data_10336 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 10336 _Entry.Title ; Solution structure of the DUF1000 domain of a thioredoxin-like protein 1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-12-09 _Entry.Accession_date 2009-12-09 _Entry.Last_release_date 2010-12-09 _Entry.Original_release_date 2010-12-09 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.14 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 A. Goroncy . K. . 10336 2 T. Kigawa . . . 10336 3 S. Koshiba . . . 10336 4 N. Kobayashi . . . 10336 5 N. Tochio . . . 10336 6 M. Inoue . . . 10336 7 S. Yokoyama . . . 10336 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'Protein 3000 Project' 'RIKEN Structural Genomics/Proteomics Initiative (RSGI)' 'RIKEN GSC' 10336 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 10336 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 752 10336 '15N chemical shifts' 183 10336 '1H chemical shifts' 1172 10336 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 . . 2010-12-09 2009-12-10 original author . 10336 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1WWY 'BMRB Entry Tracking System' 10336 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 10336 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 20455272 _Citation.Full_citation . _Citation.Title 'Solution structure of the C-terminal DUF1000 domain of the human thioredoxin-like 1 protein' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Proteins _Citation.Journal_name_full . _Citation.Journal_volume 78 _Citation.Journal_issue 9 _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 2176 _Citation.Page_last 2180 _Citation.Year 2010 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Alexander Goroncy . K. . 10336 1 2 Seizo Koshiba . . . 10336 1 3 Naoya Tochio . . . 10336 1 4 Tadashi Tomizawa . . . 10336 1 5 Makoto Inoue . . . 10336 1 6 Akiko Tanaka . . . 10336 1 7 Sumio Sugano . . . 10336 1 8 Takanori Kigawa . . . 10336 1 9 Shigeyuki Yokoyama . . . 10336 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 10336 _Assembly.ID 1 _Assembly.Name 'Thioredoxin-like protein 1' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'DUF1000 domain' 1 $entity_1 . . yes native no no . . . 10336 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . PDB 1wwy . . . . . . 10336 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 10336 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'DUF1000 domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGGYMDLMPFINKAG CECLNESDEHGFDNCLRKDT TFLESDCDEQLLITVAFNQP VKLYSMKFQGPDNGQGPKYV KIFINLPRSMDFEEAERSEP TQALELTEDDIKEDGIVPLR YVKFQNVNSVTIFVQSNQGE EETTRISYFTFIGTPVQATN MNDFKSGPSSG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 171 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1WWY . "Solution Structure Of The Duf1000 Domain Of A Thioredoxin-Li 1" . . . . . 100.00 171 100.00 100.00 1.07e-121 . . . . 10336 1 2 no DBJ BAC26626 . "unnamed protein product [Mus musculus]" . . . . . 92.40 289 98.10 99.37 3.82e-109 . . . . 10336 1 3 no DBJ BAD92500 . "thioredoxin-like 1 variant [Homo sapiens]" . . . . . 92.40 280 100.00 100.00 7.59e-111 . . . . 10336 1 4 no DBJ BAE25774 . "unnamed protein product [Mus musculus]" . . . . . 87.13 301 97.99 99.33 1.67e-101 . . . . 10336 1 5 no DBJ BAE29469 . "unnamed protein product [Mus musculus]" . . . . . 92.40 289 98.10 99.37 3.82e-109 . . . . 10336 1 6 no DBJ BAE29934 . "unnamed protein product [Mus musculus]" . . . . . 92.40 289 98.10 99.37 3.54e-109 . . . . 10336 1 7 no GB AAC05830 . "thioredoxin homolog [Homo sapiens]" . . . . . 92.40 289 100.00 100.00 1.17e-110 . . . . 10336 1 8 no GB AAC39599 . "thioredoxin-like protein [Homo sapiens]" . . . . . 92.40 289 100.00 100.00 1.17e-110 . . . . 10336 1 9 no GB AAC39898 . "thioredoxin-related protein [Homo sapiens]" . . . . . 92.40 289 100.00 100.00 1.17e-110 . . . . 10336 1 10 no GB AAC40183 . "thioredoxin-related protein [Mus musculus]" . . . . . 92.40 289 97.47 98.73 2.16e-108 . . . . 10336 1 11 no GB AAF66676 . "thioredoxin-like protein [Homo sapiens]" . . . . . 92.40 289 100.00 100.00 1.17e-110 . . . . 10336 1 12 no REF NP_001071354 . "thioredoxin-like protein 1 [Bos taurus]" . . . . . 92.40 289 99.37 99.37 5.55e-110 . . . . 10336 1 13 no REF NP_001131150 . "uncharacterized protein LOC100192458 [Zea mays]" . . . . . 92.40 289 98.10 99.37 6.04e-109 . . . . 10336 1 14 no REF NP_001231205 . "thioredoxin-like protein 1 [Sus scrofa]" . . . . . 92.40 289 99.37 99.37 6.40e-110 . . . . 10336 1 15 no REF NP_001248637 . "thioredoxin-like protein 1 [Macaca mulatta]" . . . . . 92.40 289 100.00 100.00 1.01e-110 . . . . 10336 1 16 no REF NP_004777 . "thioredoxin-like protein 1 [Homo sapiens]" . . . . . 92.40 289 100.00 100.00 1.17e-110 . . . . 10336 1 17 no SP O43396 . "RecName: Full=Thioredoxin-like protein 1; AltName: Full=32 kDa thioredoxin-related protein" . . . . . 92.40 289 100.00 100.00 1.17e-110 . . . . 10336 1 18 no SP Q8CDN6 . "RecName: Full=Thioredoxin-like protein 1; AltName: Full=32 kDa thioredoxin-related protein" . . . . . 92.40 289 98.10 99.37 3.82e-109 . . . . 10336 1 19 no SP Q920J4 . "RecName: Full=Thioredoxin-like protein 1; AltName: Full=Thioredoxin-related protein" . . . . . 92.40 289 98.10 99.37 6.04e-109 . . . . 10336 1 20 no TPG DAA15792 . "TPA: thioredoxin-like 1 [Bos taurus]" . . . . . 92.40 289 99.37 99.37 6.40e-110 . . . . 10336 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'DUF1000 domain' . 10336 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 . 10336 1 2 . SER . 10336 1 3 . SER . 10336 1 4 . GLY . 10336 1 5 . SER . 10336 1 6 . SER . 10336 1 7 . GLY . 10336 1 8 . GLY . 10336 1 9 . TYR . 10336 1 10 . MET . 10336 1 11 . ASP . 10336 1 12 . LEU . 10336 1 13 . MET . 10336 1 14 . PRO . 10336 1 15 . PHE . 10336 1 16 . ILE . 10336 1 17 . ASN . 10336 1 18 . LYS . 10336 1 19 . ALA . 10336 1 20 . GLY . 10336 1 21 . CYS . 10336 1 22 . GLU . 10336 1 23 . CYS . 10336 1 24 . LEU . 10336 1 25 . ASN . 10336 1 26 . GLU . 10336 1 27 . SER . 10336 1 28 . ASP . 10336 1 29 . GLU . 10336 1 30 . HIS . 10336 1 31 . GLY . 10336 1 32 . PHE . 10336 1 33 . ASP . 10336 1 34 . ASN . 10336 1 35 . CYS . 10336 1 36 . LEU . 10336 1 37 . ARG . 10336 1 38 . LYS . 10336 1 39 . ASP . 10336 1 40 . THR . 10336 1 41 . THR . 10336 1 42 . PHE . 10336 1 43 . LEU . 10336 1 44 . GLU . 10336 1 45 . SER . 10336 1 46 . ASP . 10336 1 47 . CYS . 10336 1 48 . ASP . 10336 1 49 . GLU . 10336 1 50 . GLN . 10336 1 51 . LEU . 10336 1 52 . LEU . 10336 1 53 . ILE . 10336 1 54 . THR . 10336 1 55 . VAL . 10336 1 56 . ALA . 10336 1 57 . PHE . 10336 1 58 . ASN . 10336 1 59 . GLN . 10336 1 60 . PRO . 10336 1 61 . VAL . 10336 1 62 . LYS . 10336 1 63 . LEU . 10336 1 64 . TYR . 10336 1 65 . SER . 10336 1 66 . MET . 10336 1 67 . LYS . 10336 1 68 . PHE . 10336 1 69 . GLN . 10336 1 70 . GLY . 10336 1 71 . PRO . 10336 1 72 . ASP . 10336 1 73 . ASN . 10336 1 74 . GLY . 10336 1 75 . GLN . 10336 1 76 . GLY . 10336 1 77 . PRO . 10336 1 78 . LYS . 10336 1 79 . TYR . 10336 1 80 . VAL . 10336 1 81 . LYS . 10336 1 82 . ILE . 10336 1 83 . PHE . 10336 1 84 . ILE . 10336 1 85 . ASN . 10336 1 86 . LEU . 10336 1 87 . PRO . 10336 1 88 . ARG . 10336 1 89 . SER . 10336 1 90 . MET . 10336 1 91 . ASP . 10336 1 92 . PHE . 10336 1 93 . GLU . 10336 1 94 . GLU . 10336 1 95 . ALA . 10336 1 96 . GLU . 10336 1 97 . ARG . 10336 1 98 . SER . 10336 1 99 . GLU . 10336 1 100 . PRO . 10336 1 101 . THR . 10336 1 102 . GLN . 10336 1 103 . ALA . 10336 1 104 . LEU . 10336 1 105 . GLU . 10336 1 106 . LEU . 10336 1 107 . THR . 10336 1 108 . GLU . 10336 1 109 . ASP . 10336 1 110 . ASP . 10336 1 111 . ILE . 10336 1 112 . LYS . 10336 1 113 . GLU . 10336 1 114 . ASP . 10336 1 115 . GLY . 10336 1 116 . ILE . 10336 1 117 . VAL . 10336 1 118 . PRO . 10336 1 119 . LEU . 10336 1 120 . ARG . 10336 1 121 . TYR . 10336 1 122 . VAL . 10336 1 123 . LYS . 10336 1 124 . PHE . 10336 1 125 . GLN . 10336 1 126 . ASN . 10336 1 127 . VAL . 10336 1 128 . ASN . 10336 1 129 . SER . 10336 1 130 . VAL . 10336 1 131 . THR . 10336 1 132 . ILE . 10336 1 133 . PHE . 10336 1 134 . VAL . 10336 1 135 . GLN . 10336 1 136 . SER . 10336 1 137 . ASN . 10336 1 138 . GLN . 10336 1 139 . GLY . 10336 1 140 . GLU . 10336 1 141 . GLU . 10336 1 142 . GLU . 10336 1 143 . THR . 10336 1 144 . THR . 10336 1 145 . ARG . 10336 1 146 . ILE . 10336 1 147 . SER . 10336 1 148 . TYR . 10336 1 149 . PHE . 10336 1 150 . THR . 10336 1 151 . PHE . 10336 1 152 . ILE . 10336 1 153 . GLY . 10336 1 154 . THR . 10336 1 155 . PRO . 10336 1 156 . VAL . 10336 1 157 . GLN . 10336 1 158 . ALA . 10336 1 159 . THR . 10336 1 160 . ASN . 10336 1 161 . MET . 10336 1 162 . ASN . 10336 1 163 . ASP . 10336 1 164 . PHE . 10336 1 165 . LYS . 10336 1 166 . SER . 10336 1 167 . GLY . 10336 1 168 . PRO . 10336 1 169 . SER . 10336 1 170 . SER . 10336 1 171 . GLY . 10336 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 10336 1 . SER 2 2 10336 1 . SER 3 3 10336 1 . GLY 4 4 10336 1 . SER 5 5 10336 1 . SER 6 6 10336 1 . GLY 7 7 10336 1 . GLY 8 8 10336 1 . TYR 9 9 10336 1 . MET 10 10 10336 1 . ASP 11 11 10336 1 . LEU 12 12 10336 1 . MET 13 13 10336 1 . PRO 14 14 10336 1 . PHE 15 15 10336 1 . ILE 16 16 10336 1 . ASN 17 17 10336 1 . LYS 18 18 10336 1 . ALA 19 19 10336 1 . GLY 20 20 10336 1 . CYS 21 21 10336 1 . GLU 22 22 10336 1 . CYS 23 23 10336 1 . LEU 24 24 10336 1 . ASN 25 25 10336 1 . GLU 26 26 10336 1 . SER 27 27 10336 1 . ASP 28 28 10336 1 . GLU 29 29 10336 1 . HIS 30 30 10336 1 . GLY 31 31 10336 1 . PHE 32 32 10336 1 . ASP 33 33 10336 1 . ASN 34 34 10336 1 . CYS 35 35 10336 1 . LEU 36 36 10336 1 . ARG 37 37 10336 1 . LYS 38 38 10336 1 . ASP 39 39 10336 1 . THR 40 40 10336 1 . THR 41 41 10336 1 . PHE 42 42 10336 1 . LEU 43 43 10336 1 . GLU 44 44 10336 1 . SER 45 45 10336 1 . ASP 46 46 10336 1 . CYS 47 47 10336 1 . ASP 48 48 10336 1 . GLU 49 49 10336 1 . GLN 50 50 10336 1 . LEU 51 51 10336 1 . LEU 52 52 10336 1 . ILE 53 53 10336 1 . THR 54 54 10336 1 . VAL 55 55 10336 1 . ALA 56 56 10336 1 . PHE 57 57 10336 1 . ASN 58 58 10336 1 . GLN 59 59 10336 1 . PRO 60 60 10336 1 . VAL 61 61 10336 1 . LYS 62 62 10336 1 . LEU 63 63 10336 1 . TYR 64 64 10336 1 . SER 65 65 10336 1 . MET 66 66 10336 1 . LYS 67 67 10336 1 . PHE 68 68 10336 1 . GLN 69 69 10336 1 . GLY 70 70 10336 1 . PRO 71 71 10336 1 . ASP 72 72 10336 1 . ASN 73 73 10336 1 . GLY 74 74 10336 1 . GLN 75 75 10336 1 . GLY 76 76 10336 1 . PRO 77 77 10336 1 . LYS 78 78 10336 1 . TYR 79 79 10336 1 . VAL 80 80 10336 1 . LYS 81 81 10336 1 . ILE 82 82 10336 1 . PHE 83 83 10336 1 . ILE 84 84 10336 1 . ASN 85 85 10336 1 . LEU 86 86 10336 1 . PRO 87 87 10336 1 . ARG 88 88 10336 1 . SER 89 89 10336 1 . MET 90 90 10336 1 . ASP 91 91 10336 1 . PHE 92 92 10336 1 . GLU 93 93 10336 1 . GLU 94 94 10336 1 . ALA 95 95 10336 1 . GLU 96 96 10336 1 . ARG 97 97 10336 1 . SER 98 98 10336 1 . GLU 99 99 10336 1 . PRO 100 100 10336 1 . THR 101 101 10336 1 . GLN 102 102 10336 1 . ALA 103 103 10336 1 . LEU 104 104 10336 1 . GLU 105 105 10336 1 . LEU 106 106 10336 1 . THR 107 107 10336 1 . GLU 108 108 10336 1 . ASP 109 109 10336 1 . ASP 110 110 10336 1 . ILE 111 111 10336 1 . LYS 112 112 10336 1 . GLU 113 113 10336 1 . ASP 114 114 10336 1 . GLY 115 115 10336 1 . ILE 116 116 10336 1 . VAL 117 117 10336 1 . PRO 118 118 10336 1 . LEU 119 119 10336 1 . ARG 120 120 10336 1 . TYR 121 121 10336 1 . VAL 122 122 10336 1 . LYS 123 123 10336 1 . PHE 124 124 10336 1 . GLN 125 125 10336 1 . ASN 126 126 10336 1 . VAL 127 127 10336 1 . ASN 128 128 10336 1 . SER 129 129 10336 1 . VAL 130 130 10336 1 . THR 131 131 10336 1 . ILE 132 132 10336 1 . PHE 133 133 10336 1 . VAL 134 134 10336 1 . GLN 135 135 10336 1 . SER 136 136 10336 1 . ASN 137 137 10336 1 . GLN 138 138 10336 1 . GLY 139 139 10336 1 . GLU 140 140 10336 1 . GLU 141 141 10336 1 . GLU 142 142 10336 1 . THR 143 143 10336 1 . THR 144 144 10336 1 . ARG 145 145 10336 1 . ILE 146 146 10336 1 . SER 147 147 10336 1 . TYR 148 148 10336 1 . PHE 149 149 10336 1 . THR 150 150 10336 1 . PHE 151 151 10336 1 . ILE 152 152 10336 1 . GLY 153 153 10336 1 . THR 154 154 10336 1 . PRO 155 155 10336 1 . VAL 156 156 10336 1 . GLN 157 157 10336 1 . ALA 158 158 10336 1 . THR 159 159 10336 1 . ASN 160 160 10336 1 . MET 161 161 10336 1 . ASN 162 162 10336 1 . ASP 163 163 10336 1 . PHE 164 164 10336 1 . LYS 165 165 10336 1 . SER 166 166 10336 1 . GLY 167 167 10336 1 . PRO 168 168 10336 1 . SER 169 169 10336 1 . SER 170 170 10336 1 . GLY 171 171 10336 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 10336 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 . . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 10336 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 10336 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'Cell free synthesis' . . . . . . . . . . . . . . . . . . . plasmid . . P040621-12 . . . . . . 10336 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 10336 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1.02mM DUF1000 domain (15N, 13C -labeled), 20mM Tris-d11-HCl, 100mM NaCl, 1mM d-DTT, 0.02% NaN3' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O, 10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'DUF1000 domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.02 . . mM . . . . 10336 1 2 Tris-d11-HCl . . . . . . buffer 20 . . mM . . . . 10336 1 3 NaCl . . . . . . salt 100 . . mM . . . . 10336 1 4 d-DTT . . . . . . salt 1 . . mM . . . . 10336 1 5 NaN3 . . . . . . salt 0.02 . . % . . . . 10336 1 6 H2O . . . . . . solvent 90 . . % . . . . 10336 1 7 D2O . . . . . . solvent 10 . . % . . . . 10336 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 10336 _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 . mM 10336 1 pH 7.0 . pH 10336 1 pressure 1 . atm 10336 1 temperature 298 . K 10336 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 10336 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 10336 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 10336 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 10336 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20020425 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'FRANK DELAGLIO' . . 10336 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 10336 2 stop_ save_ save_NMRVIEW _Software.Sf_category software _Software.Sf_framecode NMRVIEW _Software.Entry_ID 10336 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'BRUCE A. JOHNSON' . . 10336 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10336 3 stop_ save_ save_KUJIRA _Software.Sf_category software _Software.Sf_framecode KUJIRA _Software.Entry_ID 10336 _Software.ID 4 _Software.Name Kujira _Software.Version 0.896 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'NAOHIRO KOBAYASHI' . . 10336 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10336 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 10336 _Software.ID 5 _Software.Name CYANA _Software.Version 2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'PETER GUENTERT' . . 10336 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 10336 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 10336 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 10336 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker AVANCE . 900 . . . 10336 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 10336 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 3 CBCACONH yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 4 CCCONNH yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 5 'CCH TOCSY' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 6 HBHACONH yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 7 HCCCONNH yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 8 'HCCH COSY' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 9 'HCCH TOCSY' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 10 '3D HNCA' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 11 '3D HNCACB' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 12 '3D HNCACO' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 13 '3D HNCO' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 14 '3D HNCOCA' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 15 'C13 HSQC' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 16 'N15 HSQC' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 17 '3D 1H-13C NOESY-HSQC' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 18 '3D 1H-15N NOESY-HSQC' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10336 1 stop_ save_ save_NMR_spectrometer_expt_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_1 _NMR_spec_expt.Entry_ID 10336 _NMR_spec_expt.ID 1 _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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _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 . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_cbcaconh.fid/14/ . . . . . . . 10336 1 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_cbcaconh.fid/14/ . . . . . . . 10336 1 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_cbcaconh.fid/14/ . . . . . . . 10336 1 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_cbcaconh.fid/14/ . . . . . . . 10336 1 stop_ save_ save_NMR_spectrometer_expt_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_2 _NMR_spec_expt.Entry_ID 10336 _NMR_spec_expt.ID 2 _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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _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 . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_ccconnh.fid/44/ . . . . . . . 10336 2 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_ccconnh.fid/44/ . . . . . . . 10336 2 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_ccconnh.fid/44/ . . . . . . . 10336 2 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_ccconnh.fid/44/ . . . . . . . 10336 2 stop_ save_ save_NMR_spectrometer_expt_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_3 _NMR_spec_expt.Entry_ID 10336 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name 'CCH TOCSY' _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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _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 . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_cchtocsy.fid/46/ . . . . . . . 10336 3 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_cchtocsy.fid/46/ . . . . . . . 10336 3 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_cchtocsy.fid/46/ . . . . . . . 10336 3 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_cchtocsy.fid/46/ . . . . . . . 10336 3 stop_ save_ save_NMR_spectrometer_expt_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_4 _NMR_spec_expt.Entry_ID 10336 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name HBHACONH _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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _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 . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hbhaconh.fid/30/ . . . . . . . 10336 4 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hbhaconh.fid/30/ . . . . . . . 10336 4 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hbhaconh.fid/30/ . . . . . . . 10336 4 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hbhaconh.fid/30/ . . . . . . . 10336 4 stop_ save_ save_NMR_spectrometer_expt_5 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_5 _NMR_spec_expt.Entry_ID 10336 _NMR_spec_expt.ID 5 _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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _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 . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hccconnh.fid/32/ . . . . . . . 10336 5 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hccconnh.fid/32/ . . . . . . . 10336 5 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hccconnh.fid/32/ . . . . . . . 10336 5 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hccconnh.fid/32/ . . . . . . . 10336 5 stop_ save_ save_NMR_spectrometer_expt_6 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_6 _NMR_spec_expt.Entry_ID 10336 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name 'HCCH COSY' _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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _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 . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hcchcosya.fid/42/ . . . . . . . 10336 6 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hcchcosya.fid/42/ . . . . . . . 10336 6 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hcchcosya.fid/42/ . . . . . . . 10336 6 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hcchcosya.fid/42/ . . . . . . . 10336 6 stop_ save_ save_NMR_spectrometer_expt_7 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_7 _NMR_spec_expt.Entry_ID 10336 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name 'HCCH TOCSY' _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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _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 . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hcchtocsy.fid/50/ . . . . . . . 10336 7 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hcchtocsy.fid/50/ . . . . . . . 10336 7 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hcchtocsy.fid/50/ . . . . . . . 10336 7 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hcchtocsy.fid/50/ . . . . . . . 10336 7 stop_ save_ save_NMR_spectrometer_expt_8 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_8 _NMR_spec_expt.Entry_ID 10336 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name '3D 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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _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 . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hnca.fid/22/ . . . . . . . 10336 8 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hnca.fid/22/ . . . . . . . 10336 8 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hnca.fid/22/ . . . . . . . 10336 8 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hnca.fid/22/ . . . . . . . 10336 8 stop_ save_ save_NMR_spectrometer_expt_9 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_9 _NMR_spec_expt.Entry_ID 10336 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name '3D 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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _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 . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hncacb.fid/12/ . . . . . . . 10336 9 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hncacb.fid/12/ . . . . . . . 10336 9 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hncacb.fid/12/ . . . . . . . 10336 9 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hncacb.fid/12/ . . . . . . . 10336 9 stop_ save_ save_NMR_spectrometer_expt_10 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_10 _NMR_spec_expt.Entry_ID 10336 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name '3D 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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _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 . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hncaco.fid/20/ . . . . . . . 10336 10 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hncaco.fid/20/ . . . . . . . 10336 10 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hncaco.fid/20/ . . . . . . . 10336 10 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hncaco.fid/20/ . . . . . . . 10336 10 stop_ save_ save_NMR_spectrometer_expt_11 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_11 _NMR_spec_expt.Entry_ID 10336 _NMR_spec_expt.ID 11 _NMR_spec_expt.Name '3D 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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _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 . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hnco.fid/10/ . . . . . . . 10336 11 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hnco.fid/10/ . . . . . . . 10336 11 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hnco.fid/10/ . . . . . . . 10336 11 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hnco.fid/10/ . . . . . . . 10336 11 stop_ save_ save_NMR_spectrometer_expt_12 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_12 _NMR_spec_expt.Entry_ID 10336 _NMR_spec_expt.ID 12 _NMR_spec_expt.Name '3D HNCOCA' _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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _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 . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hncoca.fid/40/ . . . . . . . 10336 12 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hncoca.fid/40/ . . . . . . . 10336 12 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hncoca.fid/40/ . . . . . . . 10336 12 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hncoca.fid/40/ . . . . . . . 10336 12 stop_ save_ save_NMR_spectrometer_expt_13 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_13 _NMR_spec_expt.Entry_ID 10336 _NMR_spec_expt.ID 13 _NMR_spec_expt.Name 'C13 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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _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 . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hsqcCa.fid/24/ . . . . . . . 10336 13 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hsqcCa.fid/24/ . . . . . . . 10336 13 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hsqcCa.fid/24/ . . . . . . . 10336 13 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hsqcCa.fid/24/ . . . . . . . 10336 13 stop_ save_ save_NMR_spectrometer_expt_14 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_14 _NMR_spec_expt.Entry_ID 10336 _NMR_spec_expt.ID 14 _NMR_spec_expt.Name 'N15 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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _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 . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hsqcN.fid/2/ . . . . . . . 10336 14 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hsqcN.fid/2/ . . . . . . . 10336 14 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hsqcN.fid/2/ . . . . . . . 10336 14 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_hsqcN.fid/2/ . . . . . . . 10336 14 stop_ save_ save_NMR_spectrometer_expt_15 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_15 _NMR_spec_expt.Entry_ID 10336 _NMR_spec_expt.ID 15 _NMR_spec_expt.Name '3D 1H-13C NOESY-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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _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 . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_noehsqcCw.fid/7/ . . . . . . . 10336 15 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_noehsqcCw.fid/7/ . . . . . . . 10336 15 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_noehsqcCw.fid/7/ . . . . . . . 10336 15 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_noehsqcCw.fid/7/ . . . . . . . 10336 15 stop_ save_ save_NMR_spectrometer_expt_16 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_16 _NMR_spec_expt.Entry_ID 10336 _NMR_spec_expt.ID 16 _NMR_spec_expt.Name '3D 1H-15N NOESY-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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _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 . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_noehsqcN.fid/12/ . . . . . . . 10336 16 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_noehsqcN.fid/12/ . . . . . . . 10336 16 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_noehsqcN.fid/12/ . . . . . . . 10336 16 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr10336/timedomain_data/duf1000_noehsqcN.fid/12/ . . . . . . . 10336 16 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 10336 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 10336 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 10336 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 10336 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 10336 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10336 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 10336 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $XWINNMR . . 10336 1 2 $NMRPipe . . 10336 1 3 $NMRVIEW . . 10336 1 4 $KUJIRA . . 10336 1 5 $CYANA . . 10336 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLY HA2 H 1 3.813 0.030 . 1 . . . . 1 GLY HA2 . 10336 1 2 . 1 1 1 1 GLY HA3 H 1 3.813 0.030 . 1 . . . . 1 GLY HA3 . 10336 1 3 . 1 1 1 1 GLY CA C 13 43.923 0.300 . 1 . . . . 1 GLY CA . 10336 1 4 . 1 1 2 2 SER H H 1 8.251 0.030 . 1 . . . . 2 SER H . 10336 1 5 . 1 1 2 2 SER HA H 1 4.280 0.030 . 1 . . . . 2 SER HA . 10336 1 6 . 1 1 2 2 SER HB2 H 1 3.817 0.030 . 1 . . . . 2 SER HB2 . 10336 1 7 . 1 1 2 2 SER HB3 H 1 3.817 0.030 . 1 . . . . 2 SER HB3 . 10336 1 8 . 1 1 2 2 SER C C 13 174.129 0.300 . 1 . . . . 2 SER C . 10336 1 9 . 1 1 2 2 SER CA C 13 56.292 0.300 . 1 . . . . 2 SER CA . 10336 1 10 . 1 1 2 2 SER CB C 13 63.918 0.300 . 1 . . . . 2 SER CB . 10336 1 11 . 1 1 3 3 SER H H 1 8.359 0.030 . 1 . . . . 3 SER H . 10336 1 12 . 1 1 3 3 SER HA H 1 4.290 0.030 . 1 . . . . 3 SER HA . 10336 1 13 . 1 1 3 3 SER C C 13 174.636 0.300 . 1 . . . . 3 SER C . 10336 1 14 . 1 1 3 3 SER CA C 13 55.185 0.300 . 1 . . . . 3 SER CA . 10336 1 15 . 1 1 3 3 SER CB C 13 59.613 0.300 . 1 . . . . 3 SER CB . 10336 1 16 . 1 1 3 3 SER N N 15 123.685 0.300 . 1 . . . . 3 SER N . 10336 1 17 . 1 1 4 4 GLY HA2 H 1 3.910 0.030 . 1 . . . . 4 GLY HA2 . 10336 1 18 . 1 1 4 4 GLY HA3 H 1 3.910 0.030 . 1 . . . . 4 GLY HA3 . 10336 1 19 . 1 1 4 4 GLY C C 13 174.481 0.300 . 1 . . . . 4 GLY C . 10336 1 20 . 1 1 4 4 GLY CA C 13 45.360 0.300 . 1 . . . . 4 GLY CA . 10336 1 21 . 1 1 5 5 SER H H 1 8.239 0.030 . 1 . . . . 5 SER H . 10336 1 22 . 1 1 5 5 SER HA H 1 4.266 0.030 . 1 . . . . 5 SER HA . 10336 1 23 . 1 1 5 5 SER C C 13 174.429 0.300 . 1 . . . . 5 SER C . 10336 1 24 . 1 1 5 5 SER CA C 13 62.073 0.300 . 1 . . . . 5 SER CA . 10336 1 25 . 1 1 5 5 SER N N 15 108.603 0.300 . 1 . . . . 5 SER N . 10336 1 26 . 1 1 6 6 SER H H 1 8.315 0.030 . 1 . . . . 6 SER H . 10336 1 27 . 1 1 6 6 SER HA H 1 4.247 0.030 . 1 . . . . 6 SER HA . 10336 1 28 . 1 1 6 6 SER HB2 H 1 4.089 0.030 . 1 . . . . 6 SER HB2 . 10336 1 29 . 1 1 6 6 SER HB3 H 1 4.089 0.030 . 1 . . . . 6 SER HB3 . 10336 1 30 . 1 1 6 6 SER C C 13 175.523 0.300 . 1 . . . . 6 SER C . 10336 1 31 . 1 1 6 6 SER CA C 13 52.725 0.300 . 1 . . . . 6 SER CA . 10336 1 32 . 1 1 6 6 SER CB C 13 61.212 0.300 . 1 . . . . 6 SER CB . 10336 1 33 . 1 1 6 6 SER N N 15 122.596 0.300 . 1 . . . . 6 SER N . 10336 1 34 . 1 1 7 7 GLY H H 1 8.365 0.030 . 1 . . . . 7 GLY H . 10336 1 35 . 1 1 7 7 GLY HA2 H 1 3.779 0.030 . 1 . . . . 7 GLY HA2 . 10336 1 36 . 1 1 7 7 GLY HA3 H 1 3.779 0.030 . 1 . . . . 7 GLY HA3 . 10336 1 37 . 1 1 7 7 GLY C C 13 174.036 0.300 . 1 . . . . 7 GLY C . 10336 1 38 . 1 1 7 7 GLY CA C 13 45.345 0.300 . 1 . . . . 7 GLY CA . 10336 1 39 . 1 1 8 8 GLY H H 1 7.937 0.030 . 1 . . . . 8 GLY H . 10336 1 40 . 1 1 8 8 GLY HA2 H 1 3.632 0.030 . 1 . . . . 8 GLY HA2 . 10336 1 41 . 1 1 8 8 GLY HA3 H 1 3.632 0.030 . 1 . . . . 8 GLY HA3 . 10336 1 42 . 1 1 8 8 GLY C C 13 173.550 0.300 . 1 . . . . 8 GLY C . 10336 1 43 . 1 1 8 8 GLY CA C 13 44.880 0.300 . 1 . . . . 8 GLY CA . 10336 1 44 . 1 1 8 8 GLY N N 15 107.981 0.300 . 1 . . . . 8 GLY N . 10336 1 45 . 1 1 9 9 TYR H H 1 7.580 0.030 . 1 . . . . 9 TYR H . 10336 1 46 . 1 1 9 9 TYR HA H 1 4.575 0.030 . 1 . . . . 9 TYR HA . 10336 1 47 . 1 1 9 9 TYR HB2 H 1 2.969 0.030 . 2 . . . . 9 TYR HB2 . 10336 1 48 . 1 1 9 9 TYR HB3 H 1 2.576 0.030 . 2 . . . . 9 TYR HB3 . 10336 1 49 . 1 1 9 9 TYR HD1 H 1 6.568 0.030 . 1 . . . . 9 TYR HD1 . 10336 1 50 . 1 1 9 9 TYR HD2 H 1 6.568 0.030 . 1 . . . . 9 TYR HD2 . 10336 1 51 . 1 1 9 9 TYR HE1 H 1 6.110 0.030 . 1 . . . . 9 TYR HE1 . 10336 1 52 . 1 1 9 9 TYR HE2 H 1 6.110 0.030 . 1 . . . . 9 TYR HE2 . 10336 1 53 . 1 1 9 9 TYR C C 13 174.972 0.300 . 1 . . . . 9 TYR C . 10336 1 54 . 1 1 9 9 TYR CA C 13 56.769 0.300 . 1 . . . . 9 TYR CA . 10336 1 55 . 1 1 9 9 TYR CB C 13 39.196 0.300 . 1 . . . . 9 TYR CB . 10336 1 56 . 1 1 9 9 TYR CD1 C 13 131.565 0.300 . 1 . . . . 9 TYR CD1 . 10336 1 57 . 1 1 9 9 TYR CD2 C 13 131.565 0.300 . 1 . . . . 9 TYR CD2 . 10336 1 58 . 1 1 9 9 TYR CE1 C 13 117.789 0.300 . 1 . . . . 9 TYR CE1 . 10336 1 59 . 1 1 9 9 TYR CE2 C 13 117.789 0.300 . 1 . . . . 9 TYR CE2 . 10336 1 60 . 1 1 9 9 TYR N N 15 118.864 0.300 . 1 . . . . 9 TYR N . 10336 1 61 . 1 1 10 10 MET H H 1 9.472 0.030 . 1 . . . . 10 MET H . 10336 1 62 . 1 1 10 10 MET HA H 1 4.925 0.030 . 1 . . . . 10 MET HA . 10336 1 63 . 1 1 10 10 MET HB2 H 1 2.238 0.030 . 2 . . . . 10 MET HB2 . 10336 1 64 . 1 1 10 10 MET HB3 H 1 2.088 0.030 . 2 . . . . 10 MET HB3 . 10336 1 65 . 1 1 10 10 MET HE1 H 1 2.185 0.030 . 1 . . . . 10 MET HE . 10336 1 66 . 1 1 10 10 MET HE2 H 1 2.185 0.030 . 1 . . . . 10 MET HE . 10336 1 67 . 1 1 10 10 MET HE3 H 1 2.185 0.030 . 1 . . . . 10 MET HE . 10336 1 68 . 1 1 10 10 MET HG2 H 1 2.363 0.030 . 2 . . . . 10 MET HG2 . 10336 1 69 . 1 1 10 10 MET HG3 H 1 2.807 0.030 . 2 . . . . 10 MET HG3 . 10336 1 70 . 1 1 10 10 MET C C 13 174.525 0.300 . 1 . . . . 10 MET C . 10336 1 71 . 1 1 10 10 MET CA C 13 54.201 0.300 . 1 . . . . 10 MET CA . 10336 1 72 . 1 1 10 10 MET CB C 13 36.859 0.300 . 1 . . . . 10 MET CB . 10336 1 73 . 1 1 10 10 MET CE C 13 16.811 0.300 . 1 . . . . 10 MET CE . 10336 1 74 . 1 1 10 10 MET CG C 13 29.971 0.300 . 1 . . . . 10 MET CG . 10336 1 75 . 1 1 10 10 MET N N 15 118.708 0.300 . 1 . . . . 10 MET N . 10336 1 76 . 1 1 11 11 ASP H H 1 8.534 0.030 . 1 . . . . 11 ASP H . 10336 1 77 . 1 1 11 11 ASP HA H 1 4.691 0.030 . 1 . . . . 11 ASP HA . 10336 1 78 . 1 1 11 11 ASP HB2 H 1 2.845 0.030 . 2 . . . . 11 ASP HB2 . 10336 1 79 . 1 1 11 11 ASP HB3 H 1 2.662 0.030 . 2 . . . . 11 ASP HB3 . 10336 1 80 . 1 1 11 11 ASP C C 13 177.468 0.300 . 1 . . . . 11 ASP C . 10336 1 81 . 1 1 11 11 ASP CA C 13 54.913 0.300 . 1 . . . . 11 ASP CA . 10336 1 82 . 1 1 11 11 ASP CB C 13 41.041 0.300 . 1 . . . . 11 ASP CB . 10336 1 83 . 1 1 11 11 ASP N N 15 120.963 0.300 . 1 . . . . 11 ASP N . 10336 1 84 . 1 1 12 12 LEU H H 1 9.066 0.030 . 1 . . . . 12 LEU H . 10336 1 85 . 1 1 12 12 LEU HA H 1 4.744 0.030 . 1 . . . . 12 LEU HA . 10336 1 86 . 1 1 12 12 LEU HB2 H 1 1.864 0.030 . 2 . . . . 12 LEU HB2 . 10336 1 87 . 1 1 12 12 LEU HB3 H 1 1.769 0.030 . 2 . . . . 12 LEU HB3 . 10336 1 88 . 1 1 12 12 LEU HD11 H 1 0.444 0.030 . 1 . . . . 12 LEU HD1 . 10336 1 89 . 1 1 12 12 LEU HD12 H 1 0.444 0.030 . 1 . . . . 12 LEU HD1 . 10336 1 90 . 1 1 12 12 LEU HD13 H 1 0.444 0.030 . 1 . . . . 12 LEU HD1 . 10336 1 91 . 1 1 12 12 LEU HD21 H 1 0.480 0.030 . 1 . . . . 12 LEU HD2 . 10336 1 92 . 1 1 12 12 LEU HD22 H 1 0.480 0.030 . 1 . . . . 12 LEU HD2 . 10336 1 93 . 1 1 12 12 LEU HD23 H 1 0.480 0.030 . 1 . . . . 12 LEU HD2 . 10336 1 94 . 1 1 12 12 LEU HG H 1 1.835 0.030 . 1 . . . . 12 LEU HG . 10336 1 95 . 1 1 12 12 LEU C C 13 177.451 0.300 . 1 . . . . 12 LEU C . 10336 1 96 . 1 1 12 12 LEU CA C 13 54.505 0.300 . 1 . . . . 12 LEU CA . 10336 1 97 . 1 1 12 12 LEU CB C 13 42.394 0.300 . 1 . . . . 12 LEU CB . 10336 1 98 . 1 1 12 12 LEU CD1 C 13 26.773 0.300 . 2 . . . . 12 LEU CD1 . 10336 1 99 . 1 1 12 12 LEU CD2 C 13 21.989 0.300 . 2 . . . . 12 LEU CD2 . 10336 1 100 . 1 1 12 12 LEU CG C 13 26.158 0.300 . 1 . . . . 12 LEU CG . 10336 1 101 . 1 1 12 12 LEU N N 15 125.705 0.300 . 1 . . . . 12 LEU N . 10336 1 102 . 1 1 13 13 MET H H 1 8.675 0.030 . 1 . . . . 13 MET H . 10336 1 103 . 1 1 13 13 MET HA H 1 4.497 0.030 . 1 . . . . 13 MET HA . 10336 1 104 . 1 1 13 13 MET HB2 H 1 2.073 0.030 . 2 . . . . 13 MET HB2 . 10336 1 105 . 1 1 13 13 MET HB3 H 1 2.614 0.030 . 2 . . . . 13 MET HB3 . 10336 1 106 . 1 1 13 13 MET HE1 H 1 2.122 0.030 . 1 . . . . 13 MET HE . 10336 1 107 . 1 1 13 13 MET HE2 H 1 2.122 0.030 . 1 . . . . 13 MET HE . 10336 1 108 . 1 1 13 13 MET HE3 H 1 2.122 0.030 . 1 . . . . 13 MET HE . 10336 1 109 . 1 1 13 13 MET HG2 H 1 2.700 0.030 . 2 . . . . 13 MET HG2 . 10336 1 110 . 1 1 13 13 MET HG3 H 1 2.804 0.030 . 2 . . . . 13 MET HG3 . 10336 1 111 . 1 1 13 13 MET C C 13 175.994 0.300 . 1 . . . . 13 MET C . 10336 1 112 . 1 1 13 13 MET CA C 13 59.966 0.300 . 1 . . . . 13 MET CA . 10336 1 113 . 1 1 13 13 MET CB C 13 29.113 0.300 . 1 . . . . 13 MET CB . 10336 1 114 . 1 1 13 13 MET CE C 13 17.180 0.300 . 1 . . . . 13 MET CE . 10336 1 115 . 1 1 13 13 MET CG C 13 32.205 0.300 . 1 . . . . 13 MET CG . 10336 1 116 . 1 1 13 13 MET N N 15 123.373 0.300 . 1 . . . . 13 MET N . 10336 1 117 . 1 1 14 14 PRO HA H 1 4.346 0.030 . 1 . . . . 14 PRO HA . 10336 1 118 . 1 1 14 14 PRO HB2 H 1 2.169 0.030 . 2 . . . . 14 PRO HB2 . 10336 1 119 . 1 1 14 14 PRO HB3 H 1 1.021 0.030 . 2 . . . . 14 PRO HB3 . 10336 1 120 . 1 1 14 14 PRO HD2 H 1 3.593 0.030 . 1 . . . . 14 PRO HD2 . 10336 1 121 . 1 1 14 14 PRO HD3 H 1 3.593 0.030 . 1 . . . . 14 PRO HD3 . 10336 1 122 . 1 1 14 14 PRO HG2 H 1 1.827 0.030 . 1 . . . . 14 PRO HG2 . 10336 1 123 . 1 1 14 14 PRO HG3 H 1 1.827 0.030 . 1 . . . . 14 PRO HG3 . 10336 1 124 . 1 1 14 14 PRO C C 13 176.841 0.300 . 1 . . . . 14 PRO C . 10336 1 125 . 1 1 14 14 PRO CA C 13 65.470 0.300 . 1 . . . . 14 PRO CA . 10336 1 126 . 1 1 14 14 PRO CB C 13 31.201 0.300 . 1 . . . . 14 PRO CB . 10336 1 127 . 1 1 14 14 PRO CD C 13 50.865 0.300 . 1 . . . . 14 PRO CD . 10336 1 128 . 1 1 14 14 PRO CG C 13 27.955 0.300 . 1 . . . . 14 PRO CG . 10336 1 129 . 1 1 15 15 PHE H H 1 8.391 0.030 . 1 . . . . 15 PHE H . 10336 1 130 . 1 1 15 15 PHE HA H 1 4.743 0.030 . 1 . . . . 15 PHE HA . 10336 1 131 . 1 1 15 15 PHE HB2 H 1 3.600 0.030 . 2 . . . . 15 PHE HB2 . 10336 1 132 . 1 1 15 15 PHE HB3 H 1 3.251 0.030 . 2 . . . . 15 PHE HB3 . 10336 1 133 . 1 1 15 15 PHE HD1 H 1 7.288 0.030 . 1 . . . . 15 PHE HD1 . 10336 1 134 . 1 1 15 15 PHE HD2 H 1 7.288 0.030 . 1 . . . . 15 PHE HD2 . 10336 1 135 . 1 1 15 15 PHE HE1 H 1 7.323 0.030 . 1 . . . . 15 PHE HE1 . 10336 1 136 . 1 1 15 15 PHE HE2 H 1 7.323 0.030 . 1 . . . . 15 PHE HE2 . 10336 1 137 . 1 1 15 15 PHE HZ H 1 7.286 0.030 . 1 . . . . 15 PHE HZ . 10336 1 138 . 1 1 15 15 PHE C C 13 175.192 0.300 . 1 . . . . 15 PHE C . 10336 1 139 . 1 1 15 15 PHE CA C 13 57.401 0.300 . 1 . . . . 15 PHE CA . 10336 1 140 . 1 1 15 15 PHE CB C 13 39.196 0.300 . 1 . . . . 15 PHE CB . 10336 1 141 . 1 1 15 15 PHE CD1 C 13 131.442 0.300 . 1 . . . . 15 PHE CD1 . 10336 1 142 . 1 1 15 15 PHE CD2 C 13 131.442 0.300 . 1 . . . . 15 PHE CD2 . 10336 1 143 . 1 1 15 15 PHE CE1 C 13 131.319 0.300 . 1 . . . . 15 PHE CE1 . 10336 1 144 . 1 1 15 15 PHE CE2 C 13 131.319 0.300 . 1 . . . . 15 PHE CE2 . 10336 1 145 . 1 1 15 15 PHE CZ C 13 129.843 0.300 . 1 . . . . 15 PHE CZ . 10336 1 146 . 1 1 15 15 PHE N N 15 114.433 0.300 . 1 . . . . 15 PHE N . 10336 1 147 . 1 1 16 16 ILE H H 1 7.974 0.030 . 1 . . . . 16 ILE H . 10336 1 148 . 1 1 16 16 ILE HA H 1 4.020 0.030 . 1 . . . . 16 ILE HA . 10336 1 149 . 1 1 16 16 ILE HB H 1 2.025 0.030 . 1 . . . . 16 ILE HB . 10336 1 150 . 1 1 16 16 ILE HD11 H 1 0.903 0.030 . 1 . . . . 16 ILE HD1 . 10336 1 151 . 1 1 16 16 ILE HD12 H 1 0.903 0.030 . 1 . . . . 16 ILE HD1 . 10336 1 152 . 1 1 16 16 ILE HD13 H 1 0.903 0.030 . 1 . . . . 16 ILE HD1 . 10336 1 153 . 1 1 16 16 ILE HG12 H 1 1.891 0.030 . 2 . . . . 16 ILE HG12 . 10336 1 154 . 1 1 16 16 ILE HG13 H 1 0.692 0.030 . 2 . . . . 16 ILE HG13 . 10336 1 155 . 1 1 16 16 ILE HG21 H 1 0.720 0.030 . 1 . . . . 16 ILE HG2 . 10336 1 156 . 1 1 16 16 ILE HG22 H 1 0.720 0.030 . 1 . . . . 16 ILE HG2 . 10336 1 157 . 1 1 16 16 ILE HG23 H 1 0.720 0.030 . 1 . . . . 16 ILE HG2 . 10336 1 158 . 1 1 16 16 ILE C C 13 175.853 0.300 . 1 . . . . 16 ILE C . 10336 1 159 . 1 1 16 16 ILE CA C 13 63.131 0.300 . 1 . . . . 16 ILE CA . 10336 1 160 . 1 1 16 16 ILE CB C 13 38.458 0.300 . 1 . . . . 16 ILE CB . 10336 1 161 . 1 1 16 16 ILE CD1 C 13 13.244 0.300 . 1 . . . . 16 ILE CD1 . 10336 1 162 . 1 1 16 16 ILE CG1 C 13 28.696 0.300 . 1 . . . . 16 ILE CG1 . 10336 1 163 . 1 1 16 16 ILE CG2 C 13 16.688 0.300 . 1 . . . . 16 ILE CG2 . 10336 1 164 . 1 1 16 16 ILE N N 15 121.741 0.300 . 1 . . . . 16 ILE N . 10336 1 165 . 1 1 17 17 ASN H H 1 8.772 0.030 . 1 . . . . 17 ASN H . 10336 1 166 . 1 1 17 17 ASN HA H 1 4.906 0.030 . 1 . . . . 17 ASN HA . 10336 1 167 . 1 1 17 17 ASN HB2 H 1 2.505 0.030 . 2 . . . . 17 ASN HB2 . 10336 1 168 . 1 1 17 17 ASN HB3 H 1 2.590 0.030 . 2 . . . . 17 ASN HB3 . 10336 1 169 . 1 1 17 17 ASN HD21 H 1 6.945 0.030 . 2 . . . . 17 ASN HD21 . 10336 1 170 . 1 1 17 17 ASN HD22 H 1 7.571 0.030 . 2 . . . . 17 ASN HD22 . 10336 1 171 . 1 1 17 17 ASN C C 13 176.364 0.300 . 1 . . . . 17 ASN C . 10336 1 172 . 1 1 17 17 ASN CA C 13 50.773 0.300 . 1 . . . . 17 ASN CA . 10336 1 173 . 1 1 17 17 ASN CB C 13 37.474 0.300 . 1 . . . . 17 ASN CB . 10336 1 174 . 1 1 17 17 ASN N N 15 125.783 0.300 . 1 . . . . 17 ASN N . 10336 1 175 . 1 1 17 17 ASN ND2 N 15 110.157 0.300 . 1 . . . . 17 ASN ND2 . 10336 1 176 . 1 1 18 18 LYS H H 1 8.942 0.030 . 1 . . . . 18 LYS H . 10336 1 177 . 1 1 18 18 LYS HA H 1 4.164 0.030 . 1 . . . . 18 LYS HA . 10336 1 178 . 1 1 18 18 LYS HB2 H 1 1.969 0.030 . 2 . . . . 18 LYS HB2 . 10336 1 179 . 1 1 18 18 LYS HB3 H 1 1.881 0.030 . 2 . . . . 18 LYS HB3 . 10336 1 180 . 1 1 18 18 LYS HD2 H 1 1.742 0.030 . 2 . . . . 18 LYS HD2 . 10336 1 181 . 1 1 18 18 LYS HD3 H 1 1.804 0.030 . 2 . . . . 18 LYS HD3 . 10336 1 182 . 1 1 18 18 LYS HE2 H 1 3.016 0.030 . 1 . . . . 18 LYS HE2 . 10336 1 183 . 1 1 18 18 LYS HE3 H 1 3.016 0.030 . 1 . . . . 18 LYS HE3 . 10336 1 184 . 1 1 18 18 LYS HG2 H 1 1.463 0.030 . 2 . . . . 18 LYS HG2 . 10336 1 185 . 1 1 18 18 LYS HG3 H 1 1.639 0.030 . 2 . . . . 18 LYS HG3 . 10336 1 186 . 1 1 18 18 LYS C C 13 178.696 0.300 . 1 . . . . 18 LYS C . 10336 1 187 . 1 1 18 18 LYS CA C 13 60.351 0.300 . 1 . . . . 18 LYS CA . 10336 1 188 . 1 1 18 18 LYS CB C 13 31.693 0.300 . 1 . . . . 18 LYS CB . 10336 1 189 . 1 1 18 18 LYS CD C 13 28.599 0.300 . 1 . . . . 18 LYS CD . 10336 1 190 . 1 1 18 18 LYS CE C 13 41.756 0.300 . 1 . . . . 18 LYS CE . 10336 1 191 . 1 1 18 18 LYS CG C 13 25.378 0.300 . 1 . . . . 18 LYS CG . 10336 1 192 . 1 1 18 18 LYS N N 15 127.094 0.300 . 1 . . . . 18 LYS N . 10336 1 193 . 1 1 19 19 ALA H H 1 7.990 0.030 . 1 . . . . 19 ALA H . 10336 1 194 . 1 1 19 19 ALA HA H 1 4.254 0.030 . 1 . . . . 19 ALA HA . 10336 1 195 . 1 1 19 19 ALA HB1 H 1 1.462 0.030 . 1 . . . . 19 ALA HB . 10336 1 196 . 1 1 19 19 ALA HB2 H 1 1.462 0.030 . 1 . . . . 19 ALA HB . 10336 1 197 . 1 1 19 19 ALA HB3 H 1 1.462 0.030 . 1 . . . . 19 ALA HB . 10336 1 198 . 1 1 19 19 ALA C C 13 178.168 0.300 . 1 . . . . 19 ALA C . 10336 1 199 . 1 1 19 19 ALA CA C 13 53.975 0.300 . 1 . . . . 19 ALA CA . 10336 1 200 . 1 1 19 19 ALA CB C 13 18.169 0.300 . 1 . . . . 19 ALA CB . 10336 1 201 . 1 1 19 19 ALA N N 15 119.408 0.300 . 1 . . . . 19 ALA N . 10336 1 202 . 1 1 20 20 GLY H H 1 7.540 0.030 . 1 . . . . 20 GLY H . 10336 1 203 . 1 1 20 20 GLY HA2 H 1 4.396 0.030 . 2 . . . . 20 GLY HA2 . 10336 1 204 . 1 1 20 20 GLY HA3 H 1 3.332 0.030 . 2 . . . . 20 GLY HA3 . 10336 1 205 . 1 1 20 20 GLY C C 13 173.867 0.300 . 1 . . . . 20 GLY C . 10336 1 206 . 1 1 20 20 GLY CA C 13 44.818 0.300 . 1 . . . . 20 GLY CA . 10336 1 207 . 1 1 20 20 GLY N N 15 104.314 0.300 . 1 . . . . 20 GLY N . 10336 1 208 . 1 1 21 21 CYS H H 1 7.122 0.030 . 1 . . . . 21 CYS H . 10336 1 209 . 1 1 21 21 CYS HA H 1 4.758 0.030 . 1 . . . . 21 CYS HA . 10336 1 210 . 1 1 21 21 CYS HB2 H 1 2.525 0.030 . 2 . . . . 21 CYS HB2 . 10336 1 211 . 1 1 21 21 CYS HB3 H 1 3.093 0.030 . 2 . . . . 21 CYS HB3 . 10336 1 212 . 1 1 21 21 CYS C C 13 173.855 0.300 . 1 . . . . 21 CYS C . 10336 1 213 . 1 1 21 21 CYS CA C 13 58.910 0.300 . 1 . . . . 21 CYS CA . 10336 1 214 . 1 1 21 21 CYS CB C 13 29.848 0.300 . 1 . . . . 21 CYS CB . 10336 1 215 . 1 1 21 21 CYS N N 15 117.387 0.300 . 1 . . . . 21 CYS N . 10336 1 216 . 1 1 22 22 GLU H H 1 8.614 0.030 . 1 . . . . 22 GLU H . 10336 1 217 . 1 1 22 22 GLU HA H 1 4.369 0.030 . 1 . . . . 22 GLU HA . 10336 1 218 . 1 1 22 22 GLU HB2 H 1 1.874 0.030 . 2 . . . . 22 GLU HB2 . 10336 1 219 . 1 1 22 22 GLU HB3 H 1 1.804 0.030 . 2 . . . . 22 GLU HB3 . 10336 1 220 . 1 1 22 22 GLU HG2 H 1 1.993 0.030 . 2 . . . . 22 GLU HG2 . 10336 1 221 . 1 1 22 22 GLU HG3 H 1 1.953 0.030 . 2 . . . . 22 GLU HG3 . 10336 1 222 . 1 1 22 22 GLU C C 13 173.560 0.300 . 1 . . . . 22 GLU C . 10336 1 223 . 1 1 22 22 GLU CA C 13 55.545 0.300 . 1 . . . . 22 GLU CA . 10336 1 224 . 1 1 22 22 GLU CB C 13 34.153 0.300 . 1 . . . . 22 GLU CB . 10336 1 225 . 1 1 22 22 GLU CG C 13 36.420 0.300 . 1 . . . . 22 GLU CG . 10336 1 226 . 1 1 22 22 GLU N N 15 120.264 0.300 . 1 . . . . 22 GLU N . 10336 1 227 . 1 1 23 23 CYS H H 1 8.951 0.030 . 1 . . . . 23 CYS H . 10336 1 228 . 1 1 23 23 CYS HA H 1 5.182 0.030 . 1 . . . . 23 CYS HA . 10336 1 229 . 1 1 23 23 CYS HB2 H 1 3.023 0.030 . 2 . . . . 23 CYS HB2 . 10336 1 230 . 1 1 23 23 CYS HB3 H 1 2.060 0.030 . 2 . . . . 23 CYS HB3 . 10336 1 231 . 1 1 23 23 CYS C C 13 173.256 0.300 . 1 . . . . 23 CYS C . 10336 1 232 . 1 1 23 23 CYS CA C 13 57.564 0.300 . 1 . . . . 23 CYS CA . 10336 1 233 . 1 1 23 23 CYS CB C 13 28.126 0.300 . 1 . . . . 23 CYS CB . 10336 1 234 . 1 1 23 23 CYS N N 15 124.539 0.300 . 1 . . . . 23 CYS N . 10336 1 235 . 1 1 24 24 LEU H H 1 9.109 0.030 . 1 . . . . 24 LEU H . 10336 1 236 . 1 1 24 24 LEU HA H 1 4.703 0.030 . 1 . . . . 24 LEU HA . 10336 1 237 . 1 1 24 24 LEU HB2 H 1 1.737 0.030 . 1 . . . . 24 LEU HB2 . 10336 1 238 . 1 1 24 24 LEU HB3 H 1 1.737 0.030 . 1 . . . . 24 LEU HB3 . 10336 1 239 . 1 1 24 24 LEU HD11 H 1 0.783 0.030 . 1 . . . . 24 LEU HD1 . 10336 1 240 . 1 1 24 24 LEU HD12 H 1 0.783 0.030 . 1 . . . . 24 LEU HD1 . 10336 1 241 . 1 1 24 24 LEU HD13 H 1 0.783 0.030 . 1 . . . . 24 LEU HD1 . 10336 1 242 . 1 1 24 24 LEU HD21 H 1 0.766 0.030 . 1 . . . . 24 LEU HD2 . 10336 1 243 . 1 1 24 24 LEU HD22 H 1 0.766 0.030 . 1 . . . . 24 LEU HD2 . 10336 1 244 . 1 1 24 24 LEU HD23 H 1 0.766 0.030 . 1 . . . . 24 LEU HD2 . 10336 1 245 . 1 1 24 24 LEU HG H 1 1.587 0.030 . 1 . . . . 24 LEU HG . 10336 1 246 . 1 1 24 24 LEU C C 13 177.542 0.300 . 1 . . . . 24 LEU C . 10336 1 247 . 1 1 24 24 LEU CA C 13 54.954 0.300 . 1 . . . . 24 LEU CA . 10336 1 248 . 1 1 24 24 LEU CB C 13 42.895 0.300 . 1 . . . . 24 LEU CB . 10336 1 249 . 1 1 24 24 LEU CD1 C 13 24.899 0.300 . 2 . . . . 24 LEU CD1 . 10336 1 250 . 1 1 24 24 LEU CD2 C 13 22.837 0.300 . 2 . . . . 24 LEU CD2 . 10336 1 251 . 1 1 24 24 LEU CG C 13 27.388 0.300 . 1 . . . . 