140 140 ARG H H 1 8.3497 0.006 . 1 . . . . 140 ARG HN . 16619 1 1710 . 1 1 140 140 ARG HA H 1 4.0510 0.05 . 1 . . . . 140 ARG HA . 16619 1 1711 . 1 1 140 140 ARG HB2 H 1 1.6820 0.05 . 2 . . . . 140 ARG HB# . 16619 1 1712 . 1 1 140 140 ARG HB3 H 1 1.6820 0.05 . 2 . . . . 140 ARG HB# . 16619 1 1713 . 1 1 140 140 ARG HD2 H 1 3.1910 0.05 . 2 . . . . 140 ARG HD# . 16619 1 1714 . 1 1 140 140 ARG HD3 H 1 3.1910 0.05 . 2 . . . . 140 ARG HD# . 16619 1 1715 . 1 1 140 140 ARG HG2 H 1 1.5240 0.05 . 2 . . . . 140 ARG HG# . 16619 1 1716 . 1 1 140 140 ARG HG3 H 1 1.5240 0.05 . 2 . . . . 140 ARG HG# . 16619 1 1717 . 1 1 140 140 ARG C C 13 178.9510 0.04 . 1 . . . . 140 ARG C . 16619 1 1718 . 1 1 140 140 ARG CA C 13 59.1380 0.5 . 1 . . . . 140 ARG CA . 16619 1 1719 . 1 1 140 140 ARG CB C 13 29.8470 0.5 . 1 . . . . 140 ARG CB . 16619 1 1720 . 1 1 140 140 ARG CD C 13 43.1980 0.5 . 1 . . . . 140 ARG CD . 16619 1 1721 . 1 1 140 140 ARG CG C 13 27.9070 0.5 . 1 . . . . 140 ARG CG . 16619 1 1722 . 1 1 140 140 ARG N N 15 117.9350 0.1 . 1 . . . . 140 ARG N . 16619 1 1723 . 1 1 141 141 HIS H H 1 7.9006 0.006 . 1 . . . . 141 HIS HN . 16619 1 1724 . 1 1 141 141 HIS HA H 1 4.8890 0.05 . 1 . . . . 141 HIS HA . 16619 1 1725 . 1 1 141 141 HIS HB2 H 1 3.3720 0.05 . 2 . . . . 141 HIS HB1|HB2 . 16619 1 1726 . 1 1 141 141 HIS HB3 H 1 3.1810 0.05 . 2 . . . . 141 HIS HB2|HB1 . 16619 1 1727 . 1 1 141 141 HIS HD2 H 1 7.3880 0.05 . 1 . . . . 141 HIS HD2 . 16619 1 1728 . 1 1 141 141 HIS C C 13 177.3160 0.04 . 1 . . . . 141 HIS C . 16619 1 1729 . 1 1 141 141 HIS CA C 13 58.3200 0.5 . 1 . . . . 141 HIS CA . 16619 1 1730 . 1 1 141 141 HIS CB C 13 30.5200 0.5 . 1 . . . . 141 HIS CB . 16619 1 1731 . 1 1 141 141 HIS CD2 C 13 119.9000 0.5 . 1 . . . . 141 HIS CD2 . 16619 1 1732 . 1 1 141 141 HIS N N 15 119.5923 0.1 . 1 . . . . 141 HIS N . 16619 1 1733 . 1 1 142 142 ARG H H 1 9.0543 0.006 . 1 . . . . 142 ARG HN . 16619 1 1734 . 1 1 142 142 ARG HA H 1 4.0480 0.05 . 1 . . . . 142 ARG HA . 16619 1 1735 . 1 1 142 142 ARG HB2 H 1 2.0130 0.05 . 2 . . . . 142 ARG HB1|HB2 . 16619 1 1736 . 1 1 142 142 ARG HB3 H 1 1.7280 0.05 . 2 . . . . 142 ARG HB2|HB1 . 16619 1 1737 . 1 1 142 142 ARG HD2 H 1 3.3700 0.05 . 2 . . . . 142 ARG HD# . 16619 1 1738 . 1 1 142 142 ARG HD3 H 1 3.3700 0.05 . 2 . . . . 142 ARG HD# . 16619 1 1739 . 1 1 142 142 ARG HG2 H 1 1.6200 0.05 . 2 . . . . 142 ARG HG# . 16619 1 1740 . 1 1 142 142 ARG HG3 H 1 1.6200 0.05 . 