data_5770 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 5770 _Entry.Title ; Structural basis for simultaneous binding of two carboxy-terminal peptides of plant glutamate decarboxylase to calmodulin ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2003-03-14 _Entry.Accession_date 2003-03-14 _Entry.Last_release_date 2003-05-01 _Entry.Original_release_date 2003-05-01 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Kyoko Yap . L. . 5770 2 Tao Yuan . . . 5770 3 Tapas Mal . K. . 5770 4 Hans Vogel . J. . 5770 5 Mitsu Ikura . . . 5770 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 3 5770 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 1437 5770 '13C chemical shifts' 908 5770 '15N chemical shifts' 210 5770 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 . . 2003-05-01 2003-04-14 original author . 5770 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 5770 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 12684008 _Citation.Full_citation . _Citation.Title ; Structural basis for simultaneous binding of two carboxy-terminal peptides of plant glutamate decarboxylase to calmodulin ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full . _Citation.Journal_volume 328 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 193 _Citation.Page_last 204 _Citation.Year 2003 _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 Kyoko Yap . L. . 5770 1 2 Tao Yuan . . . 5770 1 3 Tapas Mal . K. . 5770 1 4 Hans Vogel . J. . 5770 1 5 Mitsu Ikura . . . 5770 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID calmodulin 5770 1 'glutamate decarboxylase' 5770 1 dimer 5770 1 peptide 5770 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_CaM-GAD_peptide_complex _Assembly.Sf_category assembly _Assembly.Sf_framecode system_CaM-GAD_peptide_complex _Assembly.Entry_ID 5770 _Assembly.ID 1 _Assembly.Name 'Ca2+/calmodulin-glutamate decarboxylase peptide complex' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number 4.1.1.15 _Assembly.Details 'The enzyme commission number 4.1.1.15 is for GAD peptide.' _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 5770 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 calmodulin 1 $calmodulin . . . native . . . . . 5770 1 2 'glutamate decarboxylase peptide A' 2 $GAD . . . native . . . . . 5770 1 3 'glutamate decarboxylase peptide B' 2 $GAD . . . native . . . . . 5770 1 4 'calcium ion I' 3 $CA . . . native . . . . . 5770 1 5 'calcium ion II' 3 $CA . . . native . . . . . 5770 1 6 'calcium ion III' 3 $CA . . . native . . . . . 5770 1 7 'calcium ion IV' 3 $CA . . . native . . . . . 5770 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . PDB 1NWD . . . . . . 5770 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'Ca2+/calmodulin-glutamate decarboxylase peptide complex' system 5770 1 'CaM-GAD peptide complex' abbreviation 5770 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_calmodulin _Entity.Sf_category entity _Entity.Sf_framecode calmodulin _Entity.Entry_ID 5770 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Calmodulin _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; ADQLTEEQIAEFKEAFSLFD KDGDGTITTKELGTVMRSLG QNPTEAELQDMINEVDADGN GTIDFPEFLTMMARKMKDTD SEEEIREAFRVFDKDGNGYI SAAELRHVMTNLGEKLTDEE VDEMIREADIDGDGQVNYEE FVQMMTAK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 148 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1NWD . "Solution Structure Of Ca2+CALMODULIN BOUND TO THE C- Terminal Domain Of Petunia Glutamate Decarboxylase" . . . . . 100.00 28 100.00 100.00 5.79e-09 . . . . 5770 1 2 no GB AAA33709 . "glutamate decarboxylase [Petunia x hybrida]" . . . . . 75.00 500 100.00 100.00 4.19e+00 . . . . 5770 1 3 no GB AAA33710 . "glutamate decarboxylase [Petunia x hybrida]" . . . . . 75.00 500 100.00 100.00 4.19e+00 . . . . 5770 1 4 no SP Q07346 . "RecName: Full=Glutamate decarboxylase; Short=GAD [Petunia x hybrida]" . . . . . 75.00 500 100.00 100.00 4.19e+00 . . . . 5770 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID Calmodulin common 5770 1 CaM abbreviation 5770 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 . ALA . 5770 1 2 . ASP . 5770 1 3 . GLN . 5770 1 4 . LEU . 5770 1 5 . THR . 5770 1 6 . GLU . 5770 1 7 . GLU . 5770 1 8 . GLN . 5770 1 9 . ILE . 5770 1 10 . ALA . 5770 1 11 . GLU . 5770 1 12 . PHE . 5770 1 13 . LYS . 5770 1 14 . GLU . 5770 1 15 . ALA . 5770 1 16 . PHE . 5770 1 17 . SER . 5770 1 18 . LEU . 5770 1 19 . PHE . 5770 1 20 . ASP . 5770 1 21 . LYS . 5770 1 22 . ASP . 5770 1 23 . GLY . 5770 1 24 . ASP . 5770 1 25 . GLY . 5770 1 26 . THR . 5770 1 27 . ILE . 5770 1 28 . THR . 5770 1 29 . THR . 5770 1 30 . LYS . 5770 1 31 . GLU . 5770 1 32 . LEU . 5770 1 33 . GLY . 5770 1 34 . THR . 5770 1 35 . VAL . 5770 1 36 . MET . 5770 1 37 . ARG . 5770 1 38 . SER . 5770 1 39 . LEU . 5770 1 40 . GLY . 5770 1 41 . GLN . 5770 1 42 . ASN . 5770 1 43 . PRO . 5770 1 44 . THR . 5770 1 45 . GLU . 5770 1 46 . ALA . 5770 1 47 . GLU . 5770 1 48 . LEU . 5770 1 49 . GLN . 5770 1 50 . ASP . 5770 1 51 . MET . 5770 1 52 . ILE . 5770 1 53 . ASN . 5770 1 54 . GLU . 5770 1 55 . VAL . 5770 1 56 . ASP . 5770 1 57 . ALA . 5770 1 58 . ASP . 5770 1 59 . GLY . 5770 1 60 . ASN . 5770 1 61 . GLY . 5770 1 62 . THR . 5770 1 63 . ILE . 5770 1 64 . ASP . 5770 1 65 . PHE . 5770 1 66 . PRO . 5770 1 67 . GLU . 5770 1 68 . PHE . 5770 1 69 . LEU . 5770 1 70 . THR . 5770 1 71 . MET . 5770 1 72 . MET . 5770 1 73 . ALA . 5770 1 74 . ARG . 5770 1 75 . LYS . 5770 1 76 . MET . 5770 1 77 . LYS . 5770 1 78 . ASP . 5770 1 79 . THR . 5770 1 80 . ASP . 5770 1 81 . SER . 5770 1 82 . GLU . 5770 1 83 . GLU . 5770 1 84 . GLU . 5770 1 85 . ILE . 5770 1 86 . ARG . 5770 1 87 . GLU . 5770 1 88 . ALA . 5770 1 89 . PHE . 5770 1 90 . ARG . 5770 1 91 . VAL . 5770 1 92 . PHE . 5770 1 93 . ASP . 5770 1 94 . LYS . 5770 1 95 . ASP . 5770 1 96 . GLY . 5770 1 97 . ASN . 5770 1 98 . GLY . 5770 1 99 . TYR . 5770 1 100 . ILE . 5770 1 101 . SER . 5770 1 102 . ALA . 5770 1 103 . ALA . 5770 1 104 . GLU . 5770 1 105 . LEU . 5770 1 106 . ARG . 5770 1 107 . HIS . 5770 1 108 . VAL . 5770 1 109 . MET . 5770 1 110 . THR . 5770 1 111 . ASN . 5770 1 112 . LEU . 5770 1 113 . GLY . 5770 1 114 . GLU . 5770 1 115 . LYS . 5770 1 116 . LEU . 5770 1 117 . THR . 5770 1 118 . ASP . 5770 1 119 . GLU . 5770 1 120 . GLU . 5770 1 121 . VAL . 5770 1 122 . ASP . 5770 1 123 . GLU . 5770 1 124 . MET . 5770 1 125 . ILE . 5770 1 126 . ARG . 5770 1 127 . GLU . 5770 1 128 . ALA . 5770 1 129 . ASP . 5770 1 130 . ILE . 5770 1 131 . ASP . 5770 1 132 . GLY . 5770 1 133 . ASP . 5770 1 134 . GLY . 5770 1 135 . GLN . 5770 1 136 . VAL . 5770 1 137 . ASN . 5770 1 138 . TYR . 5770 1 139 . GLU . 5770 1 140 . GLU . 5770 1 141 . PHE . 5770 1 142 . VAL . 5770 1 143 . GLN . 5770 1 144 . MET . 5770 1 145 . MET . 5770 1 146 . THR . 5770 1 147 . ALA . 5770 1 148 . LYS . 5770 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 . ALA 1 1 5770 1 . ASP 2 2 5770 1 . GLN 3 3 5770 1 . LEU 4 4 5770 1 . THR 5 5 5770 1 . GLU 6 6 5770 1 . GLU 7 7 5770 1 . GLN 8 8 5770 1 . ILE 9 9 5770 1 . ALA 10 10 5770 1 . GLU 11 11 5770 1 . PHE 12 12 5770 1 . LYS 13 13 5770 1 . GLU 14 14 5770 1 . ALA 15 15 5770 1 . PHE 16 16 5770 1 . SER 17 17 5770 1 . LEU 18 18 5770 1 . PHE 19 19 5770 1 . ASP 20 20 5770 1 . LYS 21 21 5770 1 . ASP 22 22 5770 1 . GLY 23 23 5770 1 . ASP 24 24 5770 1 . GLY 25 25 5770 1 . THR 26 26 5770 1 . ILE 27 27 5770 1 . THR 28 28 5770 1 . THR 29 29 5770 1 . LYS 30 30 5770 1 . GLU 31 31 5770 1 . LEU 32 32 5770 1 . GLY 33 33 5770 1 . THR 34 34 5770 1 . VAL 35 35 5770 1 . MET 36 36 5770 1 . ARG 37 37 5770 1 . SER 38 38 5770 1 . LEU 39 39 5770 1 . GLY 40 40 5770 1 . GLN 41 41 5770 1 . ASN 42 42 5770 1 . PRO 43 43 5770 1 . THR 44 44 5770 1 . GLU 45 45 5770 1 . ALA 46 46 5770 1 . GLU 47 47 5770 1 . LEU 48 48 5770 1 . GLN 49 49 5770 1 . ASP 50 50 5770 1 . MET 51 51 5770 1 . ILE 52 52 5770 1 . ASN 53 53 5770 1 . GLU 54 54 5770 1 . VAL 55 55 5770 1 . ASP 56 56 5770 1 . ALA 57 57 5770 1 . ASP 58 58 5770 1 . GLY 59 59 5770 1 . ASN 60 60 5770 1 . GLY 61 61 5770 1 . THR 62 62 5770 1 . ILE 63 63 5770 1 . ASP 64 64 5770 1 . PHE 65 65 5770 1 . PRO 66 66 5770 1 . GLU 67 67 5770 1 . PHE 68 68 5770 1 . LEU 69 69 5770 1 . THR 70 70 5770 1 . MET 71 71 5770 1 . MET 72 72 5770 1 . ALA 73 73 5770 1 . ARG 74 74 5770 1 . LYS 75 75 5770 1 . MET 76 76 5770 1 . LYS 77 77 5770 1 . ASP 78 78 5770 1 . THR 79 79 5770 1 . ASP 80 80 5770 1 . SER 81 81 5770 1 . GLU 82 82 5770 1 . GLU 83 83 5770 1 . GLU 84 84 5770 1 . ILE 85 85 5770 1 . ARG 86 86 5770 1 . GLU 87 87 5770 1 . ALA 88 88 5770 1 . PHE 89 89 5770 1 . ARG 90 90 5770 1 . VAL 91 91 5770 1 . PHE 92 92 5770 1 . ASP 93 93 5770 1 . LYS 94 94 5770 1 . ASP 95 95 5770 1 . GLY 96 96 5770 1 . ASN 97 97 5770 1 . GLY 98 98 5770 1 . TYR 99 99 5770 1 . ILE 100 100 5770 1 . SER 101 101 5770 1 . ALA 102 102 5770 1 . ALA 103 103 5770 1 . GLU 104 104 5770 1 . LEU 105 105 5770 1 . ARG 106 106 5770 1 . HIS 107 107 5770 1 . VAL 108 108 5770 1 . MET 109 109 5770 1 . THR 110 110 5770 1 . ASN 111 111 5770 1 . LEU 112 112 5770 1 . GLY 113 113 5770 1 . GLU 114 114 5770 1 . LYS 115 115 5770 1 . LEU 116 116 5770 1 . THR 117 117 5770 1 . ASP 118 118 5770 1 . GLU 119 119 5770 1 . GLU 120 120 5770 1 . VAL 121 121 5770 1 . ASP 122 122 5770 1 . GLU 123 123 5770 1 . MET 124 124 5770 1 . ILE 125 125 5770 1 . ARG 126 126 5770 1 . GLU 127 127 5770 1 . ALA 128 128 5770 1 . ASP 129 129 5770 1 . ILE 130 130 5770 1 . ASP 131 131 5770 1 . GLY 132 132 5770 1 . ASP 133 133 5770 1 . GLY 134 134 5770 1 . GLN 135 135 5770 1 . VAL 136 136 5770 1 . ASN 137 137 5770 1 . TYR 138 138 5770 1 . GLU 139 139 5770 1 . GLU 140 140 5770 1 . PHE 141 141 5770 1 . VAL 142 142 5770 1 . GLN 143 143 5770 1 . MET 144 144 5770 1 . MET 145 145 5770 1 . THR 146 146 5770 1 . ALA 147 147 5770 1 . LYS 148 148 5770 1 stop_ save_ save_GAD _Entity.Sf_category entity _Entity.Sf_framecode GAD _Entity.Entry_ID 5770 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name 'Glutamate decarboxylase' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSHKKTDSEVQLEMITAWKK FVEEKKKK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 28 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details "N-terminal 'GS' is a cloning artifact." _Entity.DB_query_date 2008-08-19 _Entity.DB_query_revised_last_date 2008-08-19 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 . . GenBank AAA33710 . 'glutamate decarboxylase' . . . . . 75.00 500 100.00 100.00 4.49e+00 . . . . 5770 2 . . SWISS-PROT Q07346 . 'Glutamate decarboxylase (GAD)' . . . . . 75.00 500 100.00 100.00 4.49e+00 . . . . 5770 2 . . PDB 1NWD . 'Solution Structure Of Ca2+CALMODULIN BOUND TO THE C- Terminal Domain Of Petunia Glutamate Decarboxylase' . . . . . 100.00 28 100.00 100.00 1.93e-06 . . . . 5770 2 . . GenBank AAA33709 . 'glutamate decarboxylase' . . . . . 75.00 500 100.00 100.00 4.49e+00 . . . . 5770 2 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Glutamate decarboxylase' common 5770 2 GAD abbreviation 5770 2 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 5770 2 2 . SER . 5770 2 3 . HIS . 5770 2 4 . LYS . 5770 2 5 . LYS . 5770 2 6 . THR . 5770 2 7 . ASP . 5770 2 8 . SER . 5770 2 9 . GLU . 5770 2 10 . VAL . 5770 2 11 . GLN . 5770 2 12 . LEU . 5770 2 13 . GLU . 5770 2 14 . MET . 5770 2 15 . ILE . 5770 2 16 . THR . 5770 2 17 . ALA . 5770 2 18 . TRP . 5770 2 19 . LYS . 5770 2 20 . LYS . 5770 2 21 . PHE . 5770 2 22 . VAL . 5770 2 23 . GLU . 5770 2 24 . GLU . 5770 2 25 . LYS . 5770 2 26 . LYS . 5770 2 27 . LYS . 5770 2 28 . LYS . 5770 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 5770 2 . SER 2 2 5770 2 . HIS 3 3 5770 2 . LYS 4 4 5770 2 . LYS 5 5 5770 2 . THR 6 6 5770 2 . ASP 7 7 5770 2 . SER 8 8 5770 2 . GLU 9 9 5770 2 . VAL 10 10 5770 2 . GLN 11 11 5770 2 . LEU 12 12 5770 2 . GLU 13 13 5770 2 . MET 14 14 5770 2 . ILE 15 15 5770 2 . THR 16 16 5770 2 . ALA 17 17 5770 2 . TRP 18 18 5770 2 . LYS 19 19 5770 2 . LYS 20 20 5770 2 . PHE 21 21 5770 2 . VAL 22 22 5770 2 . GLU 23 23 5770 2 . GLU 24 24 5770 2 . LYS 25 25 5770 2 . LYS 26 26 5770 2 . LYS 27 27 5770 2 . LYS 28 28 5770 2 stop_ save_ save_CA _Entity.Sf_category entity _Entity.Sf_framecode CA _Entity.Entry_ID 5770 _Entity.ID 3 _Entity.BMRB_code . _Entity.Name CA _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _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 . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID CA _Entity.Nonpolymer_comp_label $chem_comp_CA _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 3 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . CA . 5770 3 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 5770 _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 $calmodulin . 8355 organism . 'Xenopus laevis' 'African clawed frog' . . Eukaryota Metazoa Xenopus laevis . . . . . . . . . . . . . . . . . . . . . 5770 1 2 2 $GAD . 4102 organism . 'Petunia hybrida' 'Petunia hybrida' . . Eukaryota Viridiplantae Petunia hybrida . . . . . . . . . . . . . . . . . . . . . 5770 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 5770 _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 $calmodulin . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli AR58 . . . . . . . . . . . . plasmid . . pAS . . . . . . 5770 1 2 2 $GAD . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli BL21 DE3 . . . . . . . . . . . plasmid . . pGEX-2T . . . . . . 5770 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_CA _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_CA _Chem_comp.Entry_ID 5770 _Chem_comp.ID CA _Chem_comp.Provenance . _Chem_comp.Name 'CALCIUM ION' _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code CA _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 1999-07-08 _Chem_comp.Modified_date 2011-06-04 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code CA _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code . _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Ca _Chem_comp.Formula_weight 40.078 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Fri Jun 10 15:27:54 2011 ; _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID [Ca+2] SMILES ACDLabs 10.04 5770 CA [Ca++] SMILES_CANONICAL CACTVS 3.341 5770 CA [Ca++] SMILES CACTVS 3.341 5770 CA [Ca+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 5770 CA [Ca+2] SMILES 'OpenEye OEToolkits' 1.5.0 5770 CA InChI=1S/Ca/q+2 InChI InChI 1.03 5770 CA BHPQYMZQTOCNFJ-UHFFFAOYSA-N InChIKey InChI 1.03 5770 CA stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID calcium 'SYSTEMATIC NAME' ACDLabs 10.04 5770 CA 'calcium(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 5770 CA stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID CA . CA . . CA . . N 2 . . . . no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 5770 CA stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 5770 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Calmodulin [U-15N] . . 1 $calmodulin . . 1.0 . . mM . . . . 5770 1 2 'Glutamate decarboxylase' '[U-50% 13C]' . . 2 $GAD . . 2.2 . . mM . . . . 5770 1 3 KCl . . . . . . . 100 . . mM . . . . 5770 1 4 CaCl2 . . . . . . . 10 . . mM . . . . 5770 1 5 D2O . . . . . . . 9 . . % . . . . 5770 1 6 H2O . . . . . . . 91 . . % . . . . 5770 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 5770 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Calmodulin '[U-15N; U-13C]' . . 1 $calmodulin . . 1.0 . . mM . . . . 5770 2 2 'Glutamate decarboxylase' '[U-50% 13C]' . . 2 $GAD . . 2.2 . . mM . . . . 5770 2 3 KCl . . . . . . . 100 . . mM . . . . 5770 2 4 CaCl2 . . . . . . . 10 . . mM . . . . 5770 2 5 D2O . . . . . . . 9 . . % . . . . 5770 2 6 H2O . . . . . . . 91 . . % . . . . 5770 2 stop_ save_ ####################### # Sample conditions # ####################### save_Ex-cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Ex-cond_1 _Sample_condition_list.Entry_ID 5770 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.3 . n/a 5770 1 temperature 308 . K 5770 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 5770 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Unity-Plus _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 5770 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Unity-Plus _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 5770 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Varian Unity-Plus . 500 . . . 5770 1 2 NMR_spectrometer_2 Varian Unity-Plus . 600 . . . 5770 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 5770 _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 '1H, 15N HSQC' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5770 1 2 '1H, 13C HSQC' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5770 1 3 HNCACB . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5770 1 4 CBCA(CO)NH . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5770 1 5 HNCO . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5770 1 6 HCCH-TOCSY . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5770 1 7 HCC-TOCSY-NNH . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5770 1 8 (HB)CB(CGCD)HD . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5770 1 9 (HB)CB(CGCE)HE . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5770 1 10 '3D simultaneous 13C,15N-edited NOESY-HSQC' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5770 1 11 '13C-edited, 13C-filtered NOESY-HSQC' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5770 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 5770 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '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 . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _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 . save_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 5770 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '1H, 13C HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _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 . save_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 5770 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name HNCACB _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _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 . save_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 5770 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name 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 . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _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 . save_ save_NMR_spec_expt__0_5 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_5 _NMR_spec_expt.Entry_ID 5770 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name HNCO _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _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 . save_ save_NMR_spec_expt__0_6 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_6 _NMR_spec_expt.Entry_ID 5770 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name HCCH-TOCSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _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 . save_ save_NMR_spec_expt__0_7 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_7 _NMR_spec_expt.Entry_ID 5770 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name HCC-TOCSY-NNH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _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 . save_ save_NMR_spec_expt__0_8 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_8 _NMR_spec_expt.Entry_ID 5770 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name (HB)CB(CGCD)HD _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _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 . save_ save_NMR_spec_expt__0_9 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_9 _NMR_spec_expt.Entry_ID 5770 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name (HB)CB(CGCE)HE _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _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 . save_ save_NMR_spec_expt__0_10 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_10 _NMR_spec_expt.Entry_ID 5770 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name '3D simultaneous 13C,15N-edited NOESY-HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _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 . save_ save_NMR_spec_expt__0_11 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_11 _NMR_spec_expt.Entry_ID 5770 _NMR_spec_expt.ID 11 _NMR_spec_expt.Name '13C-edited, 13C-filtered NOESY-HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _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 . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 5770 _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 H 1 TSP 'methyl protons' . . . . ppm 0.0 external direct 1.0 external . parallel 1 $entry_citation . . 1 $entry_citation 5770 1 C 13 TSP 'methyl protons' . . . . ppm 0.0 external indirect 0.2514556137 external . parallel 1 $entry_citation . . 1 $entry_citation 5770 1 N 15 TSP 'methyl protons' . . . . ppm 0.0 external indirect 0.1013403477 external . parallel 1 $entry_citation . . 1 $entry_citation 5770 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_shift_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode shift_set_1 _Assigned_chem_shift_list.Entry_ID 5770 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Ex-cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 . 5770 1 . . 2 $sample_2 . 5770 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ALA CA C 13 51.9 0.30 . 1 . . . . . . . . 5770 1 2 . 1 1 1 1 ALA HA H 1 4.14 0.02 . 1 . . . . . . . . 5770 1 3 . 1 1 1 1 ALA HB1 H 1 1.56 0.02 . 1 . . . . . . . . 5770 1 4 . 1 1 1 1 ALA HB2 H 1 1.56 0.02 . 1 . . . . . . . . 5770 1 5 . 1 1 1 1 ALA HB3 H 1 1.56 0.02 . 1 . . . . . . . . 5770 1 6 . 1 1 1 1 ALA CB C 13 19.4 0.30 . 1 . . . . . . . . 5770 1 7 . 1 1 2 2 ASP CA C 13 54.7 0.30 . 1 . . . . . . . . 5770 1 8 . 1 1 2 2 ASP HA H 1 4.66 0.02 . 1 . . . . . . . . 5770 1 9 . 1 1 2 2 ASP CB C 13 41.5 0.30 . 1 . . . . . . . . 5770 1 10 . 1 1 2 2 ASP HB2 H 1 2.70 0.02 . 2 . . . . . . . . 5770 1 11 . 1 1 2 2 ASP HB3 H 1 2.62 0.02 . 2 . . . . . . . . 5770 1 12 . 1 1 2 2 ASP C C 13 175.6 0.30 . 1 . . . . . . . . 5770 1 13 . 1 1 3 3 GLN N N 15 119.6 0.20 . 1 . . . . . . . . 5770 1 14 . 1 1 3 3 GLN H H 1 8.30 0.02 . 1 . . . . . . . . 5770 1 15 . 1 1 3 3 GLN CA C 13 55.6 0.30 . 1 . . . . . . . . 5770 1 16 . 1 1 3 3 GLN HA H 1 4.41 0.02 . 1 . . . . . . . . 5770 1 17 . 1 1 3 3 GLN CB C 13 29.9 0.30 . 1 . . . . . . . . 5770 1 18 . 1 1 3 3 GLN HB2 H 1 2.12 0.02 . 2 . . . . . . . . 5770 1 19 . 1 1 3 3 GLN HB3 H 1 2.00 0.02 . 2 . . . . . . . . 5770 1 20 . 1 1 3 3 GLN CG C 13 33.8 0.30 . 1 . . . . . . . . 5770 1 21 . 1 1 3 3 GLN HG2 H 1 2.37 0.02 . 1 . . . . . . . . 5770 1 22 . 1 1 3 3 GLN HG3 H 1 2.37 0.02 . 1 . . . . . . . . 5770 1 23 . 1 1 3 3 GLN CD C 13 180.7 0.30 . 1 . . . . . . . . 5770 1 24 . 1 1 3 3 GLN NE2 N 15 112.3 0.20 . 1 . . . . . . . . 5770 1 25 . 1 1 3 3 GLN HE21 H 1 7.52 0.02 . 2 . . . . . . . . 5770 1 26 . 1 1 3 3 GLN HE22 H 1 6.83 0.02 . 2 . . . . . . . . 5770 1 27 . 1 1 3 3 GLN C C 13 175.6 0.30 . 1 . . . . . . . . 5770 1 28 . 1 1 4 4 LEU N N 15 123.0 0.20 . 1 . . . . . . . . 5770 1 29 . 1 1 4 4 LEU H H 1 8.25 0.02 . 1 . . . . . . . . 5770 1 30 . 1 1 4 4 LEU CA C 13 54.6 0.30 . 1 . . . . . . . . 5770 1 31 . 1 1 4 4 LEU HA H 1 4.68 0.02 . 1 . . . . . . . . 5770 1 32 . 1 1 4 4 LEU CB C 13 43.7 0.30 . 1 . . . . . . . . 5770 1 33 . 1 1 4 4 LEU HB2 H 1 1.75 0.02 . 2 . . . . . . . . 5770 1 34 . 1 1 4 4 LEU HB3 H 1 1.58 0.02 . 2 . . . . . . . . 5770 1 35 . 1 1 4 4 LEU CG C 13 27.3 0.30 . 1 . . . . . . . . 5770 1 36 . 1 1 4 4 LEU HG H 1 1.75 0.02 . 1 . . . . . . . . 5770 1 37 . 1 1 4 4 LEU HD11 H 1 0.93 0.02 . 1 . . . . . . . . 5770 1 38 . 1 1 4 4 LEU HD12 H 1 0.93 0.02 . 1 . . . . . . . . 5770 1 39 . 1 1 4 4 LEU HD13 H 1 0.93 0.02 . 1 . . . . . . . . 5770 1 40 . 1 1 4 4 LEU HD21 H 1 0.93 0.02 . 1 . . . . . . . . 5770 1 41 . 1 1 4 4 LEU HD22 H 1 0.93 0.02 . 1 . . . . . . . . 5770 1 42 . 1 1 4 4 LEU HD23 H 1 0.93 0.02 . 1 . . . . . . . . 5770 1 43 . 1 1 4 4 LEU CD1 C 13 26.6 0.30 . 1 . . . . . . . . 5770 1 44 . 1 1 4 4 LEU CD2 C 13 24.1 0.30 . 1 . . . . . . . . 5770 1 45 . 1 1 4 4 LEU C C 13 177.6 0.30 . 1 . . . . . . . . 5770 1 46 . 1 1 5 5 THR N N 15 113.1 0.20 . 1 . . . . . . . . 5770 1 47 . 1 1 5 5 THR H H 1 8.65 0.02 . 1 . . . . . . . . 5770 1 48 . 1 1 5 5 THR CA C 13 60.5 0.30 . 1 . . . . . . . . 5770 1 49 . 1 1 5 5 THR HA H 1 4.51 0.02 . 1 . . . . . . . . 5770 1 50 . 1 1 5 5 THR CB C 13 71.1 0.30 . 1 . . . . . . . . 5770 1 51 . 1 1 5 5 THR HB H 1 4.80 0.02 . 1 . . . . . . . . 5770 1 52 . 1 1 5 5 THR HG21 H 1 1.36 0.02 . 1 . . . . . . . . 5770 1 53 . 1 1 5 5 THR HG22 H 1 1.36 0.02 . 1 . . . . . . . . 5770 1 54 . 1 1 5 5 THR HG23 H 1 1.36 0.02 . 1 . . . . . . . . 5770 1 55 . 1 1 5 5 THR CG2 C 13 22.0 0.30 . 1 . . . . . . . . 5770 1 56 . 1 1 5 5 THR C C 13 175.5 0.30 . 1 . . . . . . . . 5770 1 57 . 1 1 6 6 GLU N N 15 120.6 0.20 . 1 . . . . . . . . 5770 1 58 . 1 1 6 6 GLU H H 1 9.02 0.02 . 1 . . . . . . . . 5770 1 59 . 1 1 6 6 GLU CA C 13 59.9 0.30 . 1 . . . . . . . . 5770 1 60 . 1 1 6 6 GLU HA H 1 4.02 0.02 . 1 . . . . . . . . 5770 1 61 . 1 1 6 6 GLU CB C 13 29.3 0.30 . 1 . . . . . . . . 5770 1 62 . 1 1 6 6 GLU HB2 H 1 2.09 0.02 . 1 . . . . . . . . 5770 1 63 . 1 1 6 6 GLU HB3 H 1 2.09 0.02 . 1 . . . . . . . . 5770 1 64 . 1 1 6 6 GLU CG C 13 36.6 0.30 . 1 . . . . . . . . 5770 1 65 . 1 1 6 6 GLU HG2 H 1 2.43 0.02 . 2 . . . . . . . . 5770 1 66 . 1 1 6 6 GLU HG3 H 1 2.33 0.02 . 2 . . . . . . . . 5770 1 67 . 1 1 6 6 GLU C C 13 179.5 0.30 . 1 . . . . . . . . 5770 1 68 . 1 1 7 7 GLU N N 15 119.4 0.20 . 1 . . . . . . . . 5770 1 69 . 1 1 7 7 GLU H H 1 8.72 0.02 . 1 . . . . . . . . 5770 1 70 . 1 1 7 7 GLU CA C 13 59.7 0.30 . 1 . . . . . . . . 5770 1 71 . 1 1 7 7 GLU HA H 1 4.11 0.02 . 1 . . . . . . . . 5770 1 72 . 1 1 7 7 GLU CB C 13 29.1 0.30 . 1 . . . . . . . . 5770 1 73 . 1 1 7 7 GLU HB2 H 1 2.07 0.02 . 2 . . . . . . . . 5770 1 74 . 1 1 7 7 GLU HB3 H 1 1.98 0.02 . 2 . . . . . . . . 5770 1 75 . 1 1 7 7 GLU CG C 13 36.9 0.30 . 1 . . . . . . . . 5770 1 76 . 1 1 7 7 GLU HG2 H 1 2.22 0.02 . 1 . . . . . . . . 5770 1 77 . 1 1 7 7 GLU HG3 H 1 2.22 0.02 . 1 . . . . . . . . 5770 1 78 . 1 1 7 7 GLU C C 13 179.1 0.30 . 1 . . . . . . . . 5770 1 79 . 1 1 8 8 GLN N N 15 120.2 0.20 . 1 . . . . . . . . 5770 1 80 . 1 1 8 8 GLN H H 1 7.75 0.02 . 1 . . . . . . . . 5770 1 81 . 1 1 8 8 GLN CA C 13 58.7 0.30 . 1 . . . . . . . . 5770 1 82 . 1 1 8 8 GLN HA H 1 3.97 0.02 . 1 . . . . . . . . 5770 1 83 . 1 1 8 8 GLN CB C 13 29.3 0.30 . 1 . . . . . . . . 5770 1 84 . 1 1 8 8 GLN HB2 H 1 2.43 0.02 . 2 . . . . . . . . 5770 1 85 . 1 1 8 8 GLN HB3 H 1 1.82 0.02 . 2 . . . . . . . . 5770 1 86 . 1 1 8 8 GLN CG C 13 35.0 0.30 . 1 . . . . . . . . 5770 1 87 . 1 1 8 8 GLN HG2 H 1 2.42 0.02 . 2 . . . . . . . . 5770 1 88 . 1 1 8 8 GLN HG3 H 1 2.38 0.02 . 2 . . . . . . . . 5770 1 89 . 1 1 8 8 GLN CD C 13 179.9 0.30 . 1 . . . . . . . . 5770 1 90 . 1 1 8 8 GLN NE2 N 15 111.3 0.20 . 1 . . . . . . . . 5770 1 91 . 1 1 8 8 GLN HE21 H 1 7.45 0.02 . 2 . . . . . . . . 5770 1 92 . 1 1 8 8 GLN HE22 H 1 6.78 0.02 . 2 . . . . . . . . 5770 1 93 . 1 1 8 8 GLN C C 13 178.5 0.30 . 1 . . . . . . . . 5770 1 94 . 1 1 9 9 ILE N N 15 119.6 0.20 . 1 . . . . . . . . 5770 1 95 . 1 1 9 9 ILE H H 1 8.42 0.02 . 1 . . . . . . . . 5770 1 96 . 1 1 9 9 ILE CA C 13 66.4 0.30 . 1 . . . . . . . . 5770 1 97 . 1 1 9 9 ILE HA H 1 3.79 0.02 . 1 . . . . . . . . 5770 1 98 . 1 1 9 9 ILE CB C 13 37.8 0.30 . 1 . . . . . . . . 5770 1 99 . 1 1 9 9 ILE HB H 1 2.01 0.02 . 1 . . . . . . . . 5770 1 100 . 1 1 9 9 ILE HG21 H 1 1.16 0.02 . 1 . . . . . . . . 5770 1 101 . 1 1 9 9 ILE HG22 H 1 1.16 0.02 . 1 . . . . . . . . 5770 1 102 . 1 1 9 9 ILE HG23 H 1 1.16 0.02 . 1 . . . . . . . . 5770 1 103 . 1 1 9 9 ILE CG2 C 13 17.6 0.30 . 1 . . . . . . . . 5770 1 104 . 1 1 9 9 ILE CG1 C 13 30.4 0.30 . 1 . . . . . . . . 5770 1 105 . 1 1 9 9 ILE HG12 H 1 1.86 0.02 . 2 . . . . . . . . 5770 1 106 . 1 1 9 9 ILE HG13 H 1 1.15 0.02 . 2 . . . . . . . . 5770 1 107 . 1 1 9 9 ILE HD11 H 1 0.89 0.02 . 1 . . . . . . . . 5770 1 108 . 1 1 9 9 ILE HD12 H 1 0.89 0.02 . 1 . . . . . . . . 5770 1 109 . 1 1 9 9 ILE HD13 H 1 0.89 0.02 . 1 . . . . . . . . 5770 1 110 . 1 1 9 9 ILE CD1 C 13 13.1 0.30 . 1 . . . . . . . . 5770 1 111 . 1 1 9 9 ILE C C 13 178.7 0.30 . 1 . . . . . . . . 5770 1 112 . 1 1 10 10 ALA N N 15 121.4 0.20 . 1 . . . . . . . . 5770 1 113 . 1 1 10 10 ALA H H 1 8.07 0.02 . 1 . . . . . . . . 5770 1 114 . 1 1 10 10 ALA CA C 13 55.4 0.30 . 1 . . . . . . . . 5770 1 115 . 1 1 10 10 ALA HA H 1 4.23 0.02 . 1 . . . . . . . . 5770 1 116 . 1 1 10 10 ALA HB1 H 1 1.56 0.02 . 1 . . . . . . . . 5770 1 117 . 1 1 10 10 ALA HB2 H 1 1.56 0.02 . 1 . . . . . . . . 5770 1 118 . 1 1 10 10 ALA HB3 H 1 1.56 0.02 . 1 . . . . . . . . 5770 1 119 . 1 1 10 10 ALA CB C 13 18.0 0.30 . 1 . . . . . . . . 5770 1 120 . 1 1 10 10 ALA C C 13 179.1 0.30 . 1 . . . . . . . . 5770 1 121 . 1 1 11 11 GLU N N 15 119.9 0.20 . 1 . . . . . . . . 5770 1 122 . 1 1 11 11 GLU H H 1 7.86 0.02 . 1 . . . . . . . . 5770 1 123 . 1 1 11 11 GLU CA C 13 59.5 0.30 . 1 . . . . . . . . 5770 1 124 . 1 1 11 11 GLU HA H 1 4.15 0.02 . 1 . . . . . . . . 5770 1 125 . 1 1 11 11 GLU CB C 13 29.3 0.30 . 1 . . . . . . . . 5770 1 126 . 1 1 11 11 GLU HB2 H 1 2.14 0.02 . 2 . . . . . . . . 5770 1 127 . 1 1 11 11 GLU HB3 H 1 2.06 0.02 . 2 . . . . . . . . 5770 1 128 . 1 1 11 11 GLU CG C 13 36.2 0.30 . 1 . . . . . . . . 5770 1 129 . 1 1 11 11 GLU HG2 H 1 2.40 0.02 . 1 . . . . . . . . 5770 1 130 . 1 1 11 11 GLU HG3 H 1 2.40 0.02 . 1 . . . . . . . . 5770 1 131 . 1 1 11 11 GLU C C 13 180.5 0.30 . 1 . . . . . . . . 5770 1 132 . 1 1 12 12 PHE N N 15 119.8 0.20 . 1 . . . . . . . . 5770 1 133 . 1 1 12 12 PHE H H 1 8.44 0.02 . 1 . . . . . . . . 5770 1 134 . 1 1 12 12 PHE CA C 13 60.1 0.30 . 1 . . . . . . . . 5770 1 135 . 1 1 12 12 PHE HA H 1 4.95 0.02 . 1 . . . . . . . . 5770 1 136 . 1 1 12 12 PHE CB C 13 38.3 0.30 . 1 . . . . . . . . 5770 1 137 . 1 1 12 12 PHE HB2 H 1 3.49 0.02 . 2 . . . . . . . . 5770 1 138 . 1 1 12 12 PHE HB3 H 1 3.46 0.02 . 2 . . . . . . . . 5770 1 139 . 1 1 12 12 PHE HD1 H 1 7.21 0.02 . 1 . . . . . . . . 5770 1 140 . 1 1 12 12 PHE HD2 H 1 7.21 0.02 . 1 . . . . . . . . 5770 1 141 . 1 1 12 12 PHE HE1 H 1 7.25 0.02 . 1 . . . . . . . . 5770 1 142 . 1 1 12 12 PHE HE2 H 1 7.25 0.02 . 1 . . . . . . . . 5770 1 143 . 1 1 12 12 PHE CD1 C 13 129.8 0.30 . 1 . . . . . . . . 5770 1 144 . 1 1 12 12 PHE CE1 C 13 129.8 0.30 . 1 . . . . . . . . 5770 1 145 . 1 1 12 12 PHE CZ C 13 132.1 0.30 . 1 . . . . . . . . 5770 1 146 . 1 1 12 12 PHE HZ H 1 6.75 0.02 . 1 . . . . . . . . 5770 1 147 . 1 1 12 12 PHE CE2 C 13 129.8 0.30 . 1 . . . . . . . . 5770 1 148 . 1 1 12 12 PHE CD2 C 13 129.8 0.30 . 1 . . . . . . . . 5770 1 149 . 1 1 12 12 PHE C C 13 178.5 0.30 . 1 . . . . . . . . 5770 1 150 . 1 1 13 13 LYS N N 15 124.1 0.20 . 1 . . . . . . . . 5770 1 151 . 1 1 13 13 LYS H H 1 9.17 0.02 . 1 . . . . . . . . 5770 1 152 . 1 1 13 13 LYS CA C 13 60.1 0.30 . 1 . . . . . . . . 5770 1 153 . 1 1 13 13 LYS HA H 1 3.86 0.02 . 1 . . . . . . . . 5770 1 154 . 1 1 13 13 LYS CB C 13 31.8 0.30 . 1 . . . . . . . . 5770 1 155 . 1 1 13 13 LYS HB2 H 1 1.89 0.02 . 2 . . . . . . . . 5770 1 156 . 1 1 13 13 LYS HB3 H 1 1.75 0.02 . 2 . . . . . . . . 5770 1 157 . 1 1 13 13 LYS CG C 13 25.3 0.30 . 1 . . . . . . . . 5770 1 158 . 1 1 13 13 LYS HG2 H 1 1.01 0.02 . 2 . . . . . . . . 5770 1 159 . 1 1 13 13 LYS HG3 H 1 0.91 0.02 . 2 . . . . . . . . 5770 1 160 . 1 1 13 13 LYS CD C 13 28.6 0.30 . 1 . . . . . . . . 5770 1 161 . 1 1 13 13 LYS HD2 H 1 1.30 0.02 . 2 . . . . . . . . 5770 1 162 . 1 1 13 13 LYS HD3 H 1 1.15 0.02 . 2 . . . . . . . . 5770 1 163 . 1 1 13 13 LYS CE C 13 41.9 0.30 . 1 . . . . . . . . 5770 1 164 . 1 1 13 13 LYS HE2 H 1 2.59 0.02 . 1 . . . . . . . . 5770 1 165 . 1 1 13 13 LYS HE3 H 1 2.59 0.02 . 1 . . . . . . . . 5770 1 166 . 1 1 13 13 LYS C C 13 179.4 0.30 . 1 . . . . . . . . 5770 1 167 . 1 1 14 14 GLU N N 15 120.5 0.20 . 1 . . . . . . . . 5770 1 168 . 1 1 14 14 GLU H H 1 7.98 0.02 . 1 . . . . . . . . 5770 1 169 . 1 1 14 14 GLU CA C 13 59.5 0.30 . 1 . . . . . . . . 5770 1 170 . 1 1 14 14 GLU HA H 1 4.13 0.02 . 1 . . . . . . . . 5770 1 171 . 1 1 14 14 GLU CB C 13 29.2 0.30 . 1 . . . . . . . . 5770 1 172 . 1 1 14 14 GLU HB2 H 1 2.26 0.02 . 1 . . . . . . . . 5770 1 173 . 1 1 14 14 GLU HB3 H 1 2.26 0.02 . 1 . . . . . . . . 5770 1 174 . 1 1 14 14 GLU CG C 13 36.2 0.30 . 1 . . . . . . . . 5770 1 175 . 1 1 14 14 GLU HG2 H 1 2.48 0.02 . 1 . . . . . . . . 5770 1 176 . 1 1 14 14 GLU HG3 H 1 2.48 0.02 . 1 . . . . . . . . 5770 1 177 . 1 1 14 14 GLU C C 13 179.6 0.30 . 1 . . . . . . . . 5770 1 178 . 1 1 15 15 ALA N N 15 121.9 0.20 . 1 . . . . . . . . 5770 1 179 . 1 1 15 15 ALA H H 1 8.00 0.02 . 1 . . . . . . . . 5770 1 180 . 1 1 15 15 ALA CA C 13 55.6 0.30 . 1 . . . . . . . . 5770 1 181 . 1 1 15 15 ALA HA H 1 4.22 0.02 . 1 . . . . . . . . 5770 1 182 . 1 1 15 15 ALA HB1 H 1 1.99 0.02 . 1 . . . . . . . . 5770 1 183 . 1 1 15 15 ALA HB2 H 1 1.99 0.02 . 1 . . . . . . . . 5770 1 184 . 1 1 15 15 ALA HB3 H 1 1.99 0.02 . 1 . . . . . . . . 5770 1 185 . 1 1 15 15 ALA CB C 13 18.9 0.30 . 1 . . . . . . . . 5770 1 186 . 1 1 15 15 ALA C C 13 179.2 0.30 . 1 . . . . . . . . 5770 1 187 . 1 1 16 16 PHE N N 15 118.9 0.20 . 1 . . . . . . . . 5770 1 188 . 1 1 16 16 PHE H H 1 8.86 0.02 . 1 . . . . . . . . 5770 1 189 . 1 1 16 16 PHE CA C 13 62.2 0.30 . 1 . . . . . . . . 5770 1 190 . 1 1 16 16 PHE HA H 1 3.40 0.02 . 1 . . . . . . . . 5770 1 191 . 1 1 16 16 PHE CB C 13 39.8 0.30 . 1 . . . . . . . . 5770 1 192 . 1 1 16 16 PHE HB2 H 1 3.28 0.02 . 2 . . . . . . . . 5770 1 193 . 1 1 16 16 PHE HB3 H 1 2.91 0.02 . 2 . . . . . . . . 5770 1 194 . 1 1 16 16 PHE HD1 H 1 6.62 0.02 . 1 . . . . . . . . 5770 1 195 . 1 1 16 16 PHE HD2 H 1 6.62 0.02 . 1 . . . . . . . . 5770 1 196 . 1 1 16 16 PHE HE1 H 1 7.18 0.02 . 1 . . . . . . . . 5770 1 197 . 1 1 16 16 PHE HE2 H 1 7.18 0.02 . 1 . . . . . . . . 5770 1 198 . 1 1 16 16 PHE CD1 C 13 131.5 0.30 . 1 . . . . . . . . 5770 1 199 . 1 1 16 16 PHE CE1 C 13 131.7 0.30 . 1 . . . . . . . . 5770 1 200 . 1 1 16 16 PHE CZ C 13 132.0 0.30 . 1 . . . . . . . . 5770 1 201 . 1 1 16 16 PHE HZ H 1 6.75 0.02 . 1 . . . . . . . . 5770 1 202 . 1 1 16 16 PHE CE2 C 13 131.7 0.30 . 1 . . . . . . . . 5770 1 203 . 1 1 16 16 PHE CD2 C 13 131.5 0.30 . 1 . . . . . . . . 5770 1 204 . 1 1 16 16 PHE C C 13 178.4 0.30 . 1 . . . . . . . . 5770 1 205 . 1 1 17 17 SER N N 15 114.4 0.20 . 1 . . . . . . . . 5770 1 206 . 1 1 17 17 SER H H 1 8.12 0.02 . 1 . . . . . . . . 5770 1 207 . 1 1 17 17 SER CA C 13 61.7 0.30 . 1 . . . . . . . . 5770 1 208 . 1 1 17 17 SER HA H 1 4.23 0.02 . 1 . . . . . . . . 5770 1 209 . 1 1 17 17 SER CB C 13 63.6 0.30 . 1 . . . . . . . . 5770 1 210 . 1 1 17 17 SER HB2 H 1 4.13 0.02 . 1 . . . . . . . . 5770 1 211 . 1 1 17 17 SER HB3 H 1 4.13 0.02 . 1 . . . . . . . . 5770 1 212 . 1 1 17 17 SER C C 13 174.5 0.30 . 1 . . . . . . . . 5770 1 213 . 1 1 18 18 LEU N N 15 118.8 0.20 . 1 . . . . . . . . 5770 1 214 . 1 1 18 18 LEU H H 1 7.56 0.02 . 1 . . . . . . . . 5770 1 215 . 