24 LEU CG . 10336 1 252 . 1 1 24 24 LEU N N 15 129.283 0.300 . 1 . . . . 24 LEU N . 10336 1 253 . 1 1 25 25 ASN H H 1 9.066 0.030 . 1 . . . . 25 ASN H . 10336 1 254 . 1 1 25 25 ASN HA H 1 4.718 0.030 . 1 . . . . 25 ASN HA . 10336 1 255 . 1 1 25 25 ASN HB2 H 1 2.650 0.030 . 1 . . . . 25 ASN HB2 . 10336 1 256 . 1 1 25 25 ASN HB3 H 1 2.650 0.030 . 1 . . . . 25 ASN HB3 . 10336 1 257 . 1 1 25 25 ASN HD21 H 1 6.250 0.030 . 2 . . . . 25 ASN HD21 . 10336 1 258 . 1 1 25 25 ASN HD22 H 1 9.189 0.030 . 2 . . . . 25 ASN HD22 . 10336 1 259 . 1 1 25 25 ASN C C 13 175.057 0.300 . 1 . . . . 25 ASN C . 10336 1 260 . 1 1 25 25 ASN CA C 13 53.669 0.300 . 1 . . . . 25 ASN CA . 10336 1 261 . 1 1 25 25 ASN CB C 13 38.823 0.300 . 1 . . . . 25 ASN CB . 10336 1 262 . 1 1 25 25 ASN N N 15 118.320 0.300 . 1 . . . . 25 ASN N . 10336 1 263 . 1 1 25 25 ASN ND2 N 15 115.210 0.300 . 1 . . . . 25 ASN ND2 . 10336 1 264 . 1 1 26 26 GLU H H 1 7.719 0.030 . 1 . . . . 26 GLU H . 10336 1 265 . 1 1 26 26 GLU HA H 1 4.186 0.030 . 1 . . . . 26 GLU HA . 10336 1 266 . 1 1 26 26 GLU HB2 H 1 2.248 0.030 . 2 . . . . 26 GLU HB2 . 10336 1 267 . 1 1 26 26 GLU HB3 H 1 2.137 0.030 . 2 . . . . 26 GLU HB3 . 10336 1 268 . 1 1 26 26 GLU HG2 H 1 2.649 0.030 . 2 . . . . 26 GLU HG2 . 10336 1 269 . 1 1 26 26 GLU HG3 H 1 2.252 0.030 . 2 . . . . 26 GLU HG3 . 10336 1 270 . 1 1 26 26 GLU C C 13 176.699 0.300 . 1 . . . . 26 GLU C . 10336 1 271 . 1 1 26 26 GLU CA C 13 55.892 0.300 . 1 . . . . 26 GLU CA . 10336 1 272 . 1 1 26 26 GLU CB C 13 32.209 0.300 . 1 . . . . 26 GLU CB . 10336 1 273 . 1 1 26 26 GLU CG C 13 35.014 0.300 . 1 . . . . 26 GLU CG . 10336 1 274 . 1 1 26 26 GLU N N 15 117.853 0.300 . 1 . . . . 26 GLU N . 10336 1 275 . 1 1 27 27 SER H H 1 8.502 0.030 . 1 . . . . 27 SER H . 10336 1 276 . 1 1 27 27 SER HA H 1 4.280 0.030 . 1 . . . . 27 SER HA . 10336 1 277 . 1 1 27 27 SER HB2 H 1 4.082 0.030 . 2 . . . . 27 SER HB2 . 10336 1 278 . 1 1 27 27 SER HB3 H 1 4.150 0.030 . 2 . . . . 27 SER HB3 . 10336 1 279 . 1 1 27 27 SER C C 13 174.627 0.300 . 1 . . . . 27 SER C . 10336 1 280 . 1 1 27 27 SER CA C 13 58.340 0.300 . 1 . . . . 27 SER CA . 10336 1 281 . 1 1 27 27 SER CB C 13 64.287 0.300 . 1 . . . . 27 SER CB . 10336 1 282 . 1 1 27 27 SER N N 15 120.565 0.300 . 1 . . . . 27 SER N . 10336 1 283 . 1 1 28 28 ASP H H 1 8.824 0.030 . 1 . . . . 28 ASP H . 10336 1 284 . 1 1 28 28 ASP HA H 1 4.377 0.030 . 1 . . . . 28 ASP HA . 10336 1 285 . 1 1 28 28 ASP HB2 H 1 2.650 0.030 . 1 . . . . 28 ASP HB2 . 10336 1 286 . 1 1 28 28 ASP HB3 H 1 2.650 0.030 . 1 . . . . 28 ASP HB3 . 10336 1 287 . 1 1 28 28 ASP C C 13 177.119 0.300 . 1 . . . . 28 ASP C . 10336 1 288 . 1 1 28 28 ASP CA C 13 56.525 0.300 . 1 . . . . 28 ASP CA . 10336 1 289 . 1 1 28 28 ASP CB C 13 41.041 0.300 . 1 . . . . 28 ASP CB . 10336 1 290 . 1 1 28 28 ASP N N 15 124.539 0.300 . 1 . . . . 28 ASP N . 10336 1 291 . 1 1 29 29 GLU H H 1 8.133 0.030 . 1 . . . . 29 GLU H . 10336 1 292 . 1 1 29 29 GLU HA H 1 4.044 0.030 . 1 . . . . 29 GLU HA . 10336 1 293 . 1 1 29 29 GLU HB2 H 1 1.679 0.030 . 2 . . . . 29 GLU HB2 . 10336 1 294 . 1 1 29 29 GLU HB3 H 1 1.483 0.030 . 2 . . . . 29 GLU HB3 . 10336 1 295 . 1 1 29 29 GLU HG2 H 1 1.992 0.030 . 2 . . . . 29 GLU HG2 . 10336 1 296 . 1 1 29 29 GLU HG3 H 1 1.713 0.030 . 2 . . . . 29 GLU HG3 . 10336 1 297 . 1 1 29 29 GLU C C 13 175.970 0.300 . 1 . . . . 29 GLU C . 10336 1 298 . 1 1 29 29 GLU CA C 13 57.380 0.300 . 1 . . . . 29 GLU CA . 10336 1 299 . 1 1 29 29 GLU CB C 13 31.570 0.300 . 1 . . . . 29 GLU CB . 10336 1 300 . 1 1 29 29 GLU CG C 13 36.244 0.300 . 1 . . . . 29 GLU CG . 10336 1 301 . 1 1 29 29 GLU N N 15 117.162 0.300 . 1 . . . . 29 GLU N . 10336 1 302 . 1 1 30 30 HIS H H 1 7.298 0.030 . 1 . . . . 30 HIS H . 10336 1 303 . 1 1 30 30 HIS HA H 1 4.569 0.030 . 1 . . . . 30 HIS HA . 10336 1 304 . 1 1 30 30 HIS HB2 H 1 3.497 0.030 . 2 . . . . 30 HIS HB2 . 10336 1 305 . 1 1 30 30 HIS HB3 H 1 2.972 0.030 . 2 . . . . 30 HIS HB3 . 10336 1 306 . 1 1 30 30 HIS HD2 H 1 7.116 0.030 . 1 . . . . 30 HIS HD2 . 10336 1 307 . 1 1 30 30 HIS HE1 H 1 8.027 0.030 . 1 . . . . 30 HIS HE1 . 10336 1 308 . 1 1 30 30 HIS C C 13 174.245 0.300 . 1 . . . . 30 HIS C . 10336 1 309 . 1 1 30 30 HIS CA C 13 54.322 0.300 . 1 . . . . 30 HIS CA . 10336 1 310 . 1 1 30 30 HIS CB C 13 30.832 0.300 . 1 . . . . 30 HIS CB . 10336 1 311 . 1 1 30 30 HIS CD2 C 13 120.864 0.300 . 1 . . . . 30 HIS CD2 . 10336 1 312 . 1 1 30 30 HIS CE1 C 13 137.715 0.300 . 1 . . . . 30 HIS CE1 . 10336 1 313 . 1 1 30 30 HIS N N 15 120.264 0.300 . 1 . . . . 30 HIS N . 10336 1 314 . 1 1 31 31 GLY H H 1 8.004 0.030 . 1 . . . . 31 GLY H . 10336 1 315 . 1 1 31 31 GLY HA2 H 1 3.959 0.030 . 2 . . . . 31 GLY HA2 . 10336 1 316 . 1 1 31 31 GLY HA3 H 1 4.689 0.030 . 2 . . . . 31 GLY HA3 . 10336 1 317 . 1 1 31 31 GLY C C 13 174.873 0.300 . 1 . . . . 31 GLY C . 10336 1 318 . 1 1 31 31 GLY CA C 13 45.634 0.300 . 1 . . . . 31 GLY CA . 10336 1 319 . 1 1 31 31 GLY N N 15 109.302 0.300 . 1 . . . . 31 GLY N . 10336 1 320 . 1 1 32 32 PHE H H 1 9.407 0.030 . 1 . . . . 32 PHE H . 10336 1 321 . 1 1 32 32 PHE HA H 1 4.282 0.030 . 1 . . . . 32 PHE HA . 10336 1 322 . 1 1 32 32 PHE HB2 H 1 2.973 0.030 . 2 . . . . 32 PHE HB2 . 10336 1 323 . 1 1 32 32 PHE HB3 H 1 3.284 0.030 . 2 . . . . 32 PHE HB3 . 10336 1 324 . 1 1 32 32 PHE HD1 H 1 7.215 0.030 . 1 . . . . 32 PHE HD1 . 10336 1 325 . 1 1 32 32 PHE HD2 H 1 7.215 0.030 . 1 . . . . 32 PHE HD2 . 10336 1 326 . 1 1 32 32 PHE HE1 H 1 7.174 0.030 . 1 . . . . 32 PHE HE1 . 10336 1 327 . 1 1 32 32 PHE HE2 H 1 7.174 0.030 . 1 . . . . 32 PHE HE2 . 10336 1 328 . 1 1 32 32 PHE HZ H 1 7.079 0.030 . 1 . . . . 32 PHE HZ . 10336 1 329 . 1 1 32 32 PHE C C 13 176.852 0.300 . 1 . . . . 32 PHE C . 10336 1 330 . 1 1 32 32 PHE CA C 13 61.212 0.300 . 1 . . . . 32 PHE CA . 10336 1 331 . 1 1 32 32 PHE CB C 13 40.115 0.300 . 1 . . . . 32 PHE CB . 10336 1 332 . 1 1 32 32 PHE CD1 C 13 131.688 0.300 . 1 . . . . 32 PHE CD1 . 10336 1 333 . 1 1 32 32 PHE CD2 C 13 131.688 0.300 . 1 . . . . 32 PHE CD2 . 10336 1 334 . 1 1 32 32 PHE CE1 C 13 131.073 0.300 . 1 . . . . 32 PHE CE1 . 10336 1 335 . 1 1 32 32 PHE CE2 C 13 131.073 0.300 . 1 . . . . 32 PHE CE2 . 10336 1 336 . 1 1 32 32 PHE CZ C 13 129.105 0.300 . 1 . . . . 32 PHE CZ . 10336 1 337 . 1 1 32 32 PHE N N 15 118.320 0.300 . 1 . . . . 32 PHE N . 10336 1 338 . 1 1 33 33 ASP H H 1 8.830 0.030 . 1 . . . . 33 ASP H . 10336 1 339 . 1 1 33 33 ASP HA H 1 3.887 0.030 . 1 . . . . 33 ASP HA . 10336 1 340 . 1 1 33 33 ASP HB2 H 1 2.511 0.030 . 1 . . . . 33 ASP HB2 . 10336 1 341 . 1 1 33 33 ASP HB3 H 1 2.511 0.030 . 1 . . . . 33 ASP HB3 . 10336 1 342 . 1 1 33 33 ASP C C 13 178.144 0.300 . 1 . . . . 33 ASP C . 10336 1 343 . 1 1 33 33 ASP CA C 13 57.462 0.300 . 1 . . . . 33 ASP CA . 10336 1 344 . 1 1 33 33 ASP CB C 13 40.260 0.300 . 1 . . . . 33 ASP CB . 10336 1 345 . 1 1 33 33 ASP N N 15 116.610 0.300 . 1 . . . . 33 ASP N . 10336 1 346 . 1 1 34 34 ASN H H 1 7.414 0.030 . 1 . . . . 34 ASN H . 10336 1 347 . 1 1 34 34 ASN HA H 1 4.130 0.030 . 1 . . . . 34 ASN HA . 10336 1 348 . 1 1 34 34 ASN HB2 H 1 2.668 0.030 . 1 . . . . 34 ASN HB2 . 10336 1 349 . 1 1 34 34 ASN HB3 H 1 2.668 0.030 . 1 . . . . 34 ASN HB3 . 10336 1 350 . 1 1 34 34 ASN HD21 H 1 7.597 0.030 . 2 . . . . 34 ASN HD21 . 10336 1 351 . 1 1 34 34 ASN HD22 H 1 7.285 0.030 . 2 . . . . 34 ASN HD22 . 10336 1 352 . 1 1 34 34 ASN C C 13 178.348 0.300 . 1 . . . . 34 ASN C . 10336 1 353 . 1 1 34 34 ASN CA C 13 55.260 0.300 . 1 . . . . 34 ASN CA . 10336 1 354 . 1 1 34 34 ASN CB C 13 37.966 0.300 . 1 . . . . 34 ASN CB . 10336 1 355 . 1 1 34 34 ASN N N 15 114.650 0.300 . 1 . . . . 34 ASN N . 10336 1 356 . 1 1 34 34 ASN ND2 N 15 111.867 0.300 . 1 . . . . 34 ASN ND2 . 10336 1 357 . 1 1 35 35 CYS H H 1 7.675 0.030 . 1 . . . . 35 CYS H . 10336 1 358 . 1 1 35 35 CYS HA H 1 4.906 0.030 . 1 . . . . 35 CYS HA . 10336 1 359 . 1 1 35 35 CYS HB2 H 1 2.576 0.030 . 2 . . . . 35 CYS HB2 . 10336 1 360 . 1 1 35 35 CYS HB3 H 1 2.902 0.030 . 2 . . . . 35 CYS HB3 . 10336 1 361 . 1 1 35 35 CYS C C 13 172.579 0.300 . 1 . . . . 35 CYS C . 10336 1 362 . 1 1 35 35 CYS CA C 13 58.482 0.300 . 1 . . . . 35 CYS CA . 10336 1 363 . 1 1 35 35 CYS CB C 13 27.513 0.300 . 1 . . . . 35 CYS CB . 10336 1 364 . 1 1 35 35 CYS N N 15 114.588 0.300 . 1 . . . . 35 CYS N . 10336 1 365 . 1 1 36 36 LEU H H 1 6.759 0.030 . 1 . . . . 36 LEU H . 10336 1 366 . 1 1 36 36 LEU HA H 1 4.535 0.030 . 1 . . . . 36 LEU HA . 10336 1 367 . 1 1 36 36 LEU HB2 H 1 1.649 0.030 . 1 . . . . 36 LEU HB2 . 10336 1 368 . 1 1 36 36 LEU HB3 H 1 1.649 0.030 . 1 . . . . 36 LEU HB3 . 10336 1 369 . 1 1 36 36 LEU HD11 H 1 0.760 0.030 . 1 . . . . 36 LEU HD1 . 10336 1 370 . 1 1 36 36 LEU HD12 H 1 0.760 0.030 . 1 . . . . 36 LEU HD1 . 10336 1 371 . 1 1 36 36 LEU HD13 H 1 0.760 0.030 . 1 . . . . 36 LEU HD1 . 10336 1 372 . 1 1 36 36 LEU HD21 H 1 0.622 0.030 . 1 . . . . 36 LEU HD2 . 10336 1 373 . 1 1 36 36 LEU HD22 H 1 0.622 0.030 . 1 . . . . 36 LEU HD2 . 10336 1 374 . 1 1 36 36 LEU HD23 H 1 0.622 0.030 . 1 . . . . 36 LEU HD2 . 10336 1 375 . 1 1 36 36 LEU HG H 1 1.224 0.030 . 1 . . . . 36 LEU HG . 10336 1 376 . 1 1 36 36 LEU C C 13 177.084 0.300 . 1 . . . . 36 LEU C . 10336 1 377 . 1 1 36 36 LEU CA C 13 54.301 0.300 . 1 . . . . 36 LEU CA . 10336 1 378 . 1 1 36 36 LEU CB C 13 41.410 0.300 . 1 . . . . 36 LEU CB . 10336 1 379 . 1 1 36 36 LEU CD1 C 13 26.035 0.300 . 2 . . . . 36 LEU CD1 . 10336 1 380 . 1 1 36 36 LEU CD2 C 13 22.066 0.300 . 2 . . . . 36 LEU CD2 . 10336 1 381 . 1 1 36 36 LEU CG C 13 26.158 0.300 . 1 . . . . 36 LEU CG . 10336 1 382 . 1 1 36 36 LEU N N 15 117.775 0.300 . 1 . . . . 36 LEU N . 10336 1 383 . 1 1 37 37 ARG H H 1 6.983 0.030 . 1 . . . . 37 ARG H . 10336 1 384 . 1 1 37 37 ARG HA H 1 4.451 0.030 . 1 . . . . 37 ARG HA . 10336 1 385 . 1 1 37 37 ARG HB2 H 1 1.494 0.030 . 2 . . . . 37 ARG HB2 . 10336 1 386 . 1 1 37 37 ARG HB3 H 1 1.701 0.030 . 2 . . . . 37 ARG HB3 . 10336 1 387 . 1 1 37 37 ARG HD2 H 1 3.047 0.030 . 2 . . . . 37 ARG HD2 . 10336 1 388 . 1 1 37 37 ARG HD3 H 1 3.265 0.030 . 2 . . . . 37 ARG HD3 . 10336 1 389 . 1 1 37 37 ARG HE H 1 7.500 0.030 . 1 . . . . 37 ARG HE . 10336 1 390 . 1 1 37 37 ARG HG2 H 1 1.584 0.030 . 2 . . . . 37 ARG HG2 . 10336 1 391 . 1 1 37 37 ARG HG3 H 1 1.356 0.030 . 2 . . . . 37 ARG HG3 . 10336 1 392 . 1 1 37 37 ARG C C 13 175.353 0.300 . 1 . . . . 37 ARG C . 10336 1 393 . 1 1 37 37 ARG CA C 13 54.831 0.300 . 1 . . . . 37 ARG CA . 10336 1 394 . 1 1 37 37 ARG CB C 13 33.120 0.300 . 1 . . . . 37 ARG CB . 10336 1 395 . 1 1 37 37 ARG CD C 13 43.413 0.300 . 1 . . . . 37 ARG CD . 10336 1 396 . 1 1 37 37 ARG CG C 13 27.974 0.300 . 1 . . . . 37 ARG CG . 10336 1 397 . 1 1 37 37 ARG N N 15 116.804 0.300 . 1 . . . . 37 ARG N . 10336 1 398 . 1 1 37 37 ARG NE N 15 85.046 0.300 . 1 . . . . 37 ARG NE . 10336 1 399 . 1 1 38 38 LYS H H 1 8.668 0.030 . 1 . . . . 38 LYS H . 10336 1 400 . 1 1 38 38 LYS HA H 1 3.632 0.030 . 1 . . . . 38 LYS HA . 10336 1 401 . 1 1 38 38 LYS HB2 H 1 1.569 0.030 . 2 . . . . 38 LYS HB2 . 10336 1 402 . 1 1 38 38 LYS HB3 H 1 0.654 0.030 . 2 . . . . 38 LYS HB3 . 10336 1 403 . 1 1 38 38 LYS HD2 H 1 1.299 0.030 . 2 . . . . 38 LYS HD2 . 10336 1 404 . 1 1 38 38 LYS HD3 H 1 1.264 0.030 . 2 . . . . 38 LYS HD3 . 10336 1 405 . 1 1 38 38 LYS HE2 H 1 2.837 0.030 . 2 . . . . 38 LYS HE2 . 10336 1 406 . 1 1 38 38 LYS HE3 H 1 2.766 0.030 . 2 . . . . 38 LYS HE3 . 10336 1 407 . 1 1 38 38 LYS HG2 H 1 0.470 0.030 . 2 . . . . 38 LYS HG2 . 10336 1 408 . 1 1 38 38 LYS HG3 H 1 0.785 0.030 . 2 . . . . 38 LYS HG3 . 10336 1 409 . 1 1 38 38 LYS C C 13 173.520 0.300 . 1 . . . . 38 LYS C . 10336 1 410 . 1 1 38 38 LYS CA C 13 55.463 0.300 . 1 . . . . 38 LYS CA . 10336 1 411 . 1 1 38 38 LYS CB C 13 29.602 0.300 . 1 . . . . 38 LYS CB . 10336 1 412 . 1 1 38 38 LYS CD C 13 29.110 0.300 . 1 . . . . 38 LYS CD . 10336 1 413 . 1 1 38 38 LYS CE C 13 42.032 0.300 . 1 . . . . 38 LYS CE . 10336 1 414 . 1 1 38 38 LYS CG C 13 24.878 0.300 . 1 . . . . 38 LYS CG . 10336 1 415 . 1 1 38 38 LYS N N 15 127.494 0.300 . 1 . . . . 38 LYS N . 10336 1 416 . 1 1 39 39 ASP H H 1 8.267 0.030 . 1 . . . . 39 ASP H . 10336 1 417 . 1 1 39 39 ASP HA H 1 4.610 0.030 . 1 . . . . 39 ASP HA . 10336 1 418 . 1 1 39 39 ASP HB2 H 1 2.830 0.030 . 2 . . . . 39 ASP HB2 . 10336 1 419 . 1 1 39 39 ASP HB3 H 1 3.195 0.030 . 2 . . . . 39 ASP HB3 . 10336 1 420 . 1 1 39 39 ASP C C 13 177.273 0.300 . 1 . . . . 39 ASP C . 10336 1 421 . 1 1 39 39 ASP CA C 13 52.323 0.300 . 1 . . . . 39 ASP CA . 10336 1 422 . 1 1 39 39 ASP CB C 13 41.287 0.300 . 1 . . . . 39 ASP CB . 10336 1 423 . 1 1 39 39 ASP N N 15 125.628 0.300 . 1 . . . . 39 ASP N . 10336 1 424 . 1 1 40 40 THR H H 1 8.021 0.030 . 1 . . . . 40 THR H . 10336 1 425 . 1 1 40 40 THR HA H 1 4.320 0.030 . 1 . . . . 40 THR HA . 10336 1 426 . 1 1 40 40 THR HB H 1 4.578 0.030 . 1 . . . . 40 THR HB . 10336 1 427 . 1 1 40 40 THR HG21 H 1 1.235 0.030 . 1 . . . . 40 THR HG2 . 10336 1 428 . 1 1 40 40 THR HG22 H 1 1.235 0.030 . 1 . . . . 40 THR HG2 . 10336 1 429 . 1 1 40 40 THR HG23 H 1 1.235 0.030 . 1 . . . . 40 THR HG2 . 10336 1 430 . 1 1 40 40 THR C C 13 176.426 0.300 . 1 . . . . 40 THR C . 10336 1 431 . 1 1 40 40 THR CA C 13 62.520 0.300 . 1 . . . . 40 THR CA . 10336 1 432 . 1 1 40 40 THR CB C 13 68.724 0.300 . 1 . . . . 40 THR CB . 10336 1 433 . 1 1 40 40 THR CG2 C 13 21.853 0.300 . 1 . . . . 40 THR CG2 . 10336 1 434 . 1 1 40 40 THR N N 15 106.971 0.300 . 1 . . . . 40 THR N . 10336 1 435 . 1 1 41 41 THR H H 1 8.045 0.030 . 1 . . . . 41 THR H . 10336 1 436 . 1 1 41 41 THR HA H 1 4.260 0.030 . 1 . . . . 41 THR HA . 10336 1 437 . 1 1 41 41 THR HB H 1 4.022 0.030 . 1 . . . . 41 THR HB . 10336 1 438 . 1 1 41 41 THR HG21 H 1 1.046 0.030 . 1 . . . . 41 THR HG2 . 10336 1 439 . 1 1 41 41 THR HG22 H 1 1.046 0.030 . 1 . . . . 41 THR HG2 . 10336 1 440 . 1 1 41 41 THR HG23 H 1 1.046 0.030 . 1 . . . . 41 THR HG2 . 10336 1 441 . 1 1 41 41 THR C C 13 174.487 0.300 . 1 . . . . 41 THR C . 10336 1 442 . 1 1 41 41 THR CA C 13 62.565 0.300 . 1 . . . . 41 THR CA . 10336 1 443 . 1 1 41 41 THR CB C 13 69.442 0.300 . 1 . . . . 41 THR CB . 10336 1 444 . 1 1 41 41 THR CG2 C 13 21.853 0.300 . 1 . . . . 41 THR CG2 . 10336 1 445 . 1 1 41 41 THR N N 15 116.235 0.300 . 1 . . . . 41 THR N . 10336 1 446 . 1 1 42 42 PHE H H 1 7.761 0.030 . 1 . . . . 42 PHE H . 10336 1 447 . 1 1 42 42 PHE HA H 1 5.238 0.030 . 1 . . . . 42 PHE HA . 10336 1 448 . 1 1 42 42 PHE HB2 H 1 2.731 0.030 . 2 . . . . 42 PHE HB2 . 10336 1 449 . 1 1 42 42 PHE HB3 H 1 2.450 0.030 . 2 . . . . 42 PHE HB3 . 10336 1 450 . 1 1 42 42 PHE HD1 H 1 6.853 0.030 . 1 . . . . 42 PHE HD1 . 10336 1 451 . 1 1 42 42 PHE HD2 H 1 6.853 0.030 . 1 . . . . 42 PHE HD2 . 10336 1 452 . 1 1 42 42 PHE HE1 H 1 6.898 0.030 . 1 . . . . 42 PHE HE1 . 10336 1 453 . 1 1 42 42 PHE HE2 H 1 6.898 0.030 . 1 . . . . 42 PHE HE2 . 10336 1 454 . 1 1 42 42 PHE HZ H 1 6.645 0.030 . 1 . . . . 42 PHE HZ . 10336 1 455 . 1 1 42 42 PHE C C 13 174.474 0.300 . 1 . . . . 42 PHE C . 10336 1 456 . 1 1 42 42 PHE CA C 13 54.627 0.300 . 1 . . . . 42 PHE CA . 10336 1 457 . 1 1 42 42 PHE CB C 13 41.287 0.300 . 1 . . . . 42 PHE CB . 10336 1 458 . 1 1 42 42 PHE CD1 C 13 132.303 0.300 . 1 . . . . 42 PHE CD1 . 10336 1 459 . 1 1 42 42 PHE CD2 C 13 132.303 0.300 . 1 . . . . 42 PHE CD2 . 10336 1 460 . 1 1 42 42 PHE CE1 C 13 130.704 0.300 . 1 . . . . 42 PHE CE1 . 10336 1 461 . 1 1 42 42 PHE CE2 C 13 130.704 0.300 . 1 . . . . 42 PHE CE2 . 10336 1 462 . 1 1 42 42 PHE CZ C 13 128.982 0.300 . 1 . . . . 42 PHE CZ . 10336 1 463 . 1 1 42 42 PHE N N 15 114.899 0.300 . 1 . . . . 42 PHE N . 10336 1 464 . 1 1 43 43 LEU H H 1 8.759 0.030 . 1 . . . . 43 LEU H . 10336 1 465 . 1 1 43 43 LEU HA H 1 4.561 0.030 . 1 . . . . 43 LEU HA . 10336 1 466 . 1 1 43 43 LEU HB2 H 1 1.856 0.030 . 2 . . . . 43 LEU HB2 . 10336 1 467 . 1 1 43 43 LEU HB3 H 1 1.683 0.030 . 2 . . . . 43 LEU HB3 . 10336 1 468 . 1 1 43 43 LEU HD11 H 1 1.254 0.030 . 1 . . . . 43 LEU HD1 . 10336 1 469 . 1 1 43 43 LEU HD12 H 1 1.254 0.030 . 1 . . . . 43 LEU HD1 . 10336 1 470 . 1 1 43 43 LEU HD13 H 1 1.254 0.030 . 1 . . . . 43 LEU HD1 . 10336 1 471 . 1 1 43 43 LEU HD21 H 1 0.894 0.030 . 1 . . . . 43 LEU HD2 . 10336 1 472 . 1 1 43 43 LEU HD22 H 1 0.894 0.030 . 1 . . . . 43 LEU HD2 . 10336 1 473 . 1 1 43 43 LEU HD23 H 1 0.894 0.030 . 1 . . . . 43 LEU HD2 . 10336 1 474 . 1 1 43 43 LEU HG H 1 1.215 0.030 . 1 . . . . 43 LEU HG . 10336 1 475 . 1 1 43 43 LEU C C 13 174.936 0.300 . 1 . . . . 43 LEU C . 10336 1 476 . 1 1 43 43 LEU CA C 13 53.404 0.300 . 1 . . . . 43 LEU CA . 10336 1 477 . 1 1 43 43 LEU CB C 13 44.967 0.300 . 1 . . . . 43 LEU CB . 10336 1 478 . 1 1 43 43 LEU CD1 C 13 23.944 0.300 . 2 . . . . 43 LEU CD1 . 10336 1 479 . 1 1 43 43 LEU CD2 C 13 24.928 0.300 . 2 . . . . 43 LEU CD2 . 10336 1 480 . 1 1 43 43 LEU CG C 13 28.987 0.300 . 1 . . . . 43 LEU CG . 10336 1 481 . 1 1 43 43 LEU N N 15 124.073 0.300 . 1 . . . . 43 LEU N . 10336 1 482 . 1 1 44 44 GLU H H 1 8.550 0.030 . 1 . . . . 44 GLU H . 10336 1 483 . 1 1 44 44 GLU HA H 1 5.997 0.030 . 1 . . . . 44 GLU HA . 10336 1 484 . 1 1 44 44 GLU HB2 H 1 2.026 0.030 . 2 . . . . 44 GLU HB2 . 10336 1 485 . 1 1 44 44 GLU HB3 H 1 2.309 0.030 . 2 . . . . 44 GLU HB3 . 10336 1 486 . 1 1 44 44 GLU HG2 H 1 2.180 0.030 . 2 . . . . 44 GLU HG2 . 10336 1 487 . 1 1 44 44 GLU HG3 H 1 3.453 0.030 . 2 . . . . 44 GLU HG3 . 10336 1 488 . 1 1 44 44 GLU C C 13 174.684 0.300 . 1 . . . . 44 GLU C . 10336 1 489 . 1 1 44 44 GLU CA C 13 53.463 0.300 . 1 . . . . 44 GLU CA . 10336 1 490 . 1 1 44 44 GLU CB C 13 35.137 0.300 . 1 . . . . 44 GLU CB . 10336 1 491 . 1 1 44 44 GLU CG C 13 37.432 0.300 . 1 . . . . 44 GLU CG . 10336 1 492 . 1 1 44 44 GLU N N 15 122.207 0.300 . 1 . . . . 44 GLU N . 10336 1 493 . 1 1 45 45 SER H H 1 8.632 0.030 . 1 . . . . 45 SER H . 10336 1 494 . 1 1 45 45 SER HA H 1 5.132 0.030 . 1 . . . . 45 SER HA . 10336 1 495 . 1 1 45 45 SER HB2 H 1 4.506 0.030 . 2 . . . . 45 SER HB2 . 10336 1 496 . 1 1 45 45 SER HB3 H 1 3.590 0.030 . 2 . . . . 45 SER HB3 . 10336 1 497 . 1 1 45 45 SER C C 13 173.718 0.300 . 1 . . . . 45 SER C . 10336 1 498 . 1 1 45 45 SER CA C 13 58.645 0.300 . 1 . . . . 45 SER CA . 10336 1 499 . 1 1 45 45 SER CB C 13 64.651 0.300 . 1 . . . . 45 SER CB . 10336 1 500 . 1 1 45 45 SER N N 15 120.497 0.300 . 1 . . . . 45 SER N . 10336 1 501 . 1 1 46 46 ASP H H 1 7.715 0.030 . 1 . . . . 46 ASP H . 10336 1 502 . 1 1 46 46 ASP HA H 1 4.718 0.030 . 1 . . . . 46 ASP HA . 10336 1 503 . 1 1 46 46 ASP HB2 H 1 2.121 0.030 . 2 . . . . 46 ASP HB2 . 10336 1 504 . 1 1 46 46 ASP HB3 H 1 2.904 0.030 . 2 . . . . 46 ASP HB3 . 10336 1 505 . 1 1 46 46 ASP C C 13 176.363 0.300 . 1 . . . . 46 ASP C . 10336 1 506 . 1 1 46 46 ASP CA C 13 55.892 0.300 . 1 . . . . 46 ASP CA . 10336 1 507 . 1 1 46 46 ASP CB C 13 42.033 0.300 . 1 . . . . 46 ASP CB . 10336 1 508 . 1 1 46 46 ASP N N 15 117.076 0.300 . 1 . . . . 46 ASP N . 10336 1 509 . 1 1 47 47 CYS H H 1 8.851 0.030 . 1 . . . . 47 CYS H . 10336 1 510 . 1 1 47 47 CYS HA H 1 4.378 0.030 . 1 . . . . 47 CYS HA . 10336 1 511 . 1 1 47 47 CYS HB2 H 1 2.969 0.030 . 2 . . . . 47 CYS HB2 . 10336 1 512 . 1 1 47 47 CYS HB3 H 1 2.916 0.030 . 2 . . . . 47 CYS HB3 . 10336 1 513 . 1 1 47 47 CYS C C 13 174.286 0.300 . 1 . . . . 47 CYS C . 10336 1 514 . 1 1 47 47 CYS CA C 13 59.787 0.300 . 1 . . . . 47 CYS CA . 10336 1 515 . 1 1 47 47 CYS CB C 13 28.423 0.300 . 1 . . . . 47 CYS CB . 10336 1 516 . 1 1 47 47 CYS N N 15 114.199 0.300 . 1 . . . . 47 CYS N . 10336 1 517 . 1 1 48 48 ASP H H 1 8.154 0.030 . 1 . . . . 48 ASP H . 10336 1 518 . 1 1 48 48 ASP HA H 1 4.513 0.030 . 1 . . . . 48 ASP HA . 10336 1 519 . 1 1 48 48 ASP HB2 H 1 3.017 0.030 . 2 . . . . 48 ASP HB2 . 10336 1 520 . 1 1 48 48 ASP HB3 H 1 3.184 0.030 . 2 . . . . 48 ASP HB3 . 10336 1 521 . 1 1 48 48 ASP C C 13 175.772 0.300 . 1 . . . . 48 ASP C . 10336 1 522 . 1 1 48 48 ASP CA C 13 54.342 0.300 . 1 . . . . 48 ASP CA . 10336 1 523 . 1 1 48 48 ASP CB C 13 38.630 0.300 . 1 . . . . 48 ASP CB . 10336 1 524 . 1 1 48 48 ASP N N 15 119.253 0.300 . 1 . . . . 48 ASP N . 10336 1 525 . 1 1 49 49 GLU H H 1 10.332 0.030 . 1 . . . . 49 GLU H . 10336 1 526 . 1 1 49 49 GLU HA H 1 4.058 0.030 . 1 . . . . 49 GLU HA . 10336 1 527 . 1 1 49 49 GLU HB2 H 1 1.890 0.030 . 2 . . . . 49 GLU HB2 . 10336 1 528 . 1 1 49 49 GLU HB3 H 1 1.729 0.030 . 2 . . . . 49 GLU HB3 . 10336 1 529 . 1 1 49 49 GLU HG2 H 1 2.540 0.030 . 2 . . . . 49 GLU HG2 . 10336 1 530 . 1 1 49 49 GLU HG3 H 1 1.898 0.030 . 2 . . . . 49 GLU HG3 . 10336 1 531 . 1 1 49 49 GLU C C 13 176.023 0.300 . 1 . . . . 49 GLU C . 10336 1 532 . 1 1 49 49 GLU CA C 13 58.054 0.300 . 1 . . . . 49 GLU CA . 10336 1 533 . 1 1 49 49 GLU CB C 13 29.430 0.300 . 1 . . . . 49 GLU CB . 10336 1 534 . 1 1 49 49 GLU CG C 13 34.856 0.300 . 1 . . . . 49 GLU CG . 10336 1 535 . 1 1 49 49 GLU N N 15 118.164 0.300 . 1 . . . . 49 GLU N . 10336 1 536 . 1 1 50 50 GLN H H 1 8.238 0.030 . 1 . . . . 50 GLN H . 10336 1 537 . 1 1 50 50 GLN HA H 1 4.838 0.030 . 1 . . . . 50 GLN HA . 10336 1 538 . 1 1 50 50 GLN HB2 H 1 1.866 0.030 . 2 . . . . 50 GLN HB2 . 10336 1 539 . 1 1 50 50 GLN HB3 H 1 2.004 0.030 . 2 . . . . 50 GLN HB3 . 10336 1 540 . 1 1 50 50 GLN HE21 H 1 7.161 0.030 . 2 . . . . 50 GLN HE21 . 10336 1 541 . 1 1 50 50 GLN HE22 H 1 7.545 0.030 . 2 . . . . 50 GLN HE22 . 10336 1 542 . 1 1 50 50 GLN HG2 H 1 2.210 0.030 . 2 . . . . 50 GLN HG2 . 10336 1 543 . 1 1 50 50 GLN HG3 H 1 2.226 0.030 . 2 . . . . 50 GLN HG3 . 10336 1 544 . 1 1 50 50 GLN C C 13 176.108 0.300 . 1 . . . . 50 GLN C . 10336 1 545 . 1 1 50 50 GLN CA C 13 56.259 0.300 . 1 . . . . 50 GLN CA . 10336 1 546 . 1 1 50 50 GLN CB C 13 30.580 0.300 . 1 . . . . 50 GLN CB . 10336 1 547 . 1 1 50 50 GLN CG C 13 35.260 0.300 . 1 . . . . 50 GLN CG . 10336 1 548 . 1 1 50 50 GLN N N 15 120.095 0.300 . 1 . . . . 50 GLN N . 10336 1 549 . 1 1 50 50 GLN NE2 N 15 111.090 0.300 . 1 . . . . 50 GLN NE2 . 10336 1 550 . 1 1 51 51 LEU H H 1 8.051 0.030 . 1 . . . . 51 LEU H . 10336 1 551 . 1 1 51 51 LEU HA H 1 5.191 0.030 . 1 . . . . 51 LEU HA . 10336 1 552 . 1 1 51 51 LEU HB2 H 1 1.633 0.030 . 2 . . . . 51 LEU HB2 . 10336 1 553 . 1 1 51 51 LEU HB3 H 1 1.499 0.030 . 2 . . . . 51 LEU HB3 . 10336 1 554 . 1 1 51 51 LEU HD11 H 1 0.895 0.030 . 1 . . . . 51 LEU HD1 . 10336 1 555 . 1 1 51 51 LEU HD12 H 1 0.895 0.030 . 1 . . . . 51 LEU HD1 . 10336 1 556 . 1 1 51 51 LEU HD13 H 1 0.895 0.030 . 1 . . . . 51 LEU HD1 . 10336 1 557 . 1 1 51 51 LEU HD21 H 1 0.780 0.030 . 1 . . . . 51 LEU HD2 . 10336 1 558 . 1 1 51 51 LEU HD22 H 1 0.780 0.030 . 1 . . . . 51 LEU HD2 . 10336 1 559 . 1 1 51 51 LEU HD23 H 1 0.780 0.030 . 1 . . . . 51 LEU HD2 . 10336 1 560 . 1 1 51 51 LEU HG H 1 1.238 0.030 . 1 . . . . 51 LEU HG . 10336 1 561 . 1 1 51 51 LEU C C 13 175.917 0.300 . 1 . . . . 51 LEU C . 10336 1 562 . 1 1 51 51 LEU CA C 13 54.444 0.300 . 1 . . . . 51 LEU CA . 10336 1 563 . 1 1 51 51 LEU CB C 13 50.019 0.300 . 1 . . . . 51 LEU CB . 10336 1 564 . 1 1 51 51 LEU CD1 C 13 24.805 0.300 . 2 . . . . 51 LEU CD1 . 10336 1 565 . 1 1 51 51 LEU CD2 C 13 26.404 0.300 . 2 . . . . 51 LEU CD2 . 10336 1 566 . 1 1 51 51 LEU CG C 13 28.126 0.300 . 1 . . . . 51 LEU CG . 10336 1 567 . 1 1 51 51 LEU N N 15 116.610 0.300 . 1 . . . . 51 LEU N . 10336 1 568 . 1 1 52 52 LEU H H 1 7.449 0.030 . 1 . . . . 52 LEU H . 10336 1 569 . 1 1 52 52 LEU HA H 1 5.427 0.030 . 1 . . . . 52 LEU HA . 10336 1 570 . 1 1 52 52 LEU HB2 H 1 1.405 0.030 . 2 . . . . 52 LEU HB2 . 10336 1 571 . 1 1 52 52 LEU HB3 H 1 1.154 0.030 . 2 . . . . 52 LEU HB3 . 10336 1 572 . 1 1 52 52 LEU HD11 H 1 0.369 0.030 . 1 . . . . 52 LEU HD1 . 10336 1 573 . 1 1 52 52 LEU HD12 H 1 0.369 0.030 . 1 . . . . 52 LEU HD1 . 10336 1 574 . 1 1 52 52 LEU HD13 H 1 0.369 0.030 . 1 . . . . 52 LEU HD1 . 10336 1 575 . 1 1 52 52 LEU HD21 H 1 -0.004 0.030 . 1 . . . . 52 LEU HD2 . 10336 1 576 . 1 1 52 52 LEU HD22 H 1 -0.004 0.030 . 1 . . . . 52 LEU HD2 . 10336 1 577 . 1 1 52 52 LEU HD23 H 1 -0.004 0.030 . 1 . . . . 52 LEU HD2 . 10336 1 578 . 1 1 52 52 LEU HG H 1 1.239 0.030 . 1 . . . . 52 LEU HG . 10336 1 579 . 1 1 52 52 LEU C C 13 175.470 0.300 . 1 . . . . 52 LEU C . 10336 1 580 . 1 1 52 52 LEU CA C 13 54.816 0.300 . 1 . . . . 52 LEU CA . 10336 1 581 . 1 1 52 52 LEU CB C 13 45.099 0.300 . 1 . . . . 52 LEU CB . 10336 1 582 . 1 1 52 52 LEU CD1 C 13 25.174 0.300 . 2 . . . . 52 LEU CD1 . 10336 1 583 . 1 1 52 52 LEU CD2 C 13 24.559 0.300 . 2 . . . . 52 LEU CD2 . 10336 1 584 . 1 1 52 52 LEU CG C 13 28.003 0.300 . 1 . . . . 52 LEU CG . 10336 1 585 . 1 1 52 52 LEU N N 15 122.985 0.300 . 1 . . . . 52 LEU N . 10336 1 586 . 1 1 53 53 ILE H H 1 9.471 0.030 . 1 . . . . 53 ILE H . 10336 1 587 . 1 1 53 53 ILE HA H 1 4.638 0.030 . 1 . . . . 53 ILE HA . 10336 1 588 . 1 1 53 53 ILE HB H 1 1.872 0.030 . 1 . . . . 53 ILE HB . 10336 1 589 . 1 1 53 53 ILE HD11 H 1 0.852 0.030 . 1 . . . . 53 ILE HD1 . 10336 1 590 . 1 1 53 53 ILE HD12 H 1 0.852 0.030 . 1 . . . . 53 ILE HD1 . 10336 1 591 . 1 1 53 53 ILE HD13 H 1 0.852 0.030 . 1 . . . . 53 ILE HD1 . 10336 1 592 . 1 1 53 53 ILE HG12 H 1 1.238 0.030 . 2 . . . . 53 ILE HG12 . 10336 1 593 . 1 1 53 53 ILE HG13 H 1 1.735 0.030 . 2 . . . . 53 ILE HG13 . 10336 1 594 . 1 1 53 53 ILE HG21 H 1 0.923 0.030 . 1 . . . . 53 ILE HG2 . 10336 1 595 . 1 1 53 53 ILE HG22 H 1 0.923 0.030 . 1 . . . . 53 ILE HG2 . 10336 1 596 . 1 1 53 53 ILE HG23 H 1 0.923 0.030 . 1 . . . . 53 ILE HG2 . 10336 1 597 . 1 1 53 53 ILE C C 13 174.911 0.300 . 1 . . . . 53 ILE C . 10336 1 598 . 1 1 53 53 ILE CA C 13 60.644 0.300 . 1 . . . . 53 ILE CA . 10336 1 599 . 1 1 53 53 ILE CB C 13 42.148 0.300 . 1 . . . . 53 ILE CB . 10336 1 600 . 1 1 53 53 ILE CD1 C 13 13.982 0.300 . 1 . . . . 53 ILE CD1 . 10336 1 601 . 1 1 53 53 ILE CG1 C 13 28.126 0.300 . 1 . . . . 53 ILE CG1 . 10336 1 602 . 1 1 53 53 ILE CG2 C 13 18.754 0.300 . 1 . . . . 53 ILE CG2 . 10336 1 603 . 1 1 53 53 ILE N N 15 128.661 0.300 . 1 . . . . 53 ILE N . 10336 1 604 . 1 1 54 54 THR H H 1 9.526 0.030 . 1 . . . . 54 THR H . 10336 1 605 . 1 1 54 54 THR HA H 1 5.445 0.030 . 1 . . . . 54 THR HA . 10336 1 606 . 1 1 54 54 THR HB H 1 3.904 0.030 . 1 . . . . 54 THR HB . 10336 1 607 . 1 1 54 54 THR HG21 H 1 1.056 0.030 . 1 . . . . 54 THR HG2 . 10336 1 608 . 1 1 54 54 THR HG22 H 1 1.056 0.030 . 1 . . . . 54 THR HG2 . 10336 1 609 . 1 1 54 54 THR HG23 H 1 1.056 0.030 . 1 . . . . 54 THR HG2 . 10336 1 610 . 1 1 54 54 THR C C 13 173.333 0.300 . 1 . . . . 54 THR C . 10336 1 611 . 1 1 54 54 THR CA C 13 62.438 0.300 . 1 . . . . 54 THR CA . 10336 1 612 . 1 1 54 54 THR CB C 13 70.682 0.300 . 1 . . . . 54 THR CB . 10336 1 613 . 1 1 54 54 THR CG2 C 13 20.500 0.300 . 1 . . . . 54 THR CG2 . 10336 1 614 . 1 1 54 54 THR N N 15 125.240 0.300 . 1 . . . . 54 THR N . 10336 1 615 . 1 1 55 55 VAL H H 1 9.463 0.030 . 1 . . . . 55 VAL H . 10336 1 616 . 1 1 55 55 VAL HA H 1 4.808 0.030 . 1 . . . . 55 VAL HA . 10336 1 617 . 1 1 55 55 VAL HB H 1 1.899 0.030 . 1 . . . . 55 VAL HB . 10336 1 618 . 1 1 55 55 VAL HG11 H 1 1.030 0.030 . 1 . . . . 55 VAL HG1 . 10336 1 619 . 1 1 55 55 VAL HG12 H 1 1.030 0.030 . 1 . . . . 55 VAL HG1 . 10336 1 620 . 1 1 55 55 VAL HG13 H 1 1.030 0.030 . 1 . . . . 55 VAL HG1 . 10336 1 621 . 1 1 55 55 VAL HG21 H 1 0.582 0.030 . 1 . . . . 55 VAL HG2 . 10336 1 622 . 1 1 55 55 VAL HG22 H 1 0.582 0.030 . 1 . . . . 55 VAL HG2 . 10336 1 623 . 1 1 55 55 VAL HG23 H 1 0.582 0.030 . 1 . . . . 55 VAL HG2 . 10336 1 624 . 1 1 55 55 VAL C C 13 173.352 0.300 . 1 . . . . 55 VAL C . 10336 1 625 . 1 1 55 55 VAL CA C 13 59.706 0.300 . 1 . . . . 55 VAL CA . 10336 1 626 . 1 1 55 55 VAL CB C 13 34.270 0.300 . 1 . . . . 55 VAL CB . 10336 1 627 . 1 1 55 55 VAL CG1 C 13 21.361 0.300 . 2 . . . . 55 VAL CG1 . 10336 1 628 . 1 1 55 55 VAL CG2 C 13 22.085 0.300 . 2 . . . . 55 VAL CG2 . 10336 1 629 . 1 1 55 55 VAL N N 15 124.462 0.300 . 1 . . . . 55 VAL N . 10336 1 630 . 1 1 56 56 ALA H H 1 6.720 0.030 . 1 . . . . 56 ALA H . 10336 1 631 . 1 1 56 56 ALA HA H 1 4.644 0.030 . 1 . . . . 56 ALA HA . 10336 1 632 . 1 1 56 56 ALA HB1 H 1 1.378 0.030 . 1 . . . . 56 ALA HB . 10336 1 633 . 1 1 56 56 ALA HB2 H 1 1.378 0.030 . 1 . . . . 56 ALA HB . 10336 1 634 . 1 1 56 56 ALA HB3 H 1 1.378 0.030 . 1 . . . . 56 ALA HB . 10336 1 635 . 1 1 56 56 ALA C C 13 175.770 0.300 . 1 . . . . 56 ALA C . 10336 1 636 . 1 1 56 56 ALA CA C 13 49.978 0.300 . 1 . . . . 56 ALA CA . 10336 1 637 . 1 1 56 56 ALA CB C 13 21.331 0.300 . 1 . . . . 56 ALA CB . 10336 1 638 . 1 1 56 56 ALA N N 15 127.960 0.300 . 1 . . . . 56 ALA N . 10336 1 639 . 1 1 57 57 PHE H H 1 8.309 0.030 . 1 . . . . 57 PHE H . 10336 1 640 . 1 1 57 57 PHE HA H 1 5.280 0.030 . 1 . . . . 57 PHE HA . 10336 1 641 . 1 1 57 57 PHE HB2 H 1 3.444 0.030 . 2 . . . . 57 PHE HB2 . 10336 1 642 . 1 1 57 57 PHE HB3 H 1 2.899 0.030 . 2 . . . . 57 PHE HB3 . 10336 1 643 . 1 1 57 57 PHE HD1 H 1 6.872 0.030 . 1 . . . . 57 PHE HD1 . 10336 1 644 . 1 1 57 57 PHE HD2 H 1 6.872 0.030 . 1 . . . . 57 PHE HD2 . 10336 1 645 . 1 1 57 57 PHE HE1 H 1 6.867 0.030 . 1 . . . . 57 PHE HE1 . 10336 1 646 . 1 1 57 57 PHE HE2 H 1 6.867 0.030 . 1 . . . . 57 PHE HE2 . 10336 1 647 . 1 1 57 57 PHE HZ H 1 7.091 0.030 . 1 . . . . 57 PHE HZ . 10336 1 648 . 1 1 57 57 PHE C C 13 177.525 0.300 . 1 . . . . 57 PHE C . 10336 1 649 . 1 1 57 57 PHE CA C 13 57.442 0.300 . 1 . . . . 57 PHE CA . 10336 1 650 . 1 1 57 57 PHE CB C 13 42.271 0.300 . 1 . . . . 57 PHE CB . 10336 1 651 . 1 1 57 57 PHE CD1 C 13 131.934 0.300 . 1 . . . . 57 PHE CD1 . 10336 1 652 . 1 1 57 57 PHE CD2 C 13 131.934 0.300 . 1 . . . . 57 PHE CD2 . 10336 1 653 . 1 1 57 57 PHE CE1 C 13 130.581 0.300 . 1 . . . . 57 PHE CE1 . 10336 1 654 . 1 1 57 57 PHE CE2 C 13 130.581 0.300 . 1 . . . . 57 PHE CE2 . 10336 1 655 . 1 1 57 57 PHE CZ C 13 129.351 0.300 . 1 . . . . 57 PHE CZ . 10336 1 656 . 1 1 57 57 PHE N N 15 118.553 0.300 . 1 . . . . 57 PHE N . 10336 1 657 . 1 1 58 58 ASN H H 1 9.804 0.030 . 1 . . . . 58 ASN H . 10336 1 658 . 1 1 58 58 ASN HA H 1 4.585 0.030 . 1 . . . . 58 ASN HA . 10336 1 659 . 1 1 58 58 ASN HB2 H 1 3.059 0.030 . 2 . . . . 58 ASN HB2 . 10336 1 660 . 1 1 58 58 ASN HB3 H 1 2.850 0.030 . 2 . . . . 58 ASN HB3 . 10336 1 661 . 1 1 58 58 ASN HD21 H 1 6.825 0.030 . 2 . . . . 58 ASN HD21 . 10336 1 662 . 1 1 58 58 ASN HD22 H 1 7.590 0.030 . 2 . . . . 58 ASN HD22 . 10336 1 663 . 1 1 58 58 ASN C C 13 174.194 0.300 . 1 . . . . 58 ASN C . 10336 1 664 . 1 1 58 58 ASN CA C 13 54.383 0.300 . 1 . . . . 58 ASN CA . 10336 1 665 . 1 1 58 58 ASN CB C 13 39.109 0.300 . 1 . . . . 58 ASN CB . 10336 1 666 . 1 1 58 58 ASN N N 15 120.264 0.300 . 1 . . . . 58 ASN N . 10336 1 667 . 1 1 58 58 ASN ND2 N 15 110.934 0.300 . 1 . . . . 58 ASN ND2 . 10336 1 668 . 1 1 59 59 GLN H H 1 7.929 0.030 . 1 . . . . 59 GLN H . 10336 1 669 . 1 1 59 59 GLN HA H 1 4.825 0.030 . 1 . . . . 59 GLN HA . 10336 1 670 . 1 1 59 59 GLN HB2 H 1 2.260 0.030 . 2 . . . . 59 GLN HB2 . 10336 1 671 . 1 1 59 59 GLN HB3 H 1 2.157 0.030 . 2 . . . . 59 GLN HB3 . 10336 1 672 . 1 1 59 59 GLN HE21 H 1 7.773 0.030 . 2 . . . . 59 GLN HE21 . 10336 1 673 . 1 1 59 59 GLN HE22 H 1 6.901 0.030 . 2 . . . . 59 GLN HE22 . 10336 1 674 . 1 1 59 59 GLN HG2 H 1 2.315 0.030 . 2 . . . . 59 GLN HG2 . 10336 1 675 . 1 1 59 59 GLN HG3 H 1 1.822 0.030 . 2 . . . . 59 GLN HG3 . 10336 1 676 . 1 1 59 59 GLN C C 13 170.702 0.300 . 1 . . . . 59 GLN C . 10336 1 677 . 1 1 59 59 GLN CA C 13 52.938 0.300 . 1 . . . . 59 GLN CA . 10336 1 678 . 1 1 59 59 GLN CB C 13 30.340 0.300 . 1 . . . . 59 GLN CB . 10336 1 679 . 1 1 59 59 GLN CG C 13 32.800 0.300 . 1 . . . . 59 GLN CG . 10336 1 680 . 1 1 59 59 GLN N N 15 114.665 0.300 . 1 . . . . 59 GLN N . 10336 1 681 . 1 1 59 59 GLN NE2 N 15 112.023 0.300 . 1 . . . . 59 GLN NE2 . 10336 1 682 . 1 1 60 60 PRO HA H 1 4.576 0.030 . 1 . . . . 60 PRO HA . 10336 1 683 . 1 1 60 60 PRO HB2 H 1 2.141 0.030 . 2 . . . . 60 PRO HB2 . 10336 1 684 . 1 1 60 60 PRO HB3 H 1 1.619 0.030 . 2 . . . . 60 PRO HB3 . 10336 1 685 . 1 1 60 60 PRO HD2 H 1 3.694 0.030 . 1 . . . . 60 PRO HD2 . 10336 1 686 . 1 1 60 60 PRO HD3 H 1 3.694 0.030 . 1 . . . . 60 PRO HD3 . 10336 1 687 . 1 1 60 60 PRO HG2 H 1 2.134 0.030 . 2 . . . . 60 PRO HG2 . 10336 1 688 . 1 1 60 60 PRO HG3 H 1 1.994 0.030 . 2 . . . . 60 PRO HG3 . 10336 1 689 . 1 1 60 60 PRO C C 13 178.260 0.300 . 1 . . . . 60 PRO C . 10336 1 690 . 1 1 60 60 PRO CA C 13 62.906 0.300 . 1 . . . . 60 PRO CA . 10336 1 691 . 1 1 60 60 PRO CB C 13 31.324 0.300 . 1 . . . . 60 PRO CB . 10336 1 692 . 1 1 60 60 PRO CD C 13 49.773 0.300 . 1 . . . . 60 PRO CD . 10336 1 693 . 1 1 60 60 PRO CG C 13 28.139 0.300 . 1 . . . . 60 PRO CG . 10336 1 694 . 1 1 61 61 VAL H H 1 8.882 0.030 . 1 . . . . 61 VAL H . 10336 1 695 . 1 1 61 61 VAL HA H 1 4.625 0.030 . 1 . . . . 61 VAL HA . 10336 1 696 . 1 1 61 61 VAL HB H 1 1.461 0.030 . 1 . . . . 61 VAL HB . 10336 1 697 . 1 1 61 61 VAL HG11 H 1 0.368 0.030 . 1 . . . . 61 VAL HG1 . 10336 1 698 . 1 1 61 61 VAL HG12 H 1 0.368 0.030 . 1 . . . . 61 VAL HG1 . 10336 1 699 . 1 1 61 61 VAL HG13 H 1 0.368 0.030 . 1 . . . . 61 VAL HG1 . 10336 1 700 . 1 1 61 61 VAL HG21 H 1 -0.460 0.030 . 1 . . . . 61 VAL HG2 . 10336 1 701 . 1 1 61 61 VAL HG22 H 1 -0.460 0.030 . 1 . . . . 61 VAL HG2 . 10336 1 702 . 1 1 61 61 VAL HG23 H 1 -0.460 0.030 . 1 . . . . 61 VAL HG2 . 10336 1 703 . 1 1 61 61 VAL C C 13 172.619 0.300 . 1 . . . . 61 VAL C . 10336 1 704 . 1 1 61 61 VAL CA C 13 59.032 0.300 . 1 . . . . 61 VAL CA . 10336 1 705 . 1 1 61 61 VAL CB C 13 35.875 0.300 . 1 . . . . 61 VAL CB . 10336 1 706 . 1 1 61 61 VAL CG1 C 13 20.042 0.300 . 2 . . . . 61 VAL CG1 . 10336 1 707 . 1 1 61 61 VAL CG2 C 13 17.303 0.300 . 2 . . . . 61 VAL CG2 . 10336 1 708 . 1 1 61 61 VAL N N 15 116.532 0.300 . 1 . . . . 61 VAL N . 10336 1 709 . 1 1 62 62 LYS H H 1 8.586 0.030 . 1 . . . . 62 LYS H . 10336 1 710 . 1 1 62 62 LYS HA H 1 5.172 0.030 . 1 . . . . 62 LYS HA . 10336 1 711 . 1 1 62 62 LYS HB2 H 1 1.650 0.030 . 2 . . . . 62 LYS HB2 . 10336 1 712 . 1 1 62 62 LYS HB3 H 1 1.901 0.030 . 2 . . . . 62 LYS HB3 . 10336 1 713 . 1 1 62 62 LYS HD2 H 1 1.650 0.030 . 1 . . . . 62 LYS HD2 . 10336 1 714 . 1 1 62 62 LYS HD3 H 1 1.650 0.030 . 1 . . . . 62 LYS HD3 . 10336 1 715 . 1 1 62 62 LYS HE2 H 1 2.969 0.030 . 1 . . . . 62 LYS HE2 . 10336 1 716 . 1 1 62 62 LYS HE3 H 1 2.969 0.030 . 1 . . . . 62 LYS HE3 . 10336 1 717 . 1 1 62 62 LYS HG2 H 1 1.180 0.030 . 2 . . . . 62 LYS HG2 . 10336 1 718 . 1 1 62 62 LYS HG3 H 1 1.426 0.030 . 2 . . . . 62 LYS HG3 . 10336 1 719 . 1 1 62 62 LYS C C 13 176.804 0.300 . 1 . . . . 62 LYS C . 10336 1 720 . 1 1 62 62 LYS CA C 13 53.853 0.300 . 1 . . . . 62 LYS CA . 10336 1 721 . 1 1 62 62 LYS CB C 13 34.645 0.300 . 1 . . . . 62 LYS CB . 10336 1 722 . 1 1 62 62 LYS CD C 13 30.244 0.300 . 1 . . . . 62 LYS CD . 10336 1 723 . 1 1 62 62 LYS CE C 13 42.763 0.300 . 1 . . . . 62 LYS CE . 10336 1 724 . 1 1 62 62 LYS CG C 13 24.878 0.300 . 1 . . . . 62 LYS CG . 10336 1 725 . 1 1 62 62 LYS N N 15 117.620 0.300 . 1 . . . . 62 LYS N . 10336 1 726 . 1 1 63 63 LEU H H 1 7.988 0.030 . 1 . . . . 63 LEU H . 10336 1 727 . 1 1 63 63 LEU HA H 1 4.394 0.030 . 1 . . . . 63 LEU HA . 10336 1 728 . 1 1 63 63 LEU HB2 H 1 0.725 0.030 . 2 . . . . 63 LEU HB2 . 10336 1 729 . 1 1 63 63 LEU HB3 H 1 1.436 0.030 . 2 . . . . 63 LEU HB3 . 10336 1 730 . 1 1 63 63 LEU HD11 H 1 0.069 0.030 . 1 . . . . 63 LEU HD1 . 10336 1 731 . 1 1 63 63 LEU HD12 H 1 0.069 0.030 . 1 . . . . 63 LEU HD1 . 10336 1 732 . 1 1 63 63 LEU HD13 H 1 0.069 0.030 . 1 . . . . 63 LEU HD1 . 10336 1 733 . 1 1 63 63 LEU HD21 H 1 0.022 0.030 . 1 . . . . 63 LEU HD2 . 10336 1 734 . 1 1 63 63 LEU HD22 H 1 0.022 0.030 . 1 . . . . 63 LEU HD2 . 10336 1 735 . 1 1 63 63 LEU HD23 H 1 0.022 0.030 . 1 . . . . 63 LEU HD2 . 10336 1 736 . 1 1 63 63 LEU HG H 1 1.216 0.030 . 1 . . . . 63 LEU HG . 10336 1 737 . 1 1 63 63 LEU C C 13 173.816 0.300 . 1 . . . . 63 LEU C . 10336 1 738 . 1 1 63 63 LEU CA C 13 53.709 0.300 . 1 . . . . 63 LEU CA . 10336 1 739 . 1 1 63 63 LEU CB C 13 43.008 0.300 . 1 . . . . 63 LEU CB . 10336 1 740 . 1 1 63 63 LEU CD1 C 13 24.190 0.300 . 2 . . . . 63 LEU CD1 . 10336 1 741 . 1 1 63 63 LEU CD2 C 13 24.559 0.300 . 2 . . . . 63 LEU CD2 . 10336 1 742 . 1 1 63 63 LEU CG C 13 25.910 0.300 . 1 . . . . 63 LEU CG . 10336 1 743 . 1 1 63 63 LEU N N 15 118.706 0.300 . 1 . . . . 63 LEU N . 10336 1 744 . 1 1 64 64 TYR H H 1 8.745 0.030 . 1 . . . . 64 TYR H . 10336 1 745 . 1 1 64 64 TYR HA H 1 4.486 0.030 . 1 . . . . 64 TYR HA . 10336 1 746 . 1 1 64 64 TYR HB2 H 1 2.531 0.030 . 2 . . . . 64 TYR HB2 . 10336 1 747 . 1 1 64 64 TYR HB3 H 1 2.162 0.030 . 2 . . . . 64 TYR HB3 . 10336 1 748 . 1 1 64 64 TYR HD1 H 1 6.364 0.030 . 1 . . . . 64 TYR HD1 . 10336 1 749 . 1 1 64 64 TYR HD2 H 1 6.364 0.030 . 1 . . . . 64 TYR HD2 . 10336 1 750 . 1 1 64 64 TYR HE1 H 1 6.269 0.030 . 1 . . . . 64 TYR HE1 . 10336 1 751 . 1 1 64 64 TYR HE2 H 1 6.269 0.030 . 1 . . . . 64 TYR HE2 . 10336 1 752 . 1 1 64 64 TYR C C 13 176.169 0.300 . 1 . . . . 64 TYR C . 10336 1 753 . 1 1 64 64 TYR CA C 13 59.481 0.300 . 1 . . . . 64 TYR CA . 10336 1 754 . 1 1 64 64 TYR CB C 13 41.533 0.300 . 1 . . . . 64 TYR CB . 10336 1 755 . 1 1 64 64 TYR CD1 C 13 132.180 0.300 . 1 . . . . 64 TYR CD1 . 10336 1 756 . 1 1 64 64 TYR CD2 C 13 132.180 0.300 . 1 . . . . 64 TYR CD2 . 10336 1 757 . 1 1 64 64 TYR CE1 C 13 117.912 0.300 . 1 . . . . 64 TYR CE1 . 10336 1 758 . 1 1 64 64 TYR CE2 C 13 117.912 0.300 . 1 . . . . 64 TYR CE2 . 10336 1 759 . 1 1 64 64 TYR N N 15 118.631 0.300 . 1 . . . . 64 TYR N . 10336 1 760 . 1 1 65 65 SER H H 1 8.483 0.030 . 1 . . . . 65 SER H . 10336 1 761 . 1 1 65 65 SER HA H 1 4.981 0.030 . 1 . . . . 65 SER HA . 10336 1 762 . 1 1 65 65 SER HB2 H 1 3.782 0.030 . 2 . . . . 65 SER HB2 . 10336 1 763 . 1 1 65 65 SER HB3 H 1 3.464 0.030 . 2 . . . . 65 SER HB3 . 10336 1 764 . 1 1 65 65 SER C C 13 171.600 0.300 . 1 . . . . 65 SER C . 10336 1 765 . 1 1 65 65 SER CA C 13 57.276 0.300 . 1 . . . . 65 SER CA . 10336 1 766 . 1 1 65 65 SER CB C 13 66.132 0.300 . 1 . . . . 65 SER CB . 10336 1 767 . 1 1 65 65 SER N N 15 112.567 0.300 . 1 . . . . 65 SER N . 10336 1 768 . 1 1 66 66 MET H H 1 9.178 0.030 . 1 . . . . 66 MET H . 10336 1 769 . 1 1 66 66 MET HA H 1 5.038 0.030 . 1 . . . . 66 MET HA . 10336 1 770 . 1 1 66 66 MET HB2 H 1 1.883 0.030 . 2 . . . . 66 MET HB2 . 10336 1 771 . 1 1 66 66 MET HB3 H 1 1.824 0.030 . 2 . . . . 66 MET HB3 . 10336 1 772 . 1 1 66 66 MET HE1 H 1 1.387 0.030 . 1 . . . . 66 MET HE . 10336 1 773 . 1 1 66 66 MET HE2 H 1 1.387 0.030 . 1 . . . . 66 MET HE . 10336 1 774 . 1 1 66 66 MET HE3 H 1 1.387 0.030 . 1 . . . . 66 MET HE . 10336 1 775 . 1 1 66 66 MET HG2 H 1 1.961 0.030 . 2 . . . . 66 MET HG2 . 10336 1 776 . 1 1 66 66 MET HG3 H 1 2.174 0.030 . 2 . . . . 66 MET HG3 . 10336 1 777 . 1 1 66 66 MET C C 13 173.410 0.300 . 1 . . . . 66 MET C . 10336 1 778 . 1 1 66 66 MET CA C 13 54.566 0.300 . 1 . . . . 66 MET CA . 10336 1 779 . 1 1 66 66 MET CB C 13 38.089 0.300 . 1 . . . . 66 MET CB . 10336 1 780 . 1 1 66 66 MET CE C 13 16.319 0.300 . 1 . . . . 66 MET CE . 10336 1 781 . 1 1 66 66 MET CG C 13 31.447 0.300 . 1 . . . . 66 MET CG . 10336 1 782 . 1 1 66 66 MET N N 15 120.186 0.300 . 1 . . . . 66 MET N . 10336 1 783 . 1 1 67 67 LYS H H 1 8.409 0.030 . 1 . . . . 67 LYS H . 10336 1 784 . 1 1 67 67 LYS HA H 1 4.730 0.030 . 1 . . . . 67 LYS HA . 10336 1 785 . 1 1 67 67 LYS HB2 H 1 1.411 0.030 . 2 . . . . 67 LYS HB2 . 10336 1 786 . 1 1 67 67 LYS HB3 H 1 1.653 0.030 . 2 . . . . 67 LYS HB3 . 10336 1 787 . 1 1 67 67 LYS HD2 H 1 1.774 0.030 . 2 . . . . 67 LYS HD2 . 10336 1 788 . 1 1 67 67 LYS HD3 H 1 1.635 0.030 . 2 . . . . 67 LYS HD3 . 10336 1 789 . 1 1 67 67 LYS HE2 H 1 2.789 0.030 . 2 . . . . 67 LYS HE2 . 10336 1 790 . 1 1 67 67 LYS HE3 H 1 2.898 0.030 . 2 . . . . 67 LYS HE3 . 10336 1 791 . 1 1 67 67 LYS HG2 H 1 1.195 0.030 . 2 . . . . 67 LYS HG2 . 10336 1 792 . 1 1 67 67 LYS HG3 H 1 1.620 0.030 . 2 . . . . 67 LYS HG3 . 10336 1 793 . 1 1 67 67 LYS C C 13 174.246 0.300 . 1 . . . . 67 LYS C . 10336 1 794 . 1 1 67 67 LYS CA C 13 55.463 0.300 . 1 . . . . 67 LYS CA . 10336 1 795 . 1 1 67 67 LYS CB C 13 34.509 0.300 . 1 . . . . 67 LYS CB . 10336 1 796 . 1 1 67 67 LYS CD C 13 30.340 0.300 . 1 . . . . 67 LYS CD . 10336 1 797 . 1 1 67 67 LYS CE C 13 42.639 0.300 . 1 . . . . 67 LYS CE . 10336 1 798 . 1 1 67 67 LYS CG C 13 25.877 0.300 . 1 . . . . 67 LYS CG . 10336 1 799 . 1 1 67 67 LYS N N 15 122.052 0.300 . 1 . . . . 67 LYS N . 10336 1 800 . 1 1 68 68 PHE H H 1 9.595 0.030 . 1 . . . . 68 PHE H . 10336 1 801 . 1 1 68 68 PHE HA H 1 4.771 0.030 . 1 . . . . 68 PHE HA . 10336 1 802 . 1 1 68 68 PHE HB2 H 1 3.251 0.030 . 2 . . . . 68 PHE HB2 . 10336 1 803 . 1 1 68 68 PHE HB3 H 1 2.432 0.030 . 2 . . . . 68 PHE HB3 . 10336 1 804 . 1 1 68 68 PHE HD1 H 1 7.043 0.030 . 1 . . . . 68 PHE HD1 . 10336 1 805 . 1 1 68 68 PHE HD2 H 1 7.043 0.030 . 1 . . . . 68 PHE HD2 . 10336 1 806 . 1 1 68 68 PHE HE1 H 1 6.473 0.030 . 1 . . . . 68 PHE HE1 . 10336 1 807 . 1 1 68 68 PHE HE2 H 1 6.473 0.030 . 1 . . . . 68 PHE HE2 . 10336 1 808 . 1 1 68 68 PHE HZ H 1 6.568 0.030 . 1 . . . . 68 PHE HZ . 10336 1 809 . 1 1 68 68 PHE C C 13 172.038 0.300 . 1 . . . . 68 PHE C . 10336 1 810 . 1 1 68 68 PHE CA C 13 59.032 0.300 . 1 . . . . 68 PHE CA . 10336 1 811 . 1 1 68 68 PHE CB C 13 41.075 0.300 . 1 . . . . 68 PHE CB . 10336 1 812 . 1 1 68 68 PHE CD1 C 13 131.688 0.300 . 1 . . . . 68 PHE CD1 . 10336 1 813 . 1 1 68 68 PHE CD2 C 13 131.688 0.300 . 1 . . . . 68 PHE CD2 . 10336 1 814 . 1 1 68 68 PHE CE1 C 13 129.720 0.300 . 1 . . . . 68 PHE CE1 . 10336 1 815 . 1 1 68 68 PHE CE2 C 13 129.720 0.300 . 1 . . . . 68 PHE CE2 . 10336 1 816 . 1 1 68 68 PHE CZ C 13 128.244 0.300 . 1 . . . . 68 PHE CZ . 10336 1 817 . 1 1 68 68 PHE N N 15 130.524 0.300 . 1 . . . . 68 PHE N . 10336 1 818 . 1 1 69 69 GLN H H 1 8.533 0.030 . 1 . . . . 69 GLN H . 10336 1 819 . 1 1 69 69 GLN HA H 1 4.784 0.030 . 1 . . . . 69 GLN HA . 10336 1 820 . 1 1 69 69 GLN HB2 H 1 1.959 0.030 . 1 . . . . 69 GLN HB2 . 10336 1 821 . 1 1 69 69 GLN HB3 H 1 1.959 0.030 . 1 . . . . 69 GLN HB3 . 10336 1 822 . 1 1 69 69 GLN HE21 H 1 6.301 0.030 . 2 . . . . 69 GLN HE21 . 10336 1 823 . 1 1 69 69 GLN HE22 H 1 7.204 0.030 . 2 . . . . 69 GLN HE22 . 10336 1 824 . 1 1 69 69 GLN HG2 H 1 2.386 0.030 . 2 . . . . 69 GLN HG2 . 10336 1 825 . 1 1 69 69 GLN HG3 H 1 2.452 0.030 . 2 . . . . 69 GLN HG3 . 10336 1 826 . 1 1 69 69 GLN C C 13 177.150 0.300 . 1 . . . . 69 GLN C . 10336 1 827 . 1 1 69 69 GLN CA C 13 54.261 0.300 . 1 . . . . 69 GLN CA . 10336 1 828 . 1 1 69 69 GLN CB C 13 31.921 0.300 . 1 . . . . 69 GLN CB . 10336 1 829 . 1 1 69 69 GLN CG C 13 33.784 0.300 . 1 . . . . 69 GLN CG . 10336 1 830 . 1 1 69 69 GLN N N 15 119.408 0.300 . 1 . . . . 69 GLN N . 10336 1 831 . 1 1 69 69 GLN NE2 N 15 108.135 0.300 . 1 . . . . 69 GLN NE2 . 10336 1 832 . 1 1 70 70 GLY H H 1 8.653 0.030 . 1 . . . . 70 GLY H . 10336 1 833 . 1 1 70 70 GLY HA2 H 1 4.032 0.030 . 2 . . . . 70 GLY HA2 . 10336 1 834 . 1 1 70 70 GLY HA3 H 1 4.390 0.030 . 2 . . . . 70 GLY HA3 . 10336 1 835 . 1 1 70 70 GLY C C 13 169.123 0.300 . 1 . . . . 70 GLY C . 10336 1 836 . 1 1 70 70 GLY CA C 13 45.378 0.300 . 1 . . . . 70 GLY CA . 10336 1 837 . 1 1 70 70 GLY N N 15 106.349 0.300 . 1 . . . . 70 GLY N . 10336 1 838 . 1 1 71 71 PRO HA H 1 4.559 0.030 . 1 . . . . 71 PRO HA . 10336 1 839 . 1 1 71 71 PRO HB2 H 1 1.869 0.030 . 2 . . . . 71 PRO HB2 . 10336 1 840 . 1 1 71 71 PRO HB3 H 1 2.122 0.030 . 2 . . . . 71 PRO HB3 . 10336 1 841 . 1 1 71 71 PRO HD2 H 1 3.369 0.030 . 2 . . . . 71 PRO HD2 . 10336 1 842 . 1 1 71 71 PRO HD3 H 1 2.906 0.030 . 2 . . . . 71 PRO HD3 . 10336 1 843 . 1 1 71 71 PRO HG2 H 1 1.507 0.030 . 2 . . . . 71 PRO HG2 . 10336 1 844 . 1 1 71 71 PRO HG3 H 1 1.688 0.030 . 2 . . . . 71 PRO HG3 . 10336 1 845 . 1 1 71 71 PRO C C 13 175.840 0.300 . 1 . . . . 71 PRO C . 10336 1 846 . 1 1 71 71 PRO CA C 13 62.336 0.300 . 1 . . . . 71 PRO CA . 10336 1 847 . 1 1 71 71 PRO CB C 13 33.292 0.300 . 1 . . . . 71 PRO CB . 10336 1 848 . 1 1 71 71 PRO CD C 13 48.717 0.300 . 1 . . . . 71 PRO CD . 10336 1 849 . 1 1 71 71 PRO CG C 13 27.265 0.300 . 1 . . . . 71 PRO CG . 10336 1 850 . 1 1 72 72 ASP H H 1 8.063 0.030 . 1 . . . . 72 ASP H . 10336 1 851 . 1 1 72 72 ASP HA H 1 4.519 0.030 . 1 . . . . 72 ASP HA . 10336 1 852 . 1 1 72 72 ASP HB2 H 1 3.070 0.030 . 2 . . . . 72 ASP HB2 . 10336 1 853 . 1 1 72 72 ASP HB3 H 1 2.667 0.030 . 2 . . . . 72 ASP HB3 . 10336 1 854 . 1 1 72 72 ASP C C 13 176.396 0.300 . 1 . . . . 72 ASP C . 10336 1 855 . 1 1 72 72 ASP CA C 13 53.730 0.300 . 1 . . . . 72 ASP CA . 10336 1 856 . 1 1 72 72 ASP CB C 13 40.180 0.300 . 1 . . . . 72 ASP CB . 10336 1 857 . 1 1 72 72 ASP N N 15 117.464 0.300 . 1 . . . . 72 ASP N . 10336 1 858 . 1 1 73 73 ASN H H 1 7.367 0.030 . 1 . . . . 73 ASN H . 10336 1 859 . 1 1 73 73 ASN HA H 1 4.588 0.030 . 1 . . . . 73 ASN HA . 10336 1 860 . 1 1 73 73 ASN HB2 H 1 2.758 0.030 . 2 . . . . 73 ASN HB2 . 10336 1 861 . 1 1 73 73 ASN HB3 H 1 3.181 0.030 . 2 . . . . 73 ASN HB3 . 10336 1 862 . 1 1 73 73 ASN HD21 H 1 7.280 0.030 . 2 . . . . 73 ASN HD21 . 10336 1 863 . 1 1 73 73 ASN HD22 H 1 7.708 0.030 . 2 . . . . 73 ASN HD22 . 10336 1 864 . 1 1 73 73 ASN C C 13 175.385 0.300 . 1 . . . . 73 ASN C . 10336 1 865 . 1 1 73 73 ASN CA C 13 53.057 0.300 . 1 . . . . 73 ASN CA . 10336 1 866 . 1 1 73 73 ASN CB C 13 38.630 0.300 . 1 . . . . 73 ASN CB . 10336 1 867 . 1 1 73 73 ASN N N 15 117.690 0.300 . 1 . . . . 73 ASN N . 10336 1 868 . 1 1 73 73 ASN ND2 N 15 111.789 0.300 . 1 . . . . 73 ASN ND2 . 10336 1 869 . 1 1 74 74 GLY H H 1 8.829 0.030 . 1 . . . . 74 GLY H . 10336 1 870 . 1 1 74 74 GLY HA2 H 1 4.568 0.030 . 2 . . . . 74 GLY HA2 . 10336 1 871 . 1 1 74 74 GLY HA3 H 1 3.432 0.030 . 2 . . . . 74 GLY HA3 . 10336 1 872 . 1 1 74 74 GLY C C 13 174.972 0.300 . 1 . . . . 74 GLY C . 10336 1 873 . 1 1 74 74 GLY CA C 13 44.608 0.300 . 1 . . . . 74 GLY CA . 10336 1 874 . 1 1 74 74 GLY N N 15 110.155 0.300 . 1 . . . . 74 GLY N . 10336 1 875 . 1 1 75 75 GLN H H 1 7.778 0.030 . 1 . . . . 75 GLN H . 10336 1 876 . 1 1 75 75 GLN HA H 1 4.207 0.030 . 1 . . . . 75 GLN HA . 10336 1 877 . 1 1 75 75 GLN HB2 H 1 2.209 0.030 . 2 . . . . 75 GLN HB2 . 10336 1 878 . 1 1 75 75 GLN HB3 H 1 1.991 0.030 . 2 . . . . 75 GLN HB3 . 10336 1 879 . 1 1 75 75 GLN HE21 H 1 5.676 0.030 . 2 . . . . 75 GLN HE21 . 10336 1 880 . 1 1 75 75 GLN HE22 H 1 6.891 0.030 . 2 . . . . 75 GLN HE22 . 10336 1 881 . 1 1 75 75 GLN HG2 H 1 1.839 0.030 . 2 . . . . 75 GLN HG2 . 10336 1 882 . 1 1 75 75 GLN HG3 H 1 2.262 0.030 . 2 . . . . 75 GLN HG3 . 10336 1 883 . 1 1 75 75 GLN C C 13 175.633 0.300 . 1 . . . . 75 GLN C . 10336 1 884 . 1 1 75 75 GLN CA C 13 56.789 0.300 . 1 . . . . 75 GLN CA . 10336 1 885 . 1 1 75 75 GLN CB C 13 31.201 0.300 . 1 . . . . 75 GLN CB . 10336 1 886 . 1 1 75 75 GLN CG C 13 36.420 0.300 . 1 . . . . 75 GLN CG . 10336 1 887 . 1 1 75 75 GLN N N 15 114.510 0.300 . 1 . . . . 75 GLN N . 10336 1 888 . 