2 . . . . 142 ARG HG# . 16619 1 1741 . 1 1 142 142 ARG C C 13 178.6780 0.04 . 1 . . . . 142 ARG C . 16619 1 1742 . 1 1 142 142 ARG CA C 13 60.4950 0.5 . 1 . . . . 142 ARG CA . 16619 1 1743 . 1 1 142 142 ARG CB C 13 29.4570 0.5 . 1 . . . . 142 ARG CB . 16619 1 1744 . 1 1 142 142 ARG CD C 13 43.9540 0.5 . 1 . . . . 142 ARG CD . 16619 1 1745 . 1 1 142 142 ARG CG C 13 27.4930 0.5 . 1 . . . . 142 ARG CG . 16619 1 1746 . 1 1 142 142 ARG N N 15 123.3917 0.1 . 1 . . . . 142 ARG N . 16619 1 1747 . 1 1 143 143 ALA H H 1 7.5529 0.006 . 1 . . . . 143 ALA HN . 16619 1 1748 . 1 1 143 143 ALA HA H 1 4.1700 0.05 . 1 . . . . 143 ALA HA . 16619 1 1749 . 1 1 143 143 ALA HB1 H 1 1.4570 0.05 . 1 . . . . 143 ALA HB# . 16619 1 1750 . 1 1 143 143 ALA HB2 H 1 1.4570 0.05 . 1 . . . . 143 ALA HB# . 16619 1 1751 . 1 1 143 143 ALA HB3 H 1 1.4570 0.05 . 1 . . . . 143 ALA HB# . 16619 1 1752 . 1 1 143 143 ALA C C 13 180.8670 0.04 . 1 . . . . 143 ALA C . 16619 1 1753 . 1 1 143 143 ALA CA C 13 54.6390 0.5 . 1 . . . . 143 ALA CA . 16619 1 1754 . 1 1 143 143 ALA CB C 13 17.8340 0.5 . 1 . . . . 143 ALA CB . 16619 1 1755 . 1 1 143 143 ALA N N 15 119.5083 0.1 . 1 . . . . 143 ALA N . 16619 1 1756 . 1 1 144 144 ARG H H 1 7.5787 0.006 . 1 . . . . 144 ARG HN . 16619 1 1757 . 1 1 144 144 ARG HA H 1 3.9070 0.05 . 1 . . . . 144 ARG HA . 16619 1 1758 . 1 1 144 144 ARG HB2 H 1 1.7290 0.05 . 2 . . . . 144 ARG HB1|HB2 . 16619 1 1759 . 1 1 144 144 ARG HB3 H 1 1.9800 0.05 . 2 . . . . 144 ARG HB2|HB1 . 16619 1 1760 . 1 1 144 144 ARG C C 13 176.9300 0.04 . 1 . . . . 144 ARG C . 16619 1 1761 . 1 1 144 144 ARG CA C 13 57.3430 0.5 . 1 . . . . 144 ARG CA . 16619 1 1762 . 1 1 144 144 ARG CB C 13 29.2590 0.5 . 1 . . . . 144 ARG CB . 16619 1 1763 . 1 1 144 144 ARG CD C 13 43.2070 0.5 . 1 . . . . 144 ARG CD . 16619 1 1764 . 1 1 144 144 ARG N N 15 120.7277 0.1 . 1 . . . . 144 ARG N . 16619 1 1765 . 1 1 145 145 LEU H H 1 8.4296 0.006 . 1 . . . . 145 LEU NH . 16619 1 1766 . 1 1 145 145 LEU HA H 1 3.5680 0.05 . 1 . . . . 145 LEU HA . 16619 1 1767 . 1 1 145 145 LEU HB2 H 1 1.6900 0.05 . 2 . . . . 145 LEU HB# . 16619 1 1768 . 1 1 145 145 LEU HB3 H 1 1.6900 0.05 . 2 . . . . 145 LEU HB# . 16619 1 1769 . 1 1 145 145 LEU HD11 H 1 0.9700 0.05 . 2 . . . . 145 LEU HD1#|HD2# . 16619 1 1770 . 1 1 145 145 LEU HD12 H 1 0.9700 0.05 . 2 . . . . 145 LEU HD1#|HD2# . 16619 1 1771 . 1 1 145 145 LEU HD13 H 1 0.9700 0.05 . 