1 1 18 18 LEU CA C 13 56.5 0.30 . 1 . . . . . . . . 5770 1 216 . 1 1 18 18 LEU HA H 1 4.09 0.02 . 1 . . . . . . . . 5770 1 217 . 1 1 18 18 LEU CB C 13 41.8 0.30 . 1 . . . . . . . . 5770 1 218 . 1 1 18 18 LEU HB2 H 1 2.14 0.02 . 2 . . . . . . . . 5770 1 219 . 1 1 18 18 LEU HB3 H 1 1.20 0.02 . 2 . . . . . . . . 5770 1 220 . 1 1 18 18 LEU CG C 13 26.1 0.30 . 1 . . . . . . . . 5770 1 221 . 1 1 18 18 LEU HG H 1 2.04 0.02 . 1 . . . . . . . . 5770 1 222 . 1 1 18 18 LEU HD11 H 1 0.80 0.02 . 2 . . . . . . . . 5770 1 223 . 1 1 18 18 LEU HD12 H 1 0.80 0.02 . 2 . . . . . . . . 5770 1 224 . 1 1 18 18 LEU HD13 H 1 0.80 0.02 . 2 . . . . . . . . 5770 1 225 . 1 1 18 18 LEU HD21 H 1 1.01 0.02 . 2 . . . . . . . . 5770 1 226 . 1 1 18 18 LEU HD22 H 1 1.01 0.02 . 2 . . . . . . . . 5770 1 227 . 1 1 18 18 LEU HD23 H 1 1.01 0.02 . 2 . . . . . . . . 5770 1 228 . 1 1 18 18 LEU CD1 C 13 22.2 0.30 . 1 . . . . . . . . 5770 1 229 . 1 1 18 18 LEU CD2 C 13 26.3 0.30 . 1 . . . . . . . . 5770 1 230 . 1 1 18 18 LEU C C 13 177.7 0.30 . 1 . . . . . . . . 5770 1 231 . 1 1 19 19 PHE N N 15 115.4 0.20 . 1 . . . . . . . . 5770 1 232 . 1 1 19 19 PHE H H 1 7.51 0.02 . 1 . . . . . . . . 5770 1 233 . 1 1 19 19 PHE CA C 13 59.2 0.30 . 1 . . . . . . . . 5770 1 234 . 1 1 19 19 PHE HA H 1 4.29 0.02 . 1 . . . . . . . . 5770 1 235 . 1 1 19 19 PHE CB C 13 41.9 0.30 . 1 . . . . . . . . 5770 1 236 . 1 1 19 19 PHE HB2 H 1 2.84 0.02 . 2 . . . . . . . . 5770 1 237 . 1 1 19 19 PHE HB3 H 1 2.74 0.02 . 2 . . . . . . . . 5770 1 238 . 1 1 19 19 PHE HD1 H 1 7.48 0.02 . 1 . . . . . . . . 5770 1 239 . 1 1 19 19 PHE HD2 H 1 7.48 0.02 . 1 . . . . . . . . 5770 1 240 . 1 1 19 19 PHE HE1 H 1 7.32 0.02 . 1 . . . . . . . . 5770 1 241 . 1 1 19 19 PHE HE2 H 1 7.32 0.02 . 1 . . . . . . . . 5770 1 242 . 1 1 19 19 PHE CD1 C 13 132.3 0.30 . 1 . . . . . . . . 5770 1 243 . 1 1 19 19 PHE CE1 C 13 130.7 0.30 . 1 . . . . . . . . 5770 1 244 . 1 1 19 19 PHE CZ C 13 129.0 0.30 . 1 . . . . . . . . 5770 1 245 . 1 1 19 19 PHE HZ H 1 7.67 0.02 . 1 . . . . . . . . 5770 1 246 . 1 1 19 19 PHE CE2 C 13 130.7 0.30 . 1 . . . . . . . . 5770 1 247 . 1 1 19 19 PHE CD2 C 13 132.3 0.30 . 1 . . . . . . . . 5770 1 248 . 1 1 19 19 PHE C C 13 175.4 0.30 . 1 . . . . . . . . 5770 1 249 . 1 1 20 20 ASP N N 15 117.0 0.20 . 1 . . . . . . . . 5770 1 250 . 1 1 20 20 ASP H H 1 7.51 0.02 . 1 . . . . . . . . 5770 1 251 . 1 1 20 20 ASP CA C 13 52.2 0.30 . 1 . . . . . . . . 5770 1 252 . 1 1 20 20 ASP HA H 1 4.61 0.02 . 1 . . . . . . . . 5770 1 253 . 1 1 20 20 ASP CB C 13 39.5 0.30 . 1 . . . . . . . . 5770 1 254 . 1 1 20 20 ASP HB2 H 1 2.42 0.02 . 2 . . . . . . . . 5770 1 255 . 1 1 20 20 ASP HB3 H 1 1.66 0.02 . 2 . . . . . . . . 5770 1 256 . 1 1 20 20 ASP C C 13 176.9 0.30 . 1 . . . . . . . . 5770 1 257 . 1 1 21 21 LYS N N 15 124.2 0.20 . 1 . . . . . . . . 5770 1 258 . 1 1 21 21 LYS H H 1 7.56 0.02 . 1 . . . . . . . . 5770 1 259 . 1 1 21 21 LYS CA C 13 57.9 0.30 . 1 . . . . . . . . 5770 1 260 . 1 1 21 21 LYS HA H 1 4.01 0.02 . 1 . . . . . . . . 5770 1 261 . 1 1 21 21 LYS CB C 13 32.2 0.30 . 1 . . . . . . . . 5770 1 262 . 1 1 21 21 LYS HB2 H 1 1.91 0.02 . 1 . . . . . . . . 5770 1 263 . 1 1 21 21 LYS HB3 H 1 1.91 0.02 . 1 . . . . . . . . 5770 1 264 . 1 1 21 21 LYS CG C 13 24.3 0.30 . 1 . . . . . . . . 5770 1 265 . 1 1 21 21 LYS HG2 H 1 1.54 0.02 . 2 . . . . . . . . 5770 1 266 . 1 1 21 21 LYS HG3 H 1 1.47 0.02 . 2 . . . . . . . . 5770 1 267 . 1 1 21 21 LYS CD C 13 28.0 0.30 . 1 . . . . . . . . 5770 1 268 . 1 1 21 21 LYS HD2 H 1 1.72 0.02 . 2 . . . . . . . . 5770 1 269 . 1 1 21 21 LYS HD3 H 1 1.64 0.02 . 2 . . . . . . . . 5770 1 270 . 1 1 21 21 LYS CE C 13 42.0 0.30 . 1 . . . . . . . . 5770 1 271 . 1 1 21 21 LYS HE2 H 1 2.99 0.02 . 2 . . . . . . . . 5770 1 272 . 1 1 21 21 LYS HE3 H 1 2.91 0.02 . 2 . . . . . . . . 5770 1 273 . 1 1 21 21 LYS C C 13 178.2 0.30 . 1 . . . . . . . . 5770 1 274 . 1 1 22 22 ASP N N 15 114.3 0.20 . 1 . . . . . . . . 5770 1 275 . 1 1 22 22 ASP H H 1 8.19 0.02 . 1 . . . . . . . . 5770 1 276 . 1 1 22 22 ASP CA C 13 52.9 0.30 . 1 . . . . . . . . 5770 1 277 . 1 1 22 22 ASP HA H 1 4.62 0.02 . 1 . . . . . . . . 5770 1 278 . 1 1 22 22 ASP CB C 13 39.6 0.30 . 1 . . . . . . . . 5770 1 279 . 1 1 22 22 ASP HB2 H 1 3.09 0.02 . 2 . . . . . . . . 5770 1 280 . 1 1 22 22 ASP HB3 H 1 2.67 0.02 . 2 . . . . . . . . 5770 1 281 . 1 1 22 22 ASP C C 13 177.7 0.30 . 1 . . . . . . . . 5770 1 282 . 1 1 23 23 GLY N N 15 109.6 0.20 . 1 . . . . . . . . 5770 1 283 . 1 1 23 23 GLY H H 1 7.71 0.02 . 1 . . . . . . . . 5770 1 284 . 1 1 23 23 GLY CA C 13 47.3 0.30 . 1 . . . . . . . . 5770 1 285 . 1 1 23 23 GLY HA2 H 1 3.95 0.02 . 2 . . . . . . . . 5770 1 286 . 1 1 23 23 GLY HA3 H 1 3.88 0.02 . 2 . . . . . . . . 5770 1 287 . 1 1 23 23 GLY C C 13 175.3 0.30 . 1 . . . . . . . . 5770 1 288 . 1 1 24 24 ASP N N 15 121.2 0.20 . 1 . . . . . . . . 5770 1 289 . 1 1 24 24 ASP H H 1 8.55 0.02 . 1 . . . . . . . . 5770 1 290 . 1 1 24 24 ASP CA C 13 53.6 0.30 . 1 . . . . . . . . 5770 1 291 . 1 1 24 24 ASP HA H 1 4.53 0.02 . 1 . . . . . . . . 5770 1 292 . 1 1 24 24 ASP CB C 13 40.6 0.30 . 1 . . . . . . . . 5770 1 293 . 1 1 24 24 ASP HB2 H 1 3.07 0.02 . 2 . . . . . . . . 5770 1 294 . 1 1 24 24 ASP HB3 H 1 2.51 0.02 . 2 . . . . . . . . 5770 1 295 . 1 1 24 24 ASP C C 13 177.3 0.30 . 1 . . . . . . . . 5770 1 296 . 1 1 25 25 GLY N N 15 112.9 0.20 . 1 . . . . . . . . 5770 1 297 . 1 1 25 25 GLY H H 1 10.60 0.02 . 1 . . . . . . . . 5770 1 298 . 1 1 25 25 GLY CA C 13 45.4 0.30 . 1 . . . . . . . . 5770 1 299 . 1 1 25 25 GLY HA2 H 1 4.43 0.02 . 2 . . . . . . . . 5770 1 300 . 1 1 25 25 GLY HA3 H 1 3.76 0.02 . 2 . . . . . . . . 5770 1 301 . 1 1 25 25 GLY C C 13 173.9 0.30 . 1 . . . . . . . . 5770 1 302 . 1 1 26 26 THR N N 15 111.6 0.20 . 1 . . . . . . . . 5770 1 303 . 1 1 26 26 THR H H 1 8.26 0.02 . 1 . . . . . . . . 5770 1 304 . 1 1 26 26 THR CA C 13 59.4 0.30 . 1 . . . . . . . . 5770 1 305 . 1 1 26 26 THR HA H 1 5.54 0.02 . 1 . . . . . . . . 5770 1 306 . 1 1 26 26 THR CB C 13 72.8 0.30 . 1 . . . . . . . . 5770 1 307 . 1 1 26 26 THR HB H 1 3.88 0.02 . 1 . . . . . . . . 5770 1 308 . 1 1 26 26 THR HG21 H 1 1.07 0.02 . 1 . . . . . . . . 5770 1 309 . 1 1 26 26 THR HG22 H 1 1.07 0.02 . 1 . . . . . . . . 5770 1 310 . 1 1 26 26 THR HG23 H 1 1.07 0.02 . 1 . . . . . . . . 5770 1 311 . 1 1 26 26 THR CG2 C 13 22.3 0.30 . 1 . . . . . . . . 5770 1 312 . 1 1 26 26 THR C C 13 173.4 0.30 . 1 . . . . . . . . 5770 1 313 . 1 1 27 27 ILE N N 15 126.4 0.20 . 1 . . . . . . . . 5770 1 314 . 1 1 27 27 ILE H H 1 10.08 0.02 . 1 . . . . . . . . 5770 1 315 . 1 1 27 27 ILE CA C 13 61.2 0.30 . 1 . . . . . . . . 5770 1 316 . 1 1 27 27 ILE HA H 1 4.83 0.02 . 1 . . . . . . . . 5770 1 317 . 1 1 27 27 ILE CB C 13 40.6 0.30 . 1 . . . . . . . . 5770 1 318 . 1 1 27 27 ILE HB H 1 1.86 0.02 . 1 . . . . . . . . 5770 1 319 . 1 1 27 27 ILE HG21 H 1 1.10 0.02 . 1 . . . . . . . . 5770 1 320 . 1 1 27 27 ILE HG22 H 1 1.10 0.02 . 1 . . . . . . . . 5770 1 321 . 1 1 27 27 ILE HG23 H 1 1.10 0.02 . 1 . . . . . . . . 5770 1 322 . 1 1 27 27 ILE CG2 C 13 17.6 0.30 . 1 . . . . . . . . 5770 1 323 . 1 1 27 27 ILE CG1 C 13 26.8 0.30 . 1 . . . . . . . . 5770 1 324 . 1 1 27 27 ILE HG12 H 1 1.11 0.02 . 1 . . . . . . . . 5770 1 325 . 1 1 27 27 ILE HG13 H 1 1.11 0.02 . 1 . . . . . . . . 5770 1 326 . 1 1 27 27 ILE HD11 H 1 0.45 0.02 . 1 . . . . . . . . 5770 1 327 . 1 1 27 27 ILE HD12 H 1 0.45 0.02 . 1 . . . . . . . . 5770 1 328 . 1 1 27 27 ILE HD13 H 1 0.45 0.02 . 1 . . . . . . . . 5770 1 329 . 1 1 27 27 ILE CD1 C 13 15.6 0.30 . 1 . . . . . . . . 5770 1 330 . 1 1 27 27 ILE C C 13 176.3 0.30 . 1 . . . . . . . . 5770 1 331 . 1 1 28 28 THR N N 15 116.3 0.20 . 1 . . . . . . . . 5770 1 332 . 1 1 28 28 THR H H 1 8.44 0.02 . 1 . . . . . . . . 5770 1 333 . 1 1 28 28 THR CA C 13 59.3 0.30 . 1 . . . . . . . . 5770 1 334 . 1 1 28 28 THR HA H 1 5.00 0.02 . 1 . . . . . . . . 5770 1 335 . 1 1 28 28 THR CB C 13 72.8 0.30 . 1 . . . . . . . . 5770 1 336 . 1 1 28 28 THR HB H 1 4.86 0.02 . 1 . . . . . . . . 5770 1 337 . 1 1 28 28 THR HG21 H 1 1.34 0.02 . 1 . . . . . . . . 5770 1 338 . 1 1 28 28 THR HG22 H 1 1.34 0.02 . 1 . . . . . . . . 5770 1 339 . 1 1 28 28 THR HG23 H 1 1.34 0.02 . 1 . . . . . . . . 5770 1 340 . 1 1 28 28 THR CG2 C 13 21.9 0.30 . 1 . . . . . . . . 5770 1 341 . 1 1 28 28 THR C C 13 176.5 0.30 . 1 . . . . . . . . 5770 1 342 . 1 1 29 29 THR N N 15 113.6 0.20 . 1 . . . . . . . . 5770 1 343 . 1 1 29 29 THR H H 1 9.17 0.02 . 1 . . . . . . . . 5770 1 344 . 1 1 29 29 THR CA C 13 66.6 0.30 . 1 . . . . . . . . 5770 1 345 . 1 1 29 29 THR HA H 1 3.77 0.02 . 1 . . . . . . . . 5770 1 346 . 1 1 29 29 THR CB C 13 68.3 0.30 . 1 . . . . . . . . 5770 1 347 . 1 1 29 29 THR HB H 1 4.21 0.02 . 1 . . . . . . . . 5770 1 348 . 1 1 29 29 THR HG21 H 1 1.31 0.02 . 1 . . . . . . . . 5770 1 349 . 1 1 29 29 THR HG22 H 1 1.31 0.02 . 1 . . . . . . . . 5770 1 350 . 1 1 29 29 THR HG23 H 1 1.31 0.02 . 1 . . . . . . . . 5770 1 351 . 1 1 29 29 THR CG2 C 13 23.2 0.30 . 1 . . . . . . . . 5770 1 352 . 1 1 29 29 THR C C 13 177.1 0.30 . 1 . . . . . . . . 5770 1 353 . 1 1 30 30 LYS N N 15 120.3 0.20 . 1 . . . . . . . . 5770 1 354 . 1 1 30 30 LYS H H 1 7.67 0.02 . 1 . . . . . . . . 5770 1 355 . 1 1 30 30 LYS CA C 13 59.3 0.30 . 1 . . . . . . . . 5770 1 356 . 1 1 30 30 LYS HA H 1 4.13 0.02 . 1 . . . . . . . . 5770 1 357 . 1 1 30 30 LYS CB C 13 32.6 0.30 . 1 . . . . . . . . 5770 1 358 . 1 1 30 30 LYS HB2 H 1 1.89 0.02 . 2 . . . . . . . . 5770 1 359 . 1 1 30 30 LYS HB3 H 1 1.83 0.02 . 2 . . . . . . . . 5770 1 360 . 1 1 30 30 LYS CG C 13 25.0 0.30 . 1 . . . . . . . . 5770 1 361 . 1 1 30 30 LYS HG2 H 1 1.51 0.02 . 2 . . . . . . . . 5770 1 362 . 1 1 30 30 LYS HG3 H 1 1.41 0.02 . 2 . . . . . . . . 5770 1 363 . 1 1 30 30 LYS CD C 13 29.1 0.30 . 1 . . . . . . . . 5770 1 364 . 1 1 30 30 LYS HD2 H 1 1.71 0.02 . 1 . . . . . . . . 5770 1 365 . 1 1 30 30 LYS HD3 H 1 1.71 0.02 . 1 . . . . . . . . 5770 1 366 . 1 1 30 30 LYS CE C 13 42.3 0.30 . 1 . . . . . . . . 5770 1 367 . 1 1 30 30 LYS HE2 H 1 3.01 0.02 . 1 . . . . . . . . 5770 1 368 . 1 1 30 30 LYS HE3 H 1 3.01 0.02 . 1 . . . . . . . . 5770 1 369 . 1 1 30 30 LYS C C 13 180.0 0.30 . 1 . . . . . . . . 5770 1 370 . 1 1 31 31 GLU N N 15 122.4 0.20 . 1 . . . . . . . . 5770 1 371 . 1 1 31 31 GLU H H 1 7.90 0.02 . 1 . . . . . . . . 5770 1 372 . 1 1 31 31 GLU CA C 13 59.9 0.30 . 1 . . . . . . . . 5770 1 373 . 1 1 31 31 GLU HA H 1 3.96 0.02 . 1 . . . . . . . . 5770 1 374 . 1 1 31 31 GLU CB C 13 29.7 0.30 . 1 . . . . . . . . 5770 1 375 . 1 1 31 31 GLU HB2 H 1 2.74 0.02 . 2 . . . . . . . . 5770 1 376 . 1 1 31 31 GLU HB3 H 1 2.42 0.02 . 2 . . . . . . . . 5770 1 377 . 1 1 31 31 GLU CG C 13 38.5 0.30 . 1 . . . . . . . . 5770 1 378 . 1 1 31 31 GLU HG2 H 1 2.57 0.02 . 2 . . . . . . . . 5770 1 379 . 1 1 31 31 GLU HG3 H 1 2.35 0.02 . 2 . . . . . . . . 5770 1 380 . 1 1 31 31 GLU C C 13 178.8 0.30 . 1 . . . . . . . . 5770 1 381 . 1 1 32 32 LEU N N 15 120.4 0.20 . 1 . . . . . . . . 5770 1 382 . 1 1 32 32 LEU H H 1 8.52 0.02 . 1 . . . . . . . . 5770 1 383 . 1 1 32 32 LEU CA C 13 58.4 0.30 . 1 . . . . . . . . 5770 1 384 . 1 1 32 32 LEU HA H 1 4.09 0.02 . 1 . . . . . . . . 5770 1 385 . 1 1 32 32 LEU CB C 13 42.2 0.30 . 1 . . . . . . . . 5770 1 386 . 1 1 32 32 LEU HB2 H 1 1.83 0.02 . 2 . . . . . . . . 5770 1 387 . 1 1 32 32 LEU HB3 H 1 1.28 0.02 . 2 . . . . . . . . 5770 1 388 . 1 1 32 32 LEU CG C 13 26.4 0.30 . 1 . . . . . . . . 5770 1 389 . 1 1 32 32 LEU HG H 1 1.28 0.02 . 1 . . . . . . . . 5770 1 390 . 1 1 32 32 LEU HD11 H 1 0.33 0.02 . 2 . . . . . . . . 5770 1 391 . 1 1 32 32 LEU HD12 H 1 0.33 0.02 . 2 . . . . . . . . 5770 1 392 . 1 1 32 32 LEU HD13 H 1 0.33 0.02 . 2 . . . . . . . . 5770 1 393 . 1 1 32 32 LEU HD21 H 1 0.40 0.02 . 2 . . . . . . . . 5770 1 394 . 1 1 32 32 LEU HD22 H 1 0.40 0.02 . 2 . . . . . . . . 5770 1 395 . 1 1 32 32 LEU HD23 H 1 0.40 0.02 . 2 . . . . . . . . 5770 1 396 . 1 1 32 32 LEU CD1 C 13 25.8 0.30 . 1 . . . . . . . . 5770 1 397 . 1 1 32 32 LEU CD2 C 13 22.8 0.30 . 1 . . . . . . . . 5770 1 398 . 1 1 32 32 LEU C C 13 178.9 0.30 . 1 . . . . . . . . 5770 1 399 . 1 1 33 33 GLY N N 15 105.3 0.20 . 1 . . . . . . . . 5770 1 400 . 1 1 33 33 GLY H H 1 8.69 0.02 . 1 . . . . . . . . 5770 1 401 . 1 1 33 33 GLY CA C 13 48.5 0.30 . 1 . . . . . . . . 5770 1 402 . 1 1 33 33 GLY HA2 H 1 3.94 0.02 . 2 . . . . . . . . 5770 1 403 . 1 1 33 33 GLY HA3 H 1 3.59 0.02 . 2 . . . . . . . . 5770 1 404 . 1 1 33 33 GLY C C 13 175.3 0.30 . 1 . . . . . . . . 5770 1 405 . 1 1 34 34 THR N N 15 118.7 0.20 . 1 . . . . . . . . 5770 1 406 . 1 1 34 34 THR H H 1 8.18 0.02 . 1 . . . . . . . . 5770 1 407 . 1 1 34 34 THR CA C 13 67.0 0.30 . 1 . . . . . . . . 5770 1 408 . 1 1 34 34 THR HA H 1 3.97 0.02 . 1 . . . . . . . . 5770 1 409 . 1 1 34 34 THR CB C 13 68.7 0.30 . 1 . . . . . . . . 5770 1 410 . 1 1 34 34 THR HB H 1 4.42 0.02 . 1 . . . . . . . . 5770 1 411 . 1 1 34 34 THR HG21 H 1 1.29 0.02 . 1 . . . . . . . . 5770 1 412 . 1 1 34 34 THR HG22 H 1 1.29 0.02 . 1 . . . . . . . . 5770 1 413 . 1 1 34 34 THR HG23 H 1 1.29 0.02 . 1 . . . . . . . . 5770 1 414 . 1 1 34 34 THR CG2 C 13 21.3 0.30 . 1 . . . . . . . . 5770 1 415 . 1 1 34 34 THR C C 13 177.3 0.30 . 1 . . . . . . . . 5770 1 416 . 1 1 35 35 VAL N N 15 122.6 0.20 . 1 . . . . . . . . 5770 1 417 . 1 1 35 35 VAL H H 1 7.96 0.02 . 1 . . . . . . . . 5770 1 418 . 1 1 35 35 VAL CA C 13 66.6 0.30 . 1 . . . . . . . . 5770 1 419 . 1 1 35 35 VAL HA H 1 3.59 0.02 . 1 . . . . . . . . 5770 1 420 . 1 1 35 35 VAL CB C 13 31.7 0.30 . 1 . . . . . . . . 5770 1 421 . 1 1 35 35 VAL HB H 1 2.14 0.02 . 1 . . . . . . . . 5770 1 422 . 1 1 35 35 VAL HG11 H 1 0.94 0.02 . 2 . . . . . . . . 5770 1 423 . 1 1 35 35 VAL HG12 H 1 0.94 0.02 . 2 . . . . . . . . 5770 1 424 . 1 1 35 35 VAL HG13 H 1 0.94 0.02 . 2 . . . . . . . . 5770 1 425 . 1 1 35 35 VAL HG21 H 1 0.53 0.02 . 2 . . . . . . . . 5770 1 426 . 1 1 35 35 VAL HG22 H 1 0.53 0.02 . 2 . . . . . . . . 5770 1 427 . 1 1 35 35 VAL HG23 H 1 0.53 0.02 . 2 . . . . . . . . 5770 1 428 . 1 1 35 35 VAL CG1 C 13 23.0 0.30 . 1 . . . . . . . . 5770 1 429 . 1 1 35 35 VAL CG2 C 13 21.4 0.30 . 1 . . . . . . . . 5770 1 430 . 1 1 35 35 VAL C C 13 178.5 0.30 . 1 . . . . . . . . 5770 1 431 . 1 1 36 36 MET N N 15 118.0 0.20 . 1 . . . . . . . . 5770 1 432 . 1 1 36 36 MET H H 1 8.43 0.02 . 1 . . . . . . . . 5770 1 433 . 1 1 36 36 MET CA C 13 61.2 0.30 . 1 . . . . . . . . 5770 1 434 . 1 1 36 36 MET HA H 1 3.70 0.02 . 1 . . . . . . . . 5770 1 435 . 1 1 36 36 MET CB C 13 33.9 0.30 . 1 . . . . . . . . 5770 1 436 . 1 1 36 36 MET HB2 H 1 2.69 0.02 . 2 . . . . . . . . 5770 1 437 . 1 1 36 36 MET HB3 H 1 2.27 0.02 . 2 . . . . . . . . 5770 1 438 . 1 1 36 36 MET CG C 13 33.2 0.30 . 1 . . . . . . . . 5770 1 439 . 1 1 36 36 MET HG2 H 1 2.01 0.02 . 2 . . . . . . . . 5770 1 440 . 1 1 36 36 MET HG3 H 1 1.96 0.02 . 2 . . . . . . . . 5770 1 441 . 1 1 36 36 MET HE1 H 1 1.92 0.02 . 1 . . . . . . . . 5770 1 442 . 1 1 36 36 MET HE2 H 1 1.92 0.02 . 1 . . . . . . . . 5770 1 443 . 1 1 36 36 MET HE3 H 1 1.92 0.02 . 1 . . . . . . . . 5770 1 444 . 1 1 36 36 MET CE C 13 17.3 0.30 . 1 . . . . . . . . 5770 1 445 . 1 1 36 36 MET C C 13 178.6 0.30 . 1 . . . . . . . . 5770 1 446 . 1 1 37 37 ARG N N 15 118.6 0.20 . 1 . . . . . . . . 5770 1 447 . 1 1 37 37 ARG H H 1 8.71 0.02 . 1 . . . . . . . . 5770 1 448 . 1 1 37 37 ARG CA C 13 59.3 0.30 . 1 . . . . . . . . 5770 1 449 . 1 1 37 37 ARG HA H 1 4.72 0.02 . 1 . . . . . . . . 5770 1 450 . 1 1 37 37 ARG CB C 13 30.0 0.30 . 1 . . . . . . . . 5770 1 451 . 1 1 37 37 ARG HB2 H 1 1.93 0.02 . 1 . . . . . . . . 5770 1 452 . 1 1 37 37 ARG HB3 H 1 1.93 0.02 . 1 . . . . . . . . 5770 1 453 . 1 1 37 37 ARG CG C 13 29.5 0.30 . 1 . . . . . . . . 5770 1 454 . 1 1 37 37 ARG HG2 H 1 1.86 0.02 . 1 . . . . . . . . 5770 1 455 . 1 1 37 37 ARG HG3 H 1 1.86 0.02 . 1 . . . . . . . . 5770 1 456 . 1 1 37 37 ARG CD C 13 43.5 0.30 . 1 . . . . . . . . 5770 1 457 . 1 1 37 37 ARG HD2 H 1 3.33 0.02 . 2 . . . . . . . . 5770 1 458 . 1 1 37 37 ARG HD3 H 1 3.16 0.02 . 2 . . . . . . . . 5770 1 459 . 1 1 37 37 ARG C C 13 181.3 0.30 . 1 . . . . . . . . 5770 1 460 . 1 1 38 38 SER N N 15 118.7 0.20 . 1 . . . . . . . . 5770 1 461 . 1 1 38 38 SER H H 1 8.14 0.02 . 1 . . . . . . . . 5770 1 462 . 1 1 38 38 SER CA C 13 61.7 0.30 . 1 . . . . . . . . 5770 1 463 . 1 1 38 38 SER HA H 1 4.40 0.02 . 1 . . . . . . . . 5770 1 464 . 1 1 38 38 SER CB C 13 62.8 0.30 . 1 . . . . . . . . 5770 1 465 . 1 1 38 38 SER HB2 H 1 4.12 0.02 . 1 . . . . . . . . 5770 1 466 . 1 1 38 38 SER HB3 H 1 4.12 0.02 . 1 . . . . . . . . 5770 1 467 . 1 1 38 38 SER C C 13 175.1 0.30 . 1 . . . . . . . . 5770 1 468 . 1 1 39 39 LEU N N 15 120.8 0.20 . 1 . . . . . . . . 5770 1 469 . 1 1 39 39 LEU H H 1 7.29 0.02 . 1 . . . . . . . . 5770 1 470 . 1 1 39 39 LEU CA C 13 54.4 0.30 . 1 . . . . . . . . 5770 1 471 . 1 1 39 39 LEU HA H 1 4.52 0.02 . 1 . . . . . . . . 5770 1 472 . 1 1 39 39 LEU CB C 13 42.3 0.30 . 1 . . . . . . . . 5770 1 473 . 1 1 39 39 LEU HB2 H 1 1.83 0.02 . 1 . . . . . . . . 5770 1 474 . 1 1 39 39 LEU HB3 H 1 1.83 0.02 . 1 . . . . . . . . 5770 1 475 . 1 1 39 39 LEU CG C 13 26.4 0.30 . 1 . . . . . . . . 5770 1 476 . 1 1 39 39 LEU HG H 1 1.83 0.02 . 1 . . . . . . . . 5770 1 477 . 1 1 39 39 LEU HD11 H 1 0.96 0.02 . 2 . . . . . . . . 5770 1 478 . 1 1 39 39 LEU HD12 H 1 0.96 0.02 . 2 . . . . . . . . 5770 1 479 . 1 1 39 39 LEU HD13 H 1 0.96 0.02 . 2 . . . . . . . . 5770 1 480 . 1 1 39 39 LEU HD21 H 1 0.77 0.02 . 2 . . . . . . . . 5770 1 481 . 1 1 39 39 LEU HD22 H 1 0.77 0.02 . 2 . . . . . . . . 5770 1 482 . 1 1 39 39 LEU HD23 H 1 0.77 0.02 . 2 . . . . . . . . 5770 1 483 . 1 1 39 39 LEU CD1 C 13 22.5 0.30 . 1 . . . . . . . . 