data_17389 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17389 _Entry.Title ; Solution NMR Structure of the serine-rich domain of hEF1( Enhancer of filamentation 1) from homo sapiens, Northeast Structural Genomics Consortium Target HR5554A ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-12-31 _Entry.Accession_date 2010-12-31 _Entry.Last_release_date 2011-01-31 _Entry.Original_release_date 2011-01-31 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'SOLUTION NMR' _Entry.Details 'hEF1, also named CRK-associated substrate-related protein CAS-L CasL Cas scaffolding protein family member 2 Neural precursor cell expressed developmentally down-regulated protein 9 NEDD-9 Renal carcinoma antigen NY-REN-12 p105Contains Enhancer of filamentation 1 )' _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 Gaohua Liu . . . 17389 2 Rong Xiao . . . 17389 3 Yuanpeng Huang . J. . 17389 4 Daya Patel . . . 17389 5 Colleen Ciccosanti . T. . 17389 6 Thomas Acton . B. . 17389 7 Saichu Tong . . . 17389 8 John Everett . T. . 17389 9 Gaetano Montelione . T. . 17389 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 'PSI, Protein Structure Initiative' 'Northeast Structural Genomics Consortium' . 17389 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG)' . 17389 'Protein NMR' . 17389 'Protein Structure Initiative' . 17389 PSI-2 . 17389 'Structural Genomics' . 17389 'Target HR5554A' . 17389 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17389 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 569 17389 '15N chemical shifts' 162 17389 '1H chemical shifts' 1181 17389 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 . . 2011-01-31 2010-12-31 original author . 17389 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2L81 'BMRB Entry Tracking System' 17389 stop_ save_ ############### # Citations # ############### save_citations _Citation.Sf_category citations _Citation.Sf_framecode citations _Citation.Entry_ID 17389 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Northeast Structural Genomics Consortium Target HR5554A' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'To be published' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _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 . _Citation.Page_last . _Citation.Year . _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 Gaohua Liu . . . 17389 1 2 Rong Xiao . . . 17389 1 3 Yuanpeng Huang . J. . 17389 1 4 Daya Patel . . . 17389 1 5 Colleen Ciccosanti . . . 17389 1 6 Saichu Tong . . . 17389 1 7 Thomas Acton . B. . 17389 1 8 John Everett . T. . 17389 1 9 Gaetano Montelione . . . 17389 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID hef1 17389 1 serine-rich 17389 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17389 _Assembly.ID 1 _Assembly.Name HR5554A _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 HR5554A 1 $HR5554A A . yes native no no . . . 17389 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_HR5554A _Entity.Sf_category entity _Entity.Sf_framecode HR5554A _Entity.Entry_ID 17389 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name HR5554A _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 ; MGHHHHHHSHMDKRLFLDPD TAIERLQRLQQALEMGVSSL MALVTTDWRCYGYMERHINE IRTAVDKVELFLKEYLHFVK GAVANAACLPELILHNKMKR ELQRVEDSHQILSQTSHDLN ECSWSLNILAINKPQNKCDD LDRFVMVAKTVPDDAKQLTT TINTNAEALFRPGPGS ; _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 176 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 20238.305 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2L81 . "Solution Nmr Structure Of The Serine-Rich Domain Of Hef1 (Enhancer Of Filamentation 1) From Homo Sapiens, Northeast Structural " . . . . . 100.00 176 100.00 100.00 4.82e-128 . . . . 17389 1 2 no DBJ BAF85371 . "unnamed protein product [Homo sapiens]" . . . . . 93.75 834 100.00 100.00 2.40e-111 . . . . 17389 1 3 no DBJ BAI46717 . "neural precursor cell expressed, developmentally down-regulated 9 [synthetic construct]" . . . . . 93.75 834 100.00 100.00 1.52e-111 . . . . 17389 1 4 no GB AAA98770 . "enhancer of filmentation 1 [Homo sapiens]" . . . . . 93.75 834 100.00 100.00 1.52e-111 . . . . 17389 1 5 no GB AAB53696 . "Crk-associated substrate related protein Cas-L [Homo sapiens]" . . . . . 93.75 834 100.00 100.00 1.52e-111 . . . . 17389 1 6 no GB AAH40207 . "Neural precursor cell expressed, developmentally down-regulated 9 [Homo sapiens]" . . . . . 93.75 834 100.00 100.00 1.52e-111 . . . . 17389 1 7 no GB ABM82651 . "neural precursor cell expressed, developmentally down-regulated 9 [synthetic construct]" . . . . . 93.75 834 100.00 100.00 1.52e-111 . . . . 17389 1 8 no GB ABM85828 . "neural precursor cell expressed, developmentally down-regulated 9 [synthetic construct]" . . . . . 93.75 834 100.00 100.00 1.52e-111 . . . . 17389 1 9 no REF NP_001135865 . "enhancer of filamentation 1 isoform 3 [Homo sapiens]" . . . . . 93.75 834 100.00 100.00 2.16e-111 . . . . 17389 1 10 no REF NP_001257962 . "enhancer of filamentation 1 isoform 4 [Homo sapiens]" . . . . . 93.75 685 100.00 100.00 6.82e-113 . . . . 17389 1 11 no REF NP_006394 . "enhancer of filamentation 1 isoform 1 [Homo sapiens]" . . . . . 93.75 834 100.00 100.00 1.52e-111 . . . . 17389 1 12 no REF XP_001088846 . "PREDICTED: enhancer of filamentation 1-like isoform 1 [Macaca mulatta]" . . . . . 93.75 834 98.18 98.79 7.96e-109 . . . . 17389 1 13 no REF XP_001089291 . "PREDICTED: enhancer of filamentation 1-like isoform 4 [Macaca mulatta]" . . . . . 93.75 834 98.18 98.79 4.83e-109 . . . . 17389 1 14 no SP Q14511 . "RecName: Full=Enhancer of filamentation 1; Short=hEF1; AltName: Full=CRK-associated substrate-related protein; Short=CAS-L; Sho" . . . . . 93.75 834 100.00 100.00 1.52e-111 . . . . 17389 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 17389 1 2 . GLY . 17389 1 3 . HIS . 17389 1 4 . HIS . 17389 1 5 . HIS . 17389 1 6 . HIS . 17389 1 7 . HIS . 17389 1 8 . HIS . 17389 1 9 . SER . 17389 1 10 . HIS . 17389 1 11 . MET . 17389 1 12 . ASP . 17389 1 13 . LYS . 17389 1 14 . ARG . 17389 1 15 . LEU . 17389 1 16 . PHE . 17389 1 17 . LEU . 17389 1 18 . ASP . 17389 1 19 . PRO . 17389 1 20 . ASP . 17389 1 21 . THR . 17389 1 22 . ALA . 17389 1 23 . ILE . 17389 1 24 . GLU . 17389 1 25 . ARG . 17389 1 26 . LEU . 17389 1 27 . GLN . 17389 1 28 . ARG . 17389 1 29 . LEU . 17389 1 30 . GLN . 17389 1 31 . GLN . 17389 1 32 . ALA . 17389 1 33 . LEU . 17389 1 34 . GLU . 17389 1 35 . MET . 17389 1 36 . GLY . 17389 1 37 . VAL . 17389 1 38 . SER . 17389 1 39 . SER . 17389 1 40 . LEU . 17389 1 41 . MET . 17389 1 42 . ALA . 17389 1 43 . LEU . 17389 1 44 . VAL . 17389 1 45 . THR . 17389 1 46 . THR . 17389 1 47 . ASP . 17389 1 48 . TRP . 17389 1 49 . ARG . 17389 1 50 . CYS . 17389 1 51 . TYR . 17389 1 52 . GLY . 17389 1 53 . TYR . 17389 1 54 . MET . 17389 1 55 . GLU . 17389 1 56 . ARG . 17389 1 57 . HIS . 17389 1 58 . ILE . 17389 1 59 . ASN . 17389 1 60 . GLU . 17389 1 61 . ILE . 17389 1 62 . ARG . 17389 1 63 . THR . 17389 1 64 . ALA . 17389 1 65 . VAL . 17389 1 66 . ASP . 17389 1 67 . LYS . 17389 1 68 . VAL . 17389 1 69 . GLU . 17389 1 70 . LEU . 17389 1 71 . PHE . 17389 1 72 . LEU . 17389 1 73 . LYS . 17389 1 74 . GLU . 17389 1 75 . TYR . 17389 1 76 . LEU . 17389 1 77 . HIS . 17389 1 78 . PHE . 17389 1 79 . VAL . 17389 1 80 . LYS . 17389 1 81 . GLY . 17389 1 82 . ALA . 17389 1 83 . VAL . 17389 1 84 . ALA . 17389 1 85 . ASN . 17389 1 86 . ALA . 17389 1 87 . ALA . 17389 1 88 . CYS . 17389 1 89 . LEU . 17389 1 90 . PRO . 17389 1 91 . GLU . 17389 1 92 . LEU . 17389 1 93 . ILE . 17389 1 94 . LEU . 17389 1 95 . HIS . 17389 1 96 . ASN . 17389 1 97 . LYS . 17389 1 98 . MET . 17389 1 99 . LYS . 17389 1 100 . ARG . 17389 1 101 . GLU . 17389 1 102 . LEU . 17389 1 103 . GLN . 17389 1 104 . ARG . 17389 1 105 . VAL . 17389 1 106 . GLU . 17389 1 107 . ASP . 17389 1 108 . SER . 17389 1 109 . HIS . 17389 1 110 . GLN . 17389 1 111 . ILE . 17389 1 112 . LEU . 17389 1 113 . SER . 17389 1 114 . GLN . 17389 1 115 . THR . 17389 1 116 . SER . 17389 1 117 . HIS . 17389 1 118 . ASP . 17389 1 119 . LEU . 17389 1 120 . ASN . 17389 1 121 . GLU . 17389 1 122 . CYS . 17389 1 123 . SER . 17389 1 124 . TRP . 17389 1 125 . SER . 17389 1 126 . LEU . 17389 1 127 . ASN . 17389 1 128 . ILE . 17389 1 129 . LEU . 17389 1 130 . ALA . 17389 1 131 . ILE . 17389 1 132 . ASN . 17389 1 133 . LYS . 17389 1 134 . PRO . 17389 1 135 . GLN . 17389 1 136 . ASN . 17389 1 137 . LYS . 17389 1 138 . CYS . 17389 1 139 . ASP . 17389 1 140 . ASP . 17389 1 141 . LEU . 17389 1 142 . ASP . 17389 1 143 . ARG . 17389 1 144 . PHE . 17389 1 145 . VAL . 17389 1 146 . MET . 17389 1 147 . VAL . 17389 1 148 . ALA . 17389 1 149 . LYS . 17389 1 150 . THR . 17389 1 151 . VAL . 17389 1 152 . PRO . 17389 1 153 . ASP . 17389 1 154 . ASP . 17389 1 155 . ALA . 17389 1 156 . LYS . 17389 1 157 . GLN . 17389 1 158 . LEU . 17389 1 159 . THR . 17389 1 160 . THR . 17389 1 161 . THR . 17389 1 162 . ILE . 17389 1 163 . ASN . 17389 1 164 . THR . 17389 1 165 . ASN . 17389 1 166 . ALA . 17389 1 167 . GLU . 17389 1 168 . ALA . 17389 1 169 . LEU . 17389 1 170 . PHE . 17389 1 171 . ARG . 17389 1 172 . PRO . 17389 1 173 . GLY . 17389 1 174 . PRO . 17389 1 175 . GLY . 17389 1 176 . SER . 17389 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 17389 1 . GLY 2 2 17389 1 . HIS 3 3 17389 1 . HIS 4 4 17389 1 . HIS 5 5 17389 1 . HIS 6 6 17389 1 . HIS 7 7 17389 1 . HIS 8 8 17389 1 . SER 9 9 17389 1 . HIS 10 10 17389 1 . MET 11 11 17389 1 . ASP 12 12 17389 1 . LYS 13 13 17389 1 . ARG 14 14 17389 1 . LEU 15 15 17389 1 . PHE 16 16 17389 1 . LEU 17 17 17389 1 . ASP 18 18 17389 1 . PRO 19 19 17389 1 . ASP 20 20 17389 1 . THR 21 21 17389 1 . ALA 22 22 17389 1 . ILE 23 23 17389 1 . GLU 24 24 17389 1 . ARG 25 25 17389 1 . LEU 26 26 17389 1 . GLN 27 27 17389 1 . ARG 28 28 17389 1 . LEU 29 29 17389 1 . GLN 30 30 17389 1 . GLN 31 31 17389 1 . ALA 32 32 17389 1 . LEU 33 33 17389 1 . GLU 34 34 17389 1 . MET 35 35 17389 1 . GLY 36 36 17389 1 . VAL 37 37 17389 1 . SER 38 38 17389 1 . SER 39 39 17389 1 . LEU 40 40 17389 1 . MET 41 41 17389 1 . ALA 42 42 17389 1 . LEU 43 43 17389 1 . VAL 44 44 17389 1 . THR 45 45 17389 1 . THR 46 46 17389 1 . ASP 47 47 17389 1 . TRP 48 48 17389 1 . ARG 49 49 17389 1 . CYS 50 50 17389 1 . TYR 51 51 17389 1 . GLY 52 52 17389 1 . TYR 53 53 17389 1 . MET 54 54 17389 1 . GLU 55 55 17389 1 . ARG 56 56 17389 1 . HIS 57 57 17389 1 . ILE 58 58 17389 1 . ASN 59 59 17389 1 . GLU 60 60 17389 1 . ILE 61 61 17389 1 . ARG 62 62 17389 1 . THR 63 63 17389 1 . ALA 64 64 17389 1 . VAL 65 65 17389 1 . ASP 66 66 17389 1 . LYS 67 67 17389 1 . VAL 68 68 17389 1 . GLU 69 69 17389 1 . LEU 70 70 17389 1 . PHE 71 71 17389 1 . LEU 72 72 17389 1 . LYS 73 73 17389 1 . GLU 74 74 17389 1 . TYR 75 75 17389 1 . LEU 76 76 17389 1 . HIS 77 77 17389 1 . PHE 78 78 17389 1 . VAL 79 79 17389 1 . LYS 80 80 17389 1 . GLY 81 81 17389 1 . ALA 82 82 17389 1 . VAL 83 83 17389 1 . ALA 84 84 17389 1 . ASN 85 85 17389 1 . ALA 86 86 17389 1 . ALA 87 87 17389 1 . CYS 88 88 17389 1 . LEU 89 89 17389 1 . PRO 90 90 17389 1 . GLU 91 91 17389 1 . LEU 92 92 17389 1 . ILE 93 93 17389 1 . LEU 94 94 17389 1 . HIS 95 95 17389 1 . ASN 96 96 17389 1 . LYS 97 97 17389 1 . MET 98 98 17389 1 . LYS 99 99 17389 1 . ARG 100 100 17389 1 . GLU 101 101 17389 1 . LEU 102 102 17389 1 . GLN 103 103 17389 1 . ARG 104 104 17389 1 . VAL 105 105 17389 1 . GLU 106 106 17389 1 . ASP 107 107 17389 1 . SER 108 108 17389 1 . HIS 109 109 17389 1 . GLN 110 110 17389 1 . ILE 111 111 17389 1 . LEU 112 112 17389 1 . SER 113 113 17389 1 . GLN 114 114 17389 1 . THR 115 115 17389 1 . SER 116 116 17389 1 . HIS 117 117 17389 1 . ASP 118 118 17389 1 . LEU 119 119 17389 1 . ASN 120 120 17389 1 . GLU 121 121 17389 1 . CYS 122 122 17389 1 . SER 123 123 17389 1 . TRP 124 124 17389 1 . SER 125 125 17389 1 . LEU 126 126 17389 1 . ASN 127 127 17389 1 . ILE 128 128 17389 1 . LEU 129 129 17389 1 . ALA 130 130 17389 1 . ILE 131 131 17389 1 . ASN 132 132 17389 1 . LYS 133 133 17389 1 . PRO 134 134 17389 1 . GLN 135 135 17389 1 . ASN 136 136 17389 1 . LYS 137 137 17389 1 . CYS 138 138 17389 1 . ASP 139 139 17389 1 . ASP 140 140 17389 1 . LEU 141 141 17389 1 . ASP 142 142 17389 1 . ARG 143 143 17389 1 . PHE 144 144 17389 1 . VAL 145 145 17389 1 . MET 146 146 17389 1 . VAL 147 147 17389 1 . ALA 148 148 17389 1 . LYS 149 149 17389 1 . THR 150 150 17389 1 . VAL 151 151 17389 1 . PRO 152 152 17389 1 . ASP 153 153 17389 1 . ASP 154 154 17389 1 . ALA 155 155 17389 1 . LYS 156 156 17389 1 . GLN 157 157 17389 1 . LEU 158 158 17389 1 . THR 159 159 17389 1 . THR 160 160 17389 1 . THR 161 161 17389 1 . ILE 162 162 17389 1 . ASN 163 163 17389 1 . THR 164 164 17389 1 . ASN 165 165 17389 1 . ALA 166 166 17389 1 . GLU 167 167 17389 1 . ALA 168 168 17389 1 . LEU 169 169 17389 1 . PHE 170 170 17389 1 . ARG 171 171 17389 1 . PRO 172 172 17389 1 . GLY 173 173 17389 1 . PRO 174 174 17389 1 . GLY 175 175 17389 1 . SER 176 176 17389 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 17389 _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 $HR5554A . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 17389 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 17389 _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 $HR5554A . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . 'pET 14-15C' . . . . . . 17389 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_NC _Sample.Sf_category sample _Sample.Sf_framecode sample_NC _Sample.Entry_ID 17389 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.56 mM [U-100% 13C; U-100% 15N] HR5554A, 95% H2O/5% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 HR5554A '[U-100% 13C; U-100% 15N]' 1 $assembly 1 $HR5554A . . 0.56 . . mM . . . . 17389 1 2 H2O 'natural abundance' . . . . . . 95 . . mM . . . . 17389 1 3 D2O 'natural abundance' . . . . . . 5 . . mM . . . . 17389 1 stop_ save_ save_sample_NC5 _Sample.Sf_category sample _Sample.Sf_framecode sample_NC5 _Sample.Entry_ID 17389 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.56 mM [U-5% 13C; U-100% 15N] HR5554A, 95% H2O/5% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 HR5554A '[U-5% 13C; U-100% 15N]' 1 $assembly 1 $HR5554A . . 0.56 . . mM . . . . 17389 2 2 H2O 'natural abundance' . . . . . . 95 . . mM . . . . 17389 2 3 D2O 'natural abundance' . . . . . . 5 . . mM . . . . 17389 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 17389 _Sample_condition_list.ID 1 _Sample_condition_list.Details 'low salt -- 100mM NaCl, 5mM DTT, 0.02% NaN3, 10mM Tris-HCl pH 7.5' loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.5 . pH 17389 1 pressure 1 . atm 17389 1 temperature 298 . K 17389 1 stop_ save_ ############################ # Computer software used # ############################ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 17389 _Software.ID 1 _Software.Name CNS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 17389 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'refinemen,structure solution,geometry optimization' 17389 1 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 17389 _Software.ID 2 _Software.Name CYANA _Software.Version 3.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 17389 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'refinement,geometry optimization,structure solution' 17389 2 stop_ save_ save_AutoStructure _Software.Sf_category software _Software.Sf_framecode AutoStructure _Software.Entry_ID 17389 _Software.ID 3 _Software.Name AutoStruct _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Huang, Tejero, Powers and Montelione' . . 17389 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis,refinement' 17389 3 stop_ save_ save_AutoAssign _Software.Sf_category software _Software.Sf_framecode AutoAssign _Software.Entry_ID 17389 _Software.ID 4 _Software.Name AutoAssign _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Zimmerman, Moseley, Kulikowski and Montelione' . . 17389 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis,chemical shift assignment' 17389 4 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 17389 _Software.ID 5 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 17389 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 17389 5 stop_ save_ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 17389 _Software.ID 6 _Software.Name XEASY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bartels et al.' . . 17389 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis,peak picking,chemical shift assignment' 17389 6 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 17389 _Software.ID 7 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 17389 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17389 7 stop_ save_ save_VNMRJ _Software.Sf_category software _Software.Sf_framecode VNMRJ _Software.Entry_ID 17389 _Software.ID 8 _Software.Name VNMRJ _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 17389 8 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17389 8 stop_ save_ save_TALOS+ _Software.Sf_category software _Software.Sf_framecode TALOS+ _Software.Entry_ID 17389 _Software.ID 9 _Software.Name TALOS+ _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Shen, Cornilescu, Delaglio and Bax' . . 17389 9 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 17389 9 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 17389 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 17389 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17389 _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 . 800 . 1 $citations 17389 1 2 spectrometer_2 Varian INOVA . 600 . 1 $citations 17389 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 17389 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17389 1 2 '2D 1H-13C HSQC 28 ct' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17389 1 3 '3D HNCO' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17389 1 4 '3D CBCA(CO)NH' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17389 1 5 '3D HNCACB' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17389 1 6 '3D 1H-13C arom NOESY' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17389 1 7 '3D simutaneous 13C-aromatic,13C-aliphatic,15N edited 1H-1H NOESY' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17389 1 8 '2D 1H-13C HSQC 28a ct' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17389 1 9 '2D 1H-13C HSQC 42 ct' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17389 1 10 '2D 1H-13C HSQC 42a ct' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17389 1 11 '3D CC(CO)NH TOCSY' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17389 1 12 '3D HBHA(CO)NH' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17389 1 13 '3D HNCA' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17389 1 14 '3D HN(CO)CA' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17389 1 15 '3D (H)CCH TOCSY' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17389 1 16 '2D 1H-15N HSQC' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17389 1 17 '2D 1H-15N HSQC T1' yes . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17389 1 18 '2D 1H-15N HSQC T2' no . . . . . . . . . . 1 $sample_NC isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17389 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 17389 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '2D 1H-15N 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/bmr17389/timedomain_data/b8/NHSQC/ . . . . . . . 17389 1 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/b8/NHSQC/ . . . . . . . 17389 1 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/b8/NHSQC/ . . . . . . . 17389 1 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/b8/NHSQC/ . . . . . . . 17389 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 17389 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '3D 1H-13C arom NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 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/bmr17389/timedomain_data/b8/aronoesy/ . . . . . . . 17389 2 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/b8/aronoesy/ . . . . . . . 17389 2 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/b8/aronoesy/ . . . . . . . 17389 2 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/b8/aronoesy/ . . . . . . . 17389 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 17389 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name '3D simutaneous 13C-aromatic,13C-aliphatic,15N edited 1H-1H NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 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/bmr17389/timedomain_data/b8/simnoesy/ . . . . . . . 17389 3 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/b8/simnoesy/ . . . . . . . 17389 3 ser 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/b8/simnoesy/ . . . . . . . 17389 3 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/b8/simnoesy/ . . . . . . . 17389 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 17389 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name '2D 1H-13C HSQC 28 ct' _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 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _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 fid 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/chsqc_ct28/ . . . . . . . 17389 4 procpar 'processing parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/chsqc_ct28/ . . . . . . . 17389 4 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/chsqc_ct28/ . . . . . . . 17389 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 17389 _NMR_spec_expt.ID 5 _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 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _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 fid 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/HNCO/ . . . . . . . 