2 . . . . 145 LEU HD1#|HD2# . 16619 1 1772 . 1 1 145 145 LEU HD21 H 1 0.7620 0.05 . 2 . . . . 145 LEU HD2#|HD1# . 16619 1 1773 . 1 1 145 145 LEU HD22 H 1 0.7620 0.05 . 2 . . . . 145 LEU HD2#|HD1# . 16619 1 1774 . 1 1 145 145 LEU HD23 H 1 0.7620 0.05 . 2 . . . . 145 LEU HD2#|HD1# . 16619 1 1775 . 1 1 145 145 LEU HG H 1 1.6530 0.05 . 1 . . . . 145 LEU HG . 16619 1 1776 . 1 1 145 145 LEU C C 13 179.8250 0.04 . 1 . . . . 145 LEU C . 16619 1 1777 . 1 1 145 145 LEU CA C 13 58.3060 0.5 . 1 . . . . 145 LEU CA . 16619 1 1778 . 1 1 145 145 LEU CB C 13 42.4860 0.5 . 1 . . . . 145 LEU CB . 16619 1 1779 . 1 1 145 145 LEU CD1 C 13 24.4160 0.5 . 2 . . . . 145 LEU CD1 . 16619 1 1780 . 1 1 145 145 LEU CD2 C 13 24.4160 0.5 . 2 . . . . 145 LEU CD2 . 16619 1 1781 . 1 1 145 145 LEU CG C 13 27.1410 0.5 . 1 . . . . 145 LEU CG . 16619 1 1782 . 1 1 145 145 LEU N N 15 120.4073 0.1 . 1 . . . . 145 LEU N . 16619 1 1783 . 1 1 146 146 GLU H H 1 8.3213 0.006 . 1 . . . . 146 GLU HN . 16619 1 1784 . 1 1 146 146 GLU HA H 1 3.8630 0.05 . 1 . . . . 146 GLU HA . 16619 1 1785 . 1 1 146 146 GLU HB2 H 1 2.0310 0.05 . 2 . . . . 146 GLU HB# . 16619 1 1786 . 1 1 146 146 GLU HB3 H 1 2.0310 0.05 . 2 . . . . 146 GLU HB# . 16619 1 1787 . 1 1 146 146 GLU HG2 H 1 2.4640 0.05 . 2 . . . . 146 GLU HG1|HG2 . 16619 1 1788 . 1 1 146 146 GLU HG3 H 1 2.1630 0.05 . 2 . . . . 146 GLU HG2|HG1 . 16619 1 1789 . 1 1 146 146 GLU C C 13 180.8040 0.04 . 1 . . . . 146 GLU C . 16619 1 1790 . 1 1 146 146 GLU CA C 13 60.2730 0.5 . 1 . . . . 146 GLU CA . 16619 1 1791 . 1 1 146 146 GLU CB C 13 29.3960 0.5 . 1 . . . . 146 GLU CB . 16619 1 1792 . 1 1 146 146 GLU CG C 13 37.4860 0.5 . 1 . . . . 146 GLU CG . 16619 1 1793 . 1 1 146 146 GLU N N 15 117.2606 0.1 . 1 . . . . 146 GLU N . 16619 1 1794 . 1 1 147 147 ALA H H 1 8.2527 0.006 . 1 . . . . 147 ALA HN . 16619 1 1795 . 1 1 147 147 ALA HA H 1 4.1230 0.05 . 1 . . . . 147 ALA HA . 16619 1 1796 . 1 1 147 147 ALA HB1 H 1 1.4740 0.05 . 1 . . . . 147 ALA HB# . 16619 1 1797 . 1 1 147 147 ALA HB2 H 1 1.4740 0.05 . 1 . . . . 147 ALA HB# . 16619 1 1798 . 1 1 147 147 ALA HB3 H 1 1.4740 0.05 . 1 . . . . 147 ALA HB# . 16619 1 1799 . 1 1 147 147 ALA C C 13 180.1160 0.04 . 1 . . . . 147 ALA C . 16619 1 1800 . 1 1 147 147 ALA CA C 13 55.0610 0.5 . 1 . . . . 147 ALA CA . 16619 1 1801 . 1 1 147 147 ALA CB C 13 18.0140 0.5 . 1 . . . . 147 ALA CB . 16619 1 1802 . 1 1 147 147 ALA N N 15 125.9313 0.1 . 