5770 1 484 . 1 1 39 39 LEU CD2 C 13 26.7 0.30 . 1 . . . . . . . . 5770 1 485 . 1 1 39 39 LEU C C 13 177.3 0.30 . 1 . . . . . . . . 5770 1 486 . 1 1 40 40 GLY N N 15 107.2 0.20 . 1 . . . . . . . . 5770 1 487 . 1 1 40 40 GLY H H 1 7.92 0.02 . 1 . . . . . . . . 5770 1 488 . 1 1 40 40 GLY CA C 13 45.7 0.30 . 1 . . . . . . . . 5770 1 489 . 1 1 40 40 GLY HA2 H 1 4.27 0.02 . 2 . . . . . . . . 5770 1 490 . 1 1 40 40 GLY HA3 H 1 3.83 0.02 . 2 . . . . . . . . 5770 1 491 . 1 1 40 40 GLY C C 13 174.5 0.30 . 1 . . . . . . . . 5770 1 492 . 1 1 41 41 GLN N N 15 118.3 0.20 . 1 . . . . . . . . 5770 1 493 . 1 1 41 41 GLN H H 1 7.78 0.02 . 1 . . . . . . . . 5770 1 494 . 1 1 41 41 GLN CA C 13 54.8 0.30 . 1 . . . . . . . . 5770 1 495 . 1 1 41 41 GLN HA H 1 4.39 0.02 . 1 . . . . . . . . 5770 1 496 . 1 1 41 41 GLN CB C 13 29.3 0.30 . 1 . . . . . . . . 5770 1 497 . 1 1 41 41 GLN HB2 H 1 2.18 0.02 . 1 . . . . . . . . 5770 1 498 . 1 1 41 41 GLN HB3 H 1 2.18 0.02 . 1 . . . . . . . . 5770 1 499 . 1 1 41 41 GLN CG C 13 33.6 0.30 . 1 . . . . . . . . 5770 1 500 . 1 1 41 41 GLN HG2 H 1 2.26 0.02 . 2 . . . . . . . . 5770 1 501 . 1 1 41 41 GLN HG3 H 1 2.21 0.02 . 2 . . . . . . . . 5770 1 502 . 1 1 41 41 GLN CD C 13 178.5 0.30 . 1 . . . . . . . . 5770 1 503 . 1 1 41 41 GLN NE2 N 15 107.6 0.20 . 1 . . . . . . . . 5770 1 504 . 1 1 41 41 GLN HE21 H 1 7.19 0.02 . 2 . . . . . . . . 5770 1 505 . 1 1 41 41 GLN HE22 H 1 6.18 0.02 . 2 . . . . . . . . 5770 1 506 . 1 1 41 41 GLN C C 13 174.3 0.30 . 1 . . . . . . . . 5770 1 507 . 1 1 42 42 ASN N N 15 116.6 0.20 . 1 . . . . . . . . 5770 1 508 . 1 1 42 42 ASN H H 1 8.62 0.02 . 1 . . . . . . . . 5770 1 509 . 1 1 42 42 ASN CA C 13 51.3 0.30 . 1 . . . . . . . . 5770 1 510 . 1 1 42 42 ASN HA H 1 5.22 0.02 . 1 . . . . . . . . 5770 1 511 . 1 1 42 42 ASN CB C 13 39.5 0.30 . 1 . . . . . . . . 5770 1 512 . 1 1 42 42 ASN HB2 H 1 2.81 0.02 . 2 . . . . . . . . 5770 1 513 . 1 1 42 42 ASN HB3 H 1 2.54 0.02 . 2 . . . . . . . . 5770 1 514 . 1 1 42 42 ASN CG C 13 178.1 0.30 . 1 . . . . . . . . 5770 1 515 . 1 1 42 42 ASN ND2 N 15 112.3 0.20 . 1 . . . . . . . . 5770 1 516 . 1 1 42 42 ASN HD21 H 1 7.51 0.02 . 2 . . . . . . . . 5770 1 517 . 1 1 42 42 ASN HD22 H 1 6.73 0.02 . 2 . . . . . . . . 5770 1 518 . 1 1 43 43 PRO CD C 13 50.2 0.30 . 1 . . . . . . . . 5770 1 519 . 1 1 43 43 PRO CA C 13 62.3 0.30 . 1 . . . . . . . . 5770 1 520 . 1 1 43 43 PRO HA H 1 4.75 0.02 . 1 . . . . . . . . 5770 1 521 . 1 1 43 43 PRO CB C 13 32.1 0.30 . 1 . . . . . . . . 5770 1 522 . 1 1 43 43 PRO HB2 H 1 2.15 0.02 . 1 . . . . . . . . 5770 1 523 . 1 1 43 43 PRO HB3 H 1 2.15 0.02 . 1 . . . . . . . . 5770 1 524 . 1 1 43 43 PRO CG C 13 27.3 0.30 . 1 . . . . . . . . 5770 1 525 . 1 1 43 43 PRO HG2 H 1 1.99 0.02 . 2 . . . . . . . . 5770 1 526 . 1 1 43 43 PRO HG3 H 1 1.93 0.02 . 2 . . . . . . . . 5770 1 527 . 1 1 43 43 PRO HD2 H 1 3.70 0.02 . 2 . . . . . . . . 5770 1 528 . 1 1 43 43 PRO HD3 H 1 3.19 0.02 . 2 . . . . . . . . 5770 1 529 . 1 1 43 43 PRO C C 13 177.8 0.30 . 1 . . . . . . . . 5770 1 530 . 1 1 44 44 THR N N 15 112.4 0.20 . 1 . . . . . . . . 5770 1 531 . 1 1 44 44 THR H H 1 8.49 0.02 . 1 . . . . . . . . 5770 1 532 . 1 1 44 44 THR CA C 13 60.2 0.30 . 1 . . . . . . . . 5770 1 533 . 1 1 44 44 THR HA H 1 4.52 0.02 . 1 . . . . . . . . 5770 1 534 . 1 1 44 44 THR CB C 13 71.1 0.30 . 1 . . . . . . . . 5770 1 535 . 1 1 44 44 THR HB H 1 4.74 0.02 . 1 . . . . . . . . 5770 1 536 . 1 1 44 44 THR HG21 H 1 1.36 0.02 . 1 . . . . . . . . 5770 1 537 . 1 1 44 44 THR HG22 H 1 1.36 0.02 . 1 . . . . . . . . 5770 1 538 . 1 1 44 44 THR HG23 H 1 1.36 0.02 . 1 . . . . . . . . 5770 1 539 . 1 1 44 44 THR CG2 C 13 22.0 0.30 . 1 . . . . . . . . 5770 1 540 . 1 1 44 44 THR C C 13 175.3 0.30 . 1 . . . . . . . . 5770 1 541 . 1 1 45 45 GLU N N 15 120.8 0.20 . 1 . . . . . . . . 5770 1 542 . 1 1 45 45 GLU H H 1 8.80 0.02 . 1 . . . . . . . . 5770 1 543 . 1 1 45 45 GLU CA C 13 59.8 0.30 . 1 . . . . . . . . 5770 1 544 . 1 1 45 45 GLU HA H 1 3.98 0.02 . 1 . . . . . . . . 5770 1 545 . 1 1 45 45 GLU CB C 13 29.1 0.30 . 1 . . . . . . . . 5770 1 546 . 1 1 45 45 GLU HB2 H 1 2.07 0.02 . 1 . . . . . . . . 5770 1 547 . 1 1 45 45 GLU HB3 H 1 2.07 0.02 . 1 . . . . . . . . 5770 1 548 . 1 1 45 45 GLU CG C 13 36.4 0.30 . 1 . . . . . . . . 5770 1 549 . 1 1 45 45 GLU HG2 H 1 2.41 0.02 . 2 . . . . . . . . 5770 1 550 . 1 1 45 45 GLU HG3 H 1 2.35 0.02 . 2 . . . . . . . . 5770 1 551 . 1 1 45 45 GLU C C 13 179.1 0.30 . 1 . . . . . . . . 5770 1 552 . 1 1 46 46 ALA N N 15 120.6 0.20 . 1 . . . . . . . . 5770 1 553 . 1 1 46 46 ALA H H 1 8.23 0.02 . 1 . . . . . . . . 5770 1 554 . 1 1 46 46 ALA CA C 13 55.0 0.30 . 1 . . . . . . . . 5770 1 555 . 1 1 46 46 ALA HA H 1 4.12 0.02 . 1 . . . . . . . . 5770 1 556 . 1 1 46 46 ALA HB1 H 1 1.43 0.02 . 1 . . . . . . . . 5770 1 557 . 1 1 46 46 ALA HB2 H 1 1.43 0.02 . 1 . . . . . . . . 5770 1 558 . 1 1 46 46 ALA HB3 H 1 1.43 0.02 . 1 . . . . . . . . 5770 1 559 . 1 1 46 46 ALA CB C 13 18.3 0.30 . 1 . . . . . . . . 5770 1 560 . 1 1 46 46 ALA C C 13 180.0 0.30 . 1 . . . . . . . . 5770 1 561 . 1 1 47 47 GLU N N 15 119.6 0.20 . 1 . . . . . . . . 5770 1 562 . 1 1 47 47 GLU H H 1 7.72 0.02 . 1 . . . . . . . . 5770 1 563 . 1 1 47 47 GLU CA C 13 59.0 0.30 . 1 . . . . . . . . 5770 1 564 . 1 1 47 47 GLU HA H 1 4.03 0.02 . 1 . . . . . . . . 5770 1 565 . 1 1 47 47 GLU CB C 13 29.9 0.30 . 1 . . . . . . . . 5770 1 566 . 1 1 47 47 GLU HB2 H 1 2.19 0.02 . 1 . . . . . . . . 5770 1 567 . 1 1 47 47 GLU HB3 H 1 2.19 0.02 . 1 . . . . . . . . 5770 1 568 . 1 1 47 47 GLU CG C 13 36.8 0.30 . 1 . . . . . . . . 5770 1 569 . 1 1 47 47 GLU HG2 H 1 2.28 0.02 . 1 . . . . . . . . 5770 1 570 . 1 1 47 47 GLU HG3 H 1 2.28 0.02 . 1 . . . . . . . . 5770 1 571 . 1 1 47 47 GLU C C 13 179.5 0.30 . 1 . . . . . . . . 5770 1 572 . 1 1 48 48 LEU N N 15 118.9 0.20 . 1 . . . . . . . . 5770 1 573 . 1 1 48 48 LEU H H 1 7.84 0.02 . 1 . . . . . . . . 5770 1 574 . 1 1 48 48 LEU CA C 13 57.7 0.30 . 1 . . . . . . . . 5770 1 575 . 1 1 48 48 LEU HA H 1 3.89 0.02 . 1 . . . . . . . . 5770 1 576 . 1 1 48 48 LEU CB C 13 42.5 0.30 . 1 . . . . . . . . 5770 1 577 . 1 1 48 48 LEU HB2 H 1 1.99 0.02 . 2 . . . . . . . . 5770 1 578 . 1 1 48 48 LEU HB3 H 1 1.24 0.02 . 2 . . . . . . . . 5770 1 579 . 1 1 48 48 LEU CG C 13 26.7 0.30 . 1 . . . . . . . . 5770 1 580 . 1 1 48 48 LEU HG H 1 1.75 0.02 . 1 . . . . . . . . 5770 1 581 . 1 1 48 48 LEU HD11 H 1 0.81 0.02 . 2 . . . . . . . . 5770 1 582 . 1 1 48 48 LEU HD12 H 1 0.81 0.02 . 2 . . . . . . . . 5770 1 583 . 1 1 48 48 LEU HD13 H 1 0.81 0.02 . 2 . . . . . . . . 5770 1 584 . 1 1 48 48 LEU HD21 H 1 0.74 0.02 . 2 . . . . . . . . 5770 1 585 . 1 1 48 48 LEU HD22 H 1 0.74 0.02 . 2 . . . . . . . . 5770 1 586 . 1 1 48 48 LEU HD23 H 1 0.74 0.02 . 2 . . . . . . . . 5770 1 587 . 1 1 48 48 LEU CD1 C 13 25.9 0.30 . 1 . . . . . . . . 5770 1 588 . 1 1 48 48 LEU CD2 C 13 24.0 0.30 . 1 . . . . . . . . 5770 1 589 . 1 1 48 48 LEU C C 13 178.5 0.30 . 1 . . . . . . . . 5770 1 590 . 1 1 49 49 GLN N N 15 117.3 0.20 . 1 . . . . . . . . 5770 1 591 . 1 1 49 49 GLN H H 1 8.19 0.02 . 1 . . . . . . . . 5770 1 592 . 1 1 49 49 GLN CA C 13 58.7 0.30 . 1 . . . . . . . . 5770 1 593 . 1 1 49 49 GLN HA H 1 3.89 0.02 . 1 . . . . . . . . 5770 1 594 . 1 1 49 49 GLN CB C 13 28.2 0.30 . 1 . . . . . . . . 5770 1 595 . 1 1 49 49 GLN HB2 H 1 2.23 0.02 . 2 . . . . . . . . 5770 1 596 . 1 1 49 49 GLN HB3 H 1 2.16 0.02 . 2 . . . . . . . . 5770 1 597 . 1 1 49 49 GLN CG C 13 34.3 0.30 . 1 . . . . . . . . 5770 1 598 . 1 1 49 49 GLN HG2 H 1 2.52 0.02 . 2 . . . . . . . . 5770 1 599 . 1 1 49 49 GLN HG3 H 1 2.48 0.02 . 2 . . . . . . . . 5770 1 600 . 1 1 49 49 GLN CD C 13 180.3 0.30 . 1 . . . . . . . . 5770 1 601 . 1 1 49 49 GLN NE2 N 15 113.0 0.20 . 1 . . . . . . . . 5770 1 602 . 1 1 49 49 GLN HE21 H 1 7.54 0.02 . 2 . . . . . . . . 5770 1 603 . 1 1 49 49 GLN HE22 H 1 7.03 0.02 . 2 . . . . . . . . 5770 1 604 . 1 1 49 49 GLN C C 13 178.3 0.30 . 1 . . . . . . . . 5770 1 605 . 1 1 50 50 ASP N N 15 119.6 0.20 . 1 . . . . . . . . 5770 1 606 . 1 1 50 50 ASP H H 1 8.04 0.02 . 1 . . . . . . . . 5770 1 607 . 1 1 50 50 ASP CA C 13 57.8 0.30 . 1 . . . . . . . . 5770 1 608 . 1 1 50 50 ASP HA H 1 4.54 0.02 . 1 . . . . . . . . 5770 1 609 . 1 1 50 50 ASP CB C 13 41.0 0.30 . 1 . . . . . . . . 5770 1 610 . 1 1 50 50 ASP HB2 H 1 2.87 0.02 . 2 . . . . . . . . 5770 1 611 . 1 1 50 50 ASP HB3 H 1 2.62 0.02 . 2 . . . . . . . . 5770 1 612 . 1 1 50 50 ASP C C 13 178.1 0.30 . 1 . . . . . . . . 5770 1 613 . 1 1 51 51 MET N N 15 116.8 0.20 . 1 . . . . . . . . 5770 1 614 . 1 1 51 51 MET H H 1 7.86 0.02 . 1 . . . . . . . . 5770 1 615 . 1 1 51 51 MET CA C 13 60.1 0.30 . 1 . . . . . . . . 5770 1 616 . 1 1 51 51 MET HA H 1 4.01 0.02 . 1 . . . . . . . . 5770 1 617 . 1 1 51 51 MET CB C 13 33.8 0.30 . 1 . . . . . . . . 5770 1 618 . 1 1 51 51 MET HB2 H 1 2.09 0.02 . 1 . . . . . . . . 5770 1 619 . 1 1 51 51 MET HB3 H 1 2.09 0.02 . 1 . . . . . . . . 5770 1 620 . 1 1 51 51 MET CG C 13 33.8 0.30 . 1 . . . . . . . . 5770 1 621 . 1 1 51 51 MET HG2 H 1 2.84 0.02 . 1 . . . . . . . . 5770 1 622 . 1 1 51 51 MET HG3 H 1 2.84 0.02 . 1 . . . . . . . . 5770 1 623 . 1 1 51 51 MET HE1 H 1 1.27 0.02 . 1 . . . . . . . . 5770 1 624 . 1 1 51 51 MET HE2 H 1 1.27 0.02 . 1 . . . . . . . . 5770 1 625 . 1 1 51 51 MET HE3 H 1 1.27 0.02 . 1 . . . . . . . . 5770 1 626 . 1 1 51 51 MET CE C 13 16.6 0.30 . 1 . . . . . . . . 5770 1 627 . 1 1 51 51 MET C C 13 178.7 0.30 . 1 . . . . . . . . 5770 1 628 . 1 1 52 52 ILE N N 15 117.8 0.20 . 1 . . . . . . . . 5770 1 629 . 1 1 52 52 ILE H H 1 7.71 0.02 . 1 . . . . . . . . 5770 1 630 . 1 1 52 52 ILE CA C 13 62.6 0.30 . 1 . . . . . . . . 5770 1 631 . 1 1 52 52 ILE HA H 1 4.13 0.02 . 1 . . . . . . . . 5770 1 632 . 1 1 52 52 ILE CB C 13 36.5 0.30 . 1 . . . . . . . . 5770 1 633 . 1 1 52 52 ILE HB H 1 2.16 0.02 . 1 . . . . . . . . 5770 1 634 . 1 1 52 52 ILE HG21 H 1 0.85 0.02 . 1 . . . . . . . . 5770 1 635 . 1 1 52 52 ILE HG22 H 1 0.85 0.02 . 1 . . . . . . . . 5770 1 636 . 1 1 52 52 ILE HG23 H 1 0.85 0.02 . 1 . . . . . . . . 5770 1 637 . 1 1 52 52 ILE CG2 C 13 16.6 0.30 . 1 . . . . . . . . 5770 1 638 . 1 1 52 52 ILE CG1 C 13 28.2 0.30 . 1 . . . . . . . . 5770 1 639 . 1 1 52 52 ILE HG12 H 1 1.68 0.02 . 2 . . . . . . . . 5770 1 640 . 1 1 52 52 ILE HG13 H 1 1.60 0.02 . 2 . . . . . . . . 5770 1 641 . 1 1 52 52 ILE HD11 H 1 0.79 0.02 . 1 . . . . . . . . 5770 1 642 . 1 1 52 52 ILE HD12 H 1 0.79 0.02 . 1 . . . . . . . . 5770 1 643 . 1 1 52 52 ILE HD13 H 1 0.79 0.02 . 1 . . . . . . . . 5770 1 644 . 1 1 52 52 ILE CD1 C 13 10.5 0.30 . 1 . . . . . . . . 5770 1 645 . 1 1 52 52 ILE C C 13 178.1 0.30 . 1 . . . . . . . . 5770 1 646 . 1 1 53 53 ASN N N 15 117.8 0.20 . 1 . . . . . . . . 5770 1 647 . 1 1 53 53 ASN H H 1 9.16 0.02 . 1 . . . . . . . . 5770 1 648 . 1 1 53 53 ASN CA C 13 56.6 0.30 . 1 . . . . . . . . 5770 1 649 . 1 1 53 53 ASN HA H 1 4.46 0.02 . 1 . . . . . . . . 5770 1 650 . 1 1 53 53 ASN CB C 13 38.2 0.30 . 1 . . . . . . . . 5770 1 651 . 1 1 53 53 ASN HB2 H 1 3.13 0.02 . 2 . . . . . . . . 5770 1 652 . 1 1 53 53 ASN HB3 H 1 2.94 0.02 . 2 . . . . . . . . 5770 1 653 . 1 1 53 53 ASN CG C 13 176.7 0.30 . 1 . . . . . . . . 5770 1 654 . 1 1 53 53 ASN ND2 N 15 111.4 0.20 . 1 . . . . . . . . 5770 1 655 . 1 1 53 53 ASN HD21 H 1 7.80 0.02 . 2 . . . . . . . . 5770 1 656 . 1 1 53 53 ASN HD22 H 1 6.95 0.02 . 2 . . . . . . . . 5770 1 657 . 1 1 53 53 ASN C C 13 178.6 0.30 . 1 . . . . . . . . 5770 1 658 . 1 1 54 54 GLU N N 15 113.7 0.20 . 1 . . . . . . . . 5770 1 659 . 1 1 54 54 GLU H H 1 8.10 0.02 . 1 . . . . . . . . 5770 1 660 . 1 1 54 54 GLU CA C 13 57.7 0.30 . 1 . . . . . . . . 5770 1 661 . 1 1 54 54 GLU HA H 1 4.42 0.02 . 1 . . . . . . . . 5770 1 662 . 1 1 54 54 GLU CB C 13 29.7 0.30 . 1 . . . . . . . . 5770 1 663 . 1 1 54 54 GLU HB2 H 1 2.65 0.02 . 2 . . . . . . . . 5770 1 664 . 1 1 54 54 GLU HB3 H 1 2.36 0.02 . 2 . . . . . . . . 5770 1 665 . 1 1 54 54 GLU CG C 13 35.4 0.30 . 1 . . . . . . . . 5770 1 666 . 1 1 54 54 GLU HG2 H 1 2.68 0.02 . 1 . . . . . . . . 5770 1 667 . 1 1 54 54 GLU HG3 H 1 2.68 0.02 . 1 . . . . . . . . 5770 1 668 . 1 1 54 54 GLU C C 13 176.7 0.30 . 1 . . . . . . . . 5770 1 669 . 1 1 55 55 VAL N N 15 114.5 0.20 . 1 . . . . . . . . 5770 1 670 . 1 1 55 55 VAL H H 1 7.17 0.02 . 1 . . . . . . . . 5770 1 671 . 1 1 55 55 VAL CA C 13 61.2 0.30 . 1 . . . . . . . . 5770 1 672 . 1 1 55 55 VAL HA H 1 4.21 0.02 . 1 . . . . . . . . 5770 1 673 . 1 1 55 55 VAL CB C 13 33.4 0.30 . 1 . . . . . . . . 5770 1 674 . 1 1 55 55 VAL HB H 1 2.11 0.02 . 1 . . . . . . . . 5770 1 675 . 1 1 55 55 VAL HG11 H 1 0.93 0.02 . 2 . . . . . . . . 5770 1 676 . 1 1 55 55 VAL HG12 H 1 0.93 0.02 . 2 . . . . . . . . 5770 1 677 . 1 1 55 55 VAL HG13 H 1 0.93 0.02 . 2 . . . . . . . . 5770 1 678 . 1 1 55 55 VAL HG21 H 1 0.75 0.02 . 2 . . . . . . . . 5770 1 679 . 1 1 55 55 VAL HG22 H 1 0.75 0.02 . 2 . . . . . . . . 5770 1 680 . 1 1 55 55 VAL HG23 H 1 0.75 0.02 . 2 . . . . . . . . 5770 1 681 . 1 1 55 55 VAL CG1 C 13 22.9 0.30 . 1 . . . . . . . . 5770 1 682 . 1 1 55 55 VAL CG2 C 13 22.8 0.30 . 1 . . . . . . . . 5770 1 683 . 1 1 55 55 VAL C C 13 175.1 0.30 . 1 . . . . . . . . 5770 1 684 . 1 1 56 56 ASP N N 15 121.6 0.20 . 1 . . . . . . . . 5770 1 685 . 1 1 56 56 ASP H H 1 7.60 0.02 . 1 . . . . . . . . 5770 1 686 . 1 1 56 56 ASP CA C 13 53.8 0.30 . 1 . . . . . . . . 5770 1 687 . 1 1 56 56 ASP HA H 1 4.46 0.02 . 1 . . . . . . . . 5770 1 688 . 1 1 56 56 ASP CB C 13 40.4 0.30 . 1 . . . . . . . . 5770 1 689 . 1 1 56 56 ASP HB2 H 1 2.84 0.02 . 2 . . . . . . . . 5770 1 690 . 1 1 56 56 ASP HB3 H 1 2.66 0.02 . 2 . . . . . . . . 5770 1 691 . 1 1 56 56 ASP C C 13 176.0 0.30 . 1 . . . . . . . . 5770 1 692 . 1 1 57 57 ALA N N 15 131.3 0.20 . 1 . . . . . . . . 5770 1 693 . 1 1 57 57 ALA H H 1 8.14 0.02 . 1 . . . . . . . . 5770 1 694 . 1 1 57 57 ALA CA C 13 54.5 0.30 . 1 . . . . . . . . 5770 1 695 . 1 1 57 57 ALA HA H 1 4.27 0.02 . 1 . . . . . . . . 5770 1 696 . 1 1 57 57 ALA HB1 H 1 1.58 0.02 . 1 . . . . . . . . 5770 1 697 . 1 1 57 57 ALA HB2 H 1 1.58 0.02 . 1 . . . . . . . . 5770 1 698 . 1 1 57 57 ALA HB3 H 1 1.58 0.02 . 1 . . . . . . . . 5770 1 699 . 1 1 57 57 ALA CB C 13 19.9 0.30 . 1 . . . . . . . . 5770 1 700 . 1 1 57 57 ALA C C 13 178.8 0.30 . 1 . . . . . . . . 5770 1 701 . 1 1 58 58 ASP N N 15 114.1 0.20 . 1 . . . . . . . . 5770 1 702 . 1 1 58 58 ASP H H 1 8.28 0.02 . 1 . . . . . . . . 5770 1 703 . 1 1 58 58 ASP CA C 13 52.7 0.30 . 1 . . . . . . . . 5770 1 704 . 1 1 58 58 ASP HA H 1 4.68 0.02 . 1 . . . . . . . . 5770 1 705 . 1 1 58 58 ASP CB C 13 39.9 0.30 . 1 . . . . . . . . 5770 1 706 . 1 1 58 58 ASP HB2 H 1 3.10 0.02 . 2 . . . . . . . . 5770 1 707 . 1 1 58 58 ASP HB3 H 1 2.73 0.02 . 2 . . . . . . . . 5770 1 708 . 1 1 58 58 ASP C C 13 178.0 0.30 . 1 . . . . . . . . 5770 1 709 . 1 1 59 59 GLY N N 15 108.5 0.20 . 1 . . . . . . . . 5770 1 710 . 1 1 59 59 GLY H H 1 7.62 0.02 . 1 . . . . . . . . 5770 1 711 . 1 1 59 59 GLY CA C 13 47.1 0.30 . 1 . . . . . . . . 5770 1 712 . 1 1 59 59 GLY HA2 H 1 3.99 0.02 . 2 . . . . . . . . 5770 1 713 . 1 1 59 59 GLY HA3 H 1 3.82 0.02 . 2 . . . . . . . . 5770 1 714 . 1 1 59 59 GLY C C 13 175.1 0.30 . 1 . . . . . . . . 5770 1 715 . 1 1 60 60 ASN N N 15 119.0 0.20 . 1 . . . . . . . . 5770 1 716 . 1 1 60 60 ASN H H 1 8.21 0.02 . 1 . . . . . . . . 5770 1 717 . 1 1 60 60 ASN CA C 13 52.8 0.30 . 1 . . . . . . . . 5770 1 718 . 1 1 60 60 ASN HA H 1 4.67 0.02 . 1 . . . . . . . . 5770 1 719 . 1 1 60 60 ASN CB C 13 37.7 0.30 . 1 . . . . . . . . 5770 1 720 . 1 1 60 60 ASN HB2 H 1 3.35 0.02 . 2 . . . . . . . . 5770 1 721 . 1 1 60 60 ASN HB3 H 1 2.70 0.02 . 2 . . . . . . . . 5770 1 722 . 1 1 60 60 ASN CG C 13 178.9 0.30 . 1 . . . . . . . . 5770 1 723 . 1 1 60 60 ASN ND2 N 15 115.2 0.20 . 1 . . . . . . . . 5770 1 724 . 1 1 60 60 ASN HD21 H 1 7.78 0.02 . 2 . . . . . . . . 5770 1 725 . 1 1 60 60 ASN HD22 H 1 6.97 0.02 . 2 . . . . . . . . 5770 1 726 . 1 1 60 60 ASN C C 13 176.9 0.30 . 1 . . . . . . . . 5770 1 727 . 1 1 61 61 GLY N N 15 113.6 0.20 . 1 . . . . . . . . 5770 1 728 . 1 1 61 61 GLY H H 1 10.70 0.02 . 1 . . . . . . . . 5770 1 729 . 1 1 61 61 GLY CA C 13 45.6 0.30 . 1 . . . . . . . . 5770 1 730 . 1 1 61 61 GLY HA2 H 1 4.33 0.02 . 2 . . . . . . . . 5770 1 731 . 1 1 61 61 GLY HA3 H 1 3.55 0.02 . 2 . . . . . . . . 5770 1 732 . 1 1 61 61 GLY C C 13 173.2 0.30 . 1 . . . . . . . . 5770 1 733 . 1 1 62 62 THR N N 15 108.3 0.20 . 1 . . . . . . . . 5770 1 734 . 1 1 62 62 THR H H 1 7.70 0.02 . 1 . . . . . . . . 5770 1 735 . 1 1 62 62 THR CA C 13 59.4 0.30 . 1 . . . . . . . . 5770 1 736 . 1 1 62 62 THR HA H 1 4.79 0.02 . 1 . . . . . . . . 5770 1 737 . 1 1 62 62 THR CB C 13 72.5 0.30 . 1 . . . . . . . . 5770 1 738 . 1 1 62 62 THR HB H 1 4.06 0.02 . 1 . . . . . . . . 5770 1 739 . 1 1 62 62 THR HG21 H 1 1.19 0.02 . 1 . . . . . . . . 5770 1 740 . 1 1 62 62 THR HG22 H 1 1.19 0.02 . 1 . . . . . . . . 5770 1 741 . 1 1 62 62 THR HG23 H 1 1.19 0.02 . 1 . . . . . . . . 5770 1 742 . 1 1 62 62 THR CG2 C 13 22.6 0.30 . 1 . . . . . . . . 5770 1 743 . 1 1 62 62 THR C C 13 173.0 0.30 . 1 . . . . . . . . 5770 1 744 . 1 1 63 63 ILE N N 15 124.6 0.20 . 1 . . . . . . . . 5770 1 745 . 1 1 63 63 ILE H H 1 8.94 0.02 . 1 . . . . . . . . 5770 1 746 . 1 1 63 63 ILE CA C 13 57.5 0.30 . 1 . . . . . . . . 5770 1 747 . 1 1 63 63 ILE HA H 1 5.42 0.02 . 1 . . . . . . . . 5770 1 748 . 1 1 63 63 ILE CB C 13 37.9 0.30 . 1 . . . . . . . . 5770 1 749 . 1 1 63 63 ILE HB H 1 2.44 0.02 . 1 . . . . . . . . 5770 1 750 . 1 1 63 63 ILE HG21 H 1 1.14 0.02 . 1 . . . . . . . . 5770 1 751 . 1 1 63 63 ILE HG22 H 1 1.14 0.02 . 1 . . . . . . . . 5770 1 752 . 1 1 63 63 ILE HG23 H 1 1.14 0.02 . 