17389 5 procpar 'processing parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/HNCO/ . . . . . . . 17389 5 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/HNCO/ . . . . . . . 17389 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 17389 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name '3D CBCA(CO)NH' _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 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _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 fid 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/CBCAcoNH/ . . . . . . . 17389 6 procpar 'processing parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/CBCAcoNH/ . . . . . . . 17389 6 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/CBCAcoNH/ . . . . . . . 17389 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 17389 _NMR_spec_expt.ID 7 _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 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _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 fid 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/HNCACB/ . . . . . . . 17389 7 procpar 'processing parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/HNCACB/ . . . . . . . 17389 7 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/HNCACB/ . . . . . . . 17389 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 17389 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name '2D 1H-13C HSQC 28a ct' _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 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _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 fid 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/chsqc_ct28a/ . . . . . . . 17389 8 procpar 'processing parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/chsqc_ct28a/ . . . . . . . 17389 8 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/chsqc_ct28a/ . . . . . . . 17389 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 17389 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name '2D 1H-13C HSQC 42 ct' _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 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _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 fid 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/chsqc_ct42/ . . . . . . . 17389 9 procpar 'processing parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/chsqc_ct42/ . . . . . . . 17389 9 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/chsqc_ct42/ . . . . . . . 17389 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 17389 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name '2D 1H-13C HSQC 42a ct' _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 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _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 fid 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/chsqc_ct42a/ . . . . . . . 17389 10 procpar 'processing parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/chsqc_ct42a/ . . . . . . . 17389 10 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/chsqc_ct42a/ . . . . . . . 17389 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 17389 _NMR_spec_expt.ID 11 _NMR_spec_expt.Name '3D CC(CO)NH 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 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _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 fid 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/CCcoNH_TOCSY/ . . . . . . . 17389 11 procpar 'processing parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/CCcoNH_TOCSY/ . . . . . . . 17389 11 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/CCcoNH_TOCSY/ . . . . . . . 17389 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 17389 _NMR_spec_expt.ID 12 _NMR_spec_expt.Name '3D HBHA(CO)NH' _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 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _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 fid 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/HBHAcoNH/ . . . . . . . 17389 12 procpar 'processing parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/HBHAcoNH/ . . . . . . . 17389 12 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/HBHAcoNH/ . . . . . . . 17389 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 17389 _NMR_spec_expt.ID 13 _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 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _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 fid 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/HNCA/ . . . . . . . 17389 13 procpar 'processing parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/HNCA/ . . . . . . . 17389 13 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/HNCA/ . . . . . . . 17389 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 17389 _NMR_spec_expt.ID 14 _NMR_spec_expt.Name '3D HN(CO)CA' _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 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _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 fid 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/HNcoCA/ . . . . . . . 17389 14 procpar 'processing parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/HNcoCA/ . . . . . . . 17389 14 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/HNcoCA/ . . . . . . . 17389 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 17389 _NMR_spec_expt.ID 15 _NMR_spec_expt.Name '3D (H)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 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _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 fid 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/cchtoc/ . . . . . . . 17389 15 procpar 'processing parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/cchtoc/ . . . . . . . 17389 15 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/cchtoc/ . . . . . . . 17389 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 17389 _NMR_spec_expt.ID 16 _NMR_spec_expt.Name '2D 1H-15N 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 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _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 fid 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/NHSQC/ . . . . . . . 17389 16 procpar 'processing parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/NHSQC/ . . . . . . . 17389 16 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/NHSQC/ . . . . . . . 17389 16 stop_ save_ save_NMR_spectrometer_expt_17 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_17 _NMR_spec_expt.Entry_ID 17389 _NMR_spec_expt.ID 17 _NMR_spec_expt.Name '2D 1H-15N HSQC T1' _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 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _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 fid 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/NHSQC_T1_short/ . . . . . . . 17389 17 procpar 'processing parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/NHSQC_T1_short/ . . . . . . . 17389 17 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/NHSQC_T1_short/ . . . . . . . 17389 17 stop_ save_ save_NMR_spectrometer_expt_18 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_18 _NMR_spec_expt.Entry_ID 17389 _NMR_spec_expt.ID 18 _NMR_spec_expt.Name '2D 1H-15N HSQC T2' _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 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _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 fid 'raw spectral data' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/NHSQC_T2_short/ . . . . . . . 17389 18 procpar 'processing parameters' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/NHSQC_T2_short/ . . . . . . . 17389 18 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/ftp/pub/bmrb/timedomain/bmr17389/timedomain_data/v6/NHSQC_T2_short/ . . . . . . . 17389 18 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 17389 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . 1 $citations . . 1 $citations 17389 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . 1 $citations . . 1 $citations 17389 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . 1 $citations . . 1 $citations 17389 1 P 31 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.404808636 . . . 1 $citations . . 1 $citations 17389 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 17389 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 17389 1 7 '3D simutaneous 13C-aromatic,13C-aliphatic,15N edited 1H-1H NOESY' . . . 17389 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 11 11 MET HA H 1 4.331 0.020 . 1 . . . . 11 MET HA . 17389 1 2 . 1 1 11 11 MET HB2 H 1 1.919 0.020 . 2 . . . . 11 MET HB2 . 17389 1 3 . 1 1 11 11 MET HB3 H 1 2.016 0.020 . 2 . . . . 11 MET HB3 . 17389 1 4 . 1 1 11 11 MET HG2 H 1 2.452 0.020 . 2 . . . . 11 MET HG2 . 17389 1 5 . 1 1 11 11 MET HG3 H 1 2.355 0.020 . 2 . . . . 11 MET HG3 . 17389 1 6 . 1 1 11 11 MET CA C 13 55.849 0.400 . 1 . . . . 11 MET CA . 17389 1 7 . 1 1 11 11 MET CB C 13 32.419 0.400 . 1 . . . . 11 MET CB . 17389 1 8 . 1 1 11 11 MET CG C 13 31.803 0.400 . 1 . . . . 11 MET CG . 17389 1 9 . 1 1 12 12 ASP H H 1 8.272 0.020 . 1 . . . . 12 ASP H . 17389 1 10 . 1 1 12 12 ASP HA H 1 4.551 0.020 . 1 . . . . 12 ASP HA . 17389 1 11 . 1 1 12 12 ASP HB2 H 1 2.731 0.020 . 2 . . . . 12 ASP HB2 . 17389 1 12 . 1 1 12 12 ASP HB3 H 1 2.608 0.020 . 2 . . . . 12 ASP HB3 . 17389 1 13 . 1 1 12 12 ASP CA C 13 54.373 0.400 . 1 . . . . 12 ASP CA . 17389 1 14 . 1 1 12 12 ASP CB C 13 40.835 0.400 . 1 . . . . 12 ASP CB . 17389 1 15 . 1 1 12 12 ASP N N 15 120.829 0.400 . 1 . . . . 12 ASP N . 17389 1 16 . 1 1 13 13 LYS H H 1 8.116 0.020 . 1 . . . . 13 LYS H . 17389 1 17 . 1 1 13 13 LYS HA H 1 4.247 0.020 . 1 . . . . 13 LYS HA . 17389 1 18 . 1 1 13 13 LYS HB2 H 1 1.862 0.020 . 2 . . . . 13 LYS HB2 . 17389 1 19 . 1 1 13 13 LYS HB3 H 1 1.646 0.020 . 2 . . . . 13 LYS HB3 . 17389 1 20 . 1 1 13 13 LYS HG2 H 1 1.445 0.020 . 2 . . . . 13 LYS HG2 . 17389 1 21 . 1 1 13 13 LYS HG3 H 1 1.372 0.020 . 2 . . . . 13 LYS HG3 . 17389 1 22 . 1 1 13 13 LYS HD2 H 1 1.634 0.020 . 2 . . . . 13 LYS HD2 . 17389 1 23 . 1 1 13 13 LYS HD3 H 1 1.635 0.020 . 2 . . . . 13 LYS HD3 . 17389 1 24 . 1 1 13 13 LYS HE2 H 1 2.966 0.020 . 2 . . . . 13 LYS HE2 . 17389 1 25 . 1 1 13 13 LYS HE3 H 1 2.966 0.020 . 2 . . . . 13 LYS HE3 . 17389 1 26 . 1 1 13 13 LYS CA C 13 55.613 0.400 . 1 . . . . 13 LYS CA . 17389 1 27 . 1 1 13 13 LYS CB C 13 32.678 0.400 . 1 . . . . 13 LYS CB . 17389 1 28 . 1 1 13 13 LYS CG C 13 24.551 0.400 . 1 . . . . 13 LYS CG . 17389 1 29 . 1 1 13 13 LYS CD C 13 28.723 0.400 . 1 . . . . 13 LYS CD . 17389 1 30 . 1 1 13 13 LYS CE C 13 41.992 0.400 . 1 . . . . 13 LYS CE . 17389 1 31 . 1 1 13 13 LYS N N 15 121.597 0.400 . 1 . . . . 13 LYS N . 17389 1 32 . 1 1 14 14 ARG H H 1 7.616 0.020 . 1 . . . . 14 ARG H . 17389 1 33 . 1 1 14 14 ARG HA H 1 3.994 0.020 . 1 . . . . 14 ARG HA . 17389 1 34 . 1 1 14 14 ARG HB2 H 1 1.273 0.020 . 2 . . . . 14 ARG HB2 . 17389 1 35 . 1 1 14 14 ARG HB3 H 1 1.483 0.020 . 2 . . . . 14 ARG HB3 . 17389 1 36 . 1 1 14 14 ARG HG2 H 1 1.623 0.020 . 2 . . . . 14 ARG HG2 . 17389 1 37 . 1 1 14 14 ARG HG3 H 1 1.385 0.020 . 2 . . . . 14 ARG HG3 . 17389 1 38 . 1 1 14 14 ARG HD2 H 1 3.242 0.020 . 2 . . . . 14 ARG HD2 . 17389 1 39 . 1 1 14 14 ARG HD3 H 1 3.078 0.020 . 2 . . . . 14 ARG HD3 . 17389 1 40 . 1 1 14 14 ARG CA C 13 56.505 0.400 . 1 . . . . 14 ARG CA . 17389 1 41 . 1 1 14 14 ARG CB C 13 31.626 0.400 . 1 . . . . 14 ARG CB . 17389 1 42 . 1 1 14 14 ARG CG C 13 26.969 0.400 . 1 . . . . 14 ARG CG . 17389 1 43 . 1 1 14 14 ARG CD C 13 43.543 0.400 . 1 . . . . 14 ARG CD . 17389 1 44 . 1 1 14 14 ARG N N 15 118.862 0.400 . 1 . . . . 14 ARG N . 17389 1 45 . 1 1 15 15 LEU H H 1 8.324 0.020 . 1 . . . . 15 LEU H . 17389 1 46 . 1 1 15 15 LEU HA H 1 4.433 0.020 . 1 . . . . 15 LEU HA . 17389 1 47 . 1 1 15 15 LEU HB2 H 1 1.304 0.020 . 2 . . . . 15 LEU HB2 . 17389 1 48 . 1 1 15 15 LEU HB3 H 1 1.304 0.020 . 2 . . . . 15 LEU HB3 . 17389 1 49 . 1 1 15 15 LEU HG H 1 1.284 0.020 . 1 . . . . 15 LEU HG . 17389 1 50 . 1 1 15 15 LEU HD11 H 1 0.631 0.020 . 2 . . . . 15 LEU HD1 . 17389 1 51 . 1 1 15 15 LEU HD12 H 1 0.631 0.020 . 2 . . . . 15 LEU HD1 . 17389 1 52 . 1 1 15 15 LEU HD13 H 1 0.631 0.020 . 2 . . . . 15 LEU HD1 . 17389 1 53 . 1 1 15 15 LEU HD21 H 1 0.554 0.020 . 2 . . . . 15 LEU HD2 . 17389 1 54 . 1 1 15 15 LEU HD22 H 1 0.554 0.020 . 2 . . . . 15 LEU HD2 . 17389 1 55 . 1 1 15 15 LEU HD23 H 1 0.554 0.020 . 2 . . . . 15 LEU HD2 . 17389 1 56 . 1 1 15 15 LEU CA C 13 53.194 0.400 . 1 . . . . 15 LEU CA . 17389 1 57 . 1 1 15 15 LEU CB C 13 44.158 0.400 . 1 . . . . 15 LEU CB . 17389 1 58 . 1 1 15 15 LEU CG C 13 26.713 0.400 . 1 . . . . 15 LEU CG . 17389 1 59 . 1 1 15 15 LEU CD1 C 13 23.890 0.400 . 1 . . . . 15 LEU CD1 . 17389 1 60 . 1 1 15 15 LEU CD2 C 13 23.928 0.400 . 1 . . . . 15 LEU CD2 . 17389 1 61 . 1 1 15 15 LEU N N 15 121.603 0.400 . 1 . . . . 15 LEU N . 17389 1 62 . 1 1 16 16 PHE H H 1 8.841 0.020 . 1 . . . . 16 PHE H . 17389 1 63 . 1 1 16 16 PHE HA H 1 4.894 0.020 . 1 . . . . 16 PHE HA . 17389 1 64 . 1 1 16 16 PHE HB2 H 1 3.126 0.020 . 2 . . . . 16 PHE HB2 . 17389 1 65 . 1 1 16 16 PHE HB3 H 1 2.870 0.020 . 2 . . . . 16 PHE HB3 . 17389 1 66 . 1 1 16 16 PHE HD1 H 1 7.233 0.020 . 1 . . . . 16 PHE HD1 . 17389 1 67 . 1 1 16 16 PHE HD2 H 1 7.233 0.020 . 1 . . . . 16 PHE HD2 . 17389 1 68 . 1 1 16 16 PHE HE1 H 1 7.208 0.020 . 1 . . . . 16 PHE HE1 . 17389 1 69 . 1 1 16 16 PHE HE2 H 1 7.208 0.020 . 1 . . . . 16 PHE HE2 . 17389 1 70 . 1 1 16 16 PHE HZ H 1 7.149 0.020 . 1 . . . . 16 PHE HZ . 17389 1 71 . 1 1 16 16 PHE CA C 13 57.034 0.400 . 1 . . . . 16 PHE CA . 17389 1 72 . 1 1 16 16 PHE CB C 13 38.010 0.400 . 1 . . . . 16 PHE CB . 17389 1 73 . 1 1 16 16 PHE CD1 C 13 131.858 0.400 . 1 . . . . 16 PHE CD1 . 17389 1 74 . 1 1 16 16 PHE CD2 C 13 131.684 0.400 . 1 . . . . 16 PHE CD2 . 17389 1 75 . 1 1 16 16 PHE CE1 C 13 130.744 0.400 . 1 . . . . 16 PHE CE1 . 17389 1 76 . 1 1 16 16 PHE CE2 C 13 130.988 0.400 . 1 . . . . 16 PHE CE2 . 17389 1 77 . 1 1 16 16 PHE CZ C 13 128.916 0.400 . 1 . . . . 16 PHE CZ . 17389 1 78 . 1 1 16 16 PHE N N 15 126.158 0.400 . 1 . . . . 16 PHE N . 17389 1 79 . 1 1 17 17 LEU H H 1 7.516 0.020 . 1 . . . . 17 LEU H . 17389 1 80 . 1 1 17 17 LEU HA H 1 4.637 0.020 . 1 . . . . 17 LEU HA . 17389 1 81 . 1 1 17 17 LEU HB2 H 1 1.415 0.020 . 2 . . . . 17 LEU HB2 . 17389 1 82 . 1 1 17 17 LEU HB3 H 1 1.282 0.020 . 2 . . . . 17 LEU HB3 . 17389 1 83 . 1 1 17 17 LEU HG H 1 1.542 0.020 . 1 . . . . 17 LEU HG . 17389 1 84 . 1 1 17 17 LEU HD11 H 1 0.796 0.020 . 2 . . . . 17 LEU HD1 . 17389 1 85 . 1 1 17 17 LEU HD12 H 1 0.796 0.020 . 2 . . . . 17 LEU HD1 . 17389 1 86 . 1 1 17 17 LEU HD13 H 1 0.796 0.020 . 2 . . . . 17 LEU HD1 . 17389 1 87 . 1 1 17 17 LEU HD21 H 1 0.933 0.020 . 2 . . . . 17 LEU HD2 . 17389 1 88 . 1 1 17 17 LEU HD22 H 1 0.933 0.020 . 2 . . . . 17 LEU HD2 . 17389 1 89 . 1 1 17 17 LEU HD23 H 1 0.933 0.020 . 2 . . . . 17 LEU HD2 . 17389 1 90 . 1 1 17 17 LEU CA C 13 53.143 0.400 . 1 . . . . 17 LEU CA . 17389 1 91 . 1 1 17 17 LEU CB C 13 46.861 0.400 . 1 . . . . 17 LEU CB . 17389 1 92 . 1 1 17 17 LEU CG C 13 26.713 0.400 . 1 . . . . 17 LEU CG . 17389 1 93 . 1 1 17 17 LEU CD1 C 13 26.015 0.400 . 1 . . . . 17 LEU CD1 . 17389 1 94 . 1 1 17 17 LEU CD2 C 13 23.430 0.400 . 1 . . . . 17 LEU CD2 . 17389 1 95 . 1 1 17 17 LEU N N 15 123.067 0.400 . 1 . . . . 17 LEU N . 17389 1 96 . 1 1 18 18 ASP H H 1 7.954 0.020 . 1 . . . . 18 ASP H . 17389 1 97 . 1 1 18 18 ASP HA H 1 4.884 0.020 . 1 . . . . 18 ASP HA . 17389 1 98 . 1 1 18 18 ASP HB2 H 1 2.896 0.020 . 2 . . . . 18 ASP HB2 . 17389 1 99 . 1 1 18 18 ASP HB3 H 1 2.702 0.020 . 2 . . . . 18 ASP HB3 . 17389 1 100 . 1 1 18 18 ASP CA C 13 52.126 0.400 . 1 . . . . 18 ASP CA . 17389 1 101 . 1 1 18 18 ASP CB C 13 40.298 0.400 . 1 . . . . 18 ASP CB . 17389 1 102 . 1 1 18 18 ASP N N 15 118.672 0.400 . 1 . . . . 18 ASP N . 17389 1 103 . 1 1 19 19 PRO HA H 1 3.988 0.020 . 1 . . . . 19 PRO HA . 17389 1 104 . 1 1 19 19 PRO HB2 H 1 2.144 0.020 . 2 . . . . 19 PRO HB2 . 17389 1 105 . 1 1 19 19 PRO HB3 H 1 2.286 0.020 . 2 . . . . 19 PRO HB3 . 17389 1 106 . 1 1 19 19 PRO HG2 H 1 2.299 0.020 . 2 . . . . 19 PRO HG2 . 17389 1 107 . 1 1 19 19 PRO HG3 H 1 2.300 0.020 . 2 . . . . 19 PRO HG3 . 17389 1 108 . 1 1 19 19 PRO HD2 H 1 3.965 0.020 . 2 . . . . 19 PRO HD2 . 17389 1 109 . 1 1 19 19 PRO HD3 H 1 3.965 0.020 . 2 . . . . 19 PRO HD3 . 17389 1 110 . 1 1 19 19 PRO CA C 13 66.185 0.400 . 1 . . . . 19 PRO CA . 17389 1 111 . 1 1 19 19 PRO CB C 13 31.597 0.400 . 1 . . . . 19 PRO CB . 17389 1 112 . 1 1 19 19 PRO CG C 13 27.961 0.400 . 1 . . . . 19 PRO CG . 17389 1 113 . 1 1 19 19 PRO CD C 13 49.869 0.400 . 1 . . . . 19 PRO CD . 17389 1 114 . 1 1 20 20 ASP H H 1 8.165 0.020 . 1 . . . . 20 ASP H . 17389 1 115 . 1 1 20 20 ASP HA H 1 4.357 0.020 . 1 . . . . 20 ASP HA . 17389 1 116 . 1 1 20 20 ASP HB2 H 1 2.636 0.020 . 2 . . . . 20 ASP HB2 . 17389 1 117 . 1 1 20 20 ASP HB3 H 1 2.637 0.020 . 2 . . . . 20 ASP HB3 . 17389 1 118 . 1 1 20 20 ASP CA C 13 57.589 0.400 . 1 . . . . 20 ASP CA . 17389 1 119 . 1 1 20 20 ASP CB C 13 39.872 0.400 . 1 . . . . 20 ASP CB . 17389 1 120 . 1 1 20 20 ASP N N 15 115.339 0.400 . 1 . . . . 20 ASP N . 17389 1 121 . 1 1 21 21 THR H H 1 8.039 0.020 . 1 . . . . 21 THR H . 17389 1 122 . 1 1 21 21 THR HA H 1 3.889 0.020 . 1 . . . . 21 THR HA . 17389 1 123 . 1 1 21 21 THR HB H 1 4.045 0.020 . 1 . . . . 21 THR HB . 17389 1 124 . 1 1 21 21 THR HG21 H 1 1.245 0.020 . 1 . . . . 21 THR HG2 . 17389 1 125 . 1 1 21 21 THR HG22 H 1 1.245 0.020 . 1 . . . . 21 THR HG2 . 17389 1 126 . 1 1 21 21 THR HG23 H 1 1.245 0.020 . 1 . . . . 21 THR HG2 . 17389 1 127 . 1 1 21 21 THR CA C 13 65.962 0.400 . 1 . . . . 21 THR CA . 17389 1 128 . 1 1 21 21 THR CB C 13 67.616 0.400 . 1 . . . . 21 THR CB . 17389 1 129 . 1 1 21 21 THR CG2 C 13 22.142 0.400 . 1 . . . . 21 THR CG2 . 17389 1 130 . 1 1 21 21 THR N N 15 119.137 0.400 . 1 . . . . 21 THR N . 17389 1 131 . 1 1 22 22 ALA H H 1 8.183 0.020 . 1 . . . . 22 ALA H . 17389 1 132 . 1 1 22 22 ALA HA H 1 3.629 0.020 . 1 . . . . 22 ALA HA . 17389 1 133 . 1 1 22 22 ALA HB1 H 1 0.401 0.020 . 1 . . . . 22 ALA HB . 17389 1 134 . 1 1 22 22 ALA HB2 H 1 0.401 0.020 . 1 . . . . 22 ALA HB . 17389 1 135 . 1 1 22 22 ALA HB3 H 1 0.401 0.020 . 1 . . . . 22 ALA HB . 17389 1 136 . 1 1 22 22 ALA CA C 13 55.618 0.400 . 1 . . . . 22 ALA CA . 17389 1 137 . 1 1 22 22 ALA CB C 13 16.673 0.400 . 1 . . . . 22 ALA CB . 17389 1 138 . 1 1 22 22 ALA N N 15 123.775 0.400 . 1 . . . . 22 ALA N . 17389 1 139 . 1 1 23 23 ILE H H 1 8.121 0.020 . 1 . . . . 23 ILE H . 17389 1 140 . 1 1 23 23 ILE HA H 1 3.676 0.020 . 1 . . . . 23 ILE HA . 17389 1 141 . 1 1 23 23 ILE HB H 1 1.947 0.020 . 1 . . . . 23 ILE HB . 17389 1 142 . 1 1 23 23 ILE HG12 H 1 1.682 0.020 . 2 . . . . 23 ILE HG12 . 17389 1 143 . 1 1 23 23 ILE HG13 H 1 1.394 0.020 . 2 . . . . 23 ILE HG13 . 17389 1 144 . 1 1 23 23 ILE HG21 H 1 0.917 0.020 . 1 . . . . 23 ILE HG2 . 17389 1 145 . 1 1 23 23 ILE HG22 H 1 0.917 0.020 . 1 . . . . 23 ILE HG2 . 17389 1 146 . 1 1 23 23 ILE HG23 H 1 0.917 0.020 . 1 . . . . 23 ILE HG2 . 17389 1 147 . 1 1 23 23 ILE HD11 H 1 0.909 0.020 . 1 . . . . 23 ILE HD1 . 17389 1 148 . 1 1 23 23 ILE HD12 H 1 0.909 0.020 . 1 . . . . 23 ILE HD1 . 17389 1 149 . 1 1 23 23 ILE HD13 H 1 0.909 0.020 . 1 . . . . 23 ILE HD1 . 17389 1 150 . 1 1 23 23 ILE CA C 13 64.414 0.400 . 1 . . . . 23 ILE CA . 17389 1 151 . 1 1 23 23 ILE CB C 13 37.172 0.400 . 1 . . . . 23 ILE CB . 17389 1 152 . 1 1 23 23 ILE CG1 C 13 28.641 0.400 . 1 . . . . 23 ILE CG1 . 17389 1 153 . 1 1 23 23 ILE CG2 C 13 17.303 0.400 . 1 . . . . 23 ILE CG2 . 17389 1 154 . 1 1 23 23 ILE CD1 C 13 12.797 0.400 . 1 . . . . 23 ILE CD1 . 17389 1 155 . 1 1 23 23 ILE N N 15 116.050 0.400 . 1 . . . . 23 ILE N . 17389 1 156 . 1 1 24 24 GLU H H 1 7.625 0.020 . 1 . . . . 24 GLU H . 17389 1 157 . 1 1 24 24 GLU HA H 1 3.986 0.020 . 1 . . . . 24 GLU HA . 17389 1 158 . 1 1 24 24 GLU HB2 H 1 2.101 0.020 . 2 . . . . 24 GLU HB2 . 17389 1 159 . 1 1 24 24 GLU HB3 H 1 2.100 0.020 . 2 . . . . 24 GLU HB3 . 17389 1 160 . 1 1 24 24 GLU HG2 H 1 2.360 0.020 . 2 . . . . 24 GLU HG2 . 17389 1 161 . 1 1 24 24 GLU HG3 H 1 2.191 0.020 . 2 . . . . 24 GLU HG3 . 17389 1 162 . 1 1 24 24 GLU CA C 13 59.290 0.400 . 1 . . . . 24 GLU CA . 17389 1 163 . 1 1 24 24 GLU CB C 13 29.193 0.400 . 1 . . . . 24 GLU CB . 17389 1 164 . 1 1 24 24 GLU CG C 13 35.953 0.400 . 1 . . . . 24 GLU CG . 17389 1 165 . 1 1 24 24 GLU N N 15 121.077 0.400 . 1 . . . . 24 GLU N . 17389 1 166 . 1 1 25 25 ARG H H 1 8.027 0.020 . 1 . . . . 25 ARG H . 17389 1 167 . 1 1 25 25 ARG HA H 1 3.805 0.020 . 1 . . . . 25 ARG HA . 17389 1 168 . 1 1 25 25 ARG HB2 H 1 1.545 0.020 . 2 . . . . 25 ARG HB2 . 17389 1 169 . 1 1 25 25 ARG HB3 H 1 1.757 0.020 . 2 . . . . 25 ARG HB3 . 17389 1 170 . 1 1 25 25 ARG HG2 H 1 1.624 0.020 . 2 . . . . 25 ARG HG2 . 17389 1 171 . 1 1 25 25 ARG HG3 H 1 1.432 0.020 . 2 . . . . 25 ARG HG3 . 17389 1 172 . 1 1 25 25 ARG HD2 H 1 3.045 0.020 . 2 . . . . 25 ARG HD2 . 17389 1 173 . 1 1 25 25 ARG HD3 H 1 3.154 0.020 . 2 . . . . 25 ARG HD3 . 17389 1 174 . 1 1 25 25 ARG CA C 13 58.761 0.400 . 1 . . . . 25 ARG CA . 17389 1 175 . 1 1 25 25 ARG CB C 13 29.297 0.400 . 1 . . . . 25 ARG CB . 17389 1 176 . 1 1 25 25 ARG CG C 13 26.699 0.400 . 1 . . . . 25 ARG CG . 17389 1 177 . 1 1 25 25 ARG CD C 13 43.043 0.400 . 1 . . . . 25 ARG CD . 17389 1 178 . 1 1 25 25 ARG N N 15 119.119 0.400 . 1 . . . . 25 ARG N . 17389 1 179 . 1 1 26 26 LEU H H 1 8.294 0.020 . 1 . . . . 26 LEU H . 17389 1 180 . 1 1 26 26 LEU HA H 1 3.528 0.020 . 1 . . . . 26 LEU HA . 17389 1 181 . 1 1 26 26 LEU HB2 H 1 1.273 0.020 . 2 . . . . 26 LEU HB2 . 17389 1 182 . 1 1 26 26 LEU HB3 H 1 1.988 0.020 . 2 . . . . 26 LEU HB3 . 17389 1 183 . 1 1 26 26 LEU HG H 1 1.673 0.020 . 1 . . . . 26 LEU HG . 17389 1 184 . 1 1 26 26 LEU HD11 H 1 0.920 0.020 . 2 . . . . 26 LEU HD1 . 17389 1 185 . 1 1 26 26 LEU HD12 H 1 0.920 0.020 . 2 . . . . 26 LEU HD1 . 17389 1 186 . 1 1 26 26 LEU HD13 H 1 0.920 0.020 . 2 . . . . 26 LEU HD1 . 17389 1 187 . 1 1 26 26 LEU HD21 H 1 1.173 0.020 . 2 . . . . 26 LEU HD2 . 17389 1 188 . 1 1 26 26 LEU HD22 H 1 1.173 0.020 . 2 . . . . 26 LEU HD2 . 17389 1 189 . 1 1 26 26 LEU HD23 H 1 1.173 0.020 . 2 . . . . 26 LEU HD2 . 17389 1 190 . 1 1 26 26 LEU CA C 13 57.176 0.400 . 1 . . . . 26 LEU CA . 17389 1 191 . 1 1 26 26 LEU CB C 13 40.828 0.400 . 1 . . . . 26 LEU CB . 17389 1 192 . 1 1 26 26 LEU CG C 13 26.713 0.400 . 1 . . . . 26 LEU CG . 17389 1 193 . 1 1 26 26 LEU CD1 C 13 22.825 0.400 . 1 . . . . 26 LEU CD1 . 17389 1 194 . 1 1 26 26 LEU CD2 C 13 27.741 0.400 . 1 . . . . 26 LEU CD2 . 17389 1 195 . 1 1 26 26 LEU N N 15 120.148 0.400 . 1 . . . . 26 LEU N . 17389 1 196 . 1 1 27 27 GLN H H 1 8.427 0.020 . 1 . . . . 27 GLN H . 17389 1 197 . 1 1 27 27 GLN HA H 1 3.971 0.020 . 1 . . . . 27 GLN HA . 17389 1 198 . 1 1 27 27 GLN HB2 H 1 2.173 0.020 . 2 . . . . 27 GLN HB2 . 17389 1 199 . 1 1 27 27 GLN HB3 H 1 2.099 0.020 . 2 . . . . 27 GLN HB3 . 17389 1 200 . 1 1 27 27 GLN HG2 H 1 2.477 0.020 . 2 . . . . 27 GLN HG2 . 17389 1 201 . 1 1 27 27 GLN HG3 H 1 2.377 0.020 . 2 . . . . 27 GLN HG3 . 17389 1 202 . 1 1 27 27 GLN HE21 H 1 7.276 0.020 . 2 . . . . 27 GLN HE21 . 17389 1 203 . 1 1 27 27 GLN HE22 H 1 6.783 0.020 . 2 . . . . 27 GLN HE22 . 17389 1 204 . 1 1 27 27 GLN CA C 13 58.839 0.400 . 1 . . . . 27 GLN CA . 17389 1 205 . 1 1 27 27 GLN CB C 13 27.574 0.400 . 1 . . . . 27 GLN CB . 17389 1 206 . 1 1 27 27 GLN CG C 13 33.663 0.400 . 1 . . . . 27 GLN CG . 17389 1 207 . 1 1 27 27 GLN N N 15 117.580 0.400 . 1 . . . . 27 GLN N . 17389 1 208 . 1 1 27 27 GLN NE2 N 15 110.441 0.400 . 1 . . . . 27 GLN NE2 . 17389 1 209 . 1 1 28 28 ARG H H 1 7.575 0.020 . 1 . . . . 28 ARG H . 17389 1 210 . 1 1 28 28 ARG HA H 1 4.027 0.020 . 1 . . . . 28 ARG HA . 17389 1 211 . 1 1 28 28 ARG HB2 H 1 1.954 0.020 . 2 . . . . 28 ARG HB2 . 17389 1 212 . 1 1 28 28 ARG HB3 H 1 1.878 0.020 . 2 . . . . 28 ARG HB3 . 17389 1 213 . 1 1 28 28 ARG HG2 H 1 1.803 0.020 . 2 . . . . 28 ARG HG2 . 17389 1 214 . 1 1 28 28 ARG HG3 H 1 1.658 0.020 . 2 . . . . 28 ARG HG3 . 17389 1 215 . 1 1 28 28 ARG HD2 H 1 3.176 0.020 . 2 . . . . 28 ARG HD2 . 17389 1 216 . 1 1 28 28 ARG HD3 H 1 3.176 0.020 . 2 . . . . 28 ARG HD3 . 17389 1 217 . 1 1 28 28 ARG CA C 13 59.353 0.400 . 1 . . . . 28 ARG CA . 17389 1 218 . 1 1 28 28 ARG CB C 13 29.551 0.400 . 1 . . . . 28 ARG CB . 17389 1 219 . 1 1 28 28 ARG CG C 13 27.428 0.400 . 1 . . . . 28 ARG CG . 17389 1 220 . 1 1 28 28 ARG CD C 13 43.043 0.400 . 1 . . . . 28 ARG CD . 17389 1 221 . 1 1 28 28 ARG N N 15 118.881 0.400 . 1 . . . . 28 ARG N . 17389 1 222 . 1 1 29 29 LEU H H 1 8.044 0.020 . 1 . . . . 29 LEU H . 17389 1 223 . 1 1 29 29 LEU HA H 1 4.119 0.020 . 1 . . . . 29 LEU HA . 17389 1 224 . 1 1 29 29 LEU HB2 H 1 2.142 0.020 . 2 . . . . 29 LEU HB2 . 17389 1 225 . 1 1 29 29 LEU HB3 H 1 1.486 0.020 . 2 . . . . 29 LEU HB3 . 17389 1 226 . 1 1 29 29 LEU HG H 1 1.780 0.020 . 1 . . . . 29 LEU HG . 17389 1 227 . 1 1 29 29 LEU HD11 H 1 0.647 0.020 . 2 . . . . 29 LEU HD1 . 17389 1 228 . 1 1 29 29 LEU HD12 H 1 0.647 0.020 . 2 . . . . 29 LEU HD1 . 17389 1 229 . 1 1 29 29 LEU HD13 H 1 0.647 0.020 . 2 . . . . 29 LEU HD1 . 17389 1 230 . 1 1 29 29 LEU HD21 H 1 0.902 0.020 . 2 . . . . 29 LEU HD2 . 17389 1 231 . 1 1 29 29 LEU HD22 H 1 0.902 0.020 . 2 . . . . 29 LEU HD2 . 17389 1 232 . 1 1 29 29 LEU HD23 H 1 0.902 0.020 . 2 . . . . 29 LEU HD2 . 17389 1 233 . 1 1 29 29 LEU CA C 13 57.491 0.400 . 1 . . . . 29 LEU CA . 17389 1 234 . 1 1 29 29 LEU CB C 13 43.060 0.400 . 1 . . . . 29 LEU CB . 17389 1 235 . 1 1 29 29 LEU CG C 13 26.592 0.400 . 1 . . . . 29 LEU CG . 17389 1 236 . 1 1 29 29 LEU CD1 C 13 26.842 0.400 . 1 . . . . 29 LEU CD1 . 17389 1 237 . 1 1 29 29 LEU CD2 C 13 23.053 0.400 . 1 . . . . 29 LEU CD2 . 17389 1 238 . 1 1 29 29 LEU N N 15 121.339 0.400 . 1 . . . . 29 LEU N . 17389 1 239 . 1 1 30 30 GLN H H 1 8.939 0.020 . 1 . . . . 30 GLN H . 17389 1 240 . 1 1 30 30 GLN HA H 1 3.712 0.020 . 1 . . . . 30 GLN HA . 17389 1 241 . 1 1 30 30 GLN HB2 H 1 2.140 0.020 . 2 . . . . 30 GLN HB2 . 17389 1 242 . 1 1 30 30 GLN HB3 H 1 2.384 0.020 . 2 . . . . 30 GLN HB3 . 17389 1 243 . 1 1 30 30 GLN HG2 H 1 2.512 0.020 . 2 . . . . 30 GLN HG2 . 17389 1 244 . 1 1 30 30 GLN HG3 H 1 2.508 0.020 . 2 . . . . 30 GLN HG3 . 17389 1 245 . 1 1 30 30 GLN HE21 H 1 5.647 0.020 . 2 . . . . 30 GLN HE21 . 17389 1 246 . 1 1 30 30 GLN HE22 H 1 8.753 0.020 . 2 . . . . 30 GLN HE22 . 17389 1 247 . 1 1 30 30 GLN CA C 13 58.357 0.400 . 1 . . . . 30 GLN CA . 17389 1 248 . 1 1 30 30 GLN CB C 13 27.525 0.400 . 1 . . . . 30 GLN CB . 17389 1 249 . 1 1 30 30 GLN CG C 13 31.627 0.400 . 1 . . . . 30 GLN CG . 17389 1 250 . 1 1 30 30 GLN N N 15 121.951 0.400 . 1 . . . . 30 GLN N . 17389 1 251 . 1 1 30 30 GLN NE2 N 15 108.357 0.400 . 1 . . . . 30 GLN NE2 . 17389 1 252 . 1 1 31 31 GLN H H 1 8.371 0.020 . 1 . . . . 31 GLN H . 17389 1 253 . 1 1 31 31 GLN HA H 1 3.990 0.020 . 1 . . . . 31 GLN HA . 17389 1 254 . 1 1 31 31 GLN HB2 H 1 2.133 0.020 . 2 . . . . 31 GLN HB2 . 17389 1 255 . 1 1 31 31 GLN HB3 H 1 2.052 0.020 . 2 . . . . 31 GLN HB3 . 17389 1 256 . 1 1 31 31 GLN HG2 H 1 2.499 0.020 . 2 . . . . 31 GLN HG2 . 17389 1 257 . 1 1 31 31 GLN HG3 H 1 2.330 0.020 . 2 . . . . 31 GLN HG3 . 17389 1 258 . 1 1 31 31 GLN HE21 H 1 7.453 0.020 . 2 . . . . 31 GLN HE21 . 17389 1 259 . 1 1 31 31 GLN HE22 H 1 6.793 0.020 . 2 . . . . 31 GLN HE22 . 17389 1 260 . 1 1 31 31 GLN CA C 13 58.797 0.400 . 1 . . . . 31 GLN CA . 17389 1 261 . 1 1 31 31 GLN CB C 13 28.232 0.400 . 1 . . . . 31 GLN CB . 17389 1 262 . 1 1 31 31 GLN CG C 13 33.942 0.400 . 1 . . . . 31 GLN CG . 17389 1 263 . 1 1 31 31 GLN N N 15 118.290 0.400 . 1 . . . . 31 GLN N . 17389 1 264 . 1 1 31 31 GLN NE2 N 15 111.461 0.400 . 1 . . . . 31 GLN NE2 . 17389 1 265 . 1 1 32 32 ALA H H 1 8.064 0.020 . 1 . . . . 32 ALA H . 17389 1 266 . 1 1 32 32 ALA HA H 1 3.800 0.020 . 1 . . . . 32 ALA HA . 17389 1 267 . 1 1 32 32 ALA HB1 H 1 0.842 0.020 . 1 . . . . 32 ALA HB . 17389 1 268 . 1 1 32 32 ALA HB2 H 1 0.842 0.020 . 1 . . . . 32 ALA HB . 17389 1 269 . 1 1 32 32 ALA HB3 H 1 0.842 0.020 . 1 . . . . 32 ALA HB . 17389 1 270 . 1 1 32 32 ALA CA C 13 54.682 0.400 . 1 . . . . 32 ALA CA . 17389 1 271 . 1 1 32 32 ALA CB C 13 16.910 0.400 . 1 . . . . 32 ALA CB . 17389 1 272 . 1 1 32 32 ALA N N 15 121.514 0.400 . 1 . . . . 32 ALA N . 17389 1 273 . 1 1 33 33 LEU H H 1 7.351 0.020 . 1 . . . . 33 LEU H . 17389 1 274 . 1 1 33 33 LEU HA H 1 4.044 0.020 . 1 . . . . 33 LEU HA . 17389 1 275 . 1 1 33 33 LEU HB2 H 1 1.902 0.020 . 2 . . . . 33 LEU HB2 . 17389 1 276 . 1 1 33 33 LEU HB3 H 1 1.371 0.020 . 2 . . . . 33 LEU HB3 . 17389 1 277 . 1 1 33 33 LEU HG H 1 1.363 0.020 . 1 . . . . 33 LEU HG . 17389 1 278 . 1 1 33 33 LEU HD11 H 1 0.727 0.020 . 2 . . . . 33 LEU HD1 . 17389 1 279 . 1 1 33 33 LEU HD12 H 1 0.727 0.020 . 2 . . . . 33 LEU HD1 . 17389 1 280 . 1 1 33 33 LEU HD13 H 1 0.727 0.020 . 2 . . . . 33 LEU HD1 . 17389 1 281 . 1 1 33 33 LEU HD21 H 1 0.393 0.020 . 2 . . . . 33 LEU HD2 . 17389 1 282 . 1 1 33 33 LEU HD22 H 1 0.393 0.020 . 2 . . . . 33 LEU HD2 . 17389 1 283 . 1 1 33 33 LEU HD23 H 1 0.393 0.020 . 2 . . . . 33 LEU HD2 . 17389 1 284 . 1 1 33 33 LEU CA C 13 58.122 0.400 . 1 . . . . 33 LEU CA . 17389 1 285 . 1 1 33 33 LEU CB C 13 42.422 0.400 . 1 . . . . 33 LEU CB . 17389 1 286 . 1 1 33 33 LEU CG C 13 26.996 0.400 . 1 . . . . 33 LEU CG . 17389 1 287 . 1 1 33 33 LEU CD1 C 13 23.372 0.400 . 1 . . . . 33 LEU CD1 . 17389 1 288 . 1 1 33 33 LEU CD2 C 13 25.084 0.400 . 1 . . . . 33 LEU CD2 . 17389 1 289 . 1 1 33 33 LEU N N 15 117.162 0.400 . 1 . . . . 33 LEU N . 17389 1 290 . 1 1 34 34 GLU H H 1 8.171 0.020 . 1 . . . . 34 GLU H . 17389 1 291 . 1 1 34 34 GLU HA H 1 3.702 0.020 . 1 . . . . 34 GLU HA . 17389 1 292 . 1 1 34 34 GLU HB2 H 1 2.056 0.020 . 2 . . . . 34 GLU HB2 . 17389 1 293 . 1 1 34 34 GLU HB3 H 1 2.232 0.020 . 2 . . . . 34 GLU HB3 . 17389 1 294 . 1 1 34 34 GLU HG2 H 1 2.156 0.020 . 2 . . . . 34 GLU HG2 . 17389 1 295 . 1 1 34 34 GLU HG3 H 1 2.610 0.020 . 2 . . . . 34 GLU HG3 . 17389 1 296 . 1 1 34 34 GLU CA C 13 59.860 0.400 . 1 . . . . 34 GLU CA . 17389 1 297 . 1 1 34 34 GLU CB C 13 29.251 0.400 . 1 . . . . 34 GLU CB . 17389 1 298 . 1 1 34 34 GLU CG C 13 36.937 0.400 . 1 . . . . 34 GLU CG . 17389 1 299 . 1 1 34 34 GLU N N 15 117.701 0.400 . 1 . . . . 34 GLU N . 17389 1 300 . 1 1 35 35 MET H H 1 8.637 0.020 . 1 . . . . 35 MET H . 17389 1 301 . 1 1 35 35 MET HA H 1 4.259 0.020 . 1 . . . . 35 MET HA . 17389 1 302 . 1 1 35 35 MET HB2 H 1 2.177 0.020 . 2 . . . . 35 MET HB2 . 17389 1 303 . 1 1 35 35 MET HB3 H 1 2.177 0.020 . 2 . . . . 35 MET HB3 . 17389 1 304 . 1 1 35 35 MET HG2 H 1 2.745 0.020 . 2 . . . . 35 MET HG2 . 17389 1 305 . 1 1 35 35 MET HG3 H 1 2.575 0.020 . 2 . . . . 35 MET HG3 . 17389 1 306 . 1 1 35 35 MET HE1 H 1 2.074 0.020 . 1 . . . . 35 MET HE . 17389 1 307 . 1 1 35 35 MET HE2 H 1 2.074 0.020 . 1 . . . . 35 MET HE . 17389 1 308 . 1 1 35 35 MET HE3 H 1 2.074 0.020 . 1 . . . . 35 MET HE . 17389 1 309 . 1 1 35 35 MET CA C 13 58.260 0.400 . 1 . . . . 35 MET CA . 17389 1 310 . 1 1 35 35 MET CB C 13 31.644 0.400 . 1 . . . . 35 MET CB . 17389 1 311 . 1 1 35 35 MET CG C 13 32.013 0.400 . 1 . . . . 35 MET CG . 17389 1 312 . 1 1 35 35 MET CE C 13 16.764 0.400 . 1 . . . . 35 MET CE . 17389 1 313 . 1 1 35 35 MET N N 15 120.038 0.400 . 1 . . . . 35 MET N . 17389 1 314 . 1 1 36 36 GLY H H 1 9.112 0.020 . 1 . . . . 36 GLY H . 17389 1 315 . 1 1 36 36 GLY HA2 H 1 3.800 0.020 . 2 . . . . 36 GLY HA2 . 17389 1 316 . 1 1 36 36 GLY HA3 H 1 4.110 0.020 . 2 . . . . 36 GLY HA3 . 17389 1 317 . 1 1 36 36 GLY CA C 13 46.842 0.400 . 1 . . . . 36 GLY CA . 17389 1 318 . 1 1 36 36 GLY N N 15 109.193 0.400 . 1 . . . . 36 GLY N . 17389 1 319 . 1 1 37 37 VAL H H 1 8.637 0.020 . 1 . . . . 37 VAL H . 17389 1 320 . 1 1 37 37 VAL HA H 1 3.630 0.020 . 1 . . . . 37 VAL HA . 17389 1 321 . 1 1 37 37 VAL HB H 1 2.189 0.020 . 1 . . . . 37 VAL HB . 17389 1 322 . 1 1 37 37 VAL HG11 H 1 0.954 0.020 . 2 . . . . 37 VAL HG1 . 17389 1 323 . 1 1 37 37 VAL HG12 H 1 0.954 0.020 . 2 . . . . 37 VAL HG1 . 17389 1 324 . 1 1 37 37 VAL HG13 H 1 0.954 0.020 . 2 . . . . 37 VAL HG1 . 17389 1 325 . 1 1 37 37 VAL HG21 H 1 1.111 0.020 . 2 . . . . 37 VAL HG2 . 17389 1 326 . 1 1 37 37 VAL HG22 H 1 1.111 0.020 . 2 . . . . 37 VAL HG2 . 17389 1 327 . 1 1 37 37 VAL HG23 H 1 1.111 0.020 . 2 . . . . 37 VAL HG2 . 17389 1 328 . 1 1 37 37 VAL CA C 13 67.736 0.400 . 1 . . . . 37 VAL CA . 17389 1 329 . 1 1 37 37 VAL CB C 13 31.158 0.400 . 1 . . . . 37 VAL CB . 17389 1 330 . 1 1 37 37 VAL CG1 C 13 21.823 0.400 . 1 . . . . 37 VAL CG1 . 17389 1 331 . 1 1 37 37 VAL CG2 C 13 23.632 0.400 . 1 . . . . 37 VAL CG2 . 17389 1 332 . 1 1 37 37 VAL N N 15 123.481 0.400 . 1 . . . . 37 VAL N . 17389 1 333 . 1 1 38 38 SER H H 1 8.588 0.020 . 1 . . . . 38 SER H . 17389 1 334 . 1 1 38 38 SER HA H 1 4.153 0.020 . 1 . . . . 38 SER HA . 17389 1 335 . 1 1 38 38 SER HB2 H 1 4.049 0.020 . 2 . . . . 38 SER HB2 . 17389 1 336 . 1 1 38 38 SER HB3 H 1 4.008 0.020 . 2 . . . . 38 SER HB3 . 17389 1 337 . 1 1 38 38 SER CA C 13 62.017 0.400 . 1 . . . . 38 SER CA . 17389 1 338 . 1 1 38 38 SER CB C 13 62.292 0.400 . 1 . . . . 38 SER CB . 17389 1 339 . 1 1 38 38 SER N N 15 116.609 0.400 . 1 . . . . 38 SER N . 17389 1 340 . 1 1 39 39 SER H H 1 8.322 0.020 . 1 . . . . 39 SER H . 17389 1 341 . 1 1 39 39 SER HA H 1 4.258 0.020 . 1 . . . . 39 SER HA . 17389 1 342 . 1 1 39 39 SER HB2 H 1 4.067 0.020 . 2 . . . . 39 SER HB2 . 17389 1 343 . 1 1 39 39 SER HB3 H 1 3.969 0.020 . 2 . . . . 39 SER HB3 . 17389 1 344 . 1 1 39 39 SER CA C 13 61.821 0.400 . 1 . . . . 39 SER CA . 17389 1 345 . 1 1 39 39 SER CB C 13 62.685 0.400 . 1 . . . . 39 SER CB . 17389 1 346 . 1 1 39 39 SER N N 15 117.634 0.400 . 1 . . . . 39 SER N . 17389 1 347 . 1 1 40 40 LEU H H 1 7.401 0.020 . 1 . . . . 40 LEU H . 17389 1 348 . 1 1 40 40 LEU HA H 1 4.124 0.020 . 1 . . . . 40 LEU HA . 17389 1 349 . 1 1 40 40 LEU HB2 H 1 2.258 0.020 . 2 . . . . 40 LEU HB2 . 17389 1 350 . 1 1 40 40 LEU HB3 H 1 1.408 0.020 . 2 . . . . 40 LEU HB3 . 17389 1 351 . 1 1 40 40 LEU HG H 1 1.619 0.020 . 1 . . . . 40 LEU HG . 17389 1 352 . 1 1 40 40 LEU HD11 H 1 0.965 0.020 . 2 . . . . 40 LEU HD1 . 17389 1 353 . 1 1 40 40 LEU HD12 H 1 0.965 0.020 . 2 . . . . 40 LEU HD1 . 17389 1 354 . 1 1 40 40 LEU HD13 H 1 0.965 0.020 . 2 . . . . 40 LEU HD1 . 17389 1 355 . 1 1 40 40 LEU HD21 H 1 1.161 0.020 . 2 . . . . 40 LEU HD2 . 17389 1 356 . 1 1 40 40 LEU HD22 H 1 1.161 0.020 . 2 . . . . 40 LEU HD2 . 17389 1 357 . 1 1 40 40 LEU HD23 H 1 1.161 0.020 . 2 . . . . 40 LEU HD2 . 17389 1 358 . 1 1 40 40 LEU CA C 13 57.702 0.400 . 1 . . . . 40 LEU CA . 17389 1 359 . 1 1 40 40 LEU CB C 13 41.490 0.400 . 1 . . . . 40 LEU CB . 17389 1 360 . 1 1 40 40 LEU CG C 13 27.120 0.400 . 1 . . . . 40 LEU CG . 17389 1 361 . 1 1 40 40 LEU CD1 C 13 22.373 0.400 . 1 . . . . 40 LEU CD1 . 17389 1 362 . 1 1 40 40 LEU CD2 C 13 27.686 0.400 . 1 . . . . 40 LEU CD2 . 17389 1 363 . 1 1 40 40 LEU N N 15 121.295 0.400 . 1 . . . . 40 LEU N . 17389 1 364 . 1 1 41 41 MET H H 1 8.632 0.020 . 1 . . . . 41 MET H . 17389 1 365 . 1 1 41 41 MET HA H 1 4.261 0.020 . 1 . . . . 41 MET HA . 17389 1 366 . 1 1 41 41 MET HB2 H 1 1.994 0.020 . 2 . . . . 41 MET HB2 . 17389 1 367 . 1 1 41 41 MET HB3 H 1 2.113 0.020 . 2 . . . . 41 MET HB3 . 17389 1 368 . 1 1 41 41 MET HG2 H 1 2.774 0.020 . 2 . . . . 41 MET HG2 . 17389 1 369 . 1 1 41 41 MET HG3 H 1 2.865 0.020 . 2 . . . . 41 MET HG3 . 17389 1 370 . 1 1 41 41 MET HE1 H 1 1.981 0.020 . 1 . . . . 41 MET HE . 17389 1 371 . 1 1 41 41 MET HE2 H 1 1.981 0.020 . 1 . . . . 41 MET HE . 17389 1 372 . 1 1 41 41 MET HE3 H 1 1.981 0.020 . 1 . . . . 41 MET HE . 17389 1 373 . 1 1 41 41 MET CA C 13 55.700 0.400 . 1 . . . . 41 MET CA . 17389 1 374 . 1 1 41 41 MET CB C 13 29.388 0.400 . 1 . . . . 41 MET CB . 17389 1 375 . 1 1 41 41 MET CG C 13 31.546 0.400 . 1 . . . . 41 MET CG . 17389 1 376 . 1 1 41 41 MET CE C 13 16.764 0.400 . 1 . . . . 41 MET CE . 17389 1 377 . 1 1 41 41 MET N N 15 114.209 0.400 . 1 . . . . 41 MET N . 17389 1 378 . 1 1 42 42 ALA H H 1 7.767 0.020 . 1 . . . . 42 ALA H . 17389 1 379 . 1 1 42 42 ALA HA H 1 4.090 0.020 . 1 . . . . 42 ALA HA . 17389 1 380 . 1 1 42 42 ALA HB1 H 1 1.458 0.020 . 1 . . . . 42 ALA HB . 17389 1 381 . 1 1 42 42 ALA HB2 H 1 1.458 0.020 . 1 . . . . 42 ALA HB . 17389 1 382 . 1 1 42 42 ALA HB3 H 1 1.458 0.020 . 1 . . . . 42 ALA HB . 17389 1 383 . 1 1 42 42 ALA CA C 13 53.931 0.400 . 1 . . . . 42 ALA CA . 17389 1 384 . 1 1 42 42 ALA CB C 13 17.936 0.400 . 1 . . . . 42 ALA CB . 17389 1 385 . 1 1 42 42 ALA N N 15 120.597 0.400 . 1 . . . . 42 ALA N . 17389 1 386 . 1 1 43 43 LEU H H 1 7.492 0.020 . 1 . . . . 43 LEU H . 17389 1 387 . 1 1 43 43 LEU HA H 1 4.131 0.020 . 1 . . . . 43 LEU HA . 17389 1 388 . 1 1 43 43 LEU HB2 H 1 1.552 0.020 . 2 . . . . 43 LEU HB2 . 17389 1 389 . 1 1 43 43 LEU HB3 H 1 2.152 0.020 . 2 . . . . 43 LEU HB3 . 17389 1 390 . 1 1 43 43 LEU HG H 1 1.802 0.020 . 1 . . . . 43 LEU HG . 17389 1 391 . 1 1 43 43 LEU HD11 H 1 0.882 0.020 . 2 . . . . 43 LEU HD1 . 17389 1 392 . 1 1 43 43 LEU HD12 H 1 0.882 0.020 . 2 . . . . 43 LEU HD1 . 17389 1 393 . 1 1 43 43 LEU HD13 H 1 0.882 0.020 . 2 . . . . 43 LEU HD1 . 17389 1 394 . 1 1 43 43 LEU HD21 H 1 0.850 0.020 . 2 . . . . 43 LEU HD2 . 17389 1 395 . 1 1 43 43 LEU HD22 H 1 0.850 0.020 . 2 . . . . 43 LEU HD2 . 17389 1 396 . 1 1 43 43 LEU HD23 H 1 0.850 0.020 . 2 . . . . 43 LEU HD2 . 17389 1 397 . 1 1 43 43 LEU CA C 13 54.755 0.400 . 1 . . . . 43 LEU CA . 17389 1 398 . 1 1 43 43 LEU CB C 13 42.810 0.400 . 1 . . . . 43 LEU CB . 17389 1 399 . 1 1 43 43 LEU CG C 13 26.713 0.400 . 1 . . . . 43 LEU CG . 17389 1 400 . 1 1 43 43 LEU CD1 C 13 26.569 0.400 . 1 . . . . 43 LEU CD1 . 17389 1 401 . 1 1 43 43 LEU CD2 C 13 22.780 0.400 . 1 . . . . 43 LEU CD2 . 17389 1 402 . 1 1 43 43 LEU N N 15 115.503 0.400 . 1 . . . . 43 LEU N . 17389 1 403 . 1 1 44 44 VAL H H 1 7.252 0.020 . 1 . . . . 44 VAL H . 17389 1 404 . 1 1 44 44 VAL HA H 1 2.824 0.020 . 1 . . . . 44 VAL HA . 17389 1 405 . 1 1 44 44 VAL HB H 1 1.789 0.020 . 1 . . . . 44 VAL HB . 17389 1 406 . 1 1 44 44 VAL HG11 H 1 -0.138 0.020 . 2 . . . . 44 VAL HG1 . 17389 1 407 . 1 1 44 44 VAL HG12 H 1 -0.138 0.020 . 2 . . . . 44 VAL HG1 . 17389 1 408 . 1 1 44 44 VAL HG13 H 1 -0.138 0.020 . 2 . . . . 44 VAL HG1 . 17389 1 409 . 1 1 44 44 VAL HG21 H 1 0.008 0.020 . 2 . . . . 44 VAL HG2 . 17389 1 410 . 1 1 44 44 VAL HG22 H 1 0.008 0.020 . 2 . . . . 44 VAL HG2 . 17389 1 411 . 1 1 44 44 VAL HG23 H 1 0.008 0.020 . 2 . . . . 44 VAL HG2 . 17389 1 412 . 1 1 44 44 VAL CA C 13 62.076 0.400 . 1 . . . . 44 VAL CA . 17389 1 413 . 1 1 44 44 VAL CB C 13 29.465 0.400 . 1 . . . . 44 VAL CB . 17389 1 414 . 1 1 44 44 VAL CG1 C 13 19.450 0.400 . 1 . . . . 44 VAL CG1 . 17389 1 415 . 1 1 44 44 VAL CG2 C 13 19.203 0.400 . 1 . . . . 44 VAL CG2 . 17389 1 416 . 1 1 44 44 VAL N N 15 123.300 0.400 . 1 . . . . 44 VAL N . 17389 1 417 . 1 1 45 45 THR H H 1 6.655 0.020 . 1 . . . . 45 THR H . 17389 1 418 . 1 1 45 45 THR HA H 1 4.514 0.020 . 1 . . . . 45 THR HA . 17389 1 419 . 1 1 45 45 THR HB H 1 4.344 0.020 . 1 . . . . 45 THR HB . 17389 1 420 . 1 1 45 45 THR HG21 H 1 1.044 0.020 . 1 . . . . 45 THR HG2 . 17389 1 421 . 1 1 45 45 THR HG22 H 1 1.044 0.020 . 1 . . . . 45 THR HG2 . 17389 1 422 . 1 1 45 45 THR HG23 H 1 1.044 0.020 . 1 . . . . 45 THR HG2 . 17389 1 423 . 1 1 45 45 THR CA C 13 59.319 0.400 . 1 . . . . 45 THR CA . 17389 1 424 . 1 1 45 45 THR CB C 13 70.358 0.400 . 1 . . . . 45 THR CB . 17389 1 425 . 1 1 45 45 THR CG2 C 13 20.905 0.400 . 1 . . . . 45 THR CG2 . 17389 1 426 . 1 1 45 45 THR N N 15 116.602 0.400 . 1 . . . . 45 THR N . 17389 1 427 . 1 1 46 46 THR HA H 1 4.012 0.020 . 1 . . . . 46 THR HA . 17389 1 428 . 1 1 46 46 THR HB H 1 4.115 0.020 . 1 . . . . 46 THR HB . 17389 1 429 . 1 1 46 46 THR HG21 H 1 1.275 0.020 . 1 . . . . 46 THR HG2 . 17389 1 430 . 1 1 46 46 THR HG22 H 1 1.275 0.020 . 1 . . . . 46 THR HG2 . 17389 1 431 . 1 1 46 46 THR HG23 H 1 1.275 0.020 . 1 . . . . 46 THR HG2 . 17389 1 432 . 1 1 46 46 THR CA C 13 65.184 0.400 . 1 . . . . 46 THR CA . 17389 1 433 . 1 1 46 46 THR CB C 13 68.663 0.400 . 1 . . . . 46 THR CB . 17389 1 434 . 1 1 46 46 THR CG2 C 13 21.675 0.400 . 1 . . . . 46 THR CG2 . 17389 1 435 . 1 1 48 48 TRP HD1 H 1 7.499 0.020 . 1 . . . . 48 TRP HD1 . 17389 1 436 . 1 1 48 48 TRP HE1 H 1 10.435 0.020 . 1 . . . . 48 TRP HE1 . 17389 1 437 . 1 1 48 48 TRP HE3 H 1 7.056 0.020 . 1 . . . . 48 TRP HE3 . 17389 1 438 . 1 1 48 48 TRP HZ2 H 1 7.635 0.020 . 1 . . . . 48 TRP HZ2 . 17389 1 439 . 1 1 48 48 TRP HZ3 H 1 7.545 0.020 . 1 . . . . 48 TRP HZ3 . 17389 1 440 . 1 1 48 48 TRP HH2 H 1 7.006 0.020 . 1 . . . . 48 TRP HH2 . 17389 1 441 . 1 1 48 48 TRP CD1 C 13 127.233 0.400 . 1 . . . . 48 TRP CD1 . 17389 1 442 . 1 1 48 48 TRP CE3 C 13 119.773 0.400 . 1 . . . . 48 TRP CE3 . 17389 1 443 . 1 1 48 48 TRP CZ2 C 13 114.108 0.400 . 1 . . . . 48 TRP CZ2 . 17389 1 444 . 1 1 48 48 TRP CZ3 C 13 121.773 0.400 . 1 . . . . 48 TRP CZ3 . 17389 1 445 . 1 1 48 48 TRP CH2 C 13 124.215 0.400 . 1 . . . . 48 TRP CH2 . 17389 1 446 . 1 1 48 48 TRP NE1 N 15 131.555 0.400 . 1 . . . . 48 TRP NE1 . 17389 1 447 . 1 1 51 51 TYR HA H 1 4.790 0.020 . 1 . . . . 51 TYR HA . 17389 1 448 . 1 1 51 51 TYR HB2 H 1 2.979 0.020 . 2 . . . . 51 TYR HB2 . 17389 1 449 . 1 1 51 51 TYR HB3 H 1 3.112 0.020 . 2 . . . . 51 TYR HB3 . 17389 1 450 . 1 1 51 51 TYR HD1 H 1 6.955 0.020 . 1 . . . . 51 TYR HD1 . 17389 1 451 . 1 1 51 51 TYR HD2 H 1 6.955 0.020 . 1 . . . . 51 TYR HD2 . 17389 1 452 . 1 1 51 51 TYR HE1 H 1 6.723 0.020 . 1 . . . . 51 TYR HE1 . 17389 1 453 . 1 1 51 51 TYR HE2 H 1 6.723 0.020 . 1 . . . . 51 TYR HE2 . 17389 1 454 . 1 1 51 51 TYR CA C 13 62.625 0.400 . 1 . . . . 51 TYR CA . 17389 1 455 . 1 1 51 51 TYR CB C 13 37.994 0.400 . 1 . . . . 51 TYR CB . 17389 1 456 . 1 1 51 51 TYR CD1 C 13 132.866 0.400 . 1 . . . . 51 TYR CD1 . 17389 1 457 . 1 1 51 51 TYR CD2 C 13 132.822 0.400 . 1 . . . . 51 TYR CD2 . 17389 1 458 . 1 1 51 51 TYR CE1 C 13 118.213 0.400 . 1 . . . . 51 TYR CE1 . 17389 1 459 . 1 1 51 51 TYR CE2 C 13 117.910 0.400 . 1 . . . . 51 TYR CE2 . 17389 1 460 . 1 1 52 52 GLY H H 1 9.046 0.020 . 1 . . . . 52 GLY H . 17389 1 461 . 1 1 52 52 GLY HA2 H 1 3.830 0.020 . 2 . . . . 52 GLY HA2 . 17389 1 462 . 1 1 52 52 GLY HA3 H 1 3.979 0.020 . 2 . . . . 52 GLY HA3 . 17389 1 463 . 1 1 52 52 GLY CA C 13 46.842 0.400 . 1 . . . . 52 GLY CA . 17389 1 464 . 1 1 52 52 GLY N N 15 104.031 0.400 . 1 . . . . 52 GLY N . 17389 1 465 . 1 1 53 53 TYR H H 1 7.618 0.020 . 1 . . . . 53 TYR H . 17389 1 466 . 1 1 53 53 TYR HA H 1 4.269 0.020 . 1 . . . . 53 TYR HA . 17389 1 467 . 1 1 53 53 TYR HB2 H 1 3.030 0.020 . 2 . . . . 53 TYR HB2 . 17389 1 468 . 1 1 53 53 TYR HB3 H 1 3.301 0.020 . 2 . . . . 53 TYR HB3 . 17389 1 469 . 1 1 53 53 TYR HD1 H 1 7.408 0.020 . 1 . . . . 53 TYR HD1 . 17389 1 470 . 1 1 53 53 TYR HD2 H 1 7.408 0.020 . 1 . . . . 53 TYR HD2 . 17389 1 471 . 1 1 53 53 TYR HE1 H 1 6.841 0.020 . 1 . . . . 53 TYR HE1 . 17389 1 472 . 1 1 53 53 TYR HE2 H 1 6.841 0.020 . 1 . . . . 53 TYR HE2 . 17389 1 473 . 1 1 53 53 TYR CA C 13 61.551 0.400 . 1 . . . . 53 TYR CA . 17389 1 474 . 1 1 53 53 TYR CB C 13 38.524 0.400 . 1 . . . . 53 TYR CB . 17389 1 475 . 1 1 53 53 TYR CD1 C 13 134.308 0.400 . 1 . . . . 53 TYR CD1 . 17389 1 476 . 1 1 53 53 TYR CD2 C 13 134.286 0.400 . 1 . . . . 53 TYR CD2 . 17389 1 477 . 1 1 53 53 TYR CE1 C 13 119.768 0.400 . 1 . . . . 53 TYR CE1 . 17389 1 478 . 1 1 53 53 TYR CE2 C 13 119.891 0.400 . 1 . . . . 53 TYR CE2 . 17389 1 479 . 1 1 53 53 TYR N N 15 122.699 0.400 . 1 . . . . 53 TYR N . 17389 1 480 . 1 1 54 54 MET H H 1 8.573 0.020 . 1 . . . . 54 MET H . 17389 1 481 . 1 1 54 54 MET HA H 1 4.151 0.020 . 1 . . . . 54 MET HA . 17389 1 482 . 1 1 54 54 MET HB2 H 1 2.084 0.020 . 2 . . . . 54 MET HB2 . 17389 1 483 . 1 1 54 54 MET HB3 H 1 1.719 0.020 . 2 . . . . 54 MET HB3 . 17389 1 484 . 1 1 54 54 MET HG2 H 1 2.594 0.020 . 2 . . . . 54 MET HG2 . 17389 1 485 . 1 1 54 54 MET HG3 H 1 2.892 0.020 . 2 . . . . 54 MET HG3 . 17389 1 486 . 1 1 54 54 MET HE1 H 1 1.832 0.020 . 1 . . . . 54 MET HE . 17389 1 487 . 1 1 54 54 MET HE2 H 1 1.832 0.020 . 1 . . . . 54 MET HE . 17389 1 488 . 1 1 54 54 MET HE3 H 1 1.832 0.020 . 1 . . . . 54 MET HE . 17389 1 489 . 1 1 54 54 MET CA C 13 58.787 0.400 . 1 . . . . 54 MET CA . 17389 1 490 . 1 1 54 54 MET CB C 13 32.488 0.400 . 1 . . . . 54 MET CB . 17389 1 491 . 1 1 54 54 MET CG C 13 32.569 0.400 . 1 . . . . 54 MET CG . 17389 1 492 . 1 1 54 54 MET CE C 13 16.600 0.400 . 1 . . . . 54 MET CE . 17389 1 493 . 1 1 54 54 MET N N 15 119.164 0.400 . 1 . . . . 54 MET N . 17389 1 494 . 1 1 55 55 GLU H H 1 9.042 0.020 . 1 . . . . 55 GLU H . 17389 1 495 . 1 1 55 55 GLU HA H 1 3.698 0.020 . 1 . . . . 55 GLU HA . 17389 1 496 . 1 1 55 55 GLU HB2 H 1 1.813 0.020 . 2 . . . . 55 GLU HB2 . 17389 1 497 . 1 1 55 55 GLU HB3 H 1 1.610 0.020 . 2 . . . . 55 GLU HB3 . 17389 1 498 . 1 1 55 55 GLU HG2 H 1 2.121 0.020 . 2 . . . . 55 GLU HG2 . 17389 1 499 . 1 1 55 55 GLU HG3 H 1 2.120 0.020 . 2 . . . . 55 GLU HG3 . 17389 1 500 . 1 1 55 55 GLU CA C 13 59.397 0.400 . 1 . . . . 55 GLU CA . 17389 1 501 . 1 1 55 55 GLU CB C 13 28.845 0.400 . 1 . . . . 55 GLU CB . 17389 1 502 . 1 1 55 55 GLU CG C 13 35.953 0.400 . 1 . . . . 55 GLU CG . 17389 1 503 . 1 1 55 55 GLU N N 15 117.781 0.400 . 1 . . . . 55 GLU N . 17389 1 504 . 1 1 56 56 ARG H H 1 6.962 0.020 . 1 . . . . 56 ARG H . 17389 1 505 . 1 1 56 56 ARG HA H 1 4.051 0.020 . 1 . . . . 56 ARG HA . 17389 1 506 . 1 1 56 56 ARG HB2 H 1 1.315 0.020 . 2 . . . . 56 ARG HB2 . 17389 1 507 . 1 1 56 56 ARG HB3 H 1 1.595 0.020 . 2 . . . . 56 ARG HB3 . 17389 1 508 . 1 1 56 56 ARG HG2 H 1 1.286 0.020 . 2 . . . . 56 ARG HG2 . 17389 1 509 . 1 1 56 56 ARG HG3 H 1 1.110 0.020 . 2 . . . . 56 ARG HG3 . 17389 1 510 . 1 1 56 56 ARG HD2 H 1 3.063 0.020 . 2 . . . . 56 ARG HD2 . 17389 1 511 . 1 1 56 56 ARG HD3 H 1 3.062 0.020 . 2 . . . . 56 ARG HD3 . 17389 1 512 . 1 1 56 56 ARG CA C 13 57.300 0.400 . 1 . . . . 56 ARG CA . 17389 1 513 . 1 1 56 56 ARG CB C 13 30.470 0.400 . 1 . . . . 56 ARG CB . 17389 1 514 . 1 1 56 56 ARG CG C 13 26.850 0.400 . 1 . . . . 56 ARG CG . 17389 1 515 . 1 1 56 56 ARG CD C 13 43.043 0.400 . 1 . . . . 56 ARG CD . 17389 1 516 . 1 1 56 56 ARG N N 15 114.902 0.400 . 1 . . . . 56 ARG N . 17389 1 517 . 1 1 57 57 HIS H H 1 7.883 0.020 . 1 . . . . 57 HIS H . 17389 1 518 . 1 1 57 57 HIS HA H 1 5.058 0.020 . 1 . . . . 57 HIS HA . 17389 1 519 . 1 1 57 57 HIS HB2 H 1 2.587 0.020 . 2 . . . . 57 HIS HB2 . 17389 1 520 . 1 1 57 57 HIS HB3 H 1 3.337 0.020 . 2 . . . . 57 HIS HB3 . 17389 1 521 . 1 1 57 57 HIS CA C 13 56.320 0.400 . 1 . . . . 57 HIS CA . 17389 1 522 . 1 1 57 57 HIS CB C 13 29.478 0.400 . 1 . . . . 57 HIS CB . 17389 1 523 . 1 1 57 57 HIS N N 15 112.718 0.400 . 1 . . . . 57 HIS N . 17389 1 524 . 1 1 58 58 ILE H H 1 8.551 0.020 . 1 . . . . 58 ILE H . 17389 1 525 . 1 1 58 58 ILE HA H 1 4.148 0.020 . 1 . . . . 58 ILE HA . 17389 1 526 . 1 1 58 58 ILE HB H 1 2.467 0.020 . 1 . . . . 58 ILE HB . 17389 1 527 . 1 1 58 58 ILE HG12 H 1 1.496 0.020 . 2 . . . . 58 ILE HG12 . 17389 1 528 . 1 1 58 58 ILE HG13 H 1 1.496 0.020 . 2 . . . . 58 ILE HG13 . 17389 1 529 . 1 1 58 58 ILE HG21 H 1 1.020 0.020 . 1 . . . . 58 ILE HG2 . 17389 1 530 . 1 1 58 58 ILE HG22 H 1 1.020 0.020 . 1 . . . . 58 ILE HG2 . 17389 1 531 . 1 1 58 58 ILE HG23 H 1 1.020 0.020 . 1 . . . . 58 ILE HG2 . 17389 1 532 . 1 1 58 58 ILE HD11 H 1 1.149 0.020 . 1 . . . . 58 ILE HD1 . 17389 1 533 . 1 1 58 58 ILE HD12 H 1 1.149 0.020 . 1 . . . . 58 ILE HD1 . 17389 1 534 . 1 1 58 58 ILE HD13 H 1 1.149 0.020 . 1 . . . . 58 ILE HD1 . 17389 1 535 . 1 1 58 58 ILE CA C 13 63.904 0.400 . 1 . . . . 58 ILE CA . 17389 1 536 . 1 1 58 58 ILE CB C 13 37.014 0.400 . 1 . . . . 58 ILE CB . 17389 1 537 . 1 1 58 58 ILE CG1 C 13 28.686 0.400 . 1 . . . . 58 ILE CG1 . 17389 1 538 . 1 1 58 58 ILE CG2 C 13 16.876 0.400 . 1 . . . . 58 ILE CG2 . 17389 1 539 . 1 1 58 58 ILE CD1 C 13 15.124 0.400 . 1 . . . . 58 ILE CD1 . 17389 1 540 . 1 1 59 59 ASN H H 1 8.310 0.020 . 1 . . . . 59 ASN H . 17389 1 541 . 1 1 59 59 ASN HA H 1 4.299 0.020 . 1 . . . . 59 ASN HA . 17389 1 542 . 1 1 59 59 ASN HB2 H 1 2.738 0.020 . 2 . . . . 59 ASN HB2 . 17389 1 543 . 1 1 59 59 ASN HB3 H 1 2.678 0.020 . 2 . . . . 59 ASN HB3 . 17389 1 544 . 1 1 59 59 ASN HD21 H 1 7.632 0.020 . 2 . . . . 59 ASN HD21 . 17389 1 545 . 1 1 59 59 ASN HD22 H 1 6.987 0.020 . 2 . . . . 59 ASN HD22 . 17389 1 546 . 1 1 59 59 ASN CA C 13 56.117 0.400 . 1 . . . . 59 ASN CA . 17389 1 547 . 1 1 59 59 ASN CB C 13 37.489 0.400 . 1 . . . . 59 ASN CB . 17389 1 548 . 1 1 59 59 ASN N N 15 119.492 0.400 . 1 . . . . 59 ASN N . 17389 1 549 . 1 1 59 59 ASN ND2 N 15 113.784 0.400 . 1 . . . . 59 ASN ND2 . 17389 1 550 . 1 1 60 60 GLU H H 1 7.809 0.020 . 1 . . . . 60 GLU H . 17389 1 551 . 1 1 60 60 GLU HA H 1 4.043 0.020 . 1 . . . . 60 GLU HA . 17389 1 552 . 1 1 60 60 GLU HB2 H 1 2.175 0.020 . 2 . . . . 60 GLU HB2 . 17389 1 553 . 1 1 60 60 GLU HB3 H 1 2.420 0.020 . 2 . . . . 60 GLU HB3 . 17389 1 554 . 1 1 60 60 GLU HG2 H 1 2.366 0.020 . 2 . . . . 60 GLU HG2 . 17389 1 555 . 1 1 60 60 GLU HG3 H 1 2.413 0.020 . 2 . . . . 60 GLU HG3 . 17389 1 556 . 1 1 60 60 GLU CA C 13 59.075 0.400 . 1 . . . . 60 GLU CA . 17389 1 557 . 1 1 60 60 GLU CB C 13 29.844 0.400 . 1 . . . . 60 GLU CB . 17389 1 558 . 1 1 60 60 GLU CG C 13 37.074 0.400 . 1 . . . . 60 GLU CG . 17389 1 559 . 1 1 60 60 GLU N N 15 121.454 0.400 . 1 . . . . 60 GLU N . 17389 1 560 . 1 1 61 61 ILE H H 1 8.448 0.020 . 1 . . . . 61 ILE H . 17389 1 561 . 1 1 61 61 ILE HA H 1 3.562 0.020 . 1 . . . . 61 ILE HA . 17389 1 562 . 1 1 61 61 ILE HB H 1 2.011 0.020 . 1 . . . . 61 ILE HB . 17389 1 563 . 1 1 61 61 ILE HG12 H 1 1.143 0.020 . 2 . . . . 61 ILE HG12 . 17389 1 564 . 1 1 61 61 ILE HG13 H 1 2.129 0.020 . 2 . . . . 61 ILE HG13 . 17389 1 565 . 1 1 61 61 ILE HG21 H 1 1.164 0.020 . 1 . . . . 61 ILE HG2 . 17389 1 566 . 1 1 61 61 ILE HG22 H 1 1.164 0.020 . 1 . . . . 61 ILE HG2 . 17389 1 567 . 1 1 61 61 ILE HG23 H 1 1.164 0.020 . 1 . . . . 61 ILE HG2 . 17389 1 568 . 1 1 61 61 ILE HD11 H 1 1.259 0.020 . 1 . . . . 61 ILE HD1 . 17389 1 569 . 1 1 61 61 ILE HD12 H 1 1.259 0.020 . 1 . . . . 61 ILE HD1 . 17389 1 570 . 1 1 61 61 ILE HD13 H 1 1.259 0.020 . 1 . . . . 61 ILE HD1 . 17389 1 571 . 1 1 61 61 ILE CA C 13 65.484 0.400 . 1 . . . . 61 ILE CA . 17389 1 572 . 1 1 61 61 ILE CB C 13 38.637 0.400 . 1 . . . . 61 ILE CB . 17389 1 573 . 1 1 61 61 ILE CG1 C 13 30.211 0.400 . 1 . . . . 61 ILE CG1 . 17389 1 574 . 1 1 61 61 ILE CG2 C 13 17.903 0.400 . 1 . . . . 61 ILE CG2 . 17389 1 575 . 1 1 61 61 ILE CD1 C 13 14.294 0.400 . 1 . . . . 61 ILE CD1 . 17389 1 576 . 1 1 61 61 ILE N N 15 121.877 0.400 . 1 . . . . 61 ILE N . 17389 1 577 . 1 1 62 62 ARG H H 1 8.202 0.020 . 1 . . . . 62 ARG H . 17389 1 578 . 1 1 62 62 ARG HA H 1 2.860 0.020 . 1 . . . . 62 ARG HA . 17389 1 579 . 1 1 62 62 ARG HB2 H 1 0.369 0.020 . 2 . . . . 62 ARG HB2 . 17389 1 580 . 1 1 62 62 ARG HB3 H 1 1.158 0.020 . 2 . . . . 62 ARG HB3 . 17389 1 581 . 1 1 62 62 ARG HG2 H 1 0.203 0.020 . 2 . . . . 62 ARG HG2 . 17389 1 582 . 1 1 62 62 ARG HG3 H 1 0.498 0.020 . 2 . . . . 62 ARG HG3 . 17389 1 583 . 1 1 62 62 ARG HD2 H 1 2.041 0.020 . 2 . . . . 62 ARG HD2 . 17389 1 584 . 1 1 62 62 ARG HD3 H 1 2.372 0.020 . 2 . . . . 62 ARG HD3 . 17389 1 585 . 1 1 62 62 ARG CA C 13 59.400 0.400 . 1 . . . . 62 ARG CA . 17389 1 586 . 1 1 62 62 ARG CB C 13 29.297 0.400 . 1 . . . . 62 ARG CB . 17389 1 587 . 1 1 62 62 ARG CG C 13 25.199 0.400 . 1 . . . . 62 ARG CG . 17389 1 588 . 1 1 62 62 ARG CD C 13 43.470 0.400 . 1 . . . . 62 ARG CD . 17389 1 589 . 1 1 62 62 ARG N N 15 119.923 0.400 . 1 . . . . 62 ARG N . 17389 1 590 . 1 1 63 63 THR H H 1 7.598 0.020 . 1 . . . . 63 THR H . 17389 1 591 . 1 1 63 63 THR HA H 1 3.817 0.020 . 1 . . . . 63 THR HA . 17389 1 592 . 1 1 63 63 THR HB H 1 4.070 0.020 . 1 . . . . 63 THR HB . 17389 1 593 . 1 1 63 63 THR HG21 H 1 1.196 0.020 . 1 . . . . 63 THR HG2 . 17389 1 594 . 1 1 63 63 THR HG22 H 1 1.196 0.020 . 1 . . . . 63 THR HG2 . 17389 1 595 . 1 1 63 63 THR HG23 H 1 1.196 0.020 . 1 . . . . 63 THR HG2 . 17389 1 596 . 1 1 63 63 THR CA C 13 66.050 0.400 . 1 . . . . 63 THR CA . 17389 1 597 . 1 1 63 63 THR CB C 13 68.763 0.400 . 1 . . . . 63 THR CB . 17389 1 598 . 1 1 63 63 THR CG2 C 13 21.276 0.400 . 1 . . . . 63 THR CG2 . 17389 1 599 . 1 1 63 63 THR N N 15 113.014 0.400 . 1 . . . . 63 THR N . 17389 1 600 . 1 1 64 64 ALA H H 1 7.807 0.020 . 1 . . . . 64 ALA H . 17389 1 601 . 1 1 64 64 ALA HA H 1 4.092 0.020 . 1 . . . . 64 ALA HA . 17389 1 602 . 1 1 64 64 ALA HB1 H 1 1.447 0.020 . 1 . . . . 64 ALA HB . 17389 1 603 . 1 1 64 64 ALA HB2 H 1 1.447 0.020 . 1 . . . . 64 ALA HB . 17389 1 604 . 1 1 64 64 ALA HB3 H 1 1.447 0.020 . 1 . . . . 64 ALA HB . 17389 1 605 . 1 1 64 64 ALA CA C 13 55.112 0.400 . 1 . . . . 64 ALA CA . 17389 1 606 . 1 1 64 64 ALA CB C 13 18.459 0.400 . 1 . . . . 64 ALA CB . 17389 1 607 . 1 1 64 64 ALA N N 15 123.481 0.400 . 1 . . . . 64 ALA N . 17389 1 608 . 1 1 65 65 VAL H H 1 8.530 0.020 . 1 . . . . 65 VAL H . 17389 1 609 . 1 1 65 65 VAL HA H 1 3.377 0.020 . 1 . . . . 65 VAL HA . 17389 1 610 . 1 1 65 65 VAL HB H 1 2.129 0.020 . 1 . . . . 65 VAL HB . 17389 1 611 . 1 1 65 65 VAL HG11 H 1 0.252 0.020 . 2 . . . . 65 VAL HG1 . 17389 1 612 . 1 1 65 65 VAL HG12 H 1 0.252 0.020 . 2 . . . . 65 VAL HG1 . 17389 1 613 . 1 1 65 65 VAL HG13 H 1 0.252 0.020 . 2 . . . . 65 VAL HG1 . 17389 1 614 . 1 1 65 65 VAL HG21 H 1 0.715 0.020 . 2 . . . . 65 VAL HG2 . 17389 1 615 . 1 1 65 65 VAL HG22 H 1 0.715 0.020 . 2 . . . . 65 VAL HG2 . 17389 1 616 . 1 1 65 65 VAL HG23 H 1 0.715 0.020 . 2 . . . . 65 VAL HG2 . 17389 1 617 . 1 1 65 65 VAL CA C 13 66.528 0.400 . 1 . . . . 65 VAL CA . 17389 1 618 . 1 1 65 65 VAL CB C 13 30.925 0.400 . 1 . . . . 65 VAL CB . 17389 1 619 . 1 1 65 65 VAL CG1 C 13 18.949 0.400 . 1 . . . . 65 VAL CG1 . 17389 1 620 . 1 1 65 65 VAL CG2 C 13 23.251 0.400 . 1 . . . . 65 VAL CG2 . 17389 1 621 . 1 1 65 65 VAL N N 15 121.704 0.400 . 1 . . . . 65 VAL N . 17389 1 622 . 1 1 66 66 ASP H H 1 8.054 0.020 . 1 . . . . 66 ASP H . 17389 1 623 . 1 1 66 66 ASP HA H 1 4.396 0.020 . 1 . . . . 66 ASP HA . 17389 1 624 . 1 1 66 66 ASP HB2 H 1 2.539 0.020 . 2 . . . . 66 ASP HB2 . 17389 1 625 . 1 1 66 66 ASP HB3 H 1 2.797 0.020 . 2 . . . . 66 ASP HB3 . 17389 1 626 . 1 1 66 66 ASP CA C 13 57.017 0.400 . 1 . . . . 66 ASP CA . 17389 1 627 . 1 1 66 66 ASP CB C 13 40.120 0.400 . 1 . . . . 66 ASP CB . 17389 1 628 . 1 1 66 66 ASP N N 15 118.869 0.400 . 1 . . . . 66 ASP N . 17389 1 629 . 1 1 67 67 LYS H H 1 8.065 0.020 . 1 . . . . 67 LYS H . 17389 1 630 . 1 1 67 67 LYS HA H 1 3.599 0.020 . 1 . . . . 67 LYS HA . 17389 1 631 . 1 1 67 67 LYS HB2 H 1 1.441 0.020 . 2 . . . . 67 LYS HB2 . 17389 1 632 . 1 1 67 67 LYS HB3 H 1 1.807 0.020 . 2 . . . . 67 LYS HB3 . 17389 1 633 . 1 1 67 67 LYS HG2 H 1 1.436 0.020 . 2 . . . . 67 LYS HG2 . 17389 1 634 . 1 1 67 67 LYS HG3 H 1 1.198 0.020 . 2 . . . . 67 LYS HG3 . 17389 1 635 . 1 1 67 67 LYS HD2 H 1 1.579 0.020 . 2 . . . . 67 LYS HD2 . 17389 1 636 . 1 1 67 67 LYS HD3 H 1 1.578 0.020 . 2 . . . . 67 LYS HD3 . 17389 1 637 . 1 1 67 67 LYS HE2 H 1 2.881 0.020 . 2 . . . . 67 LYS HE2 . 17389 1 638 . 1 1 67 67 LYS HE3 H 1 2.882 0.020 . 2 . . . . 67 LYS HE3 . 17389 1 639 . 1 1 67 67 LYS CA C 13 59.069 0.400 . 1 . . . . 67 LYS CA . 17389 1 640 . 1 1 67 67 LYS CB C 13 31.439 0.400 . 1 . . . . 67 LYS CB . 17389 1 641 . 1 1 67 67 LYS CG C 13 25.402 0.400 . 1 . . . . 67 LYS CG . 17389 1 642 . 1 1 67 67 LYS CD C 13 28.723 0.400 . 1 . . . . 67 LYS CD . 17389 1 643 . 1 1 67 67 LYS CE C 13 41.905 0.400 . 1 . . . . 67 LYS CE . 17389 1 644 . 1 1 67 67 LYS N N 15 118.427 0.400 . 1 . . . . 67 LYS N . 17389 1 645 . 1 1 68 68 VAL H H 1 7.936 0.020 . 1 . . . . 68 VAL H . 17389 1 646 . 1 1 68 68 VAL HA H 1 3.471 0.020 . 1 . . . . 68 VAL HA . 17389 1 647 . 1 1 68 68 VAL HB H 1 2.562 0.020 . 1 . . . . 68 VAL HB . 17389 1 648 . 1 1 68 68 VAL HG11 H 1 0.971 0.020 . 2 . . . . 68 VAL HG1 . 17389 1 649 . 1 1 68 68 VAL HG12 H 1 0.971 0.020 . 2 . . . . 68 VAL HG1 . 17389 1 650 . 1 1 68 68 VAL HG13 H 1 0.971 0.020 . 2 . . . . 68 VAL HG1 . 17389 1 651 . 1 1 68 68 VAL HG21 H 1 1.142 0.020 . 2 . . . . 68 VAL HG2 . 17389 1 652 . 1 1 68 68 VAL HG22 H 1 1.142 0.020 . 2 . . . . 68 VAL HG2 . 17389 1 653 . 1 1 68 68 VAL HG23 H 1 1.142 0.020 . 2 . . . . 68 VAL HG2 . 17389 1 654 . 1 1 68 68 VAL CA C 13 68.329 0.400 . 1 . . . . 68 VAL CA . 17389 1 655 . 1 1 68 68 VAL CB C 13 31.028 0.400 . 1 . . . . 68 VAL CB . 17389 1 656 . 1 1 68 68 VAL CG1 C 13 21.230 0.400 . 1 . . . . 68 VAL CG1 . 17389 1 657 . 1 1 68 68 VAL CG2 C 13 24.948 0.400 . 1 . . . . 68 VAL CG2 . 17389 1 658 . 1 1 68 68 VAL N N 15 117.744 0.400 . 1 . . . . 68 VAL N . 17389 1 659 . 1 1 69 69 GLU H H 1 8.019 0.020 . 1 . . . . 69 GLU H . 17389 1 660 . 1 1 69 69 GLU HA H 1 3.993 0.020 . 1 . . . . 69 GLU HA . 17389 1 661 . 1 1 69 69 GLU HB2 H 1 2.182 0.020 . 2 . . . . 69 GLU HB2 . 17389 1 662 . 1 1 69 69 GLU HB3 H 1 2.437 0.020 . 2 . . . . 69 GLU HB3 . 17389 1 663 . 1 1 69 69 GLU HG2 H 1 2.637 0.020 . 2 . . . . 69 GLU HG2 . 17389 1 664 . 1 1 69 69 GLU HG3 H 1 2.237 0.020 . 2 . . . . 69 GLU HG3 . 17389 1 665 . 1 1 69 69 GLU CA C 13 61.675 0.400 . 1 . . . . 69 GLU CA . 17389 1 666 . 1 1 69 69 GLU CB C 13 29.570 0.400 . 1 . . . . 69 GLU CB . 17389 1 667 . 1 1 69 69 GLU CG C 13 37.488 0.400 . 1 . . . . 69 GLU CG . 17389 1 668 . 1 1 69 69 GLU N N 15 117.300 0.400 . 1 . . . . 69 GLU N . 17389 1 669 . 1 1 70 70 LEU H H 1 7.863 0.020 . 1 . . . . 70 LEU H . 17389 1 670 . 1 1 70 70 LEU HA H 1 4.112 0.020 . 1 . . . . 70 LEU HA . 17389 1 671 . 1 1 70 70 LEU HB2 H 1 1.654 0.020 . 2 . . . . 70 LEU HB2 . 17389 1 672 . 1 1 70 70 LEU HB3 H 1 1.613 0.020 . 2 . . . . 70 LEU HB3 . 17389 1 673 . 1 1 70 70 LEU HG H 1 1.615 0.020 . 1 . . . . 70 LEU HG . 17389 1 674 . 1 1 70 70 LEU HD11 H 1 0.919 0.020 . 2 . . . . 70 LEU HD1 . 17389 1 675 . 1 1 70 70 LEU HD12 H 1 0.919 0.020 . 2 . . . . 70 LEU HD1 . 17389 1 676 . 1 1 70 70 LEU HD13 H 1 0.919 0.020 . 2 . . . . 70 LEU HD1 . 17389 1 677 . 1 1 70 70 LEU HD21 H 1 0.846 0.020 . 2 . . . . 70 LEU HD2 . 17389 1 678 . 1 1 70 70 LEU HD22 H 1 0.846 0.020 . 2 . . . . 70 LEU HD2 . 17389 1 679 . 1 1 70 70 LEU HD23 H 1 0.846 0.020 . 2 . . . . 70 LEU HD2 . 17389 1 680 . 1 1 70 70 LEU CA C 13 58.143 0.400 . 1 . . . . 70 LEU CA . 17389 1 681 . 1 1 70 70 LEU CB C 13 41.522 0.400 . 1 . . . . 70 LEU CB . 17389 1 682 . 1 1 70 70 LEU CG C 13 26.713 0.400 . 1 . . . . 70 LEU CG . 17389 1 683 . 1 1 70 70 LEU CD1 C 13 23.737 0.400 . 1 . . . . 70 LEU CD1 . 17389 1 684 . 1 1 70 70 LEU CD2 C 13 24.947 0.400 . 1 . . . . 70 LEU CD2 . 17389 1 685 . 1 1 70 70 LEU N N 15 120.297 0.400 . 1 . . . . 70 LEU N . 17389 1 686 . 1 1 71 71 PHE H H 1 9.024 0.020 . 1 . . . . 71 PHE H . 17389 1 687 . 1 1 71 71 PHE HA H 1 4.738 0.020 . 1 . . . . 71 PHE HA . 17389 1 688 . 1 1 71 71 PHE HB2 H 1 3.110 0.020 . 2 . . . . 71 PHE HB2 . 17389 1 689 . 1 1 71 71 PHE HB3 H 1 3.313 0.020 . 2 . . . . 71 PHE HB3 . 17389 1 690 . 1 1 71 71 PHE HD1 H 1 7.132 0.020 . 1 . . . . 71 PHE HD1 . 17389 1 691 . 1 1 71 71 PHE HD2 H 1 7.132 0.020 . 1 . . . . 71 PHE HD2 . 17389 1 692 . 1 1 71 71 PHE HE1 H 1 7.279 0.020 . 1 . . . . 71 PHE HE1 . 17389 1 693 . 1 1 71 71 PHE HE2 H 1 7.279 0.020 . 1 . . . . 71 PHE HE2 . 17389 1 694 . 1 1 71 71 PHE HZ H 1 7.261 0.020 . 1 . . . . 71 PHE HZ . 17389 1 695 . 1 1 71 71 PHE CA C 13 57.482 0.400 . 1 . . . . 71 PHE CA . 17389 1 696 . 1 1 71 71 PHE CB C 13 37.491 0.400 . 1 . . . . 71 PHE CB . 17389 1 697 . 1 1 71 71 PHE CD1 C 13 130.806 0.400 . 1 . . . . 71 PHE CD1 . 17389 1 698 . 1 1 71 71 PHE CD2 C 13 130.591 0.400 . 1 . . . . 71 PHE CD2 . 17389 1 699 . 1 1 71 71 PHE CE1 C 13 130.629 0.400 . 1 . . . . 71 PHE CE1 . 17389 1 700 . 1 1 71 71 PHE CE2 C 13 130.600 0.400 . 1 . . . . 71 PHE CE2 . 17389 1 701 . 1 1 71 71 PHE CZ C 13 129.209 0.400 . 1 . . . . 71 PHE CZ . 17389 1 702 . 1 1 71 71 PHE N N 15 117.981 0.400 . 1 . . . . 71 PHE N . 17389 1 703 . 1 1 72 72 LEU H H 1 8.854 0.020 . 1 . . . . 72 LEU H . 17389 1 704 . 1 1 72 72 LEU HA H 1 4.334 0.020 . 1 . . . . 72 LEU HA . 17389 1 705 . 1 1 72 72 LEU HB2 H 1 1.481 0.020 . 2 . . . . 72 LEU HB2 . 17389 1 706 . 1 1 72 72 LEU HB3 H 1 2.252 0.020 . 2 . . . . 72 LEU HB3 . 17389 1 707 . 1 1 72 72 LEU HG H 1 1.629 0.020 . 1 . . . . 72 LEU HG . 17389 1 708 . 1 1 72 72 LEU HD11 H 1 0.996 0.020 . 2 . . . . 72 LEU HD1 . 17389 1 709 . 1 1 72 72 LEU HD12 H 1 0.996 0.020 . 2 . . . . 72 LEU HD1 . 17389 1 710 . 1 1 72 72 LEU HD13 H 1 0.996 0.020 . 2 . . . . 72 LEU HD1 . 17389 1 711 . 1 1 72 72 LEU HD21 H 1 1.018 0.020 . 2 . . . . 72 LEU HD2 . 17389 1 712 . 1 1 72 72 LEU HD22 H 1 1.018 0.020 . 2 . . . . 72 LEU HD2 . 17389 1 713 . 1 1 72 72 LEU HD23 H 1 1.018 0.020 . 2 . . . . 72 LEU HD2 . 17389 1 714 . 1 1 72 72 LEU CA C 13 57.381 0.400 . 1 . . . . 72 LEU CA . 17389 1 715 . 1 1 72 72 LEU CB C 13 41.009 0.400 . 1 . . . . 72 LEU CB . 17389 1 716 . 1 1 72 72 LEU CG C 13 27.088 0.400 . 1 . . . . 72 LEU CG . 17389 1 717 . 1 1 72 72 LEU CD1 C 13 22.834 0.400 . 1 . . . . 72 LEU CD1 . 17389 1 718 . 1 1 72 72 LEU CD2 C 13 27.756 0.400 . 1 . . . . 72 LEU CD2 . 17389 1 719 . 1 1 72 72 LEU N N 15 122.764 0.400 . 1 . . . . 72 LEU N . 17389 1 720 . 1 1 73 73 LYS H H 1 8.589 0.020 . 1 . . . . 73 LYS H . 17389 1 721 . 1 1 73 73 LYS HA H 1 3.594 0.020 . 1 . . . . 73 LYS HA . 17389 1 722 . 1 1 73 73 LYS HB2 H 1 2.120 0.020 . 2 . . . . 73 LYS HB2 . 17389 1 723 . 1 1 73 73 LYS HB3 H 1 2.119 0.020 . 2 . . . . 73 LYS HB3 . 17389 1 724 . 1 1 73 73 LYS HG2 H 1 1.383 0.020 . 2 . . . . 73 LYS HG2 . 17389 1 725 . 1 1 73 73 LYS HG3 H 1 1.586 0.020 . 2 . . . . 73 LYS HG3 . 17389 1 726 . 1 1 73 73 LYS HD2 H 1 1.840 0.020 . 2 . . . . 73 LYS HD2 . 17389 1 727 . 1 1 73 73 LYS HD3 H 1 1.839 0.020 . 2 . . . . 73 LYS HD3 . 17389 1 728 . 1 1 73 73 LYS HE2 H 1 3.069 0.020 . 2 . . . . 73 LYS HE2 . 17389 1 729 . 1 1 73 73 LYS HE3 H 1 3.070 0.020 . 2 . . . . 73 LYS HE3 . 17389 1 730 . 1 1 73 73 LYS CA C 13 60.483 0.400 . 1 . . . . 73 LYS CA . 17389 1 731 . 1 1 73 73 LYS CB C 13 31.884 0.400 . 1 . . . . 73 LYS CB . 17389 1 732 . 1 1 73 73 LYS CG C 13 25.080 0.400 . 1 . . . . 73 LYS CG . 17389 1 733 . 1 1 73 73 LYS CD C 13 29.388 0.400 . 1 . . . . 73 LYS CD . 17389 1 734 . 1 1 73 73 LYS CE C 13 41.723 0.400 . 1 . . . . 73 LYS CE . 17389 1 735 . 1 1 73 73 LYS N N 15 121.950 0.400 . 1 . . . . 73 LYS N . 17389 1 736 . 1 1 74 74 GLU H H 1 8.461 0.020 . 1 . . . . 74 GLU H . 17389 1 737 . 1 1 74 74 GLU HA H 1 4.092 0.020 . 1 . . . . 74 GLU HA . 17389 1 738 . 1 1 74 74 GLU HB2 H 1 2.116 0.020 . 2 . . . . 74 GLU HB2 . 17389 1 739 . 1 1 74 74 GLU HB3 H 1 2.168 0.020 . 2 . . . . 74 GLU HB3 . 17389 1 740 . 1 1 74 74 GLU HG2 H 1 2.302 0.020 . 2 . . . . 74 GLU HG2 . 17389 1 741 . 1 1 74 74 GLU HG3 H 1 2.666 0.020 . 2 . . . . 74 GLU HG3 . 17389 1 742 . 1 1 74 74 GLU CA C 13 59.604 0.400 . 1 . . . . 74 GLU CA . 17389 1 743 . 1 1 74 74 GLU CB C 13 29.485 0.400 . 1 . . . . 74 GLU CB . 17389 1 744 . 1 1 74 74 GLU CG C 13 37.024 0.400 . 1 . . . . 74 GLU CG . 17389 1 745 . 1 1 74 74 GLU N N 15 118.492 0.400 . 1 . . . . 74 GLU N . 17389 1 746 . 1 1 75 75 TYR H H 1 8.127 0.020 . 1 . . . . 75 TYR H . 17389 1 747 . 1 1 75 75 TYR HA H 1 4.130 0.020 . 1 . . . . 75 TYR HA . 17389 1 748 . 1 1 75 75 TYR HB2 H 1 2.970 0.020 . 2 . . . . 75 TYR HB2 . 17389 1 749 . 1 1 75 75 TYR HB3 H 1 3.447 0.020 . 2 . . . . 75 TYR HB3 . 17389 1 750 . 1 1 75 75 TYR HD1 H 1 6.707 0.020 . 1 . . . . 75 TYR HD1 . 17389 1 751 . 1 1 75 75 TYR HD2 H 1 6.707 0.020 . 1 . . . . 75 TYR HD2 . 17389 1 752 . 1 1 75 75 TYR HE1 H 1 6.635 0.020 . 1 . . . . 75 TYR HE1 . 17389 1 753 . 1 1 75 75 TYR HE2 H 1 6.635 0.020 . 1 . . . . 75 TYR HE2 . 17389 1 754 . 1 1 75 75 TYR HH H 1 7.813 0.020 . 1 . . . . 75 TYR HH . 17389 1 755 . 1 1 75 75 TYR CA C 13 62.773 0.400 . 1 . . . . 75 TYR CA . 17389 1 756 . 1 1 75 75 TYR CB C 13 38.871 0.400 . 1 . . . . 75 TYR CB . 17389 1 757 . 1 1 75 75 TYR CD1 C 13 131.230 0.400 . 1 . . . . 75 TYR CD1 . 17389 1 758 . 1 1 75 75 TYR CD2 C 13 131.403 0.400 . 1 . . . . 75 TYR CD2 . 17389 1 759 . 1 1 75 75 TYR CE1 C 13 118.432 0.400 . 1 . . . . 75 TYR CE1 . 17389 1 760 . 1 1 75 75 TYR CE2 C 13 118.457 0.400 . 1 . . . . 75 TYR CE2 . 17389 1 761 . 1 1 75 75 TYR N N 15 121.074 0.400 . 1 . . . . 75 TYR N . 17389 1 762 . 1 1 76 76 LEU H H 1 8.897 0.020 . 1 . . . . 76 LEU H . 17389 1 763 . 1 1 76 76 LEU HA H 1 4.043 0.020 . 1 . . . . 76 LEU HA . 17389 1 764 . 1 1 76 76 LEU HB2 H 1 1.861 0.020 . 2 . . . . 76 LEU HB2 . 17389 1 765 . 1 1 76 76 LEU HB3 H 1 1.315 0.020 . 2 . . . . 76 LEU HB3 . 17389 1 766 . 1 1 76 76 LEU HG H 1 1.689 0.020 . 1 . . . . 76 LEU HG . 17389 1 767 . 1 1 76 76 LEU HD11 H 1 0.670 0.020 . 2 . . . . 76 LEU HD1 . 17389 1 768 . 1 1 76 76 LEU HD12 H 1 0.670 0.020 . 2 . . . . 76 LEU HD1 . 17389 1 769 . 1 1 76 76 LEU HD13 H 1 0.670 0.020 . 2 . . . . 76 LEU HD1 . 17389 1 770 . 1 1 76 76 LEU HD21 H 1 0.796 0.020 . 2 . . . . 76 LEU HD2 . 17389 1 771 . 1 1 76 76 LEU HD22 H 1 0.796 0.020 . 2 . . . . 76 LEU HD2 . 17389 1 772 . 1 1 76 76 LEU HD23 H 1 0.796 0.020 . 2 . . . . 76 LEU HD2 . 17389 1 773 . 1 1 76 76 LEU CA C 13 57.125 0.400 . 1 . . . . 76 LEU CA . 17389 1 774 . 1 1 76 76 LEU CB C 13 42.003 0.400 . 1 . . . . 76 LEU CB . 17389 1 775 . 1 1 76 76 LEU CG C 13 27.456 0.400 . 1 . . . . 76 LEU CG . 17389 1 776 . 1 1 76 76 LEU CD1 C 13 25.636 0.400 . 1 . . . . 76 LEU CD1 . 17389 1 777 . 1 1 76 76 LEU CD2 C 13 24.420 0.400 . 1 . . . . 76 LEU CD2 . 17389 1 778 . 1 1 76 76 LEU N N 15 119.292 0.400 . 1 . . . . 76 LEU N . 17389 1 779 . 1 1 77 77 HIS H H 1 8.178 0.020 . 1 . . . . 77 HIS H . 17389 1 780 . 1 1 77 77 HIS HA H 1 4.169 0.020 . 1 . . . . 77 HIS HA . 17389 1 781 . 1 1 77 77 HIS HB2 H 1 3.230 0.020 . 2 . . . . 77 HIS HB2 . 17389 1 782 . 1 1 77 77 HIS HB3 H 1 3.228 0.020 . 2 . . . . 77 HIS HB3 . 17389 1 783 . 1 1 77 77 HIS HD2 H 1 7.009 0.020 . 1 . . . . 77 HIS HD2 . 17389 1 784 . 1 1 77 77 HIS HE1 H 1 8.049 0.020 . 1 . . . . 77 HIS HE1 . 17389 1 785 . 1 1 77 77 HIS CA C 13 59.942 0.400 . 1 . . . . 77 HIS CA . 17389 1 786 . 1 1 77 77 HIS CB C 13 30.435 0.400 . 1 . . . . 77 HIS CB . 17389 1 787 . 1 1 77 77 HIS CD2 C 13 119.394 0.400 . 1 . . . . 77 HIS CD2 . 17389 1 788 . 1 1 77 77 HIS CE1 C 13 135.938 0.400 . 1 . . . . 77 HIS CE1 . 17389 1 789 . 1 1 77 77 HIS N N 15 117.295 0.400 . 1 . . . . 77 HIS N . 17389 1 790 . 1 1 78 78 PHE H H 1 7.344 0.020 . 1 . . . . 78 PHE H . 17389 1 791 . 1 1 78 78 PHE HA H 1 4.114 0.020 . 1 . . . . 78 PHE HA . 17389 1 792 . 1 1 78 78 PHE HB2 H 1 3.075 0.020 . 2 . . . . 78 PHE HB2 . 17389 1 793 . 1 1 78 78 PHE HB3 H 1 3.076 0.020 . 2 . . . . 78 PHE HB3 . 17389 1 794 . 1 1 78 78 PHE HD1 H 1 7.040 0.020 . 1 . . . . 78 PHE HD1 . 17389 1 795 . 1 1 78 78 PHE HD2 H 1 7.040 0.020 . 1 . . . . 78 PHE HD2 . 17389 1 796 . 1 1 78 78 PHE HE1 H 1 6.939 0.020 . 1 . . . . 78 PHE HE1 . 17389 1 797 . 1 1 78 78 PHE HE2 H 1 6.939 0.020 . 1 . . . . 78 PHE HE2 . 17389 1 798 . 1 1 78 78 PHE HZ H 1 7.038 0.020 . 1 . . . . 78 PHE HZ . 17389 1 799 . 1 1 78 78 PHE CA C 13 61.254 0.400 . 1 . . . . 78 PHE CA . 17389 1 800 . 1 1 78 78 PHE CB C 13 40.306 0.400 . 1 . . . . 78 PHE CB . 17389 1 801 . 1 1 78 78 PHE CD1 C 13 131.804 0.400 . 1 . . . . 78 PHE CD1 . 17389 1 802 . 1 1 78 78 PHE CD2 C 13 132.036 0.400 . 1 . . . . 78 PHE CD2 . 17389 1 803 . 1 1 78 78 PHE CE1 C 13 129.943 0.400 . 1 . . . . 78 PHE CE1 . 17389 1 804 . 1 1 78 78 PHE CE2 C 13 130.076 0.400 . 1 . . . . 78 PHE CE2 . 17389 1 805 . 1 1 78 78 PHE CZ C 13 130.304 0.400 . 1 . . . . 78 PHE CZ . 17389 1 806 . 1 1 78 78 PHE N N 15 117.618 0.400 . 1 . . . . 78 PHE N . 17389 1 807 . 1 1 79 79 VAL H H 1 8.529 0.020 . 1 . . . . 79 VAL H . 17389 1 808 . 1 1 79 79 VAL HA H 1 3.780 0.020 . 1 . . . . 79 VAL HA . 17389 1 809 . 1 1 79 79 VAL HB H 1 2.033 0.020 . 1 . . . . 79 VAL HB . 17389 1 810 . 1 1 79 79 VAL HG11 H 1 0.632 0.020 . 2 . . . . 79 VAL HG1 . 17389 1 811 . 1 1 79 79 VAL HG12 H 1 0.632 0.020 . 2 . . . . 79 VAL HG1 . 17389 1 812 . 1 1 79 79 VAL HG13 H 1 0.632 0.020 . 2 . . . . 79 VAL HG1 . 17389 1 813 . 1 1 79 79 VAL HG21 H 1 0.966 0.020 . 2 . . . . 79 VAL HG2 . 17389 1 814 . 1 1 79 79 VAL HG22 H 1 0.966 0.020 . 2 . . . . 79 VAL HG2 . 17389 1 815 . 1 1 79 79 VAL HG23 H 1 0.966 0.020 . 2 . . . . 79 VAL HG2 . 17389 1 816 . 1 1 79 79 VAL CA C 13 66.091 0.400 . 1 . . . . 79 VAL CA . 17389 1 817 . 1 1 79 79 VAL CB C 13 30.958 0.400 . 1 . . . . 79 VAL CB . 17389 1 818 . 1 1 79 79 VAL CG1 C 13 21.923 0.400 . 1 . . . . 79 VAL CG1 . 17389 1 819 . 1 1 79 79 VAL CG2 C 13 20.241 0.400 . 1 . . . . 79 VAL CG2 . 17389 1 820 . 1 1 79 79 VAL N N 15 112.370 0.400 . 1 . . . . 79 VAL N . 17389 1 821 . 1 1 80 80 LYS H H 1 8.497 0.020 . 1 . . . . 80 LYS H . 17389 1 822 . 1 1 80 80 LYS HA H 1 3.820 0.020 . 1 . . . . 80 LYS HA . 17389 1 823 . 1 1 80 80 LYS HB2 H 1 1.758 0.020 . 2 . . . . 80 LYS HB2 . 17389 1 824 . 1 1 80 80 LYS HB3 H 1 1.755 0.020 . 2 . . . . 80 LYS HB3 . 17389 1 825 . 1 1 80 80 LYS HG2 H 1 1.380 0.020 . 2 . . . . 80 LYS HG2 . 17389 1 826 . 1 1 80 80 LYS HG3 H 1 1.701 0.020 . 2 . . . . 80 LYS HG3 . 17389 1 827 . 1 1 80 80 LYS HD2 H 1 1.644 0.020 . 2 . . . . 80 LYS HD2 . 17389 1 828 . 1 1 80 80 LYS HD3 H 1 1.645 0.020 . 2 . . . . 80 LYS HD3 . 17389 1 829 . 1 1 80 80 LYS HE2 H 1 2.872 0.020 . 2 . . . . 80 LYS HE2 . 17389 1 830 . 1 1 80 80 LYS HE3 H 1 2.872 0.020 . 2 . . . . 80 LYS HE3 . 17389 1 831 . 1 1 80 80 LYS CA C 13 60.507 0.400 . 1 . . . . 80 LYS CA . 17389 1 832 . 1 1 80 80 LYS CB C 13 31.574 0.400 . 1 . . . . 80 LYS CB . 17389 1 833 . 1 1 80 80 LYS CG C 13 27.378 0.400 . 1 . . . . 80 LYS CG . 17389 1 834 . 1 1 80 80 LYS CD C 13 29.297 0.400 . 1 . . . . 80 LYS CD . 17389 1 835 . 1 1 80 80 LYS CE C 13 41.723 0.400 . 1 . . . . 80 LYS CE . 17389 1 836 . 1 1 80 80 LYS N N 15 120.928 0.400 . 1 . . . . 80 LYS N . 17389 1 837 . 1 1 81 81 GLY H H 1 7.278 0.020 . 1 . . . . 81 GLY H . 17389 1 838 . 1 1 81 81 GLY HA2 H 1 3.594 0.020 . 2 . . . . 81 GLY HA2 . 17389 1 839 . 1 1 81 81 GLY HA3 H 1 4.004 0.020 . 2 . . . . 81 GLY HA3 . 17389 1 840 . 1 1 81 81 GLY CA C 13 46.842 0.400 . 1 . . . . 81 GLY CA . 17389 1 841 . 1 1 81 81 GLY N N 15 108.564 0.400 . 1 . . . . 81 GLY N . 17389 1 842 . 1 1 82 82 ALA H H 1 7.313 0.020 . 1 . . . . 82 ALA H . 17389 1 843 . 1 1 82 82 ALA HA H 1 3.790 0.020 . 1 . . . . 82 ALA HA . 17389 1 844 . 1 1 82 82 ALA HB1 H 1 1.390 0.020 . 1 . . . . 82 ALA HB . 17389 1 845 . 1 1 82 82 ALA HB2 H 1 1.390 0.020 . 1 . . . . 82 ALA HB . 17389 1 846 . 1 1 82 82 ALA HB3 H 1 1.390 0.020 . 1 . . . . 82 ALA HB . 17389 1 847 . 1 1 82 82 ALA CA C 13 54.954 0.400 . 1 . . . . 82 ALA CA . 17389 1 848 . 1 1 82 82 ALA CB C 13 17.832 0.400 . 1 . . . . 82 ALA CB . 17389 1 849 . 1 1 82 82 ALA N N 15 122.934 0.400 . 1 . . . . 82 ALA N . 17389 1 850 . 1 1 83 83 VAL H H 1 8.210 0.020 . 1 . . . . 83 VAL H . 17389 1 851 . 1 1 83 83 VAL HA H 1 3.528 0.020 . 1 . . . . 83 VAL HA . 17389 1 852 . 1 1 83 83 VAL HB H 1 2.116 0.020 . 1 . . . . 83 VAL HB . 17389 1 853 . 1 1 83 83 VAL HG11 H 1 0.929 0.020 . 2 . . . . 83 VAL HG1 . 17389 1 854 . 1 1 83 83 VAL HG12 H 1 0.929 0.020 . 2 . . . . 83 VAL HG1 . 17389 1 855 . 1 1 83 83 VAL HG13 H 1 0.929 0.020 . 2 . . . . 83 VAL HG1 . 17389 1 856 . 1 1 83 83 VAL HG21 H 1 1.031 0.020 . 2 . . . . 83 VAL HG2 . 17389 1 857 . 1 1 83 83 VAL HG22 H 1 1.031 0.020 . 2 . . . . 83 VAL HG2 . 17389 1 858 . 1 1 83 83 VAL HG23 H 1 1.031 0.020 . 2 . . . . 83 VAL HG2 . 17389 1 859 . 1 1 83 83 VAL CA C 13 66.642 0.400 . 1 . . . . 83 VAL CA . 17389 1 860 . 1 1 83 83 VAL CB C 13 31.001 0.400 . 1 . . . . 83 VAL CB . 17389 1 861 . 1 1 83 83 VAL CG1 C 13 21.849 0.400 . 1 . . . . 83 VAL CG1 . 17389 1 862 . 1 1 83 83 VAL CG2 C 13 23.828 0.400 . 1 . . . . 83 VAL CG2 . 17389 1 863 . 1 1 83 83 VAL N N 15 117.798 0.400 . 1 . . . . 83 VAL N . 17389 1 864 . 1 1 84 84 ALA H H 1 7.612 0.020 . 1 . . . . 84 ALA H . 17389 1 865 . 1 1 84 84 ALA HA H 1 4.122 0.020 . 1 . . . . 84 ALA HA . 17389 1 866 . 1 1 84 84 ALA HB1 H 1 1.392 0.020 . 1 . . . . 84 ALA HB . 17389 1 867 . 1 1 84 84 ALA HB2 H 1 1.392 0.020 . 1 . . . . 84 ALA HB . 17389 1 868 . 1 1 84 84 ALA HB3 H 1 1.392 0.020 . 1 . . . . 84 ALA HB . 17389 1 869 . 1 1 84 84 ALA CA C 13 55.071 0.400 . 1 . . . . 84 ALA CA . 17389 1 870 . 1 1 84 84 ALA CB C 13 17.296 0.400 . 1 . . . . 84 ALA CB . 17389 1 871 . 1 1 84 84 ALA N N 15 123.017 0.400 . 1 . . . . 84 ALA N . 17389 1 872 . 1 1 85 85 ASN H H 1 7.979 0.020 . 1 . . . . 85 ASN H . 17389 1 873 . 1 1 85 85 ASN HA H 1 4.137 0.020 . 1 . . . . 85 ASN HA . 17389 1 874 . 1 1 85 85 ASN HB2 H 1 2.791 0.020 . 2 . . . . 85 ASN HB2 . 17389 1 875 . 1 1 85 85 ASN HB3 H 1 2.973 0.020 . 2 . . . . 85 ASN HB3 . 17389 1 876 . 1 1 85 85 ASN HD21 H 1 6.307 0.020 . 2 . . . . 85 ASN HD21 . 17389 1 877 . 1 1 85 85 ASN HD22 H 1 7.474 0.020 . 2 . . . . 85 ASN HD22 . 17389 1 878 . 1 1 85 85 ASN CA C 13 55.476 0.400 . 1 . . . . 85 ASN CA . 17389 1 879 . 1 1 85 85 ASN CB C 13 36.481 0.400 . 1 . . . . 85 ASN CB . 17389 1 880 . 1 1 85 85 ASN N N 15 118.618 0.400 . 1 . . . . 85 ASN N . 17389 1 881 . 1 1 85 85 ASN ND2 N 15 107.176 0.400 . 1 . . . . 85 ASN ND2 . 17389 1 882 . 1 1 86 86 ALA H H 1 7.935 0.020 . 1 . . . . 86 ALA H . 17389 1 883 . 1 1 86 86 ALA HA H 1 3.936 0.020 . 1 . . . . 86 ALA HA . 17389 1 884 . 1 1 86 86 ALA HB1 H 1 1.517 0.020 . 1 . . . . 86 ALA HB . 17389 1 885 . 1 1 86 86 ALA HB2 H 1 1.517 0.020 . 1 . . . . 86 ALA HB . 17389 1 886 . 1 1 86 86 ALA HB3 H 1 1.517 0.020 . 1 . . . . 86 ALA HB . 17389 1 887 . 1 1 86 86 ALA CA C 13 53.926 0.400 . 1 . . . . 86 ALA CA . 17389 1 888 . 1 1 86 86 ALA CB C 13 18.299 0.400 . 1 . . . . 86 ALA CB . 17389 1 889 . 1 1 86 86 ALA N N 15 122.554 0.400 . 1 . . . . 86 ALA N . 17389 1 890 . 1 1 87 87 ALA H H 1 7.802 0.020 . 1 . . . . 87 ALA H . 17389 1 891 . 1 1 87 87 ALA HA H 1 3.485 0.020 . 1 . . . . 87 ALA HA . 17389 1 892 . 1 1 87 87 ALA HB1 H 1 1.143 0.020 . 1 . . . . 87 ALA HB . 17389 1 893 . 1 1 87 87 ALA HB2 H 1 1.143 0.020 . 1 . . . . 87 ALA HB . 17389 1 894 . 1 1 87 87 ALA HB3 H 1 1.143 0.020 . 1 . . . . 87 ALA HB . 17389 1 895 . 1 1 87 87 ALA CA C 13 53.338 0.400 . 1 . . . . 87 ALA CA . 17389 1 896 . 1 1 87 87 ALA CB C 13 17.436 0.400 . 1 . . . . 87 ALA CB . 17389 1 897 . 1 1 87 87 ALA N N 15 120.257 0.400 . 1 . . . . 87 ALA N . 17389 1 898 . 1 1 88 88 CYS H H 1 7.143 0.020 . 1 . . . . 88 CYS H . 17389 1 899 . 1 1 88 88 CYS HA H 1 4.472 0.020 . 1 . . . . 88 CYS HA . 17389 1 900 . 1 1 88 88 CYS HB2 H 1 2.880 0.020 . 2 . . . . 88 CYS HB2 . 17389 1 901 . 1 1 88 88 CYS HB3 H 1 3.041 0.020 . 2 . . . . 88 CYS HB3 . 17389 1 902 . 1 1 88 88 CYS CA C 13 58.091 0.400 . 1 . . . . 88 CYS CA . 17389 1 903 . 1 1 88 88 CYS CB C 13 27.769 0.400 . 1 . . . . 88 CYS CB . 17389 1 904 . 1 1 88 88 CYS N N 15 112.225 0.400 . 1 . . . . 88 CYS N . 17389 1 905 . 1 1 89 89 LEU H H 1 6.934 0.020 . 1 . . . . 89 LEU H . 17389 1 906 . 1 1 89 89 LEU HA H 1 4.536 0.020 . 1 . . . . 89 LEU HA . 17389 1 907 . 1 1 89 89 LEU HB2 H 1 1.786 0.020 . 2 . . . . 89 LEU HB2 . 17389 1 908 . 1 1 89 89 LEU HB3 H 1 1.912 0.020 . 2 . . . . 89 LEU HB3 . 17389 1 909 . 1 1 89 89 LEU HG H 1 1.892 0.020 . 1 . . . . 89 LEU HG . 17389 1 910 . 1 1 89 89 LEU HD11 H 1 0.985 0.020 . 2 . . . . 89 LEU HD1 . 17389 1 911 . 1 1 89 89 LEU HD12 H 1 0.985 0.020 . 2 . . . . 89 LEU HD1 . 17389 1 912 . 1 1 89 89 LEU HD13 H 1 0.985 0.020 . 2 . . . . 89 LEU HD1 . 17389 1 913 . 1 1 89 89 LEU HD21 H 1 0.959 0.020 . 2 . . . . 89 LEU HD2 . 17389 1 914 . 1 1 89 89 LEU HD22 H 1 0.959 0.020 . 2 . . . . 89 LEU HD2 . 17389 1 915 . 1 1 89 89 LEU HD23 H 1 0.959 0.020 . 2 . . . . 89 LEU HD2 . 17389 1 916 . 1 1 89 89 LEU CA C 13 53.333 0.400 . 1 . . . . 89 LEU CA . 17389 1 917 . 1 1 89 89 LEU CB C 13 40.288 0.400 . 1 . . . . 89 LEU CB . 17389 1 918 . 1 1 89 89 LEU CG C 13 26.881 0.400 . 1 . . . . 89 LEU CG . 17389 1 919 . 1 1 89 89 LEU CD1 C 13 25.377 0.400 . 1 . . . . 89 LEU CD1 . 17389 1 920 . 1 1 89 89 LEU CD2 C 13 21.959 0.400 . 1 . . . . 89 LEU CD2 . 17389 1 921 . 1 1 89 89 LEU N N 15 121.951 0.400 . 1 . . . . 89 LEU N . 17389 1 922 . 1 1 90 90 PRO HA H 1 4.245 0.020 . 1 . . . . 90 PRO HA . 17389 1 923 . 1 1 90 90 PRO HB2 H 1 2.330 0.020 . 2 . . . . 90 PRO HB2 . 17389 1 924 . 1 1 90 90 PRO HB3 H 1 1.985 0.020 . 2 . . . . 90 PRO HB3 . 17389 1 925 . 1 1 90 90 PRO HG2 H 1 2.123 0.020 . 2 . . . . 90 PRO HG2 . 17389 1 926 . 1 1 90 90 PRO HG3 H 1 2.041 0.020 . 2 . . . . 90 PRO HG3 . 17389 1 927 . 1 1 90 90 PRO HD2 H 1 3.769 0.020 . 2 . . . . 90 PRO HD2 . 17389 1 928 . 1 1 90 90 PRO HD3 H 1 3.820 0.020 . 2 . . . . 90 PRO HD3 . 17389 1 929 . 1 1 90 90 PRO CA C 13 64.604 0.400 . 1 . . . . 90 PRO CA . 17389 1 930 . 1 1 90 90 PRO CB C 13 31.530 0.400 . 1 . . . . 90 PRO CB . 17389 1 931 . 1 1 90 90 PRO CG C 13 27.656 0.400 . 1 . . . . 90 PRO CG . 17389 1 932 . 1 1 90 90 PRO CD C 13 50.124 0.400 . 1 . . . . 90 PRO CD . 17389 1 933 . 1 1 91 91 GLU H H 1 7.430 0.020 . 1 . . . . 91 GLU H . 17389 1 934 . 1 1 91 91 GLU HA H 1 4.611 0.020 . 1 . . . . 91 GLU HA . 17389 1 935 . 1 1 91 91 GLU HB2 H 1 2.074 0.020 . 2 . . . . 91 GLU HB2 . 17389 1 936 . 1 1 91 91 GLU HG2 H 1 2.265 0.020 . 2 . . . . 91 GLU HG2 . 17389 1 937 . 1 1 91 91 GLU CA C 13 54.499 0.400 . 1 . . . . 91 GLU CA . 17389 1 938 . 1 1 91 91 GLU CB C 13 31.530 0.400 . 1 . . . . 91 GLU CB . 17389 1 939 . 1 1 91 91 GLU CG C 13 36.452 0.400 . 1 . . . . 91 GLU CG . 17389 1 940 . 1 1 91 91 GLU N N 15 113.875 0.400 . 1 . . . . 91 GLU N . 17389 1 941 . 1 1 92 92 LEU HA H 1 4.677 0.020 . 1 . . . . 92 LEU HA . 17389 1 942 . 1 1 92 92 LEU HB2 H 1 1.622 0.020 . 2 . . . . 92 LEU HB2 . 17389 1 943 . 1 1 92 92 LEU HB3 H 1 1.917 0.020 . 2 . . . . 92 LEU HB3 . 17389 1 944 . 1 1 92 92 LEU HG H 1 1.548 0.020 . 1 . . . . 92 LEU HG . 17389 1 945 . 1 1 92 92 LEU HD11 H 1 0.876 0.020 . 2 . . . . 92 LEU HD1 . 17389 1 946 . 1 1 92 92 LEU HD12 H 1 0.876 0.020 . 2 . . . . 92 LEU HD1 . 17389 1 947 . 1 1 92 92 LEU HD13 H 1 0.876 0.020 . 2 . . . . 92 LEU HD1 . 17389 1 948 . 1 1 92 92 LEU HD21 H 1 0.744 0.020 . 2 . . . . 92 LEU HD2 . 17389 1 949 . 1 1 92 92 LEU HD22 H 1 0.744 0.020 . 2 . . . . 92 LEU HD2 . 17389 1 950 . 1 1 92 92 LEU HD23 H 1 0.744 0.020 . 2 . . . . 92 LEU HD2 . 17389 1 951 . 1 1 92 92 LEU CA C 13 55.050 0.400 . 1 . . . . 92 LEU CA . 17389 1 952 . 1 1 92 92 LEU CB C 13 41.288 0.400 . 1 . . . . 92 LEU CB . 17389 1 953 . 1 1 92 92 LEU CG C 13 26.713 0.400 . 1 . . . . 92 LEU CG . 17389 1 954 . 1 1 92 92 LEU CD1 C 13 25.066 0.400 . 1 . . . . 92 LEU CD1 . 17389 1 955 . 1 1 92 92 LEU CD2 C 13 22.856 0.400 . 1 . . . . 92 LEU CD2 . 17389 1 956 . 1 1 93 93 ILE H H 1 7.207 0.020 . 1 . . . . 93 ILE H . 17389 1 957 . 1 1 93 93 ILE HA H 1 3.724 0.020 . 1 . . . . 93 ILE HA . 17389 1 958 . 1 1 93 93 ILE HB H 1 1.906 0.020 . 1 . . . . 93 ILE HB . 17389 1 959 . 1 1 93 93 ILE HG12 H 1 1.608 0.020 . 2 . . . . 93 ILE HG12 . 17389 1 960 . 1 1 93 93 ILE HG13 H 1 1.264 0.020 . 2 . . . . 93 ILE HG13 . 17389 1 961 . 1 1 93 93 ILE HG21 H 1 0.928 0.020 . 1 . . . . 93 ILE HG2 . 17389 1 962 . 1 1 93 93 ILE HG22 H 1 0.928 0.020 . 1 . . . . 93 ILE HG2 . 17389 1 963 . 1 1 93 93 ILE HG23 H 1 0.928 0.020 . 1 . . . . 93 ILE HG2 . 17389 1 964 . 1 1 93 93 ILE HD11 H 1 0.906 0.020 . 1 . . . . 93 ILE HD1 . 17389 1 965 . 1 1 93 93 ILE HD12 H 1 0.906 0.020 . 1 . . . . 93 ILE HD1 . 17389 1 966 . 1 1 93 93 ILE HD13 H 1 0.906 0.020 . 1 . . . . 93 ILE HD1 . 17389 1 967 . 1 1 93 93 ILE CA C 13 64.616 0.400 . 1 . . . . 93 ILE CA . 17389 1 968 . 1 1 93 93 ILE CB C 13 37.514 0.400 . 1 . . . . 93 ILE CB . 17389 1 969 . 1 1 93 93 ILE CG1 C 13 28.733 0.400 . 1 . . . . 93 ILE CG1 . 17389 1 970 . 1 1 93 93 ILE CG2 C 13 17.083 0.400 . 1 . . . . 93 ILE CG2 . 17389 1 971 . 1 1 93 93 ILE CD1 C 13 12.269 0.400 . 1 . . . . 93 ILE CD1 . 17389 1 972 . 1 1 93 93 ILE N N 15 120.913 0.400 . 1 . . . . 93 ILE N . 17389 1 973 . 1 1 94 94 LEU H H 1 8.515 0.020 . 1 . . . . 94 LEU H . 17389 1 974 . 1 1 94 94 LEU HA H 1 4.145 0.020 . 1 . . . . 94 LEU HA . 17389 1 975 . 1 1 94 94 LEU HB2 H 1 1.571 0.020 . 2 . . . . 94 LEU HB2 . 17389 1 976 . 1 1 94 94 LEU HB3 H 1 1.936 0.020 . 2 . . . . 94 LEU HB3 . 17389 1 977 . 1 1 94 94 LEU HG H 1 1.484 0.020 . 1 . . . . 94 LEU HG . 17389 1 978 . 1 1 94 94 LEU HD11 H 1 0.795 0.020 . 2 . . . . 94 LEU HD1 . 17389 1 979 . 1 1 94 94 LEU HD12 H 1 0.795 0.020 . 2 . . . . 94 LEU HD1 . 17389 1 980 . 1 1 94 94 LEU HD13 H 1 0.795 0.020 . 2 . . . . 94 LEU HD1 . 17389 1 981 . 1 1 94 94 LEU HD21 H 1 0.763 0.020 . 2 . . . . 94 LEU HD2 . 17389 1 982 . 1 1 94 94 LEU HD22 H 1 0.763 0.020 . 2 . . . . 94 LEU HD2 . 17389 1 983 . 1 1 94 94 LEU HD23 H 1 0.763 0.020 . 2 . . . . 94 LEU HD2 . 17389 1 984 . 1 1 94 94 LEU CA C 13 57.846 0.400 . 1 . . . . 94 LEU CA . 17389 1 985 . 1 1 94 94 LEU CB C 13 40.002 0.400 . 1 . . . . 94 LEU CB . 17389 1 986 . 1 1 94 94 LEU CG C 13 26.713 0.400 . 1 . . . . 94 LEU CG . 17389 1 987 . 1 1 94 94 LEU CD1 C 13 22.825 0.400 . 1 . . . . 94 LEU CD1 . 17389 1 988 . 1 1 94 94 LEU CD2 C 13 25.013 0.400 . 1 . . . . 94 LEU CD2 . 17389 1 989 . 1 1 94 94 LEU N N 15 122.531 0.400 . 1 . . . . 94 LEU N . 17389 1 990 . 1 1 95 95 HIS H H 1 8.748 0.020 . 1 . . . . 95 HIS H . 17389 1 991 . 1 1 95 95 HIS HA H 1 3.770 0.020 . 1 . . . . 95 HIS HA . 17389 1 992 . 1 1 95 95 HIS HB2 H 1 2.995 0.020 . 2 . . . . 95 HIS HB2 . 17389 1 993 . 1 1 95 95 HIS HB3 H 1 2.897 0.020 . 2 . . . . 95 HIS HB3 . 17389 1 994 . 1 1 95 95 HIS HD2 H 1 7.079 0.020 . 1 . . . . 95 HIS HD2 . 17389 1 995 . 1 1 95 95 HIS CA C 13 60.903 0.400 . 1 . . . . 95 HIS CA . 17389 1 996 . 1 1 95 95 HIS CB C 13 29.554 0.400 . 1 . . . . 95 HIS CB . 17389 1 997 . 1 1 95 95 HIS N N 15 118.966 0.400 . 1 . . . . 95 HIS N . 17389 1 998 . 1 1 96 96 ASN H H 1 8.612 0.020 . 1 . . . . 96 ASN H . 17389 1 999 . 1 1 96 96 ASN HA H 1 4.154 0.020 . 1 . . . . 96 ASN HA . 17389 1 1000 . 1 1 96 96 ASN HB2 H 1 2.789 0.020 . 2 . . . . 96 ASN HB2 . 17389 1 1001 . 1 1 96 96 ASN HB3 H 1 2.955 0.020 . 2 . . . . 96 ASN HB3 . 17389 1 1002 . 1 1 96 96 ASN HD21 H 1 7.665 0.020 . 2 . . . . 96 ASN HD21 . 17389 1 1003 . 1 1 96 96 ASN HD22 H 1 7.003 0.020 . 2 . . . . 96 ASN HD22 . 17389 1 1004 . 1 1 96 96 ASN CA C 13 55.953 0.400 . 1 . . . . 96 ASN CA . 17389 1 1005 . 1 1 96 96 ASN CB C 13 37.674 0.400 . 1 . . . . 96 ASN CB . 17389 1 1006 . 1 1 96 96 ASN N N 15 115.961 0.400 . 1 . . . . 96 ASN N . 17389 1 1007 . 1 1 96 96 ASN ND2 N 15 112.154 0.400 . 1 . . . . 96 ASN ND2 . 17389 1 1008 . 1 1 97 97 LYS H H 1 7.753 0.020 . 1 . . . . 97 LYS H . 17389 1 1009 . 1 1 97 97 LYS HA H 1 4.020 0.020 . 1 . . . . 97 LYS HA . 17389 1 1010 . 1 1 97 97 LYS HB2 H 1 1.892 0.020 . 2 . . . . 97 LYS HB2 . 17389 1 1011 . 1 1 97 97 LYS HB3 H 1 2.003 0.020 . 2 . . . . 97 LYS HB3 . 17389 1 1012 . 1 1 97 97 LYS HG2 H 1 1.429 0.020 . 2 . . . . 97 LYS HG2 . 17389 1 1013 . 1 1 97 97 LYS HG3 H 1 1.263 0.020 . 2 . . . . 97 LYS HG3 . 17389 1 1014 . 1 1 97 97 LYS HD2 H 1 1.689 0.020 . 2 . . . . 97 LYS HD2 . 17389 1 1015 . 1 1 97 97 LYS HD3 H 1 1.552 0.020 . 2 . . . . 97 LYS HD3 . 17389 1 1016 . 1 1 97 97 LYS HE2 H 1 2.964 0.020 . 2 . . . . 97 LYS HE2 . 17389 1 1017 . 1 1 97 97 LYS HE3 H 1 3.082 0.020 . 2 . . . . 97 LYS HE3 . 17389 1 1018 . 1 1 97 97 LYS CA C 13 59.359 0.400 . 1 . . . . 97 LYS CA . 17389 1 1019 . 1 1 97 97 LYS CB C 13 33.225 0.400 . 1 . . . . 97 LYS CB . 17389 1 1020 . 1 1 97 97 LYS CG C 13 24.574 0.400 . 1 . . . . 97 LYS CG . 17389 1 1021 . 1 1 97 97 LYS CD C 13 29.798 0.400 . 1 . . . . 97 LYS CD . 17389 1 1022 . 1 1 97 97 LYS CE C 13 42.492 0.400 . 1 . . . . 97 LYS CE . 17389 1 1023 . 1 1 97 97 LYS N N 15 122.060 0.400 . 1 . . . . 97 LYS N . 17389 1 1024 . 1 1 98 98 MET H H 1 8.688 0.020 . 1 . . . . 98 MET H . 17389 1 1025 . 1 1 98 98 MET HA H 1 3.809 0.020 . 1 . . . . 98 MET HA . 17389 1 1026 . 1 1 98 98 MET HB2 H 1 2.022 0.020 . 2 . . . . 98 MET HB2 . 17389 1 1027 . 1 1 98 98 MET HB3 H 1 1.967 0.020 . 2 . . . . 98 MET HB3 . 17389 1 1028 . 1 1 98 98 MET HG2 H 1 2.600 0.020 . 2 . . . . 98 MET HG2 . 17389 1 1029 . 1 1 98 98 MET HG3 H 1 2.139 0.020 . 2 . . . . 98 MET HG3 . 17389 1 1030 . 1 1 98 98 MET HE1 H 1 1.796 0.020 . 1 . . . . 98 MET HE . 17389 1 1031 . 1 1 98 98 MET HE2 H 1 1.796 0.020 . 1 . . . . 98 MET HE . 17389 1 1032 . 1 1 98 98 MET HE3 H 1 1.796 0.020 . 1 . . . . 98 MET HE . 17389 1 1033 . 1 1 98 98 MET CA C 13 58.911 0.400 . 1 . . . . 98 MET CA . 17389 1 1034 . 1 1 98 98 MET CB C 13 34.775 0.400 . 1 . . . . 98 MET CB . 17389 1 1035 . 1 1 98 98 MET CG C 13 33.258 0.400 . 1 . . . . 98 MET CG . 17389 1 1036 . 1 1 98 98 MET CE C 13 16.764 0.400 . 1 . . . . 98 MET CE . 17389 1 1037 . 1 1 98 98 MET N N 15 116.767 0.400 . 1 . . . . 98 MET N . 17389 1 1038 . 1 1 99 99 LYS H H 1 8.961 0.020 . 1 . . . . 99 LYS H . 17389 1 1039 . 1 1 99 99 LYS HA H 1 3.775 0.020 . 1 . . . . 99 LYS HA . 17389 1 1040 . 1 1 99 99 LYS HB2 H 1 1.627 0.020 . 2 . . . . 99 LYS HB2 . 17389 1 1041 . 1 1 99 99 LYS HB3 H 1 1.510 0.020 . 2 . . . . 99 LYS HB3 . 17389 1 1042 . 1 1 99 99 LYS HG2 H 1 1.230 0.020 . 2 . . . . 99 LYS HG2 . 17389 1 1043 . 1 1 99 99 LYS HG3 H 1 1.231 0.020 . 2 . . . . 99 LYS HG3 . 17389 1 1044 . 1 1 99 99 LYS HD2 H 1 1.481 0.020 . 2 . . . . 99 LYS HD2 . 17389 1 1045 . 1 1 99 99 LYS HD3 H 1 1.567 0.020 . 2 . . . . 99 LYS HD3 . 17389 1 1046 . 1 1 99 99 LYS HE2 H 1 2.920 0.020 . 2 . . . . 99 LYS HE2 . 17389 1 1047 . 1 1 99 99 LYS HE3 H 1 2.857 0.020 . 2 . . . . 99 LYS HE3 . 17389 1 1048 . 1 1 99 99 LYS CA C 13 59.446 0.400 . 1 . . . . 99 LYS CA . 17389 1 1049 . 1 1 99 99 LYS CB C 13 31.393 0.400 . 1 . . . . 99 LYS CB . 17389 1 1050 . 1 1 99 99 LYS CG C 13 24.570 0.400 . 1 . . . . 99 LYS CG . 17389 1 1051 . 1 1 99 99 LYS CD C 13 28.885 0.400 . 1 . . . . 99 LYS CD . 17389 1 1052 . 1 1 99 99 LYS CE C 13 41.533 0.400 . 1 . . . . 99 LYS CE . 17389 1 1053 . 1 1 99 99 LYS N N 15 118.914 0.400 . 1 . . . . 99 LYS N . 17389 1 1054 . 1 1 100 100 ARG H H 1 7.308 0.020 . 1 . . . . 100 ARG H . 17389 1 1055 . 1 1 100 100 ARG HA H 1 4.171 0.020 . 1 . . . . 100 ARG HA . 17389 1 1056 . 1 1 100 100 ARG HB2 H 1 2.008 0.020 . 2 . . . . 100 ARG HB2 . 17389 1 1057 . 1 1 100 100 ARG HB3 H 1 1.961 0.020 . 2 . . . . 100 ARG HB3 . 17389 1 1058 . 1 1 100 100 ARG HG2 H 1 1.809 0.020 . 2 . . . . 100 ARG HG2 . 17389 1 1059 . 1 1 100 100 ARG HG3 H 1 1.681 0.020 . 2 . . . . 100 ARG HG3 . 17389 1 1060 . 1 1 100 100 ARG HD2 H 1 3.259 0.020 . 2 . . . . 100 ARG HD2 . 17389 1 1061 . 1 1 100 100 ARG HD3 H 1 3.258 0.020 . 2 . . . . 100 ARG HD3 . 17389 1 1062 . 1 1 100 100 ARG CA C 13 58.843 0.400 . 1 . . . . 100 ARG CA . 17389 1 1063 . 1 1 100 100 ARG CB C 13 29.889 0.400 . 1 . . . . 100 ARG CB . 17389 1 1064 . 1 1 100 100 ARG CG C 13 27.552 0.400 . 1 . . . . 100 ARG CG . 17389 1 1065 . 1 1 100 100 ARG CD C 13 43.411 0.400 . 1 . . . . 100 ARG CD . 17389 1 1066 . 1 1 100 100 ARG N N 15 119.492 0.400 . 1 . . . . 100 ARG N . 17389 1 1067 . 1 1 101 101 GLU H H 1 7.750 0.020 . 1 . . . . 101 GLU H . 17389 1 1068 . 1 1 101 101 GLU HA H 1 3.932 0.020 . 1 . . . . 101 GLU HA . 17389 1 1069 . 1 1 101 101 GLU HB2 H 1 1.982 0.020 . 2 . . . . 101 GLU HB2 . 17389 1 1070 . 1 1 101 101 GLU HB3 H 1 1.983 0.020 . 2 . . . . 101 GLU HB3 . 17389 1 1071 . 1 1 101 101 GLU HG2 H 1 2.162 0.020 . 2 . . . . 101 GLU HG2 . 17389 1 1072 . 1 1 101 101 GLU HG3 H 1 2.579 0.020 . 2 . . . . 101 GLU HG3 . 17389 1 1073 . 1 1 101 101 GLU CA C 13 58.948 0.400 . 1 . . . . 101 GLU CA . 17389 1 1074 . 1 1 101 101 GLU CB C 13 29.915 0.400 . 1 . . . . 101 GLU CB . 17389 1 1075 . 1 1 101 101 GLU CG C 13 36.653 0.400 . 1 . . . . 101 GLU CG . 17389 1 1076 . 1 1 101 101 GLU N N 15 120.604 0.400 . 1 . . . . 101 GLU N . 17389 1 1077 . 1 1 102 102 LEU H H 1 9.256 0.020 . 1 . . . . 102 LEU H . 17389 1 1078 . 1 1 102 102 LEU HA H 1 4.092 0.020 . 1 . . . . 102 LEU HA . 17389 1 1079 . 1 1 102 102 LEU HB2 H 1 1.480 0.020 . 2 . . . . 102 LEU HB2 . 17389 1 1080 . 1 1 102 102 LEU HB3 H 1 2.072 0.020 . 2 . . . . 102 LEU HB3 . 17389 1 1081 . 1 1 102 102 LEU HG H 1 1.634 0.020 . 1 . . . . 102 LEU HG . 17389 1 1082 . 1 1 102 102 LEU HD11 H 1 0.822 0.020 . 2 . . . . 102 LEU HD1 . 17389 1 1083 . 1 1 102 102 LEU HD12 H 1 0.822 0.020 . 2 . . . . 102 LEU HD1 . 17389 1 1084 . 1 1 102 102 LEU HD13 H 1 0.822 0.020 . 2 . . . . 102 LEU HD1 . 17389 1 1085 . 1 1 102 102 LEU HD21 H 1 0.931 0.020 . 2 . . . . 102 LEU HD2 . 17389 1 1086 . 1 1 102 102 LEU HD22 H 1 0.931 0.020 . 2 . . . . 102 LEU HD2 . 17389 1 1087 . 1 1 102 102 LEU HD23 H 1 0.931 0.020 . 2 . . . . 102 LEU HD2 . 17389 1 1088 . 1 1 102 102 LEU CA C 13 57.723 0.400 . 1 . . . . 102 LEU CA . 17389 1 1089 . 1 1 102 102 LEU CB C 13 41.325 0.400 . 1 . . . . 102 LEU CB . 17389 1 1090 . 1 1 102 102 LEU CG C 13 26.799 0.400 . 1 . . . . 102 LEU CG . 17389 1 1091 . 1 1 102 102 LEU CD1 C 13 24.451 0.400 . 1 . . . . 102 LEU CD1 . 17389 1 1092 . 1 1 102 102 LEU CD2 C 13 27.016 0.400 . 1 . . . . 102 LEU CD2 . 17389 1 1093 . 1 1 102 102 LEU N N 15 121.350 0.400 . 1 . . . . 102 LEU N . 17389 1 1094 . 1 1 103 103 GLN H H 1 8.248 0.020 . 1 . . . . 103 GLN H . 17389 1 1095 . 1 1 103 103 GLN HA H 1 4.041 0.020 . 1 . . . . 103 GLN HA . 17389 1 1096 . 1 1 103 103 GLN HB2 H 1 2.141 0.020 . 2 . . . . 103 GLN HB2 . 17389 1 1097 . 1 1 103 103 GLN HB3 H 1 2.327 0.020 . 2 . . . . 103 GLN HB3 . 17389 1 1098 . 1 1 103 103 GLN HG2 H 1 2.497 0.020 . 2 . . . . 103 GLN HG2 . 17389 1 1099 . 1 1 103 103 GLN HG3 H 1 2.413 0.020 . 2 . . . . 103 GLN HG3 . 17389 1 1100 . 1 1 103 103 GLN HE21 H 1 6.912 0.020 . 2 . . . . 103 GLN HE21 . 17389 1 1101 . 1 1 103 103 GLN HE22 H 1 8.055 0.020 . 2 . . . . 103 GLN HE22 . 17389 1 1102 . 1 1 103 103 GLN CA C 13 58.352 0.400 . 1 . . . . 103 GLN CA . 17389 1 1103 . 1 1 103 103 GLN CB C 13 28.140 0.400 . 1 . . . . 103 GLN CB . 17389 1 1104 . 1 1 103 103 GLN CG C 13 33.370 0.400 . 1 . . . . 103 GLN CG . 17389 1 1105 . 1 1 103 103 GLN N N 15 119.587 0.400 . 1 . . . . 103 GLN N . 17389 1 1106 . 1 1 103 103 GLN NE2 N 15 115.610 0.400 . 1 . . . . 103 GLN NE2 . 17389 1 1107 . 1 1 104 104 ARG H H 1 7.028 0.020 . 1 . . . . 104 ARG H . 17389 1 1108 . 1 1 104 104 ARG HA H 1 4.212 0.020 . 1 . . . . 104 ARG HA . 17389 1 1109 . 1 1 104 104 ARG HB2 H 1 2.011 0.020 . 2 . . . . 104 ARG HB2 . 17389 1 1110 . 1 1 104 104 ARG HB3 H 1 1.898 0.020 . 2 . . . . 104 ARG HB3 . 17389 1 1111 . 1 1 104 104 ARG HG2 H 1 1.796 0.020 . 2 . . . . 104 ARG HG2 . 17389 1 1112 . 1 1 104 104 ARG HG3 H 1 1.701 0.020 . 2 . . . . 104 ARG HG3 . 17389 1 1113 . 1 1 104 104 ARG HD2 H 1 3.324 0.020 . 2 . . . . 104 ARG HD2 . 17389 1 1114 . 1 1 104 104 ARG HD3 H 1 3.257 0.020 . 2 . . . . 104 ARG HD3 . 17389 1 1115 . 1 1 104 104 ARG CA C 13 59.189 0.400 . 1 . . . . 104 ARG CA . 17389 1 1116 . 1 1 104 104 ARG CB C 13 29.943 0.400 . 1 . . . . 104 ARG CB . 17389 1 1117 . 1 1 104 104 ARG CG C 13 27.253 0.400 . 1 . . . . 104 ARG CG . 17389 1 1118 . 1 1 104 104 ARG CD C 13 43.043 0.400 . 1 . . . . 104 ARG CD . 17389 1 1119 . 1 1 104 104 ARG N N 15 114.315 0.400 . 1 . . . . 104 ARG N . 17389 1 1120 . 1 1 105 105 VAL H H 1 7.090 0.020 . 1 . . . . 105 VAL H . 17389 1 1121 . 1 1 105 105 VAL HA H 1 3.786 0.020 . 1 . . . . 105 VAL HA . 17389 1 1122 . 1 1 105 105 VAL HB H 1 2.362 0.020 . 1 . . . . 105 VAL HB . 17389 1 1123 . 1 1 105 105 VAL HG11 H 1 1.098 0.020 . 2 . . . . 105 VAL HG1 . 17389 1 1124 . 1 1 105 105 VAL HG12 H 1 1.098 0.020 . 2 . . . . 105 VAL HG1 . 17389 1 1125 . 1 1 105 105 VAL HG13 H 1 1.098 0.020 . 2 . . . . 105 VAL HG1 . 17389 1 1126 . 1 1 105 105 VAL HG21 H 1 1.113 0.020 . 2 . . . . 105 VAL HG2 . 17389 1 1127 . 1 1 105 105 VAL HG22 H 1 1.113 0.020 . 2 . . . . 105 VAL HG2 . 17389 1 1128 . 1 1 105 105 VAL HG23 H 1 1.113 0.020 . 2 . . . . 105 VAL HG2 . 17389 1 1129 . 1 1 105 105 VAL CA C 13 65.916 0.400 . 1 . . . . 105 VAL CA . 17389 1 1130 . 1 1 105 105 VAL CB C 13 31.616 0.400 . 1 . . . . 105 VAL CB . 17389 1 1131 . 1 1 105 105 VAL CG1 C 13 23.578 0.400 . 1 . . . . 105 VAL CG1 . 17389 1 1132 . 1 1 105 105 VAL CG2 C 13 21.732 0.400 . 1 . . . . 105 VAL CG2 . 17389 1 1133 . 1 1 105 105 VAL N N 15 116.596 0.400 . 1 . . . . 105 VAL N . 17389 1 1134 . 1 1 106 106 GLU H H 1 9.096 0.020 . 1 . . . . 106 GLU H . 17389 1 1135 . 1 1 106 106 GLU HA H 1 4.082 0.020 . 1 . . . . 106 GLU HA . 17389 1 1136 . 1 1 106 106 GLU HB2 H 1 2.122 0.020 . 2 . . . . 106 GLU HB2 . 17389 1 1137 . 1 1 106 106 GLU HB3 H 1 2.123 0.020 . 2 . . . . 106 GLU HB3 . 17389 1 1138 . 1 1 106 106 GLU HG2 H 1 2.350 0.020 . 2 . . . . 106 GLU HG2 . 17389 1 1139 . 1 1 106 106 GLU HG3 H 1 2.246 0.020 . 2 . . . . 106 GLU HG3 . 17389 1 1140 . 1 1 106 106 GLU CA C 13 60.540 0.400 . 1 . . . . 106 GLU CA . 17389 1 1141 . 1 1 106 106 GLU CB C 13 29.705 0.400 . 1 . . . . 106 GLU CB . 17389 1 1142 . 1 1 106 106 GLU CG C 13 37.580 0.400 . 1 . . . . 106 GLU CG . 17389 1 1143 . 1 1 106 106 GLU N N 15 121.787 0.400 . 1 . . . . 106 GLU N . 17389 1 1144 . 1 1 107 107 ASP H H 1 8.986 0.020 . 1 . . . . 107 ASP H . 17389 1 1145 . 1 1 107 107 ASP HA H 1 4.455 0.020 . 1 . . . . 107 ASP HA . 17389 1 1146 . 1 1 107 107 ASP HB2 H 1 2.662 0.020 . 2 . . . . 107 ASP HB2 . 17389 1 1147 . 1 1 107 107 ASP HB3 H 1 2.920 0.020 . 2 . . . . 107 ASP HB3 . 17389 1 1148 . 1 1 107 107 ASP CA C 13 57.380 0.400 . 1 . . . . 107 ASP CA . 17389 1 1149 . 1 1 107 107 ASP CB C 13 39.414 0.400 . 1 . . . . 107 ASP CB . 17389 1 1150 . 1 1 107 107 ASP N N 15 121.131 0.400 . 1 . . . . 107 ASP N . 17389 1 1151 . 1 1 108 108 SER H H 1 7.555 0.020 . 1 . . . . 108 SER H . 17389 1 1152 . 1 1 108 108 SER HA H 1 3.433 0.020 . 1 . . . . 108 SER HA . 17389 1 1153 . 1 1 108 108 SER HB2 H 1 4.091 0.020 . 2 . . . . 108 SER HB2 . 17389 1 1154 . 1 1 108 108 SER HB3 H 1 4.181 0.020 . 2 . . . . 108 SER HB3 . 17389 1 1155 . 1 1 108 108 SER CA C 13 61.963 0.400 . 1 . . . . 108 SER CA . 17389 1 1156 . 1 1 108 108 SER CB C 13 62.200 0.400 . 1 . . . . 108 SER CB . 17389 1 1157 . 1 1 108 108 SER N N 15 116.815 0.400 . 1 . . . . 108 SER N . 17389 1 1158 . 1 1 109 109 HIS H H 1 8.841 0.020 . 1 . . . . 109 HIS H . 17389 1 1159 . 1 1 109 109 HIS HA H 1 4.061 0.020 . 1 . . . . 109 HIS HA . 17389 1 1160 . 1 1 109 109 HIS HB2 H 1 3.074 0.020 . 2 . . . . 109 HIS HB2 . 17389 1 1161 . 1 1 109 109 HIS HB3 H 1 3.481 0.020 . 2 . . . . 109 HIS HB3 . 17389 1 1162 . 1 1 109 109 HIS HD2 H 1 6.905 0.020 . 1 . . . . 109 HIS HD2 . 17389 1 1163 . 1 1 109 109 HIS CA C 13 60.788 0.400 . 1 . . . . 109 HIS CA . 17389 1 1164 . 1 1 109 109 HIS CB C 13 30.967 0.400 . 1 . . . . 109 HIS CB . 17389 1 1165 . 1 1 109 109 HIS CD2 C 13 119.323 0.400 . 1 . . . . 109 HIS CD2 . 17389 1 1166 . 1 1 109 109 HIS N N 15 122.169 0.400 . 1 . . . . 109 HIS N . 17389 1 1167 . 1 1 110 110 GLN H H 1 8.520 0.020 . 1 . . . . 110 GLN H . 17389 1 1168 . 1 1 110 110 GLN HA H 1 3.832 0.020 . 1 . . . . 110 GLN HA . 17389 1 1169 . 1 1 110 110 GLN HB2 H 1 2.273 0.020 . 2 . . . . 110 GLN HB2 . 17389 1 1170 . 1 1 110 110 GLN HB3 H 1 2.273 0.020 . 2 . . . . 110 GLN HB3 . 17389 1 1171 . 1 1 110 110 GLN HG2 H 1 2.574 0.020 . 2 . . . . 110 GLN HG2 . 17389 1 1172 . 1 1 110 110 GLN HG3 H 1 2.486 0.020 . 2 . . . . 110 GLN HG3 . 17389 1 1173 . 1 1 110 110 GLN HE21 H 1 7.605 0.020 . 2 . . . . 110 GLN HE21 . 17389 1 1174 . 1 1 110 110 GLN HE22 H 1 6.849 0.020 . 2 . . . . 110 GLN HE22 . 17389 1 1175 . 1 1 110 110 GLN CA C 13 59.360 0.400 . 1 . . . . 110 GLN CA . 17389 1 1176 . 1 1 110 110 GLN CB C 13 27.727 0.400 . 1 . . . . 110 GLN CB . 17389 1 1177 . 1 1 110 110 GLN CG C 13 33.663 0.400 . 1 . . . . 110 GLN CG . 17389 1 1178 . 1 1 110 110 GLN N N 15 119.547 0.400 . 1 . . . . 110 GLN N . 17389 1 1179 . 1 1 110 110 GLN NE2 N 15 112.147 0.400 . 1 . . . . 110 GLN NE2 . 17389 1 1180 . 1 1 111 111 ILE H H 1 7.231 0.020 . 1 . . . . 111 ILE H . 17389 1 1181 . 1 1 111 111 ILE HA H 1 3.901 0.020 . 1 . . . . 111 ILE HA . 17389 1 1182 . 1 1 111 111 ILE HB H 1 1.911 0.020 . 1 . . . . 111 ILE HB . 17389 1 1183 . 1 1 111 111 ILE HG12 H 1 1.798 0.020 . 2 . . . . 111 ILE HG12 . 17389 1 1184 . 1 1 111 111 ILE HG13 H 1 1.158 0.020 . 2 . . . . 111 ILE HG13 . 17389 1 1185 . 1 1 111 111 ILE HG21 H 1 0.894 0.020 . 1 . . . . 111 ILE HG2 . 17389 1 1186 . 1 1 111 111 ILE HG22 H 1 0.894 0.020 . 1 . . . . 111 ILE HG2 . 17389 1 1187 . 1 1 111 111 ILE HG23 H 1 0.894 0.020 . 1 . . . . 111 ILE HG2 . 17389 1 1188 . 1 1 111 111 ILE HD11 H 1 0.888 0.020 . 1 . . . . 111 ILE HD1 . 17389 1 1189 . 1 1 111 111 ILE HD12 H 1 0.888 0.020 . 1 . . . . 111 ILE HD1 . 17389 1 1190 . 1 1 111 111 ILE HD13 H 1 0.888 0.020 . 1 . . . . 111 ILE HD1 . 17389 1 1191 . 1 1 111 111 ILE CA C 13 64.409 0.400 . 1 . . . . 111 ILE CA . 17389 1 1192 . 1 1 111 111 ILE CB C 13 38.319 0.400 . 1 . . . . 111 ILE CB . 17389 1 1193 . 1 1 111 111 ILE CG1 C 13 28.366 0.400 . 1 . . . . 111 ILE CG1 . 17389 1 1194 . 1 1 111 111 ILE CG2 C 13 17.621 0.400 . 1 . . . . 111 ILE CG2 . 17389 1 1195 . 1 1 111 111 ILE CD1 C 13 13.118 0.400 . 1 . . . . 111 ILE CD1 . 17389 1 1196 . 1 1 111 111 ILE N N 15 118.836 0.400 . 1 . . . . 111 ILE N . 17389 1 1197 . 1 1 112 112 LEU H H 1 8.616 0.020 . 1 . . . . 112 LEU H . 17389 1 1198 . 1 1 112 112 LEU HA H 1 3.832 0.020 . 1 . . . . 112 LEU HA . 17389 1 1199 . 1 1 112 112 LEU HB2 H 1 0.886 0.020 . 2 . . . . 112 LEU HB2 . 17389 1 1200 . 1 1 112 112 LEU HB3 H 1 1.541 0.020 . 2 . . . . 112 LEU HB3 . 17389 1 1201 . 1 1 112 112 LEU HG H 1 1.604 0.020 . 1 . . . . 112 LEU HG . 17389 1 1202 . 1 1 112 112 LEU HD11 H 1 0.462 0.020 . 2 . . . . 112 LEU HD1 . 17389 1 1203 . 1 1 112 112 LEU HD12 H 1 0.462 0.020 . 2 . . . . 112 LEU HD1 . 17389 1 1204 . 1 1 112 112 LEU HD13 H 1 0.462 0.020 . 2 . . . . 112 LEU HD1 . 17389 1 1205 . 1 1 112 112 LEU HD21 H 1 -0.193 0.020 . 2 . . . . 112 LEU HD2 . 17389 1 1206 . 1 1 112 112 LEU HD22 H 1 -0.193 0.020 . 2 . . . . 112 LEU HD2 . 17389 1 1207 . 1 1 112 112 LEU HD23 H 1 -0.193 0.020 . 2 . . . . 112 LEU HD2 . 17389 1 1208 . 1 1 112 112 LEU CA C 13 57.709 0.400 . 1 . . . . 112 LEU CA . 17389 1 1209 . 1 1 112 112 LEU CB C 13 38.956 0.400 . 1 . . . . 112 LEU CB . 17389 1 1210 . 1 1 112 112 LEU CG C 13 25.434 0.400 . 1 . . . . 112 LEU CG . 17389 1 1211 . 1 1 112 112 LEU CD1 C 13 25.498 0.400 . 1 . . . . 112 LEU CD1 . 17389 1 1212 . 1 1 112 112 LEU CD2 C 13 22.142 0.400 . 1 . . . . 112 LEU CD2 . 17389 1 1213 . 1 1 112 112 LEU N N 15 121.787 0.400 . 1 . . . . 112 LEU N . 17389 1 1214 . 1 1 113 113 SER H H 1 8.865 0.020 . 1 . . . . 113 SER H . 17389 1 1215 . 1 1 113 113 SER HA H 1 4.159 0.020 . 1 . . . . 113 SER HA . 17389 1 1216 . 1 1 113 113 SER HB2 H 1 3.646 0.020 . 2 . . . . 113 SER HB2 . 17389 1 1217 . 1 1 113 113 SER HB3 H 1 3.647 0.020 . 2 . . . . 113 SER HB3 . 17389 1 1218 . 1 1 113 113 SER CA C 13 61.085 0.400 . 1 . . . . 113 SER CA . 17389 1 1219 . 1 1 113 113 SER CB C 13 62.489 0.400 . 1 . . . . 113 SER CB . 17389 1 1220 . 1 1 113 113 SER N N 15 114.301 0.400 . 1 . . . . 113 SER N . 17389 1 1221 . 1 1 114 114 GLN H H 1 7.860 0.020 . 1 . . . . 114 GLN H . 17389 1 1222 . 1 1 114 114 GLN HA H 1 4.060 0.020 . 1 . . . . 114 GLN HA . 17389 1 1223 . 1 1 114 114 GLN HB2 H 1 2.186 0.020 . 2 . . . . 114 GLN HB2 . 17389 1 1224 . 1 1 114 114 GLN HB3 H 1 2.291 0.020 . 2 . . . . 114 GLN HB3 . 17389 1 1225 . 1 1 114 114 GLN HG2 H 1 2.436 0.020 . 2 . . . . 114 GLN HG2 . 17389 1 1226 . 1 1 114 114 GLN HG3 H 1 2.398 0.020 . 2 . . . . 114 GLN HG3 . 17389 1 1227 . 1 1 114 114 GLN HE21 H 1 6.739 0.020 . 2 . . . . 114 GLN HE21 . 17389 1 1228 . 1 1 114 114 GLN HE22 H 1 7.847 0.020 . 2 . . . . 114 GLN HE22 . 17389 1 1229 . 1 1 114 114 GLN CA C 13 58.858 0.400 . 1 . . . . 114 GLN CA . 17389 1 1230 . 1 1 114 114 GLN CB C 13 28.625 0.400 . 1 . . . . 114 GLN CB . 17389 1 1231 . 1 1 114 114 GLN CG C 13 33.216 0.400 . 1 . . . . 114 GLN CG . 17389 1 1232 . 1 1 114 114 GLN N N 15 122.169 0.400 . 1 . . . . 114 GLN N . 17389 1 1233 . 1 1 114 114 GLN NE2 N 15 114.691 0.400 . 1 . . . . 114 GLN NE2 . 17389 1 1234 . 1 1 115 115 THR H H 1 8.456 0.020 . 1 . . . . 115 THR H . 17389 1 1235 . 1 1 115 115 THR HA H 1 4.162 0.020 . 1 . . . . 115 THR HA . 17389 1 1236 . 1 1 115 115 THR HB H 1 4.348 0.020 . 1 . . . . 115 THR HB . 17389 1 1237 . 1 1 115 115 THR HG1 H 1 4.470 0.020 . 1 . . . . 115 THR HG1 . 17389 1 1238 . 1 1 115 115 THR HG21 H 1 1.496 0.020 . 1 . . . . 115 THR HG2 . 17389 1 1239 . 1 1 115 115 THR HG22 H 1 1.496 0.020 . 1 . . . . 115 THR HG2 . 17389 1 1240 . 1 1 115 115 THR HG23 H 1 1.496 0.020 . 1 . . . . 115 THR HG2 . 17389 1 1241 . 1 1 115 115 THR CA C 13 65.751 0.400 . 1 . . . . 115 THR CA . 17389 1 1242 . 1 1 115 115 THR CB C 13 68.782 0.400 . 1 . . . . 115 THR CB . 17389 1 1243 . 1 1 115 115 THR CG2 C 13 23.782 0.400 . 1 . . . . 115 THR CG2 . 17389 1 1244 . 1 1 115 115 THR N N 15 111.487 0.400 . 1 . . . . 115 THR N . 17389 1 1245 . 1 1 116 116 SER H H 1 8.452 0.020 . 1 . . . . 116 SER H . 17389 1 1246 . 1 1 116 116 SER HA H 1 4.125 0.020 . 1 . . . . 116 SER HA . 17389 1 1247 . 1 1 116 116 SER HB2 H 1 4.110 0.020 . 2 . . . . 116 SER HB2 . 17389 1 1248 . 1 1 116 116 SER HB3 H 1 4.110 0.020 . 2 . . . . 116 SER HB3 . 17389 1 1249 . 1 1 116 116 SER CA C 13 61.634 0.400 . 1 . . . . 116 SER CA . 17389 1 1250 . 1 1 116 116 SER CB C 13 62.635 0.400 . 1 . . . . 116 SER CB . 17389 1 1251 . 1 1 116 116 SER N N 15 115.886 0.400 . 1 . . . . 116 SER N . 17389 1 1252 . 1 1 117 117 HIS H H 1 8.183 0.020 . 1 . . . . 117 HIS H . 17389 1 1253 . 1 1 117 117 HIS HA H 1 4.372 0.020 . 1 . . . . 117 HIS HA . 17389 1 1254 . 1 1 117 117 HIS HB2 H 1 3.396 0.020 . 2 . . . . 117 HIS HB2 . 17389 1 1255 . 1 1 117 117 HIS HB3 H 1 3.539 0.020 . 2 . . . . 117 HIS HB3 . 17389 1 1256 . 1 1 117 117 HIS HD2 H 1 7.257 0.020 . 1 . . . . 117 HIS HD2 . 17389 1 1257 . 1 1 117 117 HIS HE1 H 1 8.162 0.020 . 1 . . . . 117 HIS HE1 . 17389 1 1258 . 1 1 117 117 HIS CA C 13 59.943 0.400 . 1 . . . . 117 HIS CA . 17389 1 1259 . 1 1 117 117 HIS CB C 13 28.704 0.400 . 1 . . . . 117 HIS CB . 17389 1 1260 . 1 1 117 117 HIS CD2 C 13 121.088 0.400 . 1 . . . . 117 HIS CD2 . 17389 1 1261 . 1 1 117 117 HIS N N 15 121.186 0.400 . 1 . . . . 117 HIS N . 17389 1 1262 . 1 1 118 118 ASP H H 1 8.415 0.020 . 1 . . . . 118 ASP H . 17389 1 1263 . 1 1 118 118 ASP HA H 1 4.371 0.020 . 1 . . . . 118 ASP HA . 17389 1 1264 . 1 1 118 118 ASP HB2 H 1 2.657 0.020 . 2 . . . . 118 ASP HB2 . 17389 1 1265 . 1 1 118 118 ASP HB3 H 1 2.701 0.020 . 2 . . . . 118 ASP HB3 . 17389 1 1266 . 1 1 118 118 ASP CA C 13 57.513 0.400 . 1 . . . . 118 ASP CA . 17389 1 1267 . 1 1 118 118 ASP CB C 13 39.384 0.400 . 1 . . . . 118 ASP CB . 17389 1 1268 . 1 1 118 118 ASP N N 15 121.868 0.400 . 1 . . . . 118 ASP N . 17389 1 1269 . 1 1 119 119 LEU H H 1 8.377 0.020 . 1 . . . . 119 LEU H . 17389 1 1270 . 1 1 119 119 LEU HA H 1 3.633 0.020 . 1 . . . . 119 LEU HA . 17389 1 1271 . 1 1 119 119 LEU HB2 H 1 -0.439 0.020 . 2 . . . . 119 LEU HB2 . 17389 1 1272 . 1 1 119 119 LEU HB3 H 1 1.504 0.020 . 2 . . . . 119 LEU HB3 . 17389 1 1273 . 1 1 119 119 LEU HG H 1 1.378 0.020 . 1 . . . . 119 LEU HG . 17389 1 1274 . 1 1 119 119 LEU HD11 H 1 0.276 0.020 . 2 . . . . 119 LEU HD1 . 17389 1 1275 . 1 1 119 119 LEU HD12 H 1 0.276 0.020 . 2 . . . . 119 LEU HD1 . 17389 1 1276 . 1 1 119 119 LEU HD13 H 1 0.276 0.020 . 2 . . . . 119 LEU HD1 . 17389 1 1277 . 1 1 119 119 LEU HD21 H 1 0.165 0.020 . 2 . . . . 119 LEU HD2 . 17389 1 1278 . 1 1 119 119 LEU HD22 H 1 0.165 0.020 . 2 . . . . 119 LEU HD2 . 17389 1 1279 . 1 1 119 119 LEU HD23 H 1 0.165 0.020 . 2 . . . . 119 LEU HD2 . 17389 1 1280 . 1 1 119 119 LEU CA C 13 57.754 0.400 . 1 . . . . 119 LEU CA . 17389 1 1281 . 1 1 119 119 LEU CB C 13 40.776 0.400 . 1 . . . . 119 LEU CB . 17389 1 1282 . 1 1 119 119 LEU CG C 13 26.261 0.400 . 1 . . . . 119 LEU CG . 17389 1 1283 . 1 1 119 119 LEU CD1 C 13 24.043 0.400 . 1 . . . . 119 LEU CD1 . 17389 1 1284 . 1 1 119 119 LEU CD2 C 13 23.941 0.400 . 1 . . . . 119 LEU CD2 . 17389 1 1285 . 1 1 119 119 LEU N N 15 124.563 0.400 . 1 . . . . 119 LEU N . 17389 1 1286 . 1 1 120 120 ASN H H 1 8.160 0.020 . 1 . . . . 120 ASN H . 17389 1 1287 . 1 1 120 120 ASN HA H 1 4.588 0.020 . 1 . . . . 120 ASN HA . 17389 1 1288 . 1 1 120 120 ASN HB2 H 1 2.884 0.020 . 2 . . . . 120 ASN HB2 . 17389 1 1289 . 1 1 120 120 ASN HB3 H 1 3.106 0.020 . 2 . . . . 120 ASN HB3 . 17389 1 1290 . 1 1 120 120 ASN HD21 H 1 7.380 0.020 . 2 . . . . 120 ASN HD21 . 17389 1 1291 . 1 1 120 120 ASN HD22 H 1 7.706 0.020 . 2 . . . . 120 ASN HD22 . 17389 1 1292 . 1 1 120 120 ASN CA C 13 56.098 0.400 . 1 . . . . 120 ASN CA . 17389 1 1293 . 1 1 120 120 ASN CB C 13 37.632 0.400 . 1 . . . . 120 ASN CB . 17389 1 1294 . 1 1 120 120 ASN N N 15 117.963 0.400 . 1 . . . . 120 ASN N . 17389 1 1295 . 1 1 120 120 ASN ND2 N 15 114.740 0.400 . 1 . . . . 120 ASN ND2 . 17389 1 1296 . 1 1 121 121 GLU H H 1 8.532 0.020 . 1 . . . . 121 GLU H . 17389 1 1297 . 1 1 121 121 GLU HA H 1 4.047 0.020 . 1 . . . . 121 GLU HA . 17389 1 1298 . 1 1 121 121 GLU HB2 H 1 2.110 0.020 . 2 . . . . 121 GLU HB2 . 17389 1 1299 . 1 1 121 121 GLU HB3 H 1 2.043 0.020 . 2 . . . . 121 GLU HB3 . 17389 1 1300 . 1 1 121 121 GLU HG2 H 1 2.177 0.020 . 2 . . . . 121 GLU HG2 . 17389 1 1301 . 1 1 121 121 GLU HG3 H 1 2.088 0.020 . 2 . . . . 121 GLU HG3 . 17389 1 1302 . 1 1 121 121 GLU CA C 13 58.941 0.400 . 1 . . . . 121 GLU CA . 17389 1 1303 . 1 1 121 121 GLU CB C 13 29.280 0.400 . 1 . . . . 121 GLU CB . 17389 1 1304 . 1 1 121 121 GLU CG C 13 36.247 0.400 . 1 . . . . 121 GLU CG . 17389 1 1305 . 1 1 121 121 GLU N N 15 122.395 0.400 . 1 . . . . 121 GLU N . 17389 1 1306 . 1 1 122 122 CYS H H 1 7.317 0.020 . 1 . . . . 122 CYS H . 17389 1 1307 . 1 1 122 122 CYS HA H 1 4.997 0.020 . 1 . . . . 122 CYS HA . 17389 1 1308 . 1 1 122 122 CYS HB2 H 1 3.041 0.020 . 2 . . . . 122 CYS HB2 . 17389 1 1309 . 1 1 122 122 CYS HB3 H 1 3.128 0.020 . 2 . . . . 122 CYS HB3 . 17389 1 1310 . 1 1 122 122 CYS CA C 13 56.730 0.400 . 1 . . . . 122 CYS CA . 17389 1 1311 . 1 1 122 122 CYS CB C 13 27.181 0.400 . 1 . . . . 122 CYS CB . 17389 1 1312 . 1 1 122 122 CYS N N 15 113.384 0.400 . 1 . . . . 122 CYS N . 17389 1 1313 . 1 1 123 123 SER H H 1 8.269 0.020 . 1 . . . . 123 SER H . 17389 1 1314 . 1 1 123 123 SER HA H 1 4.223 0.020 . 1 . . . . 123 SER HA . 17389 1 1315 . 1 1 123 123 SER HB2 H 1 4.211 0.020 . 2 . . . . 123 SER HB2 . 17389 1 1316 . 1 1 123 123 SER HB3 H 1 4.070 0.020 . 2 . . . . 123 SER HB3 . 17389 1 1317 . 1 1 123 123 SER CA C 13 58.860 0.400 . 1 . . . . 123 SER CA . 17389 1 1318 . 1 1 123 123 SER CB C 13 61.228 0.400 . 1 . . . . 123 SER CB . 17389 1 1319 . 1 1 123 123 SER N N 15 116.432 0.400 . 1 . . . . 123 SER N . 17389 1 1320 . 1 1 124 124 TRP H H 1 8.373 0.020 . 1 . . . . 124 TRP H . 17389 1 1321 . 1 1 124 124 TRP HA H 1 3.269 0.020 . 1 . . . . 124 TRP HA . 17389 1 1322 . 1 1 124 124 TRP HB2 H 1 3.471 0.020 . 2 . . . . 124 TRP HB2 . 17389 1 1323 . 1 1 124 124 TRP HB3 H 1 2.983 0.020 . 2 . . . . 124 TRP HB3 . 17389 1 1324 . 1 1 124 124 TRP HD1 H 1 6.991 0.020 . 1 . . . . 124 TRP HD1 . 17389 1 1325 . 1 1 124 124 TRP HE1 H 1 10.220 0.020 . 1 . . . . 124 TRP HE1 . 17389 1 1326 . 1 1 124 124 TRP HE3 H 1 7.273 0.020 . 1 . . . . 124 TRP HE3 . 17389 1 1327 . 1 1 124 124 TRP HZ2 H 1 7.444 0.020 . 1 . . . . 124 TRP HZ2 . 17389 1 1328 . 1 1 124 124 TRP HZ3 H 1 6.794 0.020 . 1 . . . . 124 TRP HZ3 . 17389 1 1329 . 1 1 124 124 TRP HH2 H 1 6.792 0.020 . 1 . . . . 124 TRP HH2 . 17389 1 1330 . 1 1 124 124 TRP CA C 13 58.827 0.400 . 1 . . . . 124 TRP CA . 17389 1 1331 . 1 1 124 124 TRP CB C 13 24.265 0.400 . 1 . . . . 124 TRP CB . 17389 1 1332 . 1 1 124 124 TRP CD1 C 13 126.248 0.400 . 1 . . . . 124 TRP CD1 . 17389 1 1333 . 1 1 124 124 TRP CE3 C 13 93.343 0.400 . 1 . . . . 124 TRP CE3 . 17389 1 1334 . 1 1 124 124 TRP CZ2 C 13 115.202 0.400 . 1 . . . . 124 TRP CZ2 . 17389 1 1335 . 1 1 124 124 TRP CZ3 C 13 98.613 0.400 . 1 . . . . 124 TRP CZ3 . 17389 1 1336 . 1 1 124 124 TRP CH2 C 13 123.405 0.400 . 1 . . . . 124 TRP CH2 . 17389 1 1337 . 1 1 124 124 TRP N N 15 114.848 0.400 . 1 . . . . 124 TRP N . 17389 1 1338 . 1 1 124 124 TRP NE1 N 15 130.344 0.400 . 1 . . . . 124 TRP NE1 . 17389 1 1339 . 1 1 125 125 SER H H 1 6.792 0.020 . 1 . . . . 125 SER H . 17389 1 1340 . 1 1 125 125 SER HA H 1 4.320 0.020 . 1 . . . . 125 SER HA . 17389 1 1341 . 1 1 125 125 SER HB2 H 1 4.249 0.020 . 2 . . . . 125 SER HB2 . 17389 1 1342 . 1 1 125 125 SER HB3 H 1 3.756 0.020 . 2 . . . . 125 SER HB3 . 17389 1 1343 . 1 1 125 125 SER CA C 13 57.938 0.400 . 1 . . . . 125 SER CA . 17389 1 1344 . 1 1 125 125 SER CB C 13 64.126 0.400 . 1 . . . . 125 SER CB . 17389 1 1345 . 1 1 125 125 SER N N 15 108.892 0.400 . 1 . . . . 125 SER N . 17389 1 1346 . 1 1 126 126 LEU HA H 1 4.017 0.020 . 1 . . . . 126 LEU HA . 17389 1 1347 . 1 1 126 126 LEU HB2 H 1 1.573 0.020 . 2 . . . . 126 LEU HB2 . 17389 1 1348 . 1 1 126 126 LEU HB3 H 1 2.012 0.020 . 2 . . . . 126 LEU HB3 . 17389 1 1349 . 1 1 126 126 LEU HG H 1 1.910 0.020 . 1 . . . . 126 LEU HG . 17389 1 1350 . 1 1 126 126 LEU HD11 H 1 0.886 0.020 . 2 . . . . 126 LEU HD1 . 17389 1 1351 . 1 1 126 126 LEU HD12 H 1 0.886 0.020 . 2 . . . . 126 LEU HD1 . 17389 1 1352 . 1 1 126 126 LEU HD13 H 1 0.886 0.020 . 2 . . . . 126 LEU HD1 . 17389 1 1353 . 1 1 126 126 LEU HD21 H 1 0.763 0.020 . 2 . . . . 126 LEU HD2 . 17389 1 1354 . 1 1 126 126 LEU HD22 H 1 0.763 0.020 . 2 . . . . 126 LEU HD2 . 17389 1 1355 . 1 1 126 126 LEU HD23 H 1 0.763 0.020 . 2 . . . . 126 LEU HD2 . 17389 1 1356 . 1 1 126 126 LEU CA C 13 57.780 0.400 . 1 . . . . 126 LEU CA . 17389 1 1357 . 1 1 126 126 LEU CB C 13 41.374 0.400 . 1 . . . . 126 LEU CB . 17389 1 1358 . 1 1 126 126 LEU CG C 13 27.018 0.400 . 1 . . . . 126 LEU CG . 17389 1 1359 . 1 1 126 126 LEU CD1 C 13 25.058 0.400 . 1 . . . . 126 LEU CD1 . 17389 1 1360 . 1 1 126 126 LEU CD2 C 13 23.782 0.400 . 1 . . . . 126 LEU CD2 . 17389 1 1361 . 1 1 127 127 ASN HA H 1 4.502 0.020 . 1 . . . . 127 ASN HA . 17389 1 1362 . 1 1 127 127 ASN HB2 H 1 2.778 0.020 . 2 . . . . 127 ASN HB2 . 17389 1 1363 . 1 1 127 127 ASN HB3 H 1 2.778 0.020 . 2 . . . . 127 ASN HB3 . 17389 1 1364 . 1 1 127 127 ASN HD21 H 1 7.036 0.020 . 2 . . . . 127 ASN HD21 . 17389 1 1365 . 1 1 127 127 ASN HD22 H 1 7.649 0.020 . 2 . . . . 127 ASN HD22 . 17389 1 1366 . 1 1 127 127 ASN CA C 13 56.096 0.400 . 1 . . . . 127 ASN CA . 17389 1 1367 . 1 1 127 127 ASN CB C 13 37.678 0.400 . 1 . . . . 127 ASN CB . 17389 1 1368 . 1 1 127 127 ASN ND2 N 15 112.882 0.400 . 1 . . . . 127 ASN ND2 . 17389 1 1369 . 1 1 128 128 ILE H H 1 7.117 0.020 . 1 . . . . 128 ILE H . 17389 1 1370 . 1 1 128 128 ILE HA H 1 4.006 0.020 . 1 . . . . 128 ILE HA . 17389 1 1371 . 1 1 128 128 ILE HB H 1 1.842 0.020 . 1 . . . . 128 ILE HB . 17389 1 1372 . 1 1 128 128 ILE HG12 H 1 1.543 0.020 . 2 . . . . 128 ILE HG12 . 17389 1 1373 . 1 1 128 128 ILE HG13 H 1 1.293 0.020 . 2 . . . . 128 ILE HG13 . 17389 1 1374 . 1 1 128 128 ILE HG21 H 1 0.896 0.020 . 1 . . . . 128 ILE HG2 . 17389 1 1375 . 1 1 128 128 ILE HG22 H 1 0.896 0.020 . 1 . . . . 128 ILE HG2 . 17389 1 1376 . 1 1 128 128 ILE HG23 H 1 0.896 0.020 . 1 . . . . 128 ILE HG2 . 17389 1 1377 . 1 1 128 128 ILE HD11 H 1 0.907 0.020 . 1 . . . . 128 ILE HD1 . 17389 1 1378 . 1 1 128 128 ILE HD12 H 1 0.907 0.020 . 1 . . . . 128 ILE HD1 . 17389 1 1379 . 1 1 128 128 ILE HD13 H 1 0.907 0.020 . 1 . . . . 128 ILE HD1 . 17389 1 1380 . 1 1 128 128 ILE CA C 13 61.733 0.400 . 1 . . . . 128 ILE CA . 17389 1 1381 . 1 1 128 128 ILE CB C 13 38.838 0.400 . 1 . . . . 128 ILE CB . 17389 1 1382 . 1 1 128 128 ILE CG1 C 13 28.303 0.400 . 1 . . . . 128 ILE CG1 . 17389 1 1383 . 1 1 128 128 ILE CG2 C 13 17.092 0.400 . 1 . . . . 128 ILE CG2 . 17389 1 1384 . 1 1 128 128 ILE CD1 C 13 12.320 0.400 . 1 . . . . 128 ILE CD1 . 17389 1 1385 . 1 1 128 128 ILE N N 15 117.470 0.400 . 1 . . . . 128 ILE N . 17389 1 1386 . 1 1 129 129 LEU H H 1 8.306 0.020 . 1 . . . . 129 LEU H . 17389 1 1387 . 1 1 129 129 LEU HA H 1 4.025 0.020 . 1 . . . . 129 LEU HA . 17389 1 1388 . 1 1 129 129 LEU HB2 H 1 1.564 0.020 . 2 . . . . 129 LEU HB2 . 17389 1 1389 . 1 1 129 129 LEU HB3 H 1 1.297 0.020 . 2 . . . . 129 LEU HB3 . 17389 1 1390 . 1 1 129 129 LEU HG H 1 1.642 0.020 . 1 . . . . 129 LEU HG . 17389 1 1391 . 1 1 129 129 LEU HD11 H 1 0.603 0.020 . 2 . . . . 129 LEU HD1 . 17389 1 1392 . 1 1 129 129 LEU HD12 H 1 0.603 0.020 . 2 . . . . 129 LEU HD1 . 17389 1 1393 . 1 1 129 129 LEU HD13 H 1 0.603 0.020 . 2 . . . . 129 LEU HD1 . 17389 1 1394 . 1 1 129 129 LEU HD21 H 1 0.598 0.020 . 2 . . . . 129 LEU HD2 . 17389 1 1395 . 1 1 129 129 LEU HD22 H 1 0.598 0.020 . 2 . . . . 129 LEU HD2 . 17389 1 1396 . 1 1 129 129 LEU HD23 H 1 0.598 0.020 . 2 . . . . 129 LEU HD2 . 17389 1 1397 . 1 1 129 129 LEU CA C 13 55.656 0.400 . 1 . . . . 129 LEU CA . 17389 1 1398 . 1 1 129 129 LEU CB C 13 42.590 0.400 . 1 . . . . 129 LEU CB . 17389 1 1399 . 1 1 129 129 LEU CG C 13 27.100 0.400 . 1 . . . . 129 LEU CG . 17389 1 1400 . 1 1 129 129 LEU CD1 C 13 25.581 0.400 . 1 . . . . 129 LEU CD1 . 17389 1 1401 . 1 1 129 129 LEU CD2 C 13 22.383 0.400 . 1 . . . . 129 LEU CD2 . 17389 1 1402 . 1 1 129 129 LEU N N 15 115.885 0.400 . 1 . . . . 129 LEU N . 17389 1 1403 . 1 1 130 130 ALA H H 1 8.035 0.020 . 1 . . . . 130 ALA H . 17389 1 1404 . 1 1 130 130 ALA HA H 1 4.804 0.020 . 1 . . . . 130 ALA HA . 17389 1 1405 . 1 1 130 130 ALA HB1 H 1 1.458 0.020 . 1 . . . . 130 ALA HB . 17389 1 1406 . 1 1 130 130 ALA HB2 H 1 1.458 0.020 . 1 . . . . 130 ALA HB . 17389 1 1407 . 1 1 130 130 ALA HB3 H 1 1.458 0.020 . 1 . . . . 130 ALA HB . 17389 1 1408 . 1 1 130 130 ALA CA C 13 52.380 0.400 . 1 . . . . 130 ALA CA . 17389 1 1409 . 1 1 130 130 ALA CB C 13 21.049 0.400 . 1 . . . . 130 ALA CB . 17389 1 1410 . 1 1 130 130 ALA N N 15 118.845 0.400 . 1 . . . . 130 ALA N . 17389 1 1411 . 1 1 131 131 ILE H H 1 7.972 0.020 . 1 . . . . 131 ILE H . 17389 1 1412 . 1 1 131 131 ILE HA H 1 4.041 0.020 . 1 . . . . 131 ILE HA . 17389 1 1413 . 1 1 131 131 ILE HB H 1 1.995 0.020 . 1 . . . . 131 ILE HB . 17389 1 1414 . 1 1 131 131 ILE HG12 H 1 1.104 0.020 . 2 . . . . 131 ILE HG12 . 17389 1 1415 . 1 1 131 131 ILE HG13 H 1 1.542 0.020 . 2 . . . . 131 ILE HG13 . 17389 1 1416 . 1 1 131 131 ILE HG21 H 1 0.874 0.020 . 1 . . . . 131 ILE HG2 . 17389 1 1417 . 1 1 131 131 ILE HG22 H 1 0.874 0.020 . 1 . . . . 131 ILE HG2 . 17389 1 1418 . 1 1 131 131 ILE HG23 H 1 0.874 0.020 . 1 . . . . 131 ILE HG2 . 17389 1 1419 . 1 1 131 131 ILE HD11 H 1 0.798 0.020 . 1 . . . . 131 ILE HD1 . 17389 1 1420 . 1 1 131 131 ILE HD12 H 1 0.798 0.020 . 1 . . . . 131 ILE HD1 . 17389 1 1421 . 1 1 131 131 ILE HD13 H 1 0.798 0.020 . 1 . . . . 131 ILE HD1 . 17389 1 1422 . 1 1 131 131 ILE CA C 13 62.625 0.400 . 1 . . . . 131 ILE CA . 17389 1 1423 . 1 1 131 131 ILE CB C 13 38.118 0.400 . 1 . . . . 131 ILE CB . 17389 1 1424 . 1 1 131 131 ILE CG1 C 13 27.593 0.400 . 1 . . . . 131 ILE CG1 . 17389 1 1425 . 1 1 131 131 ILE CG2 C 13 16.883 0.400 . 1 . . . . 131 ILE CG2 . 17389 1 1426 . 1 1 131 131 ILE CD1 C 13 12.116 0.400 . 1 . . . . 131 ILE CD1 . 17389 1 1427 . 1 1 131 131 ILE N N 15 119.496 0.400 . 1 . . . . 131 ILE N . 17389 1 1428 . 1 1 132 132 ASN HA H 1 4.804 0.020 . 1 . . . . 132 ASN HA . 17389 1 1429 . 1 1 132 132 ASN HB2 H 1 2.921 0.020 . 2 . . . . 132 ASN HB2 . 17389 1 1430 . 1 1 132 132 ASN HB3 H 1 2.714 0.020 . 2 . . . . 132 ASN HB3 . 17389 1 1431 . 1 1 132 132 ASN HD21 H 1 6.917 0.020 . 2 . . . . 132 ASN HD21 . 17389 1 1432 . 1 1 132 132 ASN HD22 H 1 7.502 0.020 . 2 . . . . 132 ASN HD22 . 17389 1 1433 . 1 1 132 132 ASN CB C 13 38.092 0.400 . 1 . . . . 132 ASN CB . 17389 1 1434 . 1 1 132 132 ASN ND2 N 15 113.264 0.400 . 1 . . . . 132 ASN ND2 . 17389 1 1435 . 1 1 133 133 LYS H H 1 7.235 0.020 . 1 . . . . 133 LYS H . 17389 1 1436 . 1 1 133 133 LYS HA H 1 4.594 0.020 . 1 . . . . 133 LYS HA . 17389 1 1437 . 1 1 133 133 LYS HB2 H 1 1.622 0.020 . 2 . . . . 133 LYS HB2 . 17389 1 1438 . 1 1 133 133 LYS HB3 H 1 1.691 0.020 . 2 . . . . 133 LYS HB3 . 17389 1 1439 . 1 1 133 133 LYS HG2 H 1 1.397 0.020 . 2 . . . . 133 LYS HG2 . 17389 1 1440 . 1 1 133 133 LYS HG3 H 1 1.397 0.020 . 2 . . . . 133 LYS HG3 . 17389 1 1441 . 1 1 133 133 LYS HD2 H 1 1.618 0.020 . 2 . . . . 133 LYS HD2 . 17389 1 1442 . 1 1 133 133 LYS HD3 H 1 1.618 0.020 . 2 . . . . 133 LYS HD3 . 17389 1 1443 . 1 1 133 133 LYS HE2 H 1 2.889 0.020 . 2 . . . . 133 LYS HE2 . 17389 1 1444 . 1 1 133 133 LYS HE3 H 1 2.885 0.020 . 2 . . . . 133 LYS HE3 . 17389 1 1445 . 1 1 133 133 LYS CA C 13 53.952 0.400 . 1 . . . . 133 LYS CA . 17389 1 1446 . 1 1 133 133 LYS CB C 13 32.624 0.400 . 1 . . . . 133 LYS CB . 17389 1 1447 . 1 1 133 133 LYS CG C 13 23.965 0.400 . 1 . . . . 133 LYS CG . 17389 1 1448 . 1 1 133 133 LYS CD C 13 28.723 0.400 . 1 . . . . 133 LYS CD . 17389 1 1449 . 1 1 133 133 LYS CE C 13 41.875 0.400 . 1 . . . . 133 LYS CE . 17389 1 1450 . 1 1 133 133 LYS N N 15 121.867 0.400 . 1 . . . . 133 LYS N . 17389 1 1451 . 1 1 134 134 PRO HA H 1 4.428 0.020 . 1 . . . . 134 PRO HA . 17389 1 1452 . 1 1 134 134 PRO HB2 H 1 1.885 0.020 . 2 . . . . 134 PRO HB2 . 17389 1 1453 . 1 1 134 134 PRO HB3 H 1 2.343 0.020 . 2 . . . . 134 PRO HB3 . 17389 1 1454 . 1 1 134 134 PRO HG2 H 1 2.011 0.020 . 2 . . . . 134 PRO HG2 . 17389 1 1455 . 1 1 134 134 PRO HG3 H 1 2.079 0.020 . 2 . . . . 134 PRO HG3 . 17389 1 1456 . 1 1 134 134 PRO HD2 H 1 3.672 0.020 . 2 . . . . 134 PRO HD2 . 17389 1 1457 . 1 1 134 134 PRO HD3 H 1 4.003 0.020 . 2 . . . . 134 PRO HD3 . 17389 1 1458 . 1 1 134 134 PRO CA C 13 62.702 0.400 . 1 . . . . 134 PRO CA . 17389 1 1459 . 1 1 134 134 PRO CB C 13 31.891 0.400 . 1 . . . . 134 PRO CB . 17389 1 1460 . 1 1 134 134 PRO CG C 13 27.212 0.400 . 1 . . . . 134 PRO CG . 17389 1 1461 . 1 1 134 134 PRO CD C 13 50.854 0.400 . 1 . . . . 134 PRO CD . 17389 1 1462 . 1 1 135 135 GLN HA H 1 4.222 0.020 . 1 . . . . 135 GLN HA . 17389 1 1463 . 1 1 135 135 GLN HB2 H 1 2.001 0.020 . 2 . . . . 135 GLN HB2 . 17389 1 1464 . 1 1 135 135 GLN HB3 H 1 2.112 0.020 . 2 . . . . 135 GLN HB3 . 17389 1 1465 . 1 1 135 135 GLN HG2 H 1 2.429 0.020 . 2 . . . . 135 GLN HG2 . 17389 1 1466 . 1 1 135 135 GLN HG3 H 1 2.429 0.020 . 2 . . . . 135 GLN HG3 . 17389 1 1467 . 1 1 135 135 GLN HE21 H 1 6.946 0.020 . 2 . . . . 135 GLN HE21 . 17389 1 1468 . 1 1 135 135 GLN HE22 H 1 7.575 0.020 . 2 . . . . 135 GLN HE22 . 17389 1 1469 . 1 1 135 135 GLN CA C 13 56.357 0.400 . 1 . . . . 135 GLN CA . 17389 1 1470 . 1 1 135 135 GLN CB C 13 29.161 0.400 . 1 . . . . 135 GLN CB . 17389 1 1471 . 1 1 135 135 GLN CG C 13 33.639 0.400 . 1 . . . . 135 GLN CG . 17389 1 1472 . 1 1 135 135 GLN NE2 N 15 112.732 0.400 . 1 . . . . 135 GLN NE2 . 17389 1 1473 . 1 1 136 136 ASN HB2 H 1 2.902 0.020 . 2 . . . . 136 ASN HB2 . 17389 1 1474 . 1 1 136 136 ASN HB3 H 1 2.886 0.020 . 2 . . . . 136 ASN HB3 . 17389 1 1475 . 1 1 136 136 ASN HD21 H 1 7.640 0.020 . 2 . . . . 136 ASN HD21 . 17389 1 1476 . 1 1 136 136 ASN HD22 H 1 6.890 0.020 . 2 . . . . 136 ASN HD22 . 17389 1 1477 . 1 1 136 136 ASN ND2 N 15 112.571 0.400 . 1 . . . . 136 ASN ND2 . 17389 1 1478 . 1 1 137 137 LYS HA H 1 4.327 0.020 . 1 . . . . 137 LYS HA . 17389 1 1479 . 1 1 137 137 LYS HB2 H 1 1.837 0.020 . 2 . . . . 137 LYS HB2 . 17389 1 1480 . 1 1 137 137 LYS HB3 H 1 1.827 0.020 . 2 . . . . 137 LYS HB3 . 17389 1 1481 . 1 1 137 137 LYS HG2 H 1 1.422 0.020 . 2 . . . . 137 LYS HG2 . 17389 1 1482 . 1 1 137 137 LYS HG3 H 1 1.412 0.020 . 2 . . . . 137 LYS HG3 . 17389 1 1483 . 1 1 137 137 LYS HD2 H 1 1.652 0.020 . 2 . . . . 137 LYS HD2 . 17389 1 1484 . 1 1 137 137 LYS HD3 H 1 1.652 0.020 . 2 . . . . 137 LYS HD3 . 17389 1 1485 . 1 1 137 137 LYS HE2 H 1 2.972 0.020 . 2 . . . . 137 LYS HE2 . 17389 1 1486 . 1 1 137 137 LYS HE3 H 1 2.972 0.020 . 2 . . . . 137 LYS HE3 . 17389 1 1487 . 1 1 137 137 LYS CG C 13 24.853 0.400 . 1 . . . . 137 LYS CG . 17389 1 1488 . 1 1 137 137 LYS CD C 13 28.723 0.400 . 1 . . . . 137 LYS CD . 17389 1 1489 . 1 1 137 137 LYS CE C 13 41.723 0.400 . 1 . . . . 137 LYS CE . 17389 1 1490 . 1 1 139 139 ASP HA H 1 4.439 0.020 . 1 . . . . 139 ASP HA . 17389 1 1491 . 1 1 139 139 ASP HB2 H 1 2.310 0.020 . 2 . . . . 139 ASP HB2 . 17389 1 1492 . 1 1 139 139 ASP HB3 H 1 2.448 0.020 . 2 . . . . 139 ASP HB3 . 17389 1 1493 . 1 1 139 139 ASP CA C 13 51.722 0.400 . 1 . . . . 139 ASP CA . 17389 1 1494 . 1 1 139 139 ASP CB C 13 40.884 0.400 . 1 . . . . 139 ASP CB . 17389 1 1495 . 1 1 140 140 ASP H H 1 7.997 0.020 . 1 . . . . 140 ASP H . 17389 1 1496 . 1 1 140 140 ASP HA H 1 4.416 0.020 . 1 . . . . 140 ASP HA . 17389 1 1497 . 1 1 140 140 ASP HB2 H 1 2.617 0.020 . 2 . . . . 140 ASP HB2 . 17389 1 1498 . 1 1 140 140 ASP HB3 H 1 3.270 0.020 . 2 . . . . 140 ASP HB3 . 17389 1 1499 . 1 1 140 140 ASP CA C 13 58.170 0.400 . 1 . . . . 140 ASP CA . 17389 1 1500 . 1 1 140 140 ASP CB C 13 40.634 0.400 . 1 . . . . 140 ASP CB . 17389 1 1501 . 1 1 140 140 ASP N N 15 116.268 0.400 . 1 . . . . 140 ASP N . 17389 1 1502 . 1 1 141 141 LEU H H 1 7.539 0.020 . 1 . . . . 141 LEU H . 17389 1 1503 . 1 1 141 141 LEU HA H 1 4.272 0.020 . 1 . . . . 141 LEU HA . 17389 1 1504 . 1 1 141 141 LEU HB2 H 1 1.208 0.020 . 2 . . . . 141 LEU HB2 . 17389 1 1505 . 1 1 141 141 LEU HB3 H 1 1.918 0.020 . 2 . . . . 141 LEU HB3 . 17389 1 1506 . 1 1 141 141 LEU HG H 1 1.889 0.020 . 1 . . . . 141 LEU HG . 17389 1 1507 . 1 1 141 141 LEU HD11 H 1 1.132 0.020 . 2 . . . . 141 LEU HD1 . 17389 1 1508 . 1 1 141 141 LEU HD12 H 1 1.132 0.020 . 2 . . . . 141 LEU HD1 . 17389 1 1509 . 1 1 141 141 LEU HD13 H 1 1.132 0.020 . 2 . . . . 141 LEU HD1 . 17389 1 1510 . 1 1 141 141 LEU HD21 H 1 0.764 0.020 . 2 . . . . 141 LEU HD2 . 17389 1 1511 . 1 1 141 141 LEU HD22 H 1 0.764 0.020 . 2 . . . . 141 LEU HD2 . 17389 1 1512 . 1 1 141 141 LEU HD23 H 1 0.764 0.020 . 2 . . . . 141 LEU HD2 . 17389 1 1513 . 1 1 141 141 LEU CA C 13 56.974 0.400 . 1 . . . . 141 LEU CA . 17389 1 1514 . 1 1 141 141 LEU CB C 13 40.198 0.400 . 1 . . . . 141 LEU CB . 17389 1 1515 . 1 1 141 141 LEU CG C 13 27.108 0.400 . 1 . . . . 141 LEU CG . 17389 1 1516 . 1 1 141 141 LEU CD1 C 13 22.368 0.400 . 1 . . . . 141 LEU CD1 . 17389 1 1517 . 1 1 141 141 LEU CD2 C 13 25.806 0.400 . 1 . . . . 141 LEU CD2 . 17389 1 1518 . 1 1 141 141 LEU N N 15 119.656 0.400 . 1 . . . . 141 LEU N . 17389 1 1519 . 1 1 142 142 ASP H H 1 8.010 0.020 . 1 . . . . 142 ASP H . 17389 1 1520 . 1 1 142 142 ASP HA H 1 4.600 0.020 . 1 . . . . 142 ASP HA . 17389 1 1521 . 1 1 142 142 ASP HB2 H 1 2.788 0.020 . 2 . . . . 142 ASP HB2 . 17389 1 1522 . 1 1 142 142 ASP HB3 H 1 3.064 0.020 . 2 . . . . 142 ASP HB3 . 17389 1 1523 . 1 1 142 142 ASP CA C 13 57.683 0.400 . 1 . . . . 142 ASP CA . 17389 1 1524 . 1 1 142 142 ASP CB C 13 41.389 0.400 . 1 . . . . 142 ASP CB . 17389 1 1525 . 1 1 142 142 ASP N N 15 118.633 0.400 . 1 . . . . 142 ASP N . 17389 1 1526 . 1 1 143 143 ARG H H 1 8.629 0.020 . 1 . . . . 143 ARG H . 17389 1 1527 . 1 1 143 143 ARG HA H 1 4.003 0.020 . 1 . . . . 143 ARG HA . 17389 1 1528 . 1 1 143 143 ARG HB2 H 1 1.960 0.020 . 2 . . . . 143 ARG HB2 . 17389 1 1529 . 1 1 143 143 ARG HB3 H 1 1.959 0.020 . 2 . . . . 143 ARG HB3 . 17389 1 1530 . 1 1 143 143 ARG HG2 H 1 1.732 0.020 . 2 . . . . 143 ARG HG2 . 17389 1 1531 . 1 1 143 143 ARG HG3 H 1 1.564 0.020 . 2 . . . . 143 ARG HG3 . 17389 1 1532 . 1 1 143 143 ARG HD2 H 1 3.188 0.020 . 2 . . . . 143 ARG HD2 . 17389 1 1533 . 1 1 143 143 ARG HD3 H 1 3.189 0.020 . 2 . . . . 143 ARG HD3 . 17389 1 1534 . 1 1 143 143 ARG CA C 13 59.190 0.400 . 1 . . . . 143 ARG CA . 17389 1 1535 . 1 1 143 143 ARG CB C 13 29.983 0.400 . 1 . . . . 143 ARG CB . 17389 1 1536 . 1 1 143 143 ARG CG C 13 27.865 0.400 . 1 . . . . 143 ARG CG . 17389 1 1537 . 1 1 143 143 ARG CD C 13 43.043 0.400 . 1 . . . . 143 ARG CD . 17389 1 1538 . 1 1 143 143 ARG N N 15 119.656 0.400 . 1 . . . . 143 ARG N . 17389 1 1539 . 1 1 144 144 PHE H H 1 8.450 0.020 . 1 . . . . 144 PHE H . 17389 1 1540 . 1 1 144 144 PHE HA H 1 3.715 0.020 . 1 . . . . 144 PHE HA . 17389 1 1541 . 1 1 144 144 PHE HB2 H 1 3.405 0.020 . 2 . . . . 144 PHE HB2 . 17389 1 1542 . 1 1 144 144 PHE HB3 H 1 3.447 0.020 . 2 . . . . 144 PHE HB3 . 17389 1 1543 . 1 1 144 144 PHE HD1 H 1 7.410 0.020 . 1 . . . . 144 PHE HD1 . 17389 1 1544 . 1 1 144 144 PHE HD2 H 1 7.410 0.020 . 1 . . . . 144 PHE HD2 . 17389 1 1545 . 1 1 144 144 PHE HE1 H 1 7.182 0.020 . 1 . . . . 144 PHE HE1 . 17389 1 1546 . 1 1 144 144 PHE HE2 H 1 7.182 0.020 . 1 . . . . 144 PHE HE2 . 17389 1 1547 . 1 1 144 144 PHE CA C 13 61.435 0.400 . 1 . . . . 144 PHE CA . 17389 1 1548 . 1 1 144 144 PHE CB C 13 38.628 0.400 . 1 . . . . 144 PHE CB . 17389 1 1549 . 1 1 144 144 PHE CD1 C 13 133.105 0.400 . 1 . . . . 144 PHE CD1 . 17389 1 1550 . 1 1 144 144 PHE CD2 C 13 132.793 0.400 . 1 . . . . 144 PHE CD2 . 17389 1 1551 . 1 1 144 144 PHE CE1 C 13 130.885 0.400 . 1 . . . . 144 PHE CE1 . 17389 1 1552 . 1 1 144 144 PHE CE2 C 13 130.600 0.400 . 1 . . . . 144 PHE CE2 . 17389 1 1553 . 1 1 144 144 PHE N N 15 119.273 0.400 . 1 . . . . 144 PHE N . 17389 1 1554 . 1 1 145 145 VAL H H 1 8.146 0.020 . 1 . . . . 145 VAL H . 17389 1 1555 . 1 1 145 145 VAL HA H 1 3.683 0.020 . 1 . . . . 145 VAL HA . 17389 1 1556 . 1 1 145 145 VAL HB H 1 2.385 0.020 . 1 . . . . 145 VAL HB . 17389 1 1557 . 1 1 145 145 VAL HG11 H 1 1.007 0.020 . 2 . . . . 145 VAL HG1 . 17389 1 1558 . 1 1 145 145 VAL HG12 H 1 1.007 0.020 . 2 . . . . 145 VAL HG1 . 17389 1 1559 . 1 1 145 145 VAL HG13 H 1 1.007 0.020 . 2 . . . . 145 VAL HG1 . 17389 1 1560 . 1 1 145 145 VAL HG21 H 1 1.346 0.020 . 2 . . . . 145 VAL HG2 . 17389 1 1561 . 1 1 145 145 VAL HG22 H 1 1.346 0.020 . 2 . . . . 145 VAL HG2 . 17389 1 1562 . 1 1 145 145 VAL HG23 H 1 1.346 0.020 . 2 . . . . 145 VAL HG2 . 17389 1 1563 . 1 1 145 145 VAL CA C 13 67.263 0.400 . 1 . . . . 145 VAL CA . 17389 1 1564 . 1 1 145 145 VAL CB C 13 31.883 0.400 . 1 . . . . 145 VAL CB . 17389 1 1565 . 1 1 145 145 VAL CG1 C 13 21.732 0.400 . 1 . . . . 145 VAL CG1 . 17389 1 1566 . 1 1 145 145 VAL CG2 C 13 22.860 0.400 . 1 . . . . 145 VAL CG2 . 17389 1 1567 . 1 1 145 145 VAL N N 15 115.600 0.400 . 1 . . . . 145 VAL N . 17389 1 1568 . 1 1 146 146 MET H H 1 8.270 0.020 . 1 . . . . 146 MET H . 17389 1 1569 . 1 1 146 146 MET HA H 1 4.036 0.020 . 1 . . . . 146 MET HA . 17389 1 1570 . 1 1 146 146 MET HB2 H 1 2.225 0.020 . 2 . . . . 146 MET HB2 . 17389 1 1571 . 1 1 146 146 MET HB3 H 1 2.284 0.020 . 2 . . . . 146 MET HB3 . 17389 1 1572 . 1 1 146 146 MET HG2 H 1 2.684 0.020 . 2 . . . . 146 MET HG2 . 17389 1 1573 . 1 1 146 146 MET HG3 H 1 2.735 0.020 . 2 . . . . 146 MET HG3 . 17389 1 1574 . 1 1 146 146 MET HE1 H 1 2.131 0.020 . 1 . . . . 146 MET HE . 17389 1 1575 . 1 1 146 146 MET HE2 H 1 2.131 0.020 . 1 . . . . 146 MET HE . 17389 1 1576 . 1 1 146 146 MET HE3 H 1 2.131 0.020 . 1 . . . . 146 MET HE . 17389 1 1577 . 1 1 146 146 MET CA C 13 58.730 0.400 . 1 . . . . 146 MET CA . 17389 1 1578 . 1 1 146 146 MET CB C 13 32.721 0.400 . 1 . . . . 146 MET CB . 17389 1 1579 . 1 1 146 146 MET CG C 13 31.592 0.400 . 1 . . . . 146 MET CG . 17389 1 1580 . 1 1 146 146 MET CE C 13 16.764 0.400 . 1 . . . . 146 MET CE . 17389 1 1581 . 1 1 146 146 MET N N 15 118.071 0.400 . 1 . . . . 146 MET N . 17389 1 1582 . 1 1 147 147 VAL H H 1 8.063 0.020 . 1 . . . . 147 VAL H . 17389 1 1583 . 1 1 147 147 VAL HA H 1 3.788 0.020 . 1 . . . . 147 VAL HA . 17389 1 1584 . 1 1 147 147 VAL HB H 1 1.924 0.020 . 1 . . . . 147 VAL HB . 17389 1 1585 . 1 1 147 147 VAL HG11 H 1 0.844 0.020 . 2 . . . . 147 VAL HG1 . 17389 1 1586 . 1 1 147 147 VAL HG12 H 1 0.844 0.020 . 2 . . . . 147 VAL HG1 . 17389 1 1587 . 1 1 147 147 VAL HG13 H 1 0.844 0.020 . 2 . . . . 147 VAL HG1 . 17389 1 1588 . 1 1 147 147 VAL HG21 H 1 1.088 0.020 . 2 . . . . 147 VAL HG2 . 17389 1 1589 . 1 1 147 147 VAL HG22 H 1 1.088 0.020 . 2 . . . . 147 VAL HG2 . 17389 1 1590 . 1 1 147 147 VAL HG23 H 1 1.088 0.020 . 2 . . . . 147 VAL HG2 . 17389 1 1591 . 1 1 147 147 VAL CA C 13 65.397 0.400 . 1 . . . . 147 VAL CA . 17389 1 1592 . 1 1 147 147 VAL CB C 13 31.575 0.400 . 1 . . . . 147 VAL CB . 17389 1 1593 . 1 1 147 147 VAL CG1 C 13 21.323 0.400 . 1 . . . . 147 VAL CG1 . 17389 1 1594 . 1 1 147 147 VAL CG2 C 13 22.848 0.400 . 1 . . . . 147 VAL CG2 . 17389 1 1595 . 1 1 147 147 VAL N N 15 118.382 0.400 . 1 . . . . 147 VAL N . 17389 1 1596 . 1 1 148 148 ALA H H 1 9.377 0.020 . 1 . . . . 148 ALA H . 17389 1 1597 . 1 1 148 148 ALA HA H 1 3.770 0.020 . 1 . . . . 148 ALA HA . 17389 1 1598 . 1 1 148 148 ALA HB1 H 1 1.393 0.020 . 1 . . . . 148 ALA HB . 17389 1 1599 . 1 1 148 148 ALA HB2 H 1 1.393 0.020 . 1 . . . . 148 ALA HB . 17389 1 1600 . 1 1 148 148 ALA HB3 H 1 1.393 0.020 . 1 . . . . 148 ALA HB . 17389 1 1601 . 1 1 148 148 ALA CA C 13 55.702 0.400 . 1 . . . . 148 ALA CA . 17389 1 1602 . 1 1 148 148 ALA CB C 13 17.657 0.400 . 1 . . . . 148 ALA CB . 17389 1 1603 . 1 1 148 148 ALA N N 15 124.901 0.400 . 1 . . . . 148 ALA N . 17389 1 1604 . 1 1 149 149 LYS H H 1 7.850 0.020 . 1 . . . . 149 LYS H . 17389 1 1605 . 1 1 149 149 LYS HA H 1 3.907 0.020 . 1 . . . . 149 LYS HA . 17389 1 1606 . 1 1 149 149 LYS HB2 H 1 1.949 0.020 . 2 . . . . 149 LYS HB2 . 17389 1 1607 . 1 1 149 149 LYS HB3 H 1 2.089 0.020 . 2 . . . . 149 LYS HB3 . 17389 1 1608 . 1 1 149 149 LYS HG2 H 1 1.602 0.020 . 2 . . . . 149 LYS HG2 . 17389 1 1609 . 1 1 149 149 LYS HG3 H 1 1.451 0.020 . 2 . . . . 149 LYS HG3 . 17389 1 1610 . 1 1 149 149 LYS HD2 H 1 1.687 0.020 . 2 . . . . 149 LYS HD2 . 17389 1 1611 . 1 1 149 149 LYS HD3 H 1 1.686 0.020 . 2 . . . . 149 LYS HD3 . 17389 1 1612 . 1 1 149 149 LYS HE2 H 1 2.973 0.020 . 2 . . . . 149 LYS HE2 . 17389 1 1613 . 1 1 149 149 LYS HE3 H 1 2.973 0.020 . 2 . . . . 149 LYS HE3 . 17389 1 1614 . 1 1 149 149 LYS CA C 13 59.245 0.400 . 1 . . . . 149 LYS CA . 17389 1 1615 . 1 1 149 149 LYS CB C 13 32.604 0.400 . 1 . . . . 149 LYS CB . 17389 1 1616 . 1 1 149 149 LYS CG C 13 24.411 0.400 . 1 . . . . 149 LYS CG . 17389 1 1617 . 1 1 149 149 LYS CD C 13 29.771 0.400 . 1 . . . . 149 LYS CD . 17389 1 1618 . 1 1 149 149 LYS CE C 13 42.073 0.400 . 1 . . . . 149 LYS CE . 17389 1 1619 . 1 1 149 149 LYS N N 15 112.225 0.400 . 1 . . . . 149 LYS N . 17389 1 1620 . 1 1 150 150 THR H H 1 7.527 0.020 . 1 . . . . 150 THR H . 17389 1 1621 . 1 1 150 150 THR HA H 1 4.519 0.020 . 1 . . . . 150 THR HA . 17389 1 1622 . 1 1 150 150 THR HB H 1 4.525 0.020 . 1 . . . . 150 THR HB . 17389 1 1623 . 1 1 150 150 THR HG21 H 1 1.379 0.020 . 1 . . . . 150 THR HG2 . 17389 1 1624 . 1 1 150 150 THR HG22 H 1 1.379 0.020 . 1 . . . . 150 THR HG2 . 17389 1 1625 . 1 1 150 150 THR HG23 H 1 1.379 0.020 . 1 . . . . 150 THR HG2 . 17389 1 1626 . 1 1 150 150 THR CA C 13 61.928 0.400 . 1 . . . . 150 THR CA . 17389 1 1627 . 1 1 150 150 THR CB C 13 70.304 0.400 . 1 . . . . 150 THR CB . 17389 1 1628 . 1 1 150 150 THR CG2 C 13 21.563 0.400 . 1 . . . . 150 THR CG2 . 17389 1 1629 . 1 1 150 150 THR N N 15 106.930 0.400 . 1 . . . . 150 THR N . 17389 1 1630 . 1 1 151 151 VAL H H 1 7.603 0.020 . 1 . . . . 151 VAL H . 17389 1 1631 . 1 1 151 151 VAL HA H 1 4.293 0.020 . 1 . . . . 151 VAL HA . 17389 1 1632 . 1 1 151 151 VAL HB H 1 2.432 0.020 . 1 . . . . 151 VAL HB . 17389 1 1633 . 1 1 151 151 VAL HG11 H 1 0.963 0.020 . 2 . . . . 151 VAL HG1 . 17389 1 1634 . 1 1 151 151 VAL HG12 H 1 0.963 0.020 . 2 . . . . 151 VAL HG1 . 17389 1 1635 . 1 1 151 151 VAL HG13 H 1 0.963 0.020 . 2 . . . . 151 VAL HG1 . 17389 1 1636 . 1 1 151 151 VAL HG21 H 1 1.156 0.020 . 2 . . . . 151 VAL HG2 . 17389 1 1637 . 1 1 151 151 VAL HG22 H 1 1.156 0.020 . 2 . . . . 151 VAL HG2 . 17389 1 1638 . 1 1 151 151 VAL HG23 H 1 1.156 0.020 . 2 . . . . 151 VAL HG2 . 17389 1 1639 . 1 1 151 151 VAL CA C 13 66.403 0.400 . 1 . . . . 151 VAL CA . 17389 1 1640 . 1 1 151 151 VAL CB C 13 29.811 0.400 . 1 . . . . 151 VAL CB . 17389 1 1641 . 1 1 151 151 VAL CG1 C 13 22.647 0.400 . 1 . . . . 151 VAL CG1 . 17389 1 1642 . 1 1 151 151 VAL CG2 C 13 24.108 0.400 . 1 . . . . 151 VAL CG2 . 17389 1 1643 . 1 1 151 151 VAL N N 15 121.951 0.400 . 1 . . . . 151 VAL N . 17389 1 1644 . 1 1 152 152 PRO HA H 1 3.903 0.020 . 1 . . . . 152 PRO HA . 17389 1 1645 . 1 1 152 152 PRO HB2 H 1 2.043 0.020 . 2 . . . . 152 PRO HB2 . 17389 1 1646 . 1 1 152 152 PRO HB3 H 1 2.178 0.020 . 2 . . . . 152 PRO HB3 . 17389 1 1647 . 1 1 152 152 PRO HG2 H 1 2.340 0.020 . 2 . . . . 152 PRO HG2 . 17389 1 1648 . 1 1 152 152 PRO HG3 H 1 1.530 0.020 . 2 . . . . 152 PRO HG3 . 17389 1 1649 . 1 1 152 152 PRO HD2 H 1 4.101 0.020 . 2 . . . . 152 PRO HD2 . 17389 1 1650 . 1 1 152 152 PRO HD3 H 1 3.700 0.020 . 2 . . . . 152 PRO HD3 . 17389 1 1651 . 1 1 152 152 PRO CA C 13 67.145 0.400 . 1 . . . . 152 PRO CA . 17389 1 1652 . 1 1 152 152 PRO CB C 13 31.008 0.400 . 1 . . . . 152 PRO CB . 17389 1 1653 . 1 1 152 152 PRO CG C 13 29.378 0.400 . 1 . . . . 152 PRO CG . 17389 1 1654 . 1 1 152 152 PRO CD C 13 50.120 0.400 . 1 . . . . 152 PRO CD . 17389 1 1655 . 1 1 153 153 ASP H H 1 7.977 0.020 . 1 . . . . 153 ASP H . 17389 1 1656 . 1 1 153 153 ASP HA H 1 4.479 0.020 . 1 . . . . 153 ASP HA . 17389 1 1657 . 1 1 153 153 ASP HB2 H 1 2.670 0.020 . 2 . . . . 153 ASP HB2 . 17389 1 1658 . 1 1 153 153 ASP HB3 H 1 2.748 0.020 . 2 . . . . 153 ASP HB3 . 17389 1 1659 . 1 1 153 153 ASP CA C 13 56.864 0.400 . 1 . . . . 153 ASP CA . 17389 1 1660 . 1 1 153 153 ASP CB C 13 40.147 0.400 . 1 . . . . 153 ASP CB . 17389 1 1661 . 1 1 153 153 ASP N N 15 115.695 0.400 . 1 . . . . 153 ASP N . 17389 1 1662 . 1 1 154 154 ASP H H 1 7.409 0.020 . 1 . . . . 154 ASP H . 17389 1 1663 . 1 1 154 154 ASP HA H 1 4.639 0.020 . 1 . . . . 154 ASP HA . 17389 1 1664 . 1 1 154 154 ASP HB2 H 1 2.678 0.020 . 2 . . . . 154 ASP HB2 . 17389 1 1665 . 1 1 154 154 ASP HB3 H 1 2.547 0.020 . 2 . . . . 154 ASP HB3 . 17389 1 1666 . 1 1 154 154 ASP CA C 13 57.255 0.400 . 1 . . . . 154 ASP CA . 17389 1 1667 . 1 1 154 154 ASP CB C 13 39.831 0.400 . 1 . . . . 154 ASP CB . 17389 1 1668 . 1 1 154 154 ASP N N 15 121.928 0.400 . 1 . . . . 154 ASP N . 17389 1 1669 . 1 1 155 155 ALA H H 1 8.938 0.020 . 1 . . . . 155 ALA H . 17389 1 1670 . 1 1 155 155 ALA HA H 1 4.169 0.020 . 1 . . . . 155 ALA HA . 17389 1 1671 . 1 1 155 155 ALA HB1 H 1 1.023 0.020 . 1 . . . . 155 ALA HB . 17389 1 1672 . 1 1 155 155 ALA HB2 H 1 1.023 0.020 . 1 . . . . 155 ALA HB . 17389 1 1673 . 1 1 155 155 ALA HB3 H 1 1.023 0.020 . 1 . . . . 155 ALA HB . 17389 1 1674 . 1 1 155 155 ALA CA C 13 54.663 0.400 . 1 . . . . 155 ALA CA . 17389 1 1675 . 1 1 155 155 ALA CB C 13 17.696 0.400 . 1 . . . . 155 ALA CB . 17389 1 1676 . 1 1 155 155 ALA N N 15 124.913 0.400 . 1 . . . . 155 ALA N . 17389 1 1677 . 1 1 156 156 LYS H H 1 8.614 0.020 . 1 . . . . 156 LYS H . 17389 1 1678 . 1 1 156 156 LYS HA H 1 3.678 0.020 . 1 . . . . 156 LYS HA . 17389 1 1679 . 1 1 156 156 LYS HB2 H 1 2.019 0.020 . 2 . . . . 156 LYS HB2 . 17389 1 1680 . 1 1 156 156 LYS HB3 H 1 2.019 0.020 . 2 . . . . 156 LYS HB3 . 17389 1 1681 . 1 1 156 156 LYS HG2 H 1 1.433 0.020 . 2 . . . . 156 LYS HG2 . 17389 1 1682 . 1 1 156 156 LYS HG3 H 1 1.432 0.020 . 2 . . . . 156 LYS HG3 . 17389 1 1683 . 1 1 156 156 LYS HD2 H 1 1.690 0.020 . 2 . . . . 156 LYS HD2 . 17389 1 1684 . 1 1 156 156 LYS HD3 H 1 1.690 0.020 . 2 . . . . 156 LYS HD3 . 17389 1 1685 . 1 1 156 156 LYS HE2 H 1 2.915 0.020 . 2 . . . . 156 LYS HE2 . 17389 1 1686 . 1 1 156 156 LYS HE3 H 1 2.915 0.020 . 2 . . . . 156 LYS HE3 . 17389 1 1687 . 1 1 156 156 LYS CA C 13 59.487 0.400 . 1 . . . . 156 LYS CA . 17389 1 1688 . 1 1 156 156 LYS CB C 13 31.985 0.400 . 1 . . . . 156 LYS CB . 17389 1 1689 . 1 1 156 156 LYS CG C 13 24.853 0.400 . 1 . . . . 156 LYS CG . 17389 1 1690 . 1 1 156 156 LYS CD C 13 28.803 0.400 . 1 . . . . 156 LYS CD . 17389 1 1691 . 1 1 156 156 LYS CE C 13 41.723 0.400 . 1 . . . . 156 LYS CE . 17389 1 1692 . 1 1 156 156 LYS N N 15 117.402 0.400 . 1 . . . . 156 LYS N . 17389 1 1693 . 1 1 157 157 GLN H H 1 7.354 0.020 . 1 . . . . 157 GLN H . 17389 1 1694 . 1 1 157 157 GLN HA H 1 4.047 0.020 . 1 . . . . 157 GLN HA . 17389 1 1695 . 1 1 157 157 GLN HB2 H 1 2.205 0.020 . 2 . . . . 157 GLN HB2 . 17389 1 1696 . 1 1 157 157 GLN HB3 H 1 2.154 0.020 . 2 . . . . 157 GLN HB3 . 17389 1 1697 . 1 1 157 157 GLN HG2 H 1 2.551 0.020 . 2 . . . . 157 GLN HG2 . 17389 1 1698 . 1 1 157 157 GLN HG3 H 1 2.366 0.020 . 2 . . . . 157 GLN HG3 . 17389 1 1699 . 1 1 157 157 GLN HE21 H 1 7.698 0.020 . 2 . . . . 157 GLN HE21 . 17389 1 1700 . 1 1 157 157 GLN HE22 H 1 6.773 0.020 . 2 . . . . 157 GLN HE22 . 17389 1 1701 . 1 1 157 157 GLN CA C 13 58.897 0.400 . 1 . . . . 157 GLN CA . 17389 1 1702 . 1 1 157 157 GLN CB C 13 27.741 0.400 . 1 . . . . 157 GLN CB . 17389 1 1703 . 1 1 157 157 GLN CG C 13 32.721 0.400 . 1 . . . . 157 GLN CG . 17389 1 1704 . 1 1 157 157 GLN N N 15 118.244 0.400 . 1 . . . . 157 GLN N . 17389 1 1705 . 1 1 157 157 GLN NE2 N 15 113.411 0.400 . 1 . . . . 157 GLN NE2 . 17389 1 1706 . 1 1 158 158 LEU H H 1 6.815 0.020 . 1 . . . . 158 LEU H . 17389 1 1707 . 1 1 158 158 LEU HA H 1 4.668 0.020 . 1 . . . . 158 LEU HA . 17389 1 1708 . 1 1 158 158 LEU HB2 H 1 2.481 0.020 . 2 . . . . 158 LEU HB2 . 17389 1 1709 . 1 1 158 158 LEU HB3 H 1 1.334 0.020 . 2 . . . . 158 LEU HB3 . 17389 1 1710 . 1 1 158 158 LEU HG H 1 1.724 0.020 . 1 . . . . 158 LEU HG . 17389 1 1711 . 1 1 158 158 LEU HD11 H 1 1.115 0.020 . 2 . . . . 158 LEU HD1 . 17389 1 1712 . 1 1 158 158 LEU HD12 H 1 1.115 0.020 . 2 . . . . 158 LEU HD1 . 17389 1 1713 . 1 1 158 158 LEU HD13 H 1 1.115 0.020 . 2 . . . . 158 LEU HD1 . 17389 1 1714 . 1 1 158 158 LEU HD21 H 1 1.000 0.020 . 2 . . . . 158 LEU HD2 . 17389 1 1715 . 1 1 158 158 LEU HD22 H 1 1.000 0.020 . 2 . . . . 158 LEU HD2 . 17389 1 1716 . 1 1 158 158 LEU HD23 H 1 1.000 0.020 . 2 . . . . 158 LEU HD2 . 17389 1 1717 . 1 1 158 158 LEU CA C 13 56.864 0.400 . 1 . . . . 158 LEU CA . 17389 1 1718 . 1 1 158 158 LEU CB C 13 40.786 0.400 . 1 . . . . 158 LEU CB . 17389 1 1719 . 1 1 158 158 LEU CG C 13 27.370 0.400 . 1 . . . . 158 LEU CG . 17389 1 1720 . 1 1 158 158 LEU CD1 C 13 22.178 0.400 . 1 . . . . 158 LEU CD1 . 17389 1 1721 . 1 1 158 158 LEU CD2 C 13 27.135 0.400 . 1 . . . . 158 LEU CD2 . 17389 1 1722 . 1 1 158 158 LEU N N 15 120.749 0.400 . 1 . . . . 158 LEU N . 17389 1 1723 . 1 1 159 159 THR H H 1 9.765 0.020 . 1 . . . . 159 THR H . 17389 1 1724 . 1 1 159 159 THR HA H 1 3.920 0.020 . 1 . . . . 159 THR HA . 17389 1 1725 . 1 1 159 159 THR HB H 1 4.306 0.020 . 1 . . . . 159 THR HB . 17389 1 1726 . 1 1 159 159 THR HG1 H 1 6.354 0.020 . 1 . . . . 159 THR HG1 . 17389 1 1727 . 1 1 159 159 THR HG21 H 1 1.164 0.020 . 1 . . . . 159 THR HG2 . 17389 1 1728 . 1 1 159 159 THR HG22 H 1 1.164 0.020 . 1 . . . . 159 THR HG2 . 17389 1 1729 . 1 1 159 159 THR HG23 H 1 1.164 0.020 . 1 . . . . 159 THR HG2 . 17389 1 1730 . 1 1 159 159 THR CA C 13 65.954 0.400 . 1 . . . . 159 THR CA . 17389 1 1731 . 1 1 159 159 THR CB C 13 68.261 0.400 . 1 . . . . 159 THR CB . 17389 1 1732 . 1 1 159 159 THR CG2 C 13 22.470 0.400 . 1 . . . . 159 THR CG2 . 17389 1 1733 . 1 1 159 159 THR N N 15 118.399 0.400 . 1 . . . . 159 THR N . 17389 1 1734 . 1 1 160 160 THR H H 1 8.416 0.020 . 1 . . . . 160 THR H . 17389 1 1735 . 1 1 160 160 THR HA H 1 4.000 0.020 . 1 . . . . 160 THR HA . 17389 1 1736 . 1 1 160 160 THR HB H 1 4.505 0.020 . 1 . . . . 160 THR HB . 17389 1 1737 . 1 1 160 160 THR HG21 H 1 1.261 0.020 . 1 . . . . 160 THR HG2 . 17389 1 1738 . 1 1 160 160 THR HG22 H 1 1.261 0.020 . 1 . . . . 160 THR HG2 . 17389 1 1739 . 1 1 160 160 THR HG23 H 1 1.261 0.020 . 1 . . . . 160 THR HG2 . 17389 1 1740 . 1 1 160 160 THR CA C 13 67.301 0.400 . 1 . . . . 160 THR CA . 17389 1 1741 . 1 1 160 160 THR CB C 13 67.966 0.400 . 1 . . . . 160 THR CB . 17389 1 1742 . 1 1 160 160 THR CG2 C 13 20.939 0.400 . 1 . . . . 160 THR CG2 . 17389 1 1743 . 1 1 160 160 THR N N 15 118.235 0.400 . 1 . . . . 160 THR N . 17389 1 1744 . 1 1 161 161 THR H H 1 8.527 0.020 . 1 . . . . 161 THR H . 17389 1 1745 . 1 1 161 161 THR HA H 1 3.791 0.020 . 1 . . . . 161 THR HA . 17389 1 1746 . 1 1 161 161 THR HB H 1 4.794 0.020 . 1 . . . . 161 THR HB . 17389 1 1747 . 1 1 161 161 THR HG21 H 1 1.113 0.020 . 1 . . . . 161 THR HG2 . 17389 1 1748 . 1 1 161 161 THR HG22 H 1 1.113 0.020 . 1 . . . . 161 THR HG2 . 17389 1 1749 . 1 1 161 161 THR HG23 H 1 1.113 0.020 . 1 . . . . 161 THR HG2 . 17389 1 1750 . 1 1 161 161 THR CA C 13 65.924 0.400 . 1 . . . . 161 THR CA . 17389 1 1751 . 1 1 161 161 THR CB C 13 68.727 0.400 . 1 . . . . 161 THR CB . 17389 1 1752 . 1 1 161 161 THR CG2 C 13 21.901 0.400 . 1 . . . . 161 THR CG2 . 17389 1 1753 . 1 1 161 161 THR N N 15 124.184 0.400 . 1 . . . . 161 THR N . 17389 1 1754 . 1 1 162 162 ILE H H 1 8.545 0.020 . 1 . . . . 162 ILE H . 17389 1 1755 . 1 1 162 162 ILE HA H 1 3.457 0.020 . 1 . . . . 162 ILE HA . 17389 1 1756 . 1 1 162 162 ILE HB H 1 1.975 0.020 . 1 . . . . 162 ILE HB . 17389 1 1757 . 1 1 162 162 ILE HG12 H 1 0.688 0.020 . 2 . . . . 162 ILE HG12 . 17389 1 1758 . 1 1 162 162 ILE HG13 H 1 1.976 0.020 . 2 . . . . 162 ILE HG13 . 17389 1 1759 . 1 1 162 162 ILE HG21 H 1 1.056 0.020 . 1 . . . . 162 ILE HG2 . 17389 1 1760 . 1 1 162 162 ILE HG22 H 1 1.056 0.020 . 1 . . . . 162 ILE HG2 . 17389 1 1761 . 1 1 162 162 ILE HG23 H 1 1.056 0.020 . 1 . . . . 162 ILE HG2 . 17389 1 1762 . 1 1 162 162 ILE HD11 H 1 0.904 0.020 . 1 . . . . 162 ILE HD1 . 17389 1 1763 . 1 1 162 162 ILE HD12 H 1 0.904 0.020 . 1 . . . . 162 ILE HD1 . 17389 1 1764 . 1 1 162 162 ILE HD13 H 1 0.904 0.020 . 1 . . . . 162 ILE HD1 . 17389 1 1765 . 1 1 162 162 ILE CA C 13 65.863 0.400 . 1 . . . . 162 ILE CA . 17389 1 1766 . 1 1 162 162 ILE CB C 13 36.979 0.400 . 1 . . . . 162 ILE CB . 17389 1 1767 . 1 1 162 162 ILE CG1 C 13 30.765 0.400 . 1 . . . . 162 ILE CG1 . 17389 1 1768 . 1 1 162 162 ILE CG2 C 13 17.978 0.400 . 1 . . . . 162 ILE CG2 . 17389 1 1769 . 1 1 162 162 ILE CD1 C 13 14.797 0.400 . 1 . . . . 162 ILE CD1 . 17389 1 1770 . 1 1 162 162 ILE N N 15 122.048 0.400 . 1 . . . . 162 ILE N . 17389 1 1771 . 1 1 163 163 ASN H H 1 8.916 0.020 . 1 . . . . 163 ASN H . 17389 1 1772 . 1 1 163 163 ASN HA H 1 4.357 0.020 . 1 . . . . 163 ASN HA . 17389 1 1773 . 1 1 163 163 ASN HB2 H 1 2.946 0.020 . 2 . . . . 163 ASN HB2 . 17389 1 1774 . 1 1 163 163 ASN HB3 H 1 2.872 0.020 . 2 . . . . 163 ASN HB3 . 17389 1 1775 . 1 1 163 163 ASN HD21 H 1 7.355 0.020 . 2 . . . . 163 ASN HD21 . 17389 1 1776 . 1 1 163 163 ASN HD22 H 1 6.328 0.020 . 2 . . . . 163 ASN HD22 . 17389 1 1777 . 1 1 163 163 ASN CA C 13 56.609 0.400 . 1 . . . . 163 ASN CA . 17389 1 1778 . 1 1 163 163 ASN CB C 13 38.537 0.400 . 1 . . . . 163 ASN CB . 17389 1 1779 . 1 1 163 163 ASN N N 15 117.580 0.400 . 1 . . . . 163 ASN N . 17389 1 1780 . 1 1 163 163 ASN ND2 N 15 107.539 0.400 . 1 . . . . 163 ASN ND2 . 17389 1 1781 . 1 1 164 164 THR H H 1 8.555 0.020 . 1 . . . . 164 THR H . 17389 1 1782 . 1 1 164 164 THR HA H 1 4.139 0.020 . 1 . . . . 164 THR HA . 17389 1 1783 . 1 1 164 164 THR HB H 1 4.329 0.020 . 1 . . . . 164 THR HB . 17389 1 1784 . 1 1 164 164 THR HG21 H 1 1.342 0.020 . 1 . . . . 164 THR HG2 . 17389 1 1785 . 1 1 164 164 THR HG22 H 1 1.342 0.020 . 1 . . . . 164 THR HG2 . 17389 1 1786 . 1 1 164 164 THR HG23 H 1 1.342 0.020 . 1 . . . . 164 THR HG2 . 17389 1 1787 . 1 1 164 164 THR CA C 13 64.768 0.400 . 1 . . . . 164 THR CA . 17389 1 1788 . 1 1 164 164 THR CB C 13 69.373 0.400 . 1 . . . . 164 THR CB . 17389 1 1789 . 1 1 164 164 THR CG2 C 13 21.383 0.400 . 1 . . . . 164 THR CG2 . 17389 1 1790 . 1 1 164 164 THR N N 15 112.225 0.400 . 1 . . . . 164 THR N . 17389 1 1791 . 1 1 165 165 ASN H H 1 7.485 0.020 . 1 . . . . 165 ASN H . 17389 1 1792 . 1 1 165 165 ASN HA H 1 5.176 0.020 . 1 . . . . 165 ASN HA . 17389 1 1793 . 1 1 165 165 ASN HB2 H 1 2.911 0.020 . 2 . . . . 165 ASN HB2 . 17389 1 1794 . 1 1 165 165 ASN HB3 H 1 2.443 0.020 . 2 . . . . 165 ASN HB3 . 17389 1 1795 . 1 1 165 165 ASN HD21 H 1 7.334 0.020 . 2 . . . . 165 ASN HD21 . 17389 1 1796 . 1 1 165 165 ASN HD22 H 1 8.589 0.020 . 2 . . . . 165 ASN HD22 . 17389 1 1797 . 1 1 165 165 ASN CA C 13 53.000 0.400 . 1 . . . . 165 ASN CA . 17389 1 1798 . 1 1 165 165 ASN CB C 13 40.223 0.400 . 1 . . . . 165 ASN CB . 17389 1 1799 . 1 1 165 165 ASN N N 15 118.399 0.400 . 1 . . . . 165 ASN N . 17389 1 1800 . 1 1 165 165 ASN ND2 N 15 119.781 0.400 . 1 . . . . 165 ASN ND2 . 17389 1 1801 . 1 1 166 166 ALA H H 1 7.327 0.020 . 1 . . . . 166 ALA H . 17389 1 1802 . 1 1 166 166 ALA HA H 1 4.105 0.020 . 1 . . . . 166 ALA HA . 17389 1 1803 . 1 1 166 166 ALA HB1 H 1 1.773 0.020 . 1 . . . . 166 ALA HB . 17389 1 1804 . 1 1 166 166 ALA HB2 H 1 1.773 0.020 . 1 . . . . 166 ALA HB . 17389 1 1805 . 1 1 166 166 ALA HB3 H 1 1.773 0.020 . 1 . . . . 166 ALA HB . 17389 1 1806 . 1 1 166 166 ALA CA C 13 56.626 0.400 . 1 . . . . 166 ALA CA . 17389 1 1807 . 1 1 166 166 ALA CB C 13 19.407 0.400 . 1 . . . . 166 ALA CB . 17389 1 1808 . 1 1 166 166 ALA N N 15 123.140 0.400 . 1 . . . . 166 ALA N . 17389 1 1809 . 1 1 167 167 GLU H H 1 8.668 0.020 . 1 . . . . 167 GLU H . 17389 1 1810 . 1 1 167 167 GLU HA H 1 4.032 0.020 . 1 . . . . 167 GLU HA . 17389 1 1811 . 1 1 167 167 GLU HB2 H 1 2.083 0.020 . 2 . . . . 167 GLU HB2 . 17389 1 1812 . 1 1 167 167 GLU HB3 H 1 2.083 0.020 . 2 . . . . 167 GLU HB3 . 17389 1 1813 . 1 1 167 167 GLU HG2 H 1 2.323 0.020 . 2 . . . . 167 GLU HG2 . 17389 1 1814 . 1 1 167 167 GLU HG3 H 1 2.399 0.020 . 2 . . . . 167 GLU HG3 . 17389 1 1815 . 1 1 167 167 GLU CA C 13 59.187 0.400 . 1 . . . . 167 GLU CA . 17389 1 1816 . 1 1 167 167 GLU CB C 13 28.893 0.400 . 1 . . . . 167 GLU CB . 17389 1 1817 . 1 1 167 167 GLU CG C 13 36.618 0.400 . 1 . . . . 167 GLU CG . 17389 1 1818 . 1 1 167 167 GLU N N 15 115.339 0.400 . 1 . . . . 167 GLU N . 17389 1 1819 . 1 1 168 168 ALA H H 1 7.674 0.020 . 1 . . . . 168 ALA H . 17389 1 1820 . 1 1 168 168 ALA HA H 1 4.222 0.020 . 1 . . . . 168 ALA HA . 17389 1 1821 . 1 1 168 168 ALA HB1 H 1 1.417 0.020 . 1 . . . . 168 ALA HB . 17389 1 1822 . 1 1 168 168 ALA HB2 H 1 1.417 0.020 . 1 . . . . 168 ALA HB . 17389 1 1823 . 1 1 168 168 ALA HB3 H 1 1.417 0.020 . 1 . . . . 168 ALA HB . 17389 1 1824 . 1 1 168 168 ALA CA C 13 53.175 0.400 . 1 . . . . 168 ALA CA . 17389 1 1825 . 1 1 168 168 ALA CB C 13 18.632 0.400 . 1 . . . . 168 ALA CB . 17389 1 1826 . 1 1 168 168 ALA N N 15 118.946 0.400 . 1 . . . . 168 ALA N . 17389 1 1827 . 1 1 169 169 LEU H H 1 7.492 0.020 . 1 . . . . 169 LEU H . 17389 1 1828 . 1 1 169 169 LEU HA H 1 3.775 0.020 . 1 . . . . 169 LEU HA . 17389 1 1829 . 1 1 169 169 LEU HB2 H 1 0.271 0.020 . 2 . . . . 169 LEU HB2 . 17389 1 1830 . 1 1 169 169 LEU HB3 H 1 1.316 0.020 . 2 . . . . 169 LEU HB3 . 17389 1 1831 . 1 1 169 169 LEU HG H 1 1.609 0.020 . 1 . . . . 169 LEU HG . 17389 1 1832 . 1 1 169 169 LEU HD11 H 1 0.780 0.020 . 2 . . . . 169 LEU HD1 . 17389 1 1833 . 1 1 169 169 LEU HD12 H 1 0.780 0.020 . 2 . . . . 169 LEU HD1 . 17389 1 1834 . 1 1 169 169 LEU HD13 H 1 0.780 0.020 . 2 . . . . 169 LEU HD1 . 17389 1 1835 . 1 1 169 169 LEU HD21 H 1 0.686 0.020 . 2 . . . . 169 LEU HD2 . 17389 1 1836 . 1 1 169 169 LEU HD22 H 1 0.686 0.020 . 2 . . . . 169 LEU HD2 . 17389 1 1837 . 1 1 169 169 LEU HD23 H 1 0.686 0.020 . 2 . . . . 169 LEU HD2 . 17389 1 1838 . 1 1 169 169 LEU CA C 13 56.165 0.400 . 1 . . . . 169 LEU CA . 17389 1 1839 . 1 1 169 169 LEU CB C 13 44.220 0.400 . 1 . . . . 169 LEU CB . 17389 1 1840 . 1 1 169 169 LEU CG C 13 26.386 0.400 . 1 . . . . 169 LEU CG . 17389 1 1841 . 1 1 169 169 LEU CD1 C 13 27.243 0.400 . 1 . . . . 169 LEU CD1 . 17389 1 1842 . 1 1 169 169 LEU CD2 C 13 22.671 0.400 . 1 . . . . 169 LEU CD2 . 17389 1 1843 . 1 1 169 169 LEU N N 15 113.288 0.400 . 1 . . . . 169 LEU N . 17389 1 1844 . 1 1 170 170 PHE H H 1 7.914 0.020 . 1 . . . . 170 PHE H . 17389 1 1845 . 1 1 170 170 PHE HA H 1 4.923 0.020 . 1 . . . . 170 PHE HA . 17389 1 1846 . 1 1 170 170 PHE HB2 H 1 2.649 0.020 . 2 . . . . 170 PHE HB2 . 17389 1 1847 . 1 1 170 170 PHE HB3 H 1 3.550 0.020 . 2 . . . . 170 PHE HB3 . 17389 1 1848 . 1 1 170 170 PHE HD1 H 1 7.404 0.020 . 1 . . . . 170 PHE HD1 . 17389 1 1849 . 1 1 170 170 PHE HD2 H 1 7.404 0.020 . 1 . . . . 170 PHE HD2 . 17389 1 1850 . 1 1 170 170 PHE HE1 H 1 6.937 0.020 . 1 . . . . 170 PHE HE1 . 17389 1 1851 . 1 1 170 170 PHE HE2 H 1 6.937 0.020 . 1 . . . . 170 PHE HE2 . 17389 1 1852 . 1 1 170 170 PHE HZ H 1 6.816 0.020 . 1 . . . . 170 PHE HZ . 17389 1 1853 . 1 1 170 170 PHE CA C 13 57.531 0.400 . 1 . . . . 170 PHE CA . 17389 1 1854 . 1 1 170 170 PHE CB C 13 38.665 0.400 . 1 . . . . 170 PHE CB . 17389 1 1855 . 1 1 170 170 PHE CD1 C 13 132.636 0.400 . 1 . . . . 170 PHE CD1 . 17389 1 1856 . 1 1 170 170 PHE CD2 C 13 132.653 0.400 . 1 . . . . 170 PHE CD2 . 17389 1 1857 . 1 1 170 170 PHE CE1 C 13 130.151 0.400 . 1 . . . . 170 PHE CE1 . 17389 1 1858 . 1 1 170 170 PHE CE2 C 13 130.292 0.400 . 1 . . . . 170 PHE CE2 . 17389 1 1859 . 1 1 170 170 PHE CZ C 13 127.409 0.400 . 1 . . . . 170 PHE CZ . 17389 1 1860 . 1 1 170 170 PHE N N 15 116.157 0.400 . 1 . . . . 170 PHE N . 17389 1 1861 . 1 1 171 171 ARG H H 1 7.942 0.020 . 1 . . . . 171 ARG H . 17389 1 1862 . 1 1 171 171 ARG HA H 1 4.774 0.020 . 1 . . . . 171 ARG HA . 17389 1 1863 . 1 1 171 171 ARG HB2 H 1 2.018 0.020 . 2 . . . . 171 ARG HB2 . 17389 1 1864 . 1 1 171 171 ARG HB3 H 1 1.847 0.020 . 2 . . . . 171 ARG HB3 . 17389 1 1865 . 1 1 171 171 ARG HG2 H 1 1.738 0.020 . 2 . . . . 171 ARG HG2 . 17389 1 1866 . 1 1 171 171 ARG HG3 H 1 1.738 0.020 . 2 . . . . 171 ARG HG3 . 17389 1 1867 . 1 1 171 171 ARG HD2 H 1 3.269 0.020 . 2 . . . . 171 ARG HD2 . 17389 1 1868 . 1 1 171 171 ARG HD3 H 1 3.269 0.020 . 2 . . . . 171 ARG HD3 . 17389 1 1869 . 1 1 171 171 ARG CA C 13 53.308 0.400 . 1 . . . . 171 ARG CA . 17389 1 1870 . 1 1 171 171 ARG CB C 13 30.249 0.400 . 1 . . . . 171 ARG CB . 17389 1 1871 . 1 1 171 171 ARG CG C 13 26.256 0.400 . 1 . . . . 171 ARG CG . 17389 1 1872 . 1 1 171 171 ARG CD C 13 43.043 0.400 . 1 . . . . 171 ARG CD . 17389 1 1873 . 1 1 171 171 ARG N N 15 120.937 0.400 . 1 . . . . 171 ARG N . 17389 1 1874 . 1 1 172 172 PRO HA H 1 4.361 0.020 . 1 . . . . 172 PRO HA . 17389 1 1875 . 1 1 172 172 PRO HB2 H 1 2.277 0.020 . 2 . . . . 172 PRO HB2 . 17389 1 1876 . 1 1 172 172 PRO HB3 H 1 2.001 0.020 . 2 . . . . 172 PRO HB3 . 17389 1 1877 . 1 1 172 172 PRO HG2 H 1 2.013 0.020 . 2 . . . . 172 PRO HG2 . 17389 1 1878 . 1 1 172 172 PRO HG3 H 1 2.075 0.020 . 2 . . . . 172 PRO HG3 . 17389 1 1879 . 1 1 172 172 PRO HD2 H 1 3.712 0.020 . 2 . . . . 172 PRO HD2 . 17389 1 1880 . 1 1 172 172 PRO HD3 H 1 3.790 0.020 . 2 . . . . 172 PRO HD3 . 17389 1 1881 . 1 1 172 172 PRO CA C 13 63.059 0.400 . 1 . . . . 172 PRO CA . 17389 1 1882 . 1 1 172 172 PRO CB C 13 31.943 0.400 . 1 . . . . 172 PRO CB . 17389 1 1883 . 1 1 172 172 PRO CG C 13 27.356 0.400 . 1 . . . . 172 PRO CG . 17389 1 1884 . 1 1 172 172 PRO CD C 13 50.659 0.400 . 1 . . . . 172 PRO CD . 17389 1 1885 . 1 1 173 173 GLY H H 1 8.193 0.020 . 1 . . . . 173 GLY H . 17389 1 1886 . 1 1 173 173 GLY HA2 H 1 3.844 0.020 . 2 . . . . 173 GLY HA2 . 17389 1 1887 . 1 1 173 173 GLY HA3 H 1 4.042 0.020 . 2 . . . . 173 GLY HA3 . 17389 1 1888 . 1 1 173 173 GLY CA C 13 44.108 0.400 . 1 . . . . 173 GLY CA . 17389 1 1889 . 1 1 173 173 GLY N N 15 108.229 0.400 . 1 . . . . 173 GLY N . 17389 1 1890 . 1 1 174 174 PRO HA H 1 4.371 0.020 . 1 . . . . 174 PRO HA . 17389 1 1891 . 1 1 174 174 PRO HB2 H 1 1.972 0.020 . 2 . . . . 174 PRO HB2 . 17389 1 1892 . 1 1 174 174 PRO HB3 H 1 2.201 0.020 . 2 . . . . 174 PRO HB3 . 17389 1 1893 . 1 1 174 174 PRO HG2 H 1 1.965 0.020 . 2 . . . . 174 PRO HG2 . 17389 1 1894 . 1 1 174 174 PRO HG3 H 1 1.933 0.020 . 2 . . . . 174 PRO HG3 . 17389 1 1895 . 1 1 174 174 PRO HD2 H 1 3.350 0.020 . 2 . . . . 174 PRO HD2 . 17389 1 1896 . 1 1 174 174 PRO HD3 H 1 3.499 0.020 . 2 . . . . 174 PRO HD3 . 17389 1 1897 . 1 1 174 174 PRO CA C 13 63.101 0.400 . 1 . . . . 174 PRO CA . 17389 1 1898 . 1 1 174 174 PRO CB C 13 31.855 0.400 . 1 . . . . 174 PRO CB . 17389 1 1899 . 1 1 174 174 PRO CG C 13 26.654 0.400 . 1 . . . . 174 PRO CG . 17389 1 1900 . 1 1 174 174 PRO CD C 13 49.468 0.400 . 1 . . . . 174 PRO CD . 17389 1 1901 . 1 1 175 175 GLY H H 1 8.513 0.020 . 1 . . . . 175 GLY H . 17389 1 1902 . 1 1 175 175 GLY HA2 H 1 3.950 0.020 . 2 . . . . 175 GLY HA2 . 17389 1 1903 . 1 1 175 175 GLY HA3 H 1 3.950 0.020 . 2 . . . . 175 GLY HA3 . 17389 1 1904 . 1 1 175 175 GLY CA C 13 45.202 0.400 . 1 . . . . 175 GLY CA . 17389 1 1905 . 1 1 175 175 GLY N N 15 109.916 0.400 . 1 . . . . 175 GLY N . 17389 1 1906 . 1 1 176 176 SER H H 1 7.820 0.020 . 1 . . . . 176 SER H . 17389 1 1907 . 1 1 176 176 SER HA H 1 4.273 0.020 . 1 . . . . 176 SER HA . 17389 1 1908 . 1 1 176 176 SER HB2 H 1 3.854 0.020 . 2 . . . . 176 SER HB2 . 17389 1 1909 . 1 1 176 176 SER HB3 H 1 4.266 0.020 . 2 . . . . 176 SER HB3 . 17389 1 1910 . 1 1 176 176 SER CA C 13 59.825 0.400 . 1 . . . . 176 SER CA . 17389 1 1911 . 1 1 176 176 SER CB C 13 64.614 0.400 . 1 . . . . 176 SER CB . 17389 1 1912 . 1 1 176 176 SER N N 15 121.093 0.400 . 1 . . . . 176 SER N . 17389 1 stop_ save_