1 . . . . 147 ALA N . 16619 1 1803 . 1 1 148 148 LEU H H 1 7.6440 0.006 . 1 . . . . 148 LEU NH . 16619 1 1804 . 1 1 148 148 LEU HA H 1 4.1170 0.05 . 1 . . . . 148 LEU HA . 16619 1 1805 . 1 1 148 148 LEU HB2 H 1 1.3740 0.05 . 2 . . . . 148 LEU HB# . 16619 1 1806 . 1 1 148 148 LEU HB3 H 1 1.3740 0.05 . 2 . . . . 148 LEU HB# . 16619 1 1807 . 1 1 148 148 LEU HD11 H 1 0.3100 0.05 . 2 . . . . 148 LEU HD1#|HD2# . 16619 1 1808 . 1 1 148 148 LEU HD12 H 1 0.3100 0.05 . 2 . . . . 148 LEU HD1#|HD2# . 16619 1 1809 . 1 1 148 148 LEU HD13 H 1 0.3100 0.05 . 2 . . . . 148 LEU HD1#|HD2# . 16619 1 1810 . 1 1 148 148 LEU HD21 H 1 -0.7600 0.05 . 2 . . . . 148 LEU HD2#|HD1# . 16619 1 1811 . 1 1 148 148 LEU HD22 H 1 -0.7600 0.05 . 2 . . . . 148 LEU HD2#|HD1# . 16619 1 1812 . 1 1 148 148 LEU HD23 H 1 -0.7600 0.05 . 2 . . . . 148 LEU HD2#|HD1# . 16619 1 1813 . 1 1 148 148 LEU HG H 1 1.0100 0.05 . 1 . . . . 148 LEU HG . 16619 1 1814 . 1 1 148 148 LEU C C 13 177.0450 0.04 . 1 . . . . 148 LEU C . 16619 1 1815 . 1 1 148 148 LEU CA C 13 55.1650 0.5 . 1 . . . . 148 LEU CA . 16619 1 1816 . 1 1 148 148 LEU CB C 13 42.1040 0.5 . 1 . . . . 148 LEU CB . 16619 1 1817 . 1 1 148 148 LEU CD1 C 13 21.3130 0.5 . 2 . . . . 148 LEU CD1 . 16619 1 1818 . 1 1 148 148 LEU CD2 C 13 23.9900 0.5 . 2 . . . . 148 LEU CD2 . 16619 1 1819 . 1 1 148 148 LEU CG C 13 26.0130 0.5 . 1 . . . . 148 LEU CG . 16619 1 1820 . 1 1 148 148 LEU N N 15 117.3914 0.1 . 1 . . . . 148 LEU N . 16619 1 1821 . 1 1 149 149 GLY H H 1 8.0022 0.006 . 1 . . . . 149 GLY HN . 16619 1 1822 . 1 1 149 149 GLY HA2 H 1 4.3740 0.05 . 2 . . . . 149 GLY HA# . 16619 1 1823 . 1 1 149 149 GLY HA3 H 1 4.3740 0.05 . 2 . . . . 149 GLY HA# . 16619 1 1824 . 1 1 149 149 GLY C C 13 176.8090 0.04 . 1 . . . . 149 GLY C . 16619 1 1825 . 1 1 149 149 GLY CA C 13 45.0590 0.5 . 1 . . . . 149 GLY CA . 16619 1 1826 . 1 1 149 149 GLY N N 15 106.4608 0.1 . 1 . . . . 149 GLY N . 16619 1 1827 . 1 1 150 150 GLY H H 1 8.9210 0.006 . 1 . . . . 150 GLY HN . 16619 1 1828 . 1 1 150 150 GLY HA2 H 1 3.0000 0.05 . 2 . . . . 150 GLY HA1|HA2 . 16619 1 1829 . 1 1 150 150 GLY HA3 H 1 4.1150 0.05 . 2 . . . . 150 GLY HA2|HA1 . 16619 1 1830 . 1 1 150 150 GLY C C 13 173.1970 0.04 . 1 . . . . 150 GLY C . 16619 1 1831 . 1 1 150 150 GLY CA C 13 44.6760 0.5 . 1 . . . . 150 GLY CA . 16619 1 1832 . 1 1 150 150 GLY N N 15 111.0172 0.1 . 1 . . . . 150 GLY N . 16619 1 1833 . 1 1 151 151 TRP H H 1 8.3577 0.006 . 1 . . . . 151 TRP HN . 16619 1 1834 . 1 1 151 151 TRP HA H 1 4.7004 0.05 . 1 . . . . 151 TRP HA . 16619 1 1835 . 1 1 151 151 TRP HB2 H 1 3.1610 0.05 . 2 . . . . 151 TRP HB# . 16619 1 1836 . 1 1 151 151 TRP HB3 H 1 3.1610 0.05 . 2 . . . . 151 TRP HB# . 16619 1 1837 . 1 1 151 151 TRP HD1 H 1 5.6600 0.05 . 1 . . . . 151 TRP HD1 . 16619 1 1838 . 1 1 151 151 TRP HE1 H 1 10.1140 0.05 . 1 . . . . 151 TRP HE1 . 16619 1 1839 . 1 1 151 151 TRP HE3 H 1 7.7130 0.05 . 1 . . . . 151 TRP HE3 . 16619 1 1840 . 1 1 151 151 TRP HH2 H 1 6.2450 0.05 . 1 . . . . 151 TRP HH2 . 16619 1 1841 . 1 1 151 151 TRP HZ2 H 1 7.2520 0.05 . 1 . . . . 151 TRP HZ2 . 16619 1 1842 . 1 1 151 151 TRP HZ3 H 1 6.4750 0.05 . 1 . . . . 151 TRP HZ3 . 16619 1 1843 . 1 1 151 151 TRP C C 13 179.1300 0.04 . 1 . . . . 151 TRP C . 16619 1 1844 . 1 1 151 151 TRP CA C 13 58.1400 0.5 . 1 . . . . 151 TRP CA . 16619 1 1845 . 1 1 151 151 TRP CB C 13 28.4490 0.5 . 1 . . . . 151 TRP CB . 16619 1 1846 . 1 1 151 151 TRP CD1 C 13 127.6400 0.5 . 1 . . . . 151 TRP CD1 . 16619 1 1847 . 1 1 151 151 TRP CE3 C 13 119.0800 0.5 . 1 . . . . 151 TRP CE3 . 16619 1 1848 . 1 1 151 151 TRP CH2 C 13 124.8300 0.5 . 1 . . . . 151 TRP CH2 . 16619 1 1849 . 1 1 151 151 TRP CZ3 C 13 121.3400 0.5 . 1 . . . . 151 TRP CZ3 . 16619 1 1850 . 1 1 151 151 TRP N N 15 121.7068 0.1 . 1 . . . . 151 TRP N . 16619 1 1851 . 1 1 151 151 TRP NE1 N 15 128.4150 0.1 . 1 . . . . 151 TRP NE1 . 16619 1 1852 . 1 1 152 152 ASP H H 1 8.8307 0.006 . 1 . . . . 152 ASP HN . 16619 1 1853 . 1 1 152 152 ASP HA H 1 4.7620 0.05 . 1 . . . . 152 ASP HA . 16619 1 1854 . 1 1 152 152 ASP HB2 H 1 2.8570 0.05 . 2 . . . . 152 ASP HB# . 16619 1 1855 . 1 1 152 152 ASP HB3 H 1 2.8570 0.05 . 2 . . . . 152 ASP HB# . 16619 1 1856 . 1 1 152 152 ASP C C 13 179.0020 0.04 . 1 . . . . 152 ASP C . 16619 1 1857 . 1 1 152 152 ASP CA C 13 58.3710 0.5 . 1 . . . . 152 ASP CA . 16619 1 1858 . 1 1 152 152 ASP CB C 13 40.1430 0.5 . 1 . . . . 152 ASP CB . 16619 1 1859 . 1 1 152 152 ASP N N 15 120.6828 0.1 . 1 . . . . 152 ASP N . 16619 1 1860 . 1 1 153 153 GLY H H 1 7.7667 0.006 . 1 . . . . 153 GLY HN . 16619 1 1861 . 1 1 153 153 GLY HA2 H 1 4.3280 0.05 . 2 . . . . 153 GLY HA1|HA2 . 16619 1 1862 . 1 1 153 153 GLY HA3 H 1 3.9290 0.05 . 2 . . . . 153 GLY HA2|HA1 . 16619 1 1863 . 1 1 153 153 GLY C C 13 176.3960 0.04 . 1 . . . . 153 GLY C . 16619 1 1864 . 1 1 153 153 GLY CA C 13 47.1910 0.5 . 1 . . . . 153 GLY CA . 16619 1 1865 . 1 1 153 153 GLY N N 15 111.1254 0.1 . 1 . . . . 153 GLY N . 16619 1 1866 . 1 1 154 154 PHE H H 1 7.8664 0.006 . 1 . . . . 154 PHE HN . 16619 1 1867 . 1 1 154 154 PHE HA H 1 4.3400 0.05 . 1 . . . . 154 PHE HA . 16619 1 1868 . 1 1 154 154 PHE HB2 H 1 2.7550 0.05 . 2 . . . . 154 PHE HB1|HB2 . 16619 1 1869 . 1 1 154 154 PHE HB3 H 1 2.3460 0.05 . 2 . . . . 154 PHE HB2|HB1 . 16619 1 1870 . 1 1 154 154 PHE HZ H 1 7.2040 0.05 . 1 . . . . 154 PHE HZ . 16619 1 1871 . 1 1 154 154 PHE C C 13 175.9220 0.04 . 1 . . . . 154 PHE C . 16619 1 1872 . 1 1 154 154 PHE CA C 13 61.2520 0.5 . 1 . . . . 154 PHE CA . 16619 1 1873 . 1 1 154 154 PHE CB C 13 39.0540 0.5 . 1 . . . . 154 PHE CB . 16619 1 1874 . 1 1 154 154 PHE N N 15 125.5265 0.1 . 1 . . . . 154 PHE N . 16619 1 1875 . 1 1 155 155 CYS H H 1 7.6588 0.006 . 1 . . . . 155 CYS HN . 16619 1 1876 . 1 1 155 155 CYS HA H 1 3.9470 0.05 . 1 . . . . 155 CYS HA . 16619 1 1877 . 1 1 155 155 CYS HB2 H 1 3.4312 0.05 . 2 . . . . 155 CYS HB1 . 16619 1 1878 . 1 1 155 155 CYS HB3 H 1 2.8175 0.05 . 2 . . . . 155 CYS HB2 . 16619 1 1879 . 1 1 155 155 CYS C C 13 176.4750 0.04 . 1 . . . . 155 CYS C . 16619 1 1880 . 1 1 155 155 CYS CA C 13 62.8990 0.5 . 1 . . . . 155 CYS CA . 16619 1 1881 . 1 1 155 155 CYS CB C 13 26.4110 0.5 . 1 . . . . 155 CYS CB . 16619 1 1882 . 1 1 155 155 CYS N N 15 115.6724 0.1 . 1 . . . . 155 CYS N . 16619 1 1883 . 1 1 156 156 ARG H H 1 7.7583 0.006 . 1 . . . . 156 ARG HN . 16619 1 1884 . 1 1 156 156 ARG HA H 1 4.0990 0.05 . 1 . . . . 156 ARG HA . 16619 1 1885 . 1 1 156 156 ARG HB2 H 1 1.9270 0.05 . 2 . . . . 156 ARG HB# . 16619 1 1886 . 1 1 156 156 ARG HB3 H 1 1.9270 0.05 . 2 . . . . 156 ARG HB# . 16619 1 1887 . 1 1 156 156 ARG HD2 H 1 3.3990 0.05 . 2 . . . . 156 ARG HD# . 16619 1 1888 . 1 1 156 156 ARG HD3 H 1 3.3990 0.05 . 2 . . . . 156 ARG HD# . 16619 1 1889 . 1 1 156 156 ARG HG2 H 1 1.6619 0.05 . 2 . . . . 156 ARG HG# . 16619 1 1890 . 1 1 156 156 ARG HG3 H 1 1.6619 0.05 . 2 . . . . 156 ARG HG# . 16619 1 1891 . 1 1 156 156 ARG C C 13 177.9920 0.04 . 1 . . . . 156 ARG C . 16619 1 1892 . 1 1 156 156 ARG CA C 13 58.7360 0.5 . 1 . . . . 156 ARG CA . 16619 1 1893 . 1 1 156 156 ARG CB C 13 30.6680 0.5 . 1 . . . . 156 ARG CB . 16619 1 1894 . 1 1 156 156 ARG CD C 13 43.7790 0.5 . 1 . . . . 156 ARG CD . 16619 1 1895 . 1 1 156 156 ARG CG C 13 25.8100 0.5 . 1 . . . . 156 ARG CG . 16619 1 1896 . 1 1 156 156 ARG N N 15 116.7446 0.1 . 1 . . . . 156 ARG N . 16619 1 1897 . 1 1 157 157 PHE H H 1 8.0708 0.006 . 1 . . . . 157 PHE HN . 16619 1 1898 . 1 1 157 157 PHE HA H 1 3.9310 0.05 . 1 . . . . 157 PHE HA . 16619 1 1899 . 1 1 157 157 PHE HB2 H 1 2.9230 0.05 . 2 . . . . 157 PHE HB1|HB2 . 16619 1 1900 . 1 1 157 157 PHE HB3 H 1 2.2260 0.05 . 2 . . . . 157 PHE HB2|HB1 . 16619 1 1901 . 1 1 157 157 PHE HD1 H 1 6.0340 0.05 . 3 . . . . 157 PHE HD1 . 16619 1 1902 . 1 1 157 157 PHE HD2 H 1 6.0340 0.05 . 3 . . . . 157 PHE HD2 . 16619 1 1903 . 1 1 157 157 PHE HE1 H 1 7.1455 0.05 . 3 . . . . 157 PHE HE1 . 16619 1 1904 . 1 1 157 157 PHE HE2 H 1 7.1455 0.05 . 3 . . . . 157 PHE HE2 . 16619 1 1905 . 1 1 157 157 PHE HZ H 1 7.2900 0.05 . 1 . . . . 157 PHE HZ . 16619 1 1906 . 1 1 157 157 PHE C C 13 176.9530 0.04 . 1 . . . . 157 PHE C . 16619 1 1907 . 1 1 157 157 PHE CA C 13 61.3920 0.5 . 1 . . . . 157 PHE CA . 16619 1 1908 . 1 1 157 157 PHE CB C 13 39.5560 0.5 . 1 . . . . 157 PHE CB . 16619 1 1909 . 1 1 157 157 PHE CD1 C 13 132.1260 0.5 . 3 . . . . 157 PHE CD1 . 16619 1 1910 . 1 1 157 157 PHE CD2 C 13 132.1260 0.5 . 3 . . . . 157 PHE CD2 . 16619 1 1911 . 1 1 157 157 PHE CE1 C 13 131.2870 0.5 . 3 . . . . 157 PHE CE1 . 16619 1 1912 . 1 1 157 157 PHE CE2 C 13 131.2870 0.5 . 3 . . . . 157 PHE CE2 . 16619 1 1913 . 1 1 157 157 PHE CZ C 13 129.6890 0.5 . 1 . . . . 157 PHE CZ . 16619 1 1914 . 1 1 157 157 PHE N N 15 119.9807 0.1 . 1 . . . . 157 PHE N . 16619 1 1915 . 1 1 158 158 PHE H H 1 7.1208 0.006 . 1 . . . . 158 PHE HN . 16619 1 1916 . 1 1 158 158 PHE HA H 1 4.3600 0.05 . 1 . . . . 158 PHE HA . 16619 1 1917 . 1 1 158 158 PHE HB2 H 1 3.1030 0.05 . 2 . . . . 158 PHE HB1|HB2 . 16619 1 1918 . 1 1 158 158 PHE HB3 H 1 2.1020 0.05 . 2 . . . . 158 PHE HB2|HB1 . 16619 1 1919 . 1 1 158 158 PHE HD1 H 1 6.7500 0.05 . 3 . . . . 158 PHE HD1 . 16619 1 1920 . 1 1 158 158 PHE HD2 H 1 6.7500 0.05 . 3 . . . . 158 PHE HD2 . 16619 1 1921 . 1 1 158 158 PHE HE1 H 1 7.1400 0.05 . 3 . . . . 158 PHE HE1 . 16619 1 1922 . 1 1 158 158 PHE HE2 H 1 7.1400 0.05 . 3 . . . . 158 PHE HE2 . 16619 1 1923 . 1 1 158 158 PHE C C 13 174.8480 0.04 . 1 . . . . 158 PHE C . 16619 1 1924 . 1 1 158 158 PHE CA C 13 59.1720 0.5 . 1 . . . . 158 PHE CA . 16619 1 1925 . 1 1 158 158 PHE CB C 13 39.6170 0.5 . 1 . . . . 158 PHE CB . 16619 1 1926 . 1 1 158 158 PHE CD1 C 13 132.7360 0.5 . 3 . . . . 158 PHE CD1 . 16619 1 1927 . 1 1 158 158 PHE CD2 C 13 132.7360 0.5 . 3 . . . . 158 PHE CD2 . 16619 1 1928 . 1 1 158 158 PHE CE1 C 13 131.3470 0.5 . 3 . . . . 158 PHE CE1 . 16619 1 1929 . 1 1 158 158 PHE CE2 C 13 131.3470 0.5 . 3 . . . . 158 PHE CE2 . 16619 1 1930 . 1 1 158 158 PHE N N 15 112.7192 0.1 . 1 . . . . 158 PHE N . 16619 1 1931 . 1 1 159 159 LYS H H 1 7.3459 0.006 . 1 . . . . 159 LYS HN . 16619 1 1932 . 1 1 159 159 LYS HA H 1 4.1640 0.05 . 1 . . . . 159 LYS HA . 16619 1 1933 . 1 1 159 159 LYS HB2 H 1 1.8570 0.05 . 2 . . . . 159 LYS HB# . 16619 1 1934 . 1 1 159 159 LYS HB3 H 1 1.8570 0.05 . 2 . . . . 159 LYS HB# . 16619 1 1935 . 1 1 159 159 LYS HD2 H 1 1.6630 0.05 . 2 . . . . 159 LYS HD# . 16619 1 1936 . 1 1 159 159 LYS HD3 H 1 1.6630 0.05 . 2 . . . . 159 LYS HD# . 16619 1 1937 . 1 1 159 159 LYS HE2 H 1 2.9940 0.05 . 2 . . . . 159 LYS HE# . 16619 1 1938 . 1 1 159 159 LYS HE3 H 1 2.9940 0.05 . 2 . . . . 159 LYS HE# . 16619 1 1939 . 1 1 159 159 LYS HG2 H 1 1.4430 0.05 . 2 . . . . 159 LYS HG# . 16619 1 1940 . 1 1 159 159 LYS HG3 H 1 1.4430 0.05 . 2 . . . . 159 LYS HG# . 16619 1 1941 . 1 1 159 159 LYS C C 13 175.1800 0.04 . 1 . . . . 159 LYS C . 16619 1 1942 . 1 1 159 159 LYS CA C 13 57.3490 0.5 . 1 . . . . 159 LYS CA . 16619 1 1943 . 1 1 159 159 LYS CB C 13 32.8100 0.5 . 1 . . . . 159 LYS CB . 16619 1 1944 . 1 1 159 159 LYS CD C 13 29.4170 0.5 . 1 . . . . 159 LYS CD . 16619 1 1945 . 1 1 159 159 LYS CE C 13 42.3690 0.5 . 1 . . . . 159 LYS CE . 16619 1 1946 . 1 1 159 159 LYS CG C 13 24.5810 0.5 . 1 . . . . 159 LYS CG . 16619 1 1947 . 1 1 159 159 LYS N N 15 120.4455 0.1 . 1 . . . . 159 LYS N . 16619 1 1948 . 1 1 160 160 ASN H H 1 7.8670 0.006 . 1 . . . . 160 ASN HN . 16619 1 1949 . 1 1 160 160 ASN HA H 1 4.4180 0.05 . 1 . . . . 160 ASN HA . 16619 1 1950 . 1 1 160 160 ASN HB2 H 1 2.6980 0.05 . 2 . . . . 160 ASN HB# . 16619 1 1951 . 1 1 160 160 ASN HB3 H 1 2.6980 0.05 . 2 . . . . 160 ASN HB# . 16619 1 1952 . 1 1 160 160 ASN HD21 H 1 7.3740 0.05 . 2 . . . . 160 ASN HD21 . 16619 1 1953 . 1 1 160 160 ASN HD22 H 1 6.7050 0.05 . 2 . . . . 160 ASN HD22 . 16619 1 1954 . 1 1 160 160 ASN CA C 13 55.0610 0.5 . 1 . . . . 160 ASN CA . 16619 1 1955 . 1 1 160 160 ASN CB C 13 40.7070 0.5 . 1 . . . . 160 ASN CB . 16619 1 1956 . 1 1 160 160 ASN N N 15 125.8539 0.1 . 1 . . . . 160 ASN N . 16619 1 1957 . 1 1 160 160 ASN ND2 N 15 110.1800 0.1 . 1 . . . . 160 ASN ND2 . 16619 1 stop_ save_