1 . . . . . . . . 5770 1 753 . 1 1 63 63 ILE CG2 C 13 18.0 0.30 . 1 . . . . . . . . 5770 1 754 . 1 1 63 63 ILE CG1 C 13 27.5 0.30 . 1 . . . . . . . . 5770 1 755 . 1 1 63 63 ILE HG12 H 1 1.55 0.02 . 1 . . . . . . . . 5770 1 756 . 1 1 63 63 ILE HG13 H 1 1.55 0.02 . 1 . . . . . . . . 5770 1 757 . 1 1 63 63 ILE HD11 H 1 0.97 0.02 . 1 . . . . . . . . 5770 1 758 . 1 1 63 63 ILE HD12 H 1 0.97 0.02 . 1 . . . . . . . . 5770 1 759 . 1 1 63 63 ILE HD13 H 1 0.97 0.02 . 1 . . . . . . . . 5770 1 760 . 1 1 63 63 ILE CD1 C 13 10.5 0.30 . 1 . . . . . . . . 5770 1 761 . 1 1 63 63 ILE C C 13 175.8 0.30 . 1 . . . . . . . . 5770 1 762 . 1 1 64 64 ASP N N 15 128.4 0.20 . 1 . . . . . . . . 5770 1 763 . 1 1 64 64 ASP H H 1 8.91 0.02 . 1 . . . . . . . . 5770 1 764 . 1 1 64 64 ASP CA C 13 52.0 0.30 . 1 . . . . . . . . 5770 1 765 . 1 1 64 64 ASP HA H 1 5.49 0.02 . 1 . . . . . . . . 5770 1 766 . 1 1 64 64 ASP CB C 13 42.3 0.30 . 1 . . . . . . . . 5770 1 767 . 1 1 64 64 ASP HB2 H 1 3.20 0.02 . 2 . . . . . . . . 5770 1 768 . 1 1 64 64 ASP HB3 H 1 2.84 0.02 . 2 . . . . . . . . 5770 1 769 . 1 1 64 64 ASP C C 13 175.8 0.30 . 1 . . . . . . . . 5770 1 770 . 1 1 65 65 PHE N N 15 118.2 0.20 . 1 . . . . . . . . 5770 1 771 . 1 1 65 65 PHE H H 1 8.83 0.02 . 1 . . . . . . . . 5770 1 772 . 1 1 65 65 PHE CA C 13 63.0 0.30 . 1 . . . . . . . . 5770 1 773 . 1 1 65 65 PHE HA H 1 3.90 0.02 . 1 . . . . . . . . 5770 1 774 . 1 1 65 65 PHE CB C 13 36.0 0.30 . 1 . . . . . . . . 5770 1 775 . 1 1 65 65 PHE HB2 H 1 2.78 0.02 . 2 . . . . . . . . 5770 1 776 . 1 1 65 65 PHE HB3 H 1 1.99 0.02 . 2 . . . . . . . . 5770 1 777 . 1 1 65 65 PHE HD1 H 1 6.80 0.02 . 1 . . . . . . . . 5770 1 778 . 1 1 65 65 PHE HD2 H 1 6.80 0.02 . 1 . . . . . . . . 5770 1 779 . 1 1 65 65 PHE HE1 H 1 7.23 0.02 . 1 . . . . . . . . 5770 1 780 . 1 1 65 65 PHE HE2 H 1 7.23 0.02 . 1 . . . . . . . . 5770 1 781 . 1 1 65 65 PHE CD1 C 13 132.1 0.30 . 1 . . . . . . . . 5770 1 782 . 1 1 65 65 PHE CE1 C 13 130.7 0.30 . 1 . . . . . . . . 5770 1 783 . 1 1 65 65 PHE CZ C 13 131.7 0.30 . 1 . . . . . . . . 5770 1 784 . 1 1 65 65 PHE HZ H 1 6.65 0.02 . 1 . . . . . . . . 5770 1 785 . 1 1 65 65 PHE CE2 C 13 130.7 0.30 . 1 . . . . . . . . 5770 1 786 . 1 1 65 65 PHE CD2 C 13 132.1 0.30 . 1 . . . . . . . . 5770 1 787 . 1 1 66 66 PRO CD C 13 49.0 0.30 . 1 . . . . . . . . 5770 1 788 . 1 1 66 66 PRO CA C 13 66.7 0.30 . 1 . . . . . . . . 5770 1 789 . 1 1 66 66 PRO HA H 1 3.81 0.02 . 1 . . . . . . . . 5770 1 790 . 1 1 66 66 PRO CB C 13 30.6 0.30 . 1 . . . . . . . . 5770 1 791 . 1 1 66 66 PRO HB2 H 1 2.20 0.02 . 2 . . . . . . . . 5770 1 792 . 1 1 66 66 PRO HB3 H 1 1.88 0.02 . 2 . . . . . . . . 5770 1 793 . 1 1 66 66 PRO CG C 13 28.4 0.30 . 1 . . . . . . . . 5770 1 794 . 1 1 66 66 PRO HG2 H 1 2.17 0.02 . 2 . . . . . . . . 5770 1 795 . 1 1 66 66 PRO HG3 H 1 1.86 0.02 . 2 . . . . . . . . 5770 1 796 . 1 1 66 66 PRO HD2 H 1 3.75 0.02 . 1 . . . . . . . . 5770 1 797 . 1 1 66 66 PRO HD3 H 1 3.75 0.02 . 1 . . . . . . . . 5770 1 798 . 1 1 66 66 PRO C C 13 179.3 0.30 . 1 . . . . . . . . 5770 1 799 . 1 1 67 67 GLU N N 15 118.5 0.20 . 1 . . . . . . . . 5770 1 800 . 1 1 67 67 GLU H H 1 8.28 0.02 . 1 . . . . . . . . 5770 1 801 . 1 1 67 67 GLU CA C 13 59.2 0.30 . 1 . . . . . . . . 5770 1 802 . 1 1 67 67 GLU HA H 1 3.92 0.02 . 1 . . . . . . . . 5770 1 803 . 1 1 67 67 GLU CB C 13 29.7 0.30 . 1 . . . . . . . . 5770 1 804 . 1 1 67 67 GLU HB2 H 1 2.06 0.02 . 1 . . . . . . . . 5770 1 805 . 1 1 67 67 GLU HB3 H 1 2.06 0.02 . 1 . . . . . . . . 5770 1 806 . 1 1 67 67 GLU CG C 13 37.6 0.30 . 1 . . . . . . . . 5770 1 807 . 1 1 67 67 GLU HG2 H 1 3.04 0.02 . 1 . . . . . . . . 5770 1 808 . 1 1 67 67 GLU HG3 H 1 3.04 0.02 . 1 . . . . . . . . 5770 1 809 . 1 1 67 67 GLU C C 13 179.1 0.30 . 1 . . . . . . . . 5770 1 810 . 1 1 68 68 PHE N N 15 123.1 0.20 . 1 . . . . . . . . 5770 1 811 . 1 1 68 68 PHE H H 1 8.42 0.02 . 1 . . . . . . . . 5770 1 812 . 1 1 68 68 PHE CA C 13 61.0 0.30 . 1 . . . . . . . . 5770 1 813 . 1 1 68 68 PHE HA H 1 3.58 0.02 . 1 . . . . . . . . 5770 1 814 . 1 1 68 68 PHE CB C 13 40.6 0.30 . 1 . . . . . . . . 5770 1 815 . 1 1 68 68 PHE HB2 H 1 3.39 0.02 . 2 . . . . . . . . 5770 1 816 . 1 1 68 68 PHE HB3 H 1 2.94 0.02 . 2 . . . . . . . . 5770 1 817 . 1 1 68 68 PHE HD1 H 1 6.69 0.02 . 1 . . . . . . . . 5770 1 818 . 1 1 68 68 PHE HD2 H 1 6.69 0.02 . 1 . . . . . . . . 5770 1 819 . 1 1 68 68 PHE HE1 H 1 6.75 0.02 . 1 . . . . . . . . 5770 1 820 . 1 1 68 68 PHE HE2 H 1 6.75 0.02 . 1 . . . . . . . . 5770 1 821 . 1 1 68 68 PHE CD1 C 13 131.6 0.30 . 1 . . . . . . . . 5770 1 822 . 1 1 68 68 PHE CE1 C 13 132.0 0.30 . 1 . . . . . . . . 5770 1 823 . 1 1 68 68 PHE CZ C 13 131.5 0.30 . 1 . . . . . . . . 5770 1 824 . 1 1 68 68 PHE HZ H 1 7.20 0.02 . 1 . . . . . . . . 5770 1 825 . 1 1 68 68 PHE CE2 C 13 132.0 0.30 . 1 . . . . . . . . 5770 1 826 . 1 1 68 68 PHE CD2 C 13 131.6 0.30 . 1 . . . . . . . . 5770 1 827 . 1 1 68 68 PHE C C 13 176.5 0.30 . 1 . . . . . . . . 5770 1 828 . 1 1 69 69 LEU N N 15 119.3 0.20 . 1 . . . . . . . . 5770 1 829 . 1 1 69 69 LEU H H 1 8.82 0.02 . 1 . . . . . . . . 5770 1 830 . 1 1 69 69 LEU CA C 13 57.4 0.30 . 1 . . . . . . . . 5770 1 831 . 1 1 69 69 LEU HA H 1 3.23 0.02 . 1 . . . . . . . . 5770 1 832 . 1 1 69 69 LEU CB C 13 41.3 0.30 . 1 . . . . . . . . 5770 1 833 . 1 1 69 69 LEU HB2 H 1 1.20 0.02 . 2 . . . . . . . . 5770 1 834 . 1 1 69 69 LEU HB3 H 1 0.97 0.02 . 2 . . . . . . . . 5770 1 835 . 1 1 69 69 LEU CG C 13 25.9 0.30 . 1 . . . . . . . . 5770 1 836 . 1 1 69 69 LEU HG H 1 1.03 0.02 . 1 . . . . . . . . 5770 1 837 . 1 1 69 69 LEU HD11 H 1 0.65 0.02 . 2 . . . . . . . . 5770 1 838 . 1 1 69 69 LEU HD12 H 1 0.65 0.02 . 2 . . . . . . . . 5770 1 839 . 1 1 69 69 LEU HD13 H 1 0.65 0.02 . 2 . . . . . . . . 5770 1 840 . 1 1 69 69 LEU HD21 H 1 0.57 0.02 . 2 . . . . . . . . 5770 1 841 . 1 1 69 69 LEU HD22 H 1 0.57 0.02 . 2 . . . . . . . . 5770 1 842 . 1 1 69 69 LEU HD23 H 1 0.57 0.02 . 2 . . . . . . . . 5770 1 843 . 1 1 69 69 LEU CD1 C 13 24.7 0.30 . 1 . . . . . . . . 5770 1 844 . 1 1 69 69 LEU CD2 C 13 24.8 0.30 . 1 . . . . . . . . 5770 1 845 . 1 1 69 69 LEU C C 13 178.6 0.30 . 1 . . . . . . . . 5770 1 846 . 1 1 70 70 THR N N 15 114.9 0.20 . 1 . . . . . . . . 5770 1 847 . 1 1 70 70 THR H H 1 7.69 0.02 . 1 . . . . . . . . 5770 1 848 . 1 1 70 70 THR CA C 13 66.7 0.30 . 1 . . . . . . . . 5770 1 849 . 1 1 70 70 THR HA H 1 3.65 0.02 . 1 . . . . . . . . 5770 1 850 . 1 1 70 70 THR CB C 13 68.6 0.30 . 1 . . . . . . . . 5770 1 851 . 1 1 70 70 THR HB H 1 4.06 0.02 . 1 . . . . . . . . 5770 1 852 . 1 1 70 70 THR HG21 H 1 1.17 0.02 . 1 . . . . . . . . 5770 1 853 . 1 1 70 70 THR HG22 H 1 1.17 0.02 . 1 . . . . . . . . 5770 1 854 . 1 1 70 70 THR HG23 H 1 1.17 0.02 . 1 . . . . . . . . 5770 1 855 . 1 1 70 70 THR CG2 C 13 21.7 0.30 . 1 . . . . . . . . 5770 1 856 . 1 1 70 70 THR C C 13 175.9 0.30 . 1 . . . . . . . . 5770 1 857 . 1 1 71 71 MET N N 15 119.3 0.20 . 1 . . . . . . . . 5770 1 858 . 1 1 71 71 MET H H 1 6.66 0.02 . 1 . . . . . . . . 5770 1 859 . 1 1 71 71 MET CA C 13 57.9 0.30 . 1 . . . . . . . . 5770 1 860 . 1 1 71 71 MET HA H 1 3.31 0.02 . 1 . . . . . . . . 5770 1 861 . 1 1 71 71 MET CB C 13 31.8 0.30 . 1 . . . . . . . . 5770 1 862 . 1 1 71 71 MET HB2 H 1 1.44 0.02 . 2 . . . . . . . . 5770 1 863 . 1 1 71 71 MET HB3 H 1 1.09 0.02 . 2 . . . . . . . . 5770 1 864 . 1 1 71 71 MET CG C 13 29.5 0.30 . 1 . . . . . . . . 5770 1 865 . 1 1 71 71 MET HG2 H 1 1.35 0.02 . 2 . . . . . . . . 5770 1 866 . 1 1 71 71 MET HG3 H 1 1.26 0.02 . 2 . . . . . . . . 5770 1 867 . 1 1 71 71 MET HE1 H 1 0.53 0.02 . 1 . . . . . . . . 5770 1 868 . 1 1 71 71 MET HE2 H 1 0.53 0.02 . 1 . . . . . . . . 5770 1 869 . 1 1 71 71 MET HE3 H 1 0.53 0.02 . 1 . . . . . . . . 5770 1 870 . 1 1 71 71 MET CE C 13 15.6 0.30 . 1 . . . . . . . . 5770 1 871 . 1 1 71 71 MET C C 13 176.9 0.30 . 1 . . . . . . . . 5770 1 872 . 1 1 72 72 MET N N 15 116.2 0.20 . 1 . . . . . . . . 5770 1 873 . 1 1 72 72 MET H H 1 7.41 0.02 . 1 . . . . . . . . 5770 1 874 . 1 1 72 72 MET CA C 13 55.4 0.30 . 1 . . . . . . . . 5770 1 875 . 1 1 72 72 MET HA H 1 3.94 0.02 . 1 . . . . . . . . 5770 1 876 . 1 1 72 72 MET CB C 13 31.2 0.30 . 1 . . . . . . . . 5770 1 877 . 1 1 72 72 MET HB2 H 1 1.11 0.02 . 2 . . . . . . . . 5770 1 878 . 1 1 72 72 MET HB3 H 1 1.04 0.02 . 2 . . . . . . . . 5770 1 879 . 1 1 72 72 MET CG C 13 32.1 0.30 . 1 . . . . . . . . 5770 1 880 . 1 1 72 72 MET HG2 H 1 1.50 0.02 . 2 . . . . . . . . 5770 1 881 . 1 1 72 72 MET HG3 H 1 1.42 0.02 . 2 . . . . . . . . 5770 1 882 . 1 1 72 72 MET HE1 H 1 1.60 0.02 . 1 . . . . . . . . 5770 1 883 . 1 1 72 72 MET HE2 H 1 1.60 0.02 . 1 . . . . . . . . 5770 1 884 . 1 1 72 72 MET HE3 H 1 1.60 0.02 . 1 . . . . . . . . 5770 1 885 . 1 1 72 72 MET CE C 13 18.3 0.30 . 1 . . . . . . . . 5770 1 886 . 1 1 72 72 MET C C 13 177.7 0.30 . 1 . . . . . . . . 5770 1 887 . 1 1 73 73 ALA N N 15 121.2 0.20 . 1 . . . . . . . . 5770 1 888 . 1 1 73 73 ALA H H 1 8.06 0.02 . 1 . . . . . . . . 5770 1 889 . 1 1 73 73 ALA CA C 13 53.4 0.30 . 1 . . . . . . . . 5770 1 890 . 1 1 73 73 ALA HA H 1 4.11 0.02 . 1 . . . . . . . . 5770 1 891 . 1 1 73 73 ALA HB1 H 1 1.30 0.02 . 1 . . . . . . . . 5770 1 892 . 1 1 73 73 ALA HB2 H 1 1.30 0.02 . 1 . . . . . . . . 5770 1 893 . 1 1 73 73 ALA HB3 H 1 1.30 0.02 . 1 . . . . . . . . 5770 1 894 . 1 1 73 73 ALA CB C 13 18.6 0.30 . 1 . . . . . . . . 5770 1 895 . 1 1 73 73 ALA C C 13 178.4 0.30 . 1 . . . . . . . . 5770 1 896 . 1 1 74 74 ARG N N 15 117.7 0.20 . 1 . . . . . . . . 5770 1 897 . 1 1 74 74 ARG H H 1 7.40 0.02 . 1 . . . . . . . . 5770 1 898 . 1 1 74 74 ARG CA C 13 57.1 0.30 . 1 . . . . . . . . 5770 1 899 . 1 1 74 74 ARG HA H 1 4.21 0.02 . 1 . . . . . . . . 5770 1 900 . 1 1 74 74 ARG CB C 13 30.1 0.30 . 1 . . . . . . . . 5770 1 901 . 1 1 74 74 ARG HB2 H 1 1.97 0.02 . 2 . . . . . . . . 5770 1 902 . 1 1 74 74 ARG HB3 H 1 1.91 0.02 . 2 . . . . . . . . 5770 1 903 . 1 1 74 74 ARG CG C 13 27.1 0.30 . 1 . . . . . . . . 5770 1 904 . 1 1 74 74 ARG HG2 H 1 1.71 0.02 . 2 . . . . . . . . 5770 1 905 . 1 1 74 74 ARG HG3 H 1 1.69 0.02 . 2 . . . . . . . . 5770 1 906 . 1 1 74 74 ARG CD C 13 43.4 0.30 . 1 . . . . . . . . 5770 1 907 . 1 1 74 74 ARG HD2 H 1 3.23 0.02 . 2 . . . . . . . . 5770 1 908 . 1 1 74 74 ARG HD3 H 1 3.16 0.02 . 2 . . . . . . . . 5770 1 909 . 1 1 74 74 ARG C C 13 176.9 0.30 . 1 . . . . . . . . 5770 1 910 . 1 1 75 75 LYS N N 15 120.6 0.20 . 1 . . . . . . . . 5770 1 911 . 1 1 75 75 LYS H H 1 8.01 0.02 . 1 . . . . . . . . 5770 1 912 . 1 1 75 75 LYS CA C 13 56.7 0.30 . 1 . . . . . . . . 5770 1 913 . 1 1 75 75 LYS HA H 1 4.35 0.02 . 1 . . . . . . . . 5770 1 914 . 1 1 75 75 LYS CB C 13 32.5 0.30 . 1 . . . . . . . . 5770 1 915 . 1 1 75 75 LYS HB2 H 1 1.94 0.02 . 2 . . . . . . . . 5770 1 916 . 1 1 75 75 LYS HB3 H 1 1.83 0.02 . 2 . . . . . . . . 5770 1 917 . 1 1 75 75 LYS CG C 13 24.6 0.30 . 1 . . . . . . . . 5770 1 918 . 1 1 75 75 LYS HG2 H 1 1.51 0.02 . 1 . . . . . . . . 5770 1 919 . 1 1 75 75 LYS HG3 H 1 1.51 0.02 . 1 . . . . . . . . 5770 1 920 . 1 1 75 75 LYS CD C 13 29.1 0.30 . 1 . . . . . . . . 5770 1 921 . 1 1 75 75 LYS HD2 H 1 1.73 0.02 . 1 . . . . . . . . 5770 1 922 . 1 1 75 75 LYS HD3 H 1 1.73 0.02 . 1 . . . . . . . . 5770 1 923 . 1 1 75 75 LYS CE C 13 42.0 0.30 . 1 . . . . . . . . 5770 1 924 . 1 1 75 75 LYS HE2 H 1 3.04 0.02 . 1 . . . . . . . . 5770 1 925 . 1 1 75 75 LYS HE3 H 1 3.04 0.02 . 1 . . . . . . . . 5770 1 926 . 1 1 75 75 LYS C C 13 177.2 0.30 . 1 . . . . . . . . 5770 1 927 . 1 1 76 76 MET N N 15 120.3 0.20 . 1 . . . . . . . . 5770 1 928 . 1 1 76 76 MET H H 1 8.19 0.02 . 1 . . . . . . . . 5770 1 929 . 1 1 76 76 MET CA C 13 56.2 0.30 . 1 . . . . . . . . 5770 1 930 . 1 1 76 76 MET HA H 1 4.46 0.02 . 1 . . . . . . . . 5770 1 931 . 1 1 76 76 MET CB C 13 33.0 0.30 . 1 . . . . . . . . 5770 1 932 . 1 1 76 76 MET HB2 H 1 2.18 0.02 . 2 . . . . . . . . 5770 1 933 . 1 1 76 76 MET HB3 H 1 2.10 0.02 . 2 . . . . . . . . 5770 1 934 . 1 1 76 76 MET CG C 13 32.4 0.30 . 1 . . . . . . . . 5770 1 935 . 1 1 76 76 MET HG2 H 1 2.68 0.02 . 2 . . . . . . . . 5770 1 936 . 1 1 76 76 MET HG3 H 1 2.63 0.02 . 2 . . . . . . . . 5770 1 937 . 1 1 76 76 MET HE1 H 1 2.12 0.02 . 1 . . . . . . . . 5770 1 938 . 1 1 76 76 MET HE2 H 1 2.12 0.02 . 1 . . . . . . . . 5770 1 939 . 1 1 76 76 MET HE3 H 1 2.12 0.02 . 1 . . . . . . . . 5770 1 940 . 1 1 76 76 MET CE C 13 17.4 0.30 . 1 . . . . . . . . 5770 1 941 . 1 1 76 76 MET C C 13 176.4 0.30 . 1 . . . . . . . . 5770 1 942 . 1 1 77 77 LYS N N 15 121.1 0.20 . 1 . . . . . . . . 5770 1 943 . 1 1 77 77 LYS H H 1 8.04 0.02 . 1 . . . . . . . . 5770 1 944 . 1 1 77 77 LYS CA C 13 56.7 0.30 . 1 . . . . . . . . 5770 1 945 . 1 1 77 77 LYS HA H 1 4.36 0.02 . 1 . . . . . . . . 5770 1 946 . 1 1 77 77 LYS CB C 13 33.3 0.30 . 1 . . . . . . . . 5770 1 947 . 1 1 77 77 LYS HB2 H 1 1.91 0.02 . 2 . . . . . . . . 5770 1 948 . 1 1 77 77 LYS HB3 H 1 1.84 0.02 . 2 . . . . . . . . 5770 1 949 . 1 1 77 77 LYS CG C 13 24.7 0.30 . 1 . . . . . . . . 5770 1 950 . 1 1 77 77 LYS HG2 H 1 1.50 0.02 . 1 . . . . . . . . 5770 1 951 . 1 1 77 77 LYS HG3 H 1 1.50 0.02 . 1 . . . . . . . . 5770 1 952 . 1 1 77 77 LYS CD C 13 29.0 0.30 . 1 . . . . . . . . 5770 1 953 . 1 1 77 77 LYS HD2 H 1 1.72 0.02 . 1 . . . . . . . . 5770 1 954 . 1 1 77 77 LYS HD3 H 1 1.72 0.02 . 1 . . . . . . . . 5770 1 955 . 1 1 77 77 LYS CE C 13 42.0 0.30 . 1 . . . . . . . . 5770 1 956 . 1 1 77 77 LYS HE2 H 1 3.02 0.02 . 1 . . . . . . . . 5770 1 957 . 1 1 77 77 LYS HE3 H 1 3.02 0.02 . 1 . . . . . . . . 5770 1 958 . 1 1 77 77 LYS C C 13 176.5 0.30 . 1 . . . . . . . . 5770 1 959 . 1 1 78 78 ASP N N 15 121.9 0.20 . 1 . . . . . . . . 5770 1 960 . 1 1 78 78 ASP H H 1 8.33 0.02 . 1 . . . . . . . . 5770 1 961 . 1 1 78 78 ASP CA C 13 54.8 0.30 . 1 . . . . . . . . 5770 1 962 . 1 1 78 78 ASP HA H 1 4.69 0.02 . 1 . . . . . . . . 5770 1 963 . 1 1 78 78 ASP CB C 13 41.2 0.30 . 1 . . . . . . . . 5770 1 964 . 1 1 78 78 ASP HB2 H 1 2.83 0.02 . 2 . . . . . . . . 5770 1 965 . 1 1 78 78 ASP HB3 H 1 2.71 0.02 . 2 . . . . . . . . 5770 1 966 . 1 1 78 78 ASP C C 13 176.7 0.30 . 1 . . . . . . . . 5770 1 967 . 1 1 79 79 THR N N 15 114.5 0.20 . 1 . . . . . . . . 5770 1 968 . 1 1 79 79 THR H H 1 8.13 0.02 . 1 . . . . . . . . 5770 1 969 . 1 1 79 79 THR CA C 13 62.5 0.30 . 1 . . . . . . . . 5770 1 970 . 1 1 79 79 THR HA H 1 4.33 0.02 . 1 . . . . . . . . 5770 1 971 . 1 1 79 79 THR CB C 13 69.9 0.30 . 1 . . . . . . . . 5770 1 972 . 1 1 79 79 THR HB H 1 4.31 0.02 . 1 . . . . . . . . 5770 1 973 . 1 1 79 79 THR HG21 H 1 1.25 0.02 . 1 . . . . . . . . 5770 1 974 . 1 1 79 79 THR HG22 H 1 1.25 0.02 . 1 . . . . . . . . 5770 1 975 . 1 1 79 79 THR HG23 H 1 1.25 0.02 . 1 . . . . . . . . 5770 1 976 . 1 1 79 79 THR CG2 C 13 21.8 0.30 . 1 . . . . . . . . 5770 1 977 . 1 1 79 79 THR C C 13 174.7 0.30 . 1 . . . . . . . . 5770 1 978 . 1 1 80 80 ASP N N 15 123.2 0.20 . 1 . . . . . . . . 5770 1 979 . 1 1 80 80 ASP H H 1 8.43 0.02 . 1 . . . . . . . . 5770 1 980 . 1 1 80 80 ASP CA C 13 54.9 0.30 . 1 . . . . . . . . 5770 1 981 . 1 1 80 80 ASP HA H 1 4.67 0.02 . 1 . . . . . . . . 5770 1 982 . 1 1 80 80 ASP CB C 13 41.2 0.30 . 1 . . . . . . . . 5770 1 983 . 1 1 80 80 ASP HB2 H 1 2.78 0.02 . 2 . . . . . . . . 5770 1 984 . 1 1 80 80 ASP HB3 H 1 2.73 0.02 . 2 . . . . . . . . 5770 1 985 . 1 1 80 80 ASP C C 13 177.1 0.30 . 1 . . . . . . . . 5770 1 986 . 1 1 81 81 SER N N 15 117.1 0.20 . 1 . . . . . . . . 5770 1 987 . 1 1 81 81 SER H H 1 8.40 0.02 . 1 . . . . . . . . 5770 1 988 . 1 1 81 81 SER CA C 13 60.2 0.30 . 1 . . . . . . . . 5770 1 989 . 1 1 81 81 SER HA H 1 4.44 0.02 . 1 . . . . . . . . 5770 1 990 . 1 1 81 81 SER CB C 13 63.5 0.30 . 1 . . . . . . . . 5770 1 991 . 1 1 81 81 SER HB2 H 1 4.02 0.02 . 1 . . . . . . . . 5770 1 992 . 1 1 81 81 SER HB3 H 1 4.02 0.02 . 1 . . . . . . . . 5770 1 993 . 1 1 81 81 SER C C 13 175.6 0.30 . 1 . . . . . . . . 5770 1 994 . 1 1 82 82 GLU N N 15 122.2 0.20 . 1 . . . . . . . . 5770 1 995 . 1 1 82 82 GLU H H 1 8.36 0.02 . 1 . . . . . . . . 5770 1 996 . 1 1 82 82 GLU CA C 13 58.5 0.30 . 1 . . . . . . . . 5770 1 997 . 1 1 82 82 GLU HA H 1 4.21 0.02 . 1 . . . . . . . . 5770 1 998 . 1 1 82 82 GLU CB C 13 29.7 0.30 . 1 . . . . . . . . 5770 1 999 . 1 1 82 82 GLU HB2 H 1 2.19 0.02 . 2 . . . . . . . . 5770 1 1000 . 1 1 82 82 GLU HB3 H 1 2.12 0.02 . 2 . . . . . . . . 5770 1 1001 . 1 1 82 82 GLU CG C 13 36.6 0.30 . 1 . . . . . . . . 5770 1 1002 . 1 1 82 82 GLU HG2 H 1 2.37 0.02 . 2 . . . . . . . . 5770 1 1003 . 1 1 82 82 GLU HG3 H 1 2.33 0.02 . 2 . . . . . . . . 5770 1 1004 . 1 1 82 82 GLU C C 13 177.7 0.30 . 1 . . . . . . . . 5770 1 1005 . 1 1 83 83 GLU N N 15 120.0 0.20 . 1 . . . . . . . . 5770 1 1006 . 1 1 83 83 GLU H H 1 8.18 0.02 . 1 . . . . . . . . 5770 1 1007 . 1 1 83 83 GLU CA C 13 59.6 0.30 . 1 . . . . . . . . 5770 1 1008 . 1 1 83 83 GLU HA H 1 4.11 0.02 . 1 . . . . . . . . 5770 1 1009 . 1 1 83 83 GLU CB C 13 29.8 0.30 . 1 . . . . . . . . 5770 1 1010 . 1 1 83 83 GLU HB2 H 1 2.13 0.02 . 1 . . . . . . . . 5770 1 1011 . 1 1 83 83 GLU HB3 H 1 2.13 0.02 . 1 . . . . . . . . 5770 1 1012 . 1 1 83 83 GLU CG C 13 36.0 0.30 . 1 . . . . . . . . 5770 1 1013 . 1 1 83 83 GLU HG2 H 1 2.33 0.02 . 1 . . . . . . . . 5770 1 1014 . 1 1 83 83 GLU HG3 H 1 2.33 0.02 . 1 . . . . . . . . 5770 1 1015 . 1 1 83 83 GLU C C 13 179.5 0.30 . 1 . . . . . . . . 5770 1 1016 . 1 1 84 84 GLU N N 15 118.7 0.20 . 1 . . . . . . . . 5770 1 1017 . 1 1 84 84 GLU H H 1 8.18 0.02 . 1 . . . . . . . . 5770 1 1018 . 1 1 84 84 GLU CA C 13 59.5 0.30 . 1 . . . . . . . . 5770 1 1019 . 1 1 84 84 GLU HA H 1 4.14 0.02 . 1 . . . . . . . . 5770 1 1020 . 1 1 84 84 GLU CB C 13 29.6 0.30 . 1 . . . . . . . . 