1 1 75 75 GLN NE2 N 15 111.323 0.300 . 1 . . . . 75 GLN NE2 . 10336 1 889 . 1 1 76 76 GLY H H 1 8.074 0.030 . 1 . . . . 76 GLY H . 10336 1 890 . 1 1 76 76 GLY HA2 H 1 3.592 0.030 . 2 . . . . 76 GLY HA2 . 10336 1 891 . 1 1 76 76 GLY HA3 H 1 4.621 0.030 . 2 . . . . 76 GLY HA3 . 10336 1 892 . 1 1 76 76 GLY C C 13 170.480 0.300 . 1 . . . . 76 GLY C . 10336 1 893 . 1 1 76 76 GLY CA C 13 44.193 0.300 . 1 . . . . 76 GLY CA . 10336 1 894 . 1 1 76 76 GLY N N 15 106.116 0.300 . 1 . . . . 76 GLY N . 10336 1 895 . 1 1 77 77 PRO HA H 1 4.102 0.030 . 1 . . . . 77 PRO HA . 10336 1 896 . 1 1 77 77 PRO HB2 H 1 1.806 0.030 . 1 . . . . 77 PRO HB2 . 10336 1 897 . 1 1 77 77 PRO HB3 H 1 1.806 0.030 . 1 . . . . 77 PRO HB3 . 10336 1 898 . 1 1 77 77 PRO HD2 H 1 3.808 0.030 . 2 . . . . 77 PRO HD2 . 10336 1 899 . 1 1 77 77 PRO HD3 H 1 3.285 0.030 . 2 . . . . 77 PRO HD3 . 10336 1 900 . 1 1 77 77 PRO HG2 H 1 2.115 0.030 . 2 . . . . 77 PRO HG2 . 10336 1 901 . 1 1 77 77 PRO HG3 H 1 1.573 0.030 . 2 . . . . 77 PRO HG3 . 10336 1 902 . 1 1 77 77 PRO C C 13 173.949 0.300 . 1 . . . . 77 PRO C . 10336 1 903 . 1 1 77 77 PRO CA C 13 63.354 0.300 . 1 . . . . 77 PRO CA . 10336 1 904 . 1 1 77 77 PRO CB C 13 32.923 0.300 . 1 . . . . 77 PRO CB . 10336 1 905 . 1 1 77 77 PRO CD C 13 48.174 0.300 . 1 . . . . 77 PRO CD . 10336 1 906 . 1 1 77 77 PRO CG C 13 27.347 0.300 . 1 . . . . 77 PRO CG . 10336 1 907 . 1 1 78 78 LYS H H 1 8.239 0.030 . 1 . . . . 78 LYS H . 10336 1 908 . 1 1 78 78 LYS HA H 1 4.529 0.030 . 1 . . . . 78 LYS HA . 10336 1 909 . 1 1 78 78 LYS HB2 H 1 1.646 0.030 . 2 . . . . 78 LYS HB2 . 10336 1 910 . 1 1 78 78 LYS HB3 H 1 0.723 0.030 . 2 . . . . 78 LYS HB3 . 10336 1 911 . 1 1 78 78 LYS HD2 H 1 1.530 0.030 . 2 . . . . 78 LYS HD2 . 10336 1 912 . 1 1 78 78 LYS HD3 H 1 1.607 0.030 . 2 . . . . 78 LYS HD3 . 10336 1 913 . 1 1 78 78 LYS HE2 H 1 2.897 0.030 . 1 . . . . 78 LYS HE2 . 10336 1 914 . 1 1 78 78 LYS HE3 H 1 2.897 0.030 . 1 . . . . 78 LYS HE3 . 10336 1 915 . 1 1 78 78 LYS HG2 H 1 1.469 0.030 . 2 . . . . 78 LYS HG2 . 10336 1 916 . 1 1 78 78 LYS HG3 H 1 1.053 0.030 . 2 . . . . 78 LYS HG3 . 10336 1 917 . 1 1 78 78 LYS C C 13 172.683 0.300 . 1 . . . . 78 LYS C . 10336 1 918 . 1 1 78 78 LYS CA C 13 57.809 0.300 . 1 . . . . 78 LYS CA . 10336 1 919 . 1 1 78 78 LYS CB C 13 34.768 0.300 . 1 . . . . 78 LYS CB . 10336 1 920 . 1 1 78 78 LYS CD C 13 30.463 0.300 . 1 . . . . 78 LYS CD . 10336 1 921 . 1 1 78 78 LYS CE C 13 42.148 0.300 . 1 . . . . 78 LYS CE . 10336 1 922 . 1 1 78 78 LYS CG C 13 25.600 0.300 . 1 . . . . 78 LYS CG . 10336 1 923 . 1 1 78 78 LYS N N 15 119.797 0.300 . 1 . . . . 78 LYS N . 10336 1 924 . 1 1 79 79 TYR H H 1 7.639 0.030 . 1 . . . . 79 TYR H . 10336 1 925 . 1 1 79 79 TYR HA H 1 5.208 0.030 . 1 . . . . 79 TYR HA . 10336 1 926 . 1 1 79 79 TYR HB2 H 1 3.109 0.030 . 2 . . . . 79 TYR HB2 . 10336 1 927 . 1 1 79 79 TYR HB3 H 1 2.729 0.030 . 2 . . . . 79 TYR HB3 . 10336 1 928 . 1 1 79 79 TYR HD1 H 1 6.931 0.030 . 1 . . . . 79 TYR HD1 . 10336 1 929 . 1 1 79 79 TYR HD2 H 1 6.931 0.030 . 1 . . . . 79 TYR HD2 . 10336 1 930 . 1 1 79 79 TYR HE1 H 1 6.631 0.030 . 1 . . . . 79 TYR HE1 . 10336 1 931 . 1 1 79 79 TYR HE2 H 1 6.631 0.030 . 1 . . . . 79 TYR HE2 . 10336 1 932 . 1 1 79 79 TYR C C 13 174.690 0.300 . 1 . . . . 79 TYR C . 10336 1 933 . 1 1 79 79 TYR CA C 13 58.013 0.300 . 1 . . . . 79 TYR CA . 10336 1 934 . 1 1 79 79 TYR CB C 13 39.442 0.300 . 1 . . . . 79 TYR CB . 10336 1 935 . 1 1 79 79 TYR CD1 C 13 132.918 0.300 . 1 . . . . 79 TYR CD1 . 10336 1 936 . 1 1 79 79 TYR CD2 C 13 132.918 0.300 . 1 . . . . 79 TYR CD2 . 10336 1 937 . 1 1 79 79 TYR CE1 C 13 117.421 0.300 . 1 . . . . 79 TYR CE1 . 10336 1 938 . 1 1 79 79 TYR CE2 C 13 117.421 0.300 . 1 . . . . 79 TYR CE2 . 10336 1 939 . 1 1 79 79 TYR N N 15 121.896 0.300 . 1 . . . . 79 TYR N . 10336 1 940 . 1 1 80 80 VAL H H 1 8.533 0.030 . 1 . . . . 80 VAL H . 10336 1 941 . 1 1 80 80 VAL HA H 1 5.254 0.030 . 1 . . . . 80 VAL HA . 10336 1 942 . 1 1 80 80 VAL HB H 1 1.612 0.030 . 1 . . . . 80 VAL HB . 10336 1 943 . 1 1 80 80 VAL HG11 H 1 0.546 0.030 . 1 . . . . 80 VAL HG1 . 10336 1 944 . 1 1 80 80 VAL HG12 H 1 0.546 0.030 . 1 . . . . 80 VAL HG1 . 10336 1 945 . 1 1 80 80 VAL HG13 H 1 0.546 0.030 . 1 . . . . 80 VAL HG1 . 10336 1 946 . 1 1 80 80 VAL HG21 H 1 0.632 0.030 . 1 . . . . 80 VAL HG2 . 10336 1 947 . 1 1 80 80 VAL HG22 H 1 0.632 0.030 . 1 . . . . 80 VAL HG2 . 10336 1 948 . 1 1 80 80 VAL HG23 H 1 0.632 0.030 . 1 . . . . 80 VAL HG2 . 10336 1 949 . 1 1 80 80 VAL C C 13 174.120 0.300 . 1 . . . . 80 VAL C . 10336 1 950 . 1 1 80 80 VAL CA C 13 58.629 0.300 . 1 . . . . 80 VAL CA . 10336 1 951 . 1 1 80 80 VAL CB C 13 35.752 0.300 . 1 . . . . 80 VAL CB . 10336 1 952 . 1 1 80 80 VAL CG1 C 13 21.976 0.300 . 2 . . . . 80 VAL CG1 . 10336 1 953 . 1 1 80 80 VAL CG2 C 13 20.410 0.300 . 2 . . . . 80 VAL CG2 . 10336 1 954 . 1 1 80 80 VAL N N 15 123.063 0.300 . 1 . . . . 80 VAL N . 10336 1 955 . 1 1 81 81 LYS H H 1 9.012 0.030 . 1 . . . . 81 LYS H . 10336 1 956 . 1 1 81 81 LYS HA H 1 4.548 0.030 . 1 . . . . 81 LYS HA . 10336 1 957 . 1 1 81 81 LYS HB2 H 1 1.985 0.030 . 2 . . . . 81 LYS HB2 . 10336 1 958 . 1 1 81 81 LYS HB3 H 1 1.444 0.030 . 2 . . . . 81 LYS HB3 . 10336 1 959 . 1 1 81 81 LYS HD2 H 1 1.925 0.030 . 2 . . . . 81 LYS HD2 . 10336 1 960 . 1 1 81 81 LYS HD3 H 1 2.338 0.030 . 2 . . . . 81 LYS HD3 . 10336 1 961 . 1 1 81 81 LYS HE2 H 1 3.170 0.030 . 1 . . . . 81 LYS HE2 . 10336 1 962 . 1 1 81 81 LYS HE3 H 1 3.170 0.030 . 1 . . . . 81 LYS HE3 . 10336 1 963 . 1 1 81 81 LYS HG2 H 1 1.253 0.030 . 2 . . . . 81 LYS HG2 . 10336 1 964 . 1 1 81 81 LYS HG3 H 1 1.716 0.030 . 2 . . . . 81 LYS HG3 . 10336 1 965 . 1 1 81 81 LYS C C 13 174.019 0.300 . 1 . . . . 81 LYS C . 10336 1 966 . 1 1 81 81 LYS CA C 13 55.341 0.300 . 1 . . . . 81 LYS CA . 10336 1 967 . 1 1 81 81 LYS CB C 13 36.367 0.300 . 1 . . . . 81 LYS CB . 10336 1 968 . 1 1 81 81 LYS CD C 13 30.038 0.300 . 1 . . . . 81 LYS CD . 10336 1 969 . 1 1 81 81 LYS CE C 13 42.394 0.300 . 1 . . . . 81 LYS CE . 10336 1 970 . 1 1 81 81 LYS CG C 13 25.789 0.300 . 1 . . . . 81 LYS CG . 10336 1 971 . 1 1 81 81 LYS N N 15 120.963 0.300 . 1 . . . . 81 LYS N . 10336 1 972 . 1 1 82 82 ILE H H 1 8.650 0.030 . 1 . . . . 82 ILE H . 10336 1 973 . 1 1 82 82 ILE HA H 1 4.758 0.030 . 1 . . . . 82 ILE HA . 10336 1 974 . 1 1 82 82 ILE HB H 1 1.866 0.030 . 1 . . . . 82 ILE HB . 10336 1 975 . 1 1 82 82 ILE HD11 H 1 0.595 0.030 . 1 . . . . 82 ILE HD1 . 10336 1 976 . 1 1 82 82 ILE HD12 H 1 0.595 0.030 . 1 . . . . 82 ILE HD1 . 10336 1 977 . 1 1 82 82 ILE HD13 H 1 0.595 0.030 . 1 . . . . 82 ILE HD1 . 10336 1 978 . 1 1 82 82 ILE HG12 H 1 1.360 0.030 . 2 . . . . 82 ILE HG12 . 10336 1 979 . 1 1 82 82 ILE HG13 H 1 0.750 0.030 . 2 . . . . 82 ILE HG13 . 10336 1 980 . 1 1 82 82 ILE HG21 H 1 0.909 0.030 . 1 . . . . 82 ILE HG2 . 10336 1 981 . 1 1 82 82 ILE HG22 H 1 0.909 0.030 . 1 . . . . 82 ILE HG2 . 10336 1 982 . 1 1 82 82 ILE HG23 H 1 0.909 0.030 . 1 . . . . 82 ILE HG2 . 10336 1 983 . 1 1 82 82 ILE C C 13 174.109 0.300 . 1 . . . . 82 ILE C . 10336 1 984 . 1 1 82 82 ILE CA C 13 60.868 0.300 . 1 . . . . 82 ILE CA . 10336 1 985 . 1 1 82 82 ILE CB C 13 39.828 0.300 . 1 . . . . 82 ILE CB . 10336 1 986 . 1 1 82 82 ILE CD1 C 13 13.859 0.300 . 1 . . . . 82 ILE CD1 . 10336 1 987 . 1 1 82 82 ILE CG1 C 13 27.664 0.300 . 1 . . . . 82 ILE CG1 . 10336 1 988 . 1 1 82 82 ILE CG2 C 13 18.656 0.300 . 1 . . . . 82 ILE CG2 . 10336 1 989 . 1 1 82 82 ILE N N 15 121.119 0.300 . 1 . . . . 82 ILE N . 10336 1 990 . 1 1 83 83 PHE H H 1 9.777 0.030 . 1 . . . . 83 PHE H . 10336 1 991 . 1 1 83 83 PHE HA H 1 5.185 0.030 . 1 . . . . 83 PHE HA . 10336 1 992 . 1 1 83 83 PHE HB2 H 1 3.208 0.030 . 2 . . . . 83 PHE HB2 . 10336 1 993 . 1 1 83 83 PHE HB3 H 1 2.845 0.030 . 2 . . . . 83 PHE HB3 . 10336 1 994 . 1 1 83 83 PHE HD1 H 1 7.340 0.030 . 1 . . . . 83 PHE HD1 . 10336 1 995 . 1 1 83 83 PHE HD2 H 1 7.340 0.030 . 1 . . . . 83 PHE HD2 . 10336 1 996 . 1 1 83 83 PHE HE1 H 1 6.946 0.030 . 1 . . . . 83 PHE HE1 . 10336 1 997 . 1 1 83 83 PHE HE2 H 1 6.946 0.030 . 1 . . . . 83 PHE HE2 . 10336 1 998 . 1 1 83 83 PHE HZ H 1 7.436 0.030 . 1 . . . . 83 PHE HZ . 10336 1 999 . 1 1 83 83 PHE C C 13 175.471 0.300 . 1 . . . . 83 PHE C . 10336 1 1000 . 1 1 83 83 PHE CA C 13 55.800 0.300 . 1 . . . . 83 PHE CA . 10336 1 1001 . 1 1 83 83 PHE CB C 13 42.176 0.300 . 1 . . . . 83 PHE CB . 10336 1 1002 . 1 1 83 83 PHE CD1 C 13 133.287 0.300 . 1 . . . . 83 PHE CD1 . 10336 1 1003 . 1 1 83 83 PHE CD2 C 13 133.287 0.300 . 1 . . . . 83 PHE CD2 . 10336 1 1004 . 1 1 83 83 PHE CE1 C 13 131.196 0.300 . 1 . . . . 83 PHE CE1 . 10336 1 1005 . 1 1 83 83 PHE CE2 C 13 131.196 0.300 . 1 . . . . 83 PHE CE2 . 10336 1 1006 . 1 1 83 83 PHE CZ C 13 129.474 0.300 . 1 . . . . 83 PHE CZ . 10336 1 1007 . 1 1 83 83 PHE N N 15 127.261 0.300 . 1 . . . . 83 PHE N . 10336 1 1008 . 1 1 84 84 ILE H H 1 8.207 0.030 . 1 . . . . 84 ILE H . 10336 1 1009 . 1 1 84 84 ILE HA H 1 5.436 0.030 . 1 . . . . 84 ILE HA . 10336 1 1010 . 1 1 84 84 ILE HB H 1 2.034 0.030 . 1 . . . . 84 ILE HB . 10336 1 1011 . 1 1 84 84 ILE HD11 H 1 0.898 0.030 . 1 . . . . 84 ILE HD1 . 10336 1 1012 . 1 1 84 84 ILE HD12 H 1 0.898 0.030 . 1 . . . . 84 ILE HD1 . 10336 1 1013 . 1 1 84 84 ILE HD13 H 1 0.898 0.030 . 1 . . . . 84 ILE HD1 . 10336 1 1014 . 1 1 84 84 ILE HG12 H 1 1.474 0.030 . 2 . . . . 84 ILE HG12 . 10336 1 1015 . 1 1 84 84 ILE HG13 H 1 1.281 0.030 . 2 . . . . 84 ILE HG13 . 10336 1 1016 . 1 1 84 84 ILE HG21 H 1 1.143 0.030 . 1 . . . . 84 ILE HG2 . 10336 1 1017 . 1 1 84 84 ILE HG22 H 1 1.143 0.030 . 1 . . . . 84 ILE HG2 . 10336 1 1018 . 1 1 84 84 ILE HG23 H 1 1.143 0.030 . 1 . . . . 84 ILE HG2 . 10336 1 1019 . 1 1 84 84 ILE C C 13 174.820 0.300 . 1 . . . . 84 ILE C . 10336 1 1020 . 1 1 84 84 ILE CA C 13 59.542 0.300 . 1 . . . . 84 ILE CA . 10336 1 1021 . 1 1 84 84 ILE CB C 13 42.560 0.300 . 1 . . . . 84 ILE CB . 10336 1 1022 . 1 1 84 84 ILE CD1 C 13 14.705 0.300 . 1 . . . . 84 ILE CD1 . 10336 1 1023 . 1 1 84 84 ILE CG1 C 13 24.436 0.300 . 1 . . . . 84 ILE CG1 . 10336 1 1024 . 1 1 84 84 ILE CG2 C 13 19.398 0.300 . 1 . . . . 84 ILE CG2 . 10336 1 1025 . 1 1 84 84 ILE N N 15 112.256 0.300 . 1 . . . . 84 ILE N . 10336 1 1026 . 1 1 85 85 ASN H H 1 8.819 0.030 . 1 . . . . 85 ASN H . 10336 1 1027 . 1 1 85 85 ASN HA H 1 4.465 0.030 . 1 . . . . 85 ASN HA . 10336 1 1028 . 1 1 85 85 ASN HB2 H 1 2.964 0.030 . 2 . . . . 85 ASN HB2 . 10336 1 1029 . 1 1 85 85 ASN HB3 H 1 3.099 0.030 . 2 . . . . 85 ASN HB3 . 10336 1 1030 . 1 1 85 85 ASN HD21 H 1 7.856 0.030 . 2 . . . . 85 ASN HD21 . 10336 1 1031 . 1 1 85 85 ASN HD22 H 1 7.456 0.030 . 2 . . . . 85 ASN HD22 . 10336 1 1032 . 1 1 85 85 ASN C C 13 175.605 0.300 . 1 . . . . 85 ASN C . 10336 1 1033 . 1 1 85 85 ASN CA C 13 52.996 0.300 . 1 . . . . 85 ASN CA . 10336 1 1034 . 1 1 85 85 ASN CB C 13 36.859 0.300 . 1 . . . . 85 ASN CB . 10336 1 1035 . 1 1 85 85 ASN N N 15 116.842 0.300 . 1 . . . . 85 ASN N . 10336 1 1036 . 1 1 85 85 ASN ND2 N 15 112.256 0.300 . 1 . . . . 85 ASN ND2 . 10336 1 1037 . 1 1 86 86 LEU H H 1 8.086 0.030 . 1 . . . . 86 LEU H . 10336 1 1038 . 1 1 86 86 LEU HA H 1 4.391 0.030 . 1 . . . . 86 LEU HA . 10336 1 1039 . 1 1 86 86 LEU HB2 H 1 1.721 0.030 . 2 . . . . 86 LEU HB2 . 10336 1 1040 . 1 1 86 86 LEU HB3 H 1 1.380 0.030 . 2 . . . . 86 LEU HB3 . 10336 1 1041 . 1 1 86 86 LEU HD11 H 1 0.875 0.030 . 1 . . . . 86 LEU HD1 . 10336 1 1042 . 1 1 86 86 LEU HD12 H 1 0.875 0.030 . 1 . . . . 86 LEU HD1 . 10336 1 1043 . 1 1 86 86 LEU HD13 H 1 0.875 0.030 . 1 . . . . 86 LEU HD1 . 10336 1 1044 . 1 1 86 86 LEU HD21 H 1 0.746 0.030 . 1 . . . . 86 LEU HD2 . 10336 1 1045 . 1 1 86 86 LEU HD22 H 1 0.746 0.030 . 1 . . . . 86 LEU HD2 . 10336 1 1046 . 1 1 86 86 LEU HD23 H 1 0.746 0.030 . 1 . . . . 86 LEU HD2 . 10336 1 1047 . 1 1 86 86 LEU HG H 1 1.505 0.030 . 1 . . . . 86 LEU HG . 10336 1 1048 . 1 1 86 86 LEU C C 13 178.100 0.300 . 1 . . . . 86 LEU C . 10336 1 1049 . 1 1 86 86 LEU CA C 13 53.755 0.300 . 1 . . . . 86 LEU CA . 10336 1 1050 . 1 1 86 86 LEU CB C 13 40.795 0.300 . 1 . . . . 86 LEU CB . 10336 1 1051 . 1 1 86 86 LEU CD1 C 13 22.345 0.300 . 2 . . . . 86 LEU CD1 . 10336 1 1052 . 1 1 86 86 LEU CD2 C 13 26.158 0.300 . 2 . . . . 86 LEU CD2 . 10336 1 1053 . 1 1 86 86 LEU CG C 13 26.736 0.300 . 1 . . . . 86 LEU CG . 10336 1 1054 . 1 1 86 86 LEU N N 15 118.864 0.300 . 1 . . . . 86 LEU N . 10336 1 1055 . 1 1 87 87 PRO HA H 1 4.454 0.030 . 1 . . . . 87 PRO HA . 10336 1 1056 . 1 1 87 87 PRO HB2 H 1 2.213 0.030 . 2 . . . . 87 PRO HB2 . 10336 1 1057 . 1 1 87 87 PRO HB3 H 1 2.006 0.030 . 2 . . . . 87 PRO HB3 . 10336 1 1058 . 1 1 87 87 PRO HD2 H 1 3.894 0.030 . 2 . . . . 87 PRO HD2 . 10336 1 1059 . 1 1 87 87 PRO HD3 H 1 3.807 0.030 . 2 . . . . 87 PRO HD3 . 10336 1 1060 . 1 1 87 87 PRO HG2 H 1 1.899 0.030 . 2 . . . . 87 PRO HG2 . 10336 1 1061 . 1 1 87 87 PRO HG3 H 1 2.131 0.030 . 2 . . . . 87 PRO HG3 . 10336 1 1062 . 1 1 87 87 PRO C C 13 175.474 0.300 . 1 . . . . 87 PRO C . 10336 1 1063 . 1 1 87 87 PRO CA C 13 63.720 0.300 . 1 . . . . 87 PRO CA . 10336 1 1064 . 1 1 87 87 PRO CB C 13 31.848 0.300 . 1 . . . . 87 PRO CB . 10336 1 1065 . 1 1 87 87 PRO CD C 13 50.511 0.300 . 1 . . . . 87 PRO CD . 10336 1 1066 . 1 1 87 87 PRO CG C 13 27.019 0.300 . 1 . . . . 87 PRO CG . 10336 1 1067 . 1 1 88 88 ARG H H 1 7.122 0.030 . 1 . . . . 88 ARG H . 10336 1 1068 . 1 1 88 88 ARG HA H 1 4.478 0.030 . 1 . . . . 88 ARG HA . 10336 1 1069 . 1 1 88 88 ARG HB2 H 1 1.870 0.030 . 2 . . . . 88 ARG HB2 . 10336 1 1070 . 1 1 88 88 ARG HB3 H 1 1.658 0.030 . 2 . . . . 88 ARG HB3 . 10336 1 1071 . 1 1 88 88 ARG HD2 H 1 3.095 0.030 . 1 . . . . 88 ARG HD2 . 10336 1 1072 . 1 1 88 88 ARG HD3 H 1 3.095 0.030 . 1 . . . . 88 ARG HD3 . 10336 1 1073 . 1 1 88 88 ARG HE H 1 7.215 0.030 . 1 . . . . 88 ARG HE . 10336 1 1074 . 1 1 88 88 ARG HG2 H 1 1.396 0.030 . 2 . . . . 88 ARG HG2 . 10336 1 1075 . 1 1 88 88 ARG HG3 H 1 1.338 0.030 . 2 . . . . 88 ARG HG3 . 10336 1 1076 . 1 1 88 88 ARG C C 13 174.785 0.300 . 1 . . . . 88 ARG C . 10336 1 1077 . 1 1 88 88 ARG CA C 13 53.955 0.300 . 1 . . . . 88 ARG CA . 10336 1 1078 . 1 1 88 88 ARG CB C 13 32.066 0.300 . 1 . . . . 88 ARG CB . 10336 1 1079 . 1 1 88 88 ARG CD C 13 43.137 0.300 . 1 . . . . 88 ARG CD . 10336 1 1080 . 1 1 88 88 ARG CG C 13 25.747 0.300 . 1 . . . . 88 ARG CG . 10336 1 1081 . 1 1 88 88 ARG N N 15 115.055 0.300 . 1 . . . . 88 ARG N . 10336 1 1082 . 1 1 88 88 ARG NE N 15 84.424 0.300 . 1 . . . . 88 ARG NE . 10336 1 1083 . 1 1 89 89 SER H H 1 8.330 0.030 . 1 . . . . 89 SER H . 10336 1 1084 . 1 1 89 89 SER HA H 1 4.183 0.030 . 1 . . . . 89 SER HA . 10336 1 1085 . 1 1 89 89 SER HB2 H 1 3.754 0.030 . 2 . . . . 89 SER HB2 . 10336 1 1086 . 1 1 89 89 SER HB3 H 1 3.644 0.030 . 2 . . . . 89 SER HB3 . 10336 1 1087 . 1 1 89 89 SER C C 13 173.874 0.300 . 1 . . . . 89 SER C . 10336 1 1088 . 1 1 89 89 SER CA C 13 59.114 0.300 . 1 . . . . 89 SER CA . 10336 1 1089 . 1 1 89 89 SER CB C 13 63.057 0.300 . 1 . . . . 89 SER CB . 10336 1 1090 . 1 1 89 89 SER N N 15 116.220 0.300 . 1 . . . . 89 SER N . 10336 1 1091 . 1 1 90 90 MET H H 1 8.155 0.030 . 1 . . . . 90 MET H . 10336 1 1092 . 1 1 90 90 MET HA H 1 4.320 0.030 . 1 . . . . 90 MET HA . 10336 1 1093 . 1 1 90 90 MET HB2 H 1 1.626 0.030 . 2 . . . . 90 MET HB2 . 10336 1 1094 . 1 1 90 90 MET HB3 H 1 1.567 0.030 . 2 . . . . 90 MET HB3 . 10336 1 1095 . 1 1 90 90 MET HE1 H 1 2.032 0.030 . 1 . . . . 90 MET HE . 10336 1 1096 . 1 1 90 90 MET HE2 H 1 2.032 0.030 . 1 . . . . 90 MET HE . 10336 1 1097 . 1 1 90 90 MET HE3 H 1 2.032 0.030 . 1 . . . . 90 MET HE . 10336 1 1098 . 1 1 90 90 MET HG2 H 1 2.013 0.030 . 2 . . . . 90 MET HG2 . 10336 1 1099 . 1 1 90 90 MET HG3 H 1 2.125 0.030 . 2 . . . . 90 MET HG3 . 10336 1 1100 . 1 1 90 90 MET C C 13 174.700 0.300 . 1 . . . . 90 MET C . 10336 1 1101 . 1 1 90 90 MET CA C 13 55.137 0.300 . 1 . . . . 90 MET CA . 10336 1 1102 . 1 1 90 90 MET CB C 13 36.244 0.300 . 1 . . . . 90 MET CB . 10336 1 1103 . 1 1 90 90 MET CE C 13 16.934 0.300 . 1 . . . . 90 MET CE . 10336 1 1104 . 1 1 90 90 MET CG C 13 32.187 0.300 . 1 . . . . 90 MET CG . 10336 1 1105 . 1 1 90 90 MET N N 15 124.384 0.300 . 1 . . . . 90 MET N . 10336 1 1106 . 1 1 91 91 ASP H H 1 7.501 0.030 . 1 . . . . 91 ASP H . 10336 1 1107 . 1 1 91 91 ASP HA H 1 4.414 0.030 . 1 . . . . 91 ASP HA . 10336 1 1108 . 1 1 91 91 ASP HB2 H 1 3.053 0.030 . 2 . . . . 91 ASP HB2 . 10336 1 1109 . 1 1 91 91 ASP HB3 H 1 2.535 0.030 . 2 . . . . 91 ASP HB3 . 10336 1 1110 . 1 1 91 91 ASP C C 13 176.177 0.300 . 1 . . . . 91 ASP C . 10336 1 1111 . 1 1 91 91 ASP CA C 13 51.495 0.300 . 1 . . . . 91 ASP CA . 10336 1 1112 . 1 1 91 91 ASP CB C 13 41.889 0.300 . 1 . . . . 91 ASP CB . 10336 1 1113 . 1 1 91 91 ASP N N 15 120.264 0.300 . 1 . . . . 91 ASP N . 10336 1 1114 . 1 1 92 92 PHE H H 1 7.832 0.030 . 1 . . . . 92 PHE H . 10336 1 1115 . 1 1 92 92 PHE HA H 1 3.637 0.030 . 1 . . . . 92 PHE HA . 10336 1 1116 . 1 1 92 92 PHE HB2 H 1 3.212 0.030 . 2 . . . . 92 PHE HB2 . 10336 1 1117 . 1 1 92 92 PHE HB3 H 1 2.886 0.030 . 2 . . . . 92 PHE HB3 . 10336 1 1118 . 1 1 92 92 PHE HD1 H 1 7.377 0.030 . 1 . . . . 92 PHE HD1 . 10336 1 1119 . 1 1 92 92 PHE HD2 H 1 7.377 0.030 . 1 . . . . 92 PHE HD2 . 10336 1 1120 . 1 1 92 92 PHE HE1 H 1 7.548 0.030 . 1 . . . . 92 PHE HE1 . 10336 1 1121 . 1 1 92 92 PHE HE2 H 1 7.548 0.030 . 1 . . . . 92 PHE HE2 . 10336 1 1122 . 1 1 92 92 PHE HZ H 1 7.268 0.030 . 1 . . . . 92 PHE HZ . 10336 1 1123 . 1 1 92 92 PHE C C 13 177.871 0.300 . 1 . . . . 92 PHE C . 10336 1 1124 . 1 1 92 92 PHE CA C 13 62.934 0.300 . 1 . . . . 92 PHE CA . 10336 1 1125 . 1 1 92 92 PHE CB C 13 38.335 0.300 . 1 . . . . 92 PHE CB . 10336 1 1126 . 1 1 92 92 PHE CD1 C 13 131.688 0.300 . 1 . . . . 92 PHE CD1 . 10336 1 1127 . 1 1 92 92 PHE CD2 C 13 131.688 0.300 . 1 . . . . 92 PHE CD2 . 10336 1 1128 . 1 1 92 92 PHE CE1 C 13 130.242 0.300 . 1 . . . . 92 PHE CE1 . 10336 1 1129 . 1 1 92 92 PHE CE2 C 13 130.242 0.300 . 1 . . . . 92 PHE CE2 . 10336 1 1130 . 1 1 92 92 PHE CZ C 13 131.319 0.300 . 1 . . . . 92 PHE CZ . 10336 1 1131 . 1 1 92 92 PHE N N 15 116.072 0.300 . 1 . . . . 92 PHE N . 10336 1 1132 . 1 1 93 93 GLU H H 1 8.148 0.030 . 1 . . . . 93 GLU H . 10336 1 1133 . 1 1 93 93 GLU HA H 1 4.011 0.030 . 1 . . . . 93 GLU HA . 10336 1 1134 . 1 1 93 93 GLU HB2 H 1 2.060 0.030 . 2 . . . . 93 GLU HB2 . 10336 1 1135 . 1 1 93 93 GLU HB3 H 1 1.998 0.030 . 2 . . . . 93 GLU HB3 . 10336 1 1136 . 1 1 93 93 GLU HG2 H 1 2.199 0.030 . 2 . . . . 93 GLU HG2 . 10336 1 1137 . 1 1 93 93 GLU HG3 H 1 2.336 0.030 . 2 . . . . 93 GLU HG3 . 10336 1 1138 . 1 1 93 93 GLU C C 13 179.297 0.300 . 1 . . . . 93 GLU C . 10336 1 1139 . 1 1 93 93 GLU CA C 13 59.736 0.300 . 1 . . . . 93 GLU CA . 10336 1 1140 . 1 1 93 93 GLU CB C 13 29.110 0.300 . 1 . . . . 93 GLU CB . 10336 1 1141 . 1 1 93 93 GLU CG C 13 36.604 0.300 . 1 . . . . 93 GLU CG . 10336 1 1142 . 1 1 93 93 GLU N N 15 120.264 0.300 . 1 . . . . 93 GLU N . 10336 1 1143 . 1 1 94 94 GLU H H 1 8.251 0.030 . 1 . . . . 94 GLU H . 10336 1 1144 . 1 1 94 94 GLU HA H 1 3.806 0.030 . 1 . . . . 94 GLU HA . 10336 1 1145 . 1 1 94 94 GLU HB2 H 1 2.002 0.030 . 2 . . . . 94 GLU HB2 . 10336 1 1146 . 1 1 94 94 GLU HB3 H 1 1.724 0.030 . 2 . . . . 94 GLU HB3 . 10336 1 1147 . 1 1 94 94 GLU HG2 H 1 1.991 0.030 . 2 . . . . 94 GLU HG2 . 10336 1 1148 . 1 1 94 94 GLU HG3 H 1 2.197 0.030 . 2 . . . . 94 GLU HG3 . 10336 1 1149 . 1 1 94 94 GLU C C 13 179.540 0.300 . 1 . . . . 94 GLU C . 10336 1 1150 . 1 1 94 94 GLU CA C 13 58.870 0.300 . 1 . . . . 94 GLU CA . 10336 1 1151 . 1 1 94 94 GLU CB C 13 29.971 0.300 . 1 . . . . 94 GLU CB . 10336 1 1152 . 1 1 94 94 GLU CG C 13 36.236 0.300 . 1 . . . . 94 GLU CG . 10336 1 1153 . 1 1 94 94 GLU N N 15 120.497 0.300 . 1 . . . . 94 GLU N . 10336 1 1154 . 1 1 95 95 ALA H H 1 8.121 0.030 . 1 . . . . 95 ALA H . 10336 1 1155 . 1 1 95 95 ALA HA H 1 3.681 0.030 . 1 . . . . 95 ALA HA . 10336 1 1156 . 1 1 95 95 ALA HB1 H 1 0.488 0.030 . 1 . . . . 95 ALA HB . 10336 1 1157 . 1 1 95 95 ALA HB2 H 1 0.488 0.030 . 1 . . . . 95 ALA HB . 10336 1 1158 . 1 1 95 95 ALA HB3 H 1 0.488 0.030 . 1 . . . . 95 ALA HB . 10336 1 1159 . 1 1 95 95 ALA C C 13 179.182 0.300 . 1 . . . . 95 ALA C . 10336 1 1160 . 1 1 95 95 ALA CA C 13 55.016 0.300 . 1 . . . . 95 ALA CA . 10336 1 1161 . 1 1 95 95 ALA CB C 13 17.426 0.300 . 1 . . . . 95 ALA CB . 10336 1 1162 . 1 1 95 95 ALA N N 15 124.277 0.300 . 1 . . . . 95 ALA N . 10336 1 1163 . 1 1 96 96 GLU H H 1 7.671 0.030 . 1 . . . . 96 GLU H . 10336 1 1164 . 1 1 96 96 GLU HA H 1 4.072 0.030 . 1 . . . . 96 GLU HA . 10336 1 1165 . 1 1 96 96 GLU HB2 H 1 2.267 0.030 . 2 . . . . 96 GLU HB2 . 10336 1 1166 . 1 1 96 96 GLU HB3 H 1 2.176 0.030 . 2 . . . . 96 GLU HB3 . 10336 1 1167 . 1 1 96 96 GLU HG2 H 1 2.512 0.030 . 2 . . . . 96 GLU HG2 . 10336 1 1168 . 1 1 96 96 GLU HG3 H 1 2.432 0.030 . 2 . . . . 96 GLU HG3 . 10336 1 1169 . 1 1 96 96 GLU C C 13 177.704 0.300 . 1 . . . . 96 GLU C . 10336 1 1170 . 1 1 96 96 GLU CA C 13 59.644 0.300 . 1 . . . . 96 GLU CA . 10336 1 1171 . 1 1 96 96 GLU CB C 13 29.670 0.300 . 1 . . . . 96 GLU CB . 10336 1 1172 . 1 1 96 96 GLU CG C 13 36.328 0.300 . 1 . . . . 96 GLU CG . 10336 1 1173 . 1 1 96 96 GLU N N 15 117.154 0.300 . 1 . . . . 96 GLU N . 10336 1 1174 . 1 1 97 97 ARG H H 1 7.369 0.030 . 1 . . . . 97 ARG H . 10336 1 1175 . 1 1 97 97 ARG HA H 1 4.399 0.030 . 1 . . . . 97 ARG HA . 10336 1 1176 . 1 1 97 97 ARG HB2 H 1 1.830 0.030 . 2 . . . . 97 ARG HB2 . 10336 1 1177 . 1 1 97 97 ARG HB3 H 1 1.899 0.030 . 2 . . . . 97 ARG HB3 . 10336 1 1178 . 1 1 97 97 ARG HD2 H 1 3.153 0.030 . 1 . . . . 97 ARG HD2 . 10336 1 1179 . 1 1 97 97 ARG HD3 H 1 3.153 0.030 . 1 . . . . 97 ARG HD3 . 10336 1 1180 . 1 1 97 97 ARG HE H 1 8.375 0.030 . 1 . . . . 97 ARG HE . 10336 1 1181 . 1 1 97 97 ARG HG2 H 1 1.635 0.030 . 2 . . . . 97 ARG HG2 . 10336 1 1182 . 1 1 97 97 ARG HG3 H 1 1.795 0.030 . 2 . . . . 97 ARG HG3 . 10336 1 1183 . 1 1 97 97 ARG C C 13 177.701 0.300 . 1 . . . . 97 ARG C . 10336 1 1184 . 1 1 97 97 ARG CA C 13 56.973 0.300 . 1 . . . . 97 ARG CA . 10336 1 1185 . 1 1 97 97 ARG CB C 13 31.346 0.300 . 1 . . . . 97 ARG CB . 10336 1 1186 . 1 1 97 97 ARG CD C 13 43.377 0.300 . 1 . . . . 97 ARG CD . 10336 1 1187 . 1 1 97 97 ARG CG C 13 27.148 0.300 . 1 . . . . 97 ARG CG . 10336 1 1188 . 1 1 97 97 ARG N N 15 114.601 0.300 . 1 . . . . 97 ARG N . 10336 1 1189 . 1 1 97 97 ARG NE N 15 81.625 0.300 . 1 . . . . 97 ARG NE . 10336 1 1190 . 1 1 98 98 SER H H 1 7.616 0.030 . 1 . . . . 98 SER H . 10336 1 1191 . 1 1 98 98 SER HA H 1 4.518 0.030 . 1 . . . . 98 SER HA . 10336 1 1192 . 1 1 98 98 SER HB2 H 1 3.864 0.030 . 2 . . . . 98 SER HB2 . 10336 1 1193 . 1 1 98 98 SER HB3 H 1 3.745 0.030 . 2 . . . . 98 SER HB3 . 10336 1 1194 . 1 1 98 98 SER C C 13 173.383 0.300 . 1 . . . . 98 SER C . 10336 1 1195 . 1 1 98 98 SER CA C 13 59.982 0.300 . 1 . . . . 98 SER CA . 10336 1 1196 . 1 1 98 98 SER CB C 13 64.656 0.300 . 1 . . . . 98 SER CB . 10336 1 1197 . 1 1 98 98 SER N N 15 115.565 0.300 . 1 . . . . 98 SER N . 10336 1 1198 . 1 1 99 99 GLU H H 1 8.931 0.030 . 1 . . . . 99 GLU H . 10336 1 1199 . 1 1 99 99 GLU HA H 1 4.650 0.030 . 1 . . . . 99 GLU HA . 10336 1 1200 . 1 1 99 99 GLU HB2 H 1 2.044 0.030 . 1 . . . . 99 GLU HB2 . 10336 1 1201 . 1 1 99 99 GLU HB3 H 1 2.044 0.030 . 1 . . . . 99 GLU HB3 . 10336 1 1202 . 1 1 99 99 GLU HG2 H 1 2.342 0.030 . 1 . . . . 99 GLU HG2 . 10336 1 1203 . 1 1 99 99 GLU HG3 H 1 2.342 0.030 . 1 . . . . 99 GLU HG3 . 10336 1 1204 . 1 1 99 99 GLU C C 13 174.803 0.300 . 1 . . . . 99 GLU C . 10336 1 1205 . 1 1 99 99 GLU CA C 13 53.796 0.300 . 1 . . . . 99 GLU CA . 10336 1 1206 . 1 1 99 99 GLU CB C 13 30.217 0.300 . 1 . . . . 99 GLU CB . 10336 1 1207 . 1 1 99 99 GLU CG C 13 35.383 0.300 . 1 . . . . 99 GLU CG . 10336 1 1208 . 1 1 99 99 GLU N N 15 126.872 0.300 . 1 . . . . 99 GLU N . 10336 1 1209 . 1 1 100 100 PRO HA H 1 4.378 0.030 . 1 . . . . 100 PRO HA . 10336 1 1210 . 1 1 100 100 PRO HB2 H 1 1.702 0.030 . 2 . . . . 100 PRO HB2 . 10336 1 1211 . 1 1 100 100 PRO HB3 H 1 0.746 0.030 . 2 . . . . 100 PRO HB3 . 10336 1 1212 . 1 1 100 100 PRO HD2 H 1 3.736 0.030 . 2 . . . . 100 PRO HD2 . 10336 1 1213 . 1 1 100 100 PRO HD3 H 1 3.970 0.030 . 2 . . . . 100 PRO HD3 . 10336 1 1214 . 1 1 100 100 PRO HG2 H 1 1.744 0.030 . 2 . . . . 100 PRO HG2 . 10336 1 1215 . 1 1 100 100 PRO HG3 H 1 1.598 0.030 . 2 . . . . 100 PRO HG3 . 10336 1 1216 . 1 1 100 100 PRO C C 13 175.880 0.300 . 1 . . . . 100 PRO C . 10336 1 1217 . 1 1 100 100 PRO CA C 13 61.969 0.300 . 1 . . . . 100 PRO CA . 10336 1 1218 . 1 1 100 100 PRO CB C 13 31.201 0.300 . 1 . . . . 100 PRO CB . 10336 1 1219 . 1 1 100 100 PRO CD C 13 49.527 0.300 . 1 . . . . 100 PRO CD . 10336 1 1220 . 1 1 100 100 PRO CG C 13 26.281 0.300 . 1 . . . . 100 PRO CG . 10336 1 1221 . 1 1 101 101 THR H H 1 8.631 0.030 . 1 . . . . 101 THR H . 10336 1 1222 . 1 1 101 101 THR HA H 1 3.898 0.030 . 1 . . . . 101 THR HA . 10336 1 1223 . 1 1 101 101 THR HB H 1 3.703 0.030 . 1 . . . . 101 THR HB . 10336 1 1224 . 1 1 101 101 THR HG21 H 1 0.636 0.030 . 1 . . . . 101 THR HG2 . 10336 1 1225 . 1 1 101 101 THR HG22 H 1 0.636 0.030 . 1 . . . . 101 THR HG2 . 10336 1 1226 . 1 1 101 101 THR HG23 H 1 0.636 0.030 . 1 . . . . 101 THR HG2 . 10336 1 1227 . 1 1 101 101 THR C C 13 175.147 0.300 . 1 . . . . 101 THR C . 10336 1 1228 . 1 1 101 101 THR CA C 13 67.536 0.300 . 1 . . . . 101 THR CA . 10336 1 1229 . 1 1 101 101 THR CB C 13 68.532 0.300 . 1 . . . . 101 THR CB . 10336 1 1230 . 1 1 101 101 THR CG2 C 13 23.998 0.300 . 1 . . . . 101 THR CG2 . 10336 1 1231 . 1 1 101 101 THR N N 15 119.875 0.300 . 1 . . . . 101 THR N . 10336 1 1232 . 1 1 102 102 GLN H H 1 7.611 0.030 . 1 . . . . 102 GLN H . 10336 1 1233 . 1 1 102 102 GLN HA H 1 4.250 0.030 . 1 . . . . 102 GLN HA . 10336 1 1234 . 1 1 102 102 GLN HB2 H 1 1.614 0.030 . 1 . . . . 102 GLN HB2 . 10336 1 1235 . 1 1 102 102 GLN HB3 H 1 1.614 0.030 . 1 . . . . 102 GLN HB3 . 10336 1 1236 . 1 1 102 102 GLN HE21 H 1 6.693 0.030 . 2 . . . . 102 GLN HE21 . 10336 1 1237 . 1 1 102 102 GLN HE22 H 1 7.418 0.030 . 2 . . . . 102 GLN HE22 . 10336 1 1238 . 1 1 102 102 GLN HG2 H 1 2.542 0.030 . 2 . . . . 102 GLN HG2 . 10336 1 1239 . 1 1 102 102 GLN HG3 H 1 2.171 0.030 . 2 . . . . 102 GLN HG3 . 10336 1 1240 . 1 1 102 102 GLN C C 13 172.145 0.300 . 1 . . . . 102 GLN C . 10336 1 1241 . 1 1 102 102 GLN CA C 13 56.728 0.300 . 1 . . . . 102 GLN CA . 10336 1 1242 . 1 1 102 102 GLN CB C 13 31.778 0.300 . 1 . . . . 102 GLN CB . 10336 1 1243 . 1 1 102 102 GLN CG C 13 33.538 0.300 . 1 . . . . 102 GLN CG . 10336 1 1244 . 1 1 102 102 GLN N N 15 115.598 0.300 . 1 . . . . 102 GLN N . 10336 1 1245 . 1 1 102 102 GLN NE2 N 15 107.202 0.300 . 1 . . . . 102 GLN NE2 . 10336 1 1246 . 1 1 103 103 ALA H H 1 8.832 0.030 . 1 . . . . 103 ALA H . 10336 1 1247 . 1 1 103 103 ALA HA H 1 5.089 0.030 . 1 . . . . 103 ALA HA . 10336 1 1248 . 1 1 103 103 ALA HB1 H 1 1.334 0.030 . 1 . . . . 103 ALA HB . 10336 1 1249 . 1 1 103 103 ALA HB2 H 1 1.334 0.030 . 1 . . . . 103 ALA HB . 10336 1 1250 . 1 1 103 103 ALA HB3 H 1 1.334 0.030 . 1 . . . . 103 ALA HB . 10336 1 1251 . 1 1 103 103 ALA C C 13 175.838 0.300 . 1 . . . . 103 ALA C . 10336 1 1252 . 1 1 103 103 ALA CA C 13 50.570 0.300 . 1 . . . . 103 ALA CA . 10336 1 1253 . 1 1 103 103 ALA CB C 13 21.571 0.300 . 1 . . . . 103 ALA CB . 10336 1 1254 . 1 1 103 103 ALA N N 15 129.439 0.300 . 1 . . . . 103 ALA N . 10336 1 1255 . 1 1 104 104 LEU H H 1 8.956 0.030 . 1 . . . . 104 LEU H . 10336 1 1256 . 1 1 104 104 LEU HA H 1 4.606 0.030 . 1 . . . . 104 LEU HA . 10336 1 1257 . 1 1 104 104 LEU HB2 H 1 1.372 0.030 . 1 . . . . 104 LEU HB2 . 10336 1 1258 . 1 1 104 104 LEU HB3 H 1 1.372 0.030 . 1 . . . . 104 LEU HB3 . 10336 1 1259 . 1 1 104 104 LEU HD11 H 1 0.703 0.030 . 1 . . . . 104 LEU HD1 . 10336 1 1260 . 1 1 104 104 LEU HD12 H 1 0.703 0.030 . 1 . . . . 104 LEU HD1 . 10336 1 1261 . 1 1 104 104 LEU HD13 H 1 0.703 0.030 . 1 . . . . 104 LEU HD1 . 10336 1 1262 . 1 1 104 104 LEU HD21 H 1 0.580 0.030 . 1 . . . . 104 LEU HD2 . 10336 1 1263 . 1 1 104 104 LEU HD22 H 1 0.580 0.030 . 1 . . . . 104 LEU HD2 . 10336 1 1264 . 1 1 104 104 LEU HD23 H 1 0.580 0.030 . 1 . . . . 104 LEU HD2 . 10336 1 1265 . 1 1 104 104 LEU HG H 1 1.317 0.030 . 1 . . . . 104 LEU HG . 10336 1 1266 . 1 1 104 104 LEU C C 13 173.290 0.300 . 1 . . . . 104 LEU C . 10336 1 1267 . 1 1 104 104 LEU CA C 13 54.301 0.300 . 1 . . . . 104 LEU CA . 10336 1 1268 . 1 1 104 104 LEU CB C 13 45.579 0.300 . 1 . . . . 104 LEU CB . 10336 1 1269 . 1 1 104 104 LEU CD1 C 13 25.174 0.300 . 2 . . . . 104 LEU CD1 . 10336 1 1270 . 1 1 104 104 LEU CD2 C 13 26.527 0.300 . 2 . . . . 104 LEU CD2 . 10336 1 1271 . 1 1 104 104 LEU CG C 13 27.265 0.300 . 1 . . . . 104 LEU CG . 10336 1 1272 . 1 1 104 104 LEU N N 15 122.052 0.300 . 1 . . . . 104 LEU N . 10336 1 1273 . 1 1 105 105 GLU H H 1 8.482 0.030 . 1 . . . . 105 GLU H . 10336 1 1274 . 1 1 105 105 GLU HA H 1 4.579 0.030 . 1 . . . . 105 GLU HA . 10336 1 1275 . 1 1 105 105 GLU HB2 H 1 2.068 0.030 . 2 . . . . 105 GLU HB2 . 10336 1 1276 . 1 1 105 105 GLU HB3 H 1 1.901 0.030 . 2 . . . . 105 GLU HB3 . 10336 1 1277 . 1 1 105 105 GLU HG2 H 1 1.990 0.030 . 1 . . . . 105 GLU HG2 . 10336 1 1278 . 1 1 105 105 GLU HG3 H 1 1.990 0.030 . 1 . . . . 105 GLU HG3 . 10336 1 1279 . 1 1 105 105 GLU C C 13 175.256 0.300 . 1 . . . . 105 GLU C . 10336 1 1280 . 1 1 105 105 GLU CA C 13 54.913 0.300 . 1 . . . . 105 GLU CA . 10336 1 1281 . 1 1 105 105 GLU CB C 13 30.586 0.300 . 1 . . . . 105 GLU CB . 10336 1 1282 . 1 1 105 105 GLU CG C 13 37.432 0.300 . 1 . . . . 105 GLU CG . 10336 1 1283 . 1 1 105 105 GLU N N 15 122.363 0.300 . 1 . . . . 105 GLU N . 10336 1 1284 . 1 1 106 106 LEU H H 1 8.842 0.030 . 1 . . . . 106 LEU H . 10336 1 1285 . 1 1 106 106 LEU HA H 1 4.625 0.030 . 1 . . . . 106 LEU HA . 10336 1 1286 . 1 1 106 106 LEU HB2 H 1 1.414 0.030 . 2 . . . . 106 LEU HB2 . 10336 1 1287 . 1 1 106 106 LEU HB3 H 1 1.963 0.030 . 2 . . . . 106 LEU HB3 . 10336 1 1288 . 1 1 106 106 LEU HD11 H 1 0.822 0.030 . 1 . . . . 106 LEU HD1 . 10336 1 1289 . 1 1 106 106 LEU HD12 H 1 0.822 0.030 . 1 . . . . 106 LEU HD1 . 10336 1 1290 . 1 1 106 106 LEU HD13 H 1 0.822 0.030 . 1 . . . . 106 LEU HD1 . 10336 1 1291 . 1 1 106 106 LEU HD21 H 1 0.811 0.030 . 1 . . . . 106 LEU HD2 . 10336 1 1292 . 1 1 106 106 LEU HD22 H 1 0.811 0.030 . 1 . . . . 106 LEU HD2 . 10336 1 1293 . 1 1 106 106 LEU HD23 H 1 0.811 0.030 . 1 . . . . 106 LEU HD2 . 10336 1 1294 . 1 1 106 106 LEU HG H 1 1.731 0.030 . 1 . . . . 106 LEU HG . 10336 1 1295 . 1 1 106 106 LEU C C 13 178.432 0.300 . 1 . . . . 106 LEU C . 10336 1 1296 . 1 1 106 106 LEU CA C 13 54.852 0.300 . 1 . . . . 106 LEU CA . 10336 1 1297 . 1 1 106 106 LEU CB C 13 41.287 0.300 . 1 . . . . 106 LEU CB . 10336 1 1298 . 1 1 106 106 LEU CD1 C 13 26.773 0.300 . 2 . . . . 106 LEU CD1 . 10336 1 1299 . 1 1 106 106 LEU CD2 C 13 24.436 0.300 . 2 . . . . 106 LEU CD2 . 10336 1 1300 . 1 1 106 106 LEU CG C 13 26.896 0.300 . 1 . . . . 106 LEU CG . 10336 1 1301 . 1 1 106 106 LEU N N 15 128.039 0.300 . 1 . . . . 106 LEU N . 10336 1 1302 . 1 1 107 107 THR H H 1 9.721 0.030 . 1 . . . . 107 THR H . 10336 1 1303 . 1 1 107 107 THR HA H 1 4.682 0.030 . 1 . . . . 107 THR HA . 10336 1 1304 . 1 1 107 107 THR HB H 1 4.773 0.030 . 1 . . . . 107 THR HB . 10336 1 1305 . 1 1 107 107 THR HG21 H 1 1.399 0.030 . 1 . . . . 107 THR HG2 . 10336 1 1306 . 1 1 107 107 THR HG22 H 1 1.399 0.030 . 1 . . . . 107 THR HG2 . 10336 1 1307 . 1 1 107 107 THR HG23 H 1 1.399 0.030 . 1 . . . . 107 THR HG2 . 10336 1 1308 . 1 1 107 107 THR C C 13 175.504 0.300 . 1 . . . . 107 THR C . 10336 1 1309 . 1 1 107 107 THR CA C 13 60.134 0.300 . 1 . . . . 107 THR CA . 10336 1 1310 . 1 1 107 107 THR CB C 13 71.934 0.300 . 1 . . . . 107 THR CB . 10336 1 1311 . 1 1 107 107 THR CG2 C 13 21.514 0.300 . 1 . . . . 107 THR CG2 . 10336 1 1312 . 1 1 107 107 THR N N 15 116.448 0.300 . 1 . . . . 107 THR N . 10336 1 1313 . 1 1 108 108 GLU H H 1 8.862 0.030 . 1 . . . . 108 GLU H . 10336 1 1314 . 1 1 108 108 GLU HA H 1 3.846 0.030 . 1 . . . . 108 GLU HA . 10336 1 1315 . 1 1 108 108 GLU HB2 H 1 1.976 0.030 . 1 . . . . 108 GLU HB2 . 10336 1 1316 . 1 1 108 108 GLU HB3 H 1 1.976 0.030 . 1 . . . . 108 GLU HB3 . 10336 1 1317 . 1 1 108 108 GLU HG2 H 1 2.281 0.030 . 2 . . . . 108 GLU HG2 . 10336 1 1318 . 1 1 108 108 GLU HG3 H 1 2.225 0.030 . 2 . . . . 108 GLU HG3 . 10336 1 1319 . 1 1 108 108 GLU C C 13 178.448 0.300 . 1 . . . . 108 GLU C . 10336 1 1320 . 1 1 108 108 GLU CA C 13 59.400 0.300 . 1 . . . . 108 GLU CA . 10336 1 1321 . 1 1 108 108 GLU CB C 13 29.238 0.300 . 1 . . . . 108 GLU CB . 10336 1 1322 . 1 1 108 108 GLU CG C 13 36.328 0.300 . 1 . . . . 108 GLU CG . 10336 1 1323 . 1 1 108 108 GLU N N 15 116.376 0.300 . 1 . . . . 108 GLU N . 10336 1 1324 . 1 1 109 109 ASP H H 1 7.682 0.030 . 1 . . . . 109 ASP H . 10336 1 1325 . 1 1 109 109 ASP HA H 1 4.442 0.030 . 1 . . . . 109 ASP HA . 10336 1 1326 . 1 1 109 109 ASP HB2 H 1 2.622 0.030 . 2 . . . . 109 ASP HB2 . 10336 1 1327 . 1 1 109 109 ASP HB3 H 1 2.430 0.030 . 2 . . . . 109 ASP HB3 . 10336 1 1328 . 1 1 109 109 ASP C C 13 178.284 0.300 . 1 . . . . 109 ASP C . 10336 1 1329 . 1 1 109 109 ASP CA C 13 56.687 0.300 . 1 . . . . 109 ASP CA . 10336 1 1330 . 1 1 109 109 ASP CB C 13 41.170 0.300 . 1 . . . . 109 ASP CB . 10336 1 1331 . 1 1 109 109 ASP N N 15 115.988 0.300 . 1 . . . . 109 ASP N . 10336 1 1332 . 1 1 110 110 ASP H H 1 7.646 0.030 . 1 . . . . 110 ASP H . 10336 1 1333 . 1 1 110 110 ASP HA H 1 4.342 0.030 . 1 . . . . 110 ASP HA . 10336 1 1334 . 1 1 110 110 ASP HB2 H 1 2.547 0.030 . 2 . . . . 110 ASP HB2 . 10336 1 1335 . 1 1 110 110 ASP HB3 H 1 2.987 0.030 . 2 . . . . 110 ASP HB3 . 10336 1 1336 . 1 1 110 110 ASP C C 13 176.105 0.300 . 1 . . . . 110 ASP C . 10336 1 1337 . 1 1 110 110 ASP CA C 13 57.544 0.300 . 1 . . . . 110 ASP CA . 10336 1 1338 . 1 1 110 110 ASP CB C 13 42.763 0.300 . 1 . . . . 110 ASP CB . 10336 1 1339 . 1 1 110 110 ASP N N 15 121.041 0.300 . 1 . . . . 110 ASP N . 10336 1 1340 . 1 1 111 111 ILE H H 1 6.626 0.030 . 1 . . . . 111 ILE H . 10336 1 1341 . 1 1 111 111 ILE HA H 1 4.974 0.030 . 1 . . . . 111 ILE HA . 10336 1 1342 . 1 1 111 111 ILE HB H 1 2.204 0.030 . 1 . . . . 111 ILE HB . 10336 1 1343 . 1 1 111 111 ILE HD11 H 1 0.858 0.030 . 1 . . . . 111 ILE HD1 . 10336 1 1344 . 1 1 111 111 ILE HD12 H 1 0.858 0.030 . 1 . . . . 111 ILE HD1 . 10336 1 1345 . 1 1 111 111 ILE HD13 H 1 0.858 0.030 . 1 . . . . 111 ILE HD1 . 10336 1 1346 . 1 1 111 111 ILE HG12 H 1 1.331 0.030 . 2 . . . . 111 ILE HG12 . 10336 1 1347 . 1 1 111 111 ILE HG13 H 1 1.280 0.030 . 2 . . . . 111 ILE HG13 . 10336 1 1348 . 1 1 111 111 ILE HG21 H 1 1.214 0.030 . 1 . . . . 111 ILE HG2 . 10336 1 1349 . 1 1 111 111 ILE HG22 H 1 1.214 0.030 . 1 . . . . 111 ILE HG2 . 10336 1 1350 . 1 1 111 111 ILE HG23 H 1 1.214 0.030 . 1 . . . . 111 ILE HG2 . 10336 1 1351 . 1 1 111 111 ILE C C 13 175.685 0.300 . 1 . . . . 111 ILE C . 10336 1 1352 . 1 1 111 111 ILE CA C 13 61.052 0.300 . 1 . . . . 111 ILE CA . 10336 1 1353 . 1 1 111 111 ILE CB C 13 39.319 0.300 . 1 . . . . 111 ILE CB . 10336 1 1354 . 1 1 111 111 ILE CD1 C 13 16.177 0.300 . 1 . . . . 111 ILE CD1 . 10336 1 1355 . 1 1 111 111 ILE CG1 C 13 26.116 0.300 . 1 . . . . 111 ILE CG1 . 10336 1 1356 . 1 1 111 111 ILE CG2 C 13 17.795 0.300 . 1 . . . . 111 ILE CG2 . 10336 1 1357 . 1 1 111 111 ILE N N 15 105.083 0.300 . 1 . . . . 111 ILE N . 10336 1 1358 . 1 1 112 112 LYS H H 1 6.656 0.030 . 1 . . . . 112 LYS H . 10336 1 1359 . 1 1 112 112 LYS HA H 1 4.527 0.030 . 1 . . . . 112 LYS HA . 10336 1 1360 . 1 1 112 112 LYS HB2 H 1 2.102 0.030 . 2 . . . . 112 LYS HB2 . 10336 1 1361 . 1 1 112 112 LYS HB3 H 1 1.812 0.030 . 2 . . . . 112 LYS HB3 . 10336 1 1362 . 1 1 112 112 LYS HD2 H 1 1.800 0.030 . 1 . . . . 112 LYS HD2 . 10336 1 1363 . 1 1 112 112 LYS HD3 H 1 1.800 0.030 . 1 . . . . 112 LYS HD3 . 10336 1 1364 . 1 1 112 112 LYS HE2 H 1 3.044 0.030 . 2 . . . . 112 LYS HE2 . 10336 1 1365 . 1 1 112 112 LYS HE3 H 1 3.008 0.030 . 2 . . . . 112 LYS HE3 . 10336 1 1366 . 1 1 112 112 LYS HG2 H 1 1.550 0.030 . 2 . . . . 112 LYS HG2 . 10336 1 1367 . 1 1 112 112 LYS HG3 H 1 2.019 0.030 . 2 . . . . 112 LYS HG3 . 10336 1 1368 . 1 1 112 112 LYS C C 13 177.593 0.300 . 1 . . . . 112 LYS C . 10336 1 1369 . 1 1 112 112 LYS CA C 13 56.292 0.300 . 1 . . . . 112 LYS CA . 10336 1 1370 . 1 1 112 112 LYS CB C 13 34.749 0.300 . 1 . . . . 112 LYS CB . 10336 1 1371 . 1 1 112 112 LYS CD C 13 29.971 0.300 . 1 . . . . 112 LYS CD . 10336 1 1372 . 1 1 112 112 LYS CE C 13 42.394 0.300 . 1 . . . . 112 LYS CE . 10336 1 1373 . 1 1 112 112 LYS CG C 13 25.420 0.300 . 1 . . . . 112 LYS CG . 10336 1 1374 . 1 1 112 112 LYS N N 15 118.864 0.300 . 1 . . . . 112 LYS N . 10336 1 1375 . 1 1 113 113 GLU H H 1 8.602 0.030 . 1 . . . . 113 GLU H . 10336 1 1376 . 1 1 113 113 GLU HA H 1 3.924 0.030 . 1 . . . . 113 GLU HA . 10336 1 1377 . 1 1 113 113 GLU HB2 H 1 1.906 0.030 . 2 . . . . 113 GLU HB2 . 10336 1 1378 . 1 1 113 113 GLU HB3 H 1 1.968 0.030 . 2 . . . . 113 GLU HB3 . 10336 1 1379 . 1 1 113 113 GLU HG2 H 1 2.223 0.030 . 1 . . . . 113 GLU HG2 . 10336 1 1380 . 1 1 113 113 GLU HG3 H 1 2.223 0.030 . 1 . . . . 113 GLU HG3 . 10336 1 1381 . 1 1 113 113 GLU C C 13 177.093 0.300 . 1 . . . . 113 GLU C . 10336 1 1382 . 1 1 113 113 GLU CA C 13 59.121 0.300 . 1 . . . . 113 GLU CA . 10336 1 1383 . 1 1 113 113 GLU CB C 13 29.526 0.300 . 1 . . . . 113 GLU CB . 10336 1 1384 . 1 1 113 113 GLU CG C 13 36.244 0.300 . 1 . . . . 113 GLU CG . 10336 1 1385 . 1 1 113 113 GLU N N 15 118.553 0.300 . 1 . . . . 113 GLU N . 10336 1 1386 . 1 1 114 114 ASP H H 1 8.140 0.030 . 1 . . . . 114 ASP H . 10336 1 1387 . 1 1 114 114 ASP HA H 1 4.641 0.030 . 1 . . . . 114 ASP HA . 10336 1 1388 . 1 1 114 114 ASP HB2 H 1 2.784 0.030 . 2 . . . . 114 ASP HB2 . 10336 1 1389 . 1 1 114 114 ASP HB3 H 1 2.671 0.030 . 2 . . . . 114 ASP HB3 . 10336 1 1390 . 1 1 114 114 ASP C C 13 176.554 0.300 . 1 . . . . 114 ASP C . 10336 1 1391 . 1 1 114 114 ASP CA C 13 53.465 0.300 . 1 . . . . 114 ASP CA . 10336 1 1392 . 1 1 114 114 ASP CB C 13 40.020 0.300 . 1 . . . . 114 ASP CB . 10336 1 1393 . 1 1 114 114 ASP N N 15 115.958 0.300 . 1 . . . . 114 ASP N . 10336 1 1394 . 1 1 115 115 GLY H H 1 8.264 0.030 . 1 . . . . 115 GLY H . 10336 1 1395 . 1 1 115 115 GLY HA2 H 1 4.076 0.030 . 2 . . . . 115 GLY HA2 . 10336 1 1396 . 1 1 115 115 GLY HA3 H 1 3.975 0.030 . 2 . . . . 115 GLY HA3 . 10336 1 1397 . 1 1 115 115 GLY C C 13 174.924 0.300 . 1 . . . . 115 GLY C . 10336 1 1398 . 1 1 115 115 GLY CA C 13 46.246 0.300 . 1 . . . . 115 GLY CA . 10336 1 1399 . 1 1 115 115 GLY N N 15 110.856 0.300 . 1 . . . . 115 GLY N . 10336 1 1400 . 1 1 116 116 ILE H H 1 8.481 0.030 . 1 . . . . 116 ILE H . 10336 1 1401 . 1 1 116 116 ILE HA H 1 4.487 0.030 . 1 . . . . 116 ILE HA . 10336 1 1402 . 1 1 116 116 ILE HB H 1 1.720 0.030 . 1 . . . . 116 ILE HB . 10336 1 1403 . 1 1 116 116 ILE HD11 H 1 0.816 0.030 . 1 . . . . 116 ILE HD1 . 10336 1 1404 . 1 1 116 116 ILE HD12 H 1 0.816 0.030 . 1 . . . . 116 ILE HD1 . 10336 1 1405 . 1 1 116 116 ILE HD13 H 1 0.816 0.030 . 1 . . . . 116 ILE HD1 . 10336 1 1406 . 1 1 116 116 ILE HG12 H 1 1.402 0.030 . 2 . . . . 116 ILE HG12 . 10336 1 1407 . 1 1 116 116 ILE HG13 H 1 0.883 0.030 . 2 . . . . 116 ILE HG13 . 10336 1 1408 . 1 1 116 116 ILE HG21 H 1 0.841 0.030 . 1 . . . . 116 ILE HG2 . 10336 1 1409 . 1 1 116 116 ILE HG22 H 1 0.841 0.030 . 1 . . . . 116 ILE HG2 . 10336 1 1410 . 1 1 116 116 ILE HG23 H 1 0.841 0.030 . 1 . . . . 116 ILE HG2 . 10336 1 1411 . 1 1 116 116 ILE C C 13 173.570 0.300 . 1 . . . . 116 ILE C . 10336 1 1412 . 1 1 116 116 ILE CA C 13 60.966 0.300 . 1 . . . . 116 ILE CA . 10336 1 1413 . 1 1 116 116 ILE CB C 13 41.075 0.300 . 1 . . . . 116 ILE CB . 10336 1 1414 . 1 1 116 116 ILE CD1 C 13 13.969 0.300 . 1 . . . . 116 ILE CD1 . 10336 1 1415 . 1 1 116 116 ILE CG1 C 13 28.495 0.300 . 1 . . . . 116 ILE CG1 . 10336 1 1416 . 1 1 116 116 ILE CG2 C 13 16.545 0.300 . 1 . . . . 116 ILE CG2 . 10336 1 1417 . 1 1 116 116 ILE N N 15 125.161 0.300 . 1 . . . . 116 ILE N . 10336 1 1418 . 1 1 117 117 VAL H H 1 9.016 0.030 . 1 . . . . 117 VAL H . 10336 1 1419 . 1 1 117 117 VAL HA H 1 4.676 0.030 . 1 . . . . 117 VAL HA . 10336 1 1420 . 1 1 117 117 VAL HB H 1 2.001 0.030 . 1 . . . . 117 VAL HB . 10336 1 1421 . 1 1 117 117 VAL HG11 H 1 0.802 0.030 . 1 . . . . 117 VAL HG1 . 10336 1 1422 . 1 1 117 117 VAL HG12 H 1 0.802 0.030 . 1 . . . . 117 VAL HG1 . 10336 1 1423 . 1 1 117 117 VAL HG13 H 1 0.802 0.030 . 1 . . . . 117 VAL HG1 . 10336 1 1424 . 1 1 117 117 VAL HG21 H 1 0.858 0.030 . 1 . . . . 117 VAL HG2 . 10336 1 1425 . 1 1 117 117 VAL HG22 H 1 0.858 0.030 . 1 . . . . 117 VAL HG2 . 10336 1 1426 . 1 1 117 117 VAL HG23 H 1 0.858 0.030 . 1 . . . . 117 VAL HG2 . 10336 1 1427 . 1 1 117 117 VAL C C 13 173.528 0.300 . 1 . . . . 117 VAL C . 10336 1 1428 . 1 1 117 117 VAL CA C 13 58.659 0.300 . 1 . . . . 117 VAL CA . 10336 1 1429 . 1 1 117 117 VAL CB C 13 33.661 0.300 . 1 . . . . 117 VAL CB . 10336 1 1430 . 1 1 117 117 VAL CG1 C 13 21.484 0.300 . 2 . . . . 117 VAL CG1 . 10336 1 1431 . 1 1 117 117 VAL CG2 C 13 20.234 0.300 . 2 . . . . 117 VAL CG2 . 10336 1 1432 . 1 1 117 117 VAL N N 15 127.494 0.300 . 1 . . . . 117 VAL N . 10336 1 1433 . 1 1 118 118 PRO HA H 1 4.443 0.030 . 1 . . . . 118 PRO HA . 10336 1 1434 . 1 1 118 118 PRO HB2 H 1 2.333 0.030 . 2 . . . . 118 PRO HB2 . 10336 1 1435 . 1 1 118 118 PRO HB3 H 1 1.894 0.030 . 2 . . . . 118 PRO HB3 . 10336 1 1436 . 1 1 118 118 PRO HD2 H 1 3.820 0.030 . 2 . . . . 118 PRO HD2 . 10336 1 1437 . 1 1 118 118 PRO HD3 H 1 3.935 0.030 . 2 . . . . 118 PRO HD3 . 10336 1 1438 . 1 1 118 118 PRO HG2 H 1 2.148 0.030 . 2 . . . . 118 PRO HG2 . 10336 1 1439 . 1 1 118 118 PRO HG3 H 1 1.986 0.030 . 2 . . . . 118 PRO HG3 . 10336 1 1440 . 1 1 118 118 PRO C C 13 176.369 0.300 . 1 . . . . 118 PRO C . 10336 1 1441 . 1 1 118 118 PRO CA C 13 62.743 0.300 . 1 . . . . 118 PRO CA . 10336 1 1442 . 1 1 118 118 PRO CB C 13 32.554 0.300 . 1 . . . . 118 PRO CB . 10336 1 1443 . 1 1 118 118 PRO CD C 13 51.233 0.300 . 1 . . . . 118 PRO CD . 10336 1 1444 . 1 1 118 118 PRO CG C 13 27.219 0.300 . 1 . . . . 118 PRO CG . 10336 1 1445 . 1 1 119 119 LEU H H 1 7.866 0.030 . 1 . . . . 119 LEU H . 10336 1 1446 . 1 1 119 119 LEU HA H 1 4.685 0.030 . 1 . . . . 119 LEU HA . 10336 1 1447 . 1 1 119 119 LEU HB2 H 1 1.075 0.030 . 2 . . . . 119 LEU HB2 . 10336 1 1448 . 1 1 119 119 LEU HB3 H 1 1.037 0.030 . 2 . . . . 119 LEU HB3 . 10336 1 1449 . 1 1 119 119 LEU HD11 H 1 0.076 0.030 . 1 . . . . 119 LEU HD1 . 10336 1 1450 . 1 1 119 119 LEU HD12 H 1 0.076 0.030 . 1 . . . . 119 LEU HD1 . 10336 1 1451 . 1 1 119 119 LEU HD13 H 1 0.076 0.030 . 1 . . . . 119 LEU HD1 . 10336 1 1452 . 1 1 119 119 LEU HD21 H 1 0.453 0.030 . 1 . . . . 119 LEU HD2 . 10336 1 1453 . 1 1 119 119 LEU HD22 H 1 0.453 0.030 . 1 . . . . 119 LEU HD2 . 10336 1 1454 . 1 1 119 119 LEU HD23 H 1 0.453 0.030 . 1 . . . . 119 LEU HD2 . 10336 1 1455 . 1 1 119 119 LEU HG H 1 1.247 0.030 . 1 . . . . 119 LEU HG . 10336 1 1456 . 1 1 119 119 LEU C C 13 178.091 0.300 . 1 . . . . 119 LEU C . 10336 1 1457 . 1 1 119 119 LEU CA C 13 52.548 0.300 . 1 . . . . 119 LEU CA . 10336 1 1458 . 1 1 119 119 LEU CB C 13 43.870 0.300 . 1 . . . . 119 LEU CB . 10336 1 1459 . 1 1 119 119 LEU CD1 C 13 25.378 0.300 . 2 . . . . 119 LEU CD1 . 10336 1 1460 . 1 1 119 119 LEU CD2 C 13 21.484 0.300 . 2 . . . . 119 LEU CD2 . 10336 1 1461 . 1 1 119 119 LEU CG C 13 27.252 0.300 . 1 . . . . 119 LEU CG . 10336 1 1462 . 1 1 119 119 LEU N N 15 120.574 0.300 . 1 . . . . 119 LEU N . 10336 1 1463 . 1 1 120 120 ARG H H 1 9.195 0.030 . 1 . . . . 120 ARG H . 10336 1 1464 . 1 1 120 120 ARG HA H 1 4.489 0.030 . 1 . . . . 120 ARG HA . 10336 1 1465 . 1 1 120 120 ARG HB2 H 1 1.606 0.030 . 1 . . . . 120 ARG HB2 . 10336 1 1466 . 1 1 120 120 ARG HB3 H 1 1.606 0.030 . 1 . . . . 120 ARG HB3 . 10336 1 1467 . 1 1 120 120 ARG HD2 H 1 3.159 0.030 . 1 . . . . 120 ARG HD2 . 10336 1 1468 . 1 1 120 120 ARG HD3 H 1 3.159 0.030 . 1 . . . . 120 ARG HD3 . 10336 1 1469 . 1 1 120 120 ARG HE H 1 8.194 0.030 . 1 . . . . 120 ARG HE . 10336 1 1470 . 1 1 120 120 ARG HG2 H 1 1.645 0.030 . 2 . . . . 120 ARG HG2 . 10336 1 1471 . 1 1 120 120 ARG HG3 H 1 1.813 0.030 . 2 . . . . 120 ARG HG3 . 10336 1 1472 . 1 1 120 120 ARG C C 13 176.010 0.300 . 1 . . . . 120 ARG C . 10336 1 1473 . 1 1 120 120 ARG CA C 13 55.096 0.300 . 1 . . . . 120 ARG CA . 10336 1 1474 . 1 1 120 120 ARG CB C 13 27.142 0.300 . 1 . . . . 120 ARG CB . 10336 1 1475 . 1 1 120 120 ARG CD C 13 43.501 0.300 . 1 . . . . 120 ARG CD . 10336 1 1476 . 1 1 120 120 ARG CG C 13 27.265 0.300 . 1 . . . . 120 ARG CG . 10336 1 1477 . 1 1 120 120 ARG N N 15 121.974 0.300 . 1 . . . . 120 ARG N . 10336 1 1478 . 1 1 120 120 ARG NE N 15 81.858 0.300 . 1 . . . . 120 ARG NE . 10336 1 1479 . 1 1 121 121 TYR H H 1 7.702 0.030 . 1 . . . . 121 TYR H . 10336 1 1480 . 1 1 121 121 TYR HA H 1 4.428 0.030 . 1 . . . . 121 TYR HA . 10336 1 1481 . 1 1 121 121 TYR HB2 H 1 2.850 0.030 . 2 . . . . 121 TYR HB2 . 10336 1 1482 . 1 1 121 121 TYR HB3 H 1 2.908 0.030 . 2 . . . . 121 TYR HB3 . 10336 1 1483 . 1 1 121 121 TYR HD1 H 1 7.192 0.030 . 1 . . . . 121 TYR HD1 . 10336 1 1484 . 1 1 121 121 TYR HD2 H 1 7.192 0.030 . 1 . . . . 121 TYR HD2 . 10336 1 1485 . 1 1 121 121 TYR HE1 H 1 6.892 0.030 . 1 . . . . 121 TYR HE1 . 10336 1 1486 . 1 1 121 121 TYR HE2 H 1 6.892 0.030 . 1 . . . . 121 TYR HE2 . 10336 1 1487 . 1 1 121 121 TYR C C 13 178.092 0.300 . 1 . . . . 121 TYR C . 10336 1 1488 . 1 1 121 121 TYR CA C 13 60.474 0.300 . 1 . . . . 121 TYR CA . 10336 1 1489 . 1 1 121 121 TYR CB C 13 39.685 0.300 . 1 . . . . 121 TYR CB . 10336 1 1490 . 1 1 121 121 TYR CD1 C 13 133.779 0.300 . 1 . . . . 121 TYR CD1 . 10336 1 1491 . 1 1 121 121 TYR CD2 C 13 133.779 0.300 . 1 . . . . 121 TYR CD2 . 10336 1 1492 . 1 1 121 121 TYR CE1 C 13 118.527 0.300 . 1 . . . . 121 TYR CE1 . 10336 1 1493 . 1 1 121 121 TYR CE2 C 13 118.527 0.300 . 1 . . . . 121 TYR CE2 . 10336 1 1494 . 1 1 121 121 TYR N N 15 125.628 0.300 . 1 . . . . 121 TYR N . 10336 1 1495 . 1 1 122 122 VAL H H 1 7.948 0.030 . 1 . . . . 122 VAL H . 10336 1 1496 . 1 1 122 122 VAL HA H 1 3.830 0.030 . 1 . . . . 122 VAL HA . 10336 1 1497 . 1 1 122 122 VAL HB H 1 2.033 0.030 . 1 . . . . 122 VAL HB . 10336 1 1498 . 1 1 122 122 VAL HG11 H 1 0.836 0.030 . 1 . . . . 122 VAL HG1 . 10336 1 1499 . 1 1 122 122 VAL HG12 H 1 0.836 0.030 . 1 . . . . 122 VAL HG1 . 10336 1 1500 . 1 1 122 122 VAL HG13 H 1 0.836 0.030 . 1 . . . . 122 VAL HG1 . 10336 1 1501 . 1 1 122 122 VAL HG21 H 1 0.799 0.030 . 1 . . . . 122 VAL HG2 . 10336 1 1502 . 1 1 122 122 VAL HG22 H 1 0.799 0.030 . 1 . . . . 122 VAL HG2 . 10336 1 1503 . 1 1 122 122 VAL HG23 H 1 0.799 0.030 . 1 . . . . 122 VAL HG2 . 10336 1 1504 . 1 1 122 122 VAL C C 13 176.972 0.300 . 1 . . . . 122 VAL C . 10336 1 1505 . 1 1 122 122 VAL CA C 13 64.783 0.300 . 1 . . . . 122 VAL CA . 10336 1 1506 . 1 1 122 122 VAL CB C 13 31.155 0.300 . 1 . . . . 122 VAL CB . 10336 1 1507 . 1 1 122 122 VAL CG1 C 13 20.255 0.300 . 2 . . . . 122 VAL CG1 . 10336 1 1508 . 1 1 122 122 VAL CG2 C 13 20.869 0.300 . 2 . . . . 122 VAL CG2 . 10336 1 1509 . 1 1 122 122 VAL N N 15 120.652 0.300 . 1 . . . . 122 VAL N . 10336 1 1510 . 1 1 123 123 LYS H H 1 8.264 0.030 . 1 . . . . 123 LYS H . 10336 1 1511 . 1 1 123 123 LYS HA H 1 4.117 0.030 . 1 . . . . 123 LYS HA . 10336 1 1512 . 1 1 123 123 LYS HB2 H 1 1.332 0.030 . 1 . . . . 123 LYS HB2 . 10336 1 1513 . 1 1 123 123 LYS HB3 H 1 1.332 0.030 . 1 . . . . 123 LYS HB3 . 10336 1 1514 . 1 1 123 123 LYS HD2 H 1 1.544 0.030 . 1 . . . . 123 LYS HD2 . 10336 1 1515 . 1 1 123 123 LYS HD3 H 1 1.544 0.030 . 1 . . . . 123 LYS HD3 . 10336 1 1516 . 1 1 123 123 LYS HE2 H 1 2.992 0.030 . 2 . . . . 123 LYS HE2 . 10336 1 1517 . 1 1 123 123 LYS HE3 H 1 2.897 0.030 . 2 . . . . 123 LYS HE3 . 10336 1 1518 . 1 1 123 123 LYS HG2 H 1 1.338 0.030 . 2 . . . . 123 LYS HG2 . 10336 1 1519 . 1 1 123 123 LYS HG3 H 1 1.197 0.030 . 2 . . . . 123 LYS HG3 . 10336 1 1520 . 1 1 123 123 LYS C C 13 176.302 0.300 . 1 . . . . 123 LYS C . 10336 1 1521 . 1 1 123 123 LYS CA C 13 56.117 0.300 . 1 . . . . 123 LYS CA . 10336 1 1522 . 1 1 123 123 LYS CB C 13 32.161 0.300 . 1 . . . . 123 LYS CB . 10336 1 1523 . 1 1 123 123 LYS CD C 13 28.618 0.300 . 1 . . . . 123 LYS CD . 10336 1 1524 . 1 1 123 123 LYS CE C 13 42.025 0.300 . 1 . . . . 123 LYS CE . 10336 1 1525 . 1 1 123 123 LYS CG C 13 25.394 0.300 . 1 . . . . 123 LYS CG . 10336 1 1526 . 1 1 123 123 LYS N N 15 117.620 0.300 . 1 . . . . 123 LYS N . 10336 1 1527 . 1 1 124 124 PHE H H 1 7.670 0.030 . 1 . . . . 124 PHE H . 10336 1 1528 . 1 1 124 124 PHE HA H 1 4.594 0.030 . 1 . . . . 124 PHE HA . 10336 1 1529 . 1 1 124 124 PHE HB2 H 1 3.146 0.030 . 2 . . . . 124 PHE HB2 . 10336 1 1530 . 1 1 124 124 PHE HB3 H 1 2.975 0.030 . 2 . . . . 124 PHE HB3 . 10336 1 1531 . 1 1 124 124 PHE HD1 H 1 7.000 0.030 . 1 . . . . 124 PHE HD1 . 10336 1 1532 . 1 1 124 124 PHE HD2 H 1 7.000 0.030 . 1 . . . . 124 PHE HD2 . 10336 1 1533 . 1 1 124 124 PHE HE1 H 1 7.240 0.030 . 1 . . . . 124 PHE HE1 . 10336 1 1534 . 1 1 124 124 PHE HE2 H 1 7.240 0.030 . 1 . . . . 124 PHE HE2 . 10336 1 1535 . 1 1 124 124 PHE HZ H 1 6.836 0.030 . 1 . . . . 124 PHE HZ . 10336 1 1536 . 1 1 124 124 PHE C C 13 174.472 0.300 . 1 . . . . 124 PHE C . 10336 1 1537 . 1 1 124 124 PHE CA C 13 55.933 0.300 . 1 . . . . 124 PHE CA . 10336 1 1538 . 1 1 124 124 PHE CB C 13 40.260 0.300 . 1 . . . . 124 PHE CB . 10336 1 1539 . 1 1 124 124 PHE CD1 C 13 132.918 0.300 . 1 . . . . 124 PHE CD1 . 10336 1 1540 . 1 1 124 124 PHE CD2 C 13 132.918 0.300 . 1 . . . . 124 PHE CD2 . 10336 1 1541 . 1 1 124 124 PHE CE1 C 13 131.073 0.300 . 1 . . . . 124 PHE CE1 . 10336 1 1542 . 1 1 124 124 PHE CE2 C 13 131.073 0.300 . 1 . . . . 124 PHE CE2 . 10336 1 1543 . 1 1 124 124 PHE CZ C 13 128.367 0.300 . 1 . . . . 124 PHE CZ . 10336 1 1544 . 1 1 124 124 PHE N N 15 118.087 0.300 . 1 . . . . 124 PHE N . 10336 1 1545 . 1 1 125 125 GLN H H 1 7.619 0.030 . 1 . . . . 125 GLN H . 10336 1 1546 . 1 1 125 125 GLN HA H 1 4.090 0.030 . 1 . . . . 125 GLN HA . 10336 1 1547 . 1 1 125 125 GLN HB2 H 1 2.157 0.030 . 2 . . . . 125 GLN HB2 . 10336 1 1548 . 1 1 125 125 GLN HB3 H 1 1.947 0.030 . 2 . . . . 125 GLN HB3 . 10336 1 1549 . 1 1 125 125 GLN HE21 H 1 6.031 0.030 . 2 . . . . 125 GLN HE21 . 10336 1 1550 . 1 1 125 125 GLN HE22 H 1 7.187 0.030 . 2 . . . . 125 GLN HE22 . 10336 1 1551 . 1 1 125 125 GLN HG2 H 1 2.340 0.030 . 2 . . . . 125 GLN HG2 . 10336 1 1552 . 1 1 125 125 GLN HG3 H 1 2.299 0.030 . 2 . . . . 125 GLN HG3 . 10336 1 1553 . 1 1 125 125 GLN C C 13 175.141 0.300 . 1 . . . . 125 GLN C . 10336 1 1554 . 1 1 125 125 GLN CA C 13 56.463 0.300 . 1 . . . . 125 GLN CA . 10336 1 1555 . 1 1 125 125 GLN CB C 13 30.340 0.300 . 1 . . . . 125 GLN CB . 10336 1 1556 . 1 1 125 125 GLN CG C 13 34.488 0.300 . 1 . . . . 125 GLN CG . 10336 1 1557 . 1 1 125 125 GLN N N 15 114.665 0.300 . 1 . . . . 125 GLN N . 10336 1 1558 . 1 1 125 125 GLN NE2 N 15 113.422 0.300 . 1 . . . . 125 GLN NE2 . 10336 1 1559 . 1 1 126 126 ASN H H 1 8.243 0.030 . 1 . . . . 126 ASN H . 10336 1 1560 . 1 1 126 126 ASN HA H 1 4.434 0.030 . 1 . . . . 126 ASN HA . 10336 1 1561 . 1 1 126 126 ASN HB2 H 1 2.767 0.030 . 2 . . . . 126 ASN HB2 . 10336 1 1562 . 1 1 126 126 ASN HB3 H 1 2.340 0.030 . 2 . . . . 126 ASN HB3 . 10336 1 1563 . 1 1 126 126 ASN HD21 H 1 7.332 0.030 . 2 . . . . 126 ASN HD21 . 10336 1 1564 . 1 1 126 126 ASN HD22 H 1 6.562 0.030 . 2 . . . . 126 ASN HD22 . 10336 1 1565 . 1 1 126 126 ASN C C 13 173.026 0.300 . 1 . . . . 126 ASN C . 10336 1 1566 . 1 1 126 126 ASN CA C 13 53.730 0.300 . 1 . . . . 126 ASN CA . 10336 1 1567 . 1 1 126 126 ASN CB C 13 38.950 0.300 . 1 . . . . 126 ASN CB . 10336 1 1568 . 1 1 126 126 ASN N N 15 118.553 0.300 . 1 . . . . 126 ASN N . 10336 1 1569 . 1 1 126 126 ASN ND2 N 15 110.468 0.300 . 1 . . . . 126 ASN ND2 . 10336 1 1570 . 1 1 127 127 VAL H H 1 9.027 0.030 . 1 . . . . 127 VAL H . 10336 1 1571 . 1 1 127 127 VAL HA H 1 4.153 0.030 . 1 . . . . 127 VAL HA . 10336 1 1572 . 1 1 127 127 VAL HB H 1 1.937 0.030 . 1 . . . . 127 VAL HB . 10336 1 1573 . 1 1 127 127 VAL HG11 H 1 0.822 0.030 . 1 . . . . 127 VAL HG1 . 10336 1 1574 . 1 1 127 127 VAL HG12 H 1 0.822 0.030 . 1 . . . . 127 VAL HG1 . 10336 1 1575 . 1 1 127 127 VAL HG13 H 1 0.822 0.030 . 1 . . . . 127 VAL HG1 . 10336 1 1576 . 1 1 127 127 VAL HG21 H 1 0.972 0.030 . 1 . . . . 127 VAL HG2 . 10336 1 1577 . 1 1 127 127 VAL HG22 H 1 0.972 0.030 . 1 . . . . 127 VAL HG2 . 10336 1 1578 . 1 1 127 127 VAL HG23 H 1 0.972 0.030 . 1 . . . . 127 VAL HG2 . 10336 1 1579 . 1 1 127 127 VAL C C 13 174.454 0.300 . 1 . . . . 127 VAL C . 10336 1 1580 . 1 1 127 127 VAL CA C 13 63.600 0.300 . 1 . . . . 127 VAL CA . 10336 1 1581 . 1 1 127 127 VAL CB C 13 33.046 0.300 . 1 . . . . 127 VAL CB . 10336 1 1582 . 1 1 127 127 VAL CG1 C 13 22.960 0.300 . 2 . . . . 127 VAL CG1 . 10336 1 1583 . 1 1 127 127 VAL CG2 C 13 22.099 0.300 . 2 . . . . 127 VAL CG2 . 10336 1 1584 . 1 1 127 127 VAL N N 15 124.695 0.300 . 1 . . . . 127 VAL N . 10336 1 1585 . 1 1 128 128 ASN H H 1 10.174 0.030 . 1 . . . . 128 ASN H . 10336 1 1586 . 1 1 128 128 ASN HA H 1 4.996 0.030 . 1 . . . . 128 ASN HA . 10336 1 1587 . 1 1 128 128 ASN HB2 H 1 2.784 0.030 . 2 . . . . 128 ASN HB2 . 10336 1 1588 . 1 1 128 128 ASN HB3 H 1 2.678 0.030 . 2 . . . . 128 ASN HB3 . 10336 1 1589 . 1 1 128 128 ASN HD21 H 1 7.352 0.030 . 2 . . . . 128 ASN HD21 . 10336 1 1590 . 1 1 128 128 ASN HD22 H 1 6.870 0.030 . 2 . . . . 128 ASN HD22 . 10336 1 1591 . 1 1 128 128 ASN C C 13 175.488 0.300 . 1 . . . . 128 ASN C . 10336 1 1592 . 1 1 128 128 ASN CA C 13 54.892 0.300 . 1 . . . . 128 ASN CA . 10336 1 1593 . 1 1 128 128 ASN CB C 13 41.266 0.300 . 1 . . . . 128 ASN CB . 10336 1 1594 . 1 1 128 128 ASN N N 15 124.384 0.300 . 1 . . . . 128 ASN N . 10336 1 1595 . 1 1 128 128 ASN ND2 N 15 112.645 0.300 . 1 . . . . 128 ASN ND2 . 10336 1 1596 . 1 1 129 129 SER H H 1 8.348 0.030 . 1 . . . . 129 SER H . 10336 1 1597 . 1 1 129 129 SER HA H 1 5.287 0.030 . 1 . . . . 129 SER HA . 10336 1 1598 . 1 1 129 129 SER HB2 H 1 3.957 0.030 . 2 . . . . 129 SER HB2 . 10336 1 1599 . 1 1 129 129 SER HB3 H 1 3.839 0.030 . 2 . . . . 129 SER HB3 . 10336 1 1600 . 1 1 129 129 SER C C 13 172.032 0.300 . 1 . . . . 129 SER C . 10336 1 1601 . 1 1 129 129 SER CA C 13 57.276 0.300 . 1 . . . . 129 SER CA . 10336 1 1602 . 1 1 129 129 SER CB C 13 65.271 0.300 . 1 . . . . 129 SER CB . 10336 1 1603 . 1 1 129 129 SER N N 15 114.043 0.300 . 1 . . . . 129 SER N . 10336 1 1604 . 1 1 130 130 VAL H H 1 9.258 0.030 . 1 . . . . 130 VAL H . 10336 1 1605 . 1 1 130 130 VAL HA H 1 5.176 0.030 . 1 . . . . 130 VAL HA . 10336 1 1606 . 1 1 130 130 VAL HB H 1 1.910 0.030 . 1 . . . . 130 VAL HB . 10336 1 1607 . 1 1 130 130 VAL HG11 H 1 0.887 0.030 . 1 . . . . 130 VAL HG1 . 10336 1 1608 . 1 1 130 130 VAL HG12 H 1 0.887 0.030 . 1 . . . . 130 VAL HG1 . 10336 1 1609 . 1 1 130 130 VAL HG13 H 1 0.887 0.030 . 1 . . . . 130 VAL HG1 . 10336 1 1610 . 1 1 130 130 VAL HG21 H 1 1.030 0.030 . 1 . . . . 130 VAL HG2 . 10336 1 1611 . 1 1 130 130 VAL HG22 H 1 1.030 0.030 . 1 . . . . 130 VAL HG2 . 10336 1 1612 . 1 1 130 130 VAL HG23 H 1 1.030 0.030 . 1 . . . . 130 VAL HG2 . 10336 1 1613 . 1 1 130 130 VAL C C 13 172.903 0.300 . 1 . . . . 130 VAL C . 10336 1 1614 . 1 1 130 130 VAL CA C 13 60.105 0.300 . 1 . . . . 130 VAL CA . 10336 1 1615 . 1 1 130 130 VAL CB C 13 35.851 0.300 . 1 . . . . 130 VAL CB . 10336 1 1616 . 1 1 130 130 VAL CG1 C 13 22.468 0.300 . 2 . . . . 130 VAL CG1 . 10336 1 1617 . 1 1 130 130 VAL CG2 C 13 21.976 0.300 . 2 . . . . 130 VAL CG2 . 10336 1 1618 . 1 1 130 130 VAL N N 15 120.419 0.300 . 1 . . . . 130 VAL N . 10336 1 1619 . 1 1 131 131 THR H H 1 9.454 0.030 . 1 . . . . 131 THR H . 10336 1 1620 . 1 1 131 131 THR HA H 1 5.628 0.030 . 1 . . . . 131 THR HA . 10336 1 1621 . 1 1 131 131 THR HB H 1 3.768 0.030 . 1 . . . . 131 THR HB . 10336 1 1622 . 1 1 131 131 THR HG21 H 1 1.028 0.030 . 1 . . . . 131 THR HG2 . 10336 1 1623 . 1 1 131 131 THR HG22 H 1 1.028 0.030 . 1 . . . . 131 THR HG2 . 10336 1 1624 . 1 1 131 131 THR HG23 H 1 1.028 0.030 . 1 . . . . 131 THR HG2 . 10336 1 1625 . 1 1 131 131 THR C C 13 173.047 0.300 . 1 . . . . 131 THR C . 10336 1 1626 . 1 1 131 131 THR CA C 13 61.826 0.300 . 1 . . . . 131 THR CA . 10336 1 1627 . 1 1 131 131 THR CB C 13 71.789 0.300 . 1 . . . . 131 THR CB . 10336 1 1628 . 1 1 131 131 THR CG2 C 13 21.974 0.300 . 1 . . . . 131 THR CG2 . 10336 1 1629 . 1 1 131 131 THR N N 15 125.317 0.300 . 1 . . . . 131 THR N . 10336 1 1630 . 1 1 132 132 ILE H H 1 10.198 0.030 . 1 . . . . 132 ILE H . 10336 1 1631 . 1 1 132 132 ILE HA H 1 4.775 0.030 . 1 . . . . 132 ILE HA . 10336 1 1632 . 1 1 132 132 ILE HB H 1 1.724 0.030 . 1 . . . . 132 ILE HB . 10336 1 1633 . 1 1 132 132 ILE HD11 H 1 0.595 0.030 . 1 . . . . 132 ILE HD1 . 10336 1 1634 . 1 1 132 132 ILE HD12 H 1 0.595 0.030 . 1 . . . . 132 ILE HD1 . 10336 1 1635 . 1 1 132 132 ILE HD13 H 1 0.595 0.030 . 1 . . . . 132 ILE HD1 . 10336 1 1636 . 1 1 132 132 ILE HG12 H 1 0.893 0.030 . 2 . . . . 132 ILE HG12 . 10336 1 1637 . 1 1 132 132 ILE HG13 H 1 1.530 0.030 . 2 . . . . 132 ILE HG13 . 10336 1 1638 . 1 1 132 132 ILE HG21 H 1 0.460 0.030 . 1 . . . . 132 ILE HG2 . 10336 1 1639 . 1 1 132 132 ILE HG22 H 1 0.460 0.030 . 1 . . . . 132 ILE HG2 . 10336 1 1640 . 1 1 132 132 ILE HG23 H 1 0.460 0.030 . 1 . . . . 132 ILE HG2 . 10336 1 1641 . 1 1 132 132 ILE C C 13 174.368 0.300 . 1 . . . . 132 ILE C . 10336 1 1642 . 1 1 132 132 ILE CA C 13 59.930 0.300 . 1 . . . . 132 ILE CA . 10336 1 1643 . 1 1 132 132 ILE CB C 13 40.978 0.300 . 1 . . . . 132 ILE CB . 10336 1 1644 . 1 1 132 132 ILE CD1 C 13 15.089 0.300 . 1 . . . . 132 ILE CD1 . 10336 1 1645 . 1 1 132 132 ILE CG1 C 13 28.372 0.300 . 1 . . . . 132 ILE CG1 . 10336 1 1646 . 1 1 132 132 ILE CG2 C 13 18.164 0.300 . 1 . . . . 132 ILE CG2 . 10336 1 1647 . 1 1 132 132 ILE N N 15 127.728 0.300 . 1 . . . . 132 ILE N . 10336 1 1648 . 1 1 133 133 PHE H H 1 9.707 0.030 . 1 . . . . 133 PHE H . 10336 1 1649 . 1 1 133 133 PHE HA H 1 5.859 0.030 . 1 . . . . 133 PHE HA . 10336 1 1650 . 1 1 133 133 PHE HB2 H 1 3.081 0.030 . 2 . . . . 133 PHE HB2 . 10336 1 1651 . 1 1 133 133 PHE HB3 H 1 3.389 0.030 . 2 . . . . 133 PHE HB3 . 10336 1 1652 . 1 1 133 133 PHE HD1 H 1 7.303 0.030 . 1 . . . . 133 PHE HD1 . 10336 1 1653 . 1 1 133 133 PHE HD2 H 1 7.303 0.030 . 1 . . . . 133 PHE HD2 . 10336 1 1654 . 1 1 133 133 PHE HE1 H 1 7.377 0.030 . 1 . . . . 133 PHE HE1 . 10336 1 1655 . 1 1 133 133 PHE HE2 H 1 7.377 0.030 . 1 . . . . 133 PHE HE2 . 10336 1 1656 . 1 1 133 133 PHE HZ H 1 6.765 0.030 . 1 . . . . 133 PHE HZ . 10336 1 1657 . 1 1 133 133 PHE C C 13 174.290 0.300 . 1 . . . . 133 PHE C . 10336 1 1658 . 1 1 133 133 PHE CA C 13 52.971 0.300 . 1 . . . . 133 PHE CA . 10336 1 1659 . 1 1 133 133 PHE CB C 13 41.164 0.300 . 1 . . . . 133 PHE CB . 10336 1 1660 . 1 1 133 133 PHE CD1 C 13 130.704 0.300 . 1 . . . . 133 PHE CD1 . 10336 1 1661 . 1 1 133 133 PHE CD2 C 13 130.704 0.300 . 1 . . . . 133 PHE CD2 . 10336 1 1662 . 1 1 133 133 PHE CE1 C 13 131.688 0.300 . 1 . . . . 133 PHE CE1 . 10336 1 1663 . 1 1 133 133 PHE CE2 C 13 131.688 0.300 . 1 . . . . 133 PHE CE2 . 10336 1 1664 . 1 1 133 133 PHE CZ C 13 129.228 0.300 . 1 . . . . 133 PHE CZ . 10336 1 1665 . 1 1 133 133 PHE N N 15 128.350 0.300 . 1 . . . . 133 PHE N . 10336 1 1666 . 1 1 134 134 VAL H H 1 9.192 0.030 . 1 . . . . 134 VAL H . 10336 1 1667 . 1 1 134 134 VAL HA H 1 4.174 0.030 . 1 . . . . 134 VAL HA . 10336 1 1668 . 1 1 134 134 VAL HB H 1 2.307 0.030 . 1 . . . . 134 VAL HB . 10336 1 1669 . 1 1 134 134 VAL HG11 H 1 1.065 0.030 . 1 . . . . 134 VAL HG1 . 10336 1 1670 . 1 1 134 134 VAL HG12 H 1 1.065 0.030 . 1 . . . . 134 VAL HG1 . 10336 1 1671 . 1 1 134 134 VAL HG13 H 1 1.065 0.030 . 1 . . . . 134 VAL HG1 . 10336 1 1672 . 1 1 134 134 VAL HG21 H 1 1.035 0.030 . 1 . . . . 134 VAL HG2 . 10336 1 1673 . 1 1 134 134 VAL HG22 H 1 1.035 0.030 . 1 . . . . 134 VAL HG2 . 10336 1 1674 . 1 1 134 134 VAL HG23 H 1 1.035 0.030 . 1 . . . . 134 VAL HG2 . 10336 1 1675 . 1 1 134 134 VAL C C 13 172.565 0.300 . 1 . . . . 134 VAL C . 10336 1 1676 . 1 1 134 134 VAL CA C 13 61.990 0.300 . 1 . . . . 134 VAL CA . 10336 1 1677 . 1 1 134 134 VAL CB C 13 31.346 0.300 . 1 . . . . 134 VAL CB . 10336 1 1678 . 1 1 134 134 VAL CG1 C 13 21.730 0.300 . 2 . . . . 134 VAL CG1 . 10336 1 1679 . 1 1 134 134 VAL CG2 C 13 22.099 0.300 . 2 . . . . 134 VAL CG2 . 10336 1 1680 . 1 1 134 134 VAL N N 15 129.048 0.300 . 1 . . . . 134 VAL N . 10336 1 1681 . 1 1 135 135 GLN H H 1 8.371 0.030 . 1 . . . . 135 GLN H . 10336 1 1682 . 1 1 135 135 GLN HA H 1 3.618 0.030 . 1 . . . . 135 GLN HA . 10336 1 1683 . 1 1 135 135 GLN HB2 H 1 1.968 0.030 . 2 . . . . 135 GLN HB2 . 10336 1 1684 . 1 1 135 135 GLN HB3 H 1 1.238 0.030 . 2 . . . . 135 GLN HB3 . 10336 1 1685 . 1 1 135 135 GLN HE21 H 1 7.750 0.030 . 2 . . . . 135 GLN HE21 . 10336 1 1686 . 1 1 135 135 GLN HE22 H 1 6.520 0.030 . 2 . . . . 135 GLN HE22 . 10336 1 1687 . 1 1 135 135 GLN HG2 H 1 2.189 0.030 . 2 . . . . 135 GLN HG2 . 10336 1 1688 . 1 1 135 135 GLN HG3 H 1 2.264 0.030 . 2 . . . . 135 GLN HG3 . 10336 1 1689 . 1 1 135 135 GLN C C 13 175.581 0.300 . 1 . . . . 135 GLN C . 10336 1 1690 . 1 1 135 135 GLN CA C 13 56.361 0.300 . 1 . . . . 135 GLN CA . 10336 1 1691 . 1 1 135 135 GLN CB C 13 30.832 0.300 . 1 . . . . 135 GLN CB . 10336 1 1692 . 1 1 135 135 GLN CG C 13 34.488 0.300 . 1 . . . . 135 GLN CG . 10336 1 1693 . 1 1 135 135 GLN N N 15 125.939 0.300 . 1 . . . . 135 GLN N . 10336 1 1694 . 1 1 135 135 GLN NE2 N 15 110.079 0.300 . 1 . . . . 135 GLN NE2 . 10336 1 1695 . 1 1 136 136 SER H H 1 7.738 0.030 . 1 . . . . 136 SER H . 10336 1 1696 . 1 1 136 136 SER HA H 1 4.758 0.030 . 1 . . . . 136 SER HA . 10336 1 1697 . 1 1 136 136 SER HB2 H 1 4.092 0.030 . 2 . . . . 136 SER HB2 . 10336 1 1698 . 1 1 136 136 SER HB3 H 1 3.882 0.030 . 2 . . . . 136 SER HB3 . 10336 1 1699 . 1 1 136 136 SER C C 13 172.745 0.300 . 1 . . . . 136 SER C . 10336 1 1700 . 1 1 136 136 SER CA C 13 55.749 0.300 . 1 . . . . 136 SER CA . 10336 1 1701 . 1 1 136 136 SER CB C 13 66.855 0.300 . 1 . . . . 136 SER CB . 10336 1 1702 . 1 1 136 136 SER N N 15 108.837 0.300 . 1 . . . . 136 SER N . 10336 1 1703 . 1 1 137 137 ASN H H 1 8.830 0.030 . 1 . . . . 137 ASN H . 10336 1 1704 . 1 1 137 137 ASN HA H 1 5.102 0.030 . 1 . . . . 137 ASN HA . 10336 1 1705 . 1 1 137 137 ASN HB2 H 1 3.098 0.030 . 2 . . . . 137 ASN HB2 . 10336 1 1706 . 1 1 137 137 ASN HB3 H 1 2.813 0.030 . 2 . . . . 137 ASN HB3 . 10336 1 1707 . 1 1 137 137 ASN HD21 H 1 6.633 0.030 . 2 . . . . 137 ASN HD21 . 10336 1 1708 . 1 1 137 137 ASN HD22 H 1 7.281 0.030 . 2 . . . . 137 ASN HD22 . 10336 1 1709 . 1 1 137 137 ASN C C 13 175.989 0.300 . 1 . . . . 137 ASN C . 10336 1 1710 . 1 1 137 137 ASN CA C 13 51.365 0.300 . 1 . . . . 137 ASN CA . 10336 1 1711 . 1 1 137 137 ASN CB C 13 41.410 0.300 . 1 . . . . 137 ASN CB . 10336 1 1712 . 1 1 137 137 ASN N N 15 115.754 0.300 . 1 . . . . 137 ASN N . 10336 1 1713 . 1 1 137 137 ASN ND2 N 15 114.744 0.300 . 1 . . . . 137 ASN ND2 . 10336 1 1714 . 1 1 138 138 GLN H H 1 8.307 0.030 . 1 . . . . 138 GLN H . 10336 1 1715 . 1 1 138 138 GLN HA H 1 3.648 0.030 . 1 . . . . 138 GLN HA . 10336 1 1716 . 1 1 138 138 GLN HB2 H 1 2.262 0.030 . 2 . . . . 138 GLN HB2 . 10336 1 1717 . 1 1 138 138 GLN HB3 H 1 1.486 0.030 . 2 . . . . 138 GLN HB3 . 10336 1 1718 . 1 1 138 138 GLN HE21 H 1 6.657 0.030 . 2 . . . . 138 GLN HE21 . 10336 1 1719 . 1 1 138 138 GLN HE22 H 1 7.388 0.030 . 2 . . . . 138 GLN HE22 . 10336 1 1720 . 1 1 138 138 GLN HG2 H 1 2.493 0.030 . 2 . . . . 138 GLN HG2 . 10336 1 1721 . 1 1 138 138 GLN HG3 H 1 1.991 0.030 . 2 . . . . 138 GLN HG3 . 10336 1 1722 . 1 1 138 138 GLN C C 13 178.215 0.300 . 1 . . . . 138 GLN C . 10336 1 1723 . 1 1 138 138 GLN CA C 13 58.787 0.300 . 1 . . . . 138 GLN CA . 10336 1 1724 . 1 1 138 138 GLN CB C 13 28.495 0.300 . 1 . . . . 138 GLN CB . 10336 1 1725 . 1 1 138 138 GLN CG C 13 32.185 0.300 . 1 . . . . 138 GLN CG . 10336 1 1726 . 1 1 138 138 GLN N N 15 114.588 0.300 . 1 . . . . 138 GLN N . 10336 1 1727 . 1 1 138 138 GLN NE2 N 15 111.323 0.300 . 1 . . . . 138 GLN NE2 . 10336 1 1728 . 1 1 139 139 GLY H H 1 9.371 0.030 . 1 . . . . 139 GLY H . 10336 1 1729 . 1 1 139 139 GLY HA2 H 1 4.572 0.030 . 2 . . . . 139 GLY HA2 . 10336 1 1730 . 1 1 139 139 GLY HA3 H 1 3.486 0.030 . 2 . . . . 139 GLY HA3 . 10336 1 1731 . 1 1 139 139 GLY C C 13 173.957 0.300 . 1 . . . . 139 GLY C . 10336 1 1732 . 1 1 139 139 GLY CA C 13 44.655 0.300 . 1 . . . . 139 GLY CA . 10336 1 1733 . 1 1 139 139 GLY N N 15 105.880 0.300 . 1 . . . . 139 GLY N . 10336 1 1734 . 1 1 140 140 GLU H H 1 7.878 0.030 . 1 . . . . 140 GLU H . 10336 1 1735 . 1 1 140 140 GLU HA H 1 3.981 0.030 . 1 . . . . 140 GLU HA . 10336 1 1736 . 1 1 140 140 GLU HB2 H 1 2.201 0.030 . 2 . . . . 140 GLU HB2 . 10336 1 1737 . 1 1 140 140 GLU HB3 H 1 2.046 0.030 . 2 . . . . 140 GLU HB3 . 10336 1 1738 . 1 1 140 140 GLU HG2 H 1 2.224 0.030 . 2 . . . . 140 GLU HG2 . 10336 1 1739 . 1 1 140 140 GLU HG3 H 1 2.161 0.030 . 2 . . . . 140 GLU HG3 . 10336 1 1740 . 1 1 140 140 GLU C C 13 177.338 0.300 . 1 . . . . 140 GLU C . 10336 1 1741 . 1 1 140 140 GLU CA C 13 57.399 0.300 . 1 . . . . 140 GLU CA . 10336 1 1742 . 1 1 140 140 GLU CB C 13 27.265 0.300 . 1 . . . . 140 GLU CB . 10336 1 1743 . 1 1 140 140 GLU CG C 13 37.064 0.300 . 1 . . . . 140 GLU CG . 10336 1 1744 . 1 1 140 140 GLU N N 15 120.341 0.300 . 1 . . . . 140 GLU N . 10336 1 1745 . 1 1 141 141 GLU H H 1 8.568 0.030 . 1 . . . . 141 GLU H . 10336 1 1746 . 1 1 141 141 GLU HA H 1 4.290 0.030 . 1 . . . . 141 GLU HA . 10336 1 1747 . 1 1 141 141 GLU HB2 H 1 2.221 0.030 . 2 . . . . 141 GLU HB2 . 10336 1 1748 . 1 1 141 141 GLU HB3 H 1 1.409 0.030 . 2 . . . . 141 GLU HB3 . 10336 1 1749 . 1 1 141 141 GLU HG2 H 1 1.838 0.030 . 1 . . . . 141 GLU HG2 . 10336 1 1750 . 1 1 141 141 GLU HG3 H 1 1.838 0.030 . 1 . . . . 141 GLU HG3 . 10336 1 1751 . 1 1 141 141 GLU C C 13 179.038 0.300 . 1 . . . . 141 GLU C . 10336 1 1752 . 1 1 141 141 GLU CA C 13 54.852 0.300 . 1 . . . . 141 GLU CA . 10336 1 1753 . 1 1 141 141 GLU CB C 13 31.816 0.300 . 1 . . . . 141 GLU CB . 10336 1 1754 . 1 1 141 141 GLU CG C 13 35.629 0.300 . 1 . . . . 141 GLU CG . 10336 1 1755 . 1 1 141 141 GLU N N 15 118.760 0.300 . 1 . . . . 141 GLU N . 10336 1 1756 . 1 1 142 142 GLU H H 1 8.980 0.030 . 1 . . . . 142 GLU H . 10336 1 1757 . 1 1 142 142 GLU HA H 1 3.901 0.030 . 1 . . . . 142 GLU HA . 10336 1 1758 . 1 1 142 142 GLU HB2 H 1 2.044 0.030 . 1 . . . . 142 GLU HB2 . 10336 1 1759 . 1 1 142 142 GLU HB3 H 1 2.044 0.030 . 1 . . . . 142 GLU HB3 . 10336 1 1760 . 1 1 142 142 GLU HG2 H 1 2.252 0.030 . 2 . . . . 142 GLU HG2 . 10336 1 1761 . 1 1 142 142 GLU HG3 H 1 2.375 0.030 . 2 . . . . 142 GLU HG3 . 10336 1 1762 . 1 1 142 142 GLU C C 13 176.156 0.300 . 1 . . . . 142 GLU C . 10336 1 1763 . 1 1 142 142 GLU CA C 13 59.767 0.300 . 1 . . . . 142 GLU CA . 10336 1 1764 . 1 1 142 142 GLU CB C 13 30.340 0.300 . 1 . . . . 142 GLU CB . 10336 1 1765 . 1 1 142 142 GLU CG C 13 36.880 0.300 . 1 . . . . 142 GLU CG . 10336 1 1766 . 1 1 142 142 GLU N N 15 121.974 0.300 . 1 . . . . 142 GLU N . 10336 1 1767 . 1 1 143 143 THR H H 1 7.151 0.030 . 1 . . . . 143 THR H . 10336 1 1768 . 1 1 143 143 THR HA H 1 4.180 0.030 . 1 . . . . 143 THR HA . 10336 1 1769 . 1 1 143 143 THR HB H 1 4.378 0.030 . 1 . . . . 143 THR HB . 10336 1 1770 . 1 1 143 143 THR HG21 H 1 0.922 0.030 . 1 . . . . 143 THR HG2 . 10336 1 1771 . 1 1 143 143 THR HG22 H 1 0.922 0.030 . 1 . . . . 143 THR HG2 . 10336 1 1772 . 1 1 143 143 THR HG23 H 1 0.922 0.030 . 1 . . . . 143 THR HG2 . 10336 1 1773 . 1 1 143 143 THR C C 13 173.113 0.300 . 1 . . . . 143 THR C . 10336 1 1774 . 1 1 143 143 THR CA C 13 58.849 0.300 . 1 . . . . 143 THR CA . 10336 1 1775 . 1 1 143 143 THR CB C 13 72.158 0.300 . 1 . . . . 143 THR CB . 10336 1 1776 . 1 1 143 143 THR CG2 C 13 23.206 0.300 . 1 . . . . 143 THR CG2 . 10336 1 1777 . 1 1 143 143 THR N N 15 101.883 0.300 . 1 . . . . 143 THR N . 10336 1 1778 . 1 1 144 144 THR H H 1 8.533 0.030 . 1 . . . . 144 THR H . 10336 1 1779 . 1 1 144 144 THR HA H 1 4.983 0.030 . 1 . . . . 144 THR HA . 10336 1 1780 . 1 1 144 144 THR HB H 1 3.523 0.030 . 1 . . . . 144 THR HB . 10336 1 1781 . 1 1 144 144 THR HG21 H 1 1.107 0.030 . 1 . . . . 144 THR HG2 . 10336 1 1782 . 1 1 144 144 THR HG22 H 1 1.107 0.030 . 1 . . . . 144 THR HG2 . 10336 1 1783 . 1 1 144 144 THR HG23 H 1 1.107 0.030 . 1 . . . . 144 THR HG2 . 10336 1 1784 . 1 1 144 144 THR C C 13 173.726 0.300 . 1 . . . . 144 THR C . 10336 1 1785 . 1 1 144 144 THR CA C 13 60.787 0.300 . 1 . . . . 144 THR CA . 10336 1 1786 . 1 1 144 144 THR CB C 13 70.436 0.300 . 1 . . . . 144 THR CB . 10336 1 1787 . 1 1 144 144 THR CG2 C 13 22.714 0.300 . 1 . . . . 144 THR CG2 . 10336 1 1788 . 1 1 144 144 THR N N 15 119.797 0.300 . 1 . . . . 144 THR N . 10336 1 1789 . 1 1 145 145 ARG H H 1 8.594 0.030 . 1 . . . . 145 ARG H . 10336 1 1790 . 1 1 145 145 ARG HA H 1 5.615 0.030 . 1 . . . . 145 ARG HA . 10336 1 1791 . 1 1 145 145 ARG HB2 H 1 0.860 0.030 . 2 . . . . 145 ARG HB2 . 10336 1 1792 . 1 1 145 145 ARG HB3 H 1 0.827 0.030 . 2 . . . . 145 ARG HB3 . 10336 1 1793 . 1 1 145 145 ARG HD2 H 1 2.018 0.030 . 2 . . . . 145 ARG HD2 . 10336 1 1794 . 1 1 145 145 ARG HD3 H 1 0.755 0.030 . 2 . . . . 145 ARG HD3 . 10336 1 1795 . 1 1 145 145 ARG HE H 1 6.432 0.030 . 1 . . . . 145 ARG HE . 10336 1 1796 . 1 1 145 145 ARG HG2 H 1 0.992 0.030 . 2 . . . . 145 ARG HG2 . 10336 1 1797 . 1 1 145 145 ARG HG3 H 1 1.273 0.030 . 2 . . . . 145 ARG HG3 . 10336 1 1798 . 1 1 145 145 ARG C C 13 173.763 0.300 . 1 . . . . 145 ARG C . 10336 1 1799 . 1 1 145 145 ARG CA C 13 54.281 0.300 . 1 . . . . 145 ARG CA . 10336 1 1800 . 1 1 145 145 ARG CB C 13 34.768 0.300 . 1 . . . . 145 ARG CB . 10336 1 1801 . 1 1 145 145 ARG CD C 13 42.886 0.300 . 1 . . . . 145 ARG CD . 10336 1 1802 . 1 1 145 145 ARG CG C 13 28.126 0.300 . 1 . . . . 145 ARG CG . 10336 1 1803 . 1 1 145 145 ARG N N 15 122.673 0.300 . 1 . . . . 145 ARG N . 10336 1 1804 . 1 1 145 145 ARG NE N 15 86.756 0.300 . 1 . . . . 145 ARG NE . 10336 1 1805 . 1 1 146 146 ILE H H 1 8.906 0.030 . 1 . . . . 146 ILE H . 10336 1 1806 . 1 1 146 146 ILE HA H 1 4.571 0.030 . 