data_18802 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18802 _Entry.Title ; Structure, phosphorylation and U2AF65 binding of the Nterminal domain of splicing factor 1 during 3 splice site recognition ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2012-10-22 _Entry.Accession_date 2012-10-22 _Entry.Last_release_date 2013-01-28 _Entry.Original_release_date 2013-01-28 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _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 Tobias Madl . . . 18802 2 Michael Sattler . . . 18802 3 Yun Zhang . . . 18802 4 Ivona Bagdiul . . . 18802 5 Thomas Kern . . . 18802 6 Hyun-Seo Kang . . . 18802 7 Peijian Zou . . . 18802 8 Nina Maeusbacher . . . 18802 9 Stephan Sieber . A. . 18802 10 Angela Kraemer . . . 18802 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 18802 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID RRM . 18802 SF1 . 18802 'spliceosome assembly' . 18802 U2AF65 . 18802 UHM . 18802 ULM . 18802 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18802 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 544 18802 '15N chemical shifts' 116 18802 '1H chemical shifts' 860 18802 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2013-01-28 2012-10-22 original author . 18802 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2M09 'BMRB Entry Tracking System' 18802 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18802 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 23175611 _Citation.Full_citation . _Citation.Title 'Structure, phosphorylation and U2AF65 binding of the N-terminal domain of splicing factor 1 during 3'-splice site recognition' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nucleic Acids Res.' _Citation.Journal_name_full . _Citation.Journal_volume 41 _Citation.Journal_issue 2 _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 1343 _Citation.Page_last 1354 _Citation.Year 2013 _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 Yun Zhang . . . 18802 1 2 Tobias Madl . . . 18802 1 3 Ivona Bagdiul . . . 18802 1 4 Thomas Kern . . . 18802 1 5 Hyun-Seo Kang . . . 18802 1 6 Peijian Zou . . . 18802 1 7 Nina Maeusbacher . . . 18802 1 8 Stephan Sieber . . . 18802 1 9 Angela Kraemer . . . 18802 1 10 Michael Sattler . . . 18802 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18802 _Assembly.ID 1 _Assembly.Name SF1N _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 SF1N 1 $SF1N A . yes native no no . . . 18802 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_SF1N _Entity.Sf_category entity _Entity.Sf_framecode SF1N _Entity.Entry_ID 18802 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GAMEQKTVIPGMPTVIPPGL TREQERAYIVQLQIEDLTRK LRTGDLGIPPNPEDRSPSPE PIYNSEGKRLNTREFRTRKK LEEERHNLITEMVALNPDFK PPADYKPPATRVSDKVMIPQ D ; _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 121 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13821.896 _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 BMRB 18808 . entity_1 . . . . . 99.17 145 98.33 98.33 1.45e-77 . . . . 18802 1 2 no PDB 2M09 . "Structure, Phosphorylation And U2af65 Binding Of The Nterminal Domain Of Splicing Factor 1 During 3 Splice Site Recognition" . . . . . 100.00 121 100.00 100.00 7.36e-80 . . . . 18802 1 3 no PDB 2M0G . "Structure, Phosphorylation And U2af65 Binding Of The Nterminal Domain Of Splicing Factor 1 During 3 Splice Site Recognition" . . . . . 99.17 145 98.33 98.33 1.45e-77 . . . . 18802 1 4 no PDB 4FXX . "Structure Of Sf1 Coiled-coil Domain" . . . . . 89.26 112 98.15 98.15 3.88e-68 . . . . 18802 1 5 no DBJ BAA05116 . "ZFM1 protein alternatively spliced product [Homo sapiens]" . . . . . 98.35 548 100.00 100.00 6.51e-74 . . . . 18802 1 6 no DBJ BAA05117 . "ZFM1 protein [Homo sapiens]" . . . . . 98.35 623 100.00 100.00 1.69e-73 . . . . 18802 1 7 no DBJ BAE01434 . "unnamed protein product [Macaca fascicularis]" . . . . . 98.35 419 100.00 100.00 1.90e-75 . . . . 18802 1 8 no DBJ BAE26935 . "unnamed protein product [Mus musculus]" . . . . . 98.35 639 99.16 99.16 1.08e-72 . . . . 18802 1 9 no DBJ BAE27661 . "unnamed protein product [Mus musculus]" . . . . . 98.35 639 99.16 99.16 1.18e-72 . . . . 18802 1 10 no EMBL CAA03883 . "splicing factor SF1 [Homo sapiens]" . . . . . 99.17 295 99.17 99.17 2.42e-77 . . . . 18802 1 11 no EMBL CAA59797 . "CW17R [Mus musculus]" . . . . . 98.35 548 99.16 99.16 6.26e-73 . . . . 18802 1 12 no EMBL CAA70018 . "SF1-Hl1 isoform [Homo sapiens]" . . . . . 98.35 639 100.00 100.00 1.32e-73 . . . . 18802 1 13 no EMBL CAA70019 . "SF1-Bo isoform [Homo sapiens]" . . . . . 98.35 638 100.00 100.00 1.58e-73 . . . . 18802 1 14 no EMBL CAA73359 . "CW17 [Mus musculus]" . . . . . 98.35 653 99.16 99.16 2.45e-72 . . . . 18802 1 15 no GB AAB03514 . "transcription factor ZFM1 [Homo sapiens]" . . . . . 98.35 571 100.00 100.00 2.85e-74 . . . . 18802 1 16 no GB AAB04033 . "transcription factor ZFM1 [Homo sapiens]" . . . . . 98.35 639 100.00 100.00 1.58e-73 . . . . 18802 1 17 no GB AAH08080 . "Splicing factor 1 [Homo sapiens]" . . . . . 98.35 548 100.00 100.00 7.64e-74 . . . . 18802 1 18 no GB AAH08724 . "Splicing factor 1 [Homo sapiens]" . . . . . 98.35 548 100.00 100.00 7.64e-74 . . . . 18802 1 19 no GB AAH09091 . "Sf1 protein [Mus musculus]" . . . . . 98.35 639 99.16 99.16 1.16e-72 . . . . 18802 1 20 no PIR S52735 . "CW17R protein - mouse" . . . . . 98.35 548 99.16 99.16 6.26e-73 . . . . 18802 1 21 no REF NP_001011340 . "splicing factor 1 [Xenopus (Silurana) tropicalis]" . . . . . 97.52 571 97.46 99.15 1.42e-71 . . . . 18802 1 22 no REF NP_001075083 . "splicing factor 1 [Bos taurus]" . . . . . 98.35 639 100.00 100.00 1.32e-73 . . . . 18802 1 23 no REF NP_001104261 . "splicing factor 1 isoform 1 [Mus musculus]" . . . . . 98.35 639 99.16 99.16 1.18e-72 . . . . 18802 1 24 no REF NP_001104263 . "splicing factor 1 isoform 1 [Rattus norvegicus]" . . . . . 98.35 639 99.16 99.16 1.18e-72 . . . . 18802 1 25 no REF NP_001162562 . "splicing factor 1 [Papio anubis]" . . . . . 98.35 638 100.00 100.00 1.58e-73 . . . . 18802 1 26 no SP Q15637 . "RecName: Full=Splicing factor 1; AltName: Full=Mammalian branch point-binding protein; Short=BBP; Short=mBBP; AltName: Full=Tra" . . . . . 98.35 639 100.00 100.00 1.32e-73 . . . . 18802 1 27 no SP Q64213 . "RecName: Full=Splicing factor 1; AltName: Full=CW17; AltName: Full=Mammalian branch point-binding protein; Short=BBP; Short=mBB" . . . . . 98.35 653 99.16 99.16 1.90e-72 . . . . 18802 1 28 no TPG DAA13585 . "TPA: splicing factor 1 [Bos taurus]" . . . . . 98.35 639 100.00 100.00 1.32e-73 . . . . 18802 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 25 GLY . 18802 1 2 26 ALA . 18802 1 3 27 MET . 18802 1 4 28 GLU . 18802 1 5 29 GLN . 18802 1 6 30 LYS . 18802 1 7 31 THR . 18802 1 8 32 VAL . 18802 1 9 33 ILE . 18802 1 10 34 PRO . 18802 1 11 35 GLY . 18802 1 12 36 MET . 18802 1 13 37 PRO . 18802 1 14 38 THR . 18802 1 15 39 VAL . 18802 1 16 40 ILE . 18802 1 17 41 PRO . 18802 1 18 42 PRO . 18802 1 19 43 GLY . 18802 1 20 44 LEU . 18802 1 21 45 THR . 18802 1 22 46 ARG . 18802 1 23 47 GLU . 18802 1 24 48 GLN . 18802 1 25 49 GLU . 18802 1 26 50 ARG . 18802 1 27 51 ALA . 18802 1 28 52 TYR . 18802 1 29 53 ILE . 18802 1 30 54 VAL . 18802 1 31 55 GLN . 18802 1 32 56 LEU . 18802 1 33 57 GLN . 18802 1 34 58 ILE . 18802 1 35 59 GLU . 18802 1 36 60 ASP . 18802 1 37 61 LEU . 18802 1 38 62 THR . 18802 1 39 63 ARG . 18802 1 40 64 LYS . 18802 1 41 65 LEU . 18802 1 42 66 ARG . 18802 1 43 67 THR . 18802 1 44 68 GLY . 18802 1 45 69 ASP . 18802 1 46 70 LEU . 18802 1 47 71 GLY . 18802 1 48 72 ILE . 18802 1 49 73 PRO . 18802 1 50 74 PRO . 18802 1 51 75 ASN . 18802 1 52 76 PRO . 18802 1 53 77 GLU . 18802 1 54 78 ASP . 18802 1 55 79 ARG . 18802 1 56 80 SER . 18802 1 57 81 PRO . 18802 1 58 82 SER . 18802 1 59 83 PRO . 18802 1 60 84 GLU . 18802 1 61 85 PRO . 18802 1 62 86 ILE . 18802 1 63 87 TYR . 18802 1 64 88 ASN . 18802 1 65 89 SER . 18802 1 66 90 GLU . 18802 1 67 91 GLY . 18802 1 68 92 LYS . 18802 1 69 93 ARG . 18802 1 70 94 LEU . 18802 1 71 95 ASN . 18802 1 72 96 THR . 18802 1 73 97 ARG . 18802 1 74 98 GLU . 18802 1 75 99 PHE . 18802 1 76 100 ARG . 18802 1 77 101 THR . 18802 1 78 102 ARG . 18802 1 79 103 LYS . 18802 1 80 104 LYS . 18802 1 81 105 LEU . 18802 1 82 106 GLU . 18802 1 83 107 GLU . 18802 1 84 108 GLU . 18802 1 85 109 ARG . 18802 1 86 110 HIS . 18802 1 87 111 ASN . 18802 1 88 112 LEU . 18802 1 89 113 ILE . 18802 1 90 114 THR . 18802 1 91 115 GLU . 18802 1 92 116 MET . 18802 1 93 117 VAL . 18802 1 94 118 ALA . 18802 1 95 119 LEU . 18802 1 96 120 ASN . 18802 1 97 121 PRO . 18802 1 98 122 ASP . 18802 1 99 123 PHE . 18802 1 100 124 LYS . 18802 1 101 125 PRO . 18802 1 102 126 PRO . 18802 1 103 127 ALA . 18802 1 104 128 ASP . 18802 1 105 129 TYR . 18802 1 106 130 LYS . 18802 1 107 131 PRO . 18802 1 108 132 PRO . 18802 1 109 133 ALA . 18802 1 110 134 THR . 18802 1 111 135 ARG . 18802 1 112 136 VAL . 18802 1 113 137 SER . 18802 1 114 138 ASP . 18802 1 115 139 LYS . 18802 1 116 140 VAL . 18802 1 117 141 MET . 18802 1 118 142 ILE . 18802 1 119 143 PRO . 18802 1 120 144 GLN . 18802 1 121 145 ASP . 18802 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 18802 1 . ALA 2 2 18802 1 . MET 3 3 18802 1 . GLU 4 4 18802 1 . GLN 5 5 18802 1 . LYS 6 6 18802 1 . THR 7 7 18802 1 . VAL 8 8 18802 1 . ILE 9 9 18802 1 . PRO 10 10 18802 1 . GLY 11 11 18802 1 . MET 12 12 18802 1 . PRO 13 13 18802 1 . THR 14 14 18802 1 . VAL 15 15 18802 1 . ILE 16 16 18802 1 . PRO 17 17 18802 1 . PRO 18 18 18802 1 . GLY 19 19 18802 1 . LEU 20 20 18802 1 . THR 21 21 18802 1 . ARG 22 22 18802 1 . GLU 23 23 18802 1 . GLN 24 24 18802 1 . GLU 25 25 18802 1 . ARG 26 26 18802 1 . ALA 27 27 18802 1 . TYR 28 28 18802 1 . ILE 29 29 18802 1 . VAL 30 30 18802 1 . GLN 31 31 18802 1 . LEU 32 32 18802 1 . GLN 33 33 18802 1 . ILE 34 34 18802 1 . GLU 35 35 18802 1 . ASP 36 36 18802 1 . LEU 37 37 18802 1 . THR 38 38 18802 1 . ARG 39 39 18802 1 . LYS 40 40 18802 1 . LEU 41 41 18802 1 . ARG 42 42 18802 1 . THR 43 43 18802 1 . GLY 44 44 18802 1 . ASP 45 45 18802 1 . LEU 46 46 18802 1 . GLY 47 47 18802 1 . ILE 48 48 18802 1 . PRO 49 49 18802 1 . PRO 50 50 18802 1 . ASN 51 51 18802 1 . PRO 52 52 18802 1 . GLU 53 53 18802 1 . ASP 54 54 18802 1 . ARG 55 55 18802 1 . SER 56 56 18802 1 . PRO 57 57 18802 1 . SER 58 58 18802 1 . PRO 59 59 18802 1 . GLU 60 60 18802 1 . PRO 61 61 18802 1 . ILE 62 62 18802 1 . TYR 63 63 18802 1 . ASN 64 64 18802 1 . SER 65 65 18802 1 . GLU 66 66 18802 1 . GLY 67 67 18802 1 . LYS 68 68 18802 1 . ARG 69 69 18802 1 . LEU 70 70 18802 1 . ASN 71 71 18802 1 . THR 72 72 18802 1 . ARG 73 73 18802 1 . GLU 74 74 18802 1 . PHE 75 75 18802 1 . ARG 76 76 18802 1 . THR 77 77 18802 1 . ARG 78 78 18802 1 . LYS 79 79 18802 1 . LYS 80 80 18802 1 . LEU 81 81 18802 1 . GLU 82 82 18802 1 . GLU 83 83 18802 1 . GLU 84 84 18802 1 . ARG 85 85 18802 1 . HIS 86 86 18802 1 . ASN 87 87 18802 1 . LEU 88 88 18802 1 . ILE 89 89 18802 1 . THR 90 90 18802 1 . GLU 91 91 18802 1 . MET 92 92 18802 1 . VAL 93 93 18802 1 . ALA 94 94 18802 1 . LEU 95 95 18802 1 . ASN 96 96 18802 1 . PRO 97 97 18802 1 . ASP 98 98 18802 1 . PHE 99 99 18802 1 . LYS 100 100 18802 1 . PRO 101 101 18802 1 . PRO 102 102 18802 1 . ALA 103 103 18802 1 . ASP 104 104 18802 1 . TYR 105 105 18802 1 . LYS 106 106 18802 1 . PRO 107 107 18802 1 . PRO 108 108 18802 1 . ALA 109 109 18802 1 . THR 110 110 18802 1 . ARG 111 111 18802 1 . VAL 112 112 18802 1 . SER 113 113 18802 1 . ASP 114 114 18802 1 . LYS 115 115 18802 1 . VAL 116 116 18802 1 . MET 117 117 18802 1 . ILE 118 118 18802 1 . PRO 119 119 18802 1 . GLN 120 120 18802 1 . ASP 121 121 18802 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 18802 _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 $SF1N . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 18802 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 18802 _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 $SF1N . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . . . . . . . . . . . . . . petM11 . . . . . . 18802 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18802 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 20 mM sodium phosphate (pH 6.5), 50 mM NaCl, 0.1% sodium azide, 1mM DTT and 1 mM EDTA ; _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 SF1N [U-15N] . . 1 $SF1N . . . 100 600 uM . . . . 18802 1 2 SF1N '[U-13C; U-15N]' . . 1 $SF1N . . . 100 600 uM . . . . 18802 1 3 SF1N '[U-13C; U-15N; U-2H]' . . 1 $SF1N . . . 100 600 uM . . . . 18802 1 4 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 18802 1 5 NaCl 'natural abundance' . . . . . . 50 . . mM . . . . 18802 1 6 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 18802 1 7 'sodium azide' 'natural abundance' . . . . . . 0.1 . . % . . . . 18802 1 8 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 18802 1 9 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18802 1 10 D2O 'natural abundance' . . . . . . 10 . . % . . . . 18802 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 18802 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 70 . mM 18802 1 pH 6.5 . pH 18802 1 pressure 1 . atm 18802 1 temperature 298 . K 18802 1 stop_ save_ ############################ # Computer software used # ############################ save_ARIA _Software.Sf_category software _Software.Sf_framecode ARIA _Software.Entry_ID 18802 _Software.ID 1 _Software.Name ARIA _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Linge, O'Donoghue and Nilges' . . 18802 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 18802 1 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 18802 _Software.ID 2 _Software.Name CYANA _Software.Version 3.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 18802 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 18802 2 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 18802 _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' . . 18802 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 18802 3 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 18802 _Software.ID 4 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 18802 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 18802 4 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 18802 _Software.ID 5 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 18802 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 18802 5 processing 18802 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 18802 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 18802 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 18802 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_4 _NMR_spectrometer.Entry_ID 18802 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 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 18802 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 900 . . . 18802 1 2 spectrometer_2 Bruker Avance . 750 . . . 18802 1 3 spectrometer_3 Bruker Avance . 600 . . . 18802 1 4 spectrometer_4 Bruker Avance . 500 . . . 18802 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 18802 _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 . . . . . . . . . . . . . . . . . . . . . 18802 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18802 1 3 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18802 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18802 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18802 1 6 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18802 1 7 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18802 1 8 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18802 1 9 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18802 1 10 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18802 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 18802 _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 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 18802 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 18802 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 18802 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 18802 _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' . . . 18802 1 2 '2D 1H-13C HSQC' . . . 18802 1 3 '2D 1H-1H NOESY' . . . 18802 1 4 '3D CBCA(CO)NH' . . . 18802 1 5 '3D HNCA' . . . 18802 1 6 '3D HNCACB' . . . 18802 1 7 '3D HCCH-TOCSY' . . . 18802 1 8 '3D 1H-15N NOESY' . . . 18802 1 9 '3D 1H-13C NOESY aliphatic' . . . 18802 1 10 '3D 1H-13C NOESY aromatic' . . . 18802 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 GLY HA2 H 1 3.812 0.001 . 1 . . . A 1 GLY HA2 . 18802 1 2 . 1 1 1 1 GLY HA3 H 1 3.812 0.001 . 1 . . . A 1 GLY HA3 . 18802 1 3 . 1 1 1 1 GLY C C 13 175.917 0.200 . 1 . . . A 1 GLY C . 18802 1 4 . 1 1 1 1 GLY CA C 13 43.380 0.001 . 1 . . . A 1 GLY CA . 18802 1 5 . 1 1 2 2 ALA H H 1 8.498 0.001 . 1 . . . A 2 ALA H . 18802 1 6 . 1 1 2 2 ALA HA H 1 4.292 0.020 . 1 . . . A 2 ALA HA . 18802 1 7 . 1 1 2 2 ALA HB1 H 1 1.360 0.020 . 1 . . . A 2 ALA MB . 18802 1 8 . 1 1 2 2 ALA HB2 H 1 1.360 0.020 . 1 . . . A 2 ALA MB . 18802 1 9 . 1 1 2 2 ALA HB3 H 1 1.360 0.020 . 1 . . . A 2 ALA MB . 18802 1 10 . 1 1 2 2 ALA C C 13 177.101 0.200 . 1 . . . A 2 ALA C . 18802 1 11 . 1 1 2 2 ALA CA C 13 52.921 0.200 . 1 . . . A 2 ALA CA . 18802 1 12 . 1 1 2 2 ALA CB C 13 19.426 0.200 . 1 . . . A 2 ALA CB . 18802 1 13 . 1 1 2 2 ALA N N 15 124.085 0.200 . 1 . . . A 2 ALA N . 18802 1 14 . 1 1 3 3 MET H H 1 8.441 0.005 . 1 . . . A 3 MET H . 18802 1 15 . 1 1 3 3 MET HA H 1 4.391 0.012 . 1 . . . A 3 MET HA . 18802 1 16 . 1 1 3 3 MET HB2 H 1 1.986 0.005 . 2 . . . A 3 MET HB2 . 18802 1 17 . 1 1 3 3 MET HB3 H 1 2.041 0.015 . 2 . . . A 3 MET HB3 . 18802 1 18 . 1 1 3 3 MET HG2 H 1 2.508 0.020 . 2 . . . A 3 MET HG2 . 18802 1 19 . 1 1 3 3 MET HG3 H 1 2.564 0.013 . 2 . . . A 3 MET HG3 . 18802 1 20 . 1 1 3 3 MET C C 13 176.296 0.200 . 1 . . . A 3 MET C . 18802 1 21 . 1 1 3 3 MET CA C 13 55.834 0.001 . 1 . . . A 3 MET CA . 18802 1 22 . 1 1 3 3 MET CB C 13 32.663 0.200 . 1 . . . A 3 MET CB . 18802 1 23 . 1 1 3 3 MET CG C 13 32.047 0.200 . 1 . . . A 3 MET CG . 18802 1 24 . 1 1 3 3 MET N N 15 119.630 0.113 . 1 . . . A 3 MET N . 18802 1 25 . 1 1 4 4 GLU H H 1 8.336 0.020 . 1 . . . A 4 GLU H . 18802 1 26 . 1 1 4 4 GLU HA H 1 4.214 0.002 . 1 . . . A 4 GLU HA . 18802 1 27 . 1 1 4 4 GLU HB2 H 1 1.931 0.020 . 1 . . . A 4 GLU HB2 . 18802 1 28 . 1 1 4 4 GLU HB3 H 1 1.931 0.020 . 1 . . . A 4 GLU HB3 . 18802 1 29 . 1 1 4 4 GLU HG2 H 1 2.198 0.020 . 1 . . . A 4 GLU HG2 . 18802 1 30 . 1 1 4 4 GLU HG3 H 1 2.198 0.020 . 1 . . . A 4 GLU HG3 . 18802 1 31 . 1 1 4 4 GLU C C 13 176.310 0.200 . 1 . . . A 4 GLU C . 18802 1 32 . 1 1 4 4 GLU CA C 13 56.819 0.052 . 1 . . . A 4 GLU CA . 18802 1 33 . 1 1 4 4 GLU CB C 13 30.252 0.200 . 1 . . . A 4 GLU CB . 18802 1 34 . 1 1 4 4 GLU N N 15 122.376 0.031 . 1 . . . A 4 GLU N . 18802 1 35 . 1 1 5 5 GLN H H 1 8.347 0.020 . 1 . . . A 5 GLN H . 18802 1 36 . 1 1 5 5 GLN HA H 1 4.291 0.001 . 1 . . . A 5 GLN HA . 18802 1 37 . 1 1 5 5 GLN HB2 H 1 1.927 0.020 . 2 . . . A 5 GLN HB2 . 18802 1 38 . 1 1 5 5 GLN HB3 H 1 2.054 0.020 . 2 . . . A 5 GLN HB3 . 18802 1 39 . 1 1 5 5 GLN HG2 H 1 2.318 0.020 . 1 . . . A 5 GLN HG2 . 18802 1 40 . 1 1 5 5 GLN HG3 H 1 2.318 0.020 . 1 . . . A 5 GLN HG3 . 18802 1 41 . 1 1 5 5 GLN HE21 H 1 6.779 0.020 . 2 . . . A 5 GLN HE21 . 18802 1 42 . 1 1 5 5 GLN HE22 H 1 7.456 0.020 . 2 . . . A 5 GLN HE22 . 18802 1 43 . 1 1 5 5 GLN C C 13 175.765 0.200 . 1 . . . A 5 GLN C . 18802 1 44 . 1 1 5 5 GLN CA C 13 55.839 0.044 . 1 . . . A 5 GLN CA . 18802 1 45 . 1 1 5 5 GLN CB C 13 29.559 0.200 . 1 . . . A 5 GLN CB . 18802 1 46 . 1 1 5 5 GLN CG C 13 33.897 0.200 . 1 . . . A 5 GLN CG . 18802 1 47 . 1 1 5 5 GLN CD C 13 180.447 0.200 . 1 . . . A 5 GLN CD . 18802 1 48 . 1 1 5 5 GLN N N 15 122.010 0.053 . 1 . . . A 5 GLN N . 18802 1 49 . 1 1 5 5 GLN NE2 N 15 112.257 0.200 . 1 . . . A 5 GLN NE2 . 18802 1 50 . 1 1 6 6 LYS H H 1 8.327 0.038 . 1 . . . A 6 LYS H . 18802 1 51 . 1 1 6 6 LYS HA H 1 4.336 0.006 . 1 . . . A 6 LYS HA . 18802 1 52 . 1 1 6 6 LYS HB2 H 1 1.707 0.004 . 2 . . . A 6 LYS HB2 . 18802 1 53 . 1 1 6 6 LYS HB3 H 1 1.785 0.010 . 2 . . . A 6 LYS HB3 . 18802 1 54 . 1 1 6 6 LYS HG2 H 1 1.363 0.020 . 1 . . . A 6 LYS HG2 . 18802 1 55 . 1 1 6 6 LYS HG3 H 1 1.363 0.020 . 1 . . . A 6 LYS HG3 . 18802 1 56 . 1 1 6 6 LYS HD2 H 1 1.625 0.001 . 1 . . . A 6 LYS HD2 . 18802 1 57 . 1 1 6 6 LYS HD3 H 1 1.625 0.001 . 1 . . . A 6 LYS HD3 . 18802 1 58 . 1 1 6 6 LYS HE2 H 1 2.939 0.035 . 1 . . . A 6 LYS HE2 . 18802 1 59 . 1 1 6 6 LYS HE3 H 1 2.939 0.035 . 1 . . . A 6 LYS HE3 . 18802 1 60 . 1 1 6 6 LYS C C 13 176.474 0.200 . 1 . . . A 6 LYS C . 18802 1 61 . 1 1 6 6 LYS CA C 13 56.391 0.209 . 1 . . . A 6 LYS CA . 18802 1 62 . 1 1 6 6 LYS CB C 13 32.993 0.094 . 1 . . . A 6 LYS CB . 18802 1 63 . 1 1 6 6 LYS CG C 13 24.869 0.200 . 1 . . . A 6 LYS CG . 18802 1 64 . 1 1 6 6 LYS CD C 13 29.070 0.012 . 1 . . . A 6 LYS CD . 18802 1 65 . 1 1 6 6 LYS CE C 13 42.125 0.200 . 1 . . . A 6 LYS CE . 18802 1 66 . 1 1 6 6 LYS N N 15 123.090 0.038 . 1 . . . A 6 LYS N . 18802 1 67 . 1 1 7 7 THR H H 1 8.160 0.008 . 1 . . . A 7 THR H . 18802 1 68 . 1 1 7 7 THR HA H 1 4.273 0.003 . 1 . . . A 7 THR HA . 18802 1 69 . 1 1 7 7 THR HB H 1 4.073 0.020 . 1 . . . A 7 THR HB . 18802 1 70 . 1 1 7 7 THR HG21 H 1 1.125 0.009 . 1 . . . A 7 THR MG . 18802 1 71 . 1 1 7 7 THR HG22 H 1 1.125 0.009 . 1 . . . A 7 THR MG . 18802 1 72 . 1 1 7 7 THR HG23 H 1 1.125 0.009 . 1 . . . A 7 THR MG . 18802 1 73 . 1 1 7 7 THR C C 13 174.071 0.200 . 1 . . . A 7 THR C . 18802 1 74 . 1 1 7 7 THR CA C 13 62.103 0.060 . 1 . . . A 7 THR CA . 18802 1 75 . 1 1 7 7 THR CB C 13 69.899 0.200 . 1 . . . A 7 THR CB . 18802 1 76 . 1 1 7 7 THR CG2 C 13 21.757 0.200 . 1 . . . A 7 THR CG2 . 18802 1 77 . 1 1 7 7 THR N N 15 116.800 0.061 . 1 . . . A 7 THR N . 18802 1 78 . 1 1 8 8 VAL H H 1 8.192 0.005 . 1 . . . A 8 VAL H . 18802 1 79 . 1 1 8 8 VAL HA H 1 4.066 0.003 . 1 . . . A 8 VAL HA . 18802 1 80 . 1 1 8 8 VAL HB H 1 1.970 0.020 . 1 . . . A 8 VAL HB . 18802 1 81 . 1 1 8 8 VAL HG11 H 1 0.807 0.020 . 2 . . . A 8 VAL MG1 . 18802 1 82 . 1 1 8 8 VAL HG12 H 1 0.807 0.020 . 2 . . . A 8 VAL MG1 . 18802 1 83 . 1 1 8 8 VAL HG13 H 1 0.807 0.020 . 2 . . . A 8 VAL MG1 . 18802 1 84 . 1 1 8 8 VAL HG21 H 1 0.865 0.020 . 2 . . . A 8 VAL MG2 . 18802 1 85 . 1 1 8 8 VAL HG22 H 1 0.865 0.020 . 2 . . . A 8 VAL MG2 . 18802 1 86 . 1 1 8 8 VAL HG23 H 1 0.865 0.020 . 2 . . . A 8 VAL MG2 . 18802 1 87 . 1 1 8 8 VAL C C 13 175.573 0.200 . 1 . . . A 8 VAL C . 18802 1 88 . 1 1 8 8 VAL CA C 13 62.344 0.144 . 1 . . . A 8 VAL CA . 18802 1 89 . 1 1 8 8 VAL CB C 13 32.912 0.200 . 1 . . . A 8 VAL CB . 18802 1 90 . 1 1 8 8 VAL CG1 C 13 21.065 0.200 . 2 . . . A 8 VAL CG1 . 18802 1 91 . 1 1 8 8 VAL CG2 C 13 21.007 0.001 . 2 . . . A 8 VAL CG2 . 18802 1 92 . 1 1 8 8 VAL N N 15 124.108 0.042 . 1 . . . A 8 VAL N . 18802 1 93 . 1 1 9 9 ILE H H 1 8.275 0.020 . 1 . . . A 9 ILE H . 18802 1 94 . 1 1 9 9 ILE HA H 1 4.424 0.013 . 1 . . . A 9 ILE HA . 18802 1 95 . 1 1 9 9 ILE HB H 1 1.805 0.009 . 1 . . . A 9 ILE HB . 18802 1 96 . 1 1 9 9 ILE HG12 H 1 1.113 0.006 . 2 . . . A 9 ILE HG12 . 18802 1 97 . 1 1 9 9 ILE HG13 H 1 1.442 0.005 . 2 . . . A 9 ILE HG13 . 18802 1 98 . 1 1 9 9 ILE HG21 H 1 0.889 0.005 . 1 . . . A 9 ILE MG . 18802 1 99 . 1 1 9 9 ILE HG22 H 1 0.889 0.005 . 1 . . . A 9 ILE MG . 18802 1 100 . 1 1 9 9 ILE HG23 H 1 0.889 0.005 . 1 . . . A 9 ILE MG . 18802 1 101 . 1 1 9 9 ILE HD11 H 1 0.802 0.007 . 1 . . . A 9 ILE MD . 18802 1 102 . 1 1 9 9 ILE HD12 H 1 0.802 0.007 . 1 . . . A 9 ILE MD . 18802 1 103 . 1 1 9 9 ILE HD13 H 1 0.802 0.007 . 1 . . . A 9 ILE MD . 18802 1 104 . 1 1 9 9 ILE C C 13 174.335 0.200 . 1 . . . A 9 ILE C . 18802 1 105 . 1 1 9 9 ILE CA C 13 58.394 0.021 . 1 . . . A 9 ILE CA . 18802 1 106 . 1 1 9 9 ILE CB C 13 38.799 0.200 . 1 . . . A 9 ILE CB . 18802 1 107 . 1 1 9 9 ILE CG1 C 13 27.022 0.096 . 1 . . . A 9 ILE CG1 . 18802 1 108 . 1 1 9 9 ILE CG2 C 13 17.166 0.200 . 1 . . . A 9 ILE CG2 . 18802 1 109 . 1 1 9 9 ILE CD1 C 13 12.755 0.200 . 1 . . . A 9 ILE CD1 . 18802 1 110 . 1 1 9 9 ILE N N 15 127.371 0.127 . 1 . . . A 9 ILE N . 18802 1 111 . 1 1 10 10 PRO HA H 1 4.303 0.012 . 1 . . . A 10 PRO HA . 18802 1 112 . 1 1 10 10 PRO HB2 H 1 1.873 0.005 . 2 . . . A 10 PRO HB2 . 18802 1 113 . 1 1 10 10 PRO HB3 H 1 2.244 0.004 . 2 . . . A 10 PRO HB3 . 18802 1 114 . 1 1 10 10 PRO HG2 H 1 1.929 0.002 . 2 . . . A 10 PRO HG2 . 18802 1 115 . 1 1 10 10 PRO HG3 H 1 2.020 0.011 . 2 . . . A 10 PRO HG3 . 18802 1 116 . 1 1 10 10 PRO HD2 H 1 3.646 0.015 . 2 . . . A 10 PRO HD2 . 18802 1 117 . 1 1 10 10 PRO HD3 H 1 3.873 0.013 . 2 . . . A 10 PRO HD3 . 18802 1 118 . 1 1 10 10 PRO C C 13 177.261 0.200 . 1 . . . A 10 PRO C . 18802 1 119 . 1 1 10 10 PRO CA C 13 63.672 0.167 . 1 . . . A 10 PRO CA . 18802 1 120 . 1 1 10 10 PRO CB C 13 32.177 0.012 . 1 . . . A 10 PRO CB . 18802 1 121 . 1 1 10 10 PRO CG C 13 27.520 0.007 . 1 . . . A 10 PRO CG . 18802 1 122 . 1 1 10 10 PRO CD C 13 51.222 0.109 . 1 . . . A 10 PRO CD . 18802 1 123 . 1 1 11 11 GLY H H 1 8.376 0.005 . 1 . . . A 11 GLY H . 18802 1 124 . 1 1 11 11 GLY HA2 H 1 3.826 0.020 . 2 . . . A 11 GLY HA2 . 18802 1 125 . 1 1 11 11 GLY HA3 H 1 3.913 0.020 . 2 . . . A 11 GLY HA3 . 18802 1 126 . 1 1 11 11 GLY C C 13 173.906 0.200 . 1 . . . A 11 GLY C . 18802 1 127 . 1 1 11 11 GLY CA C 13 45.270 0.200 . 1 . . . A 11 GLY CA . 18802 1 128 . 1 1 11 11 GLY N N 15 109.540 0.132 . 1 . . . A 11 GLY N . 18802 1 129 . 1 1 12 12 MET H H 1 7.986 0.006 . 1 . . . A 12 MET H . 18802 1 130 . 1 1 12 12 MET HA H 1 4.780 0.005 . 1 . . . A 12 MET HA . 18802 1 131 . 1 1 12 12 MET HB2 H 1 1.933 0.005 . 2 . . . A 12 MET HB2 . 18802 1 132 . 1 1 12 12 MET HB3 H 1 2.035 0.001 . 2 . . . A 12 MET HB3 . 18802 1 133 . 1 1 12 12 MET HG2 H 1 2.503 0.020 . 2 . . . A 12 MET HG2 . 18802 1 134 . 1 1 12 12 MET HG3 H 1 2.572 0.020 . 2 . . . A 12 MET HG3 . 18802 1 135 . 1 1 12 12 MET C C 13 174.235 0.200 . 1 . . . A 12 MET C . 18802 1 136 . 1 1 12 12 MET CA C 13 53.258 0.013 . 1 . . . A 12 MET CA . 18802 1 137 . 1 1 12 12 MET CB C 13 32.734 0.200 . 1 . . . A 12 MET CB . 18802 1 138 . 1 1 12 12 MET CG C 13 32.172 0.200 . 1 . . . A 12 MET CG . 18802 1 139 . 1 1 12 12 MET N N 15 120.834 0.130 . 1 . . . A 12 MET N . 18802 1 140 . 1 1 13 13 PRO HA H 1 4.462 0.003 . 1 . . . A 13 PRO HA . 18802 1 141 . 1 1 13 13 PRO HB2 H 1 1.889 0.020 . 2 . . . A 13 PRO HB2 . 18802 1 142 . 1 1 13 13 PRO HB3 H 1 2.256 0.020 . 2 . . . A 13 PRO HB3 . 18802 1 143 . 1 1 13 13 PRO HG2 H 1 1.974 0.002 . 1 . . . A 13 PRO HG2 . 18802 1 144 . 1 1 13 13 PRO HG3 H 1 1.974 0.002 . 1 . . . A 13 PRO HG3 . 18802 1 145 . 1 1 13 13 PRO HD2 H 1 3.662 0.002 . 2 . . . A 13 PRO HD2 . 18802 1 146 . 1 1 13 13 PRO HD3 H 1 3.806 0.001 . 2 . . . A 13 PRO HD3 . 18802 1 147 . 1 1 13 13 PRO C C 13 176.736 0.200 . 1 . . . A 13 PRO C . 18802 1 148 . 1 1 13 13 PRO CA C 13 63.258 0.001 . 1 . . . A 13 PRO CA . 18802 1 149 . 1 1 13 13 PRO CB C 13 32.200 0.068 . 1 . . . A 13 PRO CB . 18802 1 150 . 1 1 13 13 PRO CG C 13 27.460 0.001 . 1 . . . A 13 PRO CG . 18802 1 151 . 1 1 13 13 PRO CD C 13 50.756 0.047 . 1 . . . A 13 PRO CD . 18802 1 152 . 1 1 14 14 THR H H 1 8.189 0.020 . 1 . . . A 14 THR H . 18802 1 153 . 1 1 14 14 THR HA H 1 4.226 0.001 . 1 . . . A 14 THR HA . 18802 1 154 . 1 1 14 14 THR HB H 1 4.092 0.016 . 1 . . . A 14 THR HB . 18802 1 155 . 1 1 14 14 THR HG21 H 1 1.177 0.020 . 1 . . . A 14 THR MG . 18802 1 156 . 1 1 14 14 THR HG22 H 1 1.177 0.020 . 1 . . . A 14 THR MG . 18802 1 157 . 1 1 14 14 THR HG23 H 1 1.177 0.020 . 1 . . . A 14 THR MG . 18802 1 158 . 1 1 14 14 THR C C 13 174.164 0.200 . 1 . . . A 14 THR C . 18802 1 159 . 1 1 14 14 THR CA C 13 62.462 0.200 . 1 . . . A 14 THR CA . 18802 1 160 . 1 1 14 14 THR CB C 13 69.874 0.200 . 1 . . . A 14 THR CB . 18802 1 161 . 1 1 14 14 THR CG2 C 13 21.909 0.001 . 1 . . . A 14 THR CG2 . 18802 1 162 . 1 1 14 14 THR N N 15 115.642 0.017 . 1 . . . A 14 THR N . 18802 1 163 . 1 1 15 15 VAL H H 1 8.036 0.020 . 1 . . . A 15 VAL H . 18802 1 164 . 1 1 15 15 VAL HA H 1 4.079 0.020 . 1 . . . A 15 VAL HA . 18802 1 165 . 1 1 15 15 VAL HB H 1 1.948 0.003 . 1 . . . A 15 VAL HB . 18802 1 166 . 1 1 15 15 VAL HG11 H 1 0.814 0.020 . 2 . . . A 15 VAL MG1 . 18802 1 167 . 1 1 15 15 VAL HG12 H 1 0.814 0.020 . 2 . . . A 15 VAL MG1 . 18802 1 168 . 1 1 15 15 VAL HG13 H 1 0.814 0.020 . 2 . . . A 15 VAL MG1 . 18802 1 169 . 1 1 15 15 VAL HG21 H 1 0.867 0.003 . 2 . . . A 15 VAL MG2 . 18802 1 170 . 1 1 15 15 VAL HG22 H 1 0.867 0.003 . 2 . . . A 15 VAL MG2 . 18802 1 171 . 1 1 15 15 VAL HG23 H 1 0.867 0.003 . 2 . . . A 15 VAL MG2 . 18802 1 172 . 1 1 15 15 VAL C C 13 175.177 0.200 . 1 . . . A 15 VAL C . 18802 1 173 . 1 1 15 15 VAL CA C 13 61.991 0.200 . 1 . . . A 15 VAL CA . 18802 1 174 . 1 1 15 15 VAL CB C 13 32.898 0.200 . 1 . . . A 15 VAL CB . 18802 1 175 . 1 1 15 15 VAL CG1 C 13 21.103 0.200 . 2 . . . A 15 VAL CG1 . 18802 1 176 . 1 1 15 15 VAL CG2 C 13 21.346 0.200 . 2 . . . A 15 VAL CG2 . 18802 1 177 . 1 1 15 15 VAL N N 15 123.700 0.052 . 1 . . . A 15 VAL N . 18802 1 178 . 1 1 16 16 ILE H H 1 8.236 0.005 . 1 . . . A 16 ILE H . 18802 1 179 . 1 1 16 16 ILE HA H 1 4.177 0.002 . 1 . . . A 16 ILE HA . 18802 1 180 . 1 1 16 16 ILE HB H 1 1.715 0.002 . 1 . . . A 16 ILE HB . 18802 1 181 . 1 1 16 16 ILE HG12 H 1 1.104 0.018 . 2 . . . A 16 ILE HG12 . 18802 1 182 . 1 1 16 16 ILE HG13 H 1 1.452 0.015 . 2 . . . A 16 ILE HG13 . 18802 1 183 . 1 1 16 16 ILE HG21 H 1 0.802 0.037 . 1 . . . A 16 ILE MG . 18802 1 184 . 1 1 16 16 ILE HG22 H 1 0.802 0.037 . 1 . . . A 16 ILE MG . 18802 1 185 . 1 1 16 16 ILE HG23 H 1 0.802 0.037 . 1 . . . A 16 ILE MG . 18802 1 186 . 1 1 16 16 ILE HD11 H 1 0.792 0.005 . 1 . . . A 16 ILE MD . 18802 1 187 . 1 1 16 16 ILE HD12 H 1 0.792 0.005 . 1 . . . A 16 ILE MD . 18802 1 188 . 1 1 16 16 ILE HD13 H 1 0.792 0.005 . 1 . . . A 16 ILE MD . 18802 1 189 . 1 1 16 16 ILE C C 13 173.894 0.200 . 1 . . . A 16 ILE C . 18802 1 190 . 1 1 16 16 ILE CA C 13 57.911 0.010 . 1 . . . A 16 ILE CA . 18802 1 191 . 1 1 16 16 ILE CB C 13 38.633 0.200 . 1 . . . A 16 ILE CB . 18802 1 192 . 1 1 16 16 ILE CG1 C 13 27.383 0.071 . 1 . . . A 16 ILE CG1 . 18802 1 193 . 1 1 16 16 ILE CG2 C 13 16.961 0.200 . 1 . . . A 16 ILE CG2 . 18802 1 194 . 1 1 16 16 ILE CD1 C 13 12.568 0.200 . 1 . . . A 16 ILE CD1 . 18802 1 195 . 1 1 16 16 ILE N N 15 127.780 0.200 . 1 . . . A 16 ILE N . 18802 1 196 . 1 1 17 17 PRO HA H 1 4.491 0.008 . 1 . . . A 17 PRO HA . 18802 1 197 . 1 1 17 17 PRO HB2 H 1 2.251 0.020 . 2 . . . A 17 PRO HB2 . 18802 1 198 . 1 1 17 17 PRO HB3 H 1 1.666 0.020 . 2 . . . A 17 PRO HB3 . 18802 1 199 . 1 1 17 17 PRO HG2 H 1 1.751 0.001 . 1 . . . A 17 PRO HG2 . 18802 1 200 . 1 1 17 17 PRO HG3 H 1 1.751 0.001 . 1 . . . A 17 PRO HG3 . 18802 1 201 . 1 1 17 17 PRO HD2 H 1 2.882 0.002 . 2 . . . A 17 PRO HD2 . 18802 1 202 . 1 1 17 17 PRO HD3 H 1 3.470 0.003 . 2 . . . A 17 PRO HD3 . 18802 1 203 . 1 1 17 17 PRO CA C 13 61.624 0.024 . 1 . . . A 17 PRO CA . 18802 1 204 . 1 1 17 17 PRO CB C 13 31.102 0.200 . 1 . . . A 17 PRO CB . 18802 1 205 . 1 1 17 17 PRO CG C 13 27.414 0.200 . 1 . . . A 17 PRO CG . 18802 1 206 . 1 1 17 17 PRO CD C 13 50.868 0.082 . 1 . . . A 17 PRO CD . 18802 1 207 . 1 1 18 18 PRO HA H 1 4.255 0.020 . 1 . . . A 18 PRO HA . 18802 1 208 . 1 1 18 18 PRO HB2 H 1 1.853 0.020 . 2 . . . A 18 PRO HB2 . 18802 1 209 . 1 1 18 18 PRO HB3 H 1 2.198 0.020 . 2 . . . A 18 PRO HB3 . 18802 1 210 . 1 1 18 18 PRO HG2 H 1 1.907 0.020 . 1 . . . A 18 PRO HG2 . 18802 1 211 . 1 1 18 18 PRO HG3 H 1 1.907 0.020 . 1 . . . A 18 PRO HG3 . 18802 1 212 . 1 1 18 18 PRO HD2 H 1 3.554 0.001 . 2 . . . A 18 PRO HD2 . 18802 1 213 . 1 1 18 18 PRO HD3 H 1 3.688 0.003 . 2 . . . A 18 PRO HD3 . 18802 1 214 . 1 1 18 18 PRO C C 13 177.721 0.200 . 1 . . . A 18 PRO C . 18802 1 215 . 1 1 18 18 PRO CA C 13 62.800 0.200 . 1 . . . A 18 PRO CA . 18802 1 216 . 1 1 18 18 PRO CB C 13 32.355 0.200 . 1 . . . A 18 PRO CB . 18802 1 217 . 1 1 18 18 PRO CG C 13 27.299 0.200 . 1 . . . A 18 PRO CG . 18802 1 218 . 1 1 18 18 PRO CD C 13 50.436 0.108 . 1 . . . A 18 PRO CD . 18802 1 219 . 1 1 19 19 GLY H H 1 8.321 0.026 . 1 . . . A 19 GLY H . 18802 1 220 . 1 1 19 19 GLY HA2 H 1 3.909 0.005 . 2 . . . A 19 GLY HA2 . 18802 1 221 . 1 1 19 19 GLY HA3 H 1 3.732 0.003 . 2 . . . A 19 GLY HA3 . 18802 1 222 . 1 1 19 19 GLY C C 13 174.642 0.200 . 1 . . . A 19 GLY C . 18802 1 223 . 1 1 19 19 GLY CA C 13 45.718 0.200 . 1 . . . A 19 GLY CA . 18802 1 224 . 1 1 19 19 GLY N N 15 107.305 0.049 . 1 . . . A 19 GLY N . 18802 1 225 . 1 1 20 20 LEU H H 1 8.043 0.031 . 1 . . . A 20 LEU H . 18802 1 226 . 1 1 20 20 LEU HA H 1 4.529 0.011 . 1 . . . A 20 LEU HA . 18802 1 227 . 1 1 20 20 LEU HB2 H 1 1.537 0.010 . 2 . . . A 20 LEU HB2 . 18802 1 228 . 1 1 20 20 LEU HB3 H 1 1.731 0.020 . 2 . . . A 20 LEU HB3 . 18802 1 229 . 1 1 20 20 LEU HG H 1 1.546 0.020 . 1 . . . A 20 LEU HG . 18802 1 230 . 1 1 20 20 LEU HD11 H 1 0.598 0.009 . 2 . . . A 20 LEU MD1 . 18802 1 231 . 1 1 20 20 LEU HD12 H 1 0.598 0.009 . 2 . . . A 20 LEU MD1 . 18802 1 232 . 1 1 20 20 LEU HD13 H 1 0.598 0.009 . 2 . . . A 20 LEU MD1 . 18802 1 233 . 1 1 20 20 LEU HD21 H 1 0.663 0.020 . 2 . . . A 20 LEU MD2 . 18802 1 234 . 1 1 20 20 LEU HD22 H 1 0.663 0.020 . 2 . . . A 20 LEU MD2 . 18802 1 235 . 1 1 20 20 LEU HD23 H 1 0.663 0.020 . 2 . . . A 20 LEU MD2 . 18802 1 236 . 1 1 20 20 LEU C C 13 178.580 0.200 . 1 . . . A 20 LEU C . 18802 1 237 . 1 1 20 20 LEU CA C 13 54.550 0.200 . 1 . . . A 20 LEU CA . 18802 1 238 . 1 1 20 20 LEU CB C 13 42.579 0.005 . 1 . . . A 20 LEU CB . 18802 1 239 . 1 1 20 20 LEU CG C 13 26.624 0.200 . 1 . . . A 20 LEU CG . 18802 1 240 . 1 1 20 20 LEU CD1 C 13 25.602 0.025 . 2 . . . A 20 LEU CD1 . 18802 1 241 . 1 1 20 20 LEU CD2 C 13 22.331 0.006 . 2 . . . A 20 LEU CD2 . 18802 1 242 . 1 1 20 20 LEU N N 15 120.897 0.081 . 1 . . . A 20 LEU N . 18802 1 243 . 1 1 21 21 THR H H 1 8.427 0.020 . 1 . . . A 21 THR H . 18802 1 244 . 1 1 21 21 THR HA H 1 4.386 0.001 . 1 . . . A 21 THR HA . 18802 1 245 . 1 1 21 21 THR HB H 1 4.661 0.020 . 1 . . . A 21 THR HB . 18802 1 246 . 1 1 21 21 THR HG21 H 1 1.278 0.020 . 1 . . . A 21 THR MG . 18802 1 247 . 1 1 21 21 THR HG22 H 1 1.278 0.020 . 1 . . . A 21 THR MG . 18802 1 248 . 1 1 21 21 THR HG23 H 1 1.278 0.020 . 1 . . . A 21 THR MG . 18802 1 249 . 1 1 21 21 THR C C 13 175.377 0.200 . 1 . . . A 21 THR C . 18802 1 250 . 1 1 21 21 THR CA C 13 61.188 0.025 . 1 . . . A 21 THR CA . 18802 1 251 . 1 1 21 21 THR CB C 13 71.043 0.200 . 1 . . . A 21 THR CB . 18802 1 252 . 1 1 21 21 THR CG2 C 13 21.678 0.200 . 1 . . . A 21 THR CG2 . 18802 1 253 . 1 1 21 21 THR N N 15 113.195 0.050 . 1 . . . A 21 THR N . 18802 1 254 . 1 1 22 22 ARG H H 1 8.832 0.020 . 1 . . . A 22 ARG H . 18802 1 255 . 1 1 22 22 ARG HA H 1 4.037 0.014 . 1 . . . A 22 ARG HA . 18802 1 256 . 1 1 22 22 ARG HB2 H 1 1.784 0.005 . 2 . . . A 22 ARG HB2 . 18802 1 257 . 1 1 22 22 ARG HB3 H 1 1.869 0.005 . 2 . . . A 22 ARG HB3 . 18802 1 258 . 1 1 22 22 ARG HG2 H 1 1.627 0.010 . 2 . . . A 22 ARG HG2 . 18802 1 259 . 1 1 22 22 ARG HG3 H 1 1.719 0.021 . 2 . . . A 22 ARG HG3 . 18802 1 260 . 1 1 22 22 ARG HD2 H 1 3.194 0.011 . 1 . . . A 22 ARG HD2 . 18802 1 261 . 1 1 22 22 ARG HD3 H 1 3.194 0.011 . 1 . . . A 22 ARG HD3 . 18802 1 262 . 1 1 22 22 ARG C C 13 179.309 0.200 . 1 . . . A 22 ARG C . 18802 1 263 . 1 1 22 22 ARG CA C 13 59.384 0.102 . 1 . . . A 22 ARG CA . 18802 1 264 . 1 1 22 22 ARG CB C 13 29.816 0.046 . 1 . . . A 22 ARG CB . 18802 1 265 . 1 1 22 22 ARG CG C 13 26.970 0.200 . 1 . . . A 22 ARG CG . 18802 1 266 . 1 1 22 22 ARG CD C 13 43.341 0.173 . 1 . . . A 22 ARG CD . 18802 1 267 . 1 1 22 22 ARG N N 15 121.322 0.062 . 1 . . . A 22 ARG N . 18802 1 268 . 1 1 23 23 GLU H H 1 8.754 0.008 . 1 . . . A 23 GLU H . 18802 1 269 . 1 1 23 23 GLU HA H 1 4.009 0.004 . 1 . . . A 23 GLU HA . 18802 1 270 . 1 1 23 23 GLU HB2 H 1 2.016 0.005 . 2 . . . A 23 GLU HB2 . 18802 1 271 . 1 1 23 23 GLU HB3 H 1 1.960 0.004 . 2 . . . A 23 GLU HB3 . 18802 1 272 . 1 1 23 23 GLU HG2 H 1 2.220 0.002 . 2 . . . A 23 GLU HG2 . 18802 1 273 . 1 1 23 23 GLU HG3 H 1 2.419 0.002 . 2 . . . A 23 GLU HG3 . 18802 1 274 . 1 1 23 23 GLU C C 13 178.931 0.200 . 1 . . . A 23 GLU C . 18802 1 275 . 1 1 23 23 GLU CA C 13 60.276 0.058 . 1 . . . A 23 GLU CA . 18802 1 276 . 1 1 23 23 GLU CB C 13 29.291 0.063 . 1 . . . A 23 GLU CB . 18802 1 277 . 1 1 23 23 GLU CG C 13 37.424 0.024 . 1 . . . A 23 GLU CG . 18802 1 278 . 1 1 23 23 GLU N N 15 119.109 0.039 . 1 . . . A 23 GLU N . 18802 1 279 . 1 1 24 24 GLN H H 1 7.711 0.010 . 1 . . . A 24 GLN H . 18802 1 280 . 1 1 24 24 GLN HA H 1 4.066 0.003 . 1 . . . A 24 GLN HA . 18802 1 281 . 1 1 24 24 GLN HB2 H 1 1.973 0.020 . 2 . . . A 24 GLN HB2 . 18802 1 282 . 1 1 24 24 GLN HB3 H 1 2.315 0.018 . 2 . . . A 24 GLN HB3 . 18802 1 283 . 1 1 24 24 GLN HG2 H 1 2.436 0.006 . 1 . . . A 24 GLN HG2 . 18802 1 284 . 1 1 24 24 GLN HG3 H 1 2.436 0.006 . 1 . . . A 24 GLN HG3 . 18802 1 285 . 1 1 24 24 GLN HE21 H 1 6.735 0.020 . 2 . . . A 24 GLN HE21 . 18802 1 286 . 1 1 24 24 GLN HE22 H 1 7.456 0.020 . 2 . . . A 24 GLN HE22 . 18802 1 287 . 1 1 24 24 GLN C C 13 179.286 0.200 . 1 . . . A 24 GLN C . 18802 1 288 . 1 1 24 24 GLN CA C 13 58.215 0.033 . 1 . . . A 24 GLN CA . 18802 1 289 . 1 1 24 24 GLN CB C 13 29.667 0.112 . 1 . . . A 24 GLN CB . 18802 1 290 . 1 1 24 24 GLN CG C 13 34.459 0.044 . 1 . . . A 24 GLN CG . 18802 1 291 . 1 1 24 24 GLN CD C 13 179.961 0.200 . 1 . . . A 24 GLN CD . 18802 1 292 . 1 1 24 24 GLN N N 15 119.556 0.036 . 1 . . . A 24 GLN N . 18802 1 293 . 1 1 24 24 GLN NE2 N 15 110.750 0.282 . 1 . . . A 24 GLN NE2 . 18802 1 294 . 1 1 25 25 GLU H H 1 8.730 0.020 . 1 . . . A 25 GLU H . 18802 1 295 . 1 1 25 25 GLU HA H 1 3.873 0.005 . 1 . . . A 25 GLU HA . 18802 1 296 . 1 1 25 25 GLU HB2 H 1 2.094 0.020 . 2 . . . A 25 GLU HB2 . 18802 1 297 . 1 1 25 25 GLU HB3 H 1 2.035 0.020 . 2 . . . A 25 GLU HB3 . 18802 1 298 . 1 1 25 25 GLU HG2 H 1 2.079 0.005 . 2 . . . A 25 GLU HG2 . 18802 1 299 . 1 1 25 25 GLU HG3 H 1 2.330 0.005 . 2 . . . A 25 GLU HG3 . 18802 1 300 . 1 1 25 25 GLU C C 13 177.879 0.200 . 1 . . . A 25 GLU C . 18802 1 301 . 1 1 25 25 GLU CA C 13 59.958 0.055 . 1 . . . A 25 GLU CA . 18802 1 302 . 1 1 25 25 GLU CB C 13 29.778 0.044 . 1 . . . A 25 GLU CB . 18802 1 303 . 1 1 25 25 GLU CG C 13 37.303 0.053 . 1 . . . A 25 GLU CG . 18802 1 304 . 1 1 25 25 GLU N N 15 122.227 0.072 . 1 . . . A 25 GLU N . 18802 1 305 . 1 1 26 26 ARG H H 1 7.906 0.009 . 1 . . . A 26 ARG H . 18802 1 306 . 1 1 26 26 ARG HA H 1 4.069 0.002 . 1 . . . A 26 ARG HA . 18802 1 307 . 1 1 26 26 ARG HB2 H 1 1.902 0.003 . 2 . . . A 26 ARG HB2 . 18802 1 308 . 1 1 26 26 ARG HB3 H 1 2.002 0.008 . 2 . . . A 26 ARG HB3 . 18802 1 309 . 1 1 26 26 ARG HG2 H 1 1.750 0.001 . 2 . . . A 26 ARG HG2 . 18802 1 310 . 1 1 26 26 ARG HG3 H 1 1.413 0.020 . 2 . . . A 26 ARG HG3 . 18802 1 311 . 1 1 26 26 ARG HD2 H 1 3.202 0.007 . 2 . . . A 26 ARG HD2 . 18802 1 312 . 1 1 26 26 ARG HD3 H 1 3.007 0.007 . 2 . . . A 26 ARG HD3 . 18802 1 313 . 1 1 26 26 ARG C C 13 177.567 0.200 . 1 . . . A 26 ARG C . 18802 1 314 . 1 1 26 26 ARG CA C 13 58.226 0.045 . 1 . . . A 26 ARG CA . 18802 1 315 . 1 1 26 26 ARG CB C 13 29.096 0.063 . 1 . . . A 26 ARG CB . 18802 1 316 . 1 1 26 26 ARG CG C 13 26.400 0.200 . 1 . . . A 26 ARG CG . 18802 1 317 . 1 1 26 26 ARG CD C 13 43.042 0.200 . 1 . . . A 26 ARG CD . 18802 1 318 . 1 1 26 26 ARG N N 15 119.109 0.055 . 1 . . . A 26 ARG N . 18802 1 319 . 1 1 27 27 ALA H H 1 7.956 0.018 . 1 . . . A 27 ALA H . 18802 1 320 . 1 1 27 27 ALA HA H 1 3.804 0.002 . 1 . . . A 27 ALA HA . 18802 1 321 . 1 1 27 27 ALA HB1 H 1 1.393 0.003 . 1 . . . A 27 ALA MB . 18802 1 322 . 1 1 27 27 ALA HB2 H 1 1.393 0.003 . 1 . . . A 27 ALA MB . 18802 1 323 . 1 1 27 27 ALA HB3 H 1 1.393 0.003 . 1 . . . A 27 ALA MB . 18802 1 324 . 1 1 27 27 ALA C C 13 178.740 0.200 . 1 . . . A 27 ALA C . 18802 1 325 . 1 1 27 27 ALA CA C 13 55.235 0.030 . 1 . . . A 27 ALA CA . 18802 1 326 . 1 1 27 27 ALA CB C 13 18.259 0.067 . 1 . . . A 27 ALA CB . 18802 1 327 . 1 1 27 27 ALA N N 15 119.411 0.030 . 1 . . . A 27 ALA N . 18802 1 328 . 1 1 28 28 TYR H H 1 7.854 0.018 . 1 . . . A 28 TYR H . 18802 1 329 . 1 1 28 28 TYR HA H 1 4.058 0.005 . 1 . . . A 28 TYR HA . 18802 1 330 . 1 1 28 28 TYR HB2 H 1 3.194 0.006 . 2 . . . A 28 TYR HB2 . 18802 1 331 . 1 1 28 28 TYR HB3 H 1 3.083 0.006 . 2 . . . A 28 TYR HB3 . 18802 1 332 . 1 1 28 28 TYR HD1 H 1 7.022 0.020 . 1 . . . A 28 TYR HD1 . 18802 1 333 . 1 1 28 28 TYR HD2 H 1 7.022 0.020 . 1 . . . A 28 TYR HD2 . 18802 1 334 . 1 1 28 28 TYR HE1 H 1 6.762 0.006 . 1 . . . A 28 TYR HE1 . 18802 1 335 . 1 1 28 28 TYR HE2 H 1 6.762 0.006 . 1 . . . A 28 TYR HE2 . 18802 1 336 . 1 1 28 28 TYR C C 13 177.367 0.200 . 1 . . . A 28 TYR C . 18802 1 337 . 1 1 28 28 TYR CA C 13 61.605 0.119 . 1 . . . A 28 TYR CA . 18802 1 338 . 1 1 28 28 TYR CB C 13 38.709 0.188 . 1 . . . A 28 TYR CB . 18802 1 339 . 1 1 28 28 TYR CD1 C 13 132.910 0.200 . 1 . . . A 28 TYR CD1 . 18802 1 340 . 1 1 28 28 TYR CD2 C 13 132.910 0.200 . 1 . . . A 28 TYR CD2 . 18802 1 341 . 1 1 28 28 TYR CE1 C 13 118.394 0.016 . 1 . . . A 28 TYR CE1 . 18802 1 342 . 1 1 28 28 TYR CE2 C 13 118.394 0.016 . 1 . . . A 28 TYR CE2 . 18802 1 343 . 1 1 28 28 TYR N N 15 119.160 0.078 . 1 . . . A 28 TYR N . 18802 1 344 . 1 1 29 29 ILE H H 1 7.809 0.016 . 1 . . . A 29 ILE H . 18802 1 345 . 1 1 29 29 ILE HA H 1 3.602 0.003 . 1 . . . A 29 ILE HA . 18802 1 346 . 1 1 29 29 ILE HB H 1 2.018 0.006 . 1 . . . A 29 ILE HB . 18802 1 347 . 1 1 29 29 ILE HG12 H 1 1.338 0.003 . 2 . . . A 29 ILE HG12 . 18802 1 348 . 1 1 29 29 ILE HG13 H 1 1.758 0.008 . 2 . . . A 29 ILE HG13 . 18802 1 349 . 1 1 29 29 ILE HG21 H 1 0.903 0.005 . 1 . . . A 29 ILE MG . 18802 1 350 . 1 1 29 29 ILE HG22 H 1 0.903 0.005 . 1 . . . A 29 ILE MG . 18802 1 351 . 1 1 29 29 ILE HG23 H 1 0.903 0.005 . 1 . . . A 29 ILE MG . 18802 1 352 . 1 1 29 29 ILE HD11 H 1 0.876 0.012 . 1 . . . A 29 ILE MD . 18802 1 353 . 1 1 29 29 ILE HD12 H 1 0.876 0.012 . 1 . . . A 29 ILE MD . 18802 1 354 . 1 1 29 29 ILE HD13 H 1 0.876 0.012 . 1 . . . A 29 ILE MD . 18802 1 355 . 1 1 29 29 ILE C C 13 178.711 0.200 . 1 . . . A 29 ILE C . 18802 1 356 . 1 1 29 29 ILE CA C 13 64.188 0.072 . 1 . . . A 29 ILE CA . 18802 1 357 . 1 1 29 29 ILE CB C 13 38.314 0.040 . 1 . . . A 29 ILE CB . 18802 1 358 . 1 1 29 29 ILE CG1 C 13 29.087 0.062 . 1 . . . A 29 ILE CG1 . 18802 1 359 . 1 1 29 29 ILE CG2 C 13 17.509 0.137 . 1 . . . A 29 ILE CG2 . 18802 1 360 . 1 1 29 29 ILE CD1 C 13 12.900 0.018 . 1 . . . A 29 ILE CD1 . 18802 1 361 . 1 1 29 29 ILE N N 15 119.173 0.200 . 1 . . . A 29 ILE N . 18802 1 362 . 1 1 30 30 VAL H H 1 8.572 0.017 . 1 . . . A 30 VAL H . 18802 1 363 . 1 1 30 30 VAL HA H 1 3.474 0.005 . 1 . . . A 30 VAL HA . 18802 1 364 . 1 1 30 30 VAL HB H 1 1.985 0.013 . 1 . . . A 30 VAL HB . 18802 1 365 . 1 1 30 30 VAL HG11 H 1 0.826 0.020 . 2 . . . A 30 VAL MG1 . 18802 1 366 . 1 1 30 30 VAL HG12 H 1 0.826 0.020 . 2 . . . A 30 VAL MG1 . 18802 1 367 . 1 1 30 30 VAL HG13 H 1 0.826 0.020 . 2 . . . A 30 VAL MG1 . 18802 1 368 . 1 1 30 30 VAL HG21 H 1 0.777 0.020 . 2 . . . A 30 VAL MG2 . 18802 1 369 . 1 1 30 30 VAL HG22 H 1 0.777 0.020 . 2 . . . A 30 VAL MG2 . 18802 1 370 . 1 1 30 30 VAL HG23 H 1 0.777 0.020 . 2 . . . A 30 VAL MG2 . 18802 1 371 . 1 1 30 30 VAL C C 13 177.992 0.200 . 1 . . . A 30 VAL C . 18802 1 372 . 1 1 30 30 VAL CA C 13 66.995 0.065 . 1 . . . A 30 VAL CA . 18802 1 373 . 1 1 30 30 VAL CB C 13 31.231 0.200 . 1 . . . A 30 VAL CB . 18802 1 374 . 1 1 30 30 VAL CG1 C 13 23.423 0.200 . 2 . . . A 30 VAL CG1 . 18802 1 375 . 1 1 30 30 VAL CG2 C 13 23.695 0.200 . 2 . . . A 30 VAL CG2 . 18802 1 376 . 1 1 30 30 VAL N N 15 121.549 0.052 . 1 . . . A 30 VAL N . 18802 1 377 . 1 1 31 31 GLN H H 1 8.183 0.012 . 1 . . . A 31 GLN H . 18802 1 378 . 1 1 31 31 GLN HA H 1 3.701 0.004 . 1 . . . A 31 GLN HA . 18802 1 379 . 1 1 31 31 GLN HB2 H 1 2.104 0.009 . 1 . . . A 31 GLN HB2 . 18802 1 380 . 1 1 31 31 GLN HB3 H 1 2.104 0.009 . 1 . . . A 31 GLN HB3 . 18802 1 381 . 1 1 31 31 GLN HG2 H 1 2.241 0.010 . 2 . . . A 31 GLN HG2 . 18802 1 382 . 1 1 31 31 GLN HG3 H 1 2.421 0.004 . 2 . . . A 31 GLN HG3 . 18802 1 383 . 1 1 31 31 GLN HE21 H 1 6.819 0.018 . 2 . . . A 31 GLN HE21 . 18802 1 384 . 1 1 31 31 GLN HE22 H 1 7.408 0.005 . 2 . . . A 31 GLN HE22 . 18802 1 385 . 1 1 31 31 GLN C C 13 178.604 0.200 . 1 . . . A 31 GLN C . 18802 1 386 . 1 1 31 31 GLN CA C 13 60.195 0.072 . 1 . . . A 31 GLN CA . 18802 1 387 . 1 1 31 31 GLN CB C 13 28.142 0.074 . 1 . . . A 31 GLN CB . 18802 1 388 . 1 1 31 31 GLN CG C 13 34.440 0.062 . 1 . . . A 31 GLN CG . 18802 1 389 . 1 1 31 31 GLN CD C 13 179.945 0.200 . 1 . . . A 31 GLN CD . 18802 1 390 . 1 1 31 31 GLN N N 15 119.997 0.041 . 1 . . . A 31 GLN N . 18802 1 391 . 1 1 31 31 GLN NE2 N 15 110.834 0.200 . 1 . . . A 31 GLN NE2 . 18802 1 392 . 1 1 32 32 LEU H H 1 7.586 0.007 . 1 . . . A 32 LEU H . 18802 1 393 . 1 1 32 32 LEU HA H 1 3.946 0.004 . 1 . . . A 32 LEU HA . 18802 1 394 . 1 1 32 32 LEU HB2 H 1 1.772 0.004 . 2 . . . A 32 LEU HB2 . 18802 1 395 . 1 1 32 32 LEU HB3 H 1 1.447 0.005 . 2 . . . A 32 LEU HB3 . 18802 1 396 . 1 1 32 32 LEU HG H 1 1.522 0.010 . 1 . . . A 32 LEU HG . 18802 1 397 . 1 1 32 32 LEU HD11 H 1 0.694 0.006 . 2 . . . A 32 LEU MD1 . 18802 1 398 . 1 1 32 32 LEU HD12 H 1 0.694 0.006 . 2 . . . A 32 LEU MD1 . 18802 1 399 . 1 1 32 32 LEU HD13 H 1 0.694 0.006 . 2 . . . A 32 LEU MD1 . 18802 1 400 . 1 1 32 32 LEU HD21 H 1 0.730 0.017 . 2 . . . A 32 LEU MD2 . 18802 1 401 . 1 1 32 32 LEU HD22 H 1 0.730 0.017 . 2 . . . A 32 LEU MD2 . 18802 1 402 . 1 1 32 32 LEU HD23 H 1 0.730 0.017 . 2 . . . A 32 LEU MD2 . 18802 1 403 . 1 1 32 32 LEU C C 13 180.439 0.200 . 1 . . . A 32 LEU C . 18802 1 404 . 1 1 32 32 LEU CA C 13 58.235 0.073 . 1 . . . A 32 LEU CA . 18802 1 405 . 1 1 32 32 LEU CB C 13 41.849 0.078 . 1 . . . A 32 LEU CB . 18802 1 406 . 1 1 32 32 LEU CG C 13 26.815 0.081 . 1 . . . A 32 LEU CG . 18802 1 407 . 1 1 32 32 LEU CD1 C 13 25.552 0.090 . 2 . . . A 32 LEU CD1 . 18802 1 408 . 1 1 32 32 LEU CD2 C 13 23.279 0.008 . 2 . . . A 32 LEU CD2 . 18802 1 409 . 1 1 32 32 LEU N N 15 119.605 0.040 . 1 . . . A 32 LEU N . 18802 1 410 . 1 1 33 33 GLN H H 1 8.046 0.007 . 1 . . . A 33 GLN H . 18802 1 411 . 1 1 33 33 GLN HA H 1 4.109 0.005 . 1 . . . A 33 GLN HA . 18802 1 412 . 1 1 33 33 GLN HB2 H 1 2.013 0.007 . 2 . . . A 33 GLN HB2 . 18802 1 413 . 1 1 33 33 GLN HB3 H 1 2.273 0.014 . 2 . . . A 33 GLN HB3 . 18802 1 414 . 1 1 33 33 GLN HG2 H 1 2.274 0.020 . 2 . . . A 33 GLN HG2 . 18802 1 415 . 1 1 33 33 GLN HG3 H 1 2.594 0.005 . 2 . . . A 33 GLN HG3 . 18802 1 416 . 1 1 33 33 GLN HE21 H 1 6.580 0.006 . 2 . . . A 33 GLN HE21 . 18802 1 417 . 1 1 33 33 GLN HE22 H 1 6.912 0.001 . 2 . . . A 33 GLN HE22 . 18802 1 418 . 1 1 33 33 GLN C C 13 179.166 0.200 . 1 . . . A 33 GLN C . 18802 1 419 . 1 1 33 33 GLN CA C 13 59.390 0.045 . 1 . . . A 33 GLN CA . 18802 1 420 . 1 1 33 33 GLN CB C 13 29.490 0.156 . 1 . . . A 33 GLN CB . 18802 1 421 . 1 1 33 33 GLN CG C 13 34.855 0.046 . 1 . . . A 33 GLN CG . 18802 1 422 . 1 1 33 33 GLN CD C 13 179.334 0.200 . 1 . . . A 33 GLN CD . 18802 1 423 . 1 1 33 33 GLN N N 15 120.332 0.108 . 1 . . . A 33 GLN N . 18802 1 424 . 1 1 33 33 GLN NE2 N 15 108.422 0.200 . 1 . . . A 33 GLN NE2 . 18802 1 425 . 1 1 34 34 ILE H H 1 8.778 0.020 . 1 . . . A 34 ILE H . 18802 1 426 . 1 1 34 34 ILE HA H 1 3.405 0.007 . 1 . . . A 34 ILE HA . 18802 1 427 . 1 1 34 34 ILE HB H 1 1.977 0.006 . 1 . . . A 34 ILE HB . 18802 1 428 . 1 1 34 34 ILE HG12 H 1 1.953 0.012 . 2 . . . A 34 ILE HG12 . 18802 1 429 . 1 1 34 34 ILE HG13 H 1 0.657 0.017 . 2 . . . A 34 ILE HG13 . 18802 1 430 . 1 1 34 34 ILE HG21 H 1 0.820 0.011 . 1 . . . A 34 ILE MG . 18802 1 431 . 1 1 34 34 ILE HG22 H 1 0.820 0.011 . 1 . . . A 34 ILE MG . 18802 1 432 . 1 1 34 34 ILE HG23 H 1 0.820 0.011 . 1 . . . A 34 ILE MG . 18802 1 433 . 1 1 34 34 ILE HD11 H 1 0.511 0.020 . 1 . . . A 34 ILE MD . 18802 1 434 . 1 1 34 34 ILE HD12 H 1 0.511 0.020 . 1 . . . A 34 ILE MD . 18802 1 435 . 1 1 34 34 ILE HD13 H 1 0.511 0.020 . 1 . . . A 34 ILE MD . 18802 1 436 . 1 1 34 34 ILE C C 13 179.368 0.200 . 1 . . . A 34 ILE C . 18802 1 437 . 1 1 34 34 ILE CA C 13 67.066 0.153 . 1 . . . A 34 ILE CA . 18802 1 438 . 1 1 34 34 ILE CB C 13 38.256 0.089 . 1 . . . A 34 ILE CB . 18802 1 439 . 1 1 34 34 ILE CG1 C 13 31.305 0.178 . 1 . . . A 34 ILE CG1 . 18802 1 440 . 1 1 34 34 ILE CG2 C 13 17.440 0.038 . 1 . . . A 34 ILE CG2 . 18802 1 441 . 1 1 34 34 ILE CD1 C 13 15.274 0.032 . 1 . . . A 34 ILE CD1 . 18802 1 442 . 1 1 34 34 ILE N N 15 120.945 0.064 . 1 . . . A 34 ILE N . 18802 1 443 . 1 1 35 35 GLU H H 1 8.305 0.024 . 1 . . . A 35 GLU H . 18802 1 444 . 1 1 35 35 GLU HA H 1 4.047 0.007 . 1 . . . A 35 GLU HA . 18802 1 445 . 1 1 35 35 GLU HB2 H 1 2.078 0.014 . 2 . . . A 35 GLU HB2 . 18802 1 446 . 1 1 35 35 GLU HB3 H 1 2.176 0.007 . 2 . . . A 35 GLU HB3 . 18802 1 447 . 1 1 35 35 GLU HG2 H 1 2.463 0.010 . 2 . . . A 35 GLU HG2 . 18802 1 448 . 1 1 35 35 GLU HG3 H 1 2.288 0.006 . 2 . . . A 35 GLU HG3 . 18802 1 449 . 1 1 35 35 GLU C C 13 178.901 0.200 . 1 . . . A 35 GLU C . 18802 1 450 . 1 1 35 35 GLU CA C 13 59.864 0.065 . 1 . . . A 35 GLU CA . 18802 1 451 . 1 1 35 35 GLU CB C 13 29.536 0.121 . 1 . . . A 35 GLU CB . 18802 1 452 . 1 1 35 35 GLU CG C 13 36.537 0.108 . 1 . . . A 35 GLU CG . 18802 1 453 . 1 1 35 35 GLU N N 15 122.689 0.067 . 1 . . . A 35 GLU N . 18802 1 454 . 1 1 36 36 ASP H H 1 8.142 0.032 . 1 . . . A 36 ASP H . 18802 1 455 . 1 1 36 36 ASP HA H 1 4.437 0.010 . 1 . . . A 36 ASP HA . 18802 1 456 . 1 1 36 36 ASP HB2 H 1 2.721 0.012 . 2 . . . A 36 ASP HB2 . 18802 1 457 . 1 1 36 36 ASP HB3 H 1 2.760 0.009 . 2 . . . A 36 ASP HB3 . 18802 1 458 . 1 1 36 36 ASP C C 13 178.312 0.200 . 1 . . . A 36 ASP C . 18802 1 459 . 1 1 36 36 ASP CA C 13 58.115 0.244 . 1 . . . A 36 ASP CA . 18802 1 460 . 1 1 36 36 ASP CB C 13 42.248 0.119 . 1 . . . A 36 ASP CB . 18802 1 461 . 1 1 36 36 ASP CG C 13 178.873 0.200 . 1 . . . A 36 ASP CG . 18802 1 462 . 1 1 36 36 ASP N N 15 121.505 0.200 . 1 . . . A 36 ASP N . 18802 1 463 . 1 1 37 37 LEU H H 1 8.425 0.035 . 1 . . . A 37 LEU H . 18802 1 464 . 1 1 37 37 LEU HA H 1 3.925 0.008 . 1 . . . A 37 LEU HA . 18802 1 465 . 1 1 37 37 LEU HB2 H 1 1.231 0.007 . 2 . . . A 37 LEU HB2 . 18802 1 466 . 1 1 37 37 LEU HB3 H 1 1.838 0.010 . 2 . . . A 37 LEU HB3 . 18802 1 467 . 1 1 37 37 LEU HG H 1 1.935 0.008 . 1 . . . A 37 LEU HG . 18802 1 468 . 1 1 37 37 LEU HD11 H 1 0.817 0.006 . 2 . . . A 37 LEU MD1 . 18802 1 469 . 1 1 37 37 LEU HD12 H 1 0.817 0.006 . 2 . . . A 37 LEU MD1 . 18802 1 470 . 1 1 37 37 LEU HD13 H 1 0.817 0.006 . 2 . . . A 37 LEU MD1 . 18802 1 471 . 1 1 37 37 LEU HD21 H 1 0.926 0.009 . 2 . . . A 37 LEU MD2 . 18802 1 472 . 1 1 37 37 LEU HD22 H 1 0.926 0.009 . 2 . . . A 37 LEU MD2 . 18802 1 473 . 1 1 37 37 LEU HD23 H 1 0.926 0.009 . 2 . . . A 37 LEU MD2 . 18802 1 474 . 1 1 37 37 LEU C C 13 178.866 0.200 . 1 . . . A 37 LEU C . 18802 1 475 . 1 1 37 37 LEU CA C 13 58.302 0.163 . 1 . . . A 37 LEU CA . 18802 1 476 . 1 1 37 37 LEU CB C 13 42.610 0.095 . 1 . . . A 37 LEU CB . 18802 1 477 . 1 1 37 37 LEU CG C 13 27.448 0.119 . 1 . . . A 37 LEU CG . 18802 1 478 . 1 1 37 37 LEU CD1 C 13 26.286 0.165 . 2 . . . A 37 LEU CD1 . 18802 1 479 . 1 1 37 37 LEU CD2 C 13 23.996 0.044 . 2 . . . A 37 LEU CD2 . 18802 1 480 . 1 1 37 37 LEU N N 15 118.666 0.105 . 1 . . . A 37 LEU N . 18802 1 481 . 1 1 38 38 THR H H 1 8.340 0.026 . 1 . . . A 38 THR H . 18802 1 482 . 1 1 38 38 THR HA H 1 3.771 0.004 . 1 . . . A 38 THR HA . 18802 1 483 . 1 1 38 38 THR HB H 1 4.405 0.008 . 1 . . . A 38 THR HB . 18802 1 484 . 1 1 38 38 THR HG21 H 1 1.240 0.004 . 1 . . . A 38 THR MG . 18802 1 485 . 1 1 38 38 THR HG22 H 1 1.240 0.004 . 1 . . . A 38 THR MG . 18802 1 486 . 1 1 38 38 THR HG23 H 1 1.240 0.004 . 1 . . . A 38 THR MG . 18802 1 487 . 1 1 38 38 THR C C 13 175.988 0.200 . 1 . . . A 38 THR C . 18802 1 488 . 1 1 38 38 THR CA C 13 67.649 0.069 . 1 . . . A 38 THR CA . 18802 1 489 . 1 1 38 38 THR CB C 13 68.848 0.166 . 1 . . . A 38 THR CB . 18802 1 490 . 1 1 38 38 THR CG2 C 13 21.239 0.200 . 1 . . . A 38 THR CG2 . 18802 1 491 . 1 1 38 38 THR N N 15 115.786 0.045 . 1 . . . A 38 THR N . 18802 1 492 . 1 1 39 39 ARG H H 1 8.024 0.034 . 1 . . . A 39 ARG H . 18802 1 493 . 1 1 39 39 ARG HA H 1 3.989 0.019 . 1 . . . A 39 ARG HA . 18802 1 494 . 1 1 39 39 ARG HB2 H 1 2.015 0.010 . 2 . . . A 39 ARG HB2 . 18802 1 495 . 1 1 39 39 ARG HB3 H 1 2.068 0.015 . 2 . . . A 39 ARG HB3 . 18802 1 496 . 1 1 39 39 ARG HG2 H 1 1.514 0.006 . 2 . . . A 39 ARG HG2 . 18802 1 497 . 1 1 39 39 ARG HG3 H 1 1.744 0.005 . 2 . . . A 39 ARG HG3 . 18802 1 498 . 1 1 39 39 ARG HD2 H 1 3.229 0.016 . 1 . . . A 39 ARG HD2 . 18802 1 499 . 1 1 39 39 ARG HD3 H 1 3.229 0.016 . 1 . . . A 39 ARG HD3 . 18802 1 500 . 1 1 39 39 ARG C C 13 179.715 0.200 . 1 . . . A 39 ARG C . 18802 1 501 . 1 1 39 39 ARG CA C 13 60.086 0.096 . 1 . . . A 39 ARG CA . 18802 1 502 . 1 1 39 39 ARG CB C 13 29.811 0.139 . 1 . . . A 39 ARG CB . 18802 1 503 . 1 1 39 39 ARG CG C 13 27.650 0.085 . 1 . . . A 39 ARG CG . 18802 1 504 . 1 1 39 39 ARG CD C 13 43.360 0.065 . 1 . . . A 39 ARG CD . 18802 1 505 . 1 1 39 39 ARG N N 15 122.111 0.149 . 1 . . . A 39 ARG N . 18802 1 506 . 1 1 40 40 LYS H H 1 8.130 0.019 . 1 . . . A 40 LYS H . 18802 1 507 . 1 1 40 40 LYS HA H 1 3.854 0.029 . 1 . . . A 40 LYS HA . 18802 1 508 . 1 1 40 40 LYS HB2 H 1 1.753 0.006 . 2 . . . A 40 LYS HB2 . 18802 1 509 . 1 1 40 40 LYS HB3 H 1 1.863 0.008 . 2 . . . A 40 LYS HB3 . 18802 1 510 . 1 1 40 40 LYS HG2 H 1 1.662 0.012 . 2 . . . A 40 LYS HG2 . 18802 1 511 . 1 1 40 40 LYS HG3 H 1 1.421 0.014 . 2 . . . A 40 LYS HG3 . 18802 1 512 . 1 1 40 40 LYS HD2 H 1 1.520 0.015 . 1 . . . A 40 LYS HD2 . 18802 1 513 . 1 1 40 40 LYS HD3 H 1 1.520 0.015 . 1 . . . A 40 LYS HD3 . 18802 1 514 . 1 1 40 40 LYS HE2 H 1 2.891 0.009 . 1 . . . A 40 LYS HE2 . 18802 1 515 . 1 1 40 40 LYS HE3 H 1 2.891 0.009 . 1 . . . A 40 LYS HE3 . 18802 1 516 . 1 1 40 40 LYS C C 13 178.707 0.200 . 1 . . . A 40 LYS C . 18802 1 517 . 1 1 40 40 LYS CA C 13 60.555 0.200 . 1 . . . A 40 LYS CA . 18802 1 518 . 1 1 40 40 LYS CB C 13 33.178 0.150 . 1 . . . A 40 LYS CB . 18802 1 519 . 1 1 40 40 LYS CG C 13 26.330 0.074 . 1 . . . A 40 LYS CG . 18802 1 520 . 1 1 40 40 LYS CD C 13 29.752 0.118 . 1 . . . A 40 LYS CD . 18802 1 521 . 1 1 40 40 LYS CE C 13 42.169 0.200 . 1 . . . A 40 LYS CE . 18802 1 522 . 1 1 40 40 LYS N N 15 120.824 0.122 . 1 . . . A 40 LYS N . 18802 1 523 . 1 1 41 41 LEU H H 1 8.108 0.013 . 1 . . . A 41 LEU H . 18802 1 524 . 1 1 41 41 LEU HA H 1 3.969 0.009 . 1 . . . A 41 LEU HA . 18802 1 525 . 1 1 41 41 LEU HB2 H 1 1.494 0.003 . 2 . . . A 41 LEU HB2 . 18802 1 526 . 1 1 41 41 LEU HB3 H 1 1.905 0.006 . 2 . . . A 41 LEU HB3 . 18802 1 527 . 1 1 41 41 LEU HG H 1 1.701 0.004 . 1 . . . A 41 LEU HG . 18802 1 528 . 1 1 41 41 LEU HD11 H 1 0.679 0.019 . 2 . . . A 41 LEU MD1 . 18802 1 529 . 1 1 41 41 LEU HD12 H 1 0.679 0.019 . 2 . . . A 41 LEU MD1 . 18802 1 530 . 1 1 41 41 LEU HD13 H 1 0.679 0.019 . 2 . . . A 41 LEU MD1 . 18802 1 531 . 1 1 41 41 LEU HD21 H 1 0.958 0.005 . 2 . . . A 41 LEU MD2 . 18802 1 532 . 1 1 41 41 LEU HD22 H 1 0.958 0.005 . 2 . . . A 41 LEU MD2 . 18802 1 533 . 1 1 41 41 LEU HD23 H 1 0.958 0.005 . 2 . . . A 41 LEU MD2 . 18802 1 534 . 1 1 41 41 LEU C C 13 179.023 0.200 . 1 . . . A 41 LEU C . 18802 1 535 . 1 1 41 41 LEU CA C 13 57.281 0.093 . 1 . . . A 41 LEU CA . 18802 1 536 . 1 1 41 41 LEU CB C 13 42.390 0.100 . 1 . . . A 41 LEU CB . 18802 1 537 . 1 1 41 41 LEU CG C 13 27.405 0.050 . 1 . . . A 41 LEU CG . 18802 1 538 . 1 1 41 41 LEU CD1 C 13 24.967 0.042 . 2 . . . A 41 LEU CD1 . 18802 1 539 . 1 1 41 41 LEU CD2 C 13 24.090 0.015 . 2 . . . A 41 LEU CD2 . 18802 1 540 . 1 1 41 41 LEU N N 15 118.497 0.032 . 1 . . . A 41 LEU N . 18802 1 541 . 1 1 42 42 ARG H H 1 8.102 0.024 . 1 . . . A 42 ARG H . 18802 1 542 . 1 1 42 42 ARG HA H 1 4.214 0.014 . 1 . . . A 42 ARG HA . 18802 1 543 . 1 1 42 42 ARG HB2 H 1 1.919 0.010 . 1 . . . A 42 ARG HB2 . 18802 1 544 . 1 1 42 42 ARG HB3 H 1 1.919 0.010 . 1 . . . A 42 ARG HB3 . 18802 1 545 . 1 1 42 42 ARG HG2 H 1 1.633 0.008 . 2 . . . A 42 ARG HG2 . 18802 1 546 . 1 1 42 42 ARG HG3 H 1 1.780 0.009 . 2 . . . A 42 ARG HG3 . 18802 1 547 . 1 1 42 42 ARG HD2 H 1 3.138 0.008 . 1 . . . A 42 ARG HD2 . 18802 1 548 . 1 1 42 42 ARG HD3 H 1 3.138 0.008 . 1 . . . A 42 ARG HD3 . 18802 1 549 . 1 1 42 42 ARG C C 13 178.064 0.200 . 1 . . . A 42 ARG C . 18802 1 550 . 1 1 42 42 ARG CA C 13 58.224 0.104 . 1 . . . A 42 ARG CA . 18802 1 551 . 1 1 42 42 ARG CB C 13 30.623 0.144 . 1 . . . A 42 ARG CB . 18802 1 552 . 1 1 42 42 ARG CG C 13 27.431 0.093 . 1 . . . A 42 ARG CG . 18802 1 553 . 1 1 42 42 ARG CD C 13 43.499 0.035 . 1 . . . A 42 ARG CD . 18802 1 554 . 1 1 42 42 ARG N N 15 119.000 0.065 . 1 . . . A 42 ARG N . 18802 1 555 . 1 1 43 43 THR H H 1 7.956 0.024 . 1 . . . A 43 THR H . 18802 1 556 . 1 1 43 43 THR HA H 1 4.313 0.018 . 1 . . . A 43 THR HA . 18802 1 557 . 1 1 43 43 THR HB H 1 4.292 0.008 . 1 . . . A 43 THR HB . 18802 1 558 . 1 1 43 43 THR HG21 H 1 1.273 0.005 . 1 . . . A 43 THR MG . 18802 1 559 . 1 1 43 43 THR HG22 H 1 1.273 0.005 . 1 . . . A 43 THR MG . 18802 1 560 . 1 1 43 43 THR HG23 H 1 1.273 0.005 . 1 . . . A 43 THR MG . 18802 1 561 . 1 1 43 43 THR C C 13 175.834 0.200 . 1 . . . A 43 THR C . 18802 1 562 . 1 1 43 43 THR CA C 13 62.681 0.036 . 1 . . . A 43 THR CA . 18802 1 563 . 1 1 43 43 THR CB C 13 70.768 0.018 . 1 . . . A 43 THR CB . 18802 1 564 . 1 1 43 43 THR CG2 C 13 21.557 0.008 . 1 . . . A 43 THR CG2 . 18802 1 565 . 1 1 43 43 THR N N 15 109.849 0.022 . 1 . . . A 43 THR N . 18802 1 566 . 1 1 44 44 GLY H H 1 8.016 0.035 . 1 . . . A 44 GLY H . 18802 1 567 . 1 1 44 44 GLY HA2 H 1 3.694 0.009 . 2 . . . A 44 GLY HA2 . 18802 1 568 . 1 1 44 44 GLY HA3 H 1 4.017 0.005 . 2 . . . A 44 GLY HA3 . 18802 1 569 . 1 1 44 44 GLY C C 13 173.968 0.200 . 1 . . . A 44 GLY C . 18802 1 570 . 1 1 44 44 GLY CA C 13 46.030 0.050 . 1 . . . A 44 GLY CA . 18802 1 571 . 1 1 44 44 GLY N N 15 110.673 0.048 . 1 . . . A 44 GLY N . 18802 1 572 . 1 1 45 45 ASP H H 1 8.048 0.027 . 1 . . . A 45 ASP H . 18802 1 573 . 1 1 45 45 ASP HA H 1 4.655 0.008 . 1 . . . A 45 ASP HA . 18802 1 574 . 1 1 45 45 ASP HB2 H 1 2.537 0.004 . 2 . . . A 45 ASP HB2 . 18802 1 575 . 1 1 45 45 ASP HB3 H 1 2.692 0.002 . 2 . . . A 45 ASP HB3 . 18802 1 576 . 1 1 45 45 ASP C C 13 175.983 0.200 . 1 . . . A 45 ASP C . 18802 1 577 . 1 1 45 45 ASP CA C 13 53.855 0.200 . 1 . . . A 45 ASP CA . 18802 1 578 . 1 1 45 45 ASP CB C 13 40.646 0.046 . 1 . . . A 45 ASP CB . 18802 1 579 . 1 1 45 45 ASP N N 15 121.490 0.060 . 1 . . . A 45 ASP N . 18802 1 580 . 1 1 46 46 LEU H H 1 7.988 0.019 . 1 . . . A 46 LEU H . 18802 1 581 . 1 1 46 46 LEU HA H 1 4.139 0.011 . 1 . . . A 46 LEU HA . 18802 1 582 . 1 1 46 46 LEU HB2 H 1 1.551 0.014 . 2 . . . A 46 LEU HB2 . 18802 1 583 . 1 1 46 46 LEU HB3 H 1 1.715 0.008 . 2 . . . A 46 LEU HB3 . 18802 1 584 . 1 1 46 46 LEU HG H 1 1.552 0.026 . 1 . . . A 46 LEU HG . 18802 1 585 . 1 1 46 46 LEU HD11 H 1 0.869 0.009 . 2 . . . A 46 LEU MD1 . 18802 1 586 . 1 1 46 46 LEU HD12 H 1 0.869 0.009 . 2 . . . A 46 LEU MD1 . 18802 1 587 . 1 1 46 46 LEU HD13 H 1 0.869 0.009 . 2 . . . A 46 LEU MD1 . 18802 1 588 . 1 1 46 46 LEU HD21 H 1 0.700 0.012 . 2 . . . A 46 LEU MD2 . 18802 1 589 . 1 1 46 46 LEU HD22 H 1 0.700 0.012 . 2 . . . A 46 LEU MD2 . 18802 1 590 . 1 1 46 46 LEU HD23 H 1 0.700 0.012 . 2 . . . A 46 LEU MD2 . 18802 1 591 . 1 1 46 46 LEU C C 13 177.530 0.200 . 1 . . . A 46 LEU C . 18802 1 592 . 1 1 46 46 LEU CA C 13 55.280 0.025 . 1 . . . A 46 LEU CA . 18802 1 593 . 1 1 46 46 LEU CB C 13 42.136 0.133 . 1 . . . A 46 LEU CB . 18802 1 594 . 1 1 46 46 LEU CG C 13 27.026 0.121 . 1 . . . A 46 LEU CG . 18802 1 595 . 1 1 46 46 LEU CD1 C 13 26.011 0.044 . 2 . . . A 46 LEU CD1 . 18802 1 596 . 1 1 46 46 LEU CD2 C 13 23.070 0.063 . 2 . . . A 46 LEU CD2 . 18802 1 597 . 1 1 46 46 LEU N N 15 120.838 0.076 . 1 . . . A 46 LEU N . 18802 1 598 . 1 1 47 47 GLY H H 1 8.341 0.020 . 1 . . . A 47 GLY H . 18802 1 599 . 1 1 47 47 GLY HA2 H 1 3.795 0.004 . 2 . . . A 47 GLY HA2 . 18802 1 600 . 1 1 47 47 GLY HA3 H 1 3.868 0.005 . 2 . . . A 47 GLY HA3 . 18802 1 601 . 1 1 47 47 GLY C C 13 173.936 0.200 . 1 . . . A 47 GLY C . 18802 1 602 . 1 1 47 47 GLY CA C 13 45.558 0.112 . 1 . . . A 47 GLY CA . 18802 1 603 . 1 1 47 47 GLY N N 15 108.059 0.155 . 1 . . . A 47 GLY N . 18802 1 604 . 1 1 48 48 ILE H H 1 7.793 0.006 . 1 . . . A 48 ILE H . 18802 1 605 . 1 1 48 48 ILE HA H 1 4.394 0.020 . 1 . . . A 48 ILE HA . 18802 1 606 . 1 1 48 48 ILE HB H 1 1.790 0.004 . 1 . . . A 48 ILE HB . 18802 1 607 . 1 1 48 48 ILE HG12 H 1 1.051 0.013 . 2 . . . A 48 ILE HG12 . 18802 1 608 . 1 1 48 48 ILE HG13 H 1 1.441 0.003 . 2 . . . A 48 ILE HG13 . 18802 1 609 . 1 1 48 48 ILE HG21 H 1 0.887 0.009 . 1 . . . A 48 ILE MG . 18802 1 610 . 1 1 48 48 ILE HG22 H 1 0.887 0.009 . 1 . . . A 48 ILE MG . 18802 1 611 . 1 1 48 48 ILE HG23 H 1 0.887 0.009 . 1 . . . A 48 ILE MG . 18802 1 612 . 1 1 48 48 ILE HD11 H 1 0.810 0.016 . 1 . . . A 48 ILE MD . 18802 1 613 . 1 1 48 48 ILE HD12 H 1 0.810 0.016 . 1 . . . A 48 ILE MD . 18802 1 614 . 1 1 48 48 ILE HD13 H 1 0.810 0.016 . 1 . . . A 48 ILE MD . 18802 1 615 . 1 1 48 48 ILE C C 13 174.227 0.200 . 1 . . . A 48 ILE C . 18802 1 616 . 1 1 48 48 ILE CA C 13 58.539 0.050 . 1 . . . A 48 ILE CA . 18802 1 617 . 1 1 48 48 ILE CB C 13 38.810 0.017 . 1 . . . A 48 ILE CB . 18802 1 618 . 1 1 48 48 ILE CG1 C 13 27.097 0.065 . 1 . . . A 48 ILE CG1 . 18802 1 619 . 1 1 48 48 ILE CG2 C 13 17.180 0.200 . 1 . . . A 48 ILE CG2 . 18802 1 620 . 1 1 48 48 ILE CD1 C 13 12.942 0.171 . 1 . . . A 48 ILE CD1 . 18802 1 621 . 1 1 48 48 ILE N N 15 121.037 0.052 . 1 . . . A 48 ILE N . 18802 1 622 . 1 1 49 49 PRO HA H 1 4.622 0.032 . 1 . . . A 49 PRO HA . 18802 1 623 . 1 1 49 49 PRO HB2 H 1 2.295 0.008 . 2 . . . A 49 PRO HB2 . 18802 1 624 . 1 1 49 49 PRO HB3 H 1 1.849 0.009 . 2 . . . A 49 PRO HB3 . 18802 1 625 . 1 1 49 49 PRO HG2 H 1 1.946 0.016 . 2 . . . A 49 PRO HG2 . 18802 1 626 . 1 1 49 49 PRO HG3 H 1 2.013 0.003 . 2 . . . A 49 PRO HG3 . 18802 1 627 . 1 1 49 49 PRO HD2 H 1 3.603 0.012 . 2 . . . A 49 PRO HD2 . 18802 1 628 . 1 1 49 49 PRO HD3 H 1 3.883 0.016 . 2 . . . A 49 PRO HD3 . 18802 1 629 . 1 1 49 49 PRO CA C 13 61.640 0.200 . 1 . . . A 49 PRO CA . 18802 1 630 . 1 1 49 49 PRO CB C 13 31.104 0.103 . 1 . . . A 49 PRO CB . 18802 1 631 . 1 1 49 49 PRO CG C 13 27.450 0.200 . 1 . . . A 49 PRO CG . 18802 1 632 . 1 1 49 49 PRO CD C 13 51.082 0.060 . 1 . . . A 49 PRO CD . 18802 1 633 . 1 1 50 50 PRO HA H 1 4.372 0.011 . 1 . . . A 50 PRO HA . 18802 1 634 . 1 1 50 50 PRO HB2 H 1 1.849 0.013 . 2 . . . A 50 PRO HB2 . 18802 1 635 . 1 1 50 50 PRO HB3 H 1 2.226 0.018 . 2 . . . A 50 PRO HB3 . 18802 1 636 . 1 1 50 50 PRO HG2 H 1 1.968 0.008 . 1 . . . A 50 PRO HG2 . 18802 1 637 . 1 1 50 50 PRO HG3 H 1 1.968 0.008 . 1 . . . A 50 PRO HG3 . 18802 1 638 . 1 1 50 50 PRO HD2 H 1 3.617 0.023 . 2 . . . A 50 PRO HD2 . 18802 1 639 . 1 1 50 50 PRO HD3 H 1 3.748 0.007 . 2 . . . A 50 PRO HD3 . 18802 1 640 . 1 1 50 50 PRO C C 13 176.423 0.200 . 1 . . . A 50 PRO C . 18802 1 641 . 1 1 50 50 PRO CA C 13 63.041 0.219 . 1 . . . A 50 PRO CA . 18802 1 642 . 1 1 50 50 PRO CB C 13 32.030 0.095 . 1 . . . A 50 PRO CB . 18802 1 643 . 1 1 50 50 PRO CG C 13 27.395 0.043 . 1 . . . A 50 PRO CG . 18802 1 644 . 1 1 50 50 PRO CD C 13 50.595 0.097 . 1 . . . A 50 PRO CD . 18802 1 645 . 1 1 51 51 ASN H H 1 8.422 0.005 . 1 . . . A 51 ASN H . 18802 1 646 . 1 1 51 51 ASN HA H 1 4.929 0.002 . 1 . . . A 51 ASN HA . 18802 1 647 . 1 1 51 51 ASN HB2 H 1 2.671 0.004 . 2 . . . A 51 ASN HB2 . 18802 1 648 . 1 1 51 51 ASN HB3 H 1 2.862 0.003 . 2 . . . A 51 ASN HB3 . 18802 1 649 . 1 1 51 51 ASN HD21 H 1 6.936 0.001 . 2 . . . A 51 ASN HD21 . 18802 1 650 . 1 1 51 51 ASN HD22 H 1 7.653 0.005 . 2 . . . A 51 ASN HD22 . 18802 1 651 . 1 1 51 51 ASN C C 13 174.066 0.200 . 1 . . . A 51 ASN C . 18802 1 652 . 1 1 51 51 ASN CA C 13 51.151 0.086 . 1 . . . A 51 ASN CA . 18802 1 653 . 1 1 51 51 ASN CB C 13 38.924 0.097 . 1 . . . A 51 ASN CB . 18802 1 654 . 1 1 51 51 ASN CG C 13 177.156 0.200 . 1 . . . A 51 ASN CG . 18802 1 655 . 1 1 51 51 ASN N N 15 119.550 0.123 . 1 . . . A 51 ASN N . 18802 1 656 . 1 1 51 51 ASN ND2 N 15 113.203 0.200 . 1 . . . A 51 ASN ND2 . 18802 1 657 . 1 1 52 52 PRO HA H 1 4.293 0.006 . 1 . . . A 52 PRO HA . 18802 1 658 . 1 1 52 52 PRO HB2 H 1 1.939 0.005 . 2 . . . A 52 PRO HB2 . 18802 1 659 . 1 1 52 52 PRO HB3 H 1 2.261 0.012 . 2 . . . A 52 PRO HB3 . 18802 1 660 . 1 1 52 52 PRO HG2 H 1 1.998 0.020 . 1 . . . A 52 PRO HG2 . 18802 1 661 . 1 1 52 52 PRO HG3 H 1 1.998 0.020 . 1 . . . A 52 PRO HG3 . 18802 1 662 . 1 1 52 52 PRO HD2 H 1 3.738 0.007 . 2 . . . A 52 PRO HD2 . 18802 1 663 . 1 1 52 52 PRO HD3 H 1 3.796 0.008 . 2 . . . A 52 PRO HD3 . 18802 1 664 . 1 1 52 52 PRO C C 13 177.322 0.200 . 1 . . . A 52 PRO C . 18802 1 665 . 1 1 52 52 PRO CA C 13 64.384 0.172 . 1 . . . A 52 PRO CA . 18802 1 666 . 1 1 52 52 PRO CB C 13 32.236 0.065 . 1 . . . A 52 PRO CB . 18802 1 667 . 1 1 52 52 PRO CG C 13 27.358 0.200 . 1 . . . A 52 PRO CG . 18802 1 668 . 1 1 52 52 PRO CD C 13 50.840 0.030 . 1 . . . A 52 PRO CD . 18802 1 669 . 1 1 53 53 GLU H H 1 8.426 0.009 . 1 . . . A 53 GLU H . 18802 1 670 . 1 1 53 53 GLU HA H 1 4.176 0.004 . 1 . . . A 53 GLU HA . 18802 1 671 . 1 1 53 53 GLU HB2 H 1 1.879 0.002 . 2 . . . A 53 GLU HB2 . 18802 1 672 . 1 1 53 53 GLU HB3 H 1 2.040 0.002 . 2 . . . A 53 GLU HB3 . 18802 1 673 . 1 1 53 53 GLU HG2 H 1 2.209 0.008 . 1 . . . A 53 GLU HG2 . 18802 1 674 . 1 1 53 53 GLU HG3 H 1 2.209 0.008 . 1 . . . A 53 GLU HG3 . 18802 1 675 . 1 1 53 53 GLU C C 13 176.403 0.200 . 1 . . . A 53 GLU C . 18802 1 676 . 1 1 53 53 GLU CA C 13 56.977 0.052 . 1 . . . A 53 GLU CA . 18802 1 677 . 1 1 53 53 GLU CB C 13 29.860 0.146 . 1 . . . A 53 GLU CB . 18802 1 678 . 1 1 53 53 GLU CG C 13 36.629 0.200 . 1 . . . A 53 GLU CG . 18802 1 679 . 1 1 53 53 GLU N N 15 118.523 0.035 . 1 . . . A 53 GLU N . 18802 1 680 . 1 1 54 54 ASP H H 1 7.941 0.020 . 1 . . . A 54 ASP H . 18802 1 681 . 1 1 54 54 ASP HA H 1 4.543 0.005 . 1 . . . A 54 ASP HA . 18802 1 682 . 1 1 54 54 ASP HB2 H 1 2.715 0.020 . 2 . . . A 54 ASP HB2 . 18802 1 683 . 1 1 54 54 ASP HB3 H 1 2.611 0.019 . 2 . . . A 54 ASP HB3 . 18802 1 684 . 1 1 54 54 ASP C C 13 176.085 0.200 . 1 . . . A 54 ASP C . 18802 1 685 . 1 1 54 54 ASP CA C 13 54.544 0.029 . 1 . . . A 54 ASP CA . 18802 1 686 . 1 1 54 54 ASP CB C 13 41.239 0.034 . 1 . . . A 54 ASP CB . 18802 1 687 . 1 1 54 54 ASP CG C 13 179.982 0.200 . 1 . . . A 54 ASP CG . 18802 1 688 . 1 1 54 54 ASP N N 15 120.581 0.200 . 1 . . . A 54 ASP N . 18802 1 689 . 1 1 55 55 ARG H H 1 8.066 0.021 . 1 . . . A 55 ARG H . 18802 1 690 . 1 1 55 55 ARG HA H 1 4.325 0.007 . 1 . . . A 55 ARG HA . 18802 1 691 . 1 1 55 55 ARG HB2 H 1 1.702 0.007 . 2 . . . A 55 ARG HB2 . 18802 1 692 . 1 1 55 55 ARG HB3 H 1 1.875 0.009 . 2 . . . A 55 ARG HB3 . 18802 1 693 . 1 1 55 55 ARG HG2 H 1 1.552 0.019 . 2 . . . A 55 ARG HG2 . 18802 1 694 . 1 1 55 55 ARG HG3 H 1 1.602 0.023 . 2 . . . A 55 ARG HG3 . 18802 1 695 . 1 1 55 55 ARG HD2 H 1 3.139 0.010 . 1 . . . A 55 ARG HD2 . 18802 1 696 . 1 1 55 55 ARG HD3 H 1 3.139 0.010 . 1 . . . A 55 ARG HD3 . 18802 1 697 . 1 1 55 55 ARG C C 13 176.123 0.200 . 1 . . . A 55 ARG C . 18802 1 698 . 1 1 55 55 ARG CA C 13 55.927 0.129 . 1 . . . A 55 ARG CA . 18802 1 699 . 1 1 55 55 ARG CB C 13 30.650 0.039 . 1 . . . A 55 ARG CB . 18802 1 700 . 1 1 55 55 ARG CG C 13 27.200 0.051 . 1 . . . A 55 ARG CG . 18802 1 701 . 1 1 55 55 ARG CD C 13 43.448 0.045 . 1 . . . A 55 ARG CD . 18802 1 702 . 1 1 55 55 ARG N N 15 121.043 0.130 . 1 . . . A 55 ARG N . 18802 1 703 . 1 1 56 56 SER H H 1 8.281 0.020 . 1 . . . A 56 SER H . 18802 1 704 . 1 1 56 56 SER HA H 1 4.672 0.024 . 1 . . . A 56 SER HA . 18802 1 705 . 1 1 56 56 SER HB2 H 1 3.793 0.020 . 2 . . . A 56 SER HB2 . 18802 1 706 . 1 1 56 56 SER HB3 H 1 3.837 0.020 . 2 . . . A 56 SER HB3 . 18802 1 707 . 1 1 56 56 SER C C 13 172.577 0.200 . 1 . . . A 56 SER C . 18802 1 708 . 1 1 56 56 SER CA C 13 56.564 0.037 . 1 . . . A 56 SER CA . 18802 1 709 . 1 1 56 56 SER CB C 13 63.415 0.104 . 1 . . . A 56 SER CB . 18802 1 710 . 1 1 56 56 SER N N 15 118.338 0.073 . 1 . . . A 56 SER N . 18802 1 711 . 1 1 57 57 PRO HA H 1 4.420 0.011 . 1 . . . A 57 PRO HA . 18802 1 712 . 1 1 57 57 PRO HB2 H 1 1.885 0.002 . 2 . . . A 57 PRO HB2 . 18802 1 713 . 1 1 57 57 PRO HB3 H 1 2.242 0.006 . 2 . . . A 57 PRO HB3 . 18802 1 714 . 1 1 57 57 PRO HG2 H 1 1.960 0.003 . 1 . . . A 57 PRO HG2 . 18802 1 715 . 1 1 57 57 PRO HG3 H 1 1.960 0.003 . 1 . . . A 57 PRO HG3 . 18802 1 716 . 1 1 57 57 PRO HD2 H 1 3.663 0.016 . 2 . . . A 57 PRO HD2 . 18802 1 717 . 1 1 57 57 PRO HD3 H 1 3.749 0.021 . 2 . . . A 57 PRO HD3 . 18802 1 718 . 1 1 57 57 PRO C C 13 176.727 0.200 . 1 . . . A 57 PRO C . 18802 1 719 . 1 1 57 57 PRO CA C 13 63.263 0.200 . 1 . . . A 57 PRO CA . 18802 1 720 . 1 1 57 57 PRO CB C 13 32.052 0.200 . 1 . . . A 57 PRO CB . 18802 1 721 . 1 1 57 57 PRO CG C 13 27.326 0.031 . 1 . . . A 57 PRO CG . 18802 1 722 . 1 1 57 57 PRO CD C 13 50.752 0.096 . 1 . . . A 57 PRO CD . 18802 1 723 . 1 1 58 58 SER H H 1 8.280 0.004 . 1 . . . A 58 SER H . 18802 1 724 . 1 1 58 58 SER HA H 1 4.693 0.001 . 1 . . . A 58 SER HA . 18802 1 725 . 1 1 58 58 SER HB2 H 1 3.792 0.003 . 1 . . . A 58 SER HB2 . 18802 1 726 . 1 1 58 58 SER HB3 H 1 3.792 0.003 . 1 . . . A 58 SER HB3 . 18802 1 727 . 1 1 58 58 SER C C 13 172.803 0.200 . 1 . . . A 58 SER C . 18802 1 728 . 1 1 58 58 SER CA C 13 56.288 0.107 . 1 . . . A 58 SER CA . 18802 1 729 . 1 1 58 58 SER CB C 13 63.500 0.064 . 1 . . . A 58 SER CB . 18802 1 730 . 1 1 58 58 SER N N 15 117.341 0.103 . 1 . . . A 58 SER N . 18802 1 731 . 1 1 59 59 PRO HA H 1 4.311 0.008 . 1 . . . A 59 PRO HA . 18802 1 732 . 1 1 59 59 PRO HB2 H 1 1.662 0.003 . 2 . . . A 59 PRO HB2 . 18802 1 733 . 1 1 59 59 PRO HB3 H 1 2.051 0.004 . 2 . . . A 59 PRO HB3 . 18802 1 734 . 1 1 59 59 PRO HG2 H 1 1.988 0.004 . 1 . . . A 59 PRO HG2 . 18802 1 735 . 1 1 59 59 PRO HG3 H 1 1.988 0.004 . 1 . . . A 59 PRO HG3 . 18802 1 736 . 1 1 59 59 PRO HD2 H 1 3.647 0.004 . 2 . . . A 59 PRO HD2 . 18802 1 737 . 1 1 59 59 PRO HD3 H 1 3.740 0.013 . 2 . . . A 59 PRO HD3 . 18802 1 738 . 1 1 59 59 PRO C C 13 176.273 0.200 . 1 . . . A 59 PRO C . 18802 1 739 . 1 1 59 59 PRO CA C 13 63.115 0.082 . 1 . . . A 59 PRO CA . 18802 1 740 . 1 1 59 59 PRO CB C 13 32.099 0.023 . 1 . . . A 59 PRO CB . 18802 1 741 . 1 1 59 59 PRO CG C 13 27.324 0.200 . 1 . . . A 59 PRO CG . 18802 1 742 . 1 1 59 59 PRO CD C 13 50.718 0.039 . 1 . . . A 59 PRO CD . 18802 1 743 . 1 1 60 60 GLU H H 1 8.230 0.007 . 1 . . . A 60 GLU H . 18802 1 744 . 1 1 60 60 GLU HA H 1 4.493 0.005 . 1 . . . A 60 GLU HA . 18802 1 745 . 1 1 60 60 GLU HB2 H 1 1.830 0.010 . 2 . . . A 60 GLU HB2 . 18802 1 746 . 1 1 60 60 GLU HB3 H 1 1.981 0.004 . 2 . . . A 60 GLU HB3 . 18802 1 747 . 1 1 60 60 GLU HG2 H 1 2.254 0.009 . 1 . . . A 60 GLU HG2 . 18802 1 748 . 1 1 60 60 GLU HG3 H 1 2.254 0.009 . 1 . . . A 60 GLU HG3 . 18802 1 749 . 1 1 60 60 GLU C C 13 174.546 0.200 . 1 . . . A 60 GLU C . 18802 1 750 . 1 1 60 60 GLU CA C 13 54.529 0.300 . 1 . . . A 60 GLU CA . 18802 1 751 . 1 1 60 60 GLU CB C 13 29.938 0.103 . 1 . . . A 60 GLU CB . 18802 1 752 . 1 1 60 60 GLU CG C 13 36.080 0.200 . 1 . . . A 60 GLU CG . 18802 1 753 . 1 1 60 60 GLU N N 15 122.213 0.009 . 1 . . . A 60 GLU N . 18802 1 754 . 1 1 61 61 PRO HA H 1 4.415 0.005 . 1 . . . A 61 PRO HA . 18802 1 755 . 1 1 61 61 PRO HB2 H 1 1.876 0.007 . 2 . . . A 61 PRO HB2 . 18802 1 756 . 1 1 61 61 PRO HB3 H 1 2.220 0.028 . 2 . . . A 61 PRO HB3 . 18802 1 757 . 1 1 61 61 PRO HG2 H 1 1.975 0.006 . 1 . . . A 61 PRO HG2 . 18802 1 758 . 1 1 61 61 PRO HG3 H 1 1.975 0.006 . 1 . . . A 61 PRO HG3 . 18802 1 759 . 1 1 61 61 PRO HD2 H 1 3.645 0.007 . 2 . . . A 61 PRO HD2 . 18802 1 760 . 1 1 61 61 PRO HD3 H 1 3.750 0.008 . 2 . . . A 61 PRO HD3 . 18802 1 761 . 1 1 61 61 PRO C C 13 176.024 0.200 . 1 . . . A 61 PRO C . 18802 1 762 . 1 1 61 61 PRO CA C 13 63.242 0.051 . 1 . . . A 61 PRO CA . 18802 1 763 . 1 1 61 61 PRO CB C 13 32.189 0.123 . 1 . . . A 61 PRO CB . 18802 1 764 . 1 1 61 61 PRO CG C 13 27.283 0.200 . 1 . . . A 61 PRO CG . 18802 1 765 . 1 1 61 61 PRO CD C 13 50.623 0.190 . 1 . . . A 61 PRO CD . 18802 1 766 . 1 1 62 62 ILE H H 1 7.980 0.007 . 1 . . . A 62 ILE H . 18802 1 767 . 1 1 62 62 ILE HA H 1 4.062 0.004 . 1 . . . A 62 ILE HA . 18802 1 768 . 1 1 62 62 ILE HB H 1 1.636 0.003 . 1 . . . A 62 ILE HB . 18802 1 769 . 1 1 62 62 ILE HG12 H 1 1.034 0.008 . 2 . . . A 62 ILE HG12 . 18802 1 770 . 1 1 62 62 ILE HG13 H 1 1.333 0.003 . 2 . . . A 62 ILE HG13 . 18802 1 771 . 1 1 62 62 ILE HG21 H 1 0.719 0.010 . 1 . . . A 62 ILE MG . 18802 1 772 . 1 1 62 62 ILE HG22 H 1 0.719 0.010 . 1 . . . A 62 ILE MG . 18802 1 773 . 1 1 62 62 ILE HG23 H 1 0.719 0.010 . 1 . . . A 62 ILE MG . 18802 1 774 . 1 1 62 62 ILE HD11 H 1 0.755 0.009 . 1 . . . A 62 ILE MD . 18802 1 775 . 1 1 62 62 ILE HD12 H 1 0.755 0.009 . 1 . . . A 62 ILE MD . 18802 1 776 . 1 1 62 62 ILE HD13 H 1 0.755 0.009 . 1 . . . A 62 ILE MD . 18802 1 777 . 1 1 62 62 ILE C C 13 175.419 0.200 . 1 . . . A 62 ILE C . 18802 1 778 . 1 1 62 62 ILE CA C 13 61.029 0.075 . 1 . . . A 62 ILE CA . 18802 1 779 . 1 1 62 62 ILE CB C 13 39.258 0.038 . 1 . . . A 62 ILE CB . 18802 1 780 . 1 1 62 62 ILE CG1 C 13 27.248 0.038 . 1 . . . A 62 ILE CG1 . 18802 1 781 . 1 1 62 62 ILE CG2 C 13 17.721 0.031 . 1 . . . A 62 ILE CG2 . 18802 1 782 . 1 1 62 62 ILE CD1 C 13 13.110 0.090 . 1 . . . A 62 ILE CD1 . 18802 1 783 . 1 1 62 62 ILE N N 15 120.281 0.159 . 1 . . . A 62 ILE N . 18802 1 784 . 1 1 63 63 TYR H H 1 8.194 0.018 . 1 . . . A 63 TYR H . 18802 1 785 . 1 1 63 63 TYR HA H 1 4.817 0.011 . 1 . . . A 63 TYR HA . 18802 1 786 . 1 1 63 63 TYR HB2 H 1 2.788 0.006 . 2 . . . A 63 TYR HB2 . 18802 1 787 . 1 1 63 63 TYR HB3 H 1 2.918 0.003 . 2 . . . A 63 TYR HB3 . 18802 1 788 . 1 1 63 63 TYR HD1 H 1 6.969 0.015 . 1 . . . A 63 TYR HD1 . 18802 1 789 . 1 1 63 63 TYR HD2 H 1 6.969 0.015 . 1 . . . A 63 TYR HD2 . 18802 1 790 . 1 1 63 63 TYR HE1 H 1 6.725 0.014 . 1 . . . A 63 TYR HE1 . 18802 1 791 . 1 1 63 63 TYR HE2 H 1 6.725 0.014 . 1 . . . A 63 TYR HE2 . 18802 1 792 . 1 1 63 63 TYR C C 13 175.920 0.200 . 1 . . . A 63 TYR C . 18802 1 793 . 1 1 63 63 TYR CA C 13 57.197 0.168 . 1 . . . A 63 TYR CA . 18802 1 794 . 1 1 63 63 TYR CB C 13 40.178 0.060 . 1 . . . A 63 TYR CB . 18802 1 795 . 1 1 63 63 TYR CD1 C 13 133.110 0.200 . 1 . . . A 63 TYR CD1 . 18802 1 796 . 1 1 63 63 TYR CD2 C 13 133.110 0.200 . 1 . . . A 63 TYR CD2 . 18802 1 797 . 1 1 63 63 TYR CE1 C 13 118.016 0.200 . 1 . . . A 63 TYR CE1 . 18802 1 798 . 1 1 63 63 TYR CE2 C 13 118.016 0.200 . 1 . . . A 63 TYR CE2 . 18802 1 799 . 1 1 63 63 TYR N N 15 123.089 0.038 . 1 . . . A 63 TYR N . 18802 1 800 . 1 1 64 64 ASN H H 1 8.386 0.022 . 1 . . . A 64 ASN H . 18802 1 801 . 1 1 64 64 ASN HA H 1 4.745 0.007 . 1 . . . A 64 ASN HA . 18802 1 802 . 1 1 64 64 ASN HB2 H 1 2.790 0.007 . 2 . . . A 64 ASN HB2 . 18802 1 803 . 1 1 64 64 ASN HB3 H 1 3.096 0.009 . 2 . . . A 64 ASN HB3 . 18802 1 804 . 1 1 64 64 ASN HD21 H 1 6.904 0.001 . 2 . . . A 64 ASN HD21 . 18802 1 805 . 1 1 64 64 ASN HD22 H 1 7.626 0.009 . 2 . . . A 64 ASN HD22 . 18802 1 806 . 1 1 64 64 ASN C C 13 176.275 0.200 . 1 . . . A 64 ASN C . 18802 1 807 . 1 1 64 64 ASN CA C 13 52.286 0.277 . 1 . . . A 64 ASN CA . 18802 1 808 . 1 1 64 64 ASN CB C 13 39.082 0.095 . 1 . . . A 64 ASN CB . 18802 1 809 . 1 1 64 64 ASN CG C 13 176.888 0.200 . 1 . . . A 64 ASN CG . 18802 1 810 . 1 1 64 64 ASN N N 15 120.117 0.026 . 1 . . . A 64 ASN N . 18802 1 811 . 1 1 64 64 ASN ND2 N 15 111.942 0.200 . 1 . . . A 64 ASN ND2 . 18802 1 812 . 1 1 65 65 SER H H 1 8.371 0.020 . 1 . . . A 65 SER H . 18802 1 813 . 1 1 65 65 SER HA H 1 4.248 0.004 . 1 . . . A 65 SER HA . 18802 1 814 . 1 1 65 65 SER HB2 H 1 3.846 0.009 . 2 . . . A 65 SER HB2 . 18802 1 815 . 1 1 65 65 SER HB3 H 1 3.928 0.009 . 2 . . . A 65 SER HB3 . 18802 1 816 . 1 1 65 65 SER C C 13 175.066 0.200 . 1 . . . A 65 SER C . 18802 1 817 . 1 1 65 65 SER CA C 13 60.012 0.133 . 1 . . . A 65 SER CA . 18802 1 818 . 1 1 65 65 SER CB C 13 63.400 0.039 . 1 . . . A 65 SER CB . 18802 1 819 . 1 1 65 65 SER N N 15 115.826 0.079 . 1 . . . A 65 SER N . 18802 1 820 . 1 1 66 66 GLU H H 1 8.018 0.027 . 1 . . . A 66 GLU H . 18802 1 821 . 1 1 66 66 GLU HA H 1 4.278 0.006 . 1 . . . A 66 GLU HA . 18802 1 822 . 1 1 66 66 GLU HB2 H 1 1.945 0.006 . 2 . . . A 66 GLU HB2 . 18802 1 823 . 1 1 66 66 GLU HB3 H 1 2.117 0.011 . 2 . . . A 66 GLU HB3 . 18802 1 824 . 1 1 66 66 GLU HG2 H 1 2.211 0.015 . 1 . . . A 66 GLU HG2 . 18802 1 825 . 1 1 66 66 GLU HG3 H 1 2.211 0.015 . 1 . . . A 66 GLU HG3 . 18802 1 826 . 1 1 66 66 GLU C C 13 176.936 0.200 . 1 . . . A 66 GLU C . 18802 1 827 . 1 1 66 66 GLU CA C 13 56.781 0.109 . 1 . . . A 66 GLU CA . 18802 1 828 . 1 1 66 66 GLU CB C 13 30.063 0.141 . 1 . . . A 66 GLU CB . 18802 1 829 . 1 1 66 66 GLU CG C 13 36.624 0.043 . 1 . . . A 66 GLU CG . 18802 1 830 . 1 1 66 66 GLU N N 15 121.062 0.200 . 1 . . . A 66 GLU N . 18802 1 831 . 1 1 67 67 GLY H H 1 8.199 0.027 . 1 . . . A 67 GLY H . 18802 1 832 . 1 1 67 67 GLY HA2 H 1 3.720 0.006 . 2 . . . A 67 GLY HA2 . 18802 1 833 . 1 1 67 67 GLY HA3 H 1 3.991 0.006 . 2 . . . A 67 GLY HA3 . 18802 1 834 . 1 1 67 67 GLY C C 13 174.115 0.200 . 1 . . . A 67 GLY C . 18802 1 835 . 1 1 67 67 GLY CA C 13 45.744 0.030 . 1 . . . A 67 GLY CA . 18802 1 836 . 1 1 67 67 GLY N N 15 108.499 0.101 . 1 . . . A 67 GLY N . 18802 1 837 . 1 1 68 68 LYS H H 1 7.956 0.014 . 1 . . . A 68 LYS H . 18802 1 838 . 1 1 68 68 LYS HA H 1 4.309 0.010 . 1 . . . A 68 LYS HA . 18802 1 839 . 1 1 68 68 LYS HB2 H 1 1.677 0.003 . 2 . . . A 68 LYS HB2 . 18802 1 840 . 1 1 68 68 LYS HB3 H 1 1.769 0.006 . 2 . . . A 68 LYS HB3 . 18802 1 841 . 1 1 68 68 LYS HG2 H 1 1.314 0.004 . 2 . . . A 68 LYS HG2 . 18802 1 842 . 1 1 68 68 LYS HG3 H 1 1.392 0.009 . 2 . . . A 68 LYS HG3 . 18802 1 843 . 1 1 68 68 LYS HD2 H 1 1.625 0.004 . 1 . . . A 68 LYS HD2 . 18802 1 844 . 1 1 68 68 LYS HD3 H 1 1.625 0.004 . 1 . . . A 68 LYS HD3 . 18802 1 845 . 1 1 68 68 LYS HE2 H 1 2.939 0.002 . 1 . . . A 68 LYS HE2 . 18802 1 846 . 1 1 68 68 LYS HE3 H 1 2.939 0.002 . 1 . . . A 68 LYS HE3 . 18802 1 847 . 1 1 68 68 LYS C C 13 176.453 0.200 . 1 . . . A 68 LYS C . 18802 1 848 . 1 1 68 68 LYS CA C 13 55.856 0.001 . 1 . . . A 68 LYS CA . 18802 1 849 . 1 1 68 68 LYS CB C 13 33.109 0.106 . 1 . . . A 68 LYS CB . 18802 1 850 . 1 1 68 68 LYS CG C 13 24.858 0.111 . 1 . . . A 68 LYS CG . 18802 1 851 . 1 1 68 68 LYS CD C 13 29.055 0.001 . 1 . . . A 68 LYS CD . 18802 1 852 . 1 1 68 68 LYS CE C 13 42.405 0.200 . 1 . . . A 68 LYS CE . 18802 1 853 . 1 1 68 68 LYS N N 15 120.638 0.165 . 1 . . . A 68 LYS N . 18802 1 854 . 1 1 69 69 ARG H H 1 8.403 0.013 . 1 . . . A 69 ARG H . 18802 1 855 . 1 1 69 69 ARG HA H 1 4.191 0.008 . 1 . . . A 69 ARG HA . 18802 1 856 . 1 1 69 69 ARG HB2 H 1 1.663 0.012 . 2 . . . A 69 ARG HB2 . 18802 1 857 . 1 1 69 69 ARG HB3 H 1 1.734 0.019 . 2 . . . A 69 ARG HB3 . 18802 1 858 . 1 1 69 69 ARG HG2 H 1 1.465 0.019 . 1 . . . A 69 ARG HG2 . 18802 1 859 . 1 1 69 69 ARG HG3 H 1 1.465 0.019 . 1 . . . A 69 ARG HG3 . 18802 1 860 . 1 1 69 69 ARG HD2 H 1 3.071 0.006 . 1 . . . A 69 ARG HD2 . 18802 1 861 . 1 1 69 69 ARG HD3 H 1 3.071 0.006 . 1 . . . A 69 ARG HD3 . 18802 1 862 . 1 1 69 69 ARG C C 13 176.325 0.200 . 1 . . . A 69 ARG C . 18802 1 863 . 1 1 69 69 ARG CA C 13 56.382 0.052 . 1 . . . A 69 ARG CA . 18802 1 864 . 1 1 69 69 ARG CB C 13 30.656 0.055 . 1 . . . A 69 ARG CB . 18802 1 865 . 1 1 69 69 ARG CG C 13 27.499 0.052 . 1 . . . A 69 ARG CG . 18802 1 866 . 1 1 69 69 ARG CD C 13 43.456 0.031 . 1 . . . A 69 ARG CD . 18802 1 867 . 1 1 69 69 ARG N N 15 122.999 0.103 . 1 . . . A 69 ARG N . 18802 1 868 . 1 1 70 70 LEU H H 1 8.283 0.010 . 1 . . . A 70 LEU H . 18802 1 869 . 1 1 70 70 LEU HA H 1 4.263 0.015 . 1 . . . A 70 LEU HA . 18802 1 870 . 1 1 70 70 LEU HB2 H 1 1.437 0.011 . 2 . . . A 70 LEU HB2 . 18802 1 871 . 1 1 70 70 LEU HB3 H 1 1.494 0.007 . 2 . . . A 70 LEU HB3 . 18802 1 872 . 1 1 70 70 LEU HG H 1 1.515 0.014 . 1 . . . A 70 LEU HG . 18802 1 873 . 1 1 70 70 LEU HD11 H 1 0.785 0.005 . 2 . . . A 70 LEU MD1 . 18802 1 874 . 1 1 70 70 LEU HD12 H 1 0.785 0.005 . 2 . . . A 70 LEU MD1 . 18802 1 875 . 1 1 70 70 LEU HD13 H 1 0.785 0.005 . 2 . . . A 70 LEU MD1 . 18802 1 876 . 1 1 70 70 LEU HD21 H 1 0.753 0.007 . 2 . . . A 70 LEU MD2 . 18802 1 877 . 1 1 70 70 LEU HD22 H 1 0.753 0.007 . 2 . . . A 70 LEU MD2 . 18802 1 878 . 1 1 70 70 LEU HD23 H 1 0.753 0.007 . 2 . . . A 70 LEU MD2 . 18802 1 879 . 1 1 70 70 LEU C C 13 176.993 0.200 . 1 . . . A 70 LEU C . 18802 1 880 . 1 1 70 70 LEU CA C 13 55.034 0.122 . 1 . . . A 70 LEU CA . 18802 1 881 . 1 1 70 70 LEU CB C 13 42.941 0.159 . 1 . . . A 70 LEU CB . 18802 1 882 . 1 1 70 70 LEU CG C 13 27.145 0.068 . 1 . . . A 70 LEU CG . 18802 1 883 . 1 1 70 70 LEU CD1 C 13 25.183 0.016 . 2 . . . A 70 LEU CD1 . 18802 1 884 . 1 1 70 70 LEU CD2 C 13 23.524 0.046 . 2 . . . A 70 LEU CD2 . 18802 1 885 . 1 1 70 70 LEU N N 15 124.100 0.167 . 1 . . . A 70 LEU N . 18802 1 886 . 1 1 71 71 ASN H H 1 8.460 0.013 . 1 . . . A 71 ASN H . 18802 1 887 . 1 1 71 71 ASN HA H 1 4.747 0.003 . 1 . . . A 71 ASN HA . 18802 1 888 . 1 1 71 71 ASN HB2 H 1 2.761 0.033 . 2 . . . A 71 ASN HB2 . 18802 1 889 . 1 1 71 71 ASN HB3 H 1 2.817 0.012 . 2 . . . A 71 ASN HB3 . 18802 1 890 . 1 1 71 71 ASN HD21 H 1 6.882 0.020 . 1 . . . A 71 ASN HD21 . 18802 1 891 . 1 1 71 71 ASN HD22 H 1 6.882 0.020 . 1 . . . A 71 ASN HD22 . 18802 1 892 . 1 1 71 71 ASN C C 13 175.598 0.200 . 1 . . . A 71 ASN C . 18802 1 893 . 1 1 71 71 ASN CA C 13 52.680 0.297 . 1 . . . A 71 ASN CA . 18802 1 894 . 1 1 71 71 ASN CB C 13 38.723 0.247 . 1 . . . A 71 ASN CB . 18802 1 895 . 1 1 71 71 ASN CG C 13 177.150 0.200 . 1 . . . A 71 ASN CG . 18802 1 896 . 1 1 71 71 ASN N N 15 119.593 0.154 . 1 . . . A 71 ASN N . 18802 1 897 . 1 1 71 71 ASN ND2 N 15 112.535 0.200 . 1 . . . A 71 ASN ND2 . 18802 1 898 . 1 1 72 72 THR H H 1 8.031 0.014 . 1 . . . A 72 THR H . 18802 1 899 . 1 1 72 72 THR HA H 1 4.226 0.007 . 1 . . . A 72 THR HA . 18802 1 900 . 1 1 72 72 THR HB H 1 4.096 0.005 . 1 . . . A 72 THR HB . 18802 1 901 . 1 1 72 72 THR HG21 H 1 1.179 0.020 . 1 . . . A 72 THR MG . 18802 1 902 . 1 1 72 72 THR HG22 H 1 1.179 0.020 . 1 . . . A 72 THR MG . 18802 1 903 . 1 1 72 72 THR HG23 H 1 1.179 0.020 . 1 . . . A 72 THR MG . 18802 1 904 . 1 1 72 72 THR C C 13 175.186 0.200 . 1 . . . A 72 THR C . 18802 1 905 . 1 1 72 72 THR CA C 13 62.203 0.192 . 1 . . . A 72 THR CA . 18802 1 906 . 1 1 72 72 THR CB C 13 69.880 0.051 . 1 . . . A 72 THR CB . 18802 1 907 . 1 1 72 72 THR CG2 C 13 21.972 0.200 . 1 . . . A 72 THR CG2 . 18802 1 908 . 1 1 72 72 THR N N 15 114.100 0.072 . 1 . . . A 72 THR N . 18802 1 909 . 1 1 73 73 ARG H H 1 8.502 0.029 . 1 . . . A 73 ARG H . 18802 1 910 . 1 1 73 73 ARG HA H 1 4.113 0.007 . 1 . . . A 73 ARG HA . 18802 1 911 . 1 1 73 73 ARG HB2 H 1 1.822 0.003 . 1 . . . A 73 ARG HB2 . 18802 1 912 . 1 1 73 73 ARG HB3 H 1 1.822 0.003 . 1 . . . A 73 ARG HB3 . 18802 1 913 . 1 1 73 73 ARG HG2 H 1 1.545 0.008 . 2 . . . A 73 ARG HG2 . 18802 1 914 . 1 1 73 73 ARG HG3 H 1 1.640 0.011 . 2 . . . A 73 ARG HG3 . 18802 1 915 . 1 1 73 73 ARG HD2 H 1 3.167 0.013 . 1 . . . A 73 ARG HD2 . 18802 1 916 . 1 1 73 73 ARG HD3 H 1 3.167 0.013 . 1 . . . A 73 ARG HD3 . 18802 1 917 . 1 1 73 73 ARG HE H 1 7.665 0.020 . 1 . . . A 73 ARG HE . 18802 1 918 . 1 1 73 73 ARG C C 13 177.938 0.200 . 1 . . . A 73 ARG C . 18802 1 919 . 1 1 73 73 ARG CA C 13 58.412 0.183 . 1 . . . A 73 ARG CA . 18802 1 920 . 1 1 73 73 ARG CB C 13 30.297 0.140 . 1 . . . A 73 ARG CB . 18802 1 921 . 1 1 73 73 ARG CG C 13 27.378 0.178 . 1 . . . A 73 ARG CG . 18802 1 922 . 1 1 73 73 ARG CD C 13 43.540 0.113 . 1 . . . A 73 ARG CD . 18802 1 923 . 1 1 73 73 ARG N N 15 122.587 0.066 . 1 . . . A 73 ARG N . 18802 1 924 . 1 1 73 73 ARG NE N 15 84.769 0.200 . 1 . . . A 73 ARG NE . 18802 1 925 . 1 1 74 74 GLU H H 1 8.517 0.020 . 1 . . . A 74 GLU H . 18802 1 926 . 1 1 74 74 GLU HA H 1 4.017 0.012 . 1 . . . A 74 GLU HA . 18802 1 927 . 1 1 74 74 GLU HB2 H 1 1.915 0.020 . 2 . . . A 74 GLU HB2 . 18802 1 928 . 1 1 74 74 GLU HB3 H 1 1.982 0.007 . 2 . . . A 74 GLU HB3 . 18802 1 929 . 1 1 74 74 GLU HG2 H 1 2.180 0.002 . 1 . . . A 74 GLU HG2 . 18802 1 930 . 1 1 74 74 GLU HG3 H 1 2.180 0.002 . 1 . . . A 74 GLU HG3 . 18802 1 931 . 1 1 74 74 GLU C C 13 177.113 0.200 . 1 . . . A 74 GLU C . 18802 1 932 . 1 1 74 74 GLU CA C 13 58.680 0.079 . 1 . . . A 74 GLU CA . 18802 1 933 . 1 1 74 74 GLU CB C 13 29.666 0.269 . 1 . . . A 74 GLU CB . 18802 1 934 . 1 1 74 74 GLU CG C 13 36.703 0.200 . 1 . . . A 74 GLU CG . 18802 1 935 . 1 1 74 74 GLU N N 15 121.548 0.159 . 1 . . . A 74 GLU N . 18802 1 936 . 1 1 75 75 PHE H H 1 8.176 0.014 . 1 . . . A 75 PHE H . 18802 1 937 . 1 1 75 75 PHE HA H 1 4.322 0.002 . 1 . . . A 75 PHE HA . 18802 1 938 . 1 1 75 75 PHE HB2 H 1 3.129 0.020 . 1 . . . A 75 PHE HB2 . 18802 1 939 . 1 1 75 75 PHE HB3 H 1 3.129 0.020 . 1 . . . A 75 PHE HB3 . 18802 1 940 . 1 1 75 75 PHE HD1 H 1 7.175 0.005 . 1 . . . A 75 PHE HD1 . 18802 1 941 . 1 1 75 75 PHE HD2 H 1 7.175 0.005 . 1 . . . A 75 PHE HD2 . 18802 1 942 . 1 1 75 75 PHE HE1 H 1 7.307 0.020 . 1 . . . A 75 PHE HE1 . 18802 1 943 . 1 1 75 75 PHE HE2 H 1 7.307 0.020 . 1 . . . A 75 PHE HE2 . 18802 1 944 . 1 1 75 75 PHE HZ H 1 7.265 0.020 . 1 . . . A 75 PHE HZ . 18802 1 945 . 1 1 75 75 PHE C C 13 177.070 0.200 . 1 . . . A 75 PHE C . 18802 1 946 . 1 1 75 75 PHE CA C 13 60.075 0.109 . 1 . . . A 75 PHE CA . 18802 1 947 . 1 1 75 75 PHE CB C 13 39.486 0.053 . 1 . . . A 75 PHE CB . 18802 1 948 . 1 1 75 75 PHE CD1 C 13 131.852 0.057 . 1 . . . A 75 PHE CD1 . 18802 1 949 . 1 1 75 75 PHE CD2 C 13 131.852 0.057 . 1 . . . A 75 PHE CD2 . 18802 1 950 . 1 1 75 75 PHE CE1 C 13 131.640 0.200 . 1 . . . A 75 PHE CE1 . 18802 1 951 . 1 1 75 75 PHE CE2 C 13 131.640 0.200 . 1 . . . A 75 PHE CE2 . 18802 1 952 . 1 1 75 75 PHE N N 15 121.388 0.059 . 1 . . . A 75 PHE N . 18802 1 953 . 1 1 76 76 ARG H H 1 8.377 0.020 . 1 . . . A 76 ARG H . 18802 1 954 . 1 1 76 76 ARG C C 13 178.159 0.200 . 1 . . . A 76 ARG C . 18802 1 955 . 1 1 76 76 ARG CA C 13 58.533 0.200 . 1 . . . A 76 ARG CA . 18802 1 956 . 1 1 76 76 ARG CB C 13 30.588 0.200 . 1 . . . A 76 ARG CB . 18802 1 957 . 1 1 76 76 ARG N N 15 120.211 0.200 . 1 . . . A 76 ARG N . 18802 1 958 . 1 1 77 77 THR H H 1 7.992 0.009 . 1 . . . A 77 THR H . 18802 1 959 . 1 1 77 77 THR HA H 1 4.022 0.004 . 1 . . . A 77 THR HA . 18802 1 960 . 1 1 77 77 THR HB H 1 4.294 0.004 . 1 . . . A 77 THR HB . 18802 1 961 . 1 1 77 77 THR HG21 H 1 1.233 0.003 . 1 . . . A 77 THR MG . 18802 1 962 . 1 1 77 77 THR HG22 H 1 1.233 0.003 . 1 . . . A 77 THR MG . 18802 1 963 . 1 1 77 77 THR HG23 H 1 1.233 0.003 . 1 . . . A 77 THR MG . 18802 1 964 . 1 1 77 77 THR C C 13 175.301 0.200 . 1 . . . A 77 THR C . 18802 1 965 . 1 1 77 77 THR CA C 13 65.141 0.208 . 1 . . . A 77 THR CA . 18802 1 966 . 1 1 77 77 THR CB C 13 69.305 0.109 . 1 . . . A 77 THR CB . 18802 1 967 . 1 1 77 77 THR CG2 C 13 22.133 0.079 . 1 . . . A 77 THR CG2 . 18802 1 968 . 1 1 77 77 THR N N 15 115.416 0.077 . 1 . . . A 77 THR N . 18802 1 969 . 1 1 78 78 ARG H H 1 8.369 0.008 . 1 . . . A 78 ARG H . 18802 1 970 . 1 1 78 78 ARG HA H 1 4.307 0.024 . 1 . . . A 78 ARG HA . 18802 1 971 . 1 1 78 78 ARG HD2 H 1 3.469 0.020 . 1 . . . A 78 ARG HD2 . 18802 1 972 . 1 1 78 78 ARG HD3 H 1 3.469 0.020 . 1 . . . A 78 ARG HD3 . 18802 1 973 . 1 1 78 78 ARG C C 13 177.644 0.200 . 1 . . . A 78 ARG C . 18802 1 974 . 1 1 78 78 ARG CA C 13 60.611 0.200 . 1 . . . A 78 ARG CA . 18802 1 975 . 1 1 78 78 ARG CB C 13 29.808 0.200 . 1 . . . A 78 ARG CB . 18802 1 976 . 1 1 78 78 ARG N N 15 122.212 0.052 . 1 . . . A 78 ARG N . 18802 1 977 . 1 1 79 79 LYS H H 1 7.941 0.020 . 1 . . . A 79 LYS H . 18802 1 978 . 1 1 79 79 LYS HA H 1 3.960 0.009 . 1 . . . A 79 LYS HA . 18802 1 979 . 1 1 79 79 LYS HB2 H 1 1.695 0.004 . 1 . . . A 79 LYS HB2 . 18802 1 980 . 1 1 79 79 LYS HB3 H 1 1.695 0.004 . 1 . . . A 79 LYS HB3 . 18802 1 981 . 1 1 79 79 LYS HG2 H 1 1.248 0.006 . 2 . . . A 79 LYS HG2 . 18802 1 982 . 1 1 79 79 LYS HG3 H 1 1.343 0.006 . 2 . . . A 79 LYS HG3 . 18802 1 983 . 1 1 79 79 LYS HD2 H 1 1.568 0.008 . 1 . . . A 79 LYS HD2 . 18802 1 984 . 1 1 79 79 LYS HD3 H 1 1.568 0.008 . 1 . . . A 79 LYS HD3 . 18802 1 985 . 1 1 79 79 LYS HE2 H 1 2.845 0.027 . 2 . . . A 79 LYS HE2 . 18802 1 986 . 1 1 79 79 LYS HE3 H 1 2.904 0.029 . 2 . . . A 79 LYS HE3 . 18802 1 987 . 1 1 79 79 LYS C C 13 178.913 0.200 . 1 . . . A 79 LYS C . 18802 1 988 . 1 1 79 79 LYS CA C 13 59.050 0.108 . 1 . . . A 79 LYS CA . 18802 1 989 . 1 1 79 79 LYS CB C 13 32.141 0.095 . 1 . . . A 79 LYS CB . 18802 1 990 . 1 1 79 79 LYS CG C 13 24.611 0.230 . 1 . . . A 79 LYS CG . 18802 1 991 . 1 1 79 79 LYS CD C 13 28.974 0.200 . 1 . . . A 79 LYS CD . 18802 1 992 . 1 1 79 79 LYS CE C 13 42.119 0.046 . 1 . . . A 79 LYS CE . 18802 1 993 . 1 1 79 79 LYS N N 15 117.591 0.155 . 1 . . . A 79 LYS N . 18802 1 994 . 1 1 80 80 LYS H H 1 7.615 0.009 . 1 . . . A 80 LYS H . 18802 1 995 . 1 1 80 80 LYS HA H 1 4.146 0.007 . 1 . . . A 80 LYS HA . 18802 1 996 . 1 1 80 80 LYS HB2 H 1 1.927 0.008 . 2 . . . A 80 LYS HB2 . 18802 1 997 . 1 1 80 80 LYS HB3 H 1 1.989 0.008 . 2 . . . A 80 LYS HB3 . 18802 1 998 . 1 1 80 80 LYS HG2 H 1 1.455 0.012 . 2 . . . A 80 LYS HG2 . 18802 1 999 . 1 1 80 80 LYS HG3 H 1 1.539 0.013 . 2 . . . A 80 LYS HG3 . 18802 1 1000 . 1 1 80 80 LYS HD2 H 1 1.672 0.017 . 2 . . . A 80 LYS HD2 . 18802 1 1001 . 1 1 80 80 LYS HD3 H 1 1.723 0.007 . 2 . . . A 80 LYS HD3 . 18802 1 1002 . 1 1 80 80 LYS HE2 H 1 2.952 0.009 . 1 . . . A 80 LYS HE2 . 18802 1 1003 . 1 1 80 80 LYS HE3 H 1 2.952 0.009 . 1 . . . A 80 LYS HE3 . 18802 1 1004 . 1 1 80 80 LYS C C 13 179.377 0.200 . 1 . . . A 80 LYS C . 18802 1 1005 . 1 1 80 80 LYS CA C 13 58.979 0.047 . 1 . . . A 80 LYS CA . 18802 1 1006 . 1 1 80 80 LYS CB C 13 32.191 0.109 . 1 . . . A 80 LYS CB . 18802 1 1007 . 1 1 80 80 LYS CG C 13 24.883 0.088 . 1 . . . A 80 LYS CG . 18802 1 1008 . 1 1 80 80 LYS CD C 13 29.070 0.040 . 1 . . . A 80 LYS CD . 18802 1 1009 . 1 1 80 80 LYS CE C 13 42.439 0.200 . 1 . . . A 80 LYS CE . 18802 1 1010 . 1 1 80 80 LYS N N 15 119.769 0.017 . 1 . . . A 80 LYS N . 18802 1 1011 . 1 1 81 81 LEU H H 1 8.057 0.006 . 1 . . . A 81 LEU H . 18802 1 1012 . 1 1 81 81 LEU HA H 1 4.117 0.011 . 1 . . . A 81 LEU HA . 18802 1 1013 . 1 1 81 81 LEU HB2 H 1 2.034 0.008 . 2 . . . A 81 LEU HB2 . 18802 1 1014 . 1 1 81 81 LEU HB3 H 1 1.302 0.013 . 2 . . . A 81 LEU HB3 . 18802 1 1015 . 1 1 81 81 LEU HG H 1 1.857 0.004 . 1 . . . A 81 LEU HG . 18802 1 1016 . 1 1 81 81 LEU HD11 H 1 0.803 0.011 . 2 . . . A 81 LEU MD1 . 18802 1 1017 . 1 1 81 81 LEU HD12 H 1 0.803 0.011 . 2 . . . A 81 LEU MD1 . 18802 1 1018 . 1 1 81 81 LEU HD13 H 1 0.803 0.011 . 2 . . . A 81 LEU MD1 . 18802 1 1019 . 1 1 81 81 LEU HD21 H 1 0.798 0.026 . 2 . . . A 81 LEU MD2 . 18802 1 1020 . 1 1 81 81 LEU HD22 H 1 0.798 0.026 . 2 . . . A 81 LEU MD2 . 18802 1 1021 . 1 1 81 81 LEU HD23 H 1 0.798 0.026 . 2 . . . A 81 LEU MD2 . 18802 1 1022 . 1 1 81 81 LEU C C 13 179.481 0.200 . 1 . . . A 81 LEU C . 18802 1 1023 . 1 1 81 81 LEU CA C 13 58.261 0.077 . 1 . . . A 81 LEU CA . 18802 1 1024 . 1 1 81 81 LEU CB C 13 42.004 0.107 . 1 . . . A 81 LEU CB . 18802 1 1025 . 1 1 81 81 LEU CG C 13 27.327 0.029 . 1 . . . A 81 LEU CG . 18802 1 1026 . 1 1 81 81 LEU CD1 C 13 26.235 0.040 . 2 . . . A 81 LEU CD1 . 18802 1 1027 . 1 1 81 81 LEU CD2 C 13 23.244 0.008 . 2 . . . A 81 LEU CD2 . 18802 1 1028 . 1 1 81 81 LEU N N 15 120.500 0.103 . 1 . . . A 81 LEU N . 18802 1 1029 . 1 1 82 82 GLU H H 1 8.652 0.005 . 1 . . . A 82 GLU H . 18802 1 1030 . 1 1 82 82 GLU HA H 1 3.989 0.017 . 1 . . . A 82 GLU HA . 18802 1 1031 . 1 1 82 82 GLU HB2 H 1 2.236 0.008 . 2 . . . A 82 GLU HB2 . 18802 1 1032 . 1 1 82 82 GLU HB3 H 1 2.029 0.006 . 2 . . . A 82 GLU HB3 . 18802 1 1033 . 1 1 82 82 GLU HG2 H 1 2.518 0.008 . 2 . . . A 82 GLU HG2 . 18802 1 1034 . 1 1 82 82 GLU HG3 H 1 2.188 0.017 . 2 . . . A 82 GLU HG3 . 18802 1 1035 . 1 1 82 82 GLU C C 13 180.577 0.200 . 1 . . . A 82 GLU C . 18802 1 1036 . 1 1 82 82 GLU CA C 13 59.810 0.104 . 1 . . . A 82 GLU CA . 18802 1 1037 . 1 1 82 82 GLU CB C 13 30.009 0.117 . 1 . . . A 82 GLU CB . 18802 1 1038 . 1 1 82 82 GLU CG C 13 37.401 0.074 . 1 . . . A 82 GLU CG . 18802 1 1039 . 1 1 82 82 GLU N N 15 118.803 0.200 . 1 . . . A 82 GLU N . 18802 1 1040 . 1 1 83 83 GLU H H 1 8.281 0.020 . 1 . . . A 83 GLU H . 18802 1 1041 . 1 1 83 83 GLU HA H 1 4.106 0.004 . 1 . . . A 83 GLU HA . 18802 1 1042 . 1 1 83 83 GLU HB2 H 1 2.179 0.002 . 2 . . . A 83 GLU HB2 . 18802 1 1043 . 1 1 83 83 GLU HB3 H 1 2.046 0.005 . 2 . . . A 83 GLU HB3 . 18802 1 1044 . 1 1 83 83 GLU HG2 H 1 2.241 0.020 . 2 . . . A 83 GLU HG2 . 18802 1 1045 . 1 1 83 83 GLU HG3 H 1 2.452 0.020 . 2 . . . A 83 GLU HG3 . 18802 1 1046 . 1 1 83 83 GLU C C 13 178.457 0.200 . 1 . . . A 83 GLU C . 18802 1 1047 . 1 1 83 83 GLU CA C 13 59.826 0.117 . 1 . . . A 83 GLU CA . 18802 1 1048 . 1 1 83 83 GLU CB C 13 29.562 0.146 . 1 . . . A 83 GLU CB . 18802 1 1049 . 1 1 83 83 GLU CG C 13 36.432 0.200 . 1 . . . A 83 GLU CG . 18802 1 1050 . 1 1 83 83 GLU N N 15 122.396 0.067 . 1 . . . A 83 GLU N . 18802 1 1051 . 1 1 84 84 GLU H H 1 8.321 0.017 . 1 . . . A 84 GLU H . 18802 1 1052 . 1 1 84 84 GLU HA H 1 4.092 0.004 . 1 . . . A 84 GLU HA . 18802 1 1053 . 1 1 84 84 GLU HB2 H 1 2.048 0.005 . 2 . . . A 84 GLU HB2 . 18802 1 1054 . 1 1 84 84 GLU HB3 H 1 2.150 0.014 . 2 . . . A 84 GLU HB3 . 18802 1 1055 . 1 1 84 84 GLU HG2 H 1 2.174 0.020 . 2 . . . A 84 GLU HG2 . 18802 1 1056 . 1 1 84 84 GLU HG3 H 1 2.413 0.016 . 2 . . . A 84 GLU HG3 . 18802 1 1057 . 1 1 84 84 GLU C C 13 179.343 0.200 . 1 . . . A 84 GLU C . 18802 1 1058 . 1 1 84 84 GLU CA C 13 59.696 0.042 . 1 . . . A 84 GLU CA . 18802 1 1059 . 1 1 84 84 GLU CB C 13 29.570 0.200 . 1 . . . A 84 GLU CB . 18802 1 1060 . 1 1 84 84 GLU CG C 13 36.281 0.107 . 1 . . . A 84 GLU CG . 18802 1 1061 . 1 1 84 84 GLU N N 15 120.976 0.032 . 1 . . . A 84 GLU N . 18802 1 1062 . 1 1 85 85 ARG H H 1 8.594 0.010 . 1 . . . A 85 ARG H . 18802 1 1063 . 1 1 85 85 ARG HA H 1 3.792 0.020 . 1 . . . A 85 ARG HA . 18802 1 1064 . 1 1 85 85 ARG HB2 H 1 2.196 0.020 . 2 . . . A 85 ARG HB2 . 18802 1 1065 . 1 1 85 85 ARG HB3 H 1 1.737 0.020 . 2 . . . A 85 ARG HB3 . 18802 1 1066 . 1 1 85 85 ARG HD2 H 1 2.827 0.007 . 2 . . . A 85 ARG HD2 . 18802 1 1067 . 1 1 85 85 ARG HD3 H 1 3.079 0.020 . 2 . . . A 85 ARG HD3 . 18802 1 1068 . 1 1 85 85 ARG HE H 1 7.775 0.020 . 1 . . . A 85 ARG HE . 18802 1 1069 . 1 1 85 85 ARG C C 13 177.178 0.200 . 1 . . . A 85 ARG C . 18802 1 1070 . 1 1 85 85 ARG CA C 13 60.483 0.200 . 1 . . . A 85 ARG CA . 18802 1 1071 . 1 1 85 85 ARG CB C 13 30.149 0.001 . 1 . . . A 85 ARG CB . 18802 1 1072 . 1 1 85 85 ARG CG C 13 27.683 0.001 . 1 . . . A 85 ARG CG . 18802 1 1073 . 1 1 85 85 ARG CD C 13 44.272 0.057 . 1 . . . A 85 ARG CD . 18802 1 1074 . 1 1 85 85 ARG N N 15 118.559 0.200 . 1 . . . A 85 ARG N . 18802 1 1075 . 1 1 85 85 ARG NE N 15 81.474 0.200 . 1 . . . A 85 ARG NE . 18802 1 1076 . 1 1 86 86 HIS H H 1 8.465 0.017 . 1 . . . A 86 HIS H . 18802 1 1077 . 1 1 86 86 HIS HA H 1 4.341 0.002 . 1 . . . A 86 HIS HA . 18802 1 1078 . 1 1 86 86 HIS HB2 H 1 3.404 0.011 . 2 . . . A 86 HIS HB2 . 18802 1 1079 . 1 1 86 86 HIS HB3 H 1 3.468 0.011 . 2 . . . A 86 HIS HB3 . 18802 1 1080 . 1 1 86 86 HIS HD2 H 1 7.111 0.003 . 1 . . . A 86 HIS HD2 . 18802 1 1081 . 1 1 86 86 HIS HE1 H 1 7.784 0.020 . 1 . . . A 86 HIS HE1 . 18802 1 1082 . 1 1 86 86 HIS C C 13 177.578 0.200 . 1 . . . A 86 HIS C . 18802 1 1083 . 1 1 86 86 HIS CA C 13 60.617 0.081 . 1 . . . A 86 HIS CA . 18802 1 1084 . 1 1 86 86 HIS CB C 13 30.509 0.281 . 1 . . . A 86 HIS CB . 18802 1 1085 . 1 1 86 86 HIS CD2 C 13 119.445 0.200 . 1 . . . A 86 HIS CD2 . 18802 1 1086 . 1 1 86 86 HIS CE1 C 13 138.556 0.200 . 1 . . . A 86 HIS CE1 . 18802 1 1087 . 1 1 86 86 HIS N N 15 119.632 0.163 . 1 . . . A 86 HIS N . 18802 1 1088 . 1 1 87 87 ASN H H 1 8.323 0.025 . 1 . . . A 87 ASN H . 18802 1 1089 . 1 1 87 87 ASN HA H 1 4.278 0.004 . 1 . . . A 87 ASN HA . 18802 1 1090 . 1 1 87 87 ASN HB2 H 1 2.958 0.004 . 2 . . . A 87 ASN HB2 . 18802 1 1091 . 1 1 87 87 ASN HB3 H 1 2.795 0.003 . 2 . . . A 87 ASN HB3 . 18802 1 1092 . 1 1 87 87 ASN HD21 H 1 7.057 0.005 . 2 . . . A 87 ASN HD21 . 18802 1 1093 . 1 1 87 87 ASN HD22 H 1 7.622 0.002 . 2 . . . A 87 ASN HD22 . 18802 1 1094 . 1 1 87 87 ASN C C 13 178.630 0.200 . 1 . . . A 87 ASN C . 18802 1 1095 . 1 1 87 87 ASN CA C 13 56.281 0.073 . 1 . . . A 87 ASN CA . 18802 1 1096 . 1 1 87 87 ASN CB C 13 37.695 0.116 . 1 . . . A 87 ASN CB . 18802 1 1097 . 1 1 87 87 ASN CG C 13 175.738 0.200 . 1 . . . A 87 ASN CG . 18802 1 1098 . 1 1 87 87 ASN N N 15 119.587 0.034 . 1 . . . A 87 ASN N . 18802 1 1099 . 1 1 87 87 ASN ND2 N 15 112.600 0.354 . 1 . . . A 87 ASN ND2 . 18802 1 1100 . 1 1 88 88 LEU H H 1 7.966 0.011 . 1 . . . A 88 LEU H . 18802 1 1101 . 1 1 88 88 LEU HA H 1 4.116 0.013 . 1 . . . A 88 LEU HA . 18802 1 1102 . 1 1 88 88 LEU HB2 H 1 1.841 0.020 . 2 . . . A 88 LEU HB2 . 18802 1 1103 . 1 1 88 88 LEU HB3 H 1 1.238 0.020 . 2 . . . A 88 LEU HB3 . 18802 1 1104 . 1 1 88 88 LEU HG H 1 1.803 0.020 . 1 . . . A 88 LEU HG . 18802 1 1105 . 1 1 88 88 LEU HD11 H 1 0.814 0.020 . 2 . . . A 88 LEU MD1 . 18802 1 1106 . 1 1 88 88 LEU HD12 H 1 0.814 0.020 . 2 . . . A 88 LEU MD1 . 18802 1 1107 . 1 1 88 88 LEU HD13 H 1 0.814 0.020 . 2 . . . A 88 LEU MD1 . 18802 1 1108 . 1 1 88 88 LEU HD21 H 1 0.868 0.016 . 2 . . . A 88 LEU MD2 . 18802 1 1109 . 1 1 88 88 LEU HD22 H 1 0.868 0.016 . 2 . . . A 88 LEU MD2 . 18802 1 1110 . 1 1 88 88 LEU HD23 H 1 0.868 0.016 . 2 . . . A 88 LEU MD2 . 18802 1 1111 . 1 1 88 88 LEU C C 13 178.539 0.200 . 1 . . . A 88 LEU C . 18802 1 1112 . 1 1 88 88 LEU CA C 13 57.979 0.002 . 1 . . . A 88 LEU CA . 18802 1 1113 . 1 1 88 88 LEU CB C 13 42.594 0.200 . 1 . . . A 88 LEU CB . 18802 1 1114 . 1 1 88 88 LEU CG C 13 27.319 0.200 . 1 . . . A 88 LEU CG . 18802 1 1115 . 1 1 88 88 LEU CD1 C 13 27.546 0.200 . 2 . . . A 88 LEU CD1 . 18802 1 1116 . 1 1 88 88 LEU CD2 C 13 22.825 0.200 . 2 . . . A 88 LEU CD2 . 18802 1 1117 . 1 1 88 88 LEU N N 15 122.320 0.045 . 1 . . . A 88 LEU N . 18802 1 1118 . 1 1 89 89 ILE H H 1 8.472 0.018 . 1 . . . A 89 ILE H . 18802 1 1119 . 1 1 89 89 ILE HA H 1 3.236 0.016 . 1 . . . A 89 ILE HA . 18802 1 1120 . 1 1 89 89 ILE HB H 1 1.678 0.011 . 1 . . . A 89 ILE HB . 18802 1 1121 . 1 1 89 89 ILE HG12 H 1 0.679 0.011 . 2 . . . A 89 ILE HG12 . 18802 1 1122 . 1 1 89 89 ILE HG13 H 1 1.723 0.008 . 2 . . . A 89 ILE HG13 . 18802 1 1123 . 1 1 89 89 ILE HG21 H 1 0.538 0.023 . 1 . . . A 89 ILE MG . 18802 1 1124 . 1 1 89 89 ILE HG22 H 1 0.538 0.023 . 1 . . . A 89 ILE MG . 18802 1 1125 . 1 1 89 89 ILE HG23 H 1 0.538 0.023 . 1 . . . A 89 ILE MG . 18802 1 1126 . 1 1 89 89 ILE HD11 H 1 0.230 0.006 . 1 . . . A 89 ILE MD . 18802 1 1127 . 1 1 89 89 ILE HD12 H 1 0.230 0.006 . 1 . . . A 89 ILE MD . 18802 1 1128 . 1 1 89 89 ILE HD13 H 1 0.230 0.006 . 1 . . . A 89 ILE MD . 18802 1 1129 . 1 1 89 89 ILE C C 13 176.959 0.200 . 1 . . . A 89 ILE C . 18802 1 1130 . 1 1 89 89 ILE CA C 13 66.054 0.060 . 1 . . . A 89 ILE CA . 18802 1 1131 . 1 1 89 89 ILE CB C 13 37.603 0.070 . 1 . . . A 89 ILE CB . 18802 1 1132 . 1 1 89 89 ILE CG1 C 13 31.105 0.110 . 1 . . . A 89 ILE CG1 . 18802 1 1133 . 1 1 89 89 ILE CG2 C 13 17.133 0.114 . 1 . . . A 89 ILE CG2 . 18802 1 1134 . 1 1 89 89 ILE CD1 C 13 14.256 0.035 . 1 . . . A 89 ILE CD1 . 18802 1 1135 . 1 1 89 89 ILE N N 15 121.495 0.031 . 1 . . . A 89 ILE N . 18802 1 1136 . 1 1 90 90 THR H H 1 8.075 0.007 . 1 . . . A 90 THR H . 18802 1 1137 . 1 1 90 90 THR HA H 1 3.718 0.006 . 1 . . . A 90 THR HA . 18802 1 1138 . 1 1 90 90 THR HB H 1 4.182 0.002 . 1 . . . A 90 THR HB . 18802 1 1139 . 1 1 90 90 THR HG21 H 1 1.099 0.004 . 1 . . . A 90 THR MG . 18802 1 1140 . 1 1 90 90 THR HG22 H 1 1.099 0.004 . 1 . . . A 90 THR MG . 18802 1 1141 . 1 1 90 90 THR HG23 H 1 1.099 0.004 . 1 . . . A 90 THR MG . 18802 1 1142 . 1 1 90 90 THR C C 13 176.559 0.200 . 1 . . . A 90 THR C . 18802 1 1143 . 1 1 90 90 THR CA C 13 66.700 0.157 . 1 . . . A 90 THR CA . 18802 1 1144 . 1 1 90 90 THR CB C 13 68.759 0.060 . 1 . . . A 90 THR CB . 18802 1 1145 . 1 1 90 90 THR CG2 C 13 21.474 0.003 . 1 . . . A 90 THR CG2 . 18802 1 1146 . 1 1 90 90 THR N N 15 115.066 0.040 . 1 . . . A 90 THR N . 18802 1 1147 . 1 1 91 91 GLU H H 1 7.368 0.013 . 1 . . . A 91 GLU H . 18802 1 1148 . 1 1 91 91 GLU HA H 1 3.932 0.005 . 1 . . . A 91 GLU HA . 18802 1 1149 . 1 1 91 91 GLU HB2 H 1 1.950 0.019 . 2 . . . A 91 GLU HB2 . 18802 1 1150 . 1 1 91 91 GLU HB3 H 1 2.093 0.019 . 2 . . . A 91 GLU HB3 . 18802 1 1151 . 1 1 91 91 GLU HG2 H 1 1.984 0.003 . 2 . . . A 91 GLU HG2 . 18802 1 1152 . 1 1 91 91 GLU HG3 H 1 2.271 0.016 . 2 . . . A 91 GLU HG3 . 18802 1 1153 . 1 1 91 91 GLU C C 13 178.191 0.200 . 1 . . . A 91 GLU C . 18802 1 1154 . 1 1 91 91 GLU CA C 13 59.340 0.142 . 1 . . . A 91 GLU CA . 18802 1 1155 . 1 1 91 91 GLU CB C 13 29.399 0.085 . 1 . . . A 91 GLU CB . 18802 1 1156 . 1 1 91 91 GLU CG C 13 35.645 0.068 . 1 . . . A 91 GLU CG . 18802 1 1157 . 1 1 91 91 GLU N N 15 123.259 0.325 . 1 . . . A 91 GLU N . 18802 1 1158 . 1 1 92 92 MET H H 1 8.373 0.020 . 1 . . . A 92 MET H . 18802 1 1159 . 1 1 92 92 MET HA H 1 4.014 0.004 . 1 . . . A 92 MET HA . 18802 1 1160 . 1 1 92 92 MET HB2 H 1 1.972 0.020 . 1 . . . A 92 MET HB2 . 18802 1 1161 . 1 1 92 92 MET HB3 H 1 1.972 0.020 . 1 . . . A 92 MET HB3 . 18802 1 1162 . 1 1 92 92 MET HG2 H 1 2.155 0.020 . 2 . . . A 92 MET HG2 . 18802 1 1163 . 1 1 92 92 MET HG3 H 1 2.249 0.040 . 2 . . . A 92 MET HG3 . 18802 1 1164 . 1 1 92 92 MET HE1 H 1 1.859 0.020 . 1 . . . A 92 MET ME . 18802 1 1165 . 1 1 92 92 MET HE2 H 1 1.859 0.020 . 1 . . . A 92 MET ME . 18802 1 1166 . 1 1 92 92 MET HE3 H 1 1.859 0.020 . 1 . . . A 92 MET ME . 18802 1 1167 . 1 1 92 92 MET C C 13 177.888 0.200 . 1 . . . A 92 MET C . 18802 1 1168 . 1 1 92 92 MET CA C 13 57.183 0.177 . 1 . . . A 92 MET CA . 18802 1 1169 . 1 1 92 92 MET CB C 13 32.126 0.200 . 1 . . . A 92 MET CB . 18802 1 1170 . 1 1 92 92 MET CG C 13 29.926 0.200 . 1 . . . A 92 MET CG . 18802 1 1171 . 1 1 92 92 MET N N 15 119.844 0.082 . 1 . . . A 92 MET N . 18802 1 1172 . 1 1 93 93 VAL H H 1 8.279 0.012 . 1 . . . A 93 VAL H . 18802 1 1173 . 1 1 93 93 VAL HA H 1 3.896 0.003 . 1 . . . A 93 VAL HA . 18802 1 1174 . 1 1 93 93 VAL HB H 1 2.082 0.006 . 1 . . . A 93 VAL HB . 18802 1 1175 . 1 1 93 93 VAL HG11 H 1 1.008 0.003 . 2 . . . A 93 VAL MG1 . 18802 1 1176 . 1 1 93 93 VAL HG12 H 1 1.008 0.003 . 2 . . . A 93 VAL MG1 . 18802 1 1177 . 1 1 93 93 VAL HG13 H 1 1.008 0.003 . 2 . . . A 93 VAL MG1 . 18802 1 1178 . 1 1 93 93 VAL HG21 H 1 1.114 0.001 . 2 . . . A 93 VAL MG2 . 18802 1 1179 . 1 1 93 93 VAL HG22 H 1 1.114 0.001 . 2 . . . A 93 VAL MG2 . 18802 1 1180 . 1 1 93 93 VAL HG23 H 1 1.114 0.001 . 2 . . . A 93 VAL MG2 . 18802 1 1181 . 1 1 93 93 VAL C C 13 177.567 0.200 . 1 . . . A 93 VAL C . 18802 1 1182 . 1 1 93 93 VAL CA C 13 64.870 0.035 . 1 . . . A 93 VAL CA . 18802 1 1183 . 1 1 93 93 VAL CB C 13 32.002 0.020 . 1 . . . A 93 VAL CB . 18802 1 1184 . 1 1 93 93 VAL CG1 C 13 21.460 0.003 . 2 . . . A 93 VAL CG1 . 18802 1 1185 . 1 1 93 93 VAL CG2 C 13 22.646 0.013 . 2 . . . A 93 VAL CG2 . 18802 1 1186 . 1 1 93 93 VAL N N 15 117.572 0.078 . 1 . . . A 93 VAL N . 18802 1 1187 . 1 1 94 94 ALA H H 1 7.074 0.014 . 1 . . . A 94 ALA H . 18802 1 1188 . 1 1 94 94 ALA HA H 1 4.136 0.003 . 1 . . . A 94 ALA HA . 18802 1 1189 . 1 1 94 94 ALA HB1 H 1 1.442 0.002 . 1 . . . A 94 ALA MB . 18802 1 1190 . 1 1 94 94 ALA HB2 H 1 1.442 0.002 . 1 . . . A 94 ALA MB . 18802 1 1191 . 1 1 94 94 ALA HB3 H 1 1.442 0.002 . 1 . . . A 94 ALA MB . 18802 1 1192 . 1 1 94 94 ALA C C 13 179.595 0.200 . 1 . . . A 94 ALA C . 18802 1 1193 . 1 1 94 94 ALA CA C 13 54.103 0.021 . 1 . . . A 94 ALA CA . 18802 1 1194 . 1 1 94 94 ALA CB C 13 18.250 0.019 . 1 . . . A 94 ALA CB . 18802 1 1195 . 1 1 94 94 ALA N N 15 120.560 0.066 . 1 . . . A 94 ALA N . 18802 1 1196 . 1 1 95 95 LEU H H 1 7.525 0.008 . 1 . . . A 95 LEU H . 18802 1 1197 . 1 1 95 95 LEU HA H 1 4.140 0.012 . 1 . . . A 95 LEU HA . 18802 1 1198 . 1 1 95 95 LEU HB2 H 1 1.866 0.008 . 2 . . . A 95 LEU HB2 . 18802 1 1199 . 1 1 95 95 LEU HB3 H 1 1.390 0.017 . 2 . . . A 95 LEU HB3 . 18802 1 1200 . 1 1 95 95 LEU HG H 1 1.796 0.014 . 1 . . . A 95 LEU HG . 18802 1 1201 . 1 1 95 95 LEU HD11 H 1 0.777 0.006 . 2 . . . A 95 LEU MD1 . 18802 1 1202 . 1 1 95 95 LEU HD12 H 1 0.777 0.006 . 2 . . . A 95 LEU MD1 . 18802 1 1203 . 1 1 95 95 LEU HD13 H 1 0.777 0.006 . 2 . . . A 95 LEU MD1 . 18802 1 1204 . 1 1 95 95 LEU HD21 H 1 0.854 0.006 . 2 . . . A 95 LEU MD2 . 18802 1 1205 . 1 1 95 95 LEU HD22 H 1 0.854 0.006 . 2 . . . A 95 LEU MD2 . 18802 1 1206 . 1 1 95 95 LEU HD23 H 1 0.854 0.006 . 2 . . . A 95 LEU MD2 . 18802 1 1207 . 1 1 95 95 LEU C C 13 177.863 0.200 . 1 . . . A 95 LEU C . 18802 1 1208 . 1 1 95 95 LEU CA C 13 56.672 0.033 . 1 . . . A 95 LEU CA . 18802 1 1209 . 1 1 95 95 LEU CB C 13 43.234 0.166 . 1 . . . A 95 LEU CB . 18802 1 1210 . 1 1 95 95 LEU CG C 13 26.680 0.286 . 1 . . . A 95 LEU CG . 18802 1 1211 . 1 1 95 95 LEU CD1 C 13 25.199 0.019 . 2 . . . A 95 LEU CD1 . 18802 1 1212 . 1 1 95 95 LEU CD2 C 13 22.837 0.019 . 2 . . . A 95 LEU CD2 . 18802 1 1213 . 1 1 95 95 LEU N N 15 117.987 0.008 . 1 . . . A 95 LEU N . 18802 1 1214 . 1 1 96 96 ASN H H 1 8.467 0.007 . 1 . . . A 96 ASN H . 18802 1 1215 . 1 1 96 96 ASN HA H 1 5.018 0.004 . 1 . . . A 96 ASN HA . 18802 1 1216 . 1 1 96 96 ASN HB2 H 1 2.880 0.005 . 2 . . . A 96 ASN HB2 . 18802 1 1217 . 1 1 96 96 ASN HB3 H 1 2.585 0.020 . 2 . . . A 96 ASN HB3 . 18802 1 1218 . 1 1 96 96 ASN HD21 H 1 7.073 0.012 . 2 . . . A 96 ASN HD21 . 18802 1 1219 . 1 1 96 96 ASN HD22 H 1 7.360 0.020 . 2 . . . A 96 ASN HD22 . 18802 1 1220 . 1 1 96 96 ASN C C 13 172.510 0.200 . 1 . . . A 96 ASN C . 18802 1 1221 . 1 1 96 96 ASN CA C 13 50.101 0.049 . 1 . . . A 96 ASN CA . 18802 1 1222 . 1 1 96 96 ASN CB C 13 39.305 0.156 . 1 . . . A 96 ASN CB . 18802 1 1223 . 1 1 96 96 ASN CG C 13 177.922 0.200 . 1 . . . A 96 ASN CG . 18802 1 1224 . 1 1 96 96 ASN N N 15 115.338 0.043 . 1 . . . A 96 ASN N . 18802 1 1225 . 1 1 96 96 ASN ND2 N 15 110.107 0.200 . 1 . . . A 96 ASN ND2 . 18802 1 1226 . 1 1 97 97 PRO HA H 1 4.656 0.005 . 1 . . . A 97 PRO HA . 18802 1 1227 . 1 1 97 97 PRO HB2 H 1 2.413 0.003 . 2 . . . A 97 PRO HB2 . 18802 1 1228 . 1 1 97 97 PRO HB3 H 1 1.952 0.012 . 2 . . . A 97 PRO HB3 . 18802 1 1229 . 1 1 97 97 PRO HG2 H 1 2.029 0.002 . 1 . . . A 97 PRO HG2 . 18802 1 1230 . 1 1 97 97 PRO HG3 H 1 2.029 0.002 . 1 . . . A 97 PRO HG3 . 18802 1 1231 . 1 1 97 97 PRO HD2 H 1 3.842 0.004 . 2 . . . A 97 PRO HD2 . 18802 1 1232 . 1 1 97 97 PRO HD3 H 1 3.540 0.009 . 2 . . . A 97 PRO HD3 . 18802 1 1233 . 1 1 97 97 PRO C C 13 177.020 0.200 . 1 . . . A 97 PRO C . 18802 1 1234 . 1 1 97 97 PRO CA C 13 64.298 0.200 . 1 . . . A 97 PRO CA . 18802 1 1235 . 1 1 97 97 PRO CB C 13 32.299 0.058 . 1 . . . A 97 PRO CB . 18802 1 1236 . 1 1 97 97 PRO CG C 13 27.021 0.062 . 1 . . . A 97 PRO CG . 18802 1 1237 . 1 1 97 97 PRO CD C 13 50.630 0.073 . 1 . . . A 97 PRO CD . 18802 1 1238 . 1 1 98 98 ASP H H 1 7.600 0.036 . 1 . . . A 98 ASP H . 18802 1 1239 . 1 1 98 98 ASP HA H 1 4.669 0.014 . 1 . . . A 98 ASP HA . 18802 1 1240 . 1 1 98 98 ASP HB2 H 1 2.543 0.004 . 2 . . . A 98 ASP HB2 . 18802 1 1241 . 1 1 98 98 ASP HB3 H 1 2.766 0.006 . 2 . . . A 98 ASP HB3 . 18802 1 1242 . 1 1 98 98 ASP C C 13 176.004 0.200 . 1 . . . A 98 ASP C . 18802 1 1243 . 1 1 98 98 ASP CA C 13 54.366 0.200 . 1 . . . A 98 ASP CA . 18802 1 1244 . 1 1 98 98 ASP CB C 13 41.324 0.301 . 1 . . . A 98 ASP CB . 18802 1 1245 . 1 1 98 98 ASP CG C 13 179.922 0.200 . 1 . . . A 98 ASP CG . 18802 1 1246 . 1 1 98 98 ASP N N 15 115.744 0.091 . 1 . . . A 98 ASP N . 18802 1 1247 . 1 1 99 99 PHE H H 1 7.940 0.005 . 1 . . . A 99 PHE H . 18802 1 1248 . 1 1 99 99 PHE HA H 1 4.135 0.005 . 1 . . . A 99 PHE HA . 18802 1 1249 . 1 1 99 99 PHE HB2 H 1 2.833 0.020 . 2 . . . A 99 PHE HB2 . 18802 1 1250 . 1 1 99 99 PHE HB3 H 1 3.124 0.020 . 2 . . . A 99 PHE HB3 . 18802 1 1251 . 1 1 99 99 PHE HD1 H 1 7.014 0.002 . 1 . . . A 99 PHE HD1 . 18802 1 1252 . 1 1 99 99 PHE HD2 H 1 7.014 0.002 . 1 . . . A 99 PHE HD2 . 18802 1 1253 . 1 1 99 99 PHE HE1 H 1 7.105 0.020 . 1 . . . A 99 PHE HE1 . 18802 1 1254 . 1 1 99 99 PHE HE2 H 1 7.105 0.020 . 1 . . . A 99 PHE HE2 . 18802 1 1255 . 1 1 99 99 PHE HZ H 1 7.118 0.020 . 1 . . . A 99 PHE HZ . 18802 1 1256 . 1 1 99 99 PHE C C 13 173.954 0.200 . 1 . . . A 99 PHE C . 18802 1 1257 . 1 1 99 99 PHE CA C 13 58.993 0.006 . 1 . . . A 99 PHE CA . 18802 1 1258 . 1 1 99 99 PHE CB C 13 39.596 0.022 . 1 . . . A 99 PHE CB . 18802 1 1259 . 1 1 99 99 PHE CD1 C 13 132.303 0.029 . 1 . . . A 99 PHE CD1 . 18802 1 1260 . 1 1 99 99 PHE CD2 C 13 132.303 0.029 . 1 . . . A 99 PHE CD2 . 18802 1 1261 . 1 1 99 99 PHE CE1 C 13 130.887 0.009 . 1 . . . A 99 PHE CE1 . 18802 1 1262 . 1 1 99 99 PHE CE2 C 13 130.887 0.009 . 1 . . . A 99 PHE CE2 . 18802 1 1263 . 1 1 99 99 PHE N N 15 122.722 0.051 . 1 . . . A 99 PHE N . 18802 1 1264 . 1 1 100 100 LYS H H 1 7.602 0.020 . 1 . . . A 100 LYS H . 18802 1 1265 . 1 1 100 100 LYS HA H 1 4.559 0.015 . 1 . . . A 100 LYS HA . 18802 1 1266 . 1 1 100 100 LYS HB2 H 1 1.475 0.002 . 1 . . . A 100 LYS HB2 . 18802 1 1267 . 1 1 100 100 LYS HB3 H 1 1.475 0.002 . 1 . . . A 100 LYS HB3 . 18802 1 1268 . 1 1 100 100 LYS HG2 H 1 1.294 0.020 . 2 . . . A 100 LYS HG2 . 18802 1 1269 . 1 1 100 100 LYS HG3 H 1 1.358 0.020 . 2 . . . A 100 LYS HG3 . 18802 1 1270 . 1 1 100 100 LYS HD2 H 1 1.560 0.001 . 1 . . . A 100 LYS HD2 . 18802 1 1271 . 1 1 100 100 LYS HD3 H 1 1.560 0.001 . 1 . . . A 100 LYS HD3 . 18802 1 1272 . 1 1 100 100 LYS HE2 H 1 2.931 0.001 . 1 . . . A 100 LYS HE2 . 18802 1 1273 . 1 1 100 100 LYS HE3 H 1 2.931 0.001 . 1 . . . A 100 LYS HE3 . 18802 1 1274 . 1 1 100 100 LYS C C 13 172.622 0.200 . 1 . . . A 100 LYS C . 18802 1 1275 . 1 1 100 100 LYS CA C 13 51.815 0.057 . 1 . . . A 100 LYS CA . 18802 1 1276 . 1 1 100 100 LYS CB C 13 32.581 0.200 . 1 . . . A 100 LYS CB . 18802 1 1277 . 1 1 100 100 LYS CG C 13 24.378 0.200 . 1 . . . A 100 LYS CG . 18802 1 1278 . 1 1 100 100 LYS CD C 13 28.940 0.200 . 1 . . . A 100 LYS CD . 18802 1 1279 . 1 1 100 100 LYS CE C 13 42.284 0.200 . 1 . . . A 100 LYS CE . 18802 1 1280 . 1 1 100 100 LYS N N 15 129.400 0.045 . 1 . . . A 100 LYS N . 18802 1 1281 . 1 1 101 101 PRO HA H 1 4.089 0.007 . 1 . . . A 101 PRO HA . 18802 1 1282 . 1 1 101 101 PRO HB2 H 1 1.853 0.002 . 2 . . . A 101 PRO HB2 . 18802 1 1283 . 1 1 101 101 PRO HB3 H 1 1.901 0.005 . 2 . . . A 101 PRO HB3 . 18802 1 1284 . 1 1 101 101 PRO HG2 H 1 2.068 0.003 . 2 . . . A 101 PRO HG2 . 18802 1 1285 . 1 1 101 101 PRO HG3 H 1 1.802 0.008 . 2 . . . A 101 PRO HG3 . 18802 1 1286 . 1 1 101 101 PRO HD2 H 1 3.562 0.005 . 2 . . . A 101 PRO HD2 . 18802 1 1287 . 1 1 101 101 PRO HD3 H 1 3.832 0.012 . 2 . . . A 101 PRO HD3 . 18802 1 1288 . 1 1 101 101 PRO CA C 13 60.996 0.215 . 1 . . . A 101 PRO CA . 18802 1 1289 . 1 1 101 101 PRO CB C 13 31.067 0.165 . 1 . . . A 101 PRO CB . 18802 1 1290 . 1 1 101 101 PRO CG C 13 27.020 0.054 . 1 . . . A 101 PRO CG . 18802 1 1291 . 1 1 101 101 PRO CD C 13 50.894 0.040 . 1 . . . A 101 PRO CD . 18802 1 1292 . 1 1 102 102 PRO HA H 1 4.374 0.005 . 1 . . . A 102 PRO HA . 18802 1 1293 . 1 1 102 102 PRO HB2 H 1 2.383 0.019 . 2 . . . A 102 PRO HB2 . 18802 1 1294 . 1 1 102 102 PRO HB3 H 1 2.007 0.002 . 2 . . . A 102 PRO HB3 . 18802 1 1295 . 1 1 102 102 PRO HG2 H 1 2.061 0.014 . 2 . . . A 102 PRO HG2 . 18802 1 1296 . 1 1 102 102 PRO HG3 H 1 1.833 0.012 . 2 . . . A 102 PRO HG3 . 18802 1 1297 . 1 1 102 102 PRO HD2 H 1 3.200 0.006 . 2 . . . A 102 PRO HD2 . 18802 1 1298 . 1 1 102 102 PRO HD3 H 1 3.613 0.003 . 2 . . . A 102 PRO HD3 . 18802 1 1299 . 1 1 102 102 PRO C C 13 177.630 0.200 . 1 . . . A 102 PRO C . 18802 1 1300 . 1 1 102 102 PRO CA C 13 62.813 0.416 . 1 . . . A 102 PRO CA . 18802 1 1301 . 1 1 102 102 PRO CB C 13 32.321 0.015 . 1 . . . A 102 PRO CB . 18802 1 1302 . 1 1 102 102 PRO CG C 13 27.893 0.089 . 1 . . . A 102 PRO CG . 18802 1 1303 . 1 1 102 102 PRO CD C 13 49.805 0.064 . 1 . . . A 102 PRO CD . 18802 1 1304 . 1 1 103 103 ALA H H 1 8.630 0.001 . 1 . . . A 103 ALA H . 18802 1 1305 . 1 1 103 103 ALA HA H 1 4.058 0.001 . 1 . . . A 103 ALA HA . 18802 1 1306 . 1 1 103 103 ALA HB1 H 1 1.398 0.020 . 1 . . . A 103 ALA MB . 18802 1 1307 . 1 1 103 103 ALA HB2 H 1 1.398 0.020 . 1 . . . A 103 ALA MB . 18802 1 1308 . 1 1 103 103 ALA HB3 H 1 1.398 0.020 . 1 . . . A 103 ALA MB . 18802 1 1309 . 1 1 103 103 ALA C C 13 177.641 0.200 . 1 . . . A 103 ALA C . 18802 1 1310 . 1 1 103 103 ALA CA C 13 54.602 0.116 . 1 . . . A 103 ALA CA . 18802 1 1311 . 1 1 103 103 ALA CB C 13 18.849 0.200 . 1 . . . A 103 ALA CB . 18802 1 1312 . 1 1 103 103 ALA N N 15 123.830 0.054 . 1 . . . A 103 ALA N . 18802 1 1313 . 1 1 104 104 ASP H H 1 8.335 0.003 . 1 . . . A 104 ASP H . 18802 1 1314 . 1 1 104 104 ASP HA H 1 4.451 0.002 . 1 . . . A 104 ASP HA . 18802 1 1315 . 1 1 104 104 ASP HB2 H 1 2.477 0.001 . 2 . . . A 104 ASP HB2 . 18802 1 1316 . 1 1 104 104 ASP HB3 H 1 2.812 0.005 . 2 . . . A 104 ASP HB3 . 18802 1 1317 . 1 1 104 104 ASP C C 13 175.724 0.200 . 1 . . . A 104 ASP C . 18802 1 1318 . 1 1 104 104 ASP CA C 13 53.604 0.189 . 1 . . . A 104 ASP CA . 18802 1 1319 . 1 1 104 104 ASP CB C 13 40.418 0.013 . 1 . . . A 104 ASP CB . 18802 1 1320 . 1 1 104 104 ASP CG C 13 181.265 0.200 . 1 . . . A 104 ASP CG . 18802 1 1321 . 1 1 104 104 ASP N N 15 112.924 0.052 . 1 . . . A 104 ASP N . 18802 1 1322 . 1 1 105 105 TYR H H 1 7.600 0.024 . 1 . . . A 105 TYR H . 18802 1 1323 . 1 1 105 105 TYR HA H 1 4.362 0.006 . 1 . . . A 105 TYR HA . 18802 1 1324 . 1 1 105 105 TYR HB2 H 1 2.612 0.006 . 2 . . . A 105 TYR HB2 . 18802 1 1325 . 1 1 105 105 TYR HB3 H 1 2.954 0.011 . 2 . . . A 105 TYR HB3 . 18802 1 1326 . 1 1 105 105 TYR HD1 H 1 6.935 0.002 . 1 . . . A 105 TYR HD1 . 18802 1 1327 . 1 1 105 105 TYR HD2 H 1 6.935 0.002 . 1 . . . A 105 TYR HD2 . 18802 1 1328 . 1 1 105 105 TYR HE1 H 1 6.756 0.012 . 1 . . . A 105 TYR HE1 . 18802 1 1329 . 1 1 105 105 TYR HE2 H 1 6.756 0.012 . 1 . . . A 105 TYR HE2 . 18802 1 1330 . 1 1 105 105 TYR C C 13 174.190 0.200 . 1 . . . A 105 TYR C . 18802 1 1331 . 1 1 105 105 TYR CA C 13 58.412 0.025 . 1 . . . A 105 TYR CA . 18802 1 1332 . 1 1 105 105 TYR CB C 13 39.059 0.049 . 1 . . . A 105 TYR CB . 18802 1 1333 . 1 1 105 105 TYR CD1 C 13 133.363 0.200 . 1 . . . A 105 TYR CD1 . 18802 1 1334 . 1 1 105 105 TYR CD2 C 13 133.363 0.200 . 1 . . . A 105 TYR CD2 . 18802 1 1335 . 1 1 105 105 TYR CE1 C 13 118.369 0.200 . 1 . . . A 105 TYR CE1 . 18802 1 1336 . 1 1 105 105 TYR CE2 C 13 118.369 0.200 . 1 . . . A 105 TYR CE2 . 18802 1 1337 . 1 1 105 105 TYR N N 15 121.114 0.055 . 1 . . . A 105 TYR N . 18802 1 1338 . 1 1 106 106 LYS H H 1 7.695 0.004 . 1 . . . A 106 LYS H . 18802 1 1339 . 1 1 106 106 LYS HA H 1 4.318 0.004 . 1 . . . A 106 LYS HA . 18802 1 1340 . 1 1 106 106 LYS HB2 H 1 1.412 0.002 . 2 . . . A 106 LYS HB2 . 18802 1 1341 . 1 1 106 106 LYS HB3 H 1 1.518 0.006 . 2 . . . A 106 LYS HB3 . 18802 1 1342 . 1 1 106 106 LYS HG2 H 1 1.209 0.012 . 2 . . . A 106 LYS HG2 . 18802 1 1343 . 1 1 106 106 LYS HG3 H 1 1.248 0.012 . 2 . . . A 106 LYS HG3 . 18802 1 1344 . 1 1 106 106 LYS HD2 H 1 1.557 0.001 . 1 . . . A 106 LYS HD2 . 18802 1 1345 . 1 1 106 106 LYS HD3 H 1 1.557 0.001 . 1 . . . A 106 LYS HD3 . 18802 1 1346 . 1 1 106 106 LYS HE2 H 1 2.878 0.002 . 1 . . . A 106 LYS HE2 . 18802 1 1347 . 1 1 106 106 LYS HE3 H 1 2.878 0.002 . 1 . . . A 106 LYS HE3 . 18802 1 1348 . 1 1 106 106 LYS C C 13 172.314 0.200 . 1 . . . A 106 LYS C . 18802 1 1349 . 1 1 106 106 LYS CA C 13 52.570 0.073 . 1 . . . A 106 LYS CA . 18802 1 1350 . 1 1 106 106 LYS CB C 13 33.663 0.070 . 1 . . . A 106 LYS CB . 18802 1 1351 . 1 1 106 106 LYS CG C 13 24.249 0.073 . 1 . . . A 106 LYS CG . 18802 1 1352 . 1 1 106 106 LYS CD C 13 29.173 0.001 . 1 . . . A 106 LYS CD . 18802 1 1353 . 1 1 106 106 LYS CE C 13 42.386 0.200 . 1 . . . A 106 LYS CE . 18802 1 1354 . 1 1 106 106 LYS N N 15 129.875 0.037 . 1 . . . A 106 LYS N . 18802 1 1355 . 1 1 107 107 PRO HA H 1 4.277 0.012 . 1 . . . A 107 PRO HA . 18802 1 1356 . 1 1 107 107 PRO HB2 H 1 2.299 0.006 . 2 . . . A 107 PRO HB2 . 18802 1 1357 . 1 1 107 107 PRO HB3 H 1 1.785 0.011 . 2 . . . A 107 PRO HB3 . 18802 1 1358 . 1 1 107 107 PRO HG2 H 1 1.962 0.007 . 1 . . . A 107 PRO HG2 . 18802 1 1359 . 1 1 107 107 PRO HG3 H 1 1.962 0.007 . 1 . . . A 107 PRO HG3 . 18802 1 1360 . 1 1 107 107 PRO HD2 H 1 3.438 0.009 . 2 . . . A 107 PRO HD2 . 18802 1 1361 . 1 1 107 107 PRO HD3 H 1 3.301 0.004 . 2 . . . A 107 PRO HD3 . 18802 1 1362 . 1 1 107 107 PRO CA C 13 61.058 0.055 . 1 . . . A 107 PRO CA . 18802 1 1363 . 1 1 107 107 PRO CB C 13 30.852 0.065 . 1 . . . A 107 PRO CB . 18802 1 1364 . 1 1 107 107 PRO CG C 13 27.152 0.193 . 1 . . . A 107 PRO CG . 18802 1 1365 . 1 1 107 107 PRO CD C 13 50.567 0.097 . 1 . . . A 107 PRO CD . 18802 1 1366 . 1 1 108 108 PRO HA H 1 4.244 0.007 . 1 . . . A 108 PRO HA . 18802 1 1367 . 1 1 108 108 PRO HB2 H 1 1.783 0.002 . 2 . . . A 108 PRO HB2 . 18802 1 1368 . 1 1 108 108 PRO HB3 H 1 2.143 0.013 . 2 . . . A 108 PRO HB3 . 18802 1 1369 . 1 1 108 108 PRO HG2 H 1 1.679 0.004 . 2 . . . A 108 PRO HG2 . 18802 1 1370 . 1 1 108 108 PRO HG3 H 1 1.732 0.015 . 2 . . . A 108 PRO HG3 . 18802 1 1371 . 1 1 108 108 PRO HD2 H 1 3.179 0.024 . 2 . . . A 108 PRO HD2 . 18802 1 1372 . 1 1 108 108 PRO HD3 H 1 3.420 0.020 . 2 . . . A 108 PRO HD3 . 18802 1 1373 . 1 1 108 108 PRO C C 13 176.459 0.200 . 1 . . . A 108 PRO C . 18802 1 1374 . 1 1 108 108 PRO CA C 13 62.874 0.220 . 1 . . . A 108 PRO CA . 18802 1 1375 . 1 1 108 108 PRO CB C 13 32.047 0.097 . 1 . . . A 108 PRO CB . 18802 1 1376 . 1 1 108 108 PRO CG C 13 27.241 0.077 . 1 . . . A 108 PRO CG . 18802 1 1377 . 1 1 108 108 PRO CD C 13 50.349 0.058 . 1 . . . A 108 PRO CD . 18802 1 1378 . 1 1 109 109 ALA H H 1 8.311 0.003 . 1 . . . A 109 ALA H . 18802 1 1379 . 1 1 109 109 ALA HA H 1 4.250 0.001 . 1 . . . A 109 ALA HA . 18802 1 1380 . 1 1 109 109 ALA HB1 H 1 1.316 0.002 . 1 . . . A 109 ALA MB . 18802 1 1381 . 1 1 109 109 ALA HB2 H 1 1.316 0.002 . 1 . . . A 109 ALA MB . 18802 1 1382 . 1 1 109 109 ALA HB3 H 1 1.316 0.002 . 1 . . . A 109 ALA MB . 18802 1 1383 . 1 1 109 109 ALA C C 13 177.870 0.200 . 1 . . . A 109 ALA C . 18802 1 1384 . 1 1 109 109 ALA CA C 13 52.508 0.025 . 1 . . . A 109 ALA CA . 18802 1 1385 . 1 1 109 109 ALA CB C 13 19.303 0.018 . 1 . . . A 109 ALA CB . 18802 1 1386 . 1 1 109 109 ALA N N 15 124.170 0.309 . 1 . . . A 109 ALA N . 18802 1 1387 . 1 1 110 110 THR H H 1 8.019 0.026 . 1 . . . A 110 THR H . 18802 1 1388 . 1 1 110 110 THR HA H 1 4.228 0.012 . 1 . . . A 110 THR HA . 18802 1 1389 . 1 1 110 110 THR HB H 1 4.097 0.004 . 1 . . . A 110 THR HB . 18802 1 1390 . 1 1 110 110 THR HG21 H 1 1.160 0.034 . 1 . . . A 110 THR MG . 18802 1 1391 . 1 1 110 110 THR HG22 H 1 1.160 0.034 . 1 . . . A 110 THR MG . 18802 1 1392 . 1 1 110 110 THR HG23 H 1 1.160 0.034 . 1 . . . A 110 THR MG . 18802 1 1393 . 1 1 110 110 THR C C 13 174.282 0.200 . 1 . . . A 110 THR C . 18802 1 1394 . 1 1 110 110 THR CA C 13 62.127 0.106 . 1 . . . A 110 THR CA . 18802 1 1395 . 1 1 110 110 THR CB C 13 69.870 0.200 . 1 . . . A 110 THR CB . 18802 1 1396 . 1 1 110 110 THR CG2 C 13 21.935 0.200 . 1 . . . A 110 THR CG2 . 18802 1 1397 . 1 1 110 110 THR N N 15 113.807 0.073 . 1 . . . A 110 THR N . 18802 1 1398 . 1 1 111 111 ARG H H 1 8.300 0.020 . 1 . . . A 111 ARG H . 18802 1 1399 . 1 1 111 111 ARG HA H 1 4.349 0.020 . 1 . . . A 111 ARG HA . 18802 1 1400 . 1 1 111 111 ARG C C 13 176.217 0.200 . 1 . . . A 111 ARG C . 18802 1 1401 . 1 1 111 111 ARG CA C 13 55.993 0.200 . 1 . . . A 111 ARG CA . 18802 1 1402 . 1 1 111 111 ARG CB C 13 30.992 0.001 . 1 . . . A 111 ARG CB . 18802 1 1403 . 1 1 111 111 ARG N N 15 124.165 0.154 . 1 . . . A 111 ARG N . 18802 1 1404 . 1 1 112 112 VAL H H 1 8.233 0.002 . 1 . . . A 112 VAL H . 18802 1 1405 . 1 1 112 112 VAL HA H 1 4.070 0.011 . 1 . . . A 112 VAL HA . 18802 1 1406 . 1 1 112 112 VAL HB H 1 2.036 0.001 . 1 . . . A 112 VAL HB . 18802 1 1407 . 1 1 112 112 VAL HG11 H 1 0.865 0.020 . 2 . . . A 112 VAL MG1 . 18802 1 1408 . 1 1 112 112 VAL HG12 H 1 0.865 0.020 . 2 . . . A 112 VAL MG1 . 18802 1 1409 . 1 1 112 112 VAL HG13 H 1 0.865 0.020 . 2 . . . A 112 VAL MG1 . 18802 1 1410 . 1 1 112 112 VAL HG21 H 1 0.899 0.011 . 2 . . . A 112 VAL MG2 . 18802 1 1411 . 1 1 112 112 VAL HG22 H 1 0.899 0.011 . 2 . . . A 112 VAL MG2 . 18802 1 1412 . 1 1 112 112 VAL HG23 H 1 0.899 0.011 . 2 . . . A 112 VAL MG2 . 18802 1 1413 . 1 1 112 112 VAL C C 13 176.180 0.200 . 1 . . . A 112 VAL C . 18802 1 1414 . 1 1 112 112 VAL CA C 13 61.937 0.200 . 1 . . . A 112 VAL CA . 18802 1 1415 . 1 1 112 112 VAL CB C 13 32.747 0.042 . 1 . . . A 112 VAL CB . 18802 1 1416 . 1 1 112 112 VAL CG1 C 13 20.778 0.054 . 2 . . . A 112 VAL CG1 . 18802 1 1417 . 1 1 112 112 VAL CG2 C 13 20.931 0.200 . 2 . . . A 112 VAL CG2 . 18802 1 1418 . 1 1 112 112 VAL N N 15 122.157 0.076 . 1 . . . A 112 VAL N . 18802 1 1419 . 1 1 113 113 SER H H 1 8.264 0.028 . 1 . . . A 113 SER H . 18802 1 1420 . 1 1 113 113 SER HA H 1 4.416 0.024 . 1 . . . A 113 SER HA . 18802 1 1421 . 1 1 113 113 SER HB2 H 1 3.778 0.020 . 2 . . . A 113 SER HB2 . 18802 1 1422 . 1 1 113 113 SER HB3 H 1 3.854 0.001 . 2 . . . A 113 SER HB3 . 18802 1 1423 . 1 1 113 113 SER C C 13 174.258 0.200 . 1 . . . A 113 SER C . 18802 1 1424 . 1 1 113 113 SER CA C 13 58.341 0.200 . 1 . . . A 113 SER CA . 18802 1 1425 . 1 1 113 113 SER CB C 13 63.900 0.045 . 1 . . . A 113 SER CB . 18802 1 1426 . 1 1 113 113 SER N N 15 118.837 0.024 . 1 . . . A 113 SER N . 18802 1 1427 . 1 1 114 114 ASP H H 1 8.249 0.004 . 1 . . . A 114 ASP H . 18802 1 1428 . 1 1 114 114 ASP HA H 1 4.537 0.006 . 1 . . . A 114 ASP HA . 18802 1 1429 . 1 1 114 114 ASP HB2 H 1 2.621 0.002 . 1 . . . A 114 ASP HB2 . 18802 1 1430 . 1 1 114 114 ASP HB3 H 1 2.621 0.002 . 1 . . . A 114 ASP HB3 . 18802 1 1431 . 1 1 114 114 ASP C C 13 176.053 0.200 . 1 . . . A 114 ASP C . 18802 1 1432 . 1 1 114 114 ASP CA C 13 54.489 0.036 . 1 . . . A 114 ASP CA . 18802 1 1433 . 1 1 114 114 ASP CB C 13 41.148 0.058 . 1 . . . A 114 ASP CB . 18802 1 1434 . 1 1 114 114 ASP N N 15 122.871 0.188 . 1 . . . A 114 ASP N . 18802 1 1435 . 1 1 115 115 LYS H H 1 8.084 0.010 . 1 . . . A 115 LYS H . 18802 1 1436 . 1 1 115 115 LYS HA H 1 4.260 0.002 . 1 . . . A 115 LYS HA . 18802 1 1437 . 1 1 115 115 LYS HB2 H 1 1.679 0.003 . 2 . . . A 115 LYS HB2 . 18802 1 1438 . 1 1 115 115 LYS HB3 H 1 1.770 0.007 . 2 . . . A 115 LYS HB3 . 18802 1 1439 . 1 1 115 115 LYS HG2 H 1 1.341 0.002 . 2 . . . A 115 LYS HG2 . 18802 1 1440 . 1 1 115 115 LYS HG3 H 1 1.393 0.009 . 2 . . . A 115 LYS HG3 . 18802 1 1441 . 1 1 115 115 LYS HD2 H 1 1.617 0.004 . 1 . . . A 115 LYS HD2 . 18802 1 1442 . 1 1 115 115 LYS HD3 H 1 1.617 0.004 . 1 . . . A 115 LYS HD3 . 18802 1 1443 . 1 1 115 115 LYS HE2 H 1 2.942 0.002 . 1 . . . A 115 LYS HE2 . 18802 1 1444 . 1 1 115 115 LYS HE3 H 1 2.942 0.002 . 1 . . . A 115 LYS HE3 . 18802 1 1445 . 1 1 115 115 LYS C C 13 176.343 0.200 . 1 . . . A 115 LYS C . 18802 1 1446 . 1 1 115 115 LYS CA C 13 56.261 0.057 . 1 . . . A 115 LYS CA . 18802 1 1447 . 1 1 115 115 LYS CB C 13 33.077 0.034 . 1 . . . A 115 LYS CB . 18802 1 1448 . 1 1 115 115 LYS CG C 13 24.924 0.045 . 1 . . . A 115 LYS CG . 18802 1 1449 . 1 1 115 115 LYS CD C 13 29.102 0.200 . 1 . . . A 115 LYS CD . 18802 1 1450 . 1 1 115 115 LYS CE C 13 42.379 0.200 . 1 . . . A 115 LYS CE . 18802 1 1451 . 1 1 115 115 LYS N N 15 120.944 0.200 . 1 . . . A 115 LYS N . 18802 1 1452 . 1 1 116 116 VAL H H 1 8.025 0.028 . 1 . . . A 116 VAL H . 18802 1 1453 . 1 1 116 116 VAL HA H 1 4.012 0.007 . 1 . . . A 116 VAL HA . 18802 1 1454 . 1 1 116 116 VAL HB H 1 1.993 0.004 . 1 . . . A 116 VAL HB . 18802 1 1455 . 1 1 116 116 VAL HG11 H 1 0.863 0.020 . 2 . . . A 116 VAL MG1 . 18802 1 1456 . 1 1 116 116 VAL HG12 H 1 0.863 0.020 . 2 . . . A 116 VAL MG1 . 18802 1 1457 . 1 1 116 116 VAL HG13 H 1 0.863 0.020 . 2 . . . A 116 VAL MG1 . 18802 1 1458 . 1 1 116 116 VAL HG21 H 1 0.874 0.020 . 2 . . . A 116 VAL MG2 . 18802 1 1459 . 1 1 116 116 VAL HG22 H 1 0.874 0.020 . 2 . . . A 116 VAL MG2 . 18802 1 1460 . 1 1 116 116 VAL HG23 H 1 0.874 0.020 . 2 . . . A 116 VAL MG2 . 18802 1 1461 . 1 1 116 116 VAL C C 13 175.842 0.200 . 1 . . . A 116 VAL C . 18802 1 1462 . 1 1 116 116 VAL CA C 13 62.442 0.042 . 1 . . . A 116 VAL CA . 18802 1 1463 . 1 1 116 116 VAL CB C 13 32.867 0.314 . 1 . . . A 116 VAL CB . 18802 1 1464 . 1 1 116 116 VAL CG1 C 13 21.049 0.200 . 2 . . . A 116 VAL CG1 . 18802 1 1465 . 1 1 116 116 VAL CG2 C 13 21.181 0.001 . 2 . . . A 116 VAL CG2 . 18802 1 1466 . 1 1 116 116 VAL N N 15 121.670 0.130 . 1 . . . A 116 VAL N . 18802 1 1467 . 1 1 117 117 MET H H 1 8.364 0.029 . 1 . . . A 117 MET H . 18802 1 1468 . 1 1 117 117 MET HA H 1 4.453 0.020 . 1 . . . A 117 MET HA . 18802 1 1469 . 1 1 117 117 MET HB2 H 1 1.930 0.020 . 2 . . . A 117 MET HB2 . 18802 1 1470 . 1 1 117 117 MET HB3 H 1 1.987 0.020 . 2 . . . A 117 MET HB3 . 18802 1 1471 . 1 1 117 117 MET HG2 H 1 2.448 0.020 . 2 . . . A 117 MET HG2 . 18802 1 1472 . 1 1 117 117 MET HG3 H 1 2.527 0.020 . 2 . . . A 117 MET HG3 . 18802 1 1473 . 1 1 117 117 MET C C 13 175.562 0.200 . 1 . . . A 117 MET C . 18802 1 1474 . 1 1 117 117 MET CA C 13 55.349 0.200 . 1 . . . A 117 MET CA . 18802 1 1475 . 1 1 117 117 MET CB C 13 32.993 0.200 . 1 . . . A 117 MET CB . 18802 1 1476 . 1 1 117 117 MET CG C 13 32.077 0.200 . 1 . . . A 117 MET CG . 18802 1 1477 . 1 1 117 117 MET N N 15 124.839 0.147 . 1 . . . A 117 MET N . 18802 1 1478 . 1 1 118 118 ILE H H 1 8.093 0.001 . 1 . . . A 118 ILE H . 18802 1 1479 . 1 1 118 118 ILE HA H 1 4.428 0.008 . 1 . . . A 118 ILE HA . 18802 1 1480 . 1 1 118 118 ILE HB H 1 1.820 0.020 . 1 . . . A 118 ILE HB . 18802 1 1481 . 1 1 118 118 ILE HG12 H 1 1.115 0.001 . 1 . . . A 118 ILE HG12 . 18802 1 1482 . 1 1 118 118 ILE HG13 H 1 1.115 0.001 . 1 . . . A 118 ILE HG13 . 18802 1 1483 . 1 1 118 118 ILE HG21 H 1 0.899 0.020 . 1 . . . A 118 ILE MG . 18802 1 1484 . 1 1 118 118 ILE HG22 H 1 0.899 0.020 . 1 . . . A 118 ILE MG . 18802 1 1485 . 1 1 118 118 ILE HG23 H 1 0.899 0.020 . 1 . . . A 118 ILE MG . 18802 1 1486 . 1 1 118 118 ILE HD11 H 1 0.810 0.020 . 1 . . . A 118 ILE MD . 18802 1 1487 . 1 1 118 118 ILE HD12 H 1 0.810 0.020 . 1 . . . A 118 ILE MD . 18802 1 1488 . 1 1 118 118 ILE HD13 H 1 0.810 0.020 . 1 . . . A 118 ILE MD . 18802 1 1489 . 1 1 118 118 ILE C C 13 174.331 0.200 . 1 . . . A 118 ILE C . 18802 1 1490 . 1 1 118 118 ILE CA C 13 58.404 0.200 . 1 . . . A 118 ILE CA . 18802 1 1491 . 1 1 118 118 ILE CB C 13 38.755 0.200 . 1 . . . A 118 ILE CB . 18802 1 1492 . 1 1 118 118 ILE CG1 C 13 27.101 0.200 . 1 . . . A 118 ILE CG1 . 18802 1 1493 . 1 1 118 118 ILE CG2 C 13 17.119 0.001 . 1 . . . A 118 ILE CG2 . 18802 1 1494 . 1 1 118 118 ILE CD1 C 13 12.754 0.001 . 1 . . . A 118 ILE CD1 . 18802 1 1495 . 1 1 118 118 ILE N N 15 124.515 0.200 . 1 . . . A 118 ILE N . 18802 1 1496 . 1 1 119 119 PRO HA H 1 4.350 0.020 . 1 . . . A 119 PRO HA . 18802 1 1497 . 1 1 119 119 PRO HB2 H 1 1.898 0.020 . 2 . . . A 119 PRO HB2 . 18802 1 1498 . 1 1 119 119 PRO HB3 H 1 2.252 0.020 . 2 . . . A 119 PRO HB3 . 18802 1 1499 . 1 1 119 119 PRO HG2 H 1 1.926 0.020 . 2 . . . A 119 PRO HG2 . 18802 1 1500 . 1 1 119 119 PRO HG3 H 1 2.032 0.020 . 2 . . . A 119 PRO HG3 . 18802 1 1501 . 1 1 119 119 PRO HD2 H 1 3.649 0.011 . 2 . . . A 119 PRO HD2 . 18802 1 1502 . 1 1 119 119 PRO HD3 H 1 3.830 0.003 . 2 . . . A 119 PRO HD3 . 18802 1 1503 . 1 1 119 119 PRO C C 13 176.623 0.200 . 1 . . . A 119 PRO C . 18802 1 1504 . 1 1 119 119 PRO CA C 13 63.415 0.200 . 1 . . . A 119 PRO CA . 18802 1 1505 . 1 1 119 119 PRO CB C 13 32.233 0.200 . 1 . . . A 119 PRO CB . 18802 1 1506 . 1 1 119 119 PRO CG C 13 27.589 0.200 . 1 . . . A 119 PRO CG . 18802 1 1507 . 1 1 119 119 PRO CD C 13 51.276 0.112 . 1 . . . A 119 PRO CD . 18802 1 1508 . 1 1 120 120 GLN H H 1 8.392 0.009 . 1 . . . A 120 GLN H . 18802 1 1509 . 1 1 120 120 GLN HA H 1 4.306 0.020 . 1 . . . A 120 GLN HA . 18802 1 1510 . 1 1 120 120 GLN HB2 H 1 2.101 0.005 . 2 . . . A 120 GLN HB2 . 18802 1 1511 . 1 1 120 120 GLN HB3 H 1 2.009 0.181 . 2 . . . A 120 GLN HB3 . 18802 1 1512 . 1 1 120 120 GLN HG2 H 1 2.354 0.001 . 1 . . . A 120 GLN HG2 . 18802 1 1513 . 1 1 120 120 GLN HG3 H 1 2.354 0.001 . 1 . . . A 120 GLN HG3 . 18802 1 1514 . 1 1 120 120 GLN HE21 H 1 6.776 0.020 . 2 . . . A 120 GLN HE21 . 18802 1 1515 . 1 1 120 120 GLN HE22 H 1 7.546 0.020 . 2 . . . A 120 GLN HE22 . 18802 1 1516 . 1 1 120 120 GLN C C 13 174.751 0.200 . 1 . . . A 120 GLN C . 18802 1 1517 . 1 1 120 120 GLN CA C 13 55.671 0.200 . 1 . . . A 120 GLN CA . 18802 1 1518 . 1 1 120 120 GLN CB C 13 30.118 0.200 . 1 . . . A 120 GLN CB . 18802 1 1519 . 1 1 120 120 GLN CG C 13 33.949 0.001 . 1 . . . A 120 GLN CG . 18802 1 1520 . 1 1 120 120 GLN CD C 13 180.909 0.200 . 1 . . . A 120 GLN CD . 18802 1 1521 . 1 1 120 120 GLN N N 15 121.557 0.200 . 1 . . . A 120 GLN N . 18802 1 1522 . 1 1 120 120 GLN NE2 N 15 112.914 0.200 . 1 . . . A 120 GLN NE2 . 18802 1 1523 . 1 1 121 121 ASP H H 1 7.918 0.020 . 1 . . . A 121 ASP H . 18802 1 1524 . 1 1 121 121 ASP HA H 1 4.339 0.020 . 1 . . . A 121 ASP HA . 18802 1 1525 . 1 1 121 121 ASP HB2 H 1 2.593 0.020 . 2 . . . A 121 ASP HB2 . 18802 1 1526 . 1 1 121 121 ASP HB3 H 1 2.572 0.108 . 2 . . . A 121 ASP HB3 . 18802 1 1527 . 1 1 121 121 ASP C C 13 180.743 0.200 . 1 . . . A 121 ASP C . 18802 1 1528 . 1 1 121 121 ASP CA C 13 55.746 0.200 . 1 . . . A 121 ASP CA . 18802 1 1529 . 1 1 121 121 ASP CB C 13 42.228 0.200 . 1 . . . A 121 ASP CB . 18802 1 1530 . 1 1 121 121 ASP N N 15 127.515 0.200 . 1 . . . A 121 ASP N . 18802 1 stop_ save_