5770 1 1021 . 1 1 84 84 GLU HB2 H 1 2.13 0.02 . 1 . . . . . . . . 5770 1 1022 . 1 1 84 84 GLU HB3 H 1 2.13 0.02 . 1 . . . . . . . . 5770 1 1023 . 1 1 84 84 GLU CG C 13 36.8 0.30 . 1 . . . . . . . . 5770 1 1024 . 1 1 84 84 GLU HG2 H 1 2.41 0.02 . 2 . . . . . . . . 5770 1 1025 . 1 1 84 84 GLU HG3 H 1 2.35 0.02 . 2 . . . . . . . . 5770 1 1026 . 1 1 84 84 GLU C C 13 179.3 0.30 . 1 . . . . . . . . 5770 1 1027 . 1 1 85 85 ILE N N 15 120.8 0.20 . 1 . . . . . . . . 5770 1 1028 . 1 1 85 85 ILE H H 1 7.89 0.02 . 1 . . . . . . . . 5770 1 1029 . 1 1 85 85 ILE CA C 13 64.6 0.30 . 1 . . . . . . . . 5770 1 1030 . 1 1 85 85 ILE HA H 1 3.97 0.02 . 1 . . . . . . . . 5770 1 1031 . 1 1 85 85 ILE CB C 13 37.5 0.30 . 1 . . . . . . . . 5770 1 1032 . 1 1 85 85 ILE HB H 1 2.16 0.02 . 1 . . . . . . . . 5770 1 1033 . 1 1 85 85 ILE HG21 H 1 1.11 0.02 . 1 . . . . . . . . 5770 1 1034 . 1 1 85 85 ILE HG22 H 1 1.11 0.02 . 1 . . . . . . . . 5770 1 1035 . 1 1 85 85 ILE HG23 H 1 1.11 0.02 . 1 . . . . . . . . 5770 1 1036 . 1 1 85 85 ILE CG2 C 13 18.8 0.30 . 1 . . . . . . . . 5770 1 1037 . 1 1 85 85 ILE CG1 C 13 29.0 0.30 . 1 . . . . . . . . 5770 1 1038 . 1 1 85 85 ILE HG12 H 1 1.79 0.02 . 2 . . . . . . . . 5770 1 1039 . 1 1 85 85 ILE HG13 H 1 1.11 0.02 . 2 . . . . . . . . 5770 1 1040 . 1 1 85 85 ILE HD11 H 1 0.78 0.02 . 1 . . . . . . . . 5770 1 1041 . 1 1 85 85 ILE HD12 H 1 0.78 0.02 . 1 . . . . . . . . 5770 1 1042 . 1 1 85 85 ILE HD13 H 1 0.78 0.02 . 1 . . . . . . . . 5770 1 1043 . 1 1 85 85 ILE CD1 C 13 13.2 0.30 . 1 . . . . . . . . 5770 1 1044 . 1 1 85 85 ILE C C 13 177.8 0.30 . 1 . . . . . . . . 5770 1 1045 . 1 1 86 86 ARG N N 15 121.7 0.20 . 1 . . . . . . . . 5770 1 1046 . 1 1 86 86 ARG H H 1 8.32 0.02 . 1 . . . . . . . . 5770 1 1047 . 1 1 86 86 ARG CA C 13 59.5 0.30 . 1 . . . . . . . . 5770 1 1048 . 1 1 86 86 ARG HA H 1 4.05 0.02 . 1 . . . . . . . . 5770 1 1049 . 1 1 86 86 ARG CB C 13 29.8 0.30 . 1 . . . . . . . . 5770 1 1050 . 1 1 86 86 ARG HB2 H 1 2.22 0.02 . 2 . . . . . . . . 5770 1 1051 . 1 1 86 86 ARG HB3 H 1 1.98 0.02 . 2 . . . . . . . . 5770 1 1052 . 1 1 86 86 ARG CG C 13 27.5 0.30 . 1 . . . . . . . . 5770 1 1053 . 1 1 86 86 ARG HG2 H 1 2.11 0.02 . 1 . . . . . . . . 5770 1 1054 . 1 1 86 86 ARG HG3 H 1 2.11 0.02 . 1 . . . . . . . . 5770 1 1055 . 1 1 86 86 ARG CD C 13 43.2 0.30 . 1 . . . . . . . . 5770 1 1056 . 1 1 86 86 ARG HD2 H 1 3.01 0.02 . 1 . . . . . . . . 5770 1 1057 . 1 1 86 86 ARG HD3 H 1 3.01 0.02 . 1 . . . . . . . . 5770 1 1058 . 1 1 86 86 ARG C C 13 178.4 0.30 . 1 . . . . . . . . 5770 1 1059 . 1 1 87 87 GLU N N 15 118.7 0.20 . 1 . . . . . . . . 5770 1 1060 . 1 1 87 87 GLU H H 1 8.20 0.02 . 1 . . . . . . . . 5770 1 1061 . 1 1 87 87 GLU CA C 13 58.9 0.30 . 1 . . . . . . . . 5770 1 1062 . 1 1 87 87 GLU HA H 1 3.78 0.02 . 1 . . . . . . . . 5770 1 1063 . 1 1 87 87 GLU CB C 13 29.2 0.30 . 1 . . . . . . . . 5770 1 1064 . 1 1 87 87 GLU HB2 H 1 1.99 0.02 . 1 . . . . . . . . 5770 1 1065 . 1 1 87 87 GLU HB3 H 1 1.99 0.02 . 1 . . . . . . . . 5770 1 1066 . 1 1 87 87 GLU CG C 13 36.0 0.30 . 1 . . . . . . . . 5770 1 1067 . 1 1 87 87 GLU HG2 H 1 2.16 0.02 . 1 . . . . . . . . 5770 1 1068 . 1 1 87 87 GLU HG3 H 1 2.16 0.02 . 1 . . . . . . . . 5770 1 1069 . 1 1 87 87 GLU C C 13 177.8 0.30 . 1 . . . . . . . . 5770 1 1070 . 1 1 88 88 ALA N N 15 121.1 0.20 . 1 . . . . . . . . 5770 1 1071 . 1 1 88 88 ALA H H 1 8.07 0.02 . 1 . . . . . . . . 5770 1 1072 . 1 1 88 88 ALA CA C 13 54.9 0.30 . 1 . . . . . . . . 5770 1 1073 . 1 1 88 88 ALA HA H 1 4.12 0.02 . 1 . . . . . . . . 5770 1 1074 . 1 1 88 88 ALA HB1 H 1 1.78 0.02 . 1 . . . . . . . . 5770 1 1075 . 1 1 88 88 ALA HB2 H 1 1.78 0.02 . 1 . . . . . . . . 5770 1 1076 . 1 1 88 88 ALA HB3 H 1 1.78 0.02 . 1 . . . . . . . . 5770 1 1077 . 1 1 88 88 ALA CB C 13 19.0 0.30 . 1 . . . . . . . . 5770 1 1078 . 1 1 88 88 ALA C C 13 179.1 0.30 . 1 . . . . . . . . 5770 1 1079 . 1 1 89 89 PHE N N 15 118.1 0.20 . 1 . . . . . . . . 5770 1 1080 . 1 1 89 89 PHE H H 1 8.44 0.02 . 1 . . . . . . . . 5770 1 1081 . 1 1 89 89 PHE CA C 13 62.5 0.30 . 1 . . . . . . . . 5770 1 1082 . 1 1 89 89 PHE HA H 1 3.19 0.02 . 1 . . . . . . . . 5770 1 1083 . 1 1 89 89 PHE CB C 13 39.2 0.30 . 1 . . . . . . . . 5770 1 1084 . 1 1 89 89 PHE HB2 H 1 2.96 0.02 . 1 . . . . . . . . 5770 1 1085 . 1 1 89 89 PHE HB3 H 1 2.96 0.02 . 1 . . . . . . . . 5770 1 1086 . 1 1 89 89 PHE HD1 H 1 6.62 0.02 . 1 . . . . . . . . 5770 1 1087 . 1 1 89 89 PHE HD2 H 1 6.62 0.02 . 1 . . . . . . . . 5770 1 1088 . 1 1 89 89 PHE HE1 H 1 7.04 0.02 . 1 . . . . . . . . 5770 1 1089 . 1 1 89 89 PHE HE2 H 1 7.04 0.02 . 1 . . . . . . . . 5770 1 1090 . 1 1 89 89 PHE CD1 C 13 131.7 0.30 . 1 . . . . . . . . 5770 1 1091 . 1 1 89 89 PHE CE1 C 13 131.5 0.30 . 1 . . . . . . . . 5770 1 1092 . 1 1 89 89 PHE CZ C 13 131.5 0.30 . 1 . . . . . . . . 5770 1 1093 . 1 1 89 89 PHE HZ H 1 7.07 0.02 . 1 . . . . . . . . 5770 1 1094 . 1 1 89 89 PHE CE2 C 13 131.5 0.30 . 1 . . . . . . . . 5770 1 1095 . 1 1 89 89 PHE CD2 C 13 131.7 0.30 . 1 . . . . . . . . 5770 1 1096 . 1 1 89 89 PHE C C 13 177.1 0.30 . 1 . . . . . . . . 5770 1 1097 . 1 1 90 90 ARG N N 15 115.9 0.20 . 1 . . . . . . . . 5770 1 1098 . 1 1 90 90 ARG H H 1 7.78 0.02 . 1 . . . . . . . . 5770 1 1099 . 1 1 90 90 ARG CA C 13 59.1 0.30 . 1 . . . . . . . . 5770 1 1100 . 1 1 90 90 ARG HA H 1 3.97 0.02 . 1 . . . . . . . . 5770 1 1101 . 1 1 90 90 ARG CB C 13 30.3 0.30 . 1 . . . . . . . . 5770 1 1102 . 1 1 90 90 ARG HB2 H 1 2.03 0.02 . 1 . . . . . . . . 5770 1 1103 . 1 1 90 90 ARG HB3 H 1 2.03 0.02 . 1 . . . . . . . . 5770 1 1104 . 1 1 90 90 ARG CG C 13 27.7 0.30 . 1 . . . . . . . . 5770 1 1105 . 1 1 90 90 ARG HG2 H 1 1.91 0.02 . 2 . . . . . . . . 5770 1 1106 . 1 1 90 90 ARG HG3 H 1 1.75 0.02 . 2 . . . . . . . . 5770 1 1107 . 1 1 90 90 ARG CD C 13 43.5 0.30 . 1 . . . . . . . . 5770 1 1108 . 1 1 90 90 ARG HD2 H 1 3.25 0.02 . 1 . . . . . . . . 5770 1 1109 . 1 1 90 90 ARG HD3 H 1 3.25 0.02 . 1 . . . . . . . . 5770 1 1110 . 1 1 90 90 ARG C C 13 178.1 0.30 . 1 . . . . . . . . 5770 1 1111 . 1 1 91 91 VAL N N 15 114.8 0.20 . 1 . . . . . . . . 5770 1 1112 . 1 1 91 91 VAL H H 1 7.49 0.02 . 1 . . . . . . . . 5770 1 1113 . 1 1 91 91 VAL CA C 13 64.8 0.30 . 1 . . . . . . . . 5770 1 1114 . 1 1 91 91 VAL HA H 1 3.82 0.02 . 1 . . . . . . . . 5770 1 1115 . 1 1 91 91 VAL CB C 13 31.4 0.30 . 1 . . . . . . . . 5770 1 1116 . 1 1 91 91 VAL HB H 1 2.23 0.02 . 1 . . . . . . . . 5770 1 1117 . 1 1 91 91 VAL HG11 H 1 1.05 0.02 . 2 . . . . . . . . 5770 1 1118 . 1 1 91 91 VAL HG12 H 1 1.05 0.02 . 2 . . . . . . . . 5770 1 1119 . 1 1 91 91 VAL HG13 H 1 1.05 0.02 . 2 . . . . . . . . 5770 1 1120 . 1 1 91 91 VAL HG21 H 1 0.88 0.02 . 2 . . . . . . . . 5770 1 1121 . 1 1 91 91 VAL HG22 H 1 0.88 0.02 . 2 . . . . . . . . 5770 1 1122 . 1 1 91 91 VAL HG23 H 1 0.88 0.02 . 2 . . . . . . . . 5770 1 1123 . 1 1 91 91 VAL CG1 C 13 22.1 0.30 . 1 . . . . . . . . 5770 1 1124 . 1 1 91 91 VAL CG2 C 13 21.5 0.30 . 1 . . . . . . . . 5770 1 1125 . 1 1 91 91 VAL C C 13 177.2 0.30 . 1 . . . . . . . . 5770 1 1126 . 1 1 92 92 PHE N N 15 117.7 0.20 . 1 . . . . . . . . 5770 1 1127 . 1 1 92 92 PHE H H 1 7.56 0.02 . 1 . . . . . . . . 5770 1 1128 . 1 1 92 92 PHE CA C 13 59.6 0.30 . 1 . . . . . . . . 5770 1 1129 . 1 1 92 92 PHE HA H 1 4.26 0.02 . 1 . . . . . . . . 5770 1 1130 . 1 1 92 92 PHE CB C 13 40.8 0.30 . 1 . . . . . . . . 5770 1 1131 . 1 1 92 92 PHE HB2 H 1 2.84 0.02 . 2 . . . . . . . . 5770 1 1132 . 1 1 92 92 PHE HB3 H 1 2.75 0.02 . 2 . . . . . . . . 5770 1 1133 . 1 1 92 92 PHE HD1 H 1 7.39 0.02 . 1 . . . . . . . . 5770 1 1134 . 1 1 92 92 PHE HD2 H 1 7.39 0.02 . 1 . . . . . . . . 5770 1 1135 . 1 1 92 92 PHE HE1 H 1 7.46 0.02 . 1 . . . . . . . . 5770 1 1136 . 1 1 92 92 PHE HE2 H 1 7.46 0.02 . 1 . . . . . . . . 5770 1 1137 . 1 1 92 92 PHE CD1 C 13 130.9 0.30 . 1 . . . . . . . . 5770 1 1138 . 1 1 92 92 PHE CE1 C 13 132.1 0.30 . 1 . . . . . . . . 5770 1 1139 . 1 1 92 92 PHE CZ C 13 128.6 0.30 . 1 . . . . . . . . 5770 1 1140 . 1 1 92 92 PHE HZ H 1 7.59 0.02 . 1 . . . . . . . . 5770 1 1141 . 1 1 92 92 PHE CE2 C 13 132.1 0.30 . 1 . . . . . . . . 5770 1 1142 . 1 1 92 92 PHE CD2 C 13 130.9 0.30 . 1 . . . . . . . . 5770 1 1143 . 1 1 92 92 PHE C C 13 176.5 0.30 . 1 . . . . . . . . 5770 1 1144 . 1 1 93 93 ASP N N 15 117.1 0.20 . 1 . . . . . . . . 5770 1 1145 . 1 1 93 93 ASP H H 1 7.72 0.02 . 1 . . . . . . . . 5770 1 1146 . 1 1 93 93 ASP CA C 13 52.3 0.30 . 1 . . . . . . . . 5770 1 1147 . 1 1 93 93 ASP HA H 1 4.60 0.02 . 1 . . . . . . . . 5770 1 1148 . 1 1 93 93 ASP CB C 13 38.8 0.30 . 1 . . . . . . . . 5770 1 1149 . 1 1 93 93 ASP HB2 H 1 2.39 0.02 . 2 . . . . . . . . 5770 1 1150 . 1 1 93 93 ASP HB3 H 1 1.47 0.02 . 2 . . . . . . . . 5770 1 1151 . 1 1 93 93 ASP C C 13 177.2 0.30 . 1 . . . . . . . . 5770 1 1152 . 1 1 94 94 LYS N N 15 126.0 0.20 . 1 . . . . . . . . 5770 1 1153 . 1 1 94 94 LYS H H 1 7.57 0.02 . 1 . . . . . . . . 5770 1 1154 . 1 1 94 94 LYS CA C 13 58.9 0.30 . 1 . . . . . . . . 5770 1 1155 . 1 1 94 94 LYS HA H 1 3.98 0.02 . 1 . . . . . . . . 5770 1 1156 . 1 1 94 94 LYS CB C 13 32.8 0.30 . 1 . . . . . . . . 5770 1 1157 . 1 1 94 94 LYS HB2 H 1 1.90 0.02 . 1 . . . . . . . . 5770 1 1158 . 1 1 94 94 LYS HB3 H 1 1.90 0.02 . 1 . . . . . . . . 5770 1 1159 . 1 1 94 94 LYS CG C 13 24.2 0.30 . 1 . . . . . . . . 5770 1 1160 . 1 1 94 94 LYS HG2 H 1 1.48 0.02 . 1 . . . . . . . . 5770 1 1161 . 1 1 94 94 LYS HG3 H 1 1.48 0.02 . 1 . . . . . . . . 5770 1 1162 . 1 1 94 94 LYS CD C 13 28.4 0.30 . 1 . . . . . . . . 5770 1 1163 . 1 1 94 94 LYS HD2 H 1 1.59 0.02 . 2 . . . . . . . . 5770 1 1164 . 1 1 94 94 LYS HD3 H 1 1.50 0.02 . 2 . . . . . . . . 5770 1 1165 . 1 1 94 94 LYS CE C 13 41.8 0.30 . 1 . . . . . . . . 5770 1 1166 . 1 1 94 94 LYS HE2 H 1 2.85 0.02 . 2 . . . . . . . . 5770 1 1167 . 1 1 94 94 LYS HE3 H 1 2.80 0.02 . 2 . . . . . . . . 5770 1 1168 . 1 1 94 94 LYS C C 13 178.3 0.30 . 1 . . . . . . . . 5770 1 1169 . 1 1 95 95 ASP N N 15 114.3 0.20 . 1 . . . . . . . . 5770 1 1170 . 1 1 95 95 ASP H H 1 8.32 0.02 . 1 . . . . . . . . 5770 1 1171 . 1 1 95 95 ASP CA C 13 53.0 0.30 . 1 . . . . . . . . 5770 1 1172 . 1 1 95 95 ASP HA H 1 4.59 0.02 . 1 . . . . . . . . 5770 1 1173 . 1 1 95 95 ASP CB C 13 39.7 0.30 . 1 . . . . . . . . 5770 1 1174 . 1 1 95 95 ASP HB2 H 1 3.11 0.02 . 2 . . . . . . . . 5770 1 1175 . 1 1 95 95 ASP HB3 H 1 2.68 0.02 . 2 . . . . . . . . 5770 1 1176 . 1 1 95 95 ASP C C 13 177.7 0.30 . 1 . . . . . . . . 5770 1 1177 . 1 1 96 96 GLY N N 15 109.5 0.20 . 1 . . . . . . . . 5770 1 1178 . 1 1 96 96 GLY H H 1 7.85 0.02 . 1 . . . . . . . . 5770 1 1179 . 1 1 96 96 GLY CA C 13 47.1 0.30 . 1 . . . . . . . . 5770 1 1180 . 1 1 96 96 GLY HA2 H 1 4.05 0.02 . 2 . . . . . . . . 5770 1 1181 . 1 1 96 96 GLY HA3 H 1 3.89 0.02 . 2 . . . . . . . . 5770 1 1182 . 1 1 96 96 GLY C C 13 175.2 0.30 . 1 . . . . . . . . 5770 1 1183 . 1 1 97 97 ASN N N 15 119.7 0.20 . 1 . . . . . . . . 5770 1 1184 . 1 1 97 97 ASN H H 1 8.43 0.02 . 1 . . . . . . . . 5770 1 1185 . 1 1 97 97 ASN CA C 13 52.6 0.30 . 1 . . . . . . . . 5770 1 1186 . 1 1 97 97 ASN HA H 1 4.68 0.02 . 1 . . . . . . . . 5770 1 1187 . 1 1 97 97 ASN CB C 13 37.8 0.30 . 1 . . . . . . . . 5770 1 1188 . 1 1 97 97 ASN HB2 H 1 3.35 0.02 . 2 . . . . . . . . 5770 1 1189 . 1 1 97 97 ASN HB3 H 1 2.69 0.02 . 2 . . . . . . . . 5770 1 1190 . 1 1 97 97 ASN CG C 13 179.9 0.30 . 1 . . . . . . . . 5770 1 1191 . 1 1 97 97 ASN ND2 N 15 116.7 0.20 . 1 . . . . . . . . 5770 1 1192 . 1 1 97 97 ASN HD21 H 1 8.07 0.02 . 2 . . . . . . . . 5770 1 1193 . 1 1 97 97 ASN HD22 H 1 7.39 0.02 . 2 . . . . . . . . 5770 1 1194 . 1 1 97 97 ASN C C 13 176.0 0.30 . 1 . . . . . . . . 5770 1 1195 . 1 1 98 98 GLY N N 15 112.6 0.20 . 1 . . . . . . . . 5770 1 1196 . 1 1 98 98 GLY H H 1 10.68 0.02 . 1 . . . . . . . . 5770 1 1197 . 1 1 98 98 GLY CA C 13 45.0 0.30 . 1 . . . . . . . . 5770 1 1198 . 1 1 98 98 GLY HA2 H 1 4.12 0.02 . 2 . . . . . . . . 5770 1 1199 . 1 1 98 98 GLY HA3 H 1 3.50 0.02 . 2 . . . . . . . . 5770 1 1200 . 1 1 98 98 GLY C C 13 172.7 0.30 . 1 . . . . . . . . 5770 1 1201 . 1 1 99 99 TYR N N 15 116.0 0.20 . 1 . . . . . . . . 5770 1 1202 . 1 1 99 99 TYR H H 1 7.70 0.02 . 1 . . . . . . . . 5770 1 1203 . 1 1 99 99 TYR CA C 13 56.0 0.30 . 1 . . . . . . . . 5770 1 1204 . 1 1 99 99 TYR HA H 1 5.18 0.02 . 1 . . . . . . . . 5770 1 1205 . 1 1 99 99 TYR CB C 13 43.1 0.30 . 1 . . . . . . . . 5770 1 1206 . 1 1 99 99 TYR HB2 H 1 2.57 0.02 . 1 . . . . . . . . 5770 1 1207 . 1 1 99 99 TYR HB3 H 1 2.57 0.02 . 1 . . . . . . . . 5770 1 1208 . 1 1 99 99 TYR HD1 H 1 6.82 0.02 . 1 . . . . . . . . 5770 1 1209 . 1 1 99 99 TYR HD2 H 1 6.82 0.02 . 1 . . . . . . . . 5770 1 1210 . 1 1 99 99 TYR HE1 H 1 7.00 0.02 . 1 . . . . . . . . 5770 1 1211 . 1 1 99 99 TYR HE2 H 1 7.00 0.02 . 1 . . . . . . . . 5770 1 1212 . 1 1 99 99 TYR CD1 C 13 133.7 0.30 . 1 . . . . . . . . 5770 1 1213 . 1 1 99 99 TYR CE1 C 13 118.3 0.30 . 1 . . . . . . . . 5770 1 1214 . 1 1 99 99 TYR CE2 C 13 118.3 0.30 . 1 . . . . . . . . 5770 1 1215 . 1 1 99 99 TYR CD2 C 13 133.7 0.30 . 1 . . . . . . . . 5770 1 1216 . 1 1 99 99 TYR C C 13 174.9 0.30 . 1 . . . . . . . . 5770 1 1217 . 1 1 100 100 ILE N N 15 127.1 0.20 . 1 . . . . . . . . 5770 1 1218 . 1 1 100 100 ILE H H 1 10.28 0.02 . 1 . . . . . . . . 5770 1 1219 . 1 1 100 100 ILE CA C 13 61.4 0.30 . 1 . . . . . . . . 5770 1 1220 . 1 1 100 100 ILE HA H 1 4.75 0.02 . 1 . . . . . . . . 5770 1 1221 . 1 1 100 100 ILE CB C 13 39.7 0.30 . 1 . . . . . . . . 5770 1 1222 . 1 1 100 100 ILE HB H 1 1.97 0.02 . 1 . . . . . . . . 5770 1 1223 . 1 1 100 100 ILE HG21 H 1 1.11 0.02 . 1 . . . . . . . . 5770 1 1224 . 1 1 100 100 ILE HG22 H 1 1.11 0.02 . 1 . . . . . . . . 5770 1 1225 . 1 1 100 100 ILE HG23 H 1 1.11 0.02 . 1 . . . . . . . . 5770 1 1226 . 1 1 100 100 ILE CG2 C 13 17.4 0.30 . 1 . . . . . . . . 5770 1 1227 . 1 1 100 100 ILE CG1 C 13 27.0 0.30 . 1 . . . . . . . . 5770 1 1228 . 1 1 100 100 ILE HG12 H 1 1.38 0.02 . 2 . . . . . . . . 5770 1 1229 . 1 1 100 100 ILE HG13 H 1 0.27 0.02 . 2 . . . . . . . . 5770 1 1230 . 1 1 100 100 ILE HD11 H 1 0.50 0.02 . 1 . . . . . . . . 5770 1 1231 . 1 1 100 100 ILE HD12 H 1 0.50 0.02 . 1 . . . . . . . . 5770 1 1232 . 1 1 100 100 ILE HD13 H 1 0.50 0.02 . 1 . . . . . . . . 5770 1 1233 . 1 1 100 100 ILE CD1 C 13 16.1 0.30 . 1 . . . . . . . . 5770 1 1234 . 1 1 100 100 ILE C C 13 175.5 0.30 . 1 . . . . . . . . 5770 1 1235 . 1 1 101 101 SER N N 15 123.4 0.20 . 1 . . . . . . . . 5770 1 1236 . 1 1 101 101 SER H H 1 8.93 0.02 . 1 . . . . . . . . 5770 1 1237 . 1 1 101 101 SER CA C 13 55.6 0.30 . 1 . . . . . . . . 5770 1 1238 . 1 1 101 101 SER HA H 1 5.03 0.02 . 1 . . . . . . . . 5770 1 1239 . 1 1 101 101 SER CB C 13 67.0 0.30 . 1 . . . . . . . . 5770 1 1240 . 1 1 101 101 SER HB2 H 1 4.51 0.02 . 2 . . . . . . . . 5770 1 1241 . 1 1 101 101 SER HB3 H 1 4.04 0.02 . 2 . . . . . . . . 5770 1 1242 . 1 1 101 101 SER C C 13 175.5 0.30 . 1 . . . . . . . . 5770 1 1243 . 1 1 102 102 ALA N N 15 123.1 0.20 . 1 . . . . . . . . 5770 1 1244 . 1 1 102 102 ALA H H 1 9.33 0.02 . 1 . . . . . . . . 5770 1 1245 . 1 1 102 102 ALA CA C 13 55.9 0.30 . 1 . . . . . . . . 5770 1 1246 . 1 1 102 102 ALA HA H 1 3.92 0.02 . 1 . . . . . . . . 5770 1 1247 . 1 1 102 102 ALA HB1 H 1 1.52 0.02 . 1 . . . . . . . . 5770 1 1248 . 1 1 102 102 ALA HB2 H 1 1.52 0.02 . 1 . . . . . . . . 5770 1 1249 . 1 1 102 102 ALA HB3 H 1 1.52 0.02 . 1 . . . . . . . . 5770 1 1250 . 1 1 102 102 ALA CB C 13 18.0 0.30 . 1 . . . . . . . . 5770 1 1251 . 1 1 102 102 ALA C C 13 179.9 0.30 . 1 . . . . . . . . 5770 1 1252 . 1 1 103 103 ALA N N 15 118.3 0.20 . 1 . . . . . . . . 5770 1 1253 . 1 1 103 103 ALA H H 1 8.28 0.02 . 1 . . . . . . . . 5770 1 1254 . 1 1 103 103 ALA CA C 13 55.3 0.30 . 1 . . . . . . . . 5770 1 1255 . 1 1 103 103 ALA HA H 1 4.04 0.02 . 1 . . . . . . . . 5770 1 1256 . 1 1 103 103 ALA HB1 H 1 1.45 0.02 . 1 . . . . . . . . 5770 1 1257 . 1 1 103 103 ALA HB2 H 1 1.45 0.02 . 1 . . . . . . . . 5770 1 1258 . 1 1 103 103 ALA HB3 H 1 1.45 0.02 . 1 . . . . . . . . 5770 1 1259 . 1 1 103 103 ALA CB C 13 18.3 0.30 . 1 . . . . . . . . 5770 1 1260 . 1 1 103 103 ALA C C 13 181.3 0.30 . 1 . . . . . . . . 5770 1 1261 . 1 1 104 104 GLU N N 15 120.2 0.20 . 1 . . . . . . . . 5770 1 1262 . 1 1 104 104 GLU H H 1 7.93 0.02 . 1 . . . . . . . . 5770 1 1263 . 1 1 104 104 GLU CA C 13 59.4 0.30 . 1 . . . . . . . . 5770 1 1264 . 1 1 104 104 GLU HA H 1 4.05 0.02 . 1 . . . . . . . . 5770 1 1265 . 1 1 104 104 GLU CB C 13 28.9 0.30 . 1 . . . . . . . . 5770 1 1266 . 1 1 104 104 GLU HB2 H 1 2.61 0.02 . 1 . . . . . . . . 5770 1 1267 . 1 1 104 104 GLU HB3 H 1 2.61 0.02 . 1 . . . . . . . . 5770 1 1268 . 1 1 104 104 GLU CG C 13 38.3 0.30 . 1 . . . . . . . . 5770 1 1269 . 1 1 104 104 GLU HG2 H 1 2.61 0.02 . 2 . . . . . . . . 5770 1 1270 . 1 1 104 104 GLU HG3 H 1 2.38 0.02 . 2 . . . . . . . . 5770 1 1271 . 1 1 104 104 GLU C C 13 179.5 0.30 . 1 . . . . . . . . 5770 1 1272 . 1 1 105 105 LEU N N 15 121.8 0.20 . 1 . . . . . . . . 5770 1 1273 . 1 1 105 105 LEU H H 1 8.35 0.02 . 1 . . . . . . . . 5770 1 1274 . 1 1 105 105 LEU CA C 13 58.1 0.30 . 1 . . . . . . . . 5770 1 1275 . 1 1 105 105 LEU HA H 1 4.13 0.02 . 1 . . . . . . . . 5770 1 1276 . 1 1 105 105 LEU CB C 13 41.8 0.30 . 1 . . . . . . . . 5770 1 1277 . 1 1 105 105 LEU HB2 H 1 1.83 0.02 . 2 . . . . . . . . 5770 1 1278 . 1 1 105 105 LEU HB3 H 1 1.28 0.02 . 2 . . . . . . . . 5770 1 1279 . 1 1 105 105 LEU CG C 13 26.8 0.30 . 1 . . . . . . . . 5770 1 1280 . 1 1 105 105 LEU HG H 1 1.32 0.02 . 1 . . . . . . . . 5770 1 1281 . 1 1 105 105 LEU HD11 H 1 0.34 0.02 . 2 . . . . . . . . 5770 1 1282 . 1 1 105 105 LEU HD12 H 1 0.34 0.02 . 2 . . . . . . . . 5770 1 1283 . 