1 . . . . 146 ILE HA . 10336 1 1807 . 1 1 146 146 ILE HB H 1 1.763 0.030 . 1 . . . . 146 ILE HB . 10336 1 1808 . 1 1 146 146 ILE HD11 H 1 0.443 0.030 . 1 . . . . 146 ILE HD1 . 10336 1 1809 . 1 1 146 146 ILE HD12 H 1 0.443 0.030 . 1 . . . . 146 ILE HD1 . 10336 1 1810 . 1 1 146 146 ILE HD13 H 1 0.443 0.030 . 1 . . . . 146 ILE HD1 . 10336 1 1811 . 1 1 146 146 ILE HG12 H 1 0.824 0.030 . 2 . . . . 146 ILE HG12 . 10336 1 1812 . 1 1 146 146 ILE HG13 H 1 1.076 0.030 . 2 . . . . 146 ILE HG13 . 10336 1 1813 . 1 1 146 146 ILE HG21 H 1 0.391 0.030 . 1 . . . . 146 ILE HG2 . 10336 1 1814 . 1 1 146 146 ILE HG22 H 1 0.391 0.030 . 1 . . . . 146 ILE HG2 . 10336 1 1815 . 1 1 146 146 ILE HG23 H 1 0.391 0.030 . 1 . . . . 146 ILE HG2 . 10336 1 1816 . 1 1 146 146 ILE C C 13 176.189 0.300 . 1 . . . . 146 ILE C . 10336 1 1817 . 1 1 146 146 ILE CA C 13 58.258 0.300 . 1 . . . . 146 ILE CA . 10336 1 1818 . 1 1 146 146 ILE CB C 13 40.020 0.300 . 1 . . . . 146 ILE CB . 10336 1 1819 . 1 1 146 146 ILE CD1 C 13 13.367 0.300 . 1 . . . . 146 ILE CD1 . 10336 1 1820 . 1 1 146 146 ILE CG1 C 13 26.896 0.300 . 1 . . . . 146 ILE CG1 . 10336 1 1821 . 1 1 146 146 ILE CG2 C 13 16.729 0.300 . 1 . . . . 146 ILE CG2 . 10336 1 1822 . 1 1 146 146 ILE N N 15 119.097 0.300 . 1 . . . . 146 ILE N . 10336 1 1823 . 1 1 147 147 SER H H 1 9.523 0.030 . 1 . . . . 147 SER H . 10336 1 1824 . 1 1 147 147 SER HA H 1 4.758 0.030 . 1 . . . . 147 SER HA . 10336 1 1825 . 1 1 147 147 SER HB2 H 1 4.053 0.030 . 2 . . . . 147 SER HB2 . 10336 1 1826 . 1 1 147 147 SER HB3 H 1 3.602 0.030 . 2 . . . . 147 SER HB3 . 10336 1 1827 . 1 1 147 147 SER C C 13 174.136 0.300 . 1 . . . . 147 SER C . 10336 1 1828 . 1 1 147 147 SER CA C 13 59.237 0.300 . 1 . . . . 147 SER CA . 10336 1 1829 . 1 1 147 147 SER CB C 13 64.172 0.300 . 1 . . . . 147 SER CB . 10336 1 1830 . 1 1 147 147 SER N N 15 122.985 0.300 . 1 . . . . 147 SER N . 10336 1 1831 . 1 1 148 148 TYR H H 1 7.117 0.030 . 1 . . . . 148 TYR H . 10336 1 1832 . 1 1 148 148 TYR HA H 1 5.450 0.030 . 1 . . . . 148 TYR HA . 10336 1 1833 . 1 1 148 148 TYR HB2 H 1 3.357 0.030 . 2 . . . . 148 TYR HB2 . 10336 1 1834 . 1 1 148 148 TYR HB3 H 1 2.333 0.030 . 2 . . . . 148 TYR HB3 . 10336 1 1835 . 1 1 148 148 TYR HD1 H 1 6.725 0.030 . 1 . . . . 148 TYR HD1 . 10336 1 1836 . 1 1 148 148 TYR HD2 H 1 6.725 0.030 . 1 . . . . 148 TYR HD2 . 10336 1 1837 . 1 1 148 148 TYR HE1 H 1 6.453 0.030 . 1 . . . . 148 TYR HE1 . 10336 1 1838 . 1 1 148 148 TYR HE2 H 1 6.453 0.030 . 1 . . . . 148 TYR HE2 . 10336 1 1839 . 1 1 148 148 TYR C C 13 171.858 0.300 . 1 . . . . 148 TYR C . 10336 1 1840 . 1 1 148 148 TYR CA C 13 57.258 0.300 . 1 . . . . 148 TYR CA . 10336 1 1841 . 1 1 148 148 TYR CB C 13 40.163 0.300 . 1 . . . . 148 TYR CB . 10336 1 1842 . 1 1 148 148 TYR CD1 C 13 132.180 0.300 . 1 . . . . 148 TYR CD1 . 10336 1 1843 . 1 1 148 148 TYR CD2 C 13 132.180 0.300 . 1 . . . . 148 TYR CD2 . 10336 1 1844 . 1 1 148 148 TYR CE1 C 13 117.666 0.300 . 1 . . . . 148 TYR CE1 . 10336 1 1845 . 1 1 148 148 TYR CE2 C 13 117.666 0.300 . 1 . . . . 148 TYR CE2 . 10336 1 1846 . 1 1 148 148 TYR N N 15 120.264 0.300 . 1 . . . . 148 TYR N . 10336 1 1847 . 1 1 149 149 PHE H H 1 7.671 0.030 . 1 . . . . 149 PHE H . 10336 1 1848 . 1 1 149 149 PHE HA H 1 5.147 0.030 . 1 . . . . 149 PHE HA . 10336 1 1849 . 1 1 149 149 PHE HB2 H 1 3.025 0.030 . 2 . . . . 149 PHE HB2 . 10336 1 1850 . 1 1 149 149 PHE HB3 H 1 2.567 0.030 . 2 . . . . 149 PHE HB3 . 10336 1 1851 . 1 1 149 149 PHE HD1 H 1 7.107 0.030 . 1 . . . . 149 PHE HD1 . 10336 1 1852 . 1 1 149 149 PHE HD2 H 1 7.107 0.030 . 1 . . . . 149 PHE HD2 . 10336 1 1853 . 1 1 149 149 PHE HE1 H 1 6.766 0.030 . 1 . . . . 149 PHE HE1 . 10336 1 1854 . 1 1 149 149 PHE HE2 H 1 6.766 0.030 . 1 . . . . 149 PHE HE2 . 10336 1 1855 . 1 1 149 149 PHE HZ H 1 6.985 0.030 . 1 . . . . 149 PHE HZ . 10336 1 1856 . 1 1 149 149 PHE C C 13 172.032 0.300 . 1 . . . . 149 PHE C . 10336 1 1857 . 1 1 149 149 PHE CA C 13 53.217 0.300 . 1 . . . . 149 PHE CA . 10336 1 1858 . 1 1 149 149 PHE CB C 13 42.148 0.300 . 1 . . . . 149 PHE CB . 10336 1 1859 . 1 1 149 149 PHE CD1 C 13 131.319 0.300 . 1 . . . . 149 PHE CD1 . 10336 1 1860 . 1 1 149 149 PHE CD2 C 13 131.319 0.300 . 1 . . . . 149 PHE CD2 . 10336 1 1861 . 1 1 149 149 PHE CE1 C 13 130.089 0.300 . 1 . . . . 149 PHE CE1 . 10336 1 1862 . 1 1 149 149 PHE CE2 C 13 130.089 0.300 . 1 . . . . 149 PHE CE2 . 10336 1 1863 . 1 1 149 149 PHE CZ C 13 128.121 0.300 . 1 . . . . 149 PHE CZ . 10336 1 1864 . 1 1 149 149 PHE N N 15 129.204 0.300 . 1 . . . . 149 PHE N . 10336 1 1865 . 1 1 150 150 THR H H 1 7.976 0.030 . 1 . . . . 150 THR H . 10336 1 1866 . 1 1 150 150 THR HA H 1 3.601 0.030 . 1 . . . . 150 THR HA . 10336 1 1867 . 1 1 150 150 THR HB H 1 3.834 0.030 . 1 . . . . 150 THR HB . 10336 1 1868 . 1 1 150 150 THR HG21 H 1 0.814 0.030 . 1 . . . . 150 THR HG2 . 10336 1 1869 . 1 1 150 150 THR HG22 H 1 0.814 0.030 . 1 . . . . 150 THR HG2 . 10336 1 1870 . 1 1 150 150 THR HG23 H 1 0.814 0.030 . 1 . . . . 150 THR HG2 . 10336 1 1871 . 1 1 150 150 THR C C 13 172.502 0.300 . 1 . . . . 150 THR C . 10336 1 1872 . 1 1 150 150 THR CA C 13 59.736 0.300 . 1 . . . . 150 THR CA . 10336 1 1873 . 1 1 150 150 THR CB C 13 68.715 0.300 . 1 . . . . 150 THR CB . 10336 1 1874 . 1 1 150 150 THR CG2 C 13 18.287 0.300 . 1 . . . . 150 THR CG2 . 10336 1 1875 . 1 1 150 150 THR N N 15 113.266 0.300 . 1 . . . . 150 THR N . 10336 1 1876 . 1 1 151 151 PHE H H 1 8.295 0.030 . 1 . . . . 151 PHE H . 10336 1 1877 . 1 1 151 151 PHE HA H 1 5.190 0.030 . 1 . . . . 151 PHE HA . 10336 1 1878 . 1 1 151 151 PHE HB2 H 1 3.102 0.030 . 2 . . . . 151 PHE HB2 . 10336 1 1879 . 1 1 151 151 PHE HB3 H 1 2.609 0.030 . 2 . . . . 151 PHE HB3 . 10336 1 1880 . 1 1 151 151 PHE HD1 H 1 7.201 0.030 . 1 . . . . 151 PHE HD1 . 10336 1 1881 . 1 1 151 151 PHE HD2 H 1 7.201 0.030 . 1 . . . . 151 PHE HD2 . 10336 1 1882 . 1 1 151 151 PHE HE1 H 1 6.677 0.030 . 1 . . . . 151 PHE HE1 . 10336 1 1883 . 1 1 151 151 PHE HE2 H 1 6.677 0.030 . 1 . . . . 151 PHE HE2 . 10336 1 1884 . 1 1 151 151 PHE HZ H 1 7.110 0.030 . 1 . . . . 151 PHE HZ . 10336 1 1885 . 1 1 151 151 PHE C C 13 172.848 0.300 . 1 . . . . 151 PHE C . 10336 1 1886 . 1 1 151 151 PHE CA C 13 57.237 0.300 . 1 . . . . 151 PHE CA . 10336 1 1887 . 1 1 151 151 PHE CB C 13 45.339 0.300 . 1 . . . . 151 PHE CB . 10336 1 1888 . 1 1 151 151 PHE CD1 C 13 131.442 0.300 . 1 . . . . 151 PHE CD1 . 10336 1 1889 . 1 1 151 151 PHE CD2 C 13 131.442 0.300 . 1 . . . . 151 PHE CD2 . 10336 1 1890 . 1 1 151 151 PHE CE1 C 13 128.244 0.300 . 1 . . . . 151 PHE CE1 . 10336 1 1891 . 1 1 151 151 PHE CE2 C 13 128.244 0.300 . 1 . . . . 151 PHE CE2 . 10336 1 1892 . 1 1 151 151 PHE CZ C 13 128.490 0.300 . 1 . . . . 151 PHE CZ . 10336 1 1893 . 1 1 151 151 PHE N N 15 116.765 0.300 . 1 . . . . 151 PHE N . 10336 1 1894 . 1 1 152 152 ILE H H 1 8.799 0.030 . 1 . . . . 152 ILE H . 10336 1 1895 . 1 1 152 152 ILE HA H 1 4.985 0.030 . 1 . . . . 152 ILE HA . 10336 1 1896 . 1 1 152 152 ILE HB H 1 1.993 0.030 . 1 . . . . 152 ILE HB . 10336 1 1897 . 1 1 152 152 ILE HD11 H 1 0.714 0.030 . 1 . . . . 152 ILE HD1 . 10336 1 1898 . 1 1 152 152 ILE HD12 H 1 0.714 0.030 . 1 . . . . 152 ILE HD1 . 10336 1 1899 . 1 1 152 152 ILE HD13 H 1 0.714 0.030 . 1 . . . . 152 ILE HD1 . 10336 1 1900 . 1 1 152 152 ILE HG12 H 1 1.072 0.030 . 2 . . . . 152 ILE HG12 . 10336 1 1901 . 1 1 152 152 ILE HG13 H 1 1.289 0.030 . 2 . . . . 152 ILE HG13 . 10336 1 1902 . 1 1 152 152 ILE HG21 H 1 0.753 0.030 . 1 . . . . 152 ILE HG2 . 10336 1 1903 . 1 1 152 152 ILE HG22 H 1 0.753 0.030 . 1 . . . . 152 ILE HG2 . 10336 1 1904 . 1 1 152 152 ILE HG23 H 1 0.753 0.030 . 1 . . . . 152 ILE HG2 . 10336 1 1905 . 1 1 152 152 ILE C C 13 176.718 0.300 . 1 . . . . 152 ILE C . 10336 1 1906 . 1 1 152 152 ILE CA C 13 58.401 0.300 . 1 . . . . 152 ILE CA . 10336 1 1907 . 1 1 152 152 ILE CB C 13 38.870 0.300 . 1 . . . . 152 ILE CB . 10336 1 1908 . 1 1 152 152 ILE CD1 C 13 12.405 0.300 . 1 . . . . 152 ILE CD1 . 10336 1 1909 . 1 1 152 152 ILE CG1 C 13 28.003 0.300 . 1 . . . . 152 ILE CG1 . 10336 1 1910 . 1 1 152 152 ILE CG2 C 13 18.532 0.300 . 1 . . . . 152 ILE CG2 . 10336 1 1911 . 1 1 152 152 ILE N N 15 121.663 0.300 . 1 . . . . 152 ILE N . 10336 1 1912 . 1 1 153 153 GLY H H 1 9.203 0.030 . 1 . . . . 153 GLY H . 10336 1 1913 . 1 1 153 153 GLY HA2 H 1 5.150 0.030 . 2 . . . . 153 GLY HA2 . 10336 1 1914 . 1 1 153 153 GLY HA3 H 1 3.817 0.030 . 2 . . . . 153 GLY HA3 . 10336 1 1915 . 1 1 153 153 GLY C C 13 171.248 0.300 . 1 . . . . 153 GLY C . 10336 1 1916 . 1 1 153 153 GLY CA C 13 46.919 0.300 . 1 . . . . 153 GLY CA . 10336 1 1917 . 1 1 153 153 GLY N N 15 114.071 0.300 . 1 . . . . 153 GLY N . 10336 1 1918 . 1 1 154 154 THR H H 1 8.748 0.030 . 1 . . . . 154 THR H . 10336 1 1919 . 1 1 154 154 THR HA H 1 5.082 0.030 . 1 . . . . 154 THR HA . 10336 1 1920 . 1 1 154 154 THR HB H 1 4.225 0.030 . 1 . . . . 154 THR HB . 10336 1 1921 . 1 1 154 154 THR HG21 H 1 1.213 0.030 . 1 . . . . 154 THR HG2 . 10336 1 1922 . 1 1 154 154 THR HG22 H 1 1.213 0.030 . 1 . . . . 154 THR HG2 . 10336 1 1923 . 1 1 154 154 THR HG23 H 1 1.213 0.030 . 1 . . . . 154 THR HG2 . 10336 1 1924 . 1 1 154 154 THR C C 13 170.453 0.300 . 1 . . . . 154 THR C . 10336 1 1925 . 1 1 154 154 THR CA C 13 58.875 0.300 . 1 . . . . 154 THR CA . 10336 1 1926 . 1 1 154 154 THR CB C 13 71.420 0.300 . 1 . . . . 154 THR CB . 10336 1 1927 . 1 1 154 154 THR CG2 C 13 20.750 0.300 . 1 . . . . 154 THR CG2 . 10336 1 1928 . 1 1 154 154 THR N N 15 118.242 0.300 . 1 . . . . 154 THR N . 10336 1 1929 . 1 1 155 155 PRO HA H 1 4.396 0.030 . 1 . . . . 155 PRO HA . 10336 1 1930 . 1 1 155 155 PRO HB2 H 1 1.771 0.030 . 2 . . . . 155 PRO HB2 . 10336 1 1931 . 1 1 155 155 PRO HB3 H 1 1.625 0.030 . 2 . . . . 155 PRO HB3 . 10336 1 1932 . 1 1 155 155 PRO HD2 H 1 3.850 0.030 . 2 . . . . 155 PRO HD2 . 10336 1 1933 . 1 1 155 155 PRO HD3 H 1 3.343 0.030 . 2 . . . . 155 PRO HD3 . 10336 1 1934 . 1 1 155 155 PRO HG2 H 1 1.823 0.030 . 2 . . . . 155 PRO HG2 . 10336 1 1935 . 1 1 155 155 PRO HG3 H 1 1.306 0.030 . 2 . . . . 155 PRO HG3 . 10336 1 1936 . 1 1 155 155 PRO C C 13 176.183 0.300 . 1 . . . . 155 PRO C . 10336 1 1937 . 1 1 155 155 PRO CA C 13 62.906 0.300 . 1 . . . . 155 PRO CA . 10336 1 1938 . 1 1 155 155 PRO CB C 13 31.324 0.300 . 1 . . . . 155 PRO CB . 10336 1 1939 . 1 1 155 155 PRO CD C 13 51.126 0.300 . 1 . . . . 155 PRO CD . 10336 1 1940 . 1 1 155 155 PRO CG C 13 27.679 0.300 . 1 . . . . 155 PRO CG . 10336 1 1941 . 1 1 156 156 VAL H H 1 8.223 0.030 . 1 . . . . 156 VAL H . 10336 1 1942 . 1 1 156 156 VAL HA H 1 3.502 0.030 . 1 . . . . 156 VAL HA . 10336 1 1943 . 1 1 156 156 VAL HB H 1 1.705 0.030 . 1 . . . . 156 VAL HB . 10336 1 1944 . 1 1 156 156 VAL HG11 H 1 0.888 0.030 . 1 . . . . 156 VAL HG1 . 10336 1 1945 . 1 1 156 156 VAL HG12 H 1 0.888 0.030 . 1 . . . . 156 VAL HG1 . 10336 1 1946 . 1 1 156 156 VAL HG13 H 1 0.888 0.030 . 1 . . . . 156 VAL HG1 . 10336 1 1947 . 1 1 156 156 VAL HG21 H 1 0.810 0.030 . 1 . . . . 156 VAL HG2 . 10336 1 1948 . 1 1 156 156 VAL HG22 H 1 0.810 0.030 . 1 . . . . 156 VAL HG2 . 10336 1 1949 . 1 1 156 156 VAL HG23 H 1 0.810 0.030 . 1 . . . . 156 VAL HG2 . 10336 1 1950 . 1 1 156 156 VAL C C 13 176.696 0.300 . 1 . . . . 156 VAL C . 10336 1 1951 . 1 1 156 156 VAL CA C 13 65.803 0.300 . 1 . . . . 156 VAL CA . 10336 1 1952 . 1 1 156 156 VAL CB C 13 32.308 0.300 . 1 . . . . 156 VAL CB . 10336 1 1953 . 1 1 156 156 VAL CG1 C 13 21.238 0.300 . 2 . . . . 156 VAL CG1 . 10336 1 1954 . 1 1 156 156 VAL CG2 C 13 23.537 0.300 . 2 . . . . 156 VAL CG2 . 10336 1 1955 . 1 1 156 156 VAL N N 15 123.550 0.300 . 1 . . . . 156 VAL N . 10336 1 1956 . 1 1 157 157 GLN H H 1 8.538 0.030 . 1 . . . . 157 GLN H . 10336 1 1957 . 1 1 157 157 GLN HA H 1 4.338 0.030 . 1 . . . . 157 GLN HA . 10336 1 1958 . 1 1 157 157 GLN HB2 H 1 1.918 0.030 . 2 . . . . 157 GLN HB2 . 10336 1 1959 . 1 1 157 157 GLN HB3 H 1 2.020 0.030 . 2 . . . . 157 GLN HB3 . 10336 1 1960 . 1 1 157 157 GLN HE21 H 1 7.526 0.030 . 2 . . . . 157 GLN HE21 . 10336 1 1961 . 1 1 157 157 GLN HE22 H 1 6.877 0.030 . 2 . . . . 157 GLN HE22 . 10336 1 1962 . 1 1 157 157 GLN HG2 H 1 2.311 0.030 . 1 . . . . 157 GLN HG2 . 10336 1 1963 . 1 1 157 157 GLN HG3 H 1 2.311 0.030 . 1 . . . . 157 GLN HG3 . 10336 1 1964 . 1 1 157 157 GLN C C 13 174.892 0.300 . 1 . . . . 157 GLN C . 10336 1 1965 . 1 1 157 157 GLN CA C 13 55.185 0.300 . 1 . . . . 157 GLN CA . 10336 1 1966 . 1 1 157 157 GLN CB C 13 29.478 0.300 . 1 . . . . 157 GLN CB . 10336 1 1967 . 1 1 157 157 GLN CG C 13 33.751 0.300 . 1 . . . . 157 GLN CG . 10336 1 1968 . 1 1 157 157 GLN N N 15 121.034 0.300 . 1 . . . . 157 GLN N . 10336 1 1969 . 1 1 157 157 GLN NE2 N 15 112.178 0.300 . 1 . . . . 157 GLN NE2 . 10336 1 1970 . 1 1 158 158 ALA H H 1 8.282 0.030 . 1 . . . . 158 ALA H . 10336 1 1971 . 1 1 158 158 ALA HA H 1 4.307 0.030 . 1 . . . . 158 ALA HA . 10336 1 1972 . 1 1 158 158 ALA HB1 H 1 1.374 0.030 . 1 . . . . 158 ALA HB . 10336 1 1973 . 1 1 158 158 ALA HB2 H 1 1.374 0.030 . 1 . . . . 158 ALA HB . 10336 1 1974 . 1 1 158 158 ALA HB3 H 1 1.374 0.030 . 1 . . . . 158 ALA HB . 10336 1 1975 . 1 1 158 158 ALA C C 13 177.929 0.300 . 1 . . . . 158 ALA C . 10336 1 1976 . 1 1 158 158 ALA CA C 13 52.609 0.300 . 1 . . . . 158 ALA CA . 10336 1 1977 . 1 1 158 158 ALA CB C 13 19.224 0.300 . 1 . . . . 158 ALA CB . 10336 1 1978 . 1 1 158 158 ALA N N 15 126.484 0.300 . 1 . . . . 158 ALA N . 10336 1 1979 . 1 1 159 159 THR H H 1 8.204 0.030 . 1 . . . . 159 THR H . 10336 1 1980 . 1 1 159 159 THR HA H 1 4.302 0.030 . 1 . . . . 159 THR HA . 10336 1 1981 . 1 1 159 159 THR HB H 1 4.185 0.030 . 1 . . . . 159 THR HB . 10336 1 1982 . 1 1 159 159 THR HG21 H 1 1.196 0.030 . 1 . . . . 159 THR HG2 . 10336 1 1983 . 1 1 159 159 THR HG22 H 1 1.196 0.030 . 1 . . . . 159 THR HG2 . 10336 1 1984 . 1 1 159 159 THR HG23 H 1 1.196 0.030 . 1 . . . . 159 THR HG2 . 10336 1 1985 . 1 1 159 159 THR C C 13 174.136 0.300 . 1 . . . . 159 THR C . 10336 1 1986 . 1 1 159 159 THR CA C 13 61.990 0.300 . 1 . . . . 159 THR CA . 10336 1 1987 . 1 1 159 159 THR CB C 13 69.944 0.300 . 1 . . . . 159 THR CB . 10336 1 1988 . 1 1 159 159 THR CG2 C 13 21.607 0.300 . 1 . . . . 159 THR CG2 . 10336 1 1989 . 1 1 159 159 THR N N 15 113.655 0.300 . 1 . . . . 159 THR N . 10336 1 1990 . 1 1 160 160 ASN H H 1 8.534 0.030 . 1 . . . . 160 ASN H . 10336 1 1991 . 1 1 160 160 ASN HA H 1 4.731 0.030 . 1 . . . . 160 ASN HA . 10336 1 1992 . 1 1 160 160 ASN HB2 H 1 2.778 0.030 . 2 . . . . 160 ASN HB2 . 10336 1 1993 . 1 1 160 160 ASN HB3 H 1 2.873 0.030 . 2 . . . . 160 ASN HB3 . 10336 1 1994 . 1 1 160 160 ASN HD21 H 1 7.629 0.030 . 2 . . . . 160 ASN HD21 . 10336 1 1995 . 1 1 160 160 ASN HD22 H 1 6.907 0.030 . 2 . . . . 160 ASN HD22 . 10336 1 1996 . 1 1 160 160 ASN C C 13 175.454 0.300 . 1 . . . . 160 ASN C . 10336 1 1997 . 1 1 160 160 ASN CA C 13 53.323 0.300 . 1 . . . . 160 ASN CA . 10336 1 1998 . 1 1 160 160 ASN CB C 13 38.679 0.300 . 1 . . . . 160 ASN CB . 10336 1 1999 . 1 1 160 160 ASN N N 15 120.963 0.300 . 1 . . . . 160 ASN N . 10336 1 2000 . 1 1 160 160 ASN ND2 N 15 112.800 0.300 . 1 . . . . 160 ASN ND2 . 10336 1 2001 . 1 1 161 161 MET H H 1 8.425 0.030 . 1 . . . . 161 MET H . 10336 1 2002 . 1 1 161 161 MET HA H 1 4.432 0.030 . 1 . . . . 161 MET HA . 10336 1 2003 . 1 1 161 161 MET HB2 H 1 1.982 0.030 . 2 . . . . 161 MET HB2 . 10336 1 2004 . 1 1 161 161 MET HB3 H 1 2.105 0.030 . 2 . . . . 161 MET HB3 . 10336 1 2005 . 1 1 161 161 MET HE1 H 1 2.035 0.030 . 1 . . . . 161 MET HE . 10336 1 2006 . 1 1 161 161 MET HE2 H 1 2.035 0.030 . 1 . . . . 161 MET HE . 10336 1 2007 . 1 1 161 161 MET HE3 H 1 2.035 0.030 . 1 . . . . 161 MET HE . 10336 1 2008 . 1 1 161 161 MET HG2 H 1 2.592 0.030 . 2 . . . . 161 MET HG2 . 10336 1 2009 . 1 1 161 161 MET HG3 H 1 2.497 0.030 . 2 . . . . 161 MET HG3 . 10336 1 2010 . 1 1 161 161 MET C C 13 176.364 0.300 . 1 . . . . 161 MET C . 10336 1 2011 . 1 1 161 161 MET CA C 13 55.933 0.300 . 1 . . . . 161 MET CA . 10336 1 2012 . 1 1 161 161 MET CB C 13 32.308 0.300 . 1 . . . . 161 MET CB . 10336 1 2013 . 1 1 161 161 MET CE C 13 16.934 0.300 . 1 . . . . 161 MET CE . 10336 1 2014 . 1 1 161 161 MET CG C 13 32.185 0.300 . 1 . . . . 161 MET CG . 10336 1 2015 . 1 1 161 161 MET N N 15 121.041 0.300 . 1 . . . . 161 MET N . 10336 1 2016 . 1 1 162 162 ASN H H 1 8.408 0.030 . 1 . . . . 162 ASN H . 10336 1 2017 . 1 1 162 162 ASN HA H 1 4.603 0.030 . 1 . . . . 162 ASN HA . 10336 1 2018 . 1 1 162 162 ASN HB2 H 1 2.686 0.030 . 2 . . . . 162 ASN HB2 . 10336 1 2019 . 1 1 162 162 ASN HB3 H 1 2.746 0.030 . 2 . . . . 162 ASN HB3 . 10336 1 2020 . 1 1 162 162 ASN HD21 H 1 7.577 0.030 . 2 . . . . 162 ASN HD21 . 10336 1 2021 . 1 1 162 162 ASN HD22 H 1 6.904 0.030 . 2 . . . . 162 ASN HD22 . 10336 1 2022 . 1 1 162 162 ASN C C 13 174.975 0.300 . 1 . . . . 162 ASN C . 10336 1 2023 . 1 1 162 162 ASN CA C 13 53.710 0.300 . 1 . . . . 162 ASN CA . 10336 1 2024 . 1 1 162 162 ASN CB C 13 38.871 0.300 . 1 . . . . 162 ASN CB . 10336 1 2025 . 1 1 162 162 ASN N N 15 118.871 0.300 . 1 . . . . 162 ASN N . 10336 1 2026 . 1 1 162 162 ASN ND2 N 15 113.113 0.300 . 1 . . . . 162 ASN ND2 . 10336 1 2027 . 1 1 163 163 ASP H H 1 8.103 0.030 . 1 . . . . 163 ASP H . 10336 1 2028 . 1 1 163 163 ASP HA H 1 4.518 0.030 . 1 . . . . 163 ASP HA . 10336 1 2029 . 1 1 163 163 ASP HB2 H 1 2.515 0.030 . 2 . . . . 163 ASP HB2 . 10336 1 2030 . 1 1 163 163 ASP HB3 H 1 2.587 0.030 . 2 . . . . 163 ASP HB3 . 10336 1 2031 . 1 1 163 163 ASP C C 13 175.960 0.300 . 1 . . . . 163 ASP C . 10336 1 2032 . 1 1 163 163 ASP CA C 13 54.403 0.300 . 1 . . . . 163 ASP CA . 10336 1 2033 . 1 1 163 163 ASP CB C 13 41.041 0.300 . 1 . . . . 163 ASP CB . 10336 1 2034 . 1 1 163 163 ASP N N 15 120.108 0.300 . 1 . . . . 163 ASP N . 10336 1 2035 . 1 1 164 164 PHE H H 1 8.026 0.030 . 1 . . . . 164 PHE H . 10336 1 2036 . 1 1 164 164 PHE HA H 1 4.546 0.030 . 1 . . . . 164 PHE HA . 10336 1 2037 . 1 1 164 164 PHE HB2 H 1 3.029 0.030 . 2 . . . . 164 PHE HB2 . 10336 1 2038 . 1 1 164 164 PHE HB3 H 1 3.138 0.030 . 2 . . . . 164 PHE HB3 . 10336 1 2039 . 1 1 164 164 PHE C C 13 175.766 0.300 . 1 . . . . 164 PHE C . 10336 1 2040 . 1 1 164 164 PHE CA C 13 57.972 0.300 . 1 . . . . 164 PHE CA . 10336 1 2041 . 1 1 164 164 PHE CB C 13 39.196 0.300 . 1 . . . . 164 PHE CB . 10336 1 2042 . 1 1 164 164 PHE N N 15 120.159 0.300 . 1 . . . . 164 PHE N . 10336 1 2043 . 1 1 165 165 LYS H H 1 8.121 0.030 . 1 . . . . 165 LYS H . 10336 1 2044 . 1 1 165 165 LYS HA H 1 4.307 0.030 . 1 . . . . 165 LYS HA . 10336 1 2045 . 1 1 165 165 LYS HB2 H 1 1.709 0.030 . 2 . . . . 165 LYS HB2 . 10336 1 2046 . 1 1 165 165 LYS HB3 H 1 1.797 0.030 . 2 . . . . 165 LYS HB3 . 10336 1 2047 . 1 1 165 165 LYS HD2 H 1 1.640 0.030 . 1 . . . . 165 LYS HD2 . 10336 1 2048 . 1 1 165 165 LYS HD3 H 1 1.640 0.030 . 1 . . . . 165 LYS HD3 . 10336 1 2049 . 1 1 165 165 LYS HE2 H 1 2.969 0.030 . 1 . . . . 165 LYS HE2 . 10336 1 2050 . 1 1 165 165 LYS HE3 H 1 2.969 0.030 . 1 . . . . 165 LYS HE3 . 10336 1 2051 . 1 1 165 165 LYS HG2 H 1 1.361 0.030 . 1 . . . . 165 LYS HG2 . 10336 1 2052 . 1 1 165 165 LYS HG3 H 1 1.361 0.030 . 1 . . . . 165 LYS HG3 . 10336 1 2053 . 1 1 165 165 LYS C C 13 176.258 0.300 . 1 . . . . 165 LYS C . 10336 1 2054 . 1 1 165 165 LYS CA C 13 56.157 0.300 . 1 . . . . 165 LYS CA . 10336 1 2055 . 1 1 165 165 LYS CB C 13 33.046 0.300 . 1 . . . . 165 LYS CB . 10336 1 2056 . 1 1 165 165 LYS CD C 13 28.987 0.300 . 1 . . . . 165 LYS CD . 10336 1 2057 . 1 1 165 165 LYS CE C 13 42.148 0.300 . 1 . . . . 165 LYS CE . 10336 1 2058 . 1 1 165 165 LYS CG C 13 24.642 0.300 . 1 . . . . 165 LYS CG . 10336 1 2059 . 1 1 165 165 LYS N N 15 122.752 0.300 . 1 . . . . 165 LYS N . 10336 1 2060 . 1 1 166 166 SER H H 1 8.210 0.030 . 1 . . . . 166 SER H . 10336 1 2061 . 1 1 166 166 SER HA H 1 4.453 0.030 . 1 . . . . 166 SER HA . 10336 1 2062 . 1 1 166 166 SER HB2 H 1 3.846 0.030 . 1 . . . . 166 SER HB2 . 10336 1 2063 . 1 1 166 166 SER HB3 H 1 3.846 0.030 . 1 . . . . 166 SER HB3 . 10336 1 2064 . 1 1 166 166 SER C C 13 174.532 0.300 . 1 . . . . 166 SER C . 10336 1 2065 . 1 1 166 166 SER CA C 13 58.319 0.300 . 1 . . . . 166 SER CA . 10336 1 2066 . 1 1 166 166 SER CB C 13 63.918 0.300 . 1 . . . . 166 SER CB . 10336 1 2067 . 1 1 166 166 SER N N 15 116.687 0.300 . 1 . . . . 166 SER N . 10336 1 2068 . 1 1 167 167 GLY H H 1 8.216 0.030 . 1 . . . . 167 GLY H . 10336 1 2069 . 1 1 167 167 GLY HA2 H 1 4.080 0.030 . 2 . . . . 167 GLY HA2 . 10336 1 2070 . 1 1 167 167 GLY HA3 H 1 4.139 0.030 . 2 . . . . 167 GLY HA3 . 10336 1 2071 . 1 1 167 167 GLY C C 13 171.755 0.300 . 1 . . . . 167 GLY C . 10336 1 2072 . 1 1 167 167 GLY CA C 13 44.683 0.300 . 1 . . . . 167 GLY CA . 10336 1 2073 . 1 1 167 167 GLY N N 15 110.622 0.300 . 1 . . . . 167 GLY N . 10336 1 2074 . 1 1 168 168 PRO HA H 1 4.468 0.030 . 1 . . . . 168 PRO HA . 10336 1 2075 . 1 1 168 168 PRO HB2 H 1 2.272 0.030 . 2 . . . . 168 PRO HB2 . 10336 1 2076 . 1 1 168 168 PRO HB3 H 1 1.963 0.030 . 2 . . . . 168 PRO HB3 . 10336 1 2077 . 1 1 168 168 PRO HD2 H 1 3.608 0.030 . 1 . . . . 168 PRO HD2 . 10336 1 2078 . 1 1 168 168 PRO HD3 H 1 3.608 0.030 . 1 . . . . 168 PRO HD3 . 10336 1 2079 . 1 1 168 168 PRO HG2 H 1 1.995 0.030 . 2 . . . . 168 PRO HG2 . 10336 1 2080 . 1 1 168 168 PRO HG3 H 1 1.730 0.030 . 2 . . . . 168 PRO HG3 . 10336 1 2081 . 1 1 168 168 PRO C C 13 177.394 0.300 . 1 . . . . 168 PRO C . 10336 1 2082 . 1 1 168 168 PRO CA C 13 63.231 0.300 . 1 . . . . 168 PRO CA . 10336 1 2083 . 1 1 168 168 PRO CB C 13 32.230 0.300 . 1 . . . . 168 PRO CB . 10336 1 2084 . 1 1 168 168 PRO CD C 13 49.773 0.300 . 1 . . . . 168 PRO CD . 10336 1 2085 . 1 1 168 168 PRO CG C 13 27.142 0.300 . 1 . . . . 168 PRO CG . 10336 1 2086 . 1 1 169 169 SER H H 1 8.528 0.030 . 1 . . . . 169 SER H . 10336 1 2087 . 1 1 169 169 SER HA H 1 4.493 0.030 . 1 . . . . 169 SER HA . 10336 1 2088 . 1 1 169 169 SER HB2 H 1 3.896 0.030 . 1 . . . . 169 SER HB2 . 10336 1 2089 . 1 1 169 169 SER HB3 H 1 3.896 0.030 . 1 . . . . 169 SER HB3 . 10336 1 2090 . 1 1 169 169 SER C C 13 174.718 0.300 . 1 . . . . 169 SER C . 10336 1 2091 . 1 1 169 169 SER CA C 13 58.401 0.300 . 1 . . . . 169 SER CA . 10336 1 2092 . 1 1 169 169 SER CB C 13 63.932 0.300 . 1 . . . . 169 SER CB . 10336 1 2093 . 1 1 169 169 SER N N 15 116.402 0.300 . 1 . . . . 169 SER N . 10336 1 2094 . 1 1 170 170 SER H H 1 8.324 0.030 . 1 . . . . 170 SER H . 10336 1 2095 . 1 1 170 170 SER HA H 1 4.493 0.030 . 1 . . . . 170 SER HA . 10336 1 2096 . 1 1 170 170 SER HB2 H 1 3.883 0.030 . 1 . . . . 170 SER HB2 . 10336 1 2097 . 1 1 170 170 SER HB3 H 1 3.883 0.030 . 1 . . . . 170 SER HB3 . 10336 1 2098 . 1 1 170 170 SER C C 13 173.950 0.300 . 1 . . . . 170 SER C . 10336 1 2099 . 1 1 170 170 SER CA C 13 58.367 0.300 . 1 . . . . 170 SER CA . 10336 1 2100 . 1 1 170 170 SER CB C 13 63.968 0.300 . 1 . . . . 170 SER CB . 10336 1 2101 . 1 1 170 170 SER N N 15 117.775 0.300 . 1 . . . . 170 SER N . 10336 1 2102 . 1 1 171 171 GLY H H 1 8.052 0.030 . 1 . . . . 171 GLY H . 10336 1 2103 . 1 1 171 171 GLY HA2 H 1 3.777 0.030 . 2 . . . . 171 GLY HA2 . 10336 1 2104 . 1 1 171 171 GLY HA3 H 1 3.738 0.030 . 2 . . . . 171 GLY HA3 . 10336 1 2105 . 1 1 171 171 GLY C C 13 179.014 0.300 . 1 . . . . 171 GLY C . 10336 1 2106 . 1 1 171 171 GLY CA C 13 46.236 0.300 . 1 . . . . 171 GLY CA . 10336 1 2107 . 1 1 171 171 GLY N N 15 116.842 0.300 . 1 . . . . 171 GLY N . 10336 1 stop_ save_