data_6297 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6297 _Entry.Title ; Solution structure of the RWD domain of the mouse GCN2 protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2004-08-26 _Entry.Accession_date 2004-08-26 _Entry.Last_release_date 2005-01-24 _Entry.Original_release_date 2005-01-24 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _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 Nobukazu Nameki . . . 6297 2 Misao Yoneyama . . . 6297 3 Seizo Koshiba . . . 6297 4 Naoya Tochio . . . 6297 5 Makoto Inoue . . . 6297 6 Eiko Seki . . . 6297 7 Takayoshi Matsuda . . . 6297 8 Yasuko Tomo . . . 6297 9 Takushi Harada . . . 6297 10 Kohei Saito . . . 6297 11 Naohiro Kobayashi . . . 6297 12 Takashi Yabuki . . . 6297 13 Masaaki Aoki . . . 6297 14 Emi Nunokawa . . . 6297 15 Natsuko Matsuda . . . 6297 16 Noriko Sakagami . . . 6297 17 Takaho Terada . . . 6297 18 Mikako Shirouzu . . . 6297 19 Mayumi Yoshida . . . 6297 20 Hiroshi Hirota . . . 6297 21 Takashi Osanai . . . 6297 22 Akiko Tanaka . . . 6297 23 Takahiro Arakawa . . . 6297 24 Piero Carninci . . . 6297 25 Jun Kawai . . . 6297 26 Yoshihide Hayashizaki . . . 6297 27 Kengo Kinoshita . . . 6297 28 Peter Guntert . . . 6297 29 Takanori Kigawa . . . 6297 30 Shigeyuki Yokoyama . . . 6297 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6297 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 575 6297 '15N chemical shifts' 134 6297 '1H chemical shifts' 933 6297 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 . . 2005-01-24 2004-08-26 original author . 6297 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6297 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 15273307 _Citation.Full_citation . _Citation.Title 'Solution structure of the RWD domain of the mouse GCN2 protein' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Protein Sci.' _Citation.Journal_name_full . _Citation.Journal_volume 13 _Citation.Journal_issue 8 _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 2089 _Citation.Page_last 2100 _Citation.Year 2004 _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 Nobukazu Nameki . . . 6297 1 2 Misao Yoneyama . . . 6297 1 3 Seizo Koshiba . . . 6297 1 4 Naoya Tochio . . . 6297 1 5 Makoto Inoue . . . 6297 1 6 Eiko Seki . . . 6297 1 7 Takayoshi Matsuda . . . 6297 1 8 Yasuko Tomo . . . 6297 1 9 Takushi Harada . . . 6297 1 10 Kohei Saito . . . 6297 1 11 Naohiro Kobayashi . . . 6297 1 12 Takashi Yabuki . . . 6297 1 13 Masaaki Aoki . . . 6297 1 14 Emi Nunokawa . . . 6297 1 15 Natsuko Matsuda . . . 6297 1 16 Noriko Sakagami . . . 6297 1 17 Takaho Terada . . . 6297 1 18 Mikako Shirouzu . . . 6297 1 19 Mayumi Yoshida . . . 6297 1 20 Hiroshi Hirota . . . 6297 1 21 Takashi Osanai . . . 6297 1 22 Akiko Tanaka . . . 6297 1 23 Takahiro Arakawa . . . 6297 1 24 Piero Carninci . . . 6297 1 25 Jun Kawai . . . 6297 1 26 Yoshihide Hayashizaki . . . 6297 1 27 Kengo Kinoshita . . . 6297 1 28 Peter Guntert . . . 6297 1 29 Takanori Kigawa . . . 6297 1 30 Shigeyuki Yokoyama . . . 6297 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'GI domain' 6297 1 'hydrogen bond network' 6297 1 NMR 6297 1 'protection factor' 6297 1 'protein structure' 6297 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_molecular_system_GCN2 _Assembly.Sf_category assembly _Assembly.Sf_framecode molecular_system_GCN2 _Assembly.Entry_ID 6297 _Assembly.ID 1 _Assembly.Name GCN2 _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number 'EC: 2.7.1.-' _Assembly.Details 'eIF2alpha kinase' _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID protein 6297 1 stop_ 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 'GCN2, RWD_domain' 1 $RWD_domain . . . native . . . . . 6297 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID GCN2 abbreviation 6297 1 GCN2 system 6297 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID kinase 6297 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_RWD_domain _Entity.Sf_category entity _Entity.Sf_framecode RWD_domain _Entity.Entry_ID 6297 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'RWD domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGMESYSQRQDHELQ ALEAIYGSDFQDLRPDARGR VREPPEINLVLYPQGLAGEE VYVQVELRVKCPPTYPDVVP EIDLKNAKGLSNESVNLLKS HLEELAKKQCGEVMIFELAH HVQSFLSEHNKSGPSSG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 137 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1UKX . "Solution Structure Of The Rwd Domain Of Mouse Gcn2" . . . . . 100.00 137 100.00 100.00 1.09e-93 . . . . 6297 1 2 no DBJ BAB28984 . "unnamed protein product [Mus musculus]" . . . . . 93.43 187 97.66 97.66 1.28e-84 . . . . 6297 1 3 no REF NP_038747 . "eukaryotic translation initiation factor 2-alpha kinase 4 isoform 1 [Mus musculus]" . . . . . 93.43 1648 97.66 97.66 1.62e-76 . . . . 6297 1 4 no REF XP_006499687 . "PREDICTED: eukaryotic translation initiation factor 2-alpha kinase 4 isoform X1 [Mus musculus]" . . . . . 93.43 1621 97.66 97.66 1.75e-76 . . . . 6297 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'protein interaction' 6297 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'RWD domain' abbreviation 6297 1 'RWD domain' common 6297 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 6297 1 2 . SER . 6297 1 3 . SER . 6297 1 4 . GLY . 6297 1 5 . SER . 6297 1 6 . SER . 6297 1 7 . GLY . 6297 1 8 . MET . 6297 1 9 . GLU . 6297 1 10 . SER . 6297 1 11 . TYR . 6297 1 12 . SER . 6297 1 13 . GLN . 6297 1 14 . ARG . 6297 1 15 . GLN . 6297 1 16 . ASP . 6297 1 17 . HIS . 6297 1 18 . GLU . 6297 1 19 . LEU . 6297 1 20 . GLN . 6297 1 21 . ALA . 6297 1 22 . LEU . 6297 1 23 . GLU . 6297 1 24 . ALA . 6297 1 25 . ILE . 6297 1 26 . TYR . 6297 1 27 . GLY . 6297 1 28 . SER . 6297 1 29 . ASP . 6297 1 30 . PHE . 6297 1 31 . GLN . 6297 1 32 . ASP . 6297 1 33 . LEU . 6297 1 34 . ARG . 6297 1 35 . PRO . 6297 1 36 . ASP . 6297 1 37 . ALA . 6297 1 38 . ARG . 6297 1 39 . GLY . 6297 1 40 . ARG . 6297 1 41 . VAL . 6297 1 42 . ARG . 6297 1 43 . GLU . 6297 1 44 . PRO . 6297 1 45 . PRO . 6297 1 46 . GLU . 6297 1 47 . ILE . 6297 1 48 . ASN . 6297 1 49 . LEU . 6297 1 50 . VAL . 6297 1 51 . LEU . 6297 1 52 . TYR . 6297 1 53 . PRO . 6297 1 54 . GLN . 6297 1 55 . GLY . 6297 1 56 . LEU . 6297 1 57 . ALA . 6297 1 58 . GLY . 6297 1 59 . GLU . 6297 1 60 . GLU . 6297 1 61 . VAL . 6297 1 62 . TYR . 6297 1 63 . VAL . 6297 1 64 . GLN . 6297 1 65 . VAL . 6297 1 66 . GLU . 6297 1 67 . LEU . 6297 1 68 . ARG . 6297 1 69 . VAL . 6297 1 70 . LYS . 6297 1 71 . CYS . 6297 1 72 . PRO . 6297 1 73 . PRO . 6297 1 74 . THR . 6297 1 75 . TYR . 6297 1 76 . PRO . 6297 1 77 . ASP . 6297 1 78 . VAL . 6297 1 79 . VAL . 6297 1 80 . PRO . 6297 1 81 . GLU . 6297 1 82 . ILE . 6297 1 83 . ASP . 6297 1 84 . LEU . 6297 1 85 . LYS . 6297 1 86 . ASN . 6297 1 87 . ALA . 6297 1 88 . LYS . 6297 1 89 . GLY . 6297 1 90 . LEU . 6297 1 91 . SER . 6297 1 92 . ASN . 6297 1 93 . GLU . 6297 1 94 . SER . 6297 1 95 . VAL . 6297 1 96 . ASN . 6297 1 97 . LEU . 6297 1 98 . LEU . 6297 1 99 . LYS . 6297 1 100 . SER . 6297 1 101 . HIS . 6297 1 102 . LEU . 6297 1 103 . GLU . 6297 1 104 . GLU . 6297 1 105 . LEU . 6297 1 106 . ALA . 6297 1 107 . LYS . 6297 1 108 . LYS . 6297 1 109 . GLN . 6297 1 110 . CYS . 6297 1 111 . GLY . 6297 1 112 . GLU . 6297 1 113 . VAL . 6297 1 114 . MET . 6297 1 115 . ILE . 6297 1 116 . PHE . 6297 1 117 . GLU . 6297 1 118 . LEU . 6297 1 119 . ALA . 6297 1 120 . HIS . 6297 1 121 . HIS . 6297 1 122 . VAL . 6297 1 123 . GLN . 6297 1 124 . SER . 6297 1 125 . PHE . 6297 1 126 . LEU . 6297 1 127 . SER . 6297 1 128 . GLU . 6297 1 129 . HIS . 6297 1 130 . ASN . 6297 1 131 . LYS . 6297 1 132 . SER . 6297 1 133 . GLY . 6297 1 134 . PRO . 6297 1 135 . SER . 6297 1 136 . SER . 6297 1 137 . GLY . 6297 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 6297 1 . SER 2 2 6297 1 . SER 3 3 6297 1 . GLY 4 4 6297 1 . SER 5 5 6297 1 . SER 6 6 6297 1 . GLY 7 7 6297 1 . MET 8 8 6297 1 . GLU 9 9 6297 1 . SER 10 10 6297 1 . TYR 11 11 6297 1 . SER 12 12 6297 1 . GLN 13 13 6297 1 . ARG 14 14 6297 1 . GLN 15 15 6297 1 . ASP 16 16 6297 1 . HIS 17 17 6297 1 . GLU 18 18 6297 1 . LEU 19 19 6297 1 . GLN 20 20 6297 1 . ALA 21 21 6297 1 . LEU 22 22 6297 1 . GLU 23 23 6297 1 . ALA 24 24 6297 1 . ILE 25 25 6297 1 . TYR 26 26 6297 1 . GLY 27 27 6297 1 . SER 28 28 6297 1 . ASP 29 29 6297 1 . PHE 30 30 6297 1 . GLN 31 31 6297 1 . ASP 32 32 6297 1 . LEU 33 33 6297 1 . ARG 34 34 6297 1 . PRO 35 35 6297 1 . ASP 36 36 6297 1 . ALA 37 37 6297 1 . ARG 38 38 6297 1 . GLY 39 39 6297 1 . ARG 40 40 6297 1 . VAL 41 41 6297 1 . ARG 42 42 6297 1 . GLU 43 43 6297 1 . PRO 44 44 6297 1 . PRO 45 45 6297 1 . GLU 46 46 6297 1 . ILE 47 47 6297 1 . ASN 48 48 6297 1 . LEU 49 49 6297 1 . VAL 50 50 6297 1 . LEU 51 51 6297 1 . TYR 52 52 6297 1 . PRO 53 53 6297 1 . GLN 54 54 6297 1 . GLY 55 55 6297 1 . LEU 56 56 6297 1 . ALA 57 57 6297 1 . GLY 58 58 6297 1 . GLU 59 59 6297 1 . GLU 60 60 6297 1 . VAL 61 61 6297 1 . TYR 62 62 6297 1 . VAL 63 63 6297 1 . GLN 64 64 6297 1 . VAL 65 65 6297 1 . GLU 66 66 6297 1 . LEU 67 67 6297 1 . ARG 68 68 6297 1 . VAL 69 69 6297 1 . LYS 70 70 6297 1 . CYS 71 71 6297 1 . PRO 72 72 6297 1 . PRO 73 73 6297 1 . THR 74 74 6297 1 . TYR 75 75 6297 1 . PRO 76 76 6297 1 . ASP 77 77 6297 1 . VAL 78 78 6297 1 . VAL 79 79 6297 1 . PRO 80 80 6297 1 . GLU 81 81 6297 1 . ILE 82 82 6297 1 . ASP 83 83 6297 1 . LEU 84 84 6297 1 . LYS 85 85 6297 1 . ASN 86 86 6297 1 . ALA 87 87 6297 1 . LYS 88 88 6297 1 . GLY 89 89 6297 1 . LEU 90 90 6297 1 . SER 91 91 6297 1 . ASN 92 92 6297 1 . GLU 93 93 6297 1 . SER 94 94 6297 1 . VAL 95 95 6297 1 . ASN 96 96 6297 1 . LEU 97 97 6297 1 . LEU 98 98 6297 1 . LYS 99 99 6297 1 . SER 100 100 6297 1 . HIS 101 101 6297 1 . LEU 102 102 6297 1 . GLU 103 103 6297 1 . GLU 104 104 6297 1 . LEU 105 105 6297 1 . ALA 106 106 6297 1 . LYS 107 107 6297 1 . LYS 108 108 6297 1 . GLN 109 109 6297 1 . CYS 110 110 6297 1 . GLY 111 111 6297 1 . GLU 112 112 6297 1 . VAL 113 113 6297 1 . MET 114 114 6297 1 . ILE 115 115 6297 1 . PHE 116 116 6297 1 . GLU 117 117 6297 1 . LEU 118 118 6297 1 . ALA 119 119 6297 1 . HIS 120 120 6297 1 . HIS 121 121 6297 1 . VAL 122 122 6297 1 . GLN 123 123 6297 1 . SER 124 124 6297 1 . PHE 125 125 6297 1 . LEU 126 126 6297 1 . SER 127 127 6297 1 . GLU 128 128 6297 1 . HIS 129 129 6297 1 . ASN 130 130 6297 1 . LYS 131 131 6297 1 . SER 132 132 6297 1 . GLY 133 133 6297 1 . PRO 134 134 6297 1 . SER 135 135 6297 1 . SER 136 136 6297 1 . GLY 137 137 6297 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 6297 _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 $RWD_domain . 10090 organism . 'Mus musculus' Mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 6297 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 6297 _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 $RWD_domain . 'cell free synthesis' 'Escherichia coli' 'E. coli' . . Escherichia coli . . . . . . . . . . . . . plasmid . . P021021-28 . . . . . . 6297 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6297 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'RWD domain' '[U-15N; U-13C]' . . 1 $RWD_domain . . 1.0 . . mM . . . . 6297 1 2 dTris-HCl . . . . . . . 20 . . mM . . . . 6297 1 3 NaCl . . . . . . . 100 . . mM . . . . 6297 1 4 d-DTT . . . . . . . 1 . . mM . . . . 6297 1 5 NaN3 . . . . . . . 0.02 . . % . . . . 6297 1 6 D20 . . . . . . . 10 . . % . . . . 6297 1 7 H20 . . . . . . . 90 . . % . . . . 6297 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions _Sample_condition_list.Entry_ID 6297 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 120 10 mM 6297 1 pH 7.0 0.2 pH 6297 1 temperature 298 0.1 K 6297 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRpipe _Software.Sf_category software _Software.Sf_framecode NMRpipe _Software.Entry_ID 6297 _Software.ID 1 _Software.Name NMRPipe _Software.Version 20020425 _Software.Details 'Delaglio, F.' loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 6297 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 6297 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 6297 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 6297 _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 NMR_spectrometer_1 Bruker AVANCE . 700 . . . 6297 1 2 NMR_spectrometer_2 Bruker AVANCE . 800 . . . 6297 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 6297 _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 '1H15N HSQC' . . . . . . . . . . . 1 $sample_1 . . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 6297 1 2 '1H13C HSQC' . . . . . . . . . . . 1 $sample_1 . . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 6297 1 3 HNCO . . . . . . . . . . . 1 $sample_1 . . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 6297 1 4 HNCACO . . . . . . . . . . . 1 $sample_1 . . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 6297 1 5 HNCA . . . . . . . . . . . 1 $sample_1 . . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 6297 1 6 HNCACA . . . . . . . . . . . 1 $sample_1 . . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 6297 1 7 HNCACB . . . . . . . . . . . 1 $sample_1 . . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 6297 1 8 CBCACONH . . . . . . . . . . . 1 $sample_1 . . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 6297 1 9 HAHBNH . . . . . . . . . . . 1 $sample_1 . . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 6297 1 10 CCCONNH . . . . . . . . . . . 1 $sample_1 . . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 6297 1 11 HCCCONNH . . . . . . . . . . . 1 $sample_1 . . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 6297 1 12 HCCHCOSY . . . . . . . . . . . 1 $sample_1 . . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 6297 1 13 HCCHTOCSY . . . . . . . . . . . 1 $sample_1 . . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 6297 1 14 '15N NOESY' . . . . . . . . . . . 1 $sample_1 . . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 6297 1 15 '13C NOESY' . . . . . . . . . . . 1 $sample_1 . . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 6297 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 6297 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '1H15N HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 6297 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '1H13C HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 6297 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name HNCO _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 6297 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name HNCACO _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_5 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_5 _NMR_spec_expt.Entry_ID 6297 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name HNCA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_6 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_6 _NMR_spec_expt.Entry_ID 6297 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name HNCACA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_7 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_7 _NMR_spec_expt.Entry_ID 6297 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name HNCACB _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_8 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_8 _NMR_spec_expt.Entry_ID 6297 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name CBCACONH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_9 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_9 _NMR_spec_expt.Entry_ID 6297 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name HAHBNH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_10 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_10 _NMR_spec_expt.Entry_ID 6297 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name CCCONNH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_11 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_11 _NMR_spec_expt.Entry_ID 6297 _NMR_spec_expt.ID 11 _NMR_spec_expt.Name HCCCONNH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_12 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_12 _NMR_spec_expt.Entry_ID 6297 _NMR_spec_expt.ID 12 _NMR_spec_expt.Name HCCHCOSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_13 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_13 _NMR_spec_expt.Entry_ID 6297 _NMR_spec_expt.ID 13 _NMR_spec_expt.Name HCCHTOCSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_14 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_14 _NMR_spec_expt.Entry_ID 6297 _NMR_spec_expt.ID 14 _NMR_spec_expt.Name '15N NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_15 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_15 _NMR_spec_expt.Entry_ID 6297 _NMR_spec_expt.ID 15 _NMR_spec_expt.Name '13C NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 6297 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.698ppm at 298K), and then those of 15N and 13C were calculated based on their gyromagnetic ratios. In the case of 15N, correction value (+1.731ppm) was added to the calculated chemical shift values. ; loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 internal indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 6297 1 H 1 H2O protons . . . . ppm 4.698 internal direct 1.0 . . . 1 $entry_citation . . 1 $entry_citation 6297 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 internal indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 6297 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_chemical_shifts _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts _Assigned_chem_shift_list.Entry_ID 6297 _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 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _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 $sample_1 . 6297 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 6 6 SER CA C 13 58.851 0.300 . 1 . . . . . . . . 6297 1 2 . 1 1 6 6 SER HA H 1 4.529 0.030 . 1 . . . . . . . . 6297 1 3 . 1 1 6 6 SER CB C 13 64.127 0.300 . 1 . . . . . . . . 6297 1 4 . 1 1 6 6 SER HB2 H 1 3.927 0.030 . 1 . . . . . . . . 6297 1 5 . 1 1 6 6 SER HB3 H 1 3.927 0.030 . 1 . . . . . . . . 6297 1 6 . 1 1 6 6 SER C C 13 175.176 0.300 . 1 . . . . . . . . 6297 1 7 . 1 1 7 7 GLY N N 15 110.710 0.200 . 1 . . . . . . . . 6297 1 8 . 1 1 7 7 GLY H H 1 8.499 0.030 . 1 . . . . . . . . 6297 1 9 . 1 1 7 7 GLY CA C 13 45.543 0.300 . 1 . . . . . . . . 6297 1 10 . 1 1 7 7 GLY HA2 H 1 3.995 0.030 . 1 . . . . . . . . 6297 1 11 . 1 1 7 7 GLY HA3 H 1 3.995 0.030 . 1 . . . . . . . . 6297 1 12 . 1 1 7 7 GLY C C 13 174.665 0.300 . 1 . . . . . . . . 6297 1 13 . 1 1 8 8 MET N N 15 119.658 0.200 . 1 . . . . . . . . 6297 1 14 . 1 1 8 8 MET H H 1 8.296 0.030 . 1 . . . . . . . . 6297 1 15 . 1 1 8 8 MET CA C 13 55.866 0.300 . 1 . . . . . . . . 6297 1 16 . 1 1 8 8 MET HA H 1 4.601 0.030 . 1 . . . . . . . . 6297 1 17 . 1 1 8 8 MET CB C 13 32.584 0.300 . 1 . . . . . . . . 6297 1 18 . 1 1 8 8 MET HB2 H 1 2.063 0.030 . 2 . . . . . . . . 6297 1 19 . 1 1 8 8 MET HB3 H 1 2.172 0.030 . 2 . . . . . . . . 6297 1 20 . 1 1 8 8 MET CG C 13 32.220 0.300 . 1 . . . . . . . . 6297 1 21 . 1 1 8 8 MET HG2 H 1 2.560 0.030 . 2 . . . . . . . . 6297 1 22 . 1 1 8 8 MET HG3 H 1 2.674 0.030 . 2 . . . . . . . . 6297 1 23 . 1 1 8 8 MET CE C 13 17.050 0.300 . 1 . . . . . . . . 6297 1 24 . 1 1 8 8 MET HE1 H 1 2.078 0.030 . 1 . . . . . . . . 6297 1 25 . 1 1 8 8 MET HE2 H 1 2.078 0.030 . 1 . . . . . . . . 6297 1 26 . 1 1 8 8 MET HE3 H 1 2.078 0.030 . 1 . . . . . . . . 6297 1 27 . 1 1 8 8 MET C C 13 177.124 0.300 . 1 . . . . . . . . 6297 1 28 . 1 1 9 9 GLU N N 15 121.410 0.200 . 1 . . . . . . . . 6297 1 29 . 1 1 9 9 GLU H H 1 8.619 0.030 . 1 . . . . . . . . 6297 1 30 . 1 1 9 9 GLU CA C 13 57.730 0.300 . 1 . . . . . . . . 6297 1 31 . 1 1 9 9 GLU HA H 1 4.308 0.030 . 1 . . . . . . . . 6297 1 32 . 1 1 9 9 GLU CB C 13 30.196 0.300 . 1 . . . . . . . . 6297 1 33 . 1 1 9 9 GLU HB2 H 1 1.995 0.030 . 2 . . . . . . . . 6297 1 34 . 1 1 9 9 GLU HB3 H 1 2.044 0.030 . 2 . . . . . . . . 6297 1 35 . 1 1 9 9 GLU CG C 13 36.660 0.300 . 1 . . . . . . . . 6297 1 36 . 1 1 9 9 GLU HG2 H 1 2.320 0.030 . 1 . . . . . . . . 6297 1 37 . 1 1 9 9 GLU HG3 H 1 2.320 0.030 . 1 . . . . . . . . 6297 1 38 . 1 1 9 9 GLU C C 13 177.102 0.300 . 1 . . . . . . . . 6297 1 39 . 1 1 10 10 SER N N 15 116.271 0.200 . 1 . . . . . . . . 6297 1 40 . 1 1 10 10 SER H H 1 8.333 0.030 . 1 . . . . . . . . 6297 1 41 . 1 1 10 10 SER CA C 13 58.774 0.300 . 1 . . . . . . . . 6297 1 42 . 1 1 10 10 SER HA H 1 4.358 0.030 . 1 . . . . . . . . 6297 1 43 . 1 1 10 10 SER CB C 13 64.159 0.300 . 1 . . . . . . . . 6297 1 44 . 1 1 10 10 SER HB2 H 1 3.882 0.030 . 2 . . . . . . . . 6297 1 45 . 1 1 10 10 SER HB3 H 1 4.085 0.030 . 2 . . . . . . . . 6297 1 46 . 1 1 10 10 SER C C 13 175.965 0.300 . 1 . . . . . . . . 6297 1 47 . 1 1 11 11 TYR N N 15 120.783 0.200 . 1 . . . . . . . . 6297 1 48 . 1 1 11 11 TYR H H 1 7.834 0.030 . 1 . . . . . . . . 6297 1 49 . 1 1 11 11 TYR CA C 13 62.649 0.300 . 1 . . . . . . . . 6297 1 50 . 1 1 11 11 TYR HA H 1 4.261 0.030 . 1 . . . . . . . . 6297 1 51 . 1 1 11 11 TYR CB C 13 38.092 0.300 . 1 . . . . . . . . 6297 1 52 . 1 1 11 11 TYR HB2 H 1 2.989 0.030 . 2 . . . . . . . . 6297 1 53 . 1 1 11 11 TYR HB3 H 1 3.532 0.030 . 2 . . . . . . . . 6297 1 54 . 1 1 11 11 TYR CD1 C 13 133.021 0.300 . 1 . . . . . . . . 6297 1 55 . 1 1 11 11 TYR HD1 H 1 7.193 0.030 . 1 . . . . . . . . 6297 1 56 . 1 1 11 11 TYR CD2 C 13 133.021 0.300 . 1 . . . . . . . . 6297 1 57 . 1 1 11 11 TYR HD2 H 1 7.193 0.030 . 1 . . . . . . . . 6297 1 58 . 1 1 11 11 TYR CE1 C 13 118.195 0.300 . 1 . . . . . . . . 6297 1 59 . 1 1 11 11 TYR HE1 H 1 6.755 0.030 . 1 . . . . . . . . 6297 1 60 . 1 1 11 11 TYR CE2 C 13 118.195 0.300 . 1 . . . . . . . . 6297 1 61 . 1 1 11 11 TYR HE2 H 1 6.755 0.030 . 1 . . . . . . . . 6297 1 62 . 1 1 11 11 TYR C C 13 178.536 0.300 . 1 . . . . . . . . 6297 1 63 . 1 1 12 12 SER N N 15 114.136 0.200 . 1 . . . . . . . . 6297 1 64 . 1 1 12 12 SER H H 1 8.500 0.030 . 1 . . . . . . . . 6297 1 65 . 1 1 12 12 SER CA C 13 62.182 0.300 . 1 . . . . . . . . 6297 1 66 . 1 1 12 12 SER HA H 1 3.924 0.030 . 1 . . . . . . . . 6297 1 67 . 1 1 12 12 SER CB C 13 62.182 0.300 . 1 . . . . . . . . 6297 1 68 . 1 1 12 12 SER HB2 H 1 3.933 0.030 . 2 . . . . . . . . 6297 1 69 . 1 1 12 12 SER HB3 H 1 4.039 0.030 . 2 . . . . . . . . 6297 1 70 . 1 1 12 12 SER C C 13 176.050 0.300 . 1 . . . . . . . . 6297 1 71 . 1 1 13 13 GLN N N 15 121.299 0.200 . 1 . . . . . . . . 6297 1 72 . 1 1 13 13 GLN H H 1 7.920 0.030 . 1 . . . . . . . . 6297 1 73 . 1 1 13 13 GLN CA C 13 59.273 0.300 . 1 . . . . . . . . 6297 1 74 . 1 1 13 13 GLN HA H 1 4.119 0.030 . 1 . . . . . . . . 6297 1 75 . 1 1 13 13 GLN CB C 13 28.879 0.300 . 1 . . . . . . . . 6297 1 76 . 1 1 13 13 GLN HB2 H 1 2.227 0.030 . 2 . . . . . . . . 6297 1 77 . 1 1 13 13 GLN HB3 H 1 2.066 0.030 . 2 . . . . . . . . 6297 1 78 . 1 1 13 13 GLN CG C 13 34.396 0.300 . 1 . . . . . . . . 6297 1 79 . 1 1 13 13 GLN HG2 H 1 2.360 0.030 . 2 . . . . . . . . 6297 1 80 . 1 1 13 13 GLN HG3 H 1 2.429 0.030 . 2 . . . . . . . . 6297 1 81 . 1 1 13 13 GLN NE2 N 15 112.131 0.200 . 1 . . . . . . . . 6297 1 82 . 1 1 13 13 GLN HE21 H 1 6.913 0.030 . 2 . . . . . . . . 6297 1 83 . 1 1 13 13 GLN HE22 H 1 7.522 0.030 . 2 . . . . . . . . 6297 1 84 . 1 1 13 13 GLN C C 13 178.842 0.300 . 1 . . . . . . . . 6297 1 85 . 1 1 14 14 ARG N N 15 119.023 0.200 . 1 . . . . . . . . 6297 1 86 . 1 1 14 14 ARG H H 1 8.116 0.030 . 1 . . . . . . . . 6297 1 87 . 1 1 14 14 ARG CA C 13 59.826 0.300 . 1 . . . . . . . . 6297 1 88 . 1 1 14 14 ARG HA H 1 4.162 0.030 . 1 . . . . . . . . 6297 1 89 . 1 1 14 14 ARG CB C 13 31.409 0.300 . 1 . . . . . . . . 6297 1 90 . 1 1 14 14 ARG HB2 H 1 1.985 0.030 . 1 . . . . . . . . 6297 1 91 . 1 1 14 14 ARG HB3 H 1 1.985 0.030 . 1 . . . . . . . . 6297 1 92 . 1 1 14 14 ARG CG C 13 27.173 0.300 . 1 . . . . . . . . 6297 1 93 . 1 1 14 14 ARG HG2 H 1 1.836 0.030 . 2 . . . . . . . . 6297 1 94 . 1 1 14 14 ARG HG3 H 1 2.053 0.030 . 2 . . . . . . . . 6297 1 95 . 1 1 14 14 ARG CD C 13 45.210 0.300 . 1 . . . . . . . . 6297 1 96 . 1 1 14 14 ARG HD2 H 1 2.983 0.030 . 2 . . . . . . . . 6297 1 97 . 1 1 14 14 ARG HD3 H 1 3.210 0.030 . 2 . . . . . . . . 6297 1 98 . 1 1 14 14 ARG C C 13 180.481 0.300 . 1 . . . . . . . . 6297 1 99 . 1 1 15 15 GLN N N 15 119.014 0.200 . 1 . . . . . . . . 6297 1 100 . 1 1 15 15 GLN H H 1 8.570 0.030 . 1 . . . . . . . . 6297 1 101 . 1 1 15 15 GLN CA C 13 58.596 0.300 . 1 . . . . . . . . 6297 1 102 . 1 1 15 15 GLN HA H 1 4.407 0.030 . 1 . . . . . . . . 6297 1 103 . 1 1 15 15 GLN CB C 13 28.668 0.300 . 1 . . . . . . . . 6297 1 104 . 1 1 15 15 GLN HB2 H 1 2.055 0.030 . 2 . . . . . . . . 6297 1 105 . 1 1 15 15 GLN HB3 H 1 2.408 0.030 . 2 . . . . . . . . 6297 1 106 . 1 1 15 15 GLN CG C 13 34.368 0.300 . 1 . . . . . . . . 6297 1 107 . 1 1 15 15 GLN HG2 H 1 2.783 0.030 . 2 . . . . . . . . 6297 1 108 . 1 1 15 15 GLN HG3 H 1 3.007 0.030 . 2 . . . . . . . . 6297 1 109 . 1 1 15 15 GLN NE2 N 15 109.463 0.200 . 1 . . . . . . . . 6297 1 110 . 1 1 15 15 GLN HE21 H 1 6.291 0.030 . 2 . . . . . . . . 6297 1 111 . 1 1 15 15 GLN HE22 H 1 8.431 0.030 . 2 . . . . . . . . 6297 1 112 . 1 1 15 15 GLN C C 13 178.198 0.300 . 1 . . . . . . . . 6297 1 113 . 1 1 16 16 ASP N N 15 120.627 0.200 . 1 . . . . . . . . 6297 1 114 . 1 1 16 16 ASP H H 1 8.756 0.030 . 1 . . . . . . . . 6297 1 115 . 1 1 16 16 ASP CA C 13 57.850 0.300 . 1 . . . . . . . . 6297 1 116 . 1 1 16 16 ASP HA H 1 4.532 0.030 . 1 . . . . . . . . 6297 1 117 . 1 1 16 16 ASP CB C 13 39.723 0.300 . 1 . . . . . . . . 6297 1 118 . 1 1 16 16 ASP HB2 H 1 2.727 0.030 . 2 . . . . . . . . 6297 1 119 . 1 1 16 16 ASP HB3 H 1 2.869 0.030 . 2 . . . . . . . . 6297 1 120 . 1 1 16 16 ASP C C 13 178.229 0.300 . 1 . . . . . . . . 6297 1 121 . 1 1 17 17 HIS N N 15 119.163 0.200 . 1 . . . . . . . . 6297 1 122 . 1 1 17 17 HIS H H 1 8.390 0.030 . 1 . . . . . . . . 6297 1 123 . 1 1 17 17 HIS CA C 13 59.248 0.300 . 1 . . . . . . . . 6297 1 124 . 1 1 17 17 HIS HA H 1 4.488 0.030 . 1 . . . . . . . . 6297 1 125 . 1 1 17 17 HIS CB C 13 30.076 0.300 . 1 . . . . . . . . 6297 1 126 . 1 1 17 17 HIS HB2 H 1 3.300 0.030 . 2 . . . . . . . . 6297 1 127 . 1 1 17 17 HIS HB3 H 1 3.373 0.030 . 2 . . . . . . . . 6297 1 128 . 1 1 17 17 HIS CD2 C 13 119.893 0.300 . 1 . . . . . . . . 6297 1 129 . 1 1 17 17 HIS HD2 H 1 7.155 0.030 . 1 . . . . . . . . 6297 1 130 . 1 1 17 17 HIS C C 13 178.316 0.300 . 1 . . . . . . . . 6297 1 131 . 1 1 18 18 GLU N N 15 122.113 0.200 . 1 . . . . . . . . 6297 1 132 . 1 1 18 18 GLU H H 1 7.868 0.030 . 1 . . . . . . . . 6297 1 133 . 1 1 18 18 GLU CA C 13 59.960 0.300 . 1 . . . . . . . . 6297 1 134 . 1 1 18 18 GLU HA H 1 4.335 0.030 . 1 . . . . . . . . 6297 1 135 . 1 1 18 18 GLU CB C 13 29.717 0.300 . 1 . . . . . . . . 6297 1 136 . 1 1 18 18 GLU HB2 H 1 2.197 0.030 . 2 . . . . . . . . 6297 1 137 . 1 1 18 18 GLU HB3 H 1 2.722 0.030 . 2 . . . . . . . . 6297 1 138 . 1 1 18 18 GLU CG C 13 37.162 0.300 . 1 . . . . . . . . 6297 1 139 . 1 1 18 18 GLU HG2 H 1 2.240 0.030 . 2 . . . . . . . . 6297 1 140 . 1 1 18 18 GLU HG3 H 1 2.381 0.030 . 2 . . . . . . . . 6297 1 141 . 1 1 18 18 GLU C C 13 177.991 0.300 . 1 . . . . . . . . 6297 1 142 . 1 1 19 19 LEU N N 15 119.007 0.200 . 1 . . . . . . . . 6297 1 143 . 1 1 19 19 LEU H H 1 8.522 0.030 . 1 . . . . . . . . 6297 1 144 . 1 1 19 19 LEU CA C 13 59.129 0.300 . 1 . . . . . . . . 6297 1 145 . 1 1 19 19 LEU HA H 1 3.950 0.030 . 1 . . . . . . . . 6297 1 146 . 1 1 19 19 LEU CB C 13 41.322 0.300 . 1 . . . . . . . . 6297 1 147 . 1 1 19 19 LEU HB2 H 1 1.801 0.030 . 2 . . . . . . . . 6297 1 148 . 1 1 19 19 LEU HB3 H 1 2.077 0.030 . 2 . . . . . . . . 6297 1 149 . 1 1 19 19 LEU CG C 13 28.117 0.300 . 1 . . . . . . . . 6297 1 150 . 1 1 19 19 LEU HG H 1 2.170 0.030 . 1 . . . . . . . . 6297 1 151 . 1 1 19 19 LEU CD1 C 13 24.267 0.300 . 2 . . . . . . . . 6297 1 152 . 1 1 19 19 LEU HD11 H 1 1.012 0.030 . 1 . . . . . . . . 6297 1 153 . 1 1 19 19 LEU HD12 H 1 1.012 0.030 . 1 . . . . . . . . 6297 1 154 . 1 1 19 19 LEU HD13 H 1 1.012 0.030 . 1 . . . . . . . . 6297 1 155 . 1 1 19 19 LEU CD2 C 13 25.293 0.300 . 2 . . . . . . . . 6297 1 156 . 1 1 19 19 LEU HD21 H 1 1.044 0.030 . 1 . . . . . . . . 6297 1 157 . 1 1 19 19 LEU HD22 H 1 1.044 0.030 . 1 . . . . . . . . 6297 1 158 . 1 1 19 19 LEU HD23 H 1 1.044 0.030 . 1 . . . . . . . . 6297 1 159 . 1 1 19 19 LEU C C 13 179.616 0.300 . 1 . . . . . . . . 6297 1 160 . 1 1 20 20 GLN N N 15 118.258 0.200 . 1 . . . . . . . . 6297 1 161 . 1 1 20 20 GLN H H 1 8.105 0.030 . 1 . . . . . . . . 6297 1 162 . 1 1 20 20 GLN CA C 13 58.999 0.300 . 1 . . . . . . . . 6297 1 163 . 1 1 20 20 GLN HA H 1 4.057 0.030 . 1 . . . . . . . . 6297 1 164 . 1 1 20 20 GLN CB C 13 28.379 0.300 . 1 . . . . . . . . 6297 1 165 . 1 1 20 20 GLN HB2 H 1 2.172 0.030 . 2 . . . . . . . . 6297 1 166 . 1 1 20 20 GLN HB3 H 1 2.231 0.030 . 2 . . . . . . . . 6297 1 167 . 1 1 20 20 GLN CG C 13 34.143 0.300 . 1 . . . . . . . . 6297 1 168 . 1 1 20 20 GLN HG2 H 1 2.461 0.030 . 2 . . . . . . . . 6297 1 169 . 1 1 20 20 GLN HG3 H 1 2.651 0.030 . 2 . . . . . . . . 6297 1 170 . 1 1 20 20 GLN NE2 N 15 111.440 0.200 . 1 . . . . . . . . 6297 1 171 . 1 1 20 20 GLN HE21 H 1 6.845 0.030 . 2 . . . . . . . . 6297 1 172 . 1 1 20 20 GLN HE22 H 1 7.489 0.030 . 2 . . . . . . . . 6297 1 173 . 1 1 20 20 GLN C C 13 178.975 0.300 . 1 . . . . . . . . 6297 1 174 . 1 1 21 21 ALA N N 15 123.566 0.200 . 1 . . . . . . . . 6297 1 175 . 1 1 21 21 ALA H H 1 7.768 0.030 . 1 . . . . . . . . 6297 1 176 . 1 1 21 21 ALA CA C 13 55.071 0.300 . 1 . . . . . . . . 6297 1 177 . 1 1 21 21 ALA HA H 1 4.263 0.030 . 1 . . . . . . . . 6297 1 178 . 1 1 21 21 ALA CB C 13 18.271 0.300 . 1 . . . . . . . . 6297 1 179 . 1 1 21 21 ALA HB1 H 1 1.682 0.030 . 1 . . . . . . . . 6297 1 180 . 1 1 21 21 ALA HB2 H 1 1.682 0.030 . 1 . . . . . . . . 6297 1 181 . 1 1 21 21 ALA HB3 H 1 1.682 0.030 . 1 . . . . . . . . 6297 1 182 . 1 1 21 21 ALA C C 13 180.419 0.300 . 1 . . . . . . . . 6297 1 183 . 1 1 22 22 LEU N N 15 119.290 0.200 . 1 . . . . . . . . 6297 1 184 . 1 1 22 22 LEU H H 1 8.556 0.030 . 1 . . . . . . . . 6297 1 185 . 1 1 22 22 LEU CA C 13 57.833 0.300 . 1 . . . . . . . . 6297 1 186 . 1 1 22 22 LEU HA H 1 4.033 0.030 . 1 . . . . . . . . 6297 1 187 . 1 1 22 22 LEU CB C 13 43.304 0.300 . 1 . . . . . . . . 6297 1 188 . 1 1 22 22 LEU HB2 H 1 1.006 0.030 . 2 . . . . . . . . 6297 1 189 . 1 1 22 22 LEU HB3 H 1 1.746 0.030 . 2 . . . . . . . . 6297 1 190 . 1 1 22 22 LEU CG C 13 26.396 0.300 . 1 . . . . . . . . 6297 1 191 . 1 1 22 22 LEU HG H 1 1.808 0.030 . 1 . . . . . . . . 6297 1 192 . 1 1 22 22 LEU CD1 C 13 27.262 0.300 . 1 . . . . . . . . 6297 1 193 . 1 1 22 22 LEU HD11 H 1 0.823 0.030 . 1 . . . . . . . . 6297 1 194 . 1 1 22 22 LEU HD12 H 1 0.823 0.030 . 1 . . . . . . . . 6297 1 195 . 1 1 22 22 LEU HD13 H 1 0.823 0.030 . 1 . . . . . . . . 6297 1 196 . 1 1 22 22 LEU CD2 C 13 22.296 0.300 . 1 . . . . . . . . 6297 1 197 . 1 1 22 22 LEU HD21 H 1 0.310 0.030 . 1 . . . . . . . . 6297 1 198 . 1 1 22 22 LEU HD22 H 1 0.310 0.030 . 1 . . . . . . . . 6297 1 199 . 1 1 22 22 LEU HD23 H 1 0.310 0.030 . 1 . . . . . . . . 6297 1 200 . 1 1 22 22 LEU C C 13 179.009 0.300 . 1 . . . . . . . . 6297 1 201 . 1 1 23 23 GLU N N 15 120.138 0.200 . 1 . . . . . . . . 6297 1 202 . 1 1 23 23 GLU H H 1 7.764 0.030 . 1 . . . . . . . . 6297 1 203 . 1 1 23 23 GLU CA C 13 59.749 0.300 . 1 . . . . . . . . 6297 1 204 . 1 1 23 23 GLU HA H 1 3.417 0.030 . 1 . . . . . . . . 6297 1 205 . 1 1 23 23 GLU CB C 13 29.124 0.300 . 1 . . . . . . . . 6297 1 206 . 1 1 23 23 GLU HB2 H 1 1.439 0.030 . 2 . . . . . . . . 6297 1 207 . 1 1 23 23 GLU HB3 H 1 1.842 0.030 . 2 . . . . . . . . 6297 1 208 . 1 1 23 23 GLU CG C 13 36.242 0.300 . 1 . . . . . . . . 6297 1 209 . 1 1 23 23 GLU HG2 H 1 2.192 0.030 . 2 . . . . . . . . 6297 1 210 . 1 1 23 23 GLU HG3 H 1 2.285 0.030 . 2 . . . . . . . . 6297 1 211 . 1 1 23 23 GLU C C 13 179.097 0.300 . 1 . . . . . . . . 6297 1 212 . 1 1 24 24 ALA N N 15 120.753 0.200 . 1 . . . . . . . . 6297 1 213 . 1 1 24 24 ALA H H 1 7.617 0.030 . 1 . . . . . . . . 6297 1 214 . 1 1 24 24 ALA CA C 13 54.907 0.300 . 1 . . . . . . . . 6297 1 215 . 1 1 24 24 ALA HA H 1 4.121 0.030 . 1 . . . . . . . . 6297 1 216 . 1 1 24 24 ALA CB C 13 18.205 0.300 . 1 . . . . . . . . 6297 1 217 . 1 1 24 24 ALA HB1 H 1 1.555 0.030 . 1 . . . . . . . . 6297 1 218 . 1 1 24 24 ALA HB2 H 1 1.555 0.030 . 1 . . . . . . . . 6297 1 219 . 1 1 24 24 ALA HB3 H 1 1.555 0.030 . 1 . . . . . . . . 6297 1 220 . 1 1 24 24 ALA C C 13 179.556 0.300 . 1 . . . . . . . . 6297 1 221 . 1 1 25 25 ILE N N 15 116.339 0.200 . 1 . . . . . . . . 6297 1 222 . 1 1 25 25 ILE H H 1 7.652 0.030 . 1 . . . . . . . . 6297 1 223 . 1 1 25 25 ILE CA C 13 62.259 0.300 . 1 . . . . . . . . 6297 1 224 . 1 1 25 25 ILE HA H 1 3.974 0.030 . 1 . . . . . . . . 6297 1 225 . 1 1 25 25 ILE CB C 13 38.410 0.300 . 1 . . . . . . . . 6297 1 226 . 1 1 25 25 ILE HB H 1 1.857 0.030 . 1 . . . . . . . . 6297 1 227 . 1 1 25 25 ILE CG1 C 13 28.223 0.300 . 1 . . . . . . . . 6297 1 228 . 1 1 25 25 ILE HG12 H 1 1.494 0.030 . 2 . . . . . . . . 6297 1 229 . 1 1 25 25 ILE HG13 H 1 1.608 0.030 . 2 . . . . . . . . 6297 1 230 . 1 1 25 25 ILE CG2 C 13 16.619 0.300 . 1 . . . . . . . . 6297 1 231 . 1 1 25 25 ILE HG21 H 1 0.391 0.030 . 1 . . . . . . . . 6297 1 232 . 1 1 25 25 ILE HG22 H 1 0.391 0.030 . 1 . . . . . . . . 6297 1 233 . 1 1 25 25 ILE HG23 H 1 0.391 0.030 . 1 . . . . . . . . 6297 1 234 . 1 1 25 25 ILE CD1 C 13 11.293 0.300 . 1 . . . . . . . . 6297 1 235 . 1 1 25 25 ILE HD11 H 1 0.772 0.030 . 1 . . . . . . . . 6297 1 236 . 1 1 25 25 ILE HD12 H 1 0.772 0.030 . 1 . . . . . . . . 6297 1 237 . 1 1 25 25 ILE HD13 H 1 0.772 0.030 . 1 . . . . . . . . 6297 1 238 . 1 1 25 25 ILE C C 13 177.961 0.300 . 1 . . . . . . . . 6297 1 239 . 1 1 26 26 TYR N N 15 116.921 0.200 . 1 . . . . . . . . 6297 1 240 . 1 1 26 26 TYR H H 1 8.788 0.030 . 1 . . . . . . . . 6297 1 241 . 1 1 26 26 TYR CA C 13 61.236 0.300 . 1 . . . . . . . . 6297 1 242 . 1 1 26 26 TYR HA H 1 4.492 0.030 . 1 . . . . . . . . 6297 1 243 . 1 1 26 26 TYR CB C 13 39.778 0.300 . 1 . . . . . . . . 6297 1 244 . 1 1 26 26 TYR HB2 H 1 2.846 0.030 . 2 . . . . . . . . 6297 1 245 . 1 1 26 26 TYR HB3 H 1 3.016 0.030 . 2 . . . . . . . . 6297 1 246 . 1 1 26 26 TYR CD1 C 13 133.097 0.300 . 1 . . . . . . . . 6297 1 247 . 1 1 26 26 TYR HD1 H 1 7.378 0.030 . 1 . . . . . . . . 6297 1 248 . 1 1 26 26 TYR CD2 C 13 133.097 0.300 . 1 . . . . . . . . 6297 1 249 . 1 1 26 26 TYR HD2 H 1 7.378 0.030 . 1 . . . . . . . . 6297 1 250 . 1 1 26 26 TYR CE1 C 13 117.893 0.300 . 1 . . . . . . . . 6297 1 251 . 1 1 26 26 TYR HE1 H 1 6.676 0.030 . 1 . . . . . . . . 6297 1 252 . 1 1 26 26 TYR CE2 C 13 117.893 0.300 . 1 . . . . . . . . 6297 1 253 . 1 1 26 26 TYR HE2 H 1 6.676 0.030 . 1 . . . . . . . . 6297 1 254 . 1 1 26 26 TYR C C 13 177.968 0.300 . 1 . . . . . . . . 6297 1 255 . 1 1 27 27 GLY N N 15 111.668 0.200 . 1 . . . . . . . . 6297 1 256 . 1 1 27 27 GLY H H 1 8.321 0.030 . 1 . . . . . . . . 6297 1 257 . 1 1 27 27 GLY CA C 13 47.529 0.300 . 1 . . . . . . . . 6297 1 258 . 1 1 27 27 GLY HA2 H 1 4.059 0.030 . 1 . . . . . . . . 6297 1 259 . 1 1 27 27 GLY HA3 H 1 4.059 0.030 . 1 . . . . . . . . 6297 1 260 . 1 1 27 27 GLY C C 13 176.578 0.300 . 1 . . . . . . . . 6297 1 261 . 1 1 28 28 SER N N 15 121.451 0.200 . 1 . . . . . . . . 6297 1 262 . 1 1 28 28 SER H H 1 9.046 0.030 . 1 . . . . . . . . 6297 1 263 . 1 1 28 28 SER CA C 13 60.708 0.300 . 1 . . . . . . . . 6297 1 264 . 1 1 28 28 SER HA H 1 4.517 0.030 . 1 . . . . . . . . 6297 1 265 . 1 1 28 28 SER CB C 13 63.104 0.300 . 1 . . . . . . . . 6297 1 266 . 1 1 28 28 SER HB2 H 1 4.043 0.030 . 2 . . . . . . . . 6297 1 267 . 1 1 28 28 SER HB3 H 1 4.188 0.030 . 2 . . . . . . . . 6297 1 268 . 1 1 29 29 ASP N N 15 120.953 0.200 . 1 . . . . . . . . 6297 1 269 . 1 1 29 29 ASP H H 1 8.230 0.030 . 1 . . . . . . . . 6297 1 270 . 1 1 29 29 ASP CA C 13 56.238 0.300 . 1 . . . . . . . . 6297 1 271 . 1 1 29 29 ASP HA H 1 4.857 0.030 . 1 . . . . . . . . 6297 1 272 . 1 1 29 29 ASP CB C 13 41.100 0.300 . 1 . . . . . . . . 6297 1 273 . 1 1 29 29 ASP HB2 H 1 3.101 0.030 . 2 . . . . . . . . 6297 1 274 . 1 1 29 29 ASP HB3 H 1 3.706 0.030 . 2 . . . . . . . . 6297 1 275 . 1 1 29 29 ASP C C 13 174.257 0.300 . 1 . . . . . . . . 6297 1 276 . 1 1 30 30 PHE N N 15 122.095 0.200 . 1 . . . . . . . . 6297 1 277 . 1 1 30 30 PHE H H 1 8.208 0.030 . 1 . . . . . . . . 6297 1 278 . 1 1 30 30 PHE CA C 13 56.853 0.300 . 1 . . . . . . . . 6297 1 279 . 1 1 30 30 PHE HA H 1 5.119 0.030 . 1 . . . . . . . . 6297 1 280 . 1 1 30 30 PHE CB C 13 41.216 0.300 . 1 . . . . . . . . 6297 1 281 . 1 1 30 30 PHE HB2 H 1 2.787 0.030 . 2 . . . . . . . . 6297 1 282 . 1 1 30 30 PHE HB3 H 1 3.484 0.030 . 2 . . . . . . . . 6297 1 283 . 1 1 30 30 PHE CD1 C 13 131.436 0.300 . 1 . . . . . . . . 6297 1 284 . 1 1 30 30 PHE HD1 H 1 7.076 0.030 . 1 . . . . . . . . 6297 1 285 . 1 1 30 30 PHE CD2 C 13 131.436 0.300 . 1 . . . . . . . . 6297 1 286 . 1 1 30 30 PHE HD2 H 1 7.076 0.030 . 1 . . . . . . . . 6297 1 287 . 1 1 30 30 PHE CE1 C 13 131.506 0.300 . 1 . . . . . . . . 6297 1 288 . 1 1 30 30 PHE HE1 H 1 7.251 0.030 . 1 . . . . . . . . 6297 1 289 . 1 1 30 30 PHE CE2 C 13 131.506 0.300 . 1 . . . . . . . . 6297 1 290 . 1 1 30 30 PHE HE2 H 1 7.251 0.030 . 1 . . . . . . . . 6297 1 291 . 1 1 30 30 PHE CZ C 13 129.009 0.300 . 1 . . . . . . . . 6297 1 292 . 1 1 30 30 PHE HZ H 1 7.211 0.030 . 1 . . . . . . . . 6297 1 293 . 1 1 30 30 PHE C C 13 173.559 0.300 . 1 . . . . . . . . 6297 1 294 . 1 1 31 31 GLN N N 15 124.258 0.200 . 1 . . . . . . . . 6297 1 295 . 1 1 31 31 GLN H H 1 8.190 0.030 . 1 . . . . . . . . 6297 1 296 . 1 1 31 31 GLN CA C 13 54.598 0.300 . 1 . . . . . . . . 6297 1 297 . 1 1 31 31 GLN HA H 1 4.239 0.030 . 1 . . . . . . . . 6297 1 298 . 1 1 31 31 GLN CB C 13 32.573 0.300 . 1 . . . . . . . . 6297 1 299 . 1 1 31 31 GLN HB2 H 1 1.750 0.030 . 2 . . . . . . . . 6297 1 300 . 1 1 31 31 GLN HB3 H 1 1.784 0.030 . 2 . . . . . . . . 6297 1 301 . 1 1 31 31 GLN CG C 13 33.661 0.300 . 1 . . . . . . . . 6297 1 302 . 1 1 31 31 GLN HG2 H 1 2.163 0.030 . 2 . . . . . . . . 6297 1 303 . 1 1 31 31 GLN HG3 H 1 2.222 0.030 . 2 . . . . . . . . 6297 1 304 . 1 1 31 31 GLN NE2 N 15 111.178 0.200 . 1 . . . . . . . . 6297 1 305 . 1 1 31 31 GLN HE21 H 1 6.513 0.030 . 2 . . . . . . . . 6297 1 306 . 1 1 31 31 GLN HE22 H 1 7.359 0.030 . 2 . . . . . . . . 6297 1 307 . 1 1 31 31 GLN C C 13 173.074 0.300 . 1 . . . . . . . . 6297 1 308 . 1 1 32 32 ASP N N 15 124.041 0.200 . 1 . . . . . . . . 6297 1 309 . 1 1 32 32 ASP H H 1 8.468 0.030 . 1 . . . . . . . . 6297 1 310 . 1 1 32 32 ASP CA C 13 52.852 0.300 . 1 . . . . . . . . 6297 1 311 . 1 1 32 32 ASP HA H 1 4.556 0.030 . 1 . . . . . . . . 6297 1 312 . 1 1 32 32 ASP CB C 13 41.006 0.300 . 1 . . . . . . . . 6297 1 313 . 1 1 32 32 ASP HB2 H 1 2.524 0.030 . 2 . . . . . . . . 6297 1 314 . 1 1 32 32 ASP HB3 H 1 3.012 0.030 . 2 . . . . . . . . 6297 1 315 . 1 1 32 32 ASP C C 13 177.157 0.300 . 1 . . . . . . . . 6297 1 316 . 1 1 33 33 LEU N N 15 126.480 0.200 . 1 . . . . . . . . 6297 1 317 . 1 1 33 33 LEU H H 1 8.866 0.030 . 1 . . . . . . . . 6297 1 318 . 1 1 33 33 LEU CA C 13 54.754 0.300 . 1 . . . . . . . . 6297 1 319 . 1 1 33 33 LEU HA H 1 4.207 0.030 . 1 . . . . . . . . 6297 1 320 . 1 1 33 33 LEU CB C 13 41.061 0.300 . 1 . . . . . . . . 6297 1 321 . 1 1 33 33 LEU HB2 H 1 1.290 0.030 . 2 . . . . . . . . 6297 1 322 . 1 1 33 33 LEU HB3 H 1 1.571 0.030 . 2 . . . . . . . . 6297 1 323 . 1 1 33 33 LEU CG C 13 27.080 0.300 . 1 . . . . . . . . 6297 1 324 . 1 1 33 33 LEU HG H 1 1.364 0.030 . 1 . . . . . . . . 6297 1 325 . 1 1 33 33 LEU CD1 C 13 22.321 0.300 . 2 . . . . . . . . 6297 1 326 . 1 1 33 33 LEU HD11 H 1 0.619 0.030 . 1 . . . . . . . . 6297 1 327 . 1 1 33 33 LEU HD12 H 1 0.619 0.030 . 1 . . . . . . . . 6297 1 328 . 1 1 33 33 LEU HD13 H 1 0.619 0.030 . 1 . . . . . . . . 6297 1 329 . 1 1 33 33 LEU CD2 C 13 25.370 0.300 . 2 . . . . . . . . 6297 1 330 . 1 1 33 33 LEU HD21 H 1 0.638 0.030 . 1 . . . . . . . . 6297 1 331 . 1 1 33 33 LEU HD22 H 1 0.638 0.030 . 1 . . . . . . . . 6297 1 332 . 1 1 33 33 LEU HD23 H 1 0.638 0.030 . 1 . . . . . . . . 6297 1 333 . 1 1 33 33 LEU C C 13 177.896 0.300 . 1 . . . . . . . . 6297 1 334 . 1 1 34 34 ARG N N 15 122.057 0.200 . 1 . . . . . . . . 6297 1 335 . 1 1 34 34 ARG H H 1 8.331 0.030 . 1 . . . . . . . . 6297 1 336 . 1 1 34 34 ARG CA C 13 55.305 0.300 . 1 . . . . . . . . 6297 1 337 . 1 1 34 34 ARG HA H 1 4.456 0.030 . 1 . . . . . . . . 6297 1 338 . 1 1 34 34 ARG CB C 13 30.468 0.300 . 1 . . . . . . . . 6297 1 339 . 1 1 34 34 ARG HB2 H 1 1.859 0.030 . 2 . . . . . . . . 6297 1 340 . 1 1 34 34 ARG HB3 H 1 1.961 0.030 . 2 . . . . . . . . 6297 1 341 . 1 1 34 34 ARG CG C 13 26.456 0.300 . 1 . . . . . . . . 6297 1 342 . 1 1 34 34 ARG HG2 H 1 1.918 0.030 . 2 . . . . . . . . 6297 1 343 . 1 1 34 34 ARG HG3 H 1 1.786 0.030 . 2 . . . . . . . . 6297 1 344 . 1 1 34 34 ARG CD C 13 44.132 0.300 . 1 . . . . . . . . 6297 1 345 . 1 1 34 34 ARG HD2 H 1 3.330 0.030 . 2 . . . . . . . . 6297 1 346 . 1 1 34 34 ARG HD3 H 1 3.020 0.030 . 2 . . . . . . . . 6297 1 347 . 1 1 34 34 ARG NE N 15 82.589 0.200 . 1 . . . . . . . . 6297 1 348 . 1 1 34 34 ARG HE H 1 8.710 0.030 . 1 . . . . . . . . 6297 1 349 . 1 1 34 34 ARG HH11 H 1 6.977 0.030 . 1 . . . . . . . . 6297 1 350 . 1 1 34 34 ARG HH12 H 1 6.977 0.030 . 1 . . . . . . . . 6297 1 351 . 1 1 34 34 ARG HH21 H 1 6.977 0.030 . 1 . . . . . . . . 6297 1 352 . 1 1 34 34 ARG HH22 H 1 6.977 0.030 . 1 . . . . . . . . 6297 1 353 . 1 1 34 34 ARG C C 13 175.067 0.300 . 1 . . . . . . . . 6297 1 354 . 1 1 35 35 PRO CA C 13 63.023 0.300 . 1 . . . . . . . . 6297 1 355 . 1 1 35 35 PRO HA H 1 4.457 0.030 . 1 . . . . . . . . 6297 1 356 . 1 1 35 35 PRO CB C 13 32.177 0.300 . 1 . . . . . . . . 6297 1 357 . 1 1 35 35 PRO HB2 H 1 1.927 0.030 . 2 . . . . . . . . 6297 1 358 . 1 1 35 35 PRO HB3 H 1 2.304 0.030 . 2 . . . . . . . . 6297 1 359 . 1 1 35 35 PRO CG C 13 27.251 0.300 . 1 . . . . . . . . 6297 1 360 . 1 1 35 35 PRO HG2 H 1 2.007 0.030 . 2 . . . . . . . . 6297 1 361 . 1 1 35 35 PRO HG3 H 1 2.037 0.030 . 2 . . . . . . . . 6297 1 362 . 1 1 35 35 PRO CD C 13 50.542 0.300 . 1 . . . . . . . . 6297 1 363 . 1 1 35 35 PRO HD2 H 1 3.660 0.030 . 2 . . . . . . . . 6297 1 364 . 1 1 35 35 PRO HD3 H 1 3.878 0.030 . 2 . . . . . . . . 6297 1 365 . 1 1 35 35 PRO C C 13 176.605 0.300 . 1 . . . . . . . . 6297 1 366 . 1 1 36 36 ASP N N 15 119.884 0.200 . 1 . . . . . . . . 6297 1 367 . 1 1 36 36 ASP H H 1 8.353 0.030 . 1 . . . . . . . . 6297 1 368 . 1 1 36 36 ASP CA C 13 54.499 0.300 . 1 . . . . . . . . 6297 1 369 . 1 1 36 36 ASP HA H 1 4.508 0.030 . 1 . . . . . . . . 6297 1 370 . 1 1 36 36 ASP CB C 13 41.046 0.300 . 1 . . . . . . . . 6297 1 371 . 1 1 36 36 ASP HB2 H 1 2.606 0.030 . 2 . . . . . . . . 6297 1 372 . 1 1 36 36 ASP HB3 H 1 2.717 0.030 . 2 . . . . . . . . 6297 1 373 . 1 1 36 36 ASP C C 13 176.393 0.300 . 1 . . . . . . . . 6297 1 374 . 1 1 37 37 ALA N N 15 125.935 0.200 . 1 . . . . . . . . 6297 1 375 . 1 1 37 37 ALA H H 1 8.330 0.030 . 1 . . . . . . . . 6297 1 376 . 1 1 37 37 ALA CA C 13 53.090 0.300 . 1 . . . . . . . . 6297 1 377 . 1 1 37 37 ALA HA H 1 4.260 0.030 . 1 . . . . . . . . 6297 1 378 . 1 1 37 37 ALA CB C 13 19.340 0.300 . 1 . . . . . . . . 6297 1 379 . 1 1 37 37 ALA HB1 H 1 1.422 0.030 . 1 . . . . . . . . 6297 1 380 . 1 1 37 37 ALA HB2 H 1 1.422 0.030 . 1 . . . . . . . . 6297 1 381 . 1 1 37 37 ALA HB3 H 1 1.422 0.030 . 1 . . . . . . . . 6297 1 382 . 1 1 37 37 ALA C C 13 178.056 0.300 . 1 . . . . . . . . 6297 1 383 . 1 1 38 38 ARG N N 15 119.210 0.200 . 1 . . . . . . . . 6297 1 384 . 1 1 38 38 ARG H H 1 8.433 0.030 . 1 . . . . . . . . 6297 1 385 . 1 1 38 38 ARG CA C 13 56.371 0.300 . 1 . . . . . . . . 6297 1 386 . 1 1 38 38 ARG HA H 1 4.309 0.030 . 1 . . . . . . . . 6297 1 387 . 1 1 38 38 ARG CB C 13 29.893 0.300 . 1 . . . . . . . . 6297 1 388 . 1 1 38 38 ARG HB2 H 1 1.824 0.030 . 2 . . . . . . . . 6297 1 389 . 1 1 38 38 ARG HB3 H 1 1.938 0.030 . 2 . . . . . . . . 6297 1 390 . 1 1 38 38 ARG CG C 13 26.994 0.300 . 1 . . . . . . . . 6297 1 391 . 1 1 38 38 ARG HG2 H 1 1.635 0.030 . 2 . . . . . . . . 6297 1 392 . 1 1 38 38 ARG HG3 H 1 1.687 0.030 . 2 . . . . . . . . 6297 1 393 . 1 1 38 38 ARG CD C 13 43.472 0.300 . 1 . . . . . . . . 6297 1 394 . 1 1 38 38 ARG HD2 H 1 3.218 0.030 . 1 . . . . . . . . 6297 1 395 . 1 1 38 38 ARG HD3 H 1 3.218 0.030 . 1 . . . . . . . . 6297 1 396 . 1 1 38 38 ARG C C 13 177.103 0.300 . 1 . . . . . . . . 6297 1 397 . 1 1 39 39 GLY N N 15 109.739 0.200 . 1 . . . . . . . . 6297 1 398 . 1 1 39 39 GLY H H 1 8.383 0.030 . 1 . . . . . . . . 6297 1 399 . 1 1 39 39 GLY CA C 13 45.493 0.300 . 1 . . . . . . . . 6297 1 400 . 1 1 39 39 GLY HA2 H 1 4.055 0.030 . 1 . . . . . . . . 6297 1 401 . 1 1 39 39 GLY HA3 H 1 4.055 0.030 . 1 . . . . . . . . 6297 1 402 . 1 1 39 39 GLY C C 13 174.245 0.300 . 1 . . . . . . . . 6297 1 403 . 1 1 40 40 ARG N N 15 119.644 0.200 . 1 . . . . . . . . 6297 1 404 . 1 1 40 40 ARG H H 1 8.152 0.030 . 1 . . . . . . . . 6297 1 405 . 1 1 40 40 ARG CA C 13 56.454 0.300 . 1 . . . . . . . . 6297 1 406 . 1 1 40 40 ARG HA H 1 4.329 0.030 . 1 . . . . . . . . 6297 1 407 . 1 1 40 40 ARG CB C 13 31.038 0.300 . 1 . . . . . . . . 6297 1 408 . 1 1 40 40 ARG HB2 H 1 1.830 0.030 . 2 . . . . . . . . 6297 1 409 . 1 1 40 40 ARG HB3 H 1 1.953 0.030 . 2 . . . . . . . . 6297 1 410 . 1 1 40 40 ARG CG C 13 27.235 0.300 . 1 . . . . . . . . 6297 1 411 . 1 1 40 40 ARG HG2 H 1 1.674 0.030 . 1 . . . . . . . . 6297 1 412 . 1 1 40 40 ARG HG3 H 1 1.674 0.030 . 1 . . . . . . . . 6297 1 413 . 1 1 40 40 ARG CD C 13 43.363 0.300 . 1 . . . . . . . . 6297 1 414 . 1 1 40 40 ARG HD2 H 1 3.239 0.030 . 1 . . . . . . . . 6297 1 415 . 1 1 40 40 ARG HD3 H 1 3.239 0.030 . 1 . . . . . . . . 6297 1 416 . 1 1 40 40 ARG C C 13 176.366 0.300 . 1 . . . . . . . . 6297 1 417 . 1 1 41 41 VAL N N 15 118.788 0.200 . 1 . . . . . . . . 6297 1 418 . 1 1 41 41 VAL H H 1 7.856 0.030 . 1 . . . . . . . . 6297 1 419 . 1 1 41 41 VAL CA C 13 62.294 0.300 . 1 . . . . . . . . 6297 1 420 . 1 1 41 41 VAL HA H 1 4.091 0.030 . 1 . . . . . . . . 6297 1 421 . 1 1 41 41 VAL CB C 13 32.617 0.300 . 1 . . . . . . . . 6297 1 422 . 1 1 41 41 VAL HB H 1 2.064 0.030 . 1 . . . . . . . . 6297 1 423 . 1 1 41 41 VAL CG1 C 13 20.855 0.300 . 2 . . . . . . . . 6297 1 424 . 1 1 41 41 VAL HG11 H 1 0.968 0.030 . 1 . . . . . . . . 6297 1 425 . 1 1 41 41 VAL HG12 H 1 0.968 0.030 . 1 . . . . . . . . 6297 1 426 . 1 1 41 41 VAL HG13 H 1 0.968 0.030 . 1 . . . . . . . . 6297 1 427 . 1 1 41 41 VAL CG2 C 13 21.181 0.300 . 2 . . . . . . . . 6297 1 428 . 1 1 41 41 VAL HG21 H 1 0.957 0.030 . 1 . . . . . . . . 6297 1 429 . 1 1 41 41 VAL HG22 H 1 0.957 0.030 . 1 . . . . . . . . 6297 1 430 . 1 1 41 41 VAL HG23 H 1 0.957 0.030 . 1 . . . . . . . . 6297 1 431 . 1 1 41 41 VAL C C 13 175.525 0.300 . 1 . . . . . . . . 6297 1 432 . 1 1 42 42 ARG N N 15 126.472 0.200 . 1 . . . . . . . . 6297 1 433 . 1 1 42 42 ARG H H 1 8.434 0.030 . 1 . . . . . . . . 6297 1 434 . 1 1 42 42 ARG CA C 13 56.363 0.300 . 1 . . . . . . . . 6297 1 435 . 1 1 42 42 ARG HA H 1 4.327 0.030 . 1 . . . . . . . . 6297 1 436 . 1 1 42 42 ARG CB C 13 31.067 0.300 . 1 . . . . . . . . 6297 1 437 . 1 1 42 42 ARG HB2 H 1 1.808 0.030 . 1 . . . . . . . . 6297 1 438 . 1 1 42 42 ARG HB3 H 1 1.808 0.030 . 1 . . . . . . . . 6297 1 439 . 1 1 42 42 ARG CG C 13 27.318 0.300 . 1 . . . . . . . . 6297 1 440 . 1 1 42 42 ARG HG2 H 1 1.576 0.030 . 2 . . . . . . . . 6297 1 441 . 1 1 42 42 ARG HG3 H 1 1.690 0.030 . 2 . . . . . . . . 6297 1 442 . 1 1 42 42 ARG CD C 13 43.629 0.300 . 1 . . . . . . . . 6297 1 443 . 1 1 42 42 ARG HD2 H 1 3.173 0.030 . 2 . . . . . . . . 6297 1 444 . 1 1 42 42 ARG HD3 H 1 3.266 0.030 . 2 . . . . . . . . 6297 1 445 . 1 1 42 42 ARG NE N 15 88.517 0.200 . 1 . . . . . . . . 6297 1 446 . 1 1 42 42 ARG HE H 1 8.671 0.030 . 1 . . . . . . . . 6297 1 447 . 1 1 42 42 ARG C C 13 176.195 0.300 . 1 . . . . . . . . 6297 1 448 . 1 1 43 43 GLU N N 15 127.266 0.200 . 1 . . . . . . . . 6297 1 449 . 1 1 43 43 GLU H H 1 8.740 0.030 . 1 . . . . . . . . 6297 1 450 . 1 1 43 43 GLU CA C 13 54.147 0.300 . 1 . . . . . . . . 6297 1 451 . 1 1 43 43 GLU HA H 1 4.691 0.030 . 1 . . . . . . . . 6297 1 452 . 1 1 43 43 GLU CB C 13 29.851 0.300 . 1 . . . . . . . . 6297 1 453 . 1 1 43 43 GLU HB2 H 1 1.741 0.030 . 2 . . . . . . . . 6297 1 454 . 1 1 43 43 GLU HB3 H 1 2.139 0.030 . 2 . . . . . . . . 6297 1 455 . 1 1 43 43 GLU CG C 13 36.196 0.300 . 1 . . . . . . . . 6297 1 456 . 1 1 43 43 GLU HG2 H 1 2.284 0.030 . 2 . . . . . . . . 6297 1 457 . 1 1 43 43 GLU HG3 H 1 2.358 0.030 . 2 . . . . . . . . 6297 1 458 . 1 1 43 43 GLU C C 13 173.202 0.300 . 1 . . . . . . . . 6297 1 459 . 1 1 44 44 PRO CA C 13 61.453 0.300 . 1 . . . . . . . . 6297 1 460 . 1 1 44 44 PRO HA H 1 4.665 0.030 . 1 . . . . . . . . 6297 1 461 . 1 1 44 44 PRO CB C 13 30.559 0.300 . 1 . . . . . . . . 6297 1 462 . 1 1 44 44 PRO HB2 H 1 2.237 0.030 . 2 . . . . . . . . 6297 1 463 . 1 1 44 44 PRO HB3 H 1 1.936 0.030 . 2 . . . . . . . . 6297 1 464 . 1 1 44 44 PRO CG C 13 27.961 0.300 . 1 . . . . . . . . 6297 1 465 . 1 1 44 44 PRO HG2 H 1 2.061 0.030 . 2 . . . . . . . . 6297 1 466 . 1 1 44 44 PRO HG3 H 1 1.894 0.030 . 2 . . . . . . . . 6297 1 467 . 1 1 44 44 PRO CD C 13 50.309 0.300 . 1 . . . . . . . . 6297 1 468 . 1 1 44 44 PRO HD2 H 1 3.707 0.030 . 2 . . . . . . . . 6297 1 469 . 1 1 44 44 PRO HD3 H 1 3.852 0.030 . 2 . . . . . . . . 6297 1 470 . 1 1 45 45 PRO CA C 13 64.751 0.300 . 1 . . . . . . . . 6297 1 471 . 1 1 45 45 PRO HA H 1 3.791 0.030 . 1 . . . . . . . . 6297 1 472 . 1 1 45 45 PRO CB C 13 33.059 0.300 . 1 . . . . . . . . 6297 1 473 . 1 1 45 45 PRO HB2 H 1 1.857 0.030 . 2 . . . . . . . . 6297 1 474 . 1 1 45 45 PRO HB3 H 1 2.178 0.030 . 2 . . . . . . . . 6297 1 475 . 1 1 45 45 PRO CG C 13 27.734 0.300 . 1 . . . . . . . . 6297 1 476 . 1 1 45 45 PRO HG2 H 1 1.965 0.030 . 2 . . . . . . . . 6297 1 477 . 1 1 45 45 PRO HG3 H 1 2.188 0.030 . 2 . . . . . . . . 6297 1 478 . 1 1 45 45 PRO CD C 13 50.702 0.300 . 1 . . . . . . . . 6297 1 479 . 1 1 45 45 PRO HD2 H 1 3.527 0.030 . 2 . . . . . . . . 6297 1 480 . 1 1 45 45 PRO HD3 H 1 3.956 0.030 . 2 . . . . . . . . 6297 1 481 . 1 1 45 45 PRO C C 13 174.243 0.300 . 1 . . . . . . . . 6297 1 482 . 1 1 46 46 GLU N N 15 123.446 0.200 . 1 . . . . . . . . 6297 1 483 . 1 1 46 46 GLU H H 1 6.453 0.030 . 1 . . . . . . . . 6297 1 484 . 1 1 46 46 GLU CA C 13 55.705 0.300 . 1 . . . . . . . . 6297 1 485 . 1 1 46 46 GLU HA H 1 5.177 0.030 . 1 . . . . . . . . 6297 1 486 . 1 1 46 46 GLU CB C 13 31.619 0.300 . 1 . . . . . . . . 6297 1 487 . 1 1 46 46 GLU HB2 H 1 1.791 0.030 . 2 . . . . . . . . 6297 1 488 . 1 1 46 46 GLU HB3 H 1 1.861 0.030 . 2 . . . . . . . . 6297 1 489 . 1 1 46 46 GLU CG C 13 36.456 0.300 . 1 . . . . . . . . 6297 1 490 . 1 1 46 46 GLU HG2 H 1 1.944 0.030 . 2 . . . . . . . . 6297 1 491 . 1 1 46 46 GLU HG3 H 1 2.059 0.030 . 2 . . . . . . . . 6297 1 492 . 1 1 46 46 GLU C C 13 174.629 0.300 . 1 . . . . . . . . 6297 1 493 . 1 1 47 47 ILE N N 15 119.248 0.200 . 1 . . . . . . . . 6297 1 494 . 1 1 47 47 ILE H H 1 8.996 0.030 . 1 . . . . . . . . 6297 1 495 . 1 1 47 47 ILE CA C 13 57.939 0.300 . 1 . . . . . . . . 6297 1 496 . 1 1 47 47 ILE HA H 1 5.105 0.030 . 1 . . . . . . . . 6297 1 497 . 1 1 47 47 ILE CB C 13 42.862 0.300 . 1 . . . . . . . . 6297 1 498 . 1 1 47 47 ILE HB H 1 1.739 0.030 . 1 . . . . . . . . 6297 1 499 . 1 1 47 47 ILE CG1 C 13 27.039 0.300 . 1 . . . . . . . . 6297 1 500 . 1 1 47 47 ILE HG12 H 1 0.997 0.030 . 2 . . . . . . . . 6297 1 501 . 1 1 47 47 ILE HG13 H 1 1.396 0.030 . 2 . . . . . . . . 6297 1 502 . 1 1 47 47 ILE CG2 C 13 20.453 0.300 . 1 . . . . . . . . 6297 1 503 . 1 1 47 47 ILE HG21 H 1 0.849 0.030 . 1 . . . . . . . . 6297 1 504 . 1 1 47 47 ILE HG22 H 1 0.849 0.030 . 1 . . . . . . . . 6297 1 505 . 1 1 47 47 ILE HG23 H 1 0.849 0.030 . 1 . . . . . . . . 6297 1 506 . 1 1 47 47 ILE CD1 C 13 15.444 0.300 . 1 . . . . . . . . 6297 1 507 . 1 1 47 47 ILE HD11 H 1 0.802 0.030 . 1 . . . . . . . . 6297 1 508 . 1 1 47 47 ILE HD12 H 1 0.802 0.030 . 1 . . . . . . . . 6297 1 509 . 1 1 47 47 ILE HD13 H 1 0.802 0.030 . 1 . . . . . . . . 6297 1 510 . 1 1 47 47 ILE C C 13 173.206 0.300 . 1 . . . . . . . . 6297 1 511 . 1 1 48 48 ASN N N 15 121.933 0.200 . 1 . . . . . . . . 6297 1 512 . 1 1 48 48 ASN H H 1 8.842 0.030 . 1 . . . . . . . . 6297 1 513 . 1 1 48 48 ASN CA C 13 52.151 0.300 . 1 . . . . . . . . 6297 1 514 . 1 1 48 48 ASN HA H 1 5.516 0.030 . 1 . . . . . . . . 6297 1 515 . 1 1 48 48 ASN CB C 13 44.659 0.300 . 1 . . . . . . . . 6297 1 516 . 1 1 48 48 ASN HB2 H 1 2.093 0.030 . 2 . . . . . . . . 6297 1 517 . 1 1 48 48 ASN HB3 H 1 2.699 0.030 . 2 . . . . . . . . 6297 1 518 . 1 1 48 48 ASN ND2 N 15 112.616 0.200 . 1 . . . . . . . . 6297 1 519 . 1 1 48 48 ASN HD21 H 1 7.213 0.030 . 2 . . . . . . . . 6297 1 520 . 1 1 48 48 ASN HD22 H 1 7.406 0.030 . 2 . . . . . . . . 6297 1 521 . 1 1 48 48 ASN C C 13 173.535 0.300 . 1 . . . . . . . . 6297 1 522 . 1 1 49 49 LEU N N 15 126.278 0.200 . 1 . . . . . . . . 6297 1 523 . 1 1 49 49 LEU H H 1 8.837 0.030 . 1 . . . . . . . . 6297 1 524 . 1 1 49 49 LEU CA C 13 52.812 0.300 . 1 . . . . . . . . 6297 1 525 . 1 1 49 49 LEU HA H 1 5.299 0.030 . 1 . . . . . . . . 6297 1 526 . 1 1 49 49 LEU CB C 13 45.791 0.300 . 1 . . . . . . . . 6297 1 527 . 1 1 49 49 LEU HB2 H 1 1.052 0.030 . 2 . . . . . . . . 6297 1 528 . 1 1 49 49 LEU HB3 H 1 1.407 0.030 . 2 . . . . . . . . 6297 1 529 . 1 1 49 49 LEU CG C 13 26.772 0.300 . 1 . . . . . . . . 6297 1 530 . 1 1 49 49 LEU HG H 1 1.340 0.030 . 1 . . . . . . . . 6297 1 531 . 1 1 49 49 LEU CD1 C 13 25.700 0.300 . 1 . . . . . . . . 6297 1 532 . 1 1 49 49 LEU HD11 H 1 0.475 0.030 . 1 . . . . . . . . 6297 1 533 . 1 1 49 49 LEU HD12 H 1 0.475 0.030 . 1 . . . . . . . . 6297 1 534 . 1 1 49 49 LEU HD13 H 1 0.475 0.030 . 1 . . . . . . . . 6297 1 535 . 1 1 49 49 LEU CD2 C 13 25.517 0.300 . 1 . . . . . . . . 6297 1 536 . 1 1 49 49 LEU HD21 H 1 0.512 0.030 . 1 . . . . . . . . 6297 1 537 . 1 1 49 49 LEU HD22 H 1 0.512 0.030 . 1 . . . . . . . . 6297 1 538 . 1 1 49 49 LEU HD23 H 1 0.512 0.030 . 1 . . . . . . . . 6297 1 539 . 1 1 49 49 LEU C C 13 175.195 0.300 . 1 . . . . . . . . 6297 1 540 . 1 1 50 50 VAL N N 15 126.115 0.200 . 1 . . . . . . . . 6297 1 541 . 1 1 50 50 VAL H H 1 8.632 0.030 . 1 . . . . . . . . 6297 1 542 . 1 1 50 50 VAL CA C 13 63.335 0.300 . 1 . . . . . . . . 6297 1 543 . 1 1 50 50 VAL HA H 1 3.922 0.030 . 1 . . . . . . . . 6297 1 544 . 1 1 50 50 VAL CB C 13 31.332 0.300 . 1 . . . . . . . . 6297 1 545 . 1 1 50 50 VAL HB H 1 2.126 0.030 . 1 . . . . . . . . 6297 1 546 . 1 1 50 50 VAL CG1 C 13 20.980 0.300 . 2 . . . . . . . . 6297 1 547 . 1 1 50 50 VAL HG11 H 1 0.765 0.030 . 1 . . . . . . . . 6297 1 548 . 1 1 50 50 VAL HG12 H 1 0.765 0.030 . 1 . . . . . . . . 6297 1 549 . 1 1 50 50 VAL HG13 H 1 0.765 0.030 . 1 . . . . . . . . 6297 1 550 . 1 1 50 50 VAL CG2 C 13 20.732 0.300 . 2 . . . . . . . . 6297 1 551 . 1 1 50 50 VAL HG21 H 1 0.901 0.030 . 1 . . . . . . . . 6297 1 552 . 1 1 50 50 VAL HG22 H 1 0.901 0.030 . 1 . . . . . . . . 6297 1 553 . 1 1 50 50 VAL HG23 H 1 0.901 0.030 . 1 . . . . . . . . 6297 1 554 . 1 1 50 50 VAL C C 13 173.972 0.300 . 1 . . . . . . . . 6297 1 555 . 1 1 51 51 LEU N N 15 125.488 0.200 . 1 . . . . . . . . 6297 1 556 . 1 1 51 51 LEU H H 1 8.284 0.030 . 1 . . . . . . . . 6297 1 557 . 1 1 51 51 LEU CA C 13 53.749 0.300 . 1 . . . . . . . . 6297 1 558 . 1 1 51 51 LEU HA H 1 4.696 0.030 . 1 . . . . . . . . 6297 1 559 . 1 1 51 51 LEU CB C 13 45.742 0.300 . 1 . . . . . . . . 6297 1 560 . 1 1 51 51 LEU HB2 H 1 1.073 0.030 . 2 . . . . . . . . 6297 1 561 . 1 1 51 51 LEU HB3 H 1 1.621 0.030 . 2 . . . . . . . . 6297 1 562 . 1 1 51 51 LEU CG C 13 26.207 0.300 . 1 . . . . . . . . 6297 1 563 . 1 1 51 51 LEU HG H 1 1.463 0.030 . 1 . . . . . . . . 6297 1 564 . 1 1 51 51 LEU CD1 C 13 27.933 0.300 . 1 . . . . . . . . 6297 1 565 . 1 1 51 51 LEU HD11 H 1 0.821 0.030 . 1 . . . . . . . . 6297 1 566 . 1 1 51 51 LEU HD12 H 1 0.821 0.030 . 1 . . . . . . . . 6297 1 567 . 1 1 51 51 LEU HD13 H 1 0.821 0.030 . 1 . . . . . . . . 6297 1 568 . 1 1 51 51 LEU CD2 C 13 24.325 0.300 . 1 . . . . . . . . 6297 1 569 . 1 1 51 51 LEU HD21 H 1 0.775 0.030 . 1 . . . . . . . . 6297 1 570 . 1 1 51 51 LEU HD22 H 1 0.775 0.030 . 1 . . . . . . . . 6297 1 571 . 1 1 51 51 LEU HD23 H 1 0.775 0.030 . 1 . . . . . . . . 6297 1 572 . 1 1 51 51 LEU C C 13 173.546 0.300 . 1 . . . . . . . . 6297 1 573 . 1 1 52 52 TYR N N 15 115.861 0.200 . 1 . . . . . . . . 6297 1 574 . 1 1 52 52 TYR H H 1 7.961 0.030 . 1 . . . . . . . . 6297 1 575 . 1 1 52 52 TYR CA C 13 55.252 0.300 . 1 . . . . . . . . 6297 1 576 . 1 1 52 52 TYR HA H 1 4.985 0.030 . 1 . . . . . . . . 6297 1 577 . 1 1 52 52 TYR CB C 13 39.569 0.300 . 1 . . . . . . . . 6297 1 578 . 1 1 52 52 TYR HB2 H 1 2.732 0.030 . 2 . . . . . . . . 6297 1 579 . 1 1 52 52 TYR HB3 H 1 3.253 0.030 . 2 . . . . . . . . 6297 1 580 . 1 1 52 52 TYR CD1 C 13 133.873 0.300 . 1 . . . . . . . . 6297 1 581 . 1 1 52 52 TYR HD1 H 1 7.124 0.030 . 1 . . . . . . . . 6297 1 582 . 1 1 52 52 TYR CD2 C 13 133.873 0.300 . 1 . . . . . . . . 6297 1 583 . 1 1 52 52 TYR HD2 H 1 7.124 0.030 . 1 . . . . . . . . 6297 1 584 . 1 1 52 52 TYR CE1 C 13 118.429 0.300 . 1 . . . . . . . . 6297 1 585 . 1 1 52 52 TYR HE1 H 1 6.807 0.030 . 1 . . . . . . . . 6297 1 586 . 1 1 52 52 TYR CE2 C 13 118.429 0.300 . 1 . . . . . . . . 6297 1 587 . 1 1 52 52 TYR HE2 H 1 6.807 0.030 . 1 . . . . . . . . 6297 1 588 . 1 1 52 52 TYR C C 13 173.412 0.300 . 1 . . . . . . . . 6297 1 589 . 1 1 53 53 PRO CA C 13 63.002 0.300 . 1 . . . . . . . . 6297 1 590 . 1 1 53 53 PRO HA H 1 4.539 0.030 . 1 . . . . . . . . 6297 1 591 . 1 1 53 53 PRO CB C 13 32.065 0.300 . 1 . . . . . . . . 6297 1 592 . 1 1 53 53 PRO HB2 H 1 2.011 0.030 . 2 . . . . . . . . 6297 1 593 . 1 1 53 53 PRO HB3 H 1 2.124 0.030 . 2 . . . . . . . . 6297 1 594 . 1 1 53 53 PRO CG C 13 27.785 0.300 . 1 . . . . . . . . 6297 1 595 . 1 1 53 53 PRO HG2 H 1 1.878 0.030 . 2 . . . . . . . . 6297 1 596 . 1 1 53 53 PRO HG3 H 1 2.166 0.030 . 2 . . . . . . . . 6297 1 597 . 1 1 53 53 PRO CD C 13 50.932 0.300 . 1 . . . . . . . . 6297 1 598 . 1 1 53 53 PRO HD2 H 1 4.012 0.030 . 1 . . . . . . . . 6297 1 599 . 1 1 53 53 PRO HD3 H 1 4.012 0.030 . 1 . . . . . . . . 6297 1 600 . 1 1 53 53 PRO C C 13 176.024 0.300 . 1 . . . . . . . . 6297 1 601 . 1 1 54 54 GLN N N 15 120.712 0.200 . 1 . . . . . . . . 6297 1 602 . 1 1 54 54 GLN H H 1 8.038 0.030 . 1 . . . . . . . . 6297 1 603 . 1 1 54 54 GLN CA C 13 55.925 0.300 . 1 . . . . . . . . 6297 1 604 . 1 1 54 54 GLN HA H 1 4.351 0.030 . 1 . . . . . . . . 6297 1 605 . 1 1 54 54 GLN CB C 13 29.880 0.300 . 1 . . . . . . . . 6297 1 606 . 1 1 54 54 GLN HB2 H 1 1.974 0.030 . 2 . . . . . . . . 6297 1 607 . 1 1 54 54 GLN HB3 H 1 2.137 0.030 . 2 . . . . . . . . 6297 1 608 . 1 1 54 54 GLN CG C 13 33.759 0.300 . 1 . . . . . . . . 6297 1 609 . 1 1 54 54 GLN HG2 H 1 2.394 0.030 . 1 . . . . . . . . 6297 1 610 . 1 1 54 54 GLN HG3 H 1 2.394 0.030 . 1 . . . . . . . . 6297 1 611 . 1 1 54 54 GLN NE2 N 15 112.771 0.200 . 1 . . . . . . . . 6297 1 612 . 1 1 54 54 GLN HE21 H 1 6.848 0.030 . 2 . . . . . . . . 6297 1 613 . 1 1 54 54 GLN HE22 H 1 7.517 0.030 . 2 . . . . . . . . 6297 1 614 . 1 1 54 54 GLN C C 13 176.544 0.300 . 1 . . . . . . . . 6297 1 615 . 1 1 55 55 GLY N N 15 111.607 0.200 . 1 . . . . . . . . 6297 1 616 . 1 1 55 55 GLY H H 1 8.627 0.030 . 1 . . . . . . . . 6297 1 617 . 1 1 55 55 GLY CA C 13 45.788 0.300 . 1 . . . . . . . . 6297 1 618 . 1 1 55 55 GLY HA2 H 1 3.995 0.030 . 1 . . . . . . . . 6297 1 619 . 1 1 55 55 GLY HA3 H 1 3.995 0.030 . 1 . . . . . . . . 6297 1 620 . 1 1 55 55 GLY C C 13 174.220 0.300 . 1 . . . . . . . . 6297 1 621 . 1 1 56 56 LEU N N 15 121.059 0.200 . 1 . . . . . . . . 6297 1 622 . 1 1 56 56 LEU H H 1 8.045 0.030 . 1 . . . . . . . . 6297 1 623 . 1 1 56 56 LEU CA C 13 54.441 0.300 . 1 . . . . . . . . 6297 1 624 . 1 1 56 56 LEU HA H 1 4.464 0.030 . 1 . . . . . . . . 6297 1 625 . 1 1 56 56 LEU CB C 13 43.081 0.300 . 1 . . . . . . . . 6297 1 626 . 1 1 56 56 LEU HB2 H 1 1.566 0.030 . 1 . . . . . . . . 6297 1 627 . 1 1 56 56 LEU HB3 H 1 1.566 0.030 . 1 . . . . . . . . 6297 1 628 . 1 1 56 56 LEU CG C 13 26.913 0.300 . 1 . . . . . . . . 6297 1 629 . 1 1 56 56 LEU HG H 1 1.580 0.030 . 1 . . . . . . . . 6297 1 630 . 1 1 56 56 LEU CD1 C 13 23.069 0.300 . 2 . . . . . . . . 6297 1 631 . 1 1 56 56 LEU HD11 H 1 0.867 0.030 . 1 . . . . . . . . 6297 1 632 . 1 1 56 56 LEU HD12 H 1 0.867 0.030 . 1 . . . . . . . . 6297 1 633 . 1 1 56 56 LEU HD13 H 1 0.867 0.030 . 1 . . . . . . . . 6297 1 634 . 1 1 56 56 LEU CD2 C 13 25.811 0.300 . 2 . . . . . . . . 6297 1 635 . 1 1 56 56 LEU HD21 H 1 0.907 0.030 . 1 . . . . . . . . 6297 1 636 . 1 1 56 56 LEU HD22 H 1 0.907 0.030 . 1 . . . . . . . . 6297 1 637 . 1 1 56 56 LEU HD23 H 1 0.907 0.030 . 1 . . . . . . . . 6297 1 638 . 1 1 56 56 LEU C C 13 176.944 0.300 . 1 . . . . . . . . 6297 1 639 . 1 1 57 57 ALA N N 15 124.485 0.200 . 1 . . . . . . . . 6297 1 640 . 1 1 57 57 ALA H H 1 8.542 0.030 . 1 . . . . . . . . 6297 1 641 . 1 1 57 57 ALA CA C 13 52.835 0.300 . 1 . . . . . . . . 6297 1 642 . 1 1 57 57 ALA HA H 1 4.170 0.030 . 1 . . . . . . . . 6297 1 643 . 1 1 57 57 ALA CB C 13 18.846 0.300 . 1 . . . . . . . . 6297 1 644 . 1 1 57 57 ALA HB1 H 1 1.375 0.030 . 1 . . . . . . . . 6297 1 645 . 1 1 57 57 ALA HB2 H 1 1.375 0.030 . 1 . . . . . . . . 6297 1 646 . 1 1 57 57 ALA HB3 H 1 1.375 0.030 . 1 . . . . . . . . 6297 1 647 . 1 1 57 57 ALA C C 13 178.412 0.300 . 1 . . . . . . . . 6297 1 648 . 1 1 58 58 GLY N N 15 109.194 0.200 . 1 . . . . . . . . 6297 1 649 . 1 1 58 58 GLY H H 1 8.250 0.030 . 1 . . . . . . . . 6297 1 650 . 1 1 58 58 GLY CA C 13 45.862 0.300 . 1 . . . . . . . . 6297 1 651 . 1 1 58 58 GLY HA2 H 1 3.702 0.030 . 2 . . . . . . . . 6297 1 652 . 1 1 58 58 GLY HA3 H 1 4.061 0.030 . 2 . . . . . . . . 6297 1 653 . 1 1 58 58 GLY C C 13 174.811 0.300 . 1 . . . . . . . . 6297 1 654 . 1 1 59 59 GLU N N 15 120.163 0.200 . 1 . . . . . . . . 6297 1 655 . 1 1 59 59 GLU H H 1 8.185 0.030 . 1 . . . . . . . . 6297 1 656 . 1 1 59 59 GLU CA C 13 56.559 0.300 . 1 . . . . . . . . 6297 1 657 . 1 1 59 59 GLU HA H 1 4.301 0.030 . 1 . . . . . . . . 6297 1 658 . 1 1 59 59 GLU CB C 13 30.189 0.300 . 1 . . . . . . . . 6297 1 659 . 1 1 59 59 GLU HB2 H 1 1.998 0.030 . 2 . . . . . . . . 6297 1 660 . 1 1 59 59 GLU HB3 H 1 2.122 0.030 . 2 . . . . . . . . 6297 1 661 . 1 1 59 59 GLU CG C 13 36.493 0.300 . 1 . . . . . . . . 6297 1 662 . 1 1 59 59 GLU HG2 H 1 2.259 0.030 . 2 . . . . . . . . 6297 1 663 . 1 1 59 59 GLU HG3 H 1 2.309 0.030 . 2 . . . . . . . . 6297 1 664 . 1 1 59 59 GLU C C 13 176.252 0.300 . 1 . . . . . . . . 6297 1 665 . 1 1 60 60 GLU N N 15 120.597 0.200 . 1 . . . . . . . . 6297 1 666 . 1 1 60 60 GLU H H 1 8.259 0.030 . 1 . . . . . . . . 6297 1 667 . 1 1 60 60 GLU CA C 13 56.417 0.300 . 1 . . . . . . . . 6297 1 668 . 1 1 60 60 GLU HA H 1 4.127 0.030 . 1 . . . . . . . . 6297 1 669 . 1 1 60 60 GLU CB C 13 30.160 0.300 . 1 . . . . . . . . 6297 1 670 . 1 1 60 60 GLU HB2 H 1 1.829 0.030 . 1 . . . . . . . . 6297 1 671 . 1 1 60 60 GLU HB3 H 1 1.829 0.030 . 1 . . . . . . . . 6297 1 672 . 1 1 60 60 GLU CG C 13 36.409 0.300 . 1 . . . . . . . . 6297 1 673 . 1 1 60 60 GLU HG2 H 1 2.120 0.030 . 2 . . . . . . . . 6297 1 674 . 1 1 60 60 GLU HG3 H 1 2.168 0.030 . 2 . . . . . . . . 6297 1 675 . 1 1 60 60 GLU C C 13 175.321 0.300 . 1 . . . . . . . . 6297 1 676 . 1 1 61 61 VAL N N 15 120.842 0.200 . 1 . . . . . . . . 6297 1 677 . 1 1 61 61 VAL H H 1 7.928 0.030 . 1 . . . . . . . . 6297 1 678 . 1 1 61 61 VAL CA C 13 62.197 0.300 . 1 . . . . . . . . 6297 1 679 . 1 1 61 61 VAL HA H 1 4.039 0.030 . 1 . . . . . . . . 6297 1 680 . 1 1 61 61 VAL CB C 13 33.115 0.300 . 1 . . . . . . . . 6297 1 681 . 1 1 61 61 VAL HB H 1 2.041 0.030 . 1 . . . . . . . . 6297 1 682 . 1 1 61 61 VAL CG1 C 13 21.077 0.300 . 2 . . . . . . . . 6297 1 683 . 1 1 61 61 VAL HG11 H 1 0.907 0.030 . 1 . . . . . . . . 6297 1 684 . 1 1 61 61 VAL HG12 H 1 0.907 0.030 . 1 . . . . . . . . 6297 1 685 . 1 1 61 61 VAL HG13 H 1 0.907 0.030 . 1 . . . . . . . . 6297 1 686 . 1 1 61 61 VAL CG2 C 13 22.658 0.300 . 2 . . . . . . . . 6297 1 687 . 1 1 61 61 VAL HG21 H 1 1.040 0.030 . 1 . . . . . . . . 6297 1 688 . 1 1 61 61 VAL HG22 H 1 1.040 0.030 . 1 . . . . . . . . 6297 1 689 . 1 1 61 61 VAL HG23 H 1 1.040 0.030 . 1 . . . . . . . . 6297 1 690 . 1 1 61 61 VAL C C 13 175.869 0.300 . 1 . . . . . . . . 6297 1 691 . 1 1 62 62 TYR N N 15 124.774 0.200 . 1 . . . . . . . . 6297 1 692 . 1 1 62 62 TYR H H 1 9.322 0.030 . 1 . . . . . . . . 6297 1 693 . 1 1 62 62 TYR CA C 13 58.630 0.300 . 1 . . . . . . . . 6297 1 694 . 1 1 62 62 TYR HA H 1 4.648 0.030 . 1 . . . . . . . . 6297 1 695 . 1 1 62 62 TYR CB C 13 40.256 0.300 . 1 . . . . . . . . 6297 1 696 . 1 1 62 62 TYR HB2 H 1 2.865 0.030 . 2 . . . . . . . . 6297 1 697 . 1 1 62 62 TYR HB3 H 1 3.262 0.030 . 2 . . . . . . . . 6297 1 698 . 1 1 62 62 TYR CD1 C 13 133.149 0.300 . 1 . . . . . . . . 6297 1 699 . 1 1 62 62 TYR HD1 H 1 7.092 0.030 . 1 . . . . . . . . 6297 1 700 . 1 1 62 62 TYR CD2 C 13 133.149 0.300 . 1 . . . . . . . . 6297 1 701 . 1 1 62 62 TYR HD2 H 1 7.092 0.030 . 1 . . . . . . . . 6297 1 702 . 1 1 62 62 TYR CE1 C 13 118.347 0.300 . 1 . . . . . . . . 6297 1 703 . 1 1 62 62 TYR HE1 H 1 6.825 0.030 . 1 . . . . . . . . 6297 1 704 . 1 1 62 62 TYR CE2 C 13 118.347 0.300 . 1 . . . . . . . . 6297 1 705 . 1 1 62 62 TYR HE2 H 1 6.825 0.030 . 1 . . . . . . . . 6297 1 706 . 1 1 62 62 TYR C C 13 175.364 0.300 . 1 . . . . . . . . 6297 1 707 . 1 1 63 63 VAL N N 15 111.292 0.200 . 1 . . . . . . . . 6297 1 708 . 1 1 63 63 VAL H H 1 7.110 0.030 . 1 . . . . . . . . 6297 1 709 . 1 1 63 63 VAL CA C 13 58.297 0.300 . 1 . . . . . . . . 6297 1 710 . 1 1 63 63 VAL HA H 1 5.189 0.030 . 1 . . . . . . . . 6297 1 711 . 1 1 63 63 VAL CB C 13 35.544 0.300 . 1 . . . . . . . . 6297 1 712 . 1 1 63 63 VAL HB H 1 2.052 0.030 . 1 . . . . . . . . 6297 1 713 . 1 1 63 63 VAL CG1 C 13 20.450 0.300 . 2 . . . . . . . . 6297 1 714 . 1 1 63 63 VAL HG11 H 1 1.065 0.030 . 1 . . . . . . . . 6297 1 715 . 1 1 63 63 VAL HG12 H 1 1.065 0.030 . 1 . . . . . . . . 6297 1 716 . 1 1 63 63 VAL HG13 H 1 1.065 0.030 . 1 . . . . . . . . 6297 1 717 . 1 1 63 63 VAL CG2 C 13 22.498 0.300 . 2 . . . . . . . . 6297 1 718 . 1 1 63 63 VAL HG21 H 1 1.080 0.030 . 1 . . . . . . . . 6297 1 719 . 1 1 63 63 VAL HG22 H 1 1.080 0.030 . 1 . . . . . . . . 6297 1 720 . 1 1 63 63 VAL HG23 H 1 1.080 0.030 . 1 . . . . . . . . 6297 1 721 . 1 1 63 63 VAL C C 13 173.731 0.300 . 1 . . . . . . . . 6297 1 722 . 1 1 64 64 GLN N N 15 114.295 0.200 . 1 . . . . . . . . 6297 1 723 . 1 1 64 64 GLN H H 1 7.990 0.030 . 1 . . . . . . . . 6297 1 724 . 1 1 64 64 GLN CA C 13 55.514 0.300 . 1 . . . . . . . . 6297 1 725 . 1 1 64 64 GLN HA H 1 4.916 0.030 . 1 . . . . . . . . 6297 1 726 . 1 1 64 64 GLN CB C 13 33.113 0.300 . 1 . . . . . . . . 6297 1 727 . 1 1 64 64 GLN HB2 H 1 2.008 0.030 . 2 . . . . . . . . 6297 1 728 . 1 1 64 64 GLN HB3 H 1 2.250 0.030 . 2 . . . . . . . . 6297 1 729 . 1 1 64 64 GLN CG C 13 33.520 0.300 . 1 . . . . . . . . 6297 1 730 . 1 1 64 64 GLN HG2 H 1 2.077 0.030 . 1 . . . . . . . . 6297 1 731 . 1 1 64 64 GLN HG3 H 1 2.077 0.030 . 1 . . . . . . . . 6297 1 732 . 1 1 64 64 GLN NE2 N 15 112.415 0.200 . 1 . . . . . . . . 6297 1 733 . 1 1 64 64 GLN HE21 H 1 6.784 0.030 . 2 . . . . . . . . 6297 1 734 . 1 1 64 64 GLN HE22 H 1 7.748 0.030 . 2 . . . . . . . . 6297 1 735 . 1 1 64 64 GLN C C 13 173.181 0.300 . 1 . . . . . . . . 6297 1 736 . 1 1 65 65 VAL N N 15 117.734 0.200 . 1 . . . . . . . . 6297 1 737 . 1 1 65 65 VAL H H 1 8.466 0.030 . 1 . . . . . . . . 6297 1 738 . 1 1 65 65 VAL CA C 13 61.690 0.300 . 1 . . . . . . . . 6297 1 739 . 1 1 65 65 VAL HA H 1 4.350 0.030 . 1 . . . . . . . . 6297 1 740 . 1 1 65 65 VAL CB C 13 34.274 0.300 . 1 . . . . . . . . 6297 1 741 . 1 1 65 65 VAL HB H 1 2.079 0.030 . 1 . . . . . . . . 6297 1 742 . 1 1 65 65 VAL CG1 C 13 20.146 0.300 . 2 . . . . . . . . 6297 1 743 . 1 1 65 65 VAL HG11 H 1 0.651 0.030 . 1 . . . . . . . . 6297 1 744 . 1 1 65 65 VAL HG12 H 1 0.651 0.030 . 1 . . . . . . . . 6297 1 745 . 1 1 65 65 VAL HG13 H 1 0.651 0.030 . 1 . . . . . . . . 6297 1 746 . 1 1 65 65 VAL CG2 C 13 23.116 0.300 . 2 . . . . . . . . 6297 1 747 . 1 1 65 65 VAL HG21 H 1 0.958 0.030 . 1 . . . . . . . . 6297 1 748 . 1 1 65 65 VAL HG22 H 1 0.958 0.030 . 1 . . . . . . . . 6297 1 749 . 1 1 65 65 VAL HG23 H 1 0.958 0.030 . 1 . . . . . . . . 6297 1 750 . 1 1 65 65 VAL C C 13 170.169 0.300 . 1 . . . . . . . . 6297 1 751 . 1 1 66 66 GLU N N 15 121.528 0.200 . 1 . . . . . . . . 6297 1 752 . 1 1 66 66 GLU H H 1 8.138 0.030 . 1 . . . . . . . . 6297 1 753 . 1 1 66 66 GLU CA C 13 54.517 0.300 . 1 . . . . . . . . 6297 1 754 . 1 1 66 66 GLU HA H 1 5.272 0.030 . 1 . . . . . . . . 6297 1 755 . 1 1 66 66 GLU CB C 13 29.799 0.300 . 1 . . . . . . . . 6297 1 756 . 1 1 66 66 GLU HB2 H 1 1.803 0.030 . 2 . . . . . . . . 6297 1 757 . 1 1 66 66 GLU HB3 H 1 2.081 0.030 . 2 . . . . . . . . 6297 1 758 . 1 1 66 66 GLU CG C 13 37.598 0.300 . 1 . . . . . . . . 6297 1 759 . 1 1 66 66 GLU HG2 H 1 2.100 0.030 . 2 . . . . . . . . 6297 1 760 . 1 1 66 66 GLU HG3 H 1 2.318 0.030 . 2 . . . . . . . . 6297 1 761 . 1 1 66 66 GLU C C 13 175.027 0.300 . 1 . . . . . . . . 6297 1 762 . 1 1 67 67 LEU N N 15 126.280 0.200 . 1 . . . . . . . . 6297 1 763 . 1 1 67 67 LEU H H 1 9.181 0.030 . 1 . . . . . . . . 6297 1 764 . 1 1 67 67 LEU CA C 13 53.579 0.300 . 1 . . . . . . . . 6297 1 765 . 1 1 67 67 LEU HA H 1 4.772 0.030 . 1 . . . . . . . . 6297 1 766 . 1 1 67 67 LEU CB C 13 45.150 0.300 . 1 . . . . . . . . 6297 1 767 . 1 1 67 67 LEU HB2 H 1 0.992 0.030 . 2 . . . . . . . . 6297 1 768 . 1 1 67 67 LEU HB3 H 1 1.882 0.030 . 2 . . . . . . . . 6297 1 769 . 1 1 67 67 LEU CG C 13 27.371 0.300 . 1 . . . . . . . . 6297 1 770 . 1 1 67 67 LEU HG H 1 1.388 0.030 . 1 . . . . . . . . 6297 1 771 . 1 1 67 67 LEU CD1 C 13 26.001 0.300 . 1 . . . . . . . . 6297 1 772 . 1 1 67 67 LEU HD11 H 1 0.627 0.030 . 1 . . . . . . . . 6297 1 773 . 1 1 67 67 LEU HD12 H 1 0.627 0.030 . 1 . . . . . . . . 6297 1 774 . 1 1 67 67 LEU HD13 H 1 0.627 0.030 . 1 . . . . . . . . 6297 1 775 . 1 1 67 67 LEU CD2 C 13 24.374 0.300 . 1 . . . . . . . . 6297 1 776 . 1 1 67 67 LEU HD21 H 1 0.771 0.030 . 1 . . . . . . . . 6297 1 777 . 1 1 67 67 LEU HD22 H 1 0.771 0.030 . 1 . . . . . . . . 6297 1 778 . 1 1 67 67 LEU HD23 H 1 0.771 0.030 . 1 . . . . . . . . 6297 1 779 . 1 1 67 67 LEU C C 13 172.873 0.300 . 1 . . . . . . . . 6297 1 780 . 1 1 68 68 ARG N N 15 128.887 0.200 . 1 . . . . . . . . 6297 1 781 . 1 1 68 68 ARG H H 1 8.824 0.030 . 1 . . . . . . . . 6297 1 782 . 1 1 68 68 ARG CA C 13 53.169 0.300 . 1 . . . . . . . . 6297 1 783 . 1 1 68 68 ARG HA H 1 5.418 0.030 . 1 . . . . . . . . 6297 1 784 . 1 1 68 68 ARG CB C 13 31.484 0.300 . 1 . . . . . . . . 6297 1 785 . 1 1 68 68 ARG HB2 H 1 1.577 0.030 . 2 . . . . . . . . 6297 1 786 . 1 1 68 68 ARG HB3 H 1 1.726 0.030 . 2 . . . . . . . . 6297 1 787 . 1 1 68 68 ARG CG C 13 26.800 0.300 . 1 . . . . . . . . 6297 1 788 . 1 1 68 68 ARG HG2 H 1 1.420 0.030 . 2 . . . . . . . . 6297 1 789 . 1 1 68 68 ARG HG3 H 1 1.513 0.030 . 2 . . . . . . . . 6297 1 790 . 1 1 68 68 ARG CD C 13 42.181 0.300 . 1 . . . . . . . . 6297 1 791 . 1 1 68 68 ARG HD2 H 1 3.143 0.030 . 1 . . . . . . . . 6297 1 792 . 1 1 68 68 ARG HD3 H 1 3.143 0.030 . 1 . . . . . . . . 6297 1 793 . 1 1 68 68 ARG NE N 15 83.907 0.200 . 1 . . . . . . . . 6297 1 794 . 1 1 68 68 ARG HE H 1 7.547 0.030 . 1 . . . . . . . . 6297 1 795 . 1 1 68 68 ARG C C 13 175.584 0.300 . 1 . . . . . . . . 6297 1 796 . 1 1 69 69 VAL N N 15 124.217 0.200 . 1 . . . . . . . . 6297 1 797 . 1 1 69 69 VAL H H 1 8.580 0.030 . 1 . . . . . . . . 6297 1 798 . 1 1 69 69 VAL CA C 13 60.358 0.300 . 1 . . . . . . . . 6297 1 799 . 1 1 69 69 VAL HA H 1 4.949 0.030 . 1 . . . . . . . . 6297 1 800 . 1 1 69 69 VAL CB C 13 35.373 0.300 . 1 . . . . . . . . 6297 1 801 . 1 1 69 69 VAL HB H 1 1.723 0.030 . 1 . . . . . . . . 6297 1 802 . 1 1 69 69 VAL CG1 C 13 20.753 0.300 . 1 . . . . . . . . 6297 1 803 . 1 1 69 69 VAL HG11 H 1 0.732 0.030 . 1 . . . . . . . . 6297 1 804 . 1 1 69 69 VAL HG12 H 1 0.732 0.030 . 1 . . . . . . . . 6297 1 805 . 1 1 69 69 VAL HG13 H 1 0.732 0.030 . 1 . . . . . . . . 6297 1 806 . 1 1 69 69 VAL CG2 C 13 22.456 0.300 . 1 . . . . . . . . 6297 1 807 . 1 1 69 69 VAL HG21 H 1 0.695 0.030 . 1 . . . . . . . . 6297 1 808 . 1 1 69 69 VAL HG22 H 1 0.695 0.030 . 1 . . . . . . . . 6297 1 809 . 1 1 69 69 VAL HG23 H 1 0.695 0.030 . 1 . . . . . . . . 6297 1 810 . 1 1 69 69 VAL C C 13 173.978 0.300 . 1 . . . . . . . . 6297 1 811 . 1 1 70 70 LYS N N 15 127.202 0.200 . 1 . . . . . . . . 6297 1 812 . 1 1 70 70 LYS H H 1 8.796 0.030 . 1 . . . . . . . . 6297 1 813 . 1 1 70 70 LYS CA C 13 54.915 0.300 . 1 . . . . . . . . 6297 1 814 . 1 1 70 70 LYS HA H 1 5.027 0.030 . 1 . . . . . . . . 6297 1 815 . 1 1 70 70 LYS CB C 13 35.488 0.300 . 1 . . . . . . . . 6297 1 816 . 1 1 70 70 LYS HB2 H 1 1.542 0.030 . 2 . . . . . . . . 6297 1 817 . 1 1 70 70 LYS HB3 H 1 1.839 0.030 . 2 . . . . . . . . 6297 1 818 . 1 1 70 70 LYS CG C 13 25.316 0.300 . 1 . . . . . . . . 6297 1 819 . 1 1 70 70 LYS HG2 H 1 1.091 0.030 . 2 . . . . . . . . 6297 1 820 . 1 1 70 70 LYS HG3 H 1 1.259 0.030 . 2 . . . . . . . . 6297 1 821 . 1 1 70 70 LYS CD C 13 29.608 0.300 . 1 . . . . . . . . 6297 1 822 . 1 1 70 70 LYS HD2 H 1 1.525 0.030 . 2 . . . . . . . . 6297 1 823 . 1 1 70 70 LYS HD3 H 1 1.561 0.030 . 2 . . . . . . . . 6297 1 824 . 1 1 70 70 LYS CE C 13 42.016 0.300 . 1 . . . . . . . . 6297 1 825 . 1 1 70 70 LYS HE2 H 1 2.830 0.030 . 1 . . . . . . . . 6297 1 826 . 1 1 70 70 LYS HE3 H 1 2.830 0.030 . 1 . . . . . . . . 6297 1 827 . 1 1 70 70 LYS C C 13 175.883 0.300 . 1 . . . . . . . . 6297 1 828 . 1 1 71 71 CYS N N 15 125.579 0.200 . 1 . . . . . . . . 6297 1 829 . 1 1 71 71 CYS H H 1 8.530 0.030 . 1 . . . . . . . . 6297 1 830 . 1 1 71 71 CYS CA C 13 56.894 0.300 . 1 . . . . . . . . 6297 1 831 . 1 1 71 71 CYS HA H 1 4.398 0.030 . 1 . . . . . . . . 6297 1 832 . 1 1 71 71 CYS CB C 13 27.903 0.300 . 1 . . . . . . . . 6297 1 833 . 1 1 71 71 CYS HB2 H 1 2.318 0.030 . 2 . . . . . . . . 6297 1 834 . 1 1 71 71 CYS HB3 H 1 2.699 0.030 . 2 . . . . . . . . 6297 1 835 . 1 1 71 71 CYS HG H 1 0.789 0.030 . 1 . . . . . . . . 6297 1 836 . 1 1 71 71 CYS C C 13 172.068 0.300 . 1 . . . . . . . . 6297 1 837 . 1 1 72 72 PRO CA C 13 61.625 0.300 . 1 . . . . . . . . 6297 1 838 . 1 1 72 72 PRO HA H 1 4.780 0.030 . 1 . . . . . . . . 6297 1 839 . 1 1 72 72 PRO CB C 13 31.005 0.300 . 1 . . . . . . . . 6297 1 840 . 1 1 72 72 PRO HB2 H 1 2.513 0.030 . 2 . . . . . . . . 6297 1 841 . 1 1 72 72 PRO HB3 H 1 1.806 0.030 . 2 . . . . . . . . 6297 1 842 . 1 1 72 72 PRO CG C 13 27.484 0.300 . 1 . . . . . . . . 6297 1 843 . 1 1 72 72 PRO HG2 H 1 2.065 0.030 . 2 . . . . . . . . 6297 1 844 . 1 1 72 72 PRO HG3 H 1 1.961 0.030 . 2 . . . . . . . . 6297 1 845 . 1 1 72 72 PRO CD C 13 51.969 0.300 . 1 . . . . . . . . 6297 1 846 . 1 1 72 72 PRO HD2 H 1 4.286 0.030 . 2 . . . . . . . . 6297 1 847 . 1 1 72 72 PRO HD3 H 1 3.464 0.030 . 2 . . . . . . . . 6297 1 848 . 1 1 73 73 PRO CA C 13 66.178 0.300 . 1 . . . . . . . . 6297 1 849 . 1 1 73 73 PRO HA H 1 4.341 0.030 . 1 . . . . . . . . 6297 1 850 . 1 1 73 73 PRO CB C 13 32.590 0.300 . 1 . . . . . . . . 6297 1 851 . 1 1 73 73 PRO HB2 H 1 1.942 0.030 . 2 . . . . . . . . 6297 1 852 . 1 1 73 73 PRO HB3 H 1 2.477 0.030 . 2 . . . . . . . . 6297 1 853 . 1 1 73 73 PRO CG C 13 27.870 0.300 . 1 . . . . . . . . 6297 1 854 . 1 1 73 73 PRO HG2 H 1 2.223 0.030 . 2 . . . . . . . . 6297 1 855 . 1 1 73 73 PRO HG3 H 1 2.052 0.030 . 2 . . . . . . . . 6297 1 856 . 1 1 73 73 PRO CD C 13 50.137 0.300 . 1 . . . . . . . . 6297 1 857 . 1 1 73 73 PRO HD2 H 1 3.753 0.030 . 2 . . . . . . . . 6297 1 858 . 1 1 73 73 PRO HD3 H 1 3.849 0.030 . 2 . . . . . . . . 6297 1 859 . 1 1 73 73 PRO C C 13 177.870 0.300 . 1 . . . . . . . . 6297 1 860 . 1 1 74 74 THR N N 15 100.249 0.200 . 1 . . . . . . . . 6297 1 861 . 1 1 74 74 THR H H 1 7.186 0.030 . 1 . . . . . . . . 6297 1 862 . 1 1 74 74 THR CA C 13 59.639 0.300 . 1 . . . . . . . . 6297 1 863 . 1 1 74 74 THR HA H 1 3.396 0.030 . 1 . . . . . . . . 6297 1 864 . 1 1 74 74 THR CB C 13 67.574 0.300 . 1 . . . . . . . . 6297 1 865 . 1 1 74 74 THR HB H 1 4.051 0.030 . 1 . . . . . . . . 6297 1 866 . 1 1 74 74 THR HG1 H 1 5.453 0.030 . 1 . . . . . . . . 6297 1 867 . 1 1 74 74 THR CG2 C 13 21.638 0.300 . 1 . . . . . . . . 6297 1 868 . 1 1 74 74 THR HG21 H 1 0.884 0.030 . 1 . . . . . . . . 6297 1 869 . 1 1 74 74 THR HG22 H 1 0.884 0.030 . 1 . . . . . . . . 6297 1 870 . 1 1 74 74 THR HG23 H 1 0.884 0.030 . 1 . . . . . . . . 6297 1 871 . 1 1 74 74 THR C C 13 174.532 0.300 . 1 . . . . . . . . 6297 1 872 . 1 1 75 75 TYR N N 15 124.131 0.200 . 1 . . . . . . . . 6297 1 873 . 1 1 75 75 TYR H H 1 7.513 0.030 . 1 . . . . . . . . 6297 1 874 . 1 1 75 75 TYR CA C 13 57.140 0.300 . 1 . . . . . . . . 6297 1 875 . 1 1 75 75 TYR HA H 1 4.779 0.030 . 1 . . . . . . . . 6297 1 876 . 1 1 75 75 TYR CB C 13 38.233 0.300 . 1 . . . . . . . . 6297 1 877 . 1 1 75 75 TYR HB2 H 1 2.922 0.030 . 2 . . . . . . . . 6297 1 878 . 1 1 75 75 TYR HB3 H 1 3.118 0.030 . 2 . . . . . . . . 6297 1 879 . 1 1 75 75 TYR CD1 C 13 133.338 0.300 . 2 . . . . . . . . 6297 1 880 . 1 1 75 75 TYR HD1 H 1 7.468 0.030 . 2 . . . . . . . . 6297 1 881 . 1 1 75 75 TYR CD2 C 13 134.341 0.300 . 2 . . . . . . . . 6297 1 882 . 1 1 75 75 TYR HD2 H 1 7.058 0.030 . 2 . . . . . . . . 6297 1 883 . 1 1 75 75 TYR CE1 C 13 118.031 0.300 . 2 . . . . . . . . 6297 1 884 . 1 1 75 75 TYR HE1 H 1 6.859 0.030 . 2 . . . . . . . . 6297 1 885 . 1 1 75 75 TYR CE2 C 13 119.968 0.300 . 2 . . . . . . . . 6297 1 886 . 1 1 75 75 TYR HE2 H 1 7.354 0.030 . 2 . . . . . . . . 6297 1 887 . 1 1 75 75 TYR HH H 1 13.748 0.030 . 1 . . . . . . . . 6297 1 888 . 1 1 76 76 PRO CA C 13 63.963 0.300 . 1 . . . . . . . . 6297 1 889 . 1 1 76 76 PRO HA H 1 4.108 0.030 . 1 . . . . . . . . 6297 1 890 . 1 1 76 76 PRO CB C 13 32.580 0.300 . 1 . . . . . . . . 6297 1 891 . 1 1 76 76 PRO HB2 H 1 0.281 0.030 . 2 . . . . . . . . 6297 1 892 . 1 1 76 76 PRO HB3 H 1 1.971 0.030 . 2 . . . . . . . . 6297 1 893 . 1 1 76 76 PRO CG C 13 25.183 0.300 . 1 . . . . . . . . 6297 1 894 . 1 1 76 76 PRO HG2 H 1 1.190 0.030 . 2 . . . . . . . . 6297 1 895 . 1 1 76 76 PRO HG3 H 1 1.549 0.030 . 2 . . . . . . . . 6297 1 896 . 1 1 76 76 PRO CD C 13 48.245 0.300 . 1 . . . . . . . . 6297 1 897 . 1 1 76 76 PRO HD2 H 1 3.312 0.030 . 2 . . . . . . . . 6297 1 898 . 1 1 76 76 PRO HD3 H 1 3.219 0.030 . 2 . . . . . . . . 6297 1 899 . 1 1 76 76 PRO C C 13 174.562 0.300 . 1 . . . . . . . . 6297 1 900 . 1 1 77 77 ASP N N 15 126.096 0.200 . 1 . . . . . . . . 6297 1 901 . 1 1 77 77 ASP H H 1 9.384 0.030 . 1 . . . . . . . . 6297 1 902 . 1 1 77 77 ASP CA C 13 57.110 0.300 . 1 . . . . . . . . 6297 1 903 . 1 1 77 77 ASP HA H 1 4.710 0.030 . 1 . . . . . . . . 6297 1 904 . 1 1 77 77 ASP CB C 13 40.258 0.300 . 1 . . . . . . . . 6297 1 905 . 1 1 77 77 ASP HB2 H 1 2.917 0.030 . 2 . . . . . . . . 6297 1 906 . 1 1 77 77 ASP HB3 H 1 2.849 0.030 . 2 . . . . . . . . 6297 1 907 . 1 1 77 77 ASP C C 13 175.644 0.300 . 1 . . . . . . . . 6297 1 908 . 1 1 78 78 VAL N N 15 112.991 0.200 . 1 . . . . . . . . 6297 1 909 . 1 1 78 78 VAL H H 1 6.905 0.030 . 1 . . . . . . . . 6297 1 910 . 1 1 78 78 VAL CA C 13 59.267 0.300 . 1 . . . . . . . . 6297 1 911 . 1 1 78 78 VAL HA H 1 4.386 0.030 . 1 . . . . . . . . 6297 1 912 . 1 1 78 78 VAL CB C 13 34.680 0.300 . 1 . . . . . . . . 6297 1 913 . 1 1 78 78 VAL HB H 1 1.951 0.030 . 1 . . . . . . . . 6297 1 914 . 1 1 78 78 VAL CG1 C 13 19.355 0.300 . 2 . . . . . . . . 6297 1 915 . 1 1 78 78 VAL HG11 H 1 0.621 0.030 . 1 . . . . . . . . 6297 1 916 . 1 1 78 78 VAL HG12 H 1 0.621 0.030 . 1 . . . . . . . . 6297 1 917 . 1 1 78 78 VAL HG13 H 1 0.621 0.030 . 1 . . . . . . . . 6297 1 918 . 1 1 78 78 VAL CG2 C 13 21.224 0.300 . 2 . . . . . . . . 6297 1 919 . 1 1 78 78 VAL HG21 H 1 0.849 0.030 . 1 . . . . . . . . 6297 1 920 . 1 1 78 78 VAL HG22 H 1 0.849 0.030 . 1 . . . . . . . . 6297 1 921 . 1 1 78 78 VAL HG23 H 1 0.849 0.030 . 1 . . . . . . . . 6297 1 922 . 1 1 78 78 VAL C C 13 174.338 0.300 . 1 . . . . . . . . 6297 1 923 . 1 1 79 79 VAL N N 15 113.457 0.200 . 1 . . . . . . . . 6297 1 924 . 1 1 79 79 VAL H H 1 7.761 0.030 . 1 . . . . . . . . 6297 1 925 . 1 1 79 79 VAL CA C 13 60.177 0.300 . 1 . . . . . . . . 6297 1 926 . 1 1 79 79 VAL HA H 1 4.219 0.030 . 1 . . . . . . . . 6297 1 927 . 1 1 79 79 VAL CB C 13 30.522 0.300 . 1 . . . . . . . . 6297 1 928 . 1 1 79 79 VAL HB H 1 2.262 0.030 . 1 . . . . . . . . 6297 1 929 . 1 1 79 79 VAL CG1 C 13 17.764 0.300 . 2 . . . . . . . . 6297 1 930 . 1 1 79 79 VAL HG11 H 1 0.962 0.030 . 1 . . . . . . . . 6297 1 931 . 1 1 79 79 VAL HG12 H 1 0.962 0.030 . 1 . . . . . . . . 6297 1 932 . 1 1 79 79 VAL HG13 H 1 0.962 0.030 . 1 . . . . . . . . 6297 1 933 . 1 1 79 79 VAL CG2 C 13 22.420 0.300 . 2 . . . . . . . . 6297 1 934 . 1 1 79 79 VAL HG21 H 1 1.038 0.030 . 1 . . . . . . . . 6297 1 935 . 1 1 79 79 VAL HG22 H 1 1.038 0.030 . 1 . . . . . . . . 6297 1 936 . 1 1 79 79 VAL HG23 H 1 1.038 0.030 . 1 . . . . . . . . 6297 1 937 . 1 1 79 79 VAL C C 13 173.491 0.300 . 1 . . . . . . . . 6297 1 938 . 1 1 80 80 PRO CA C 13 61.699 0.300 . 1 . . . . . . . . 6297 1 939 . 1 1 80 80 PRO HA H 1 4.836 0.030 . 1 . . . . . . . . 6297 1 940 . 1 1 80 80 PRO CB C 13 32.312 0.300 . 1 . . . . . . . . 6297 1 941 . 1 1 80 80 PRO HB2 H 1 1.826 0.030 . 1 . . . . . . . . 6297 1 942 . 1 1 80 80 PRO HB3 H 1 1.826 0.030 . 1 . . . . . . . . 6297 1 943 . 1 1 80 80 PRO CG C 13 25.970 0.300 . 1 . . . . . . . . 6297 1 944 . 1 1 80 80 PRO HG2 H 1 1.929 0.030 . 2 . . . . . . . . 6297 1 945 . 1 1 80 80 PRO HG3 H 1 1.778 0.030 . 2 . . . . . . . . 6297 1 946 . 1 1 80 80 PRO CD C 13 50.329 0.300 . 1 . . . . . . . . 6297 1 947 . 1 1 80 80 PRO HD2 H 1 3.787 0.030 . 2 . . . . . . . . 6297 1 948 . 1 1 80 80 PRO HD3 H 1 4.082 0.030 . 2 . . . . . . . . 6297 1 949 . 1 1 80 80 PRO C C 13 175.015 0.300 . 1 . . . . . . . . 6297 1 950 . 1 1 81 81 GLU N N 15 118.381 0.200 . 1 . . . . . . . . 6297 1 951 . 1 1 81 81 GLU H H 1 8.411 0.030 . 1 . . . . . . . . 6297 1 952 . 1 1 81 81 GLU CA C 13 56.160 0.300 . 1 . . . . . . . . 6297 1 953 . 1 1 81 81 GLU HA H 1 4.398 0.030 . 1 . . . . . . . . 6297 1 954 . 1 1 81 81 GLU CB C 13 30.750 0.300 . 1 . . . . . . . . 6297 1 955 . 1 1 81 81 GLU HB2 H 1 1.985 0.030 . 2 . . . . . . . . 6297 1 956 . 1 1 81 81 GLU HB3 H 1 2.037 0.030 . 2 . . . . . . . . 6297 1 957 . 1 1 81 81 GLU CG C 13 36.158 0.300 . 1 . . . . . . . . 6297 1 958 . 1 1 81 81 GLU HG2 H 1 2.169 0.030 . 2 . . . . . . . . 6297 1 959 . 1 1 81 81 GLU HG3 H 1 2.283 0.030 . 2 . . . . . . . . 6297 1 960 . 1 1 81 81 GLU C C 13 176.258 0.300 . 1 . . . . . . . . 6297 1 961 . 1 1 82 82 ILE N N 15 124.469 0.200 . 1 . . . . . . . . 6297 1 962 . 1 1 82 82 ILE H H 1 8.617 0.030 . 1 . . . . . . . . 6297 1 963 . 1 1 82 82 ILE CA C 13 60.168 0.300 . 1 . . . . . . . . 6297 1 964 . 1 1 82 82 ILE HA H 1 4.823 0.030 . 1 . . . . . . . . 6297 1 965 . 1 1 82 82 ILE CB C 13 42.079 0.300 . 1 . . . . . . . . 6297 1 966 . 1 1 82 82 ILE HB H 1 1.635 0.030 . 1 . . . . . . . . 6297 1 967 . 1 1 82 82 ILE CG1 C 13 27.485 0.300 . 1 . . . . . . . . 6297 1 968 . 1 1 82 82 ILE HG12 H 1 1.506 0.030 . 2 . . . . . . . . 6297 1 969 . 1 1 82 82 ILE HG13 H 1 0.780 0.030 . 2 . . . . . . . . 6297 1 970 . 1 1 82 82 ILE CG2 C 13 18.250 0.300 . 1 . . . . . . . . 6297 1 971 . 1 1 82 82 ILE HG21 H 1 0.733 0.030 . 1 . . . . . . . . 6297 1 972 . 1 1 82 82 ILE HG22 H 1 0.733 0.030 . 1 . . . . . . . . 6297 1 973 . 1 1 82 82 ILE HG23 H 1 0.733 0.030 . 1 . . . . . . . . 6297 1 974 . 1 1 82 82 ILE CD1 C 13 15.523 0.300 . 1 . . . . . . . . 6297 1 975 . 1 1 82 82 ILE HD11 H 1 0.768 0.030 . 1 . . . . . . . . 6297 1 976 . 1 1 82 82 ILE HD12 H 1 0.768 0.030 . 1 . . . . . . . . 6297 1 977 . 1 1 82 82 ILE HD13 H 1 0.768 0.030 . 1 . . . . . . . . 6297 1 978 . 1 1 82 82 ILE C C 13 174.336 0.300 . 1 . . . . . . . . 6297 1 979 . 1 1 83 83 ASP N N 15 124.372 0.200 . 1 . . . . . . . . 6297 1 980 . 1 1 83 83 ASP H H 1 9.043 0.030 . 1 . . . . . . . . 6297 1 981 . 1 1 83 83 ASP CA C 13 52.708 0.300 . 1 . . . . . . . . 6297 1 982 . 1 1 83 83 ASP HA H 1 4.864 0.030 . 1 . . . . . . . . 6297 1 983 . 1 1 83 83 ASP CB C 13 44.994 0.300 . 1 . . . . . . . . 6297 1 984 . 1 1 83 83 ASP HB2 H 1 2.364 0.030 . 2 . . . . . . . . 6297 1 985 . 1 1 83 83 ASP HB3 H 1 2.581 0.030 . 2 . . . . . . . . 6297 1 986 . 1 1 83 83 ASP C C 13 173.787 0.300 . 1 . . . . . . . . 6297 1 987 . 1 1 84 84 LEU N N 15 121.574 0.200 . 1 . . . . . . . . 6297 1 988 . 1 1 84 84 LEU H H 1 8.227 0.030 . 1 . . . . . . . . 6297 1 989 . 1 1 84 84 LEU CA C 13 52.821 0.300 . 1 . . . . . . . . 6297 1 990 . 1 1 84 84 LEU HA H 1 5.484 0.030 . 1 . . . . . . . . 6297 1 991 . 1 1 84 84 LEU CB C 13 44.404 0.300 . 1 . . . . . . . . 6297 1 992 . 1 1 84 84 LEU HB2 H 1 1.586 0.030 . 2 . . . . . . . . 6297 1 993 . 1 1 84 84 LEU HB3 H 1 1.124 0.030 . 2 . . . . . . . . 6297 1 994 . 1 1 84 84 LEU CG C 13 26.953 0.300 . 1 . . . . . . . . 6297 1 995 . 1 1 84 84 LEU HG H 1 1.406 0.030 . 1 . . . . . . . . 6297 1 996 . 1 1 84 84 LEU CD1 C 13 24.075 0.300 . 1 . . . . . . . . 6297 1 997 . 1 1 84 84 LEU HD11 H 1 0.813 0.030 . 1 . . . . . . . . 6297 1 998 . 1 1 84 84 LEU HD12 H 1 0.813 0.030 . 1 . . . . . . . . 6297 1 999 . 1 1 84 84 LEU HD13 H 1 0.813 0.030 . 1 . . . . . . . . 6297 1 1000 . 1 1 84 84 LEU CD2 C 13 26.884 0.300 . 1 . . . . . . . . 6297 1 1001 . 1 1 84 84 LEU HD21 H 1 0.831 0.030 . 1 . . . . . . . . 6297 1 1002 . 1 1 84 84 LEU HD22 H 1 0.831 0.030 . 1 . . . . . . . . 6297 1 1003 . 1 1 84 84 LEU HD23 H 1 0.831 0.030 . 1 . . . . . . . . 6297 1 1004 . 1 1 84 84 LEU C C 13 175.840 0.300 . 1 . . . . . . . . 6297 1 1005 . 1 1 85 85 LYS N N 15 121.065 0.200 . 1 . . . . . . . . 6297 1 1006 . 1 1 85 85 LYS H H 1 9.193 0.030 . 1 . . . . . . . . 6297 1 1007 . 1 1 85 85 LYS CA C 13 53.483 0.300 . 1 . . . . . . . . 6297 1 1008 . 1 1 85 85 LYS HA H 1 4.662 0.030 . 1 . . . . . . . . 6297 1 1009 . 1 1 85 85 LYS CB C 13 36.741 0.300 . 1 . . . . . . . . 6297 1 1010 . 1 1 85 85 LYS HB2 H 1 1.674 0.030 . 2 . . . . . . . . 6297 1 1011 . 1 1 85 85 LYS HB3 H 1 1.638 0.030 . 2 . . . . . . . . 6297 1 1012 . 1 1 85 85 LYS CG C 13 24.381 0.300 . 1 . . . . . . . . 6297 1 1013 . 1 1 85 85 LYS HG2 H 1 1.195 0.030 . 1 . . . . . . . . 6297 1 1014 . 1 1 85 85 LYS HG3 H 1 1.195 0.030 . 1 . . . . . . . . 6297 1 1015 . 1 1 85 85 LYS CD C 13 28.552 0.300 . 1 . . . . . . . . 6297 1 1016 . 1 1 85 85 LYS HD2 H 1 1.554 0.030 . 2 . . . . . . . . 6297 1 1017 . 1 1 85 85 LYS HD3 H 1 1.626 0.030 . 2 . . . . . . . . 6297 1 1018 . 1 1 85 85 LYS CE C 13 42.016 0.300 . 1 . . . . . . . . 6297 1 1019 . 1 1 85 85 LYS HE2 H 1 2.771 0.030 . 2 . . . . . . . . 6297 1 1020 . 1 1 85 85 LYS HE3 H 1 2.907 0.030 . 2 . . . . . . . . 6297 1 1021 . 1 1 85 85 LYS C C 13 174.509 0.300 . 1 . . . . . . . . 6297 1 1022 . 1 1 86 86 ASN N N 15 115.697 0.200 . 1 . . . . . . . . 6297 1 1023 . 1 1 86 86 ASN H H 1 8.835 0.030 . 1 . . . . . . . . 6297 1 1024 . 1 1 86 86 ASN CA C 13 53.365 0.300 . 1 . . . . . . . . 6297 1 1025 . 1 1 86 86 ASN HA H 1 4.302 0.030 . 1 . . . . . . . . 6297 1 1026 . 1 1 86 86 ASN CB C 13 36.770 0.300 . 1 . . . . . . . . 6297 1 1027 . 1 1 86 86 ASN HB2 H 1 2.604 0.030 . 2 . . . . . . . . 6297 1 1028 . 1 1 86 86 ASN HB3 H 1 2.839 0.030 . 2 . . . . . . . . 6297 1 1029 . 1 1 86 86 ASN ND2 N 15 113.440 0.200 . 1 . . . . . . . . 6297 1 1030 . 1 1 86 86 ASN HD21 H 1 6.744 0.030 . 2 . . . . . . . . 6297 1 1031 . 1 1 86 86 ASN HD22 H 1 7.702 0.030 . 2 . . . . . . . . 6297 1 1032 . 1 1 86 86 ASN C C 13 174.563 0.300 . 1 . . . . . . . . 6297 1 1033 . 1 1 87 87 ALA N N 15 118.591 0.200 . 1 . . . . . . . . 6297 1 1034 . 1 1 87 87 ALA H H 1 8.289 0.030 . 1 . . . . . . . . 6297 1 1035 . 1 1 87 87 ALA CA C 13 52.666 0.300 . 1 . . . . . . . . 6297 1 1036 . 1 1 87 87 ALA HA H 1 4.685 0.030 . 1 . . . . . . . . 6297 1 1037 . 1 1 87 87 ALA CB C 13 19.931 0.300 . 1 . . . . . . . . 6297 1 1038 . 1 1 87 87 ALA HB1 H 1 1.324 0.030 . 1 . . . . . . . . 6297 1 1039 . 1 1 87 87 ALA HB2 H 1 1.324 0.030 . 1 . . . . . . . . 6297 1 1040 . 1 1 87 87 ALA HB3 H 1 1.324 0.030 . 1 . . . . . . . . 6297 1 1041 . 1 1 87 87 ALA C C 13 177.991 0.300 . 1 . . . . . . . . 6297 1 1042 . 1 1 88 88 LYS N N 15 123.738 0.200 . 1 . . . . . . . . 6297 1 1043 . 1 1 88 88 LYS H H 1 8.835 0.030 . 1 . . . . . . . . 6297 1 1044 . 1 1 88 88 LYS CA C 13 55.393 0.300 . 1 . . . . . . . . 6297 1 1045 . 1 1 88 88 LYS HA H 1 4.683 0.030 . 1 . . . . . . . . 6297 1 1046 . 1 1 88 88 LYS CB C 13 35.519 0.300 . 1 . . . . . . . . 6297 1 1047 . 1 1 88 88 LYS HB2 H 1 1.702 0.030 . 2 . . . . . . . . 6297 1 1048 . 1 1 88 88 LYS HB3 H 1 1.811 0.030 . 2 . . . . . . . . 6297 1 1049 . 1 1 88 88 LYS CG C 13 24.668 0.300 . 1 . . . . . . . . 6297 1 1050 . 1 1 88 88 LYS HG2 H 1 1.379 0.030 . 2 . . . . . . . . 6297 1 1051 . 1 1 88 88 LYS HG3 H 1 1.454 0.030 . 2 . . . . . . . . 6297 1 1052 . 1 1 88 88 LYS CD C 13 29.479 0.300 . 1 . . . . . . . . 6297 1 1053 . 1 1 88 88 LYS HD2 H 1 1.583 0.030 . 1 . . . . . . . . 6297 1 1054 . 1 1 88 88 LYS HD3 H 1 1.583 0.030 . 1 . . . . . . . . 6297 1 1055 . 1 1 88 88 LYS CE C 13 42.193 0.300 . 1 . . . . . . . . 6297 1 1056 . 1 1 88 88 LYS HE2 H 1 2.916 0.030 . 1 . . . . . . . . 6297 1 1057 . 1 1 88 88 LYS HE3 H 1 2.916 0.030 . 1 . . . . . . . . 6297 1 1058 . 1 1 88 88 LYS C C 13 176.385 0.300 . 1 . . . . . . . . 6297 1 1059 . 1 1 89 89 GLY N N 15 110.447 0.200 . 1 . . . . . . . . 6297 1 1060 . 1 1 89 89 GLY H H 1 8.714 0.030 . 1 . . . . . . . . 6297 1 1061 . 1 1 89 89 GLY CA C 13 46.255 0.300 . 1 . . . . . . . . 6297 1 1062 . 1 1 89 89 GLY HA2 H 1 3.793 0.030 . 2 . . . . . . . . 6297 1 1063 . 1 1 89 89 GLY HA3 H 1 4.486 0.030 . 2 . . . . . . . . 6297 1 1064 . 1 1 89 89 GLY C C 13 173.302 0.300 . 1 . . . . . . . . 6297 1 1065 . 1 1 90 90 LEU N N 15 117.381 0.200 . 1 . . . . . . . . 6297 1 1066 . 1 1 90 90 LEU H H 1 7.184 0.030 . 1 . . . . . . . . 6297 1 1067 . 1 1 90 90 LEU CA C 13 52.735 0.300 . 1 . . . . . . . . 6297 1 1068 . 1 1 90 90 LEU HA H 1 4.848 0.030 . 1 . . . . . . . . 6297 1 1069 . 1 1 90 90 LEU CB C 13 46.428 0.300 . 1 . . . . . . . . 6297 1 1070 . 1 1 90 90 LEU HB2 H 1 1.390 0.030 . 2 . . . . . . . . 6297 1 1071 . 1 1 90 90 LEU HB3 H 1 1.420 0.030 . 2 . . . . . . . . 6297 1 1072 . 1 1 90 90 LEU CG C 13 26.241 0.300 . 1 . . . . . . . . 6297 1 1073 . 1 1 90 90 LEU HG H 1 1.747 0.030 . 1 . . . . . . . . 6297 1 1074 . 1 1 90 90 LEU CD1 C 13 25.792 0.300 . 1 . . . . . . . . 6297 1 1075 . 1 1 90 90 LEU HD11 H 1 0.735 0.030 . 1 . . . . . . . . 6297 1 1076 . 1 1 90 90 LEU HD12 H 1 0.735 0.030 . 1 . . . . . . . . 6297 1 1077 . 1 1 90 90 LEU HD13 H 1 0.735 0.030 . 1 . . . . . . . . 6297 1 1078 . 1 1 90 90 LEU CD2 C 13 23.756 0.300 . 1 . . . . . . . . 6297 1 1079 . 1 1 90 90 LEU HD21 H 1 0.793 0.030 . 1 . . . . . . . . 6297 1 1080 . 1 1 90 90 LEU HD22 H 1 0.793 0.030 . 1 . . . . . . . . 6297 1 1081 . 1 1 90 90 LEU HD23 H 1 0.793 0.030 . 1 . . . . . . . . 6297 1 1082 . 1 1 90 90 LEU C C 13 176.412 0.300 . 1 . . . . . . . . 6297 1 1083 . 1 1 91 91 SER N N 15 119.471 0.200 . 1 . . . . . . . . 6297 1 1084 . 1 1 91 91 SER H H 1 9.027 0.030 . 1 . . . . . . . . 6297 1 1085 . 1 1 91 91 SER CA C 13 57.090 0.300 . 1 . . . . . . . . 6297 1 1086 . 1 1 91 91 SER HA H 1 4.510 0.030 . 1 . . . . . . . . 6297 1 1087 . 1 1 91 91 SER CB C 13 64.993 0.300 . 1 . . . . . . . . 6297 1 1088 . 1 1 91 91 SER HB2 H 1 4.471 0.030 . 2 . . . . . . . . 6297 1 1089 . 1 1 91 91 SER HB3 H 1 4.159 0.030 . 2 . . . . . . . . 6297 1 1090 . 1 1 91 91 SER C C 13 174.808 0.300 . 1 . . . . . . . . 6297 1 1091 . 1 1 92 92 ASN CA C 13 56.641 0.300 . 1 . . . . . . . . 6297 1 1092 . 1 1 92 92 ASN HA H 1 4.339 0.030 . 1 . . . . . . . . 6297 1 1093 . 1 1 92 92 ASN CB C 13 38.068 0.300 . 1 . . . . . . . . 6297 1 1094 . 1 1 92 92 ASN HB2 H 1 2.805 0.030 . 2 . . . . . . . . 6297 1 1095 . 1 1 92 92 ASN HB3 H 1 2.835 0.030 . 2 . . . . . . . . 6297 1 1096 . 1 1 92 92 ASN ND2 N 15 113.123 0.200 . 1 . . . . . . . . 6297 1 1097 . 1 1 92 92 ASN HD21 H 1 7.049 0.030 . 2 . . . . . . . . 6297 1 1098 . 1 1 92 92 ASN HD22 H 1 7.758 0.030 . 2 . . . . . . . . 6297 1 1099 . 1 1 92 92 ASN C C 13 177.680 0.300 . 1 . . . . . . . . 6297 1 1100 . 1 1 93 93 GLU N N 15 118.875 0.200 . 1 . . . . . . . . 6297 1 1101 . 1 1 93 93 GLU H H 1 8.862 0.030 . 1 . . . . . . . . 6297 1 1102 . 1 1 93 93 GLU CA C 13 60.344 0.300 . 1 . . . . . . . . 6297 1 1103 . 1 1 93 93 GLU HA H 1 4.104 0.030 . 1 . . . . . . . . 6297 1 1104 . 1 1 93 93 GLU CB C 13 28.986 0.300 . 1 . . . . . . . . 6297 1 1105 . 1 1 93 93 GLU HB2 H 1 2.020 0.030 . 2 . . . . . . . . 6297 1 1106 . 1 1 93 93 GLU HB3 H 1 2.157 0.030 . 2 . . . . . . . . 6297 1 1107 . 1 1 93 93 GLU CG C 13 36.930 0.300 . 1 . . . . . . . . 6297 1 1108 . 1 1 93 93 GLU HG2 H 1 2.354 0.030 . 2 . . . . . . . . 6297 1 1109 . 1 1 93 93 GLU HG3 H 1 2.464 0.030 . 2 . . . . . . . . 6297 1 1110 . 1 1 93 93 GLU C C 13 179.486 0.300 . 1 . . . . . . . . 6297 1 1111 . 1 1 94 94 SER N N 15 118.532 0.200 . 1 . . . . . . . . 6297 1 1112 . 1 1 94 94 SER H H 1 8.169 0.030 . 1 . . . . . . . . 6297 1 1113 . 1 1 94 94 SER CA C 13 63.038 0.300 . 1 . . . . . . . . 6297 1 1114 . 1 1 94 94 SER HA H 1 4.105 0.030 . 1 . . . . . . . . 6297 1 1115 . 1 1 94 94 SER CB C 13 62.845 0.300 . 1 . . . . . . . . 6297 1 1116 . 1 1 94 94 SER HB2 H 1 3.832 0.030 . 2 . . . . . . . . 6297 1 1117 . 1 1 94 94 SER HB3 H 1 4.344 0.030 . 2 . . . . . . . . 6297 1 1118 . 1 1 94 94 SER C C 13 175.618 0.300 . 1 . . . . . . . . 6297 1 1119 . 1 1 95 95 VAL N N 15 122.503 0.200 . 1 . . . . . . . . 6297 1 1120 . 1 1 95 95 VAL H H 1 7.958 0.030 . 1 . . . . . . . . 6297 1 1121 . 1 1 95 95 VAL CA C 13 67.500 0.300 . 1 . . . . . . . . 6297 1 1122 . 1 1 95 95 VAL HA H 1 3.268 0.030 . 1 . . . . . . . . 6297 1 1123 . 1 1 95 95 VAL CB C 13 31.433 0.300 . 1 . . . . . . . . 6297 1 1124 . 1 1 95 95 VAL HB H 1 2.129 0.030 . 1 . . . . . . . . 6297 1 1125 . 1 1 95 95 VAL CG1 C 13 22.026 0.300 . 2 . . . . . . . . 6297 1 1126 . 1 1 95 95 VAL HG11 H 1 0.878 0.030 . 1 . . . . . . . . 6297 1 1127 . 1 1 95 95 VAL HG12 H 1 0.878 0.030 . 1 . . . . . . . . 6297 1 1128 . 1 1 95 95 VAL HG13 H 1 0.878 0.030 . 1 . . . . . . . . 6297 1 1129 . 1 1 95 95 VAL CG2 C 13 24.322 0.300 . 2 . . . . . . . . 6297 1 1130 . 1 1 95 95 VAL HG21 H 1 0.872 0.030 . 1 . . . . . . . . 6297 1 1131 . 1 1 95 95 VAL HG22 H 1 0.872 0.030 . 1 . . . . . . . . 6297 1 1132 . 1 1 95 95 VAL HG23 H 1 0.872 0.030 . 1 . . . . . . . . 6297 1 1133 . 1 1 95 95 VAL C C 13 177.188 0.300 . 1 . . . . . . . . 6297 1 1134 . 1 1 96 96 ASN N N 15 117.897 0.200 . 1 . . . . . . . . 6297 1 1135 . 1 1 96 96 ASN H H 1 8.111 0.030 . 1 . . . . . . . . 6297 1 1136 . 1 1 96 96 ASN CA C 13 56.134 0.300 . 1 . . . . . . . . 6297 1 1137 . 1 1 96 96 ASN HA H 1 4.408 0.030 . 1 . . . . . . . . 6297 1 1138 . 1 1 96 96 ASN CB C 13 37.914 0.300 . 1 . . . . . . . . 6297 1 1139 . 1 1 96 96 ASN HB2 H 1 2.864 0.030 . 2 . . . . . . . . 6297 1 1140 . 1 1 96 96 ASN HB3 H 1 2.805 0.030 . 2 . . . . . . . . 6297 1 1141 . 1 1 96 96 ASN ND2 N 15 111.972 0.200 . 1 . . . . . . . . 6297 1 1142 . 1 1 96 96 ASN HD21 H 1 6.856 0.030 . 2 . . . . . . . . 6297 1 1143 . 1 1 96 96 ASN HD22 H 1 7.587 0.030 . 2 . . . . . . . . 6297 1 1144 . 1 1 96 96 ASN C C 13 178.406 0.300 . 1 . . . . . . . . 6297 1 1145 . 1 1 97 97 LEU N N 15 123.192 0.200 . 1 . . . . . . . . 6297 1 1146 . 1 1 97 97 LEU H H 1 8.018 0.030 . 1 . . . . . . . . 6297 1 1147 . 1 1 97 97 LEU CA C 13 57.973 0.300 . 1 . . . . . . . . 6297 1 1148 . 1 1 97 97 LEU HA H 1 4.094 0.030 . 1 . . . . . . . . 6297 1 1149 . 1 1 97 97 LEU CB C 13 41.987 0.300 . 1 . . . . . . . . 6297 1 1150 . 1 1 97 97 LEU HB2 H 1 1.783 0.030 . 2 . . . . . . . . 6297 1 1151 . 1 1 97 97 LEU HB3 H 1 1.861 0.030 . 2 . . . . . . . . 6297 1 1152 . 1 1 97 97 LEU CG C 13 26.756 0.300 . 1 . . . . . . . . 6297 1 1153 . 1 1 97 97 LEU HG H 1 1.454 0.030 . 1 . . . . . . . . 6297 1 1154 . 1 1 97 97 LEU CD1 C 13 24.963 0.300 . 2 . . . . . . . . 6297 1 1155 . 1 1 97 97 LEU HD11 H 1 1.062 0.030 . 1 . . . . . . . . 6297 1 1156 . 1 1 97 97 LEU HD12 H 1 1.062 0.030 . 1 . . . . . . . . 6297 1 1157 . 1 1 97 97 LEU HD13 H 1 1.062 0.030 . 1 . . . . . . . . 6297 1 1158 . 1 1 97 97 LEU CD2 C 13 24.048 0.300 . 2 . . . . . . . . 6297 1 1159 . 1 1 97 97 LEU HD21 H 1 0.981 0.030 . 1 . . . . . . . . 6297 1 1160 . 1 1 97 97 LEU HD22 H 1 0.981 0.030 . 1 . . . . . . . . 6297 1 1161 . 1 1 97 97 LEU HD23 H 1 0.981 0.030 . 1 . . . . . . . . 6297 1 1162 . 1 1 97 97 LEU C C 13 178.660 0.300 . 1 . . . . . . . . 6297 1 1163 . 1 1 98 98 LEU N N 15 121.067 0.200 . 1 . . . . . . . . 6297 1 1164 . 1 1 98 98 LEU H H 1 7.923 0.030 . 1 . . . . . . . . 6297 1 1165 . 1 1 98 98 LEU CA C 13 57.512 0.300 . 1 . . . . . . . . 6297 1 1166 . 1 1 98 98 LEU HA H 1 3.622 0.030 . 1 . . . . . . . . 6297 1 1167 . 1 1 98 98 LEU CB C 13 39.716 0.300 . 1 . . . . . . . . 6297 1 1168 . 1 1 98 98 LEU HB2 H 1 0.386 0.030 . 2 . . . . . . . . 6297 1 1169 . 1 1 98 98 LEU HB3 H 1 1.551 0.030 . 2 . . . . . . . . 6297 1 1170 . 1 1 98 98 LEU CG C 13 26.457 0.300 . 1 . . . . . . . . 6297 1 1171 . 1 1 98 98 LEU HG H 1 1.241 0.030 . 1 . . . . . . . . 6297 1 1172 . 1 1 98 98 LEU CD1 C 13 21.932 0.300 . 1 . . . . . . . . 6297 1 1173 . 1 1 98 98 LEU HD11 H 1 0.595 0.030 . 1 . . . . . . . . 6297 1 1174 . 1 1 98 98 LEU HD12 H 1 0.595 0.030 . 1 . . . . . . . . 6297 1 1175 . 1 1 98 98 LEU HD13 H 1 0.595 0.030 . 1 . . . . . . . . 6297 1 1176 . 1 1 98 98 LEU CD2 C 13 25.370 0.300 . 1 . . . . . . . . 6297 1 1177 . 1 1 98 98 LEU HD21 H 1 0.537 0.030 . 1 . . . . . . . . 6297 1 1178 . 1 1 98 98 LEU HD22 H 1 0.537 0.030 . 1 . . . . . . . . 6297 1 1179 . 1 1 98 98 LEU HD23 H 1 0.537 0.030 . 1 . . . . . . . . 6297 1 1180 . 1 1 98 98 LEU C C 13 178.134 0.300 . 1 . . . . . . . . 6297 1 1181 . 1 1 99 99 LYS N N 15 119.286 0.200 . 1 . . . . . . . . 6297 1 1182 . 1 1 99 99 LYS H H 1 8.487 0.030 . 1 . . . . . . . . 6297 1 1183 . 1 1 99 99 LYS CA C 13 61.146 0.300 . 1 . . . . . . . . 6297 1 1184 . 1 1 99 99 LYS HA H 1 3.606 0.030 . 1 . . . . . . . . 6297 1 1185 . 1 1 99 99 LYS CB C 13 32.407 0.300 . 1 . . . . . . . . 6297 1 1186 . 1 1 99 99 LYS HB2 H 1 1.829 0.030 . 2 . . . . . . . . 6297 1 1187 . 1 1 99 99 LYS HB3 H 1 2.083 0.030 . 2 . . . . . . . . 6297 1 1188 . 1 1 99 99 LYS CG C 13 25.706 0.300 . 1 . . . . . . . . 6297 1 1189 . 1 1 99 99 LYS HG2 H 1 1.287 0.030 . 2 . . . . . . . . 6297 1 1190 . 1 1 99 99 LYS HG3 H 1 1.435 0.030 . 2 . . . . . . . . 6297 1 1191 . 1 1 99 99 LYS CD C 13 29.791 0.300 . 1 . . . . . . . . 6297 1 1192 . 1 1 99 99 LYS HD2 H 1 1.752 0.030 . 2 . . . . . . . . 6297 1 1193 . 1 1 99 99 LYS HD3 H 1 1.808 0.030 . 2 . . . . . . . . 6297 1 1194 . 1 1 99 99 LYS CE C 13 42.314 0.300 . 1 . . . . . . . . 6297 1 1195 . 1 1 99 99 LYS HE2 H 1 3.112 0.030 . 1 . . . . . . . . 6297 1 1196 . 1 1 99 99 LYS HE3 H 1 3.112 0.030 . 1 . . . . . . . . 6297 1 1197 . 1 1 99 99 LYS C C 13 178.059 0.300 . 1 . . . . . . . . 6297 1 1198 . 1 1 100 100 SER N N 15 113.767 0.200 . 1 . . . . . . . . 6297 1 1199 . 1 1 100 100 SER H H 1 7.799 0.030 . 1 . . . . . . . . 6297 1 1200 . 1 1 100 100 SER CA C 13 61.822 0.300 . 1 . . . . . . . . 6297 1 1201 . 1 1 100 100 SER HA H 1 4.358 0.030 . 1 . . . . . . . . 6297 1 1202 . 1 1 100 100 SER CB C 13 62.926 0.300 . 1 . . . . . . . . 6297 1 1203 . 1 1 100 100 SER HB2 H 1 4.080 0.030 . 1 . . . . . . . . 6297 1 1204 . 1 1 100 100 SER HB3 H 1 4.080 0.030 . 1 . . . . . . . . 6297 1 1205 . 1 1 101 101 HIS N N 15 122.043 0.200 . 1 . . . . . . . . 6297 1 1206 . 1 1 101 101 HIS H H 1 8.377 0.030 . 1 . . . . . . . . 6297 1 1207 . 1 1 101 101 HIS CA C 13 58.569 0.300 . 1 . . . . . . . . 6297 1 1208 . 1 1 101 101 HIS HA H 1 4.460 0.030 . 1 . . . . . . . . 6297 1 1209 . 1 1 101 101 HIS CB C 13 30.700 0.300 . 1 . . . . . . . . 6297 1 1210 . 1 1 101 101 HIS HB2 H 1 3.143 0.030 . 2 . . . . . . . . 6297 1 1211 . 1 1 101 101 HIS HB3 H 1 3.436 0.030 . 2 . . . . . . . . 6297 1 1212 . 1 1 101 101 HIS CD2 C 13 117.954 0.300 . 1 . . . . . . . . 6297 1 1213 . 1 1 101 101 HIS HD2 H 1 6.823 0.030 . 1 . . . . . . . . 6297 1 1214 . 1 1 101 101 HIS CE1 C 13 138.144 0.300 . 1 . . . . . . . . 6297 1 1215 . 1 1 101 101 HIS HE1 H 1 8.068 0.030 . 1 . . . . . . . . 6297 1 1216 . 1 1 101 101 HIS C C 13 179.135 0.300 . 1 . . . . . . . . 6297 1 1217 . 1 1 102 102 LEU N N 15 119.539 0.200 . 1 . . . . . . . . 6297 1 1218 . 1 1 102 102 LEU H H 1 8.672 0.030 . 1 . . . . . . . . 6297 1 1219 . 1 1 102 102 LEU CA C 13 57.634 0.300 . 1 . . . . . . . . 6297 1 1220 . 1 1 102 102 LEU HA H 1 3.909 0.030 . 1 . . . . . . . . 6297 1 1221 . 1 1 102 102 LEU CB C 13 41.998 0.300 . 1 . . . . . . . . 6297 1 1222 . 1 1 102 102 LEU HB2 H 1 1.312 0.030 . 2 . . . . . . . . 6297 1 1223 . 1 1 102 102 LEU HB3 H 1 2.141 0.030 . 2 . . . . . . . . 6297 1 1224 . 1 1 102 102 LEU CG C 13 26.200 0.300 . 1 . . . . . . . . 6297 1 1225 . 1 1 102 102 LEU HG H 1 2.092 0.030 . 1 . . . . . . . . 6297 1 1226 . 1 1 102 102 LEU CD1 C 13 27.087 0.300 . 1 . . . . . . . . 6297 1 1227 . 1 1 102 102 LEU HD11 H 1 0.728 0.030 . 1 . . . . . . . . 6297 1 1228 . 1 1 102 102 LEU HD12 H 1 0.728 0.030 . 1 . . . . . . . . 6297 1 1229 . 1 1 102 102 LEU HD13 H 1 0.728 0.030 . 1 . . . . . . . . 6297 1 1230 . 1 1 102 102 LEU CD2 C 13 23.271 0.300 . 1 . . . . . . . . 6297 1 1231 . 1 1 102 102 LEU HD21 H 1 0.938 0.030 . 1 . . . . . . . . 6297 1 1232 . 1 1 102 102 LEU HD22 H 1 0.938 0.030 . 1 . . . . . . . . 6297 1 1233 . 1 1 102 102 LEU HD23 H 1 0.938 0.030 . 1 . . . . . . . . 6297 1 1234 . 1 1 102 102 LEU C C 13 178.357 0.300 . 1 . . . . . . . . 6297 1 1235 . 1 1 103 103 GLU N N 15 118.768 0.200 . 1 . . . . . . . . 6297 1 1236 . 1 1 103 103 GLU H H 1 8.330 0.030 . 1 . . . . . . . . 6297 1 1237 . 1 1 103 103 GLU CA C 13 60.077 0.300 . 1 . . . . . . . . 6297 1 1238 . 1 1 103 103 GLU HA H 1 3.904 0.030 . 1 . . . . . . . . 6297 1 1239 . 1 1 103 103 GLU CB C 13 29.588 0.300 . 1 . . . . . . . . 6297 1 1240 . 1 1 103 103 GLU HB2 H 1 2.076 0.030 . 2 . . . . . . . . 6297 1 1241 . 1 1 103 103 GLU HB3 H 1 2.292 0.030 . 2 . . . . . . . . 6297 1 1242 . 1 1 103 103 GLU CG C 13 37.269 0.300 . 1 . . . . . . . . 6297 1 1243 . 1 1 103 103 GLU HG2 H 1 2.232 0.030 . 2 . . . . . . . . 6297 1 1244 . 1 1 103 103 GLU HG3 H 1 2.593 0.030 . 2 . . . . . . . . 6297 1 1245 . 1 1 103 103 GLU C C 13 179.961 0.300 . 1 . . . . . . . . 6297 1 1246 . 1 1 104 104 GLU N N 15 119.360 0.200 . 1 . . . . . . . . 6297 1 1247 . 1 1 104 104 GLU H H 1 7.768 0.030 . 1 . . . . . . . . 6297 1 1248 . 1 1 104 104 GLU CA C 13 59.120 0.300 . 1 . . . . . . . . 6297 1 1249 . 1 1 104 104 GLU HA H 1 4.093 0.030 . 1 . . . . . . . . 6297 1 1250 . 1 1 104 104 GLU CB C 13 29.468 0.300 . 1 . . . . . . . . 6297 1 1251 . 1 1 104 104 GLU HB2 H 1 2.111 0.030 . 2 . . . . . . . . 6297 1 1252 . 1 1 104 104 GLU HB3 H 1 2.148 0.030 . 2 . . . . . . . . 6297 1 1253 . 1 1 104 104 GLU CG C 13 36.074 0.300 . 1 . . . . . . . . 6297 1 1254 . 1 1 104 104 GLU HG2 H 1 2.412 0.030 . 2 . . . . . . . . 6297 1 1255 . 1 1 104 104 GLU HG3 H 1 2.360 0.030 . 2 . . . . . . . . 6297 1 1256 . 1 1 104 104 GLU C C 13 179.009 0.300 . 1 . . . . . . . . 6297 1 1257 . 1 1 105 105 LEU N N 15 122.830 0.200 . 1 . . . . . . . . 6297 1 1258 . 1 1 105 105 LEU H H 1 8.180 0.030 . 1 . . . . . . . . 6297 1 1259 . 1 1 105 105 LEU CA C 13 57.891 0.300 . 1 . . . . . . . . 6297 1 1260 . 1 1 105 105 LEU HA H 1 4.042 0.030 . 1 . . . . . . . . 6297 1 1261 . 1 1 105 105 LEU CB C 13 42.132 0.300 . 1 . . . . . . . . 6297 1 1262 . 1 1 105 105 LEU HB2 H 1 1.419 0.030 . 2 . . . . . . . . 6297 1 1263 . 1 1 105 105 LEU HB3 H 1 1.686 0.030 . 2 . . . . . . . . 6297 1 1264 . 1 1 105 105 LEU CG C 13 26.981 0.300 . 1 . . . . . . . . 6297 1 1265 . 1 1 105 105 LEU HG H 1 1.405 0.030 . 1 . . . . . . . . 6297 1 1266 . 1 1 105 105 LEU CD1 C 13 23.873 0.300 . 1 . . . . . . . . 6297 1 1267 . 1 1 105 105 LEU HD11 H 1 0.775 0.030 . 1 . . . . . . . . 6297 1 1268 . 1 1 105 105 LEU HD12 H 1 0.775 0.030 . 1 . . . . . . . . 6297 1 1269 . 1 1 105 105 LEU HD13 H 1 0.775 0.030 . 1 . . . . . . . . 6297 1 1270 . 1 1 105 105 LEU CD2 C 13 25.363 0.300 . 1 . . . . . . . . 6297 1 1271 . 1 1 105 105 LEU HD21 H 1 0.649 0.030 . 1 . . . . . . . . 6297 1 1272 . 1 1 105 105 LEU HD22 H 1 0.649 0.030 . 1 . . . . . . . . 6297 1 1273 . 1 1 105 105 LEU HD23 H 1 0.649 0.030 . 1 . . . . . . . . 6297 1 1274 . 1 1 105 105 LEU C C 13 178.641 0.300 . 1 . . . . . . . . 6297 1 1275 . 1 1 106 106 ALA N N 15 120.689 0.200 . 1 . . . . . . . . 6297 1 1276 . 1 1 106 106 ALA H H 1 8.597 0.030 . 1 . . . . . . . . 6297 1 1277 . 1 1 106 106 ALA CA C 13 54.941 0.300 . 1 . . . . . . . . 6297 1 1278 . 1 1 106 106 ALA HA H 1 4.340 0.030 . 1 . . . . . . . . 6297 1 1279 . 1 1 106 106 ALA CB C 13 18.514 0.300 . 1 . . . . . . . . 6297 1 1280 . 1 1 106 106 ALA HB1 H 1 1.501 0.030 . 1 . . . . . . . . 6297 1 1281 . 1 1 106 106 ALA HB2 H 1 1.501 0.030 . 1 . . . . . . . . 6297 1 1282 . 1 1 106 106 ALA HB3 H 1 1.501 0.030 . 1 . . . . . . . . 6297 1 1283 . 1 1 106 106 ALA C C 13 179.174 0.300 . 1 . . . . . . . . 6297 1 1284 . 1 1 107 107 LYS N N 15 114.721 0.200 . 1 . . . . . . . . 6297 1 1285 . 1 1 107 107 LYS H H 1 7.318 0.030 . 1 . . . . . . . . 6297 1 1286 . 1 1 107 107 LYS CA C 13 59.826 0.300 . 1 . . . . . . . . 6297 1 1287 . 1 1 107 107 LYS HA H 1 3.836 0.030 . 1 . . . . . . . . 6297 1 1288 . 1 1 107 107 LYS CB C 13 32.591 0.300 . 1 . . . . . . . . 6297 1 1289 . 1 1 107 107 LYS HB2 H 1 1.966 0.030 . 1 . . . . . . . . 6297 1 1290 . 1 1 107 107 LYS HB3 H 1 1.966 0.030 . 1 . . . . . . . . 6297 1 1291 . 1 1 107 107 LYS CG C 13 25.614 0.300 . 1 . . . . . . . . 6297 1 1292 . 1 1 107 107 LYS HG2 H 1 1.496 0.030 . 2 . . . . . . . . 6297 1 1293 . 1 1 107 107 LYS HG3 H 1 1.760 0.030 . 2 . . . . . . . . 6297 1 1294 . 1 1 107 107 LYS CD C 13 29.570 0.300 . 1 . . . . . . . . 6297 1 1295 . 1 1 107 107 LYS HD2 H 1 1.757 0.030 . 1 . . . . . . . . 6297 1 1296 . 1 1 107 107 LYS HD3 H 1 1.757 0.030 . 1 . . . . . . . . 6297 1 1297 . 1 1 107 107 LYS CE C 13 42.191 0.300 . 1 . . . . . . . . 6297 1 1298 . 1 1 107 107 LYS HE2 H 1 3.001 0.030 . 1 . . . . . . . . 6297 1 1299 . 1 1 107 107 LYS HE3 H 1 3.001 0.030 . 1 . . . . . . . . 6297 1 1300 . 1 1 107 107 LYS C C 13 179.711 0.300 . 1 . . . . . . . . 6297 1 1301 . 1 1 108 108 LYS N N 15 118.762 0.200 . 1 . . . . . . . . 6297 1 1302 . 1 1 108 108 LYS H H 1 7.657 0.030 . 1 . . . . . . . . 6297 1 1303 . 1 1 108 108 LYS CA C 13 58.765 0.300 . 1 . . . . . . . . 6297 1 1304 . 1 1 108 108 LYS HA H 1 4.150 0.030 . 1 . . . . . . . . 6297 1 1305 . 1 1 108 108 LYS CB C 13 32.727 0.300 . 1 . . . . . . . . 6297 1 1306 . 1 1 108 108 LYS HB2 H 1 2.062 0.030 . 1 . . . . . . . . 6297 1 1307 . 1 1 108 108 LYS HB3 H 1 2.062 0.030 . 1 . . . . . . . . 6297 1 1308 . 1 1 108 108 LYS CG C 13 25.168 0.300 . 1 . . . . . . . . 6297 1 1309 . 1 1 108 108 LYS HG2 H 1 1.541 0.030 . 2 . . . . . . . . 6297 1 1310 . 1 1 108 108 LYS HG3 H 1 1.652 0.030 . 2 . . . . . . . . 6297 1 1311 . 1 1 108 108 LYS CD C 13 29.294 0.300 . 1 . . . . . . . . 6297 1 1312 . 1 1 108 108 LYS HD2 H 1 1.717 0.030 . 1 . . . . . . . . 6297 1 1313 . 1 1 108 108 LYS HD3 H 1 1.717 0.030 . 1 . . . . . . . . 6297 1 1314 . 1 1 108 108 LYS CE C 13 42.183 0.300 . 1 . . . . . . . . 6297 1 1315 . 1 1 108 108 LYS HE2 H 1 3.008 0.030 . 1 . . . . . . . . 6297 1 1316 . 1 1 108 108 LYS HE3 H 1 3.008 0.030 . 1 . . . . . . . . 6297 1 1317 . 1 1 108 108 LYS C C 13 178.279 0.300 . 1 . . . . . . . . 6297 1 1318 . 1 1 109 109 GLN N N 15 116.354 0.200 . 1 . . . . . . . . 6297 1 1319 . 1 1 109 109 GLN H H 1 7.959 0.030 . 1 . . . . . . . . 6297 1 1320 . 1 1 109 109 GLN CA C 13 55.104 0.300 . 1 . . . . . . . . 6297 1 1321 . 1 1 109 109 GLN HA H 1 4.312 0.030 . 1 . . . . . . . . 6297 1 1322 . 1 1 109 109 GLN CB C 13 30.140 0.300 . 1 . . . . . . . . 6297 1 1323 . 1 1 109 109 GLN HB2 H 1 2.160 0.030 . 2 . . . . . . . . 6297 1 1324 . 1 1 109 109 GLN HB3 H 1 2.509 0.030 . 2 . . . . . . . . 6297 1 1325 . 1 1 109 109 GLN CG C 13 34.554 0.300 . 1 . . . . . . . . 6297 1 1326 . 1 1 109 109 GLN HG2 H 1 2.299 0.030 . 2 . . . . . . . . 6297 1 1327 . 1 1 109 109 GLN HG3 H 1 2.559 0.030 . 2 . . . . . . . . 6297 1 1328 . 1 1 109 109 GLN NE2 N 15 109.403 0.200 . 1 . . . . . . . . 6297 1 1329 . 1 1 109 109 GLN HE21 H 1 6.763 0.030 . 2 . . . . . . . . 6297 1 1330 . 1 1 109 109 GLN HE22 H 1 7.433 0.030 . 2 . . . . . . . . 6297 1 1331 . 1 1 109 109 GLN C C 13 174.942 0.300 . 1 . . . . . . . . 6297 1 1332 . 1 1 110 110 CYS N N 15 118.511 0.200 . 1 . . . . . . . . 6297 1 1333 . 1 1 110 110 CYS H H 1 7.192 0.030 . 1 . . . . . . . . 6297 1 1334 . 1 1 110 110 CYS CA C 13 63.348 0.300 . 1 . . . . . . . . 6297 1 1335 . 1 1 110 110 CYS HA H 1 3.844 0.030 . 1 . . . . . . . . 6297 1 1336 . 1 1 110 110 CYS CB C 13 27.148 0.300 . 1 . . . . . . . . 6297 1 1337 . 1 1 110 110 CYS HB2 H 1 2.846 0.030 . 2 . . . . . . . . 6297 1 1338 . 1 1 110 110 CYS HB3 H 1 2.901 0.030 . 2 . . . . . . . . 6297 1 1339 . 1 1 110 110 CYS C C 13 174.347 0.300 . 1 . . . . . . . . 6297 1 1340 . 1 1 111 111 GLY N N 15 116.955 0.200 . 1 . . . . . . . . 6297 1 1341 . 1 1 111 111 GLY H H 1 8.640 0.030 . 1 . . . . . . . . 6297 1 1342 . 1 1 111 111 GLY CA C 13 44.507 0.300 . 1 . . . . . . . . 6297 1 1343 . 1 1 111 111 GLY HA2 H 1 3.750 0.030 . 2 . . . . . . . . 6297 1 1344 . 1 1 111 111 GLY HA3 H 1 4.659 0.030 . 2 . . . . . . . . 6297 1 1345 . 1 1 111 111 GLY C C 13 173.732 0.300 . 1 . . . . . . . . 6297 1 1346 . 1 1 112 112 GLU N N 15 121.034 0.200 . 1 . . . . . . . . 6297 1 1347 . 1 1 112 112 GLU H H 1 8.202 0.030 . 1 . . . . . . . . 6297 1 1348 . 1 1 112 112 GLU CA C 13 53.843 0.300 . 1 . . . . . . . . 6297 1 1349 . 1 1 112 112 GLU HA H 1 4.594 0.030 . 1 . . . . . . . . 6297 1 1350 . 1 1 112 112 GLU CB C 13 32.794 0.300 . 1 . . . . . . . . 6297 1 1351 . 1 1 112 112 GLU HB2 H 1 1.949 0.030 . 2 . . . . . . . . 6297 1 1352 . 1 1 112 112 GLU HB3 H 1 2.072 0.030 . 2 . . . . . . . . 6297 1 1353 . 1 1 112 112 GLU CG C 13 35.991 0.300 . 1 . . . . . . . . 6297 1 1354 . 1 1 112 112 GLU HG2 H 1 2.325 0.030 . 2 . . . . . . . . 6297 1 1355 . 1 1 112 112 GLU HG3 H 1 2.547 0.030 . 2 . . . . . . . . 6297 1 1356 . 1 1 112 112 GLU C C 13 174.134 0.300 . 1 . . . . . . . . 6297 1 1357 . 1 1 113 113 VAL N N 15 115.588 0.200 . 1 . . . . . . . . 6297 1 1358 . 1 1 113 113 VAL H H 1 8.748 0.030 . 1 . . . . . . . . 6297 1 1359 . 1 1 113 113 VAL CA C 13 64.160 0.300 . 1 . . . . . . . . 6297 1 1360 . 1 1 113 113 VAL HA H 1 3.917 0.030 . 1 . . . . . . . . 6297 1 1361 . 1 1 113 113 VAL CB C 13 29.416 0.300 . 1 . . . . . . . . 6297 1 1362 . 1 1 113 113 VAL HB H 1 2.922 0.030 . 1 . . . . . . . . 6297 1 1363 . 1 1 113 113 VAL CG1 C 13 17.637 0.300 . 2 . . . . . . . . 6297 1 1364 . 1 1 113 113 VAL HG11 H 1 1.118 0.030 . 1 . . . . . . . . 6297 1 1365 . 1 1 113 113 VAL HG12 H 1 1.118 0.030 . 1 . . . . . . . . 6297 1 1366 . 1 1 113 113 VAL HG13 H 1 1.118 0.030 . 1 . . . . . . . . 6297 1 1367 . 1 1 113 113 VAL CG2 C 13 22.242 0.300 . 2 . . . . . . . . 6297 1 1368 . 1 1 113 113 VAL HG21 H 1 1.046 0.030 . 1 . . . . . . . . 6297 1 1369 . 1 1 113 113 VAL HG22 H 1 1.046 0.030 . 1 . . . . . . . . 6297 1 1370 . 1 1 113 113 VAL HG23 H 1 1.046 0.030 . 1 . . . . . . . . 6297 1 1371 . 1 1 113 113 VAL C C 13 177.926 0.300 . 1 . . . . . . . . 6297 1 1372 . 1 1 114 114 MET N N 15 117.133 0.200 . 1 . . . . . . . . 6297 1 1373 . 1 1 114 114 MET H H 1 8.262 0.030 . 1 . . . . . . . . 6297 1 1374 . 1 1 114 114 MET CA C 13 56.532 0.300 . 1 . . . . . . . . 6297 1 1375 . 1 1 114 114 MET HA H 1 5.434 0.030 . 1 . . . . . . . . 6297 1 1376 . 1 1 114 114 MET CB C 13 37.539 0.300 . 1 . . . . . . . . 6297 1 1377 . 1 1 114 114 MET HB2 H 1 2.134 0.030 . 2 . . . . . . . . 6297 1 1378 . 1 1 114 114 MET HB3 H 1 2.268 0.030 . 2 . . . . . . . . 6297 1 1379 . 1 1 114 114 MET CG C 13 30.140 0.300 . 1 . . . . . . . . 6297 1 1380 . 1 1 114 114 MET HG2 H 1 2.958 0.030 . 2 . . . . . . . . 6297 1 1381 . 1 1 114 114 MET HG3 H 1 2.270 0.030 . 2 . . . . . . . . 6297 1 1382 . 1 1 114 114 MET CE C 13 16.588 0.300 . 1 . . . . . . . . 6297 1 1383 . 1 1 114 114 MET HE1 H 1 2.272 0.030 . 1 . . . . . . . . 6297 1 1384 . 1 1 114 114 MET HE2 H 1 2.272 0.030 . 1 . . . . . . . . 6297 1 1385 . 1 1 114 114 MET HE3 H 1 2.272 0.030 . 1 . . . . . . . . 6297 1 1386 . 1 1 114 114 MET C C 13 176.327 0.300 . 1 . . . . . . . . 6297 1 1387 . 1 1 115 115 ILE N N 15 126.593 0.200 . 1 . . . . . . . . 6297 1 1388 . 1 1 115 115 ILE H H 1 10.304 0.030 . 1 . . . . . . . . 6297 1 1389 . 1 1 115 115 ILE CA C 13 67.693 0.300 . 1 . . . . . . . . 6297 1 1390 . 1 1 115 115 ILE HA H 1 3.516 0.030 . 1 . . . . . . . . 6297 1 1391 . 1 1 115 115 ILE CB C 13 35.931 0.300 . 1 . . . . . . . . 6297 1 1392 . 1 1 115 115 ILE HB H 1 1.858 0.030 . 1 . . . . . . . . 6297 1 1393 . 1 1 115 115 ILE CG1 C 13 29.960 0.300 . 1 . . . . . . . . 6297 1 1394 . 1 1 115 115 ILE HG12 H 1 2.262 0.030 . 2 . . . . . . . . 6297 1 1395 . 1 1 115 115 ILE HG13 H 1 0.745 0.030 . 2 . . . . . . . . 6297 1 1396 . 1 1 115 115 ILE CG2 C 13 19.156 0.300 . 1 . . . . . . . . 6297 1 1397 . 1 1 115 115 ILE HG21 H 1 0.722 0.030 . 1 . . . . . . . . 6297 1 1398 . 1 1 115 115 ILE HG22 H 1 0.722 0.030 . 1 . . . . . . . . 6297 1 1399 . 1 1 115 115 ILE HG23 H 1 0.722 0.030 . 1 . . . . . . . . 6297 1 1400 . 1 1 115 115 ILE CD1 C 13 13.008 0.300 . 1 . . . . . . . . 6297 1 1401 . 1 1 115 115 ILE HD11 H 1 0.588 0.030 . 1 . . . . . . . . 6297 1 1402 . 1 1 115 115 ILE HD12 H 1 0.588 0.030 . 1 . . . . . . . . 6297 1 1403 . 1 1 115 115 ILE HD13 H 1 0.588 0.030 . 1 . . . . . . . . 6297 1 1404 . 1 1 116 116 PHE N N 15 117.796 0.200 . 1 . . . . . . . . 6297 1 1405 . 1 1 116 116 PHE H H 1 9.093 0.030 . 1 . . . . . . . . 6297 1 1406 . 1 1 116 116 PHE CA C 13 63.646 0.300 . 1 . . . . . . . . 6297 1 1407 . 1 1 116 116 PHE HA H 1 4.078 0.030 . 1 . . . . . . . . 6297 1 1408 . 1 1 116 116 PHE CB C 13 38.070 0.300 . 1 . . . . . . . . 6297 1 1409 . 1 1 116 116 PHE HB2 H 1 2.928 0.030 . 2 . . . . . . . . 6297 1 1410 . 1 1 116 116 PHE HB3 H 1 3.185 0.030 . 2 . . . . . . . . 6297 1 1411 . 1 1 116 116 PHE CD1 C 13 132.159 0.300 . 1 . . . . . . . . 6297 1 1412 . 1 1 116 116 PHE HD1 H 1 7.581 0.030 . 1 . . . . . . . . 6297 1 1413 . 1 1 116 116 PHE CD2 C 13 132.159 0.300 . 1 . . . . . . . . 6297 1 1414 . 1 1 116 116 PHE HD2 H 1 7.581 0.030 . 1 . . . . . . . . 6297 1 1415 . 1 1 116 116 PHE CE1 C 13 131.436 0.300 . 1 . . . . . . . . 6297 1 1416 . 1 1 116 116 PHE HE1 H 1 7.380 0.030 . 1 . . . . . . . . 6297 1 1417 . 1 1 116 116 PHE CE2 C 13 131.436 0.300 . 1 . . . . . . . . 6297 1 1418 . 1 1 116 116 PHE HE2 H 1 7.380 0.030 . 1 . . . . . . . . 6297 1 1419 . 1 1 116 116 PHE CZ C 13 129.333 0.300 . 1 . . . . . . . . 6297 1 1420 . 1 1 116 116 PHE HZ H 1 7.159 0.030 . 1 . . . . . . . . 6297 1 1421 . 1 1 116 116 PHE C C 13 178.126 0.300 . 1 . . . . . . . . 6297 1 1422 . 1 1 117 117 GLU N N 15 119.860 0.200 . 1 . . . . . . . . 6297 1 1423 . 1 1 117 117 GLU H H 1 8.168 0.030 . 1 . . . . . . . . 6297 1 1424 . 1 1 117 117 GLU CA C 13 60.241 0.300 . 1 . . . . . . . . 6297 1 1425 . 1 1 117 117 GLU HA H 1 4.162 0.030 . 1 . . . . . . . . 6297 1 1426 . 1 1 117 117 GLU CB C 13 28.695 0.300 . 1 . . . . . . . . 6297 1 1427 . 1 1 117 117 GLU HB2 H 1 2.033 0.030 . 2 . . . . . . . . 6297 1 1428 . 1 1 117 117 GLU HB3 H 1 2.329 0.030 . 2 . . . . . . . . 6297 1 1429 . 1 1 117 117 GLU CG C 13 36.718 0.300 . 1 . . . . . . . . 6297 1 1430 . 1 1 117 117 GLU HG2 H 1 2.395 0.030 . 2 . . . . . . . . 6297 1 1431 . 1 1 117 117 GLU HG3 H 1 2.498 0.030 . 2 . . . . . . . . 6297 1 1432 . 1 1 117 117 GLU C C 13 180.219 0.300 . 1 . . . . . . . . 6297 1 1433 . 1 1 118 118 LEU N N 15 119.124 0.200 . 1 . . . . . . . . 6297 1 1434 . 1 1 118 118 LEU H H 1 8.291 0.030 . 1 . . . . . . . . 6297 1 1435 . 1 1 118 118 LEU CA C 13 58.320 0.300 . 1 . . . . . . . . 6297 1 1436 . 1 1 118 118 LEU HA H 1 4.010 0.030 . 1 . . . . . . . . 6297 1 1437 . 1 1 118 118 LEU CB C 13 41.696 0.300 . 1 . . . . . . . . 6297 1 1438 . 1 1 118 118 LEU HB2 H 1 1.267 0.030 . 2 . . . . . . . . 6297 1 1439 . 1 1 118 118 LEU HB3 H 1 2.112 0.030 . 2 . . . . . . . . 6297 1 1440 . 1 1 118 118 LEU CG C 13 26.455 0.300 . 1 . . . . . . . . 6297 1 1441 . 1 1 118 118 LEU HG H 1 2.132 0.030 . 1 . . . . . . . . 6297 1 1442 . 1 1 118 118 LEU CD1 C 13 25.949 0.300 . 1 . . . . . . . . 6297 1 1443 . 1 1 118 118 LEU HD11 H 1 0.802 0.030 . 1 . . . . . . . . 6297 1 1444 . 1 1 118 118 LEU HD12 H 1 0.802 0.030 . 1 . . . . . . . . 6297 1 1445 . 1 1 118 118 LEU HD13 H 1 0.802 0.030 . 1 . . . . . . . . 6297 1 1446 . 1 1 118 118 LEU CD2 C 13 22.936 0.300 . 1 . . . . . . . . 6297 1 1447 . 1 1 118 118 LEU HD21 H 1 0.852 0.030 . 1 . . . . . . . . 6297 1 1448 . 1 1 118 118 LEU HD22 H 1 0.852 0.030 . 1 . . . . . . . . 6297 1 1449 . 1 1 118 118 LEU HD23 H 1 0.852 0.030 . 1 . . . . . . . . 6297 1 1450 . 1 1 118 118 LEU C C 13 178.316 0.300 . 1 . . . . . . . . 6297 1 1451 . 1 1 119 119 ALA N N 15 120.867 0.200 . 1 . . . . . . . . 6297 1 1452 . 1 1 119 119 ALA H H 1 8.823 0.030 . 1 . . . . . . . . 6297 1 1453 . 1 1 119 119 ALA CA C 13 55.303 0.300 . 1 . . . . . . . . 6297 1 1454 . 1 1 119 119 ALA HA H 1 3.779 0.030 . 1 . . . . . . . . 6297 1 1455 . 1 1 119 119 ALA CB C 13 17.987 0.300 . 1 . . . . . . . . 6297 1 1456 . 1 1 119 119 ALA HB1 H 1 1.353 0.030 . 1 . . . . . . . . 6297 1 1457 . 1 1 119 119 ALA HB2 H 1 1.353 0.030 . 1 . . . . . . . . 6297 1 1458 . 1 1 119 119 ALA HB3 H 1 1.353 0.030 . 1 . . . . . . . . 6297 1 1459 . 1 1 119 119 ALA C C 13 179.819 0.300 . 1 . . . . . . . . 6297 1 1460 . 1 1 120 120 HIS N N 15 117.984 0.200 . 1 . . . . . . . . 6297 1 1461 . 1 1 120 120 HIS H H 1 8.918 0.030 . 1 . . . . . . . . 6297 1 1462 . 1 1 120 120 HIS CA C 13 59.104 0.300 . 1 . . . . . . . . 6297 1 1463 . 1 1 120 120 HIS HA H 1 4.461 0.030 . 1 . . . . . . . . 6297 1 1464 . 1 1 120 120 HIS CB C 13 29.582 0.300 . 1 . . . . . . . . 6297 1 1465 . 1 1 120 120 HIS HB2 H 1 3.247 0.030 . 2 . . . . . . . . 6297 1 1466 . 1 1 120 120 HIS HB3 H 1 3.300 0.030 . 2 . . . . . . . . 6297 1 1467 . 1 1 120 120 HIS CD2 C 13 120.040 0.300 . 1 . . . . . . . . 6297 1 1468 . 1 1 120 120 HIS HD2 H 1 7.085 0.030 . 1 . . . . . . . . 6297 1 1469 . 1 1 120 120 HIS C C 13 178.494 0.300 . 1 . . . . . . . . 6297 1 1470 . 1 1 121 121 HIS N N 15 120.267 0.200 . 1 . . . . . . . . 6297 1 1471 . 1 1 121 121 HIS H H 1 8.175 0.030 . 1 . . . . . . . . 6297 1 1472 . 1 1 121 121 HIS CA C 13 60.826 0.300 . 1 . . . . . . . . 6297 1 1473 . 1 1 121 121 HIS HA H 1 4.230 0.030 . 1 . . . . . . . . 6297 1 1474 . 1 1 121 121 HIS CB C 13 30.107 0.300 . 1 . . . . . . . . 6297 1 1475 . 1 1 121 121 HIS HB2 H 1 3.217 0.030 . 1 . . . . . . . . 6297 1 1476 . 1 1 121 121 HIS HB3 H 1 3.217 0.030 . 1 . . . . . . . . 6297 1 1477 . 1 1 121 121 HIS CD2 C 13 120.266 0.300 . 1 . . . . . . . . 6297 1 1478 . 1 1 121 121 HIS HD2 H 1 6.753 0.030 . 1 . . . . . . . . 6297 1 1479 . 1 1 121 121 HIS CE1 C 13 138.768 0.300 . 1 . . . . . . . . 6297 1 1480 . 1 1 121 121 HIS HE1 H 1 7.853 0.030 . 1 . . . . . . . . 6297 1 1481 . 1 1 121 121 HIS C C 13 178.719 0.300 . 1 . . . . . . . . 6297 1 1482 . 1 1 122 122 VAL N N 15 119.053 0.200 . 1 . . . . . . . . 6297 1 1483 . 1 1 122 122 VAL H H 1 8.241 0.030 . 1 . . . . . . . . 6297 1 1484 . 1 1 122 122 VAL CA C 13 67.301 0.300 . 1 . . . . . . . . 6297 1 1485 . 1 1 122 122 VAL HA H 1 3.589 0.030 . 1 . . . . . . . . 6297 1 1486 . 1 1 122 122 VAL CB C 13 30.971 0.300 . 1 . . . . . . . . 6297 1 1487 . 1 1 122 122 VAL HB H 1 2.477 0.030 . 1 . . . . . . . . 6297 1 1488 . 1 1 122 122 VAL CG1 C 13 23.225 0.300 . 2 . . . . . . . . 6297 1 1489 . 1 1 122 122 VAL HG11 H 1 0.751 0.030 . 1 . . . . . . . . 6297 1 1490 . 1 1 122 122 VAL HG12 H 1 0.751 0.030 . 1 . . . . . . . . 6297 1 1491 . 1 1 122 122 VAL HG13 H 1 0.751 0.030 . 1 . . . . . . . . 6297 1 1492 . 1 1 122 122 VAL CG2 C 13 24.822 0.300 . 2 . . . . . . . . 6297 1 1493 . 1 1 122 122 VAL HG21 H 1 1.144 0.030 . 1 . . . . . . . . 6297 1 1494 . 1 1 122 122 VAL HG22 H 1 1.144 0.030 . 1 . . . . . . . . 6297 1 1495 . 1 1 122 122 VAL HG23 H 1 1.144 0.030 . 1 . . . . . . . . 6297 1 1496 . 1 1 122 122 VAL C C 13 177.640 0.300 . 1 . . . . . . . . 6297 1 1497 . 1 1 123 123 GLN N N 15 118.045 0.200 . 1 . . . . . . . . 6297 1 1498 . 1 1 123 123 GLN H H 1 8.751 0.030 . 1 . . . . . . . . 6297 1 1499 . 1 1 123 123 GLN CA C 13 60.436 0.300 . 1 . . . . . . . . 6297 1 1500 . 1 1 123 123 GLN HA H 1 3.874 0.030 . 1 . . . . . . . . 6297 1 1501 . 1 1 123 123 GLN CB C 13 29.178 0.300 . 1 . . . . . . . . 6297 1 1502 . 1 1 123 123 GLN HB2 H 1 2.155 0.030 . 2 . . . . . . . . 6297 1 1503 . 1 1 123 123 GLN HB3 H 1 2.406 0.030 . 2 . . . . . . . . 6297 1 1504 . 1 1 123 123 GLN CG C 13 35.613 0.300 . 1 . . . . . . . . 6297 1 1505 . 1 1 123 123 GLN HG2 H 1 2.737 0.030 . 2 . . . . . . . . 6297 1 1506 . 1 1 123 123 GLN HG3 H 1 2.797 0.030 . 2 . . . . . . . . 6297 1 1507 . 1 1 123 123 GLN NE2 N 15 113.165 0.200 . 1 . . . . . . . . 6297 1 1508 . 1 1 123 123 GLN HE21 H 1 7.237 0.030 . 2 . . . . . . . . 6297 1 1509 . 1 1 123 123 GLN HE22 H 1 7.933 0.030 . 2 . . . . . . . . 6297 1 1510 . 1 1 123 123 GLN C C 13 179.203 0.300 . 1 . . . . . . . . 6297 1 1511 . 1 1 124 124 SER N N 15 116.589 0.200 . 1 . . . . . . . . 6297 1 1512 . 1 1 124 124 SER H H 1 8.332 0.030 . 1 . . . . . . . . 6297 1 1513 . 1 1 124 124 SER CA C 13 61.977 0.300 . 1 . . . . . . . . 6297 1 1514 . 1 1 124 124 SER HA H 1 4.267 0.030 . 1 . . . . . . . . 6297 1 1515 . 1 1 124 124 SER CB C 13 62.689 0.300 . 1 . . . . . . . . 6297 1 1516 . 1 1 124 124 SER HB2 H 1 3.916 0.030 . 1 . . . . . . . . 6297 1 1517 . 1 1 124 124 SER HB3 H 1 3.916 0.030 . 1 . . . . . . . . 6297 1 1518 . 1 1 124 124 SER C C 13 179.231 0.300 . 1 . . . . . . . . 6297 1 1519 . 1 1 125 125 PHE N N 15 125.238 0.200 . 1 . . . . . . . . 6297 1 1520 . 1 1 125 125 PHE H H 1 8.236 0.030 . 1 . . . . . . . . 6297 1 1521 . 1 1 125 125 PHE CA C 13 61.497 0.300 . 1 . . . . . . . . 6297 1 1522 . 1 1 125 125 PHE HA H 1 4.333 0.030 . 1 . . . . . . . . 6297 1 1523 . 1 1 125 125 PHE CB C 13 39.745 0.300 . 1 . . . . . . . . 6297 1 1524 . 1 1 125 125 PHE HB2 H 1 3.024 0.030 . 2 . . . . . . . . 6297 1 1525 . 1 1 125 125 PHE HB3 H 1 3.323 0.030 . 2 . . . . . . . . 6297 1 1526 . 1 1 125 125 PHE CD1 C 13 132.663 0.300 . 1 . . . . . . . . 6297 1 1527 . 1 1 125 125 PHE HD1 H 1 7.160 0.030 . 1 . . . . . . . . 6297 1 1528 . 1 1 125 125 PHE CD2 C 13 132.663 0.300 . 1 . . . . . . . . 6297 1 1529 . 1 1 125 125 PHE HD2 H 1 7.160 0.030 . 1 . . . . . . . . 6297 1 1530 . 1 1 125 125 PHE CE1 C 13 131.037 0.300 . 1 . . . . . . . . 6297 1 1531 . 1 1 125 125 PHE HE1 H 1 7.030 0.030 . 1 . . . . . . . . 6297 1 1532 . 1 1 125 125 PHE CE2 C 13 131.037 0.300 . 1 . . . . . . . . 6297 1 1533 . 1 1 125 125 PHE HE2 H 1 7.030 0.030 . 1 . . . . . . . . 6297 1 1534 . 1 1 125 125 PHE CZ C 13 131.037 0.300 . 1 . . . . . . . . 6297 1 1535 . 1 1 125 125 PHE HZ H 1 7.030 0.030 . 1 . . . . . . . . 6297 1 1536 . 1 1 125 125 PHE C C 13 179.013 0.300 . 1 . . . . . . . . 6297 1 1537 . 1 1 126 126 LEU N N 15 118.995 0.200 . 1 . . . . . . . . 6297 1 1538 . 1 1 126 126 LEU H H 1 9.251 0.030 . 1 . . . . . . . . 6297 1 1539 . 1 1 126 126 LEU CA C 13 58.007 0.300 . 1 . . . . . . . . 6297 1 1540 . 1 1 126 126 LEU HA H 1 3.950 0.030 . 1 . . . . . . . . 6297 1 1541 . 1 1 126 126 LEU CB C 13 40.991 0.300 . 1 . . . . . . . . 6297 1 1542 . 1 1 126 126 LEU HB2 H 1 1.273 0.030 . 2 . . . . . . . . 6297 1 1543 . 1 1 126 126 LEU HB3 H 1 1.986 0.030 . 2 . . . . . . . . 6297 1 1544 . 1 1 126 126 LEU CG C 13 26.163 0.300 . 1 . . . . . . . . 6297 1 1545 . 1 1 126 126 LEU HG H 1 2.176 0.030 . 1 . . . . . . . . 6297 1 1546 . 1 1 126 126 LEU CD1 C 13 27.073 0.300 . 1 . . . . . . . . 6297 1 1547 . 1 1 126 126 LEU HD11 H 1 0.719 0.030 . 1 . . . . . . . . 6297 1 1548 . 1 1 126 126 LEU HD12 H 1 0.719 0.030 . 1 . . . . . . . . 6297 1 1549 . 1 1 126 126 LEU HD13 H 1 0.719 0.030 . 1 . . . . . . . . 6297 1 1550 . 1 1 126 126 LEU CD2 C 13 22.477 0.300 . 1 . . . . . . . . 6297 1 1551 . 1 1 126 126 LEU HD21 H 1 0.778 0.030 . 1 . . . . . . . . 6297 1 1552 . 1 1 126 126 LEU HD22 H 1 0.778 0.030 . 1 . . . . . . . . 6297 1 1553 . 1 1 126 126 LEU HD23 H 1 0.778 0.030 . 1 . . . . . . . . 6297 1 1554 . 1 1 126 126 LEU C C 13 179.091 0.300 . 1 . . . . . . . . 6297 1 1555 . 1 1 127 127 SER N N 15 114.311 0.200 . 1 . . . . . . . . 6297 1 1556 . 1 1 127 127 SER H H 1 8.203 0.030 . 1 . . . . . . . . 6297 1 1557 . 1 1 127 127 SER CA C 13 62.855 0.300 . 1 . . . . . . . . 6297 1 1558 . 1 1 127 127 SER HA H 1 4.221 0.030 . 1 . . . . . . . . 6297 1 1559 . 1 1 127 127 SER CB C 13 62.855 0.300 . 1 . . . . . . . . 6297 1 1560 . 1 1 127 127 SER HB2 H 1 4.227 0.030 . 2 . . . . . . . . 6297 1 1561 . 1 1 127 127 SER HB3 H 1 4.130 0.030 . 2 . . . . . . . . 6297 1 1562 . 1 1 127 127 SER C C 13 176.406 0.300 . 1 . . . . . . . . 6297 1 1563 . 1 1 128 128 GLU N N 15 120.148 0.200 . 1 . . . . . . . . 6297 1 1564 . 1 1 128 128 GLU H H 1 7.593 0.030 . 1 . . . . . . . . 6297 1 1565 . 1 1 128 128 GLU CA C 13 58.249 0.300 . 1 . . . . . . . . 6297 1 1566 . 1 1 128 128 GLU HA H 1 4.065 0.030 . 1 . . . . . . . . 6297 1 1567 . 1 1 128 128 GLU CB C 13 29.361 0.300 . 1 . . . . . . . . 6297 1 1568 . 1 1 128 128 GLU HB2 H 1 1.860 0.030 . 2 . . . . . . . . 6297 1 1569 . 1 1 128 128 GLU HB3 H 1 1.960 0.030 . 2 . . . . . . . . 6297 1 1570 . 1 1 128 128 GLU CG C 13 35.907 0.300 . 1 . . . . . . . . 6297 1 1571 . 1 1 128 128 GLU HG2 H 1 2.029 0.030 . 2 . . . . . . . . 6297 1 1572 . 1 1 128 128 GLU HG3 H 1 2.217 0.030 . 2 . . . . . . . . 6297 1 1573 . 1 1 128 128 GLU C C 13 177.453 0.300 . 1 . . . . . . . . 6297 1 1574 . 1 1 129 129 HIS N N 15 116.219 0.200 . 1 . . . . . . . . 6297 1 1575 . 1 1 129 129 HIS H H 1 7.544 0.030 . 1 . . . . . . . . 6297 1 1576 . 1 1 129 129 HIS CA C 13 57.577 0.300 . 1 . . . . . . . . 6297 1 1577 . 1 1 129 129 HIS HA H 1 4.355 0.030 . 1 . . . . . . . . 6297 1 1578 . 1 1 129 129 HIS CB C 13 30.239 0.300 . 1 . . . . . . . . 6297 1 1579 . 1 1 129 129 HIS HB2 H 1 3.346 0.030 . 2 . . . . . . . . 6297 1 1580 . 1 1 129 129 HIS HB3 H 1 2.515 0.030 . 2 . . . . . . . . 6297 1 1581 . 1 1 129 129 HIS CD2 C 13 121.242 0.300 . 1 . . . . . . . . 6297 1 1582 . 1 1 129 129 HIS HD2 H 1 6.462 0.030 . 1 . . . . . . . . 6297 1 1583 . 1 1 129 129 HIS CE1 C 13 138.021 0.300 . 1 . . . . . . . . 6297 1 1584 . 1 1 129 129 HIS HE1 H 1 7.497 0.030 . 1 . . . . . . . . 6297 1 1585 . 1 1 129 129 HIS C C 13 175.030 0.300 . 1 . . . . . . . . 6297 1 1586 . 1 1 130 130 ASN N N 15 120.161 0.200 . 1 . . . . . . . . 6297 1 1587 . 1 1 130 130 ASN H H 1 7.728 0.030 . 1 . . . . . . . . 6297 1 1588 . 1 1 130 130 ASN CA C 13 54.711 0.300 . 1 . . . . . . . . 6297 1 1589 . 1 1 130 130 ASN HA H 1 4.836 0.030 . 1 . . . . . . . . 6297 1 1590 . 1 1 130 130 ASN CB C 13 38.773 0.300 . 1 . . . . . . . . 6297 1 1591 . 1 1 130 130 ASN HB2 H 1 2.807 0.030 . 2 . . . . . . . . 6297 1 1592 . 1 1 130 130 ASN HB3 H 1 3.054 0.030 . 2 . . . . . . . . 6297 1 1593 . 1 1 130 130 ASN ND2 N 15 114.300 0.200 . 1 . . . . . . . . 6297 1 1594 . 1 1 130 130 ASN HD21 H 1 7.332 0.030 . 2 . . . . . . . . 6297 1 1595 . 1 1 130 130 ASN HD22 H 1 7.941 0.030 . 2 . . . . . . . . 6297 1 1596 . 1 1 130 130 ASN C C 13 174.501 0.300 . 1 . . . . . . . . 6297 1 1597 . 1 1 131 131 LYS N N 15 120.189 0.200 . 1 . . . . . . . . 6297 1 1598 . 1 1 131 131 LYS H H 1 7.776 0.030 . 1 . . . . . . . . 6297 1 1599 . 1 1 131 131 LYS CA C 13 55.963 0.300 . 1 . . . . . . . . 6297 1 1600 . 1 1 131 131 LYS HA H 1 4.399 0.030 . 1 . . . . . . . . 6297 1 1601 . 1 1 131 131 LYS CB C 13 33.879 0.300 . 1 . . . . . . . . 6297 1 1602 . 1 1 131 131 LYS HB2 H 1 1.730 0.030 . 2 . . . . . . . . 6297 1 1603 . 1 1 131 131 LYS HB3 H 1 1.891 0.030 . 2 . . . . . . . . 6297 1 1604 . 1 1 131 131 LYS CG C 13 24.515 0.300 . 1 . . . . . . . . 6297 1 1605 . 1 1 131 131 LYS HG2 H 1 1.369 0.030 . 2 . . . . . . . . 6297 1 1606 . 1 1 131 131 LYS HG3 H 1 1.430 0.030 . 2 . . . . . . . . 6297 1 1607 . 1 1 131 131 LYS CD C 13 29.149 0.300 . 1 . . . . . . . . 6297 1 1608 . 1 1 131 131 LYS HD2 H 1 1.666 0.030 . 1 . . . . . . . . 6297 1 1609 . 1 1 131 131 LYS HD3 H 1 1.666 0.030 . 1 . . . . . . . . 6297 1 1610 . 1 1 131 131 LYS CE C 13 42.267 0.300 . 1 . . . . . . . . 6297 1 1611 . 1 1 131 131 LYS HE2 H 1 2.980 0.030 . 1 . . . . . . . . 6297 1 1612 . 1 1 131 131 LYS HE3 H 1 2.980 0.030 . 1 . . . . . . . . 6297 1 1613 . 1 1 131 131 LYS C C 13 175.846 0.300 . 1 . . . . . . . . 6297 1 1614 . 1 1 132 132 SER N N 15 115.520 0.200 . 1 . . . . . . . . 6297 1 1615 . 1 1 132 132 SER H H 1 8.066 0.030 . 1 . . . . . . . . 6297 1 1616 . 1 1 132 132 SER CA C 13 58.313 0.300 . 1 . . . . . . . . 6297 1 1617 . 1 1 132 132 SER HA H 1 4.162 0.030 . 1 . . . . . . . . 6297 1 1618 . 1 1 132 132 SER CB C 13 63.787 0.300 . 1 . . . . . . . . 6297 1 1619 . 1 1 132 132 SER HB2 H 1 3.744 0.030 . 2 . . . . . . . . 6297 1 1620 . 1 1 132 132 SER HB3 H 1 3.663 0.030 . 2 . . . . . . . . 6297 1 1621 . 1 1 132 132 SER C C 13 175.852 0.300 . 1 . . . . . . . . 6297 1 1622 . 1 1 133 133 GLY N N 15 110.392 0.200 . 1 . . . . . . . . 6297 1 1623 . 1 1 133 133 GLY H H 1 8.041 0.030 . 1 . . . . . . . . 6297 1 1624 . 1 1 133 133 GLY CA C 13 44.773 0.300 . 1 . . . . . . . . 6297 1 1625 . 1 1 133 133 GLY HA2 H 1 4.028 0.030 . 1 . . . . . . . . 6297 1 1626 . 1 1 133 133 GLY HA3 H 1 4.028 0.030 . 1 . . . . . . . . 6297 1 1627 . 1 1 134 134 PRO CA C 13 63.321 0.300 . 1 . . . . . . . . 6297 1 1628 . 1 1 134 134 PRO HA H 1 4.446 0.030 . 1 . . . . . . . . 6297 1 1629 . 1 1 134 134 PRO CB C 13 32.231 0.300 . 1 . . . . . . . . 6297 1 1630 . 1 1 134 134 PRO HB2 H 1 2.287 0.030 . 1 . . . . . . . . 6297 1 1631 . 1 1 134 134 PRO HB3 H 1 2.287 0.030 . 1 . . . . . . . . 6297 1 1632 . 1 1 134 134 PRO CG C 13 27.230 0.300 . 1 . . . . . . . . 6297 1 1633 . 1 1 134 134 PRO HG2 H 1 2.005 0.030 . 1 . . . . . . . . 6297 1 1634 . 1 1 134 134 PRO HG3 H 1 2.005 0.030 . 1 . . . . . . . . 6297 1 1635 . 1 1 134 134 PRO CD C 13 49.794 0.300 . 1 . . . . . . . . 6297 1 1636 . 1 1 134 134 PRO HD2 H 1 3.601 0.030 . 2 . . . . . . . . 6297 1 1637 . 1 1 134 134 PRO HD3 H 1 3.494 0.030 . 2 . . . . . . . . 6297 1 1638 . 1 1 135 135 SER H H 1 6.478 0.030 . 1 . . . . . . . . 6297 1 1639 . 1 1 135 135 SER CA C 13 64.146 0.300 . 1 . . . . . . . . 6297 1 1640 . 1 1 135 135 SER HA H 1 3.925 0.030 . 1 . . . . . . . . 6297 1 1641 . 1 1 137 137 GLY CA C 13 46.259 0.300 . 1 . . . . . . . . 6297 1 1642 . 1 1 137 137 GLY C C 13 179.092 0.300 . 1 . . . . . . . . 6297 1 stop_ save_