1 1 105 105 LEU HD13 H 1 0.34 0.02 . 2 . . . . . . . . 5770 1 1284 . 1 1 105 105 LEU HD21 H 1 0.50 0.02 . 2 . . . . . . . . 5770 1 1285 . 1 1 105 105 LEU HD22 H 1 0.50 0.02 . 2 . . . . . . . . 5770 1 1286 . 1 1 105 105 LEU HD23 H 1 0.50 0.02 . 2 . . . . . . . . 5770 1 1287 . 1 1 105 105 LEU CD1 C 13 25.5 0.30 . 1 . . . . . . . . 5770 1 1288 . 1 1 105 105 LEU CD2 C 13 23.5 0.30 . 1 . . . . . . . . 5770 1 1289 . 1 1 105 105 LEU C C 13 178.3 0.30 . 1 . . . . . . . . 5770 1 1290 . 1 1 106 106 ARG N N 15 118.6 0.20 . 1 . . . . . . . . 5770 1 1291 . 1 1 106 106 ARG H H 1 8.79 0.02 . 1 . . . . . . . . 5770 1 1292 . 1 1 106 106 ARG CA C 13 60.0 0.30 . 1 . . . . . . . . 5770 1 1293 . 1 1 106 106 ARG HA H 1 3.80 0.02 . 1 . . . . . . . . 5770 1 1294 . 1 1 106 106 ARG CB C 13 30.3 0.30 . 1 . . . . . . . . 5770 1 1295 . 1 1 106 106 ARG HB2 H 1 1.99 0.02 . 1 . . . . . . . . 5770 1 1296 . 1 1 106 106 ARG HB3 H 1 1.99 0.02 . 1 . . . . . . . . 5770 1 1297 . 1 1 106 106 ARG CG C 13 28.1 0.30 . 1 . . . . . . . . 5770 1 1298 . 1 1 106 106 ARG HG2 H 1 1.73 0.02 . 2 . . . . . . . . 5770 1 1299 . 1 1 106 106 ARG HG3 H 1 1.63 0.02 . 2 . . . . . . . . 5770 1 1300 . 1 1 106 106 ARG CD C 13 43.5 0.30 . 1 . . . . . . . . 5770 1 1301 . 1 1 106 106 ARG HD2 H 1 3.29 0.02 . 2 . . . . . . . . 5770 1 1302 . 1 1 106 106 ARG HD3 H 1 3.17 0.02 . 2 . . . . . . . . 5770 1 1303 . 1 1 106 106 ARG C C 13 178.7 0.30 . 1 . . . . . . . . 5770 1 1304 . 1 1 107 107 HIS N N 15 119.7 0.20 . 1 . . . . . . . . 5770 1 1305 . 1 1 107 107 HIS H H 1 8.06 0.02 . 1 . . . . . . . . 5770 1 1306 . 1 1 107 107 HIS CA C 13 59.6 0.30 . 1 . . . . . . . . 5770 1 1307 . 1 1 107 107 HIS HA H 1 4.33 0.02 . 1 . . . . . . . . 5770 1 1308 . 1 1 107 107 HIS CB C 13 30.0 0.30 . 1 . . . . . . . . 5770 1 1309 . 1 1 107 107 HIS HB2 H 1 3.43 0.02 . 2 . . . . . . . . 5770 1 1310 . 1 1 107 107 HIS HB3 H 1 3.33 0.02 . 2 . . . . . . . . 5770 1 1311 . 1 1 107 107 HIS CD2 C 13 118.5 0.30 . 1 . . . . . . . . 5770 1 1312 . 1 1 107 107 HIS CE1 C 13 138.8 0.30 . 1 . . . . . . . . 5770 1 1313 . 1 1 107 107 HIS HD2 H 1 6.98 0.02 . 1 . . . . . . . . 5770 1 1314 . 1 1 107 107 HIS HE1 H 1 7.88 0.02 . 1 . . . . . . . . 5770 1 1315 . 1 1 107 107 HIS C C 13 177.6 0.30 . 1 . . . . . . . . 5770 1 1316 . 1 1 108 108 VAL N N 15 119.4 0.20 . 1 . . . . . . . . 5770 1 1317 . 1 1 108 108 VAL H H 1 7.90 0.02 . 1 . . . . . . . . 5770 1 1318 . 1 1 108 108 VAL CA C 13 66.7 0.30 . 1 . . . . . . . . 5770 1 1319 . 1 1 108 108 VAL HA H 1 3.58 0.02 . 1 . . . . . . . . 5770 1 1320 . 1 1 108 108 VAL CB C 13 31.7 0.30 . 1 . . . . . . . . 5770 1 1321 . 1 1 108 108 VAL HB H 1 2.20 0.02 . 1 . . . . . . . . 5770 1 1322 . 1 1 108 108 VAL HG11 H 1 0.99 0.02 . 2 . . . . . . . . 5770 1 1323 . 1 1 108 108 VAL HG12 H 1 0.99 0.02 . 2 . . . . . . . . 5770 1 1324 . 1 1 108 108 VAL HG13 H 1 0.99 0.02 . 2 . . . . . . . . 5770 1 1325 . 1 1 108 108 VAL HG21 H 1 0.69 0.02 . 2 . . . . . . . . 5770 1 1326 . 1 1 108 108 VAL HG22 H 1 0.69 0.02 . 2 . . . . . . . . 5770 1 1327 . 1 1 108 108 VAL HG23 H 1 0.69 0.02 . 2 . . . . . . . . 5770 1 1328 . 1 1 108 108 VAL CG1 C 13 23.0 0.30 . 1 . . . . . . . . 5770 1 1329 . 1 1 108 108 VAL CG2 C 13 21.4 0.30 . 1 . . . . . . . . 5770 1 1330 . 1 1 108 108 VAL C C 13 178.1 0.30 . 1 . . . . . . . . 5770 1 1331 . 1 1 109 109 MET N N 15 116.5 0.20 . 1 . . . . . . . . 5770 1 1332 . 1 1 109 109 MET H H 1 8.25 0.02 . 1 . . . . . . . . 5770 1 1333 . 1 1 109 109 MET CA C 13 59.2 0.30 . 1 . . . . . . . . 5770 1 1334 . 1 1 109 109 MET HA H 1 3.94 0.02 . 1 . . . . . . . . 5770 1 1335 . 1 1 109 109 MET CB C 13 31.9 0.30 . 1 . . . . . . . . 5770 1 1336 . 1 1 109 109 MET HB2 H 1 2.13 0.02 . 2 . . . . . . . . 5770 1 1337 . 1 1 109 109 MET HB3 H 1 2.05 0.02 . 2 . . . . . . . . 5770 1 1338 . 1 1 109 109 MET CG C 13 33.3 0.30 . 1 . . . . . . . . 5770 1 1339 . 1 1 109 109 MET HG2 H 1 2.58 0.02 . 2 . . . . . . . . 5770 1 1340 . 1 1 109 109 MET HG3 H 1 2.44 0.02 . 2 . . . . . . . . 5770 1 1341 . 1 1 109 109 MET HE1 H 1 1.88 0.02 . 1 . . . . . . . . 5770 1 1342 . 1 1 109 109 MET HE2 H 1 1.88 0.02 . 1 . . . . . . . . 5770 1 1343 . 1 1 109 109 MET HE3 H 1 1.88 0.02 . 1 . . . . . . . . 5770 1 1344 . 1 1 109 109 MET CE C 13 17.9 0.30 . 1 . . . . . . . . 5770 1 1345 . 1 1 109 109 MET C C 13 178.6 0.30 . 1 . . . . . . . . 5770 1 1346 . 1 1 110 110 THR N N 15 115.7 0.20 . 1 . . . . . . . . 5770 1 1347 . 1 1 110 110 THR H H 1 8.50 0.02 . 1 . . . . . . . . 5770 1 1348 . 1 1 110 110 THR CA C 13 66.5 0.30 . 1 . . . . . . . . 5770 1 1349 . 1 1 110 110 THR HA H 1 4.07 0.02 . 1 . . . . . . . . 5770 1 1350 . 1 1 110 110 THR CB C 13 68.8 0.30 . 1 . . . . . . . . 5770 1 1351 . 1 1 110 110 THR HB H 1 4.28 0.02 . 1 . . . . . . . . 5770 1 1352 . 1 1 110 110 THR HG21 H 1 1.28 0.02 . 1 . . . . . . . . 5770 1 1353 . 1 1 110 110 THR HG22 H 1 1.28 0.02 . 1 . . . . . . . . 5770 1 1354 . 1 1 110 110 THR HG23 H 1 1.28 0.02 . 1 . . . . . . . . 5770 1 1355 . 1 1 110 110 THR CG2 C 13 21.8 0.30 . 1 . . . . . . . . 5770 1 1356 . 1 1 110 110 THR C C 13 178.1 0.30 . 1 . . . . . . . . 5770 1 1357 . 1 1 111 111 ASN N N 15 122.5 0.20 . 1 . . . . . . . . 5770 1 1358 . 1 1 111 111 ASN H H 1 7.98 0.02 . 1 . . . . . . . . 5770 1 1359 . 1 1 111 111 ASN CA C 13 56.0 0.30 . 1 . . . . . . . . 5770 1 1360 . 1 1 111 111 ASN HA H 1 4.46 0.02 . 1 . . . . . . . . 5770 1 1361 . 1 1 111 111 ASN CB C 13 38.3 0.30 . 1 . . . . . . . . 5770 1 1362 . 1 1 111 111 ASN HB2 H 1 2.84 0.02 . 1 . . . . . . . . 5770 1 1363 . 1 1 111 111 ASN HB3 H 1 2.84 0.02 . 1 . . . . . . . . 5770 1 1364 . 1 1 111 111 ASN CG C 13 176.3 0.30 . 1 . . . . . . . . 5770 1 1365 . 1 1 111 111 ASN ND2 N 15 111.9 0.20 . 1 . . . . . . . . 5770 1 1366 . 1 1 111 111 ASN HD21 H 1 7.53 0.02 . 2 . . . . . . . . 5770 1 1367 . 1 1 111 111 ASN HD22 H 1 6.53 0.02 . 2 . . . . . . . . 5770 1 1368 . 1 1 111 111 ASN C C 13 176.7 0.30 . 1 . . . . . . . . 5770 1 1369 . 1 1 112 112 LEU N N 15 117.6 0.20 . 1 . . . . . . . . 5770 1 1370 . 1 1 112 112 LEU H H 1 7.63 0.02 . 1 . . . . . . . . 5770 1 1371 . 1 1 112 112 LEU CA C 13 55.0 0.30 . 1 . . . . . . . . 5770 1 1372 . 1 1 112 112 LEU HA H 1 4.38 0.02 . 1 . . . . . . . . 5770 1 1373 . 1 1 112 112 LEU CB C 13 43.0 0.30 . 1 . . . . . . . . 5770 1 1374 . 1 1 112 112 LEU HB2 H 1 1.85 0.02 . 2 . . . . . . . . 5770 1 1375 . 1 1 112 112 LEU HB3 H 1 1.77 0.02 . 2 . . . . . . . . 5770 1 1376 . 1 1 112 112 LEU CG C 13 26.4 0.30 . 1 . . . . . . . . 5770 1 1377 . 1 1 112 112 LEU HG H 1 1.92 0.02 . 1 . . . . . . . . 5770 1 1378 . 1 1 112 112 LEU HD11 H 1 0.85 0.02 . 2 . . . . . . . . 5770 1 1379 . 1 1 112 112 LEU HD12 H 1 0.85 0.02 . 2 . . . . . . . . 5770 1 1380 . 1 1 112 112 LEU HD13 H 1 0.85 0.02 . 2 . . . . . . . . 5770 1 1381 . 1 1 112 112 LEU HD21 H 1 0.97 0.02 . 2 . . . . . . . . 5770 1 1382 . 1 1 112 112 LEU HD22 H 1 0.97 0.02 . 2 . . . . . . . . 5770 1 1383 . 1 1 112 112 LEU HD23 H 1 0.97 0.02 . 2 . . . . . . . . 5770 1 1384 . 1 1 112 112 LEU CD1 C 13 26.6 0.30 . 1 . . . . . . . . 5770 1 1385 . 1 1 112 112 LEU CD2 C 13 22.6 0.30 . 1 . . . . . . . . 5770 1 1386 . 1 1 112 112 LEU C C 13 177.5 0.30 . 1 . . . . . . . . 5770 1 1387 . 1 1 113 113 GLY N N 15 107.6 0.20 . 1 . . . . . . . . 5770 1 1388 . 1 1 113 113 GLY H H 1 7.85 0.02 . 1 . . . . . . . . 5770 1 1389 . 1 1 113 113 GLY CA C 13 45.8 0.30 . 1 . . . . . . . . 5770 1 1390 . 1 1 113 113 GLY HA2 H 1 4.20 0.02 . 2 . . . . . . . . 5770 1 1391 . 1 1 113 113 GLY HA3 H 1 3.82 0.02 . 2 . . . . . . . . 5770 1 1392 . 1 1 113 113 GLY C C 13 174.8 0.30 . 1 . . . . . . . . 5770 1 1393 . 1 1 114 114 GLU N N 15 119.7 0.20 . 1 . . . . . . . . 5770 1 1394 . 1 1 114 114 GLU H H 1 7.79 0.02 . 1 . . . . . . . . 5770 1 1395 . 1 1 114 114 GLU CA C 13 55.7 0.30 . 1 . . . . . . . . 5770 1 1396 . 1 1 114 114 GLU HA H 1 4.28 0.02 . 1 . . . . . . . . 5770 1 1397 . 1 1 114 114 GLU CB C 13 31.0 0.30 . 1 . . . . . . . . 5770 1 1398 . 1 1 114 114 GLU HB2 H 1 2.02 0.02 . 2 . . . . . . . . 5770 1 1399 . 1 1 114 114 GLU HB3 H 1 1.72 0.02 . 2 . . . . . . . . 5770 1 1400 . 1 1 114 114 GLU CG C 13 35.8 0.30 . 1 . . . . . . . . 5770 1 1401 . 1 1 114 114 GLU HG2 H 1 2.18 0.02 . 2 . . . . . . . . 5770 1 1402 . 1 1 114 114 GLU HG3 H 1 2.06 0.02 . 2 . . . . . . . . 5770 1 1403 . 1 1 114 114 GLU C C 13 175.8 0.30 . 1 . . . . . . . . 5770 1 1404 . 1 1 115 115 LYS N N 15 123.5 0.20 . 1 . . . . . . . . 5770 1 1405 . 1 1 115 115 LYS H H 1 8.54 0.02 . 1 . . . . . . . . 5770 1 1406 . 1 1 115 115 LYS CA C 13 55.6 0.30 . 1 . . . . . . . . 5770 1 1407 . 1 1 115 115 LYS HA H 1 4.41 0.02 . 1 . . . . . . . . 5770 1 1408 . 1 1 115 115 LYS CB C 13 32.4 0.30 . 1 . . . . . . . . 5770 1 1409 . 1 1 115 115 LYS HB2 H 1 1.83 0.02 . 2 . . . . . . . . 5770 1 1410 . 1 1 115 115 LYS HB3 H 1 1.67 0.02 . 2 . . . . . . . . 5770 1 1411 . 1 1 115 115 LYS CG C 13 24.6 0.30 . 1 . . . . . . . . 5770 1 1412 . 1 1 115 115 LYS HG2 H 1 1.43 0.02 . 2 . . . . . . . . 5770 1 1413 . 1 1 115 115 LYS HG3 H 1 1.35 0.02 . 2 . . . . . . . . 5770 1 1414 . 1 1 115 115 LYS CD C 13 29.0 0.30 . 1 . . . . . . . . 5770 1 1415 . 1 1 115 115 LYS HD2 H 1 1.67 0.02 . 1 . . . . . . . . 5770 1 1416 . 1 1 115 115 LYS HD3 H 1 1.67 0.02 . 1 . . . . . . . . 5770 1 1417 . 1 1 115 115 LYS CE C 13 42.3 0.30 . 1 . . . . . . . . 5770 1 1418 . 1 1 115 115 LYS HE2 H 1 3.00 0.02 . 1 . . . . . . . . 5770 1 1419 . 1 1 115 115 LYS HE3 H 1 3.00 0.02 . 1 . . . . . . . . 5770 1 1420 . 1 1 115 115 LYS C C 13 175.5 0.30 . 1 . . . . . . . . 5770 1 1421 . 1 1 116 116 LEU N N 15 124.2 0.20 . 1 . . . . . . . . 5770 1 1422 . 1 1 116 116 LEU H H 1 7.89 0.02 . 1 . . . . . . . . 5770 1 1423 . 1 1 116 116 LEU CA C 13 54.5 0.30 . 1 . . . . . . . . 5770 1 1424 . 1 1 116 116 LEU HA H 1 4.74 0.02 . 1 . . . . . . . . 5770 1 1425 . 1 1 116 116 LEU CB C 13 44.0 0.30 . 1 . . . . . . . . 5770 1 1426 . 1 1 116 116 LEU HB2 H 1 1.67 0.02 . 2 . . . . . . . . 5770 1 1427 . 1 1 116 116 LEU HB3 H 1 1.48 0.02 . 2 . . . . . . . . 5770 1 1428 . 1 1 116 116 LEU CG C 13 27.6 0.30 . 1 . . . . . . . . 5770 1 1429 . 1 1 116 116 LEU HG H 1 1.63 0.02 . 1 . . . . . . . . 5770 1 1430 . 1 1 116 116 LEU HD11 H 1 0.81 0.02 . 2 . . . . . . . . 5770 1 1431 . 1 1 116 116 LEU HD12 H 1 0.81 0.02 . 2 . . . . . . . . 5770 1 1432 . 1 1 116 116 LEU HD13 H 1 0.81 0.02 . 2 . . . . . . . . 5770 1 1433 . 1 1 116 116 LEU HD21 H 1 0.78 0.02 . 2 . . . . . . . . 5770 1 1434 . 1 1 116 116 LEU HD22 H 1 0.78 0.02 . 2 . . . . . . . . 5770 1 1435 . 1 1 116 116 LEU HD23 H 1 0.78 0.02 . 2 . . . . . . . . 5770 1 1436 . 1 1 116 116 LEU CD1 C 13 25.1 0.30 . 1 . . . . . . . . 5770 1 1437 . 1 1 116 116 LEU CD2 C 13 26.2 0.30 . 1 . . . . . . . . 5770 1 1438 . 1 1 116 116 LEU C C 13 177.4 0.30 . 1 . . . . . . . . 5770 1 1439 . 1 1 117 117 THR N N 15 113.2 0.20 . 1 . . . . . . . . 5770 1 1440 . 1 1 117 117 THR H H 1 8.71 0.02 . 1 . . . . . . . . 5770 1 1441 . 1 1 117 117 THR CA C 13 60.9 0.30 . 1 . . . . . . . . 5770 1 1442 . 1 1 117 117 THR HA H 1 4.50 0.02 . 1 . . . . . . . . 5770 1 1443 . 1 1 117 117 THR CB C 13 71.3 0.30 . 1 . . . . . . . . 5770 1 1444 . 1 1 117 117 THR HB H 1 4.70 0.02 . 1 . . . . . . . . 5770 1 1445 . 1 1 117 117 THR HG21 H 1 1.33 0.02 . 1 . . . . . . . . 5770 1 1446 . 1 1 117 117 THR HG22 H 1 1.33 0.02 . 1 . . . . . . . . 5770 1 1447 . 1 1 117 117 THR HG23 H 1 1.33 0.02 . 1 . . . . . . . . 5770 1 1448 . 1 1 117 117 THR CG2 C 13 21.9 0.30 . 1 . . . . . . . . 5770 1 1449 . 1 1 117 117 THR C C 13 175.5 0.30 . 1 . . . . . . . . 5770 1 1450 . 1 1 118 118 ASP N N 15 121.6 0.20 . 1 . . . . . . . . 5770 1 1451 . 1 1 118 118 ASP H H 1 8.87 0.02 . 1 . . . . . . . . 5770 1 1452 . 1 1 118 118 ASP CA C 13 58.0 0.30 . 1 . . . . . . . . 5770 1 1453 . 1 1 118 118 ASP HA H 1 4.25 0.02 . 1 . . . . . . . . 5770 1 1454 . 1 1 118 118 ASP CB C 13 39.8 0.30 . 1 . . . . . . . . 5770 1 1455 . 1 1 118 118 ASP HB2 H 1 2.75 0.02 . 2 . . . . . . . . 5770 1 1456 . 1 1 118 118 ASP HB3 H 1 2.60 0.02 . 2 . . . . . . . . 5770 1 1457 . 1 1 118 118 ASP C C 13 178.5 0.30 . 1 . . . . . . . . 5770 1 1458 . 1 1 119 119 GLU N N 15 119.0 0.20 . 1 . . . . . . . . 5770 1 1459 . 1 1 119 119 GLU H H 1 8.73 0.02 . 1 . . . . . . . . 5770 1 1460 . 1 1 119 119 GLU CA C 13 59.7 0.30 . 1 . . . . . . . . 5770 1 1461 . 1 1 119 119 GLU HA H 1 4.13 0.02 . 1 . . . . . . . . 5770 1 1462 . 1 1 119 119 GLU CB C 13 29.1 0.30 . 1 . . . . . . . . 5770 1 1463 . 1 1 119 119 GLU HB2 H 1 2.42 0.02 . 2 . . . . . . . . 5770 1 1464 . 1 1 119 119 GLU HB3 H 1 2.32 0.02 . 2 . . . . . . . . 5770 1 1465 . 1 1 119 119 GLU CG C 13 36.7 0.30 . 1 . . . . . . . . 5770 1 1466 . 1 1 119 119 GLU HG2 H 1 2.08 0.02 . 2 . . . . . . . . 5770 1 1467 . 1 1 119 119 GLU HG3 H 1 1.99 0.02 . 2 . . . . . . . . 5770 1 1468 . 1 1 119 119 GLU C C 13 179.1 0.30 . 1 . . . . . . . . 5770 1 1469 . 1 1 120 120 GLU N N 15 120.9 0.20 . 1 . . . . . . . . 5770 1 1470 . 1 1 120 120 GLU H H 1 7.71 0.02 . 1 . . . . . . . . 5770 1 1471 . 1 1 120 120 GLU CA C 13 59.3 0.30 . 1 . . . . . . . . 5770 1 1472 . 1 1 120 120 GLU HA H 1 4.03 0.02 . 1 . . . . . . . . 5770 1 1473 . 1 1 120 120 GLU CB C 13 30.4 0.30 . 1 . . . . . . . . 5770 1 1474 . 1 1 120 120 GLU HB2 H 1 2.35 0.02 . 1 . . . . . . . . 5770 1 1475 . 1 1 120 120 GLU HB3 H 1 2.35 0.02 . 1 . . . . . . . . 5770 1 1476 . 1 1 120 120 GLU CG C 13 37.4 0.30 . 1 . . . . . . . . 5770 1 1477 . 1 1 120 120 GLU HG2 H 1 2.37 0.02 . 1 . . . . . . . . 5770 1 1478 . 1 1 120 120 GLU HG3 H 1 2.37 0.02 . 1 . . . . . . . . 5770 1 1479 . 1 1 120 120 GLU C C 13 179.5 0.30 . 1 . . . . . . . . 5770 1 1480 . 1 1 121 121 VAL N N 15 120.7 0.20 . 1 . . . . . . . . 5770 1 1481 . 1 1 121 121 VAL H H 1 7.85 0.02 . 1 . . . . . . . . 5770 1 1482 . 1 1 121 121 VAL CA C 13 66.7 0.30 . 1 . . . . . . . . 5770 1 1483 . 1 1 121 121 VAL HA H 1 3.50 0.02 . 1 . . . . . . . . 5770 1 1484 . 1 1 121 121 VAL CB C 13 31.4 0.30 . 1 . . . . . . . . 5770 1 1485 . 1 1 121 121 VAL HB H 1 2.18 0.02 . 1 . . . . . . . . 5770 1 1486 . 1 1 121 121 VAL HG11 H 1 0.93 0.02 . 1 . . . . . . . . 5770 1 1487 . 1 1 121 121 VAL HG12 H 1 0.93 0.02 . 1 . . . . . . . . 5770 1 1488 . 1 1 121 121 VAL HG13 H 1 0.93 0.02 . 1 . . . . . . . . 5770 1 1489 . 1 1 121 121 VAL HG21 H 1 0.93 0.02 . 1 . . . . . . . . 5770 1 1490 . 1 1 121 121 VAL HG22 H 1 0.93 0.02 . 1 . . . . . . . . 5770 1 1491 . 1 1 121 121 VAL HG23 H 1 0.93 0.02 . 1 . . . . . . . . 5770 1 1492 . 1 1 121 121 VAL CG1 C 13 23.7 0.30 . 1 . . . . . . . . 5770 1 1493 . 1 1 121 121 VAL CG2 C 13 22.3 0.30 . 1 . . . . . . . . 5770 1 1494 . 1 1 121 121 VAL C C 13 177.5 0.30 . 1 . . . . . . . . 5770 1 1495 . 1 1 122 122 ASP N N 15 119.2 0.20 . 1 . . . . . . . . 5770 1 1496 . 1 1 122 122 ASP H H 1 8.11 0.02 . 1 . . . . . . . . 5770 1 1497 . 1 1 122 122 ASP CA C 13 57.7 0.30 . 1 . . . . . . . . 5770 1 1498 . 1 1 122 122 ASP HA H 1 4.36 0.02 . 1 . . . . . . . . 5770 1 1499 . 1 1 122 122 ASP CB C 13 40.5 0.30 . 1 . . . . . . . . 5770 1 1500 . 1 1 122 122 ASP HB2 H 1 2.78 0.02 . 2 . . . . . . . . 5770 1 1501 . 1 1 122 122 ASP HB3 H 1 2.66 0.02 . 2 . . . . . . . . 5770 1 1502 . 1 1 122 122 ASP C C 13 179.1 0.30 . 1 . . . . . . . . 5770 1 1503 . 1 1 123 123 GLU N N 15 119.8 0.20 . 1 . . . . . . . . 5770 1 1504 . 1 1 123 123 GLU H H 1 7.97 0.02 . 1 . . . . . . . . 5770 1 1505 . 1 1 123 123 GLU CA C 13 59.4 0.30 . 1 . . . . . . . . 5770 1 1506 . 1 1 123 123 GLU HA H 1 4.07 0.02 . 1 . . . . . . . . 5770 1 1507 . 1 1 123 123 GLU CB C 13 30.0 0.30 . 1 . . . . . . . . 5770 1 1508 . 1 1 123 123 GLU HB2 H 1 2.24 0.02 . 1 . . . . . . . . 5770 1 1509 . 1 1 123 123 GLU HB3 H 1 2.24 0.02 . 1 . . . . . . . . 5770 1 1510 . 1 1 123 123 GLU CG C 13 36.6 0.30 . 1 . . . . . . . . 5770 1 1511 . 1 1 123 123 GLU HG2 H 1 2.35 0.02 . 1 . . . . . . . . 5770 1 1512 . 1 1 123 123 GLU HG3 H 1 2.35 0.02 . 1 . . . . . . . . 5770 1 1513 . 1 1 123 123 GLU C C 13 177.6 0.30 . 1 . . . . . . . . 5770 1 1514 . 1 1 124 124 MET N N 15 118.5 0.20 . 1 . . . . . . . . 5770 1 1515 . 1 1 124 124 MET H H 1 7.72 0.02 . 1 . . . . . . . . 5770 1 1516 . 1 1 124 124 MET CA C 13 60.5 0.30 . 1 . . . . . . . . 5770 1 1517 . 1 1 124 124 MET HA H 1 3.95 0.02 . 1 . . . . . . . . 5770 1 1518 . 1 1 124 124 MET CB C 13 32.8 0.30 . 1 . . . . . . . . 5770 1 1519 . 1 1 124 124 MET HB2 H 1 2.05 0.02 . 1 . . . . . . . . 5770 1 1520 . 1 1 124 124 MET HB3 H 1 2.05 0.02 . 1 . . . . . . . . 5770 1 1521 . 1 1 124 124 MET CG C 13 33.5 0.30 . 1 . . . . . . . . 5770 1 1522 . 1 1 124 124 MET HG2 H 1 2.84 0.02 . 1 . . . . . . . . 5770 1 1523 . 1 1 124 124 MET HG3 H 1 2.84 0.02 . 1 . . . . . . . . 5770 1 1524 . 1 1 124 124 MET HE1 H 1 1.35 0.02 . 1 . . . . . . . . 5770 1 1525 . 1 1 124 124 MET HE2 H 1 1.35 0.02 . 1 . . . . . . . . 5770 1 1526 . 1 1 124 124 MET HE3 H 1 1.35 0.02 . 1 . . . . . . . . 5770 1 1527 . 1 1 124 124 MET CE C 13 16.8 0.30 . 1 . . . . . . . . 5770 1 1528 . 1 1 124 124 MET C C 13 179.3 0.30 . 1 . . . . . . . . 5770 1 1529 . 1 1 125 125 ILE N N 15 118.2 0.20 . 1 . . . . . . . . 5770 1 1530 . 1 1 125 125 ILE H H 1 7.67 0.02 . 1 . . . . . . . . 5770 1 1531 . 1 1 125 125 ILE CA C 13 62.5 0.30 . 1 . . . . . . . . 5770 1 1532 . 1 1 125 125 ILE HA H 1 3.97 0.02 . 1 . . . . . . . . 5770 1 1533 . 1 1 125 125 ILE CB C 13 35.9 0.30 . 1 . . . . . . . . 5770 1 1534 . 1 1 125 125 ILE HB H 1 2.37 0.02 . 1 . . . . . . . . 5770 1 1535 . 1 1 125 125 ILE HG21 H 1 0.85 0.02 . 1 . . . . . . . . 5770 1 1536 . 1 1 125 125 ILE HG22 H 1 0.85 0.02 . 1 . . . . . . . . 5770 1 1537 . 1 1 125 125 ILE HG23 H 1 0.85 0.02 . 1 . . . . . . . . 5770 1 1538 . 1 1 125 125 ILE CG2 C 13 16.8 0.30 . 1 . . . . . . . . 5770 1 1539 . 1 1 125 125 ILE CG1 C 13 26.9 0.30 . 1 . . . . . . . . 5770 1 1540 . 1 1 125 125 ILE HG12 H 1 1.77 0.02 . 2 . . . . . . . . 5770 1 1541 . 1 1 125 125 ILE HG13 H 1 1.36 0.02 . 2 . . . . . . . . 5770 1 1542 . 1 1 125 125 ILE HD11 H 1 0.79 0.02 . 1 . . . . . . . . 5770 1 1543 . 1 1 125 125 ILE HD12 H 1 0.79 0.02 . 1 . . . . . . . . 5770 1 1544 . 1 1 125 125 ILE HD13 H 1 0.79 0.02 . 1 . . . . . . . . 5770 1 1545 . 1 1 125 125 ILE CD1 C 13 9.5 0.30 . 1 . . . . . . . . 5770 1 1546 . 1 1 125 125 ILE C C 13 177.2 0.30 . 1 . . . . . . . . 5770 1 1547 . 1 1 126 126 ARG N N 15 117.9 0.20 . 1 . . . . . . . . 5770 1 1548 . 1 1 126 126 ARG H H 1 8.58 0.02 . 1 . . . . . . . . 5770 1 1549 . 1 1 126 126 ARG CA C 13 60.0 0.30 . 1 . . . . . . . . 5770 1 1550 . 1 1 126 126 ARG HA H 1 4.17 0.02 . 1 . . . . . . . . 5770 1 1551 . 1 1 126 126 ARG CB C 13 30.8 0.30 . 1 . . . . . . . . 5770 1 1552 . 1 1 126 126 ARG HB2 H 1 2.02 0.02 . 2 . . . . . . . . 5770 1 1553 . 1 1 126 126 ARG HB3 H 1 1.95 0.02 . 2 . . . . . . . . 5770 1 1554 . 1 1 126 126 ARG CG C 13 27.7 0.30 . 1 . . . . . . . . 5770 1 1555 . 1 1 126 126 ARG HG2 H 1 1.82 0.02 . 2 . . . . . . . . 5770 1 1556 . 1 1 126 126 ARG HG3 H 1 1.67 0.02 . 2 . . . . . . . . 5770 1 1557 . 1 1 126 126 ARG CD C 13 43.6 0.30 . 1 . . . . . . . . 5770 1 1558 . 1 1 126 126 ARG HD2 H 1 3.29 0.02 . 1 . . . . . . . . 5770 1 1559 . 1 1 126 126 ARG HD3 H 1 3.29 0.02 . 1 . . . . . . . . 5770 1 1560 . 1 1 126 126 ARG C C 13 179.9 0.30 . 1 . . . . . . . . 5770 1 1561 . 1 1 127 127 GLU N N 15 113.6 0.20 . 1 . . . . . . . . 5770 1 1562 . 1 1 127 127 GLU H H 1 8.34 0.02 . 1 . . . . . . . . 5770 1 1563 . 1 1 127 127 GLU CA C 13 57.7 0.30 . 1 . . . . . . . . 5770 1 1564 . 1 1 127 127 GLU HA H 1 4.41 0.02 . 1 . . . . . . . . 5770 1 1565 . 1 1 127 127 GLU CB C 13 29.4 0.30 . 1 . . . . . . . . 5770 1 1566 . 1 1 127 127 GLU HB2 H 1 2.19 0.02 . 2 . . . . . . . . 5770 1 1567 . 1 1 127 127 GLU HB3 H 1 2.09 0.02 . 2 . . . . . . . . 5770 1 1568 . 1 1 127 127 GLU CG C 13 35.3 0.30 . 1 . . . . . . . . 5770 1 1569 . 1 1 127 127 GLU HG2 H 1 2.69 0.02 . 2 . . . . . . . . 5770 1 1570 . 1 1 127 127 GLU HG3 H 1 2.38 0.02 . 2 . . . . . . . . 5770 1 1571 . 1 1 127 127 GLU C C 13 177.4 0.30 . 1 . . . . . . . . 5770 1 1572 . 1 1 128 128 ALA N N 15 118.7 0.20 . 1 . . . . . . . . 5770 1 1573 . 1 1 128 128 ALA H H 1 7.29 0.02 . 1 . . . . . . . . 5770 1 1574 . 1 1 128 128 ALA CA C 13 52.1 0.30 . 1 . . . . . . . . 5770 1 1575 . 1 1 128 128 ALA HA H 1 4.55 0.02 . 1 . . . . . . . . 5770 1 1576 . 1 1 128 128 ALA HB1 H 1 1.49 0.02 . 1 . . . . . . . . 5770 1 1577 . 1 1 128 128 ALA HB2 H 1 1.49 0.02 . 1 . . . . . . . . 5770 1 1578 . 1 1 128 128 ALA HB3 H 1 1.49 0.02 . 1 . . . . . . . . 5770 1 1579 . 1 1 128 128 ALA CB C 13 21.1 0.30 . 1 . . . . . . . . 5770 1 1580 . 1 1 128 128 ALA C C 13 177.1 0.30 . 1 . . . . . . . . 5770 1 1581 . 1 1 129 129 ASP N N 15 118.1 0.20 . 1 . . . . . . . . 5770 1 1582 . 1 1 129 129 ASP H H 1 7.67 0.02 . 1 . . . . . . . . 5770 1 1583 . 1 1 129 129 ASP CA C 13 54.0 0.30 . 1 . . . . . . . . 5770 1 1584 . 1 1 129 129 ASP HA H 1 4.52 0.02 . 1 . . . . . . . . 5770 1 1585 . 1 1 129 129 ASP CB C 13 40.9 0.30 . 1 . . . . . . . . 5770 1 1586 . 1 1 129 129 ASP HB2 H 1 3.03 0.02 . 2 . . . . . . . . 5770 1 1587 . 1 1 129 129 ASP HB3 H 1 2.61 0.02 . 2 . . . . . . . . 5770 1 1588 . 1 1 129 129 ASP C C 13 175.8 0.30 . 1 . . . . . . . . 5770 1 1589 . 1 1 130 130 ILE N N 15 127.1 0.20 . 1 . . . . . . . . 5770 1 1590 . 1 1 130 130 ILE H H 1 8.15 0.02 . 1 . . . . . . . . 5770 1 1591 . 1 1 130 130 ILE CA C 13 63.5 0.30 . 1 . . . . . . . . 5770 1 1592 . 1 1 130 130 ILE HA H 1 3.94 0.02 . 1 . . . . . . . . 5770 1 1593 . 1 1 130 130 ILE CB C 13 38.6 0.30 . 1 . . . . . . . . 5770 1 1594 . 1 1 130 130 ILE HB H 1 2.03 0.02 . 1 . . . . . . . . 5770 1 1595 . 1 1 130 130 ILE HG21 H 1 0.97 0.02 . 1 . . . . . . . . 5770 1 1596 . 1 1 130 130 ILE HG22 H 1 0.97 0.02 . 1 . . . . . . . . 5770 1 1597 . 1 1 130 130 ILE HG23 H 1 0.97 0.02 . 1 . . . . . . . . 5770 1 1598 . 1 1 130 130 ILE CG2 C 13 17.4 0.30 . 1 . . . . . . . . 5770 1 1599 . 1 1 130 130 ILE CG1 C 13 27.9 0.30 . 1 . . . . . . . . 5770 1 1600 . 1 1 130 130 ILE HG12 H 1 1.75 0.02 . 2 . . . . . . . . 5770 1 1601 . 1 1 130 130 ILE HG13 H 1 1.34 0.02 . 2 . . . . . . . . 5770 1 1602 . 1 1 130 130 ILE HD11 H 1 0.94 0.02 . 1 . . . . . . . . 5770 1 1603 . 1 1 130 130 ILE HD12 H 1 0.94 0.02 . 1 . . . . . . . . 5770 1 1604 . 1 1 130 130 ILE HD13 H 1 0.94 0.02 . 1 . . . . . . . . 5770 1 1605 . 1 1 130 130 ILE CD1 C 13 12.7 0.30 . 1 . . . . . . . . 5770 1 1606 . 1 1 130 130 ILE C C 13 178.1 0.30 . 1 . . . . . . . . 5770 1 1607 . 1 1 131 131 ASP N N 15 116.8 0.20 . 1 . . . . . . . . 5770 1 1608 . 1 1 131 131 ASP H H 1 8.47 0.02 . 1 . . . . . . . . 5770 1 1609 . 1 1 131 131 ASP CA C 13 53.9 0.30 . 1 . . . . . . . . 5770 1 1610 . 1 1 131 131 ASP HA H 1 4.52 0.02 . 1 . . . . . . . . 5770 1 1611 . 1 1 131 131 ASP CB C 13 40.0 0.30 . 1 . . . . . . . . 5770 1 1612 . 1 1 131 131 ASP HB2 H 1 3.13 0.02 . 2 . . . . . . . . 5770 1 1613 . 1 1 131 131 ASP HB3 H 1 2.68 0.02 . 2 . . . . . . . . 5770 1 1614 . 1 1 131 131 ASP C C 13 178.3 0.30 . 1 . . . . . . . . 5770 1 1615 . 1 1 132 132 GLY N N 15 108.8 0.20 . 1 . . . . . . . . 5770 1 1616 . 1 1 132 132 GLY H H 1 7.72 0.02 . 1 . . . . . . . . 5770 1 1617 . 1 1 132 132 GLY CA C 13 47.5 0.30 . 1 . . . . . . . . 5770 1 1618 . 1 1 132 132 GLY HA2 H 1 4.05 0.02 . 2 . . . . . . . . 5770 1 1619 . 1 1 132 132 GLY HA3 H 1 3.89 0.02 . 2 . . . . . . . . 5770 1 1620 . 1 1 132 132 GLY C C 13 175.4 0.30 . 1 . . . . . . . . 5770 1 1621 . 1 1 133 133 ASP N N 15 121.1 0.20 . 1 . . . . . . . . 5770 1 1622 . 1 1 133 133 ASP H H 1 8.43 0.02 . 1 . . . . . . . . 5770 1 1623 . 1 1 133 133 ASP CA C 13 53.6 0.30 . 1 . . . . . . . . 5770 1 1624 . 1 1 133 133 ASP HA H 1 4.49 0.02 . 1 . . . . . . . . 5770 1 1625 . 1 1 133 133 ASP CB C 13 40.1 0.30 . 1 . . . . . . . . 5770 1 1626 . 1 1 133 133 ASP HB2 H 1 3.01 0.02 . 2 . . . . . . . . 5770 1 1627 . 1 1 133 133 ASP HB3 H 1 2.53 0.02 . 2 . . . . . . . . 5770 1 1628 . 1 1 133 133 ASP C C 13 177.6 0.30 . 1 . . . . . . . . 5770 1 1629 . 1 1 134 134 GLY N N 15 112.7 0.20 . 1 . . . . . . . . 5770 1 1630 . 1 1 134 134 GLY H H 1 10.33 0.02 . 1 . . . . . . . . 5770 1 1631 . 1 1 134 134 GLY CA C 13 45.9 0.30 . 1 . . . . . . . . 5770 1 1632 . 1 1 134 134 GLY HA2 H 1 4.11 0.02 . 2 . . . . . . . . 5770 1 1633 . 1 1 134 134 GLY HA3 H 1 3.52 0.02 . 2 . . . . . . . . 5770 1 1634 . 1 1 134 134 GLY C C 13 172.8 0.30 . 1 . . . . . . . . 5770 1 1635 . 1 1 135 135 GLN N N 15 114.9 0.20 . 1 . . . . . . . . 5770 1 1636 . 1 1 135 135 GLN H H 1 7.97 0.02 . 1 . . . . . . . . 5770 1 1637 . 1 1 135 135 GLN CA C 13 53.6 0.30 . 1 . . . . . . . . 5770 1 1638 . 1 1 135 135 GLN HA H 1 4.95 0.02 . 1 . . . . . . . . 5770 1 1639 . 1 1 135 135 GLN CB C 13 33.1 0.30 . 1 . . . . . . . . 5770 1 1640 . 1 1 135 135 GLN HB2 H 1 2.00 0.02 . 1 . . . . . . . . 5770 1 1641 . 1 1 135 135 GLN HB3 H 1 2.00 0.02 . 1 . . . . . . . . 5770 1 1642 . 1 1 135 135 GLN CG C 13 32.5 0.30 . 1 . . . . . . . . 5770 1 1643 . 1 1 135 135 GLN HG2 H 1 2.14 0.02 . 2 . . . . . . . . 5770 1 1644 . 1 1 135 135 GLN HG3 H 1 1.74 0.02 . 2 . . . . . . . . 5770 1 1645 . 1 1 135 135 GLN CD C 13 178.7 0.30 . 1 . . . . . . . . 5770 1 1646 . 1 1 135 135 GLN NE2 N 15 108.6 0.20 . 1 . . . . . . . . 5770 1 1647 . 1 1 135 135 GLN HE21 H 1 6.44 0.02 . 2 . . . . . . . . 5770 1 1648 . 1 1 135 135 GLN HE22 H 1 5.90 0.02 . 2 . . . . . . . . 5770 1 1649 . 1 1 135 135 GLN C C 13 174.9 0.30 . 1 . . . . . . . . 5770 1 1650 . 1 1 136 136 VAL N N 15 125.8 0.20 . 1 . . . . . . . . 5770 1 1651 . 1 1 136 136 VAL H H 1 9.14 0.02 . 1 . . . . . . . . 5770 1 1652 . 1 1 136 136 VAL CA C 13 62.0 0.30 . 1 . . . . . . . . 5770 1 1653 . 1 1 136 136 VAL HA H 1 5.27 0.02 . 1 . . . . . . . . 5770 1 1654 . 1 1 136 136 VAL CB C 13 34.1 0.30 . 1 . . . . . . . . 5770 1 1655 . 1 1 136 136 VAL HB H 1 2.40 0.02 . 1 . . . . . . . . 5770 1 1656 . 1 1 136 136 VAL HG11 H 1 1.25 0.02 . 2 . . . . . . . . 5770 1 1657 . 1 1 136 136 VAL HG12 H 1 1.25 0.02 . 2 . . . . . . . . 5770 1 1658 . 1 1 136 136 VAL HG13 H 1 1.25 0.02 . 2 . . . . . . . . 5770 1 1659 . 1 1 136 136 VAL HG21 H 1 1.17 0.02 . 2 . . . . . . . . 5770 1 1660 . 1 1 136 136 VAL HG22 H 1 1.17 0.02 . 2 . . . . . . . . 5770 1 1661 . 1 1 136 136 VAL HG23 H 1 1.17 0.02 . 2 . . . . . . . . 5770 1 1662 . 1 1 136 136 VAL CG1 C 13 23.7 0.30 . 1 . . . . . . . . 5770 1 1663 . 1 1 136 136 VAL CG2 C 13 21.6 0.30 . 1 . . . . . . . . 5770 1 1664 . 1 1 136 136 VAL C C 13 175.8 0.30 . 1 . . . . . . . . 5770 1 1665 . 1 1 137 137 ASN N N 15 129.3 0.20 . 1 . . . . . . . . 5770 1 1666 . 1 1 137 137 ASN H H 1 9.68 0.02 . 1 . . . . . . . . 5770 1 1667 . 1 1 137 137 ASN CA C 13 51.1 0.30 . 1 . . . . . . . . 5770 1 1668 . 1 1 137 137 ASN HA H 1 5.38 0.02 . 1 . . . . . . . . 5770 1 1669 . 1 1 137 137 ASN CB C 13 38.6 0.30 . 1 . . . . . . . . 5770 1 1670 . 1 1 137 137 ASN HB2 H 1 3.25 0.02 . 1 . . . . . . . . 5770 1 1671 . 1 1 137 137 ASN HB3 H 1 3.25 0.02 . 1 . . . . . . . . 5770 1 1672 . 1 1 137 137 ASN CG C 13 175.5 0.30 . 1 . . . . . . . . 5770 1 1673 . 1 1 137 137 ASN ND2 N 15 108.3 0.20 . 1 . . . . . . . . 5770 1 1674 . 1 1 137 137 ASN HD21 H 1 7.21 0.02 . 2 . . . . . . . . 5770 1 1675 . 1 1 137 137 ASN HD22 H 1 6.86 0.02 . 2 . . . . . . . . 5770 1 1676 . 1 1 137 137 ASN C C 13 174.7 0.30 . 1 . . . . . . . . 5770 1 1677 . 1 1 138 138 TYR N N 15 118.8 0.20 . 1 . . . . . . . . 5770 1 1678 . 1 1 138 138 TYR H H 1 8.26 0.02 . 1 . . . . . . . . 5770 1 1679 . 1 1 138 138 TYR CA C 13 62.4 0.30 . 1 . . . . . . . . 5770 1 1680 . 1 1 138 138 TYR HA H 1 3.28 0.02 . 1 . . . . . . . . 5770 1 1681 . 1 1 138 138 TYR CB C 13 37.9 0.30 . 1 . . . . . . . . 5770 1 1682 . 1 1 138 138 TYR HB2 H 1 2.38 0.02 . 2 . . . . . . . . 5770 1 1683 . 1 1 138 138 TYR HB3 H 1 2.02 0.02 . 2 . . . . . . . . 5770 1 1684 . 1 1 138 138 TYR HD1 H 1 6.41 0.02 . 1 . . . . . . . . 5770 1 1685 . 1 1 138 138 TYR HD2 H 1 6.41 0.02 . 1 . . . . . . . . 5770 1 1686 . 1 1 138 138 TYR HE1 H 1 6.59 0.02 . 1 . . . . . . . . 5770 1 1687 . 1 1 138 138 TYR HE2 H 1 6.59 0.02 . 1 . . . . . . . . 5770 1 1688 . 1 1 138 138 TYR CD1 C 13 132.5 0.30 . 1 . . . . . . . . 5770 1 1689 . 1 1 138 138 TYR CE1 C 13 118.0 0.30 . 1 . . . . . . . . 5770 1 1690 . 1 1 138 138 TYR CE2 C 13 118.0 0.30 . 1 . . . . . . . . 5770 1 1691 . 1 1 138 138 TYR CD2 C 13 132.5 0.30 . 1 . . . . . . . . 5770 1 1692 . 1 1 138 138 TYR C C 13 176.1 0.30 . 1 . . . . . . . . 5770 1 1693 . 1 1 139 139 GLU N N 15 118.4 0.20 . 1 . . . . . . . . 5770 1 1694 . 1 1 139 139 GLU H H 1 7.99 0.02 . 1 . . . . . . . . 5770 1 1695 . 1 1 139 139 GLU CA C 13 60.2 0.30 . 1 . . . . . . . . 5770 1 1696 . 1 1 139 139 GLU HA H 1 3.65 0.02 . 1 . . . . . . . . 5770 1 1697 . 1 1 139 139 GLU CB C 13 29.0 0.30 . 1 . . . . . . . . 5770 1 1698 . 1 1 139 139 GLU HB2 H 1 2.09 0.02 . 2 . . . . . . . . 5770 1 1699 . 1 1 139 139 GLU HB3 H 1 1.97 0.02 . 2 . . . . . . . . 5770 1 1700 . 1 1 139 139 GLU CG C 13 36.9 0.30 . 1 . . . . . . . . 5770 1 1701 . 1 1 139 139 GLU HG2 H 1 2.35 0.02 . 2 . . . . . . . . 5770 1 1702 . 1 1 139 139 GLU HG3 H 1 2.29 0.02 . 2 . . . . . . . . 5770 1 1703 . 1 1 139 139 GLU C C 13 180.0 0.30 . 1 . . . . . . . . 5770 1 1704 . 1 1 140 140 GLU N N 15 119.8 0.20 . 1 . . . . . . . . 5770 1 1705 . 1 1 140 140 GLU H H 1 8.67 0.02 . 1 . . . . . . . . 5770 1 1706 . 1 1 140 140 GLU CA C 13 58.9 0.30 . 1 . . . . . . . . 5770 1 1707 . 1 1 140 140 GLU HA H 1 3.86 0.02 . 1 . . . . . . . . 5770 1 1708 . 1 1 140 140 GLU CB C 13 29.5 0.30 . 1 . . . . . . . . 5770 1 1709 . 1 1 140 140 GLU HB2 H 1 2.55 0.02 . 2 . . . . . . . . 5770 1 1710 . 1 1 140 140 GLU HB3 H 1 2.29 0.02 . 2 . . . . . . . . 5770 1 1711 . 1 1 140 140 GLU CG C 13 37.2 0.30 . 1 . . . . . . . . 5770 1 1712 . 1 1 140 140 GLU HG2 H 1 2.91 0.02 . 2 . . . . . . . . 5770 1 1713 . 1 1 140 140 GLU HG3 H 1 2.39 0.02 . 2 . . . . . . . . 5770 1 1714 . 1 1 140 140 GLU C C 13 179.0 0.30 . 1 . . . . . . . . 5770 1 1715 . 1 1 141 141 PHE N N 15 123.5 0.20 . 1 . . . . . . . . 5770 1 1716 . 1 1 141 141 PHE H H 1 8.46 0.02 . 1 . . . . . . . . 5770 1 1717 . 1 1 141 141 PHE CA C 13 61.8 0.30 . 1 . . . . . . . . 5770 1 1718 . 1 1 141 141 PHE HA H 1 3.62 0.02 . 1 . . . . . . . . 5770 1 1719 . 1 1 141 141 PHE CB C 13 40.5 0.30 . 1 . . . . . . . . 5770 1 1720 . 1 1 141 141 PHE HB2 H 1 3.22 0.02 . 2 . . . . . . . . 5770 1 1721 . 1 1 141 141 PHE HB3 H 1 3.00 0.02 . 2 . . . . . . . . 5770 1 1722 . 1 1 141 141 PHE HD1 H 1 6.70 0.02 . 1 . . . . . . . . 5770 1 1723 . 1 1 141 141 PHE HD2 H 1 6.70 0.02 . 1 . . . . . . . . 5770 1 1724 . 1 1 141 141 PHE HE1 H 1 7.20 0.02 . 1 . . . . . . . . 5770 1 1725 . 1 1 141 141 PHE HE2 H 1 7.20 0.02 . 1 . . . . . . . . 5770 1 1726 . 1 1 141 141 PHE CD1 C 13 131.9 0.30 . 1 . . . . . . . . 5770 1 1727 . 1 1 141 141 PHE CE1 C 13 131.7 0.30 . 1 . . . . . . . . 5770 1 1728 . 1 1 141 141 PHE CZ C 13 129.3 0.30 . 1 . . . . . . . . 5770 1 1729 . 1 1 141 141 PHE HZ H 1 7.05 0.02 . 1 . . . . . . . . 5770 1 1730 . 1 1 141 141 PHE CE2 C 13 131.7 0.30 . 1 . . . . . . . . 5770 1 1731 . 1 1 141 141 PHE CD2 C 13 131.9 0.30 . 1 . . . . . . . . 5770 1 1732 . 1 1 141 141 PHE C C 13 176.7 0.30 . 1 . . . . . . . . 5770 1 1733 . 1 1 142 142 VAL N N 15 118.7 0.20 . 1 . . . . . . . . 5770 1 1734 . 1 1 142 142 VAL H H 1 8.66 0.02 . 1 . . . . . . . . 5770 1 1735 . 1 1 142 142 VAL CA C 13 66.7 0.30 . 1 . . . . . . . . 5770 1 1736 . 1 1 142 142 VAL HA H 1 3.13 0.02 . 1 . . . . . . . . 5770 1 1737 . 1 1 142 142 VAL CB C 13 31.4 0.30 . 1 . . . . . . . . 5770 1 1738 . 1 1 142 142 VAL HB H 1 1.71 0.02 . 1 . . . . . . . . 5770 1 1739 . 1 1 142 142 VAL HG11 H 1 0.71 0.02 . 2 . . . . . . . . 5770 1 1740 . 1 1 142 142 VAL HG12 H 1 0.71 0.02 . 2 . . . . . . . . 5770 1 1741 . 1 1 142 142 VAL HG13 H 1 0.71 0.02 . 2 . . . . . . . . 5770 1 1742 . 1 1 142 142 VAL HG21 H 1 0.47 0.02 . 2 . . . . . . . . 5770 1 1743 . 1 1 142 142 VAL HG22 H 1 0.47 0.02 . 2 . . . . . . . . 5770 1 1744 . 1 1 142 142 VAL HG23 H 1 0.47 0.02 . 2 . . . . . . . . 5770 1 1745 . 1 1 142 142 VAL CG1 C 13 21.3 0.30 . 1 . . . . . . . . 5770 1 1746 . 1 1 142 142 VAL CG2 C 13 23.2 0.30 . 1 . . . . . . . . 5770 1 1747 . 1 1 142 142 VAL C C 13 180.8 0.30 . 1 . . . . . . . . 5770 1 1748 . 1 1 143 143 GLN N N 15 119.5 0.20 . 1 . . . . . . . . 5770 1 1749 . 1 1 143 143 GLN H H 1 7.78 0.02 . 1 . . . . . . . . 5770 1 1750 . 1 1 143 143 GLN CA C 13 58.9 0.30 . 1 . . . . . . . . 5770 1 1751 . 1 1 143 143 GLN HA H 1 3.79 0.02 . 1 . . . . . . . . 5770 1 1752 . 1 1 143 143 GLN CB C 13 28.1 0.30 . 1 . . . . . . . . 5770 1 1753 . 1 1 143 143 GLN HB2 H 1 2.03 0.02 . 1 . . . . . . . . 5770 1 1754 . 1 1 143 143 GLN HB3 H 1 2.03 0.02 . 1 . . . . . . . . 5770 1 1755 . 1 1 143 143 GLN CG C 13 34.1 0.30 . 1 . . . . . . . . 5770 1 1756 . 1 1 143 143 GLN HG2 H 1 2.39 0.02 . 1 . . . . . . . . 5770 1 1757 . 1 1 143 143 GLN HG3 H 1 2.39 0.02 . 1 . . . . . . . . 5770 1 1758 . 1 1 143 143 GLN CD C 13 179.7 0.30 . 1 . . . . . . . . 5770 1 1759 . 1 1 143 143 GLN NE2 N 15 111.6 0.20 . 1 . . . . . . . . 5770 1 1760 . 1 1 143 143 GLN HE21 H 1 7.41 0.02 . 2 . . . . . . . . 5770 1 1761 . 1 1 143 143 GLN HE22 H 1 6.72 0.02 . 2 . . . . . . . . 5770 1 1762 . 1 1 143 143 GLN C C 13 177.8 0.30 . 1 . . . . . . . . 5770 1 1763 . 1 1 144 144 MET N N 15 117.8 0.20 . 1 . . . . . . . . 5770 1 1764 . 1 1 144 144 MET H H 1 7.11 0.02 . 1 . . . . . . . . 5770 1 1765 . 1 1 144 144 MET CA C 13 57.9 0.30 . 1 . . . . . . . . 5770 1 1766 . 1 1 144 144 MET HA H 1 3.48 0.02 . 1 . . . . . . . . 5770 1 1767 . 1 1 144 144 MET CB C 13 32.2 0.30 . 1 . . . . . . . . 5770 1 1768 . 1 1 144 144 MET HB2 H 1 1.42 0.02 . 2 . . . . . . . . 5770 1 1769 . 1 1 144 144 MET HB3 H 1 1.27 0.02 . 2 . . . . . . . . 5770 1 1770 . 1 1 144 144 MET CG C 13 29.3 0.30 . 1 . . . . . . . . 5770 1 1771 . 1 1 144 144 MET HG2 H 1 1.01 0.02 . 2 . . . . . . . . 5770 1 1772 . 1 1 144 144 MET HG3 H 1 0.86 0.02 . 2 . . . . . . . . 5770 1 1773 . 1 1 144 144 MET HE1 H 1 0.41 0.02 . 1 . . . . . . . . 5770 1 1774 . 1 1 144 144 MET HE2 H 1 0.41 0.02 . 1 . . . . . . . . 5770 1 1775 . 1 1 144 144 MET HE3 H 1 0.41 0.02 . 1 . . . . . . . . 5770 1 1776 . 1 1 144 144 MET CE C 13 15.7 0.30 . 1 . . . . . . . . 5770 1 1777 . 1 1 144 144 MET C C 13 177.1 0.30 . 1 . . . . . . . . 5770 1 1778 . 1 1 145 145 MET N N 15 114.0 0.20 . 1 . . . . . . . . 5770 1 1779 . 1 1 145 145 MET H H 1 7.45 0.02 . 1 . . . . . . . . 5770 1 1780 . 1 1 145 145 MET CA C 13 55.2 0.30 . 1 . . . . . . . . 5770 1 1781 . 1 1 145 145 MET HA H 1 4.13 0.02 . 1 . . . . . . . . 5770 1 1782 . 1 1 145 145 MET CB C 13 32.1 0.30 . 1 . . . . . . . . 5770 1 1783 . 1 1 145 145 MET HB2 H 1 1.79 0.02 . 2 . . . . . . . . 5770 1 1784 . 1 1 145 145 MET HB3 H 1 1.66 0.02 . 2 . . . . . . . . 5770 1 1785 . 1 1 145 145 MET CG C 13 32.5 0.30 . 1 . . . . . . . . 5770 1 1786 . 1 1 145 145 MET HG2 H 1 1.83 0.02 . 1 . . . . . . . . 5770 1 1787 . 1 1 145 145 MET HG3 H 1 1.83 0.02 . 1 . . . . . . . . 5770 1 1788 . 1 1 145 145 MET HE1 H 1 1.66 0.02 . 1 . . . . . . . . 5770 1 1789 . 1 1 145 145 MET HE2 H 1 1.66 0.02 . 1 . . . . . . . . 5770 1 1790 . 1 1 145 145 MET HE3 H 1 1.66 0.02 . 1 . . . . . . . . 5770 1 1791 . 1 1 145 145 MET CE C 13 18.0 0.30 . 1 . . . . . . . . 5770 1 1792 . 1 1 145 145 MET C C 13 177.4 0.30 . 1 . . . . . . . . 5770 1 1793 . 1 1 146 146 THR N N 15 110.0 0.20 . 1 . . . . . . . . 5770 1 1794 . 1 1 146 146 THR H H 1 7.55 0.02 . 1 . . . . . . . . 5770 1 1795 . 1 1 146 146 THR CA C 13 61.9 0.30 . 1 . . . . . . . . 5770 1 1796 . 1 1 146 146 THR HA H 1 4.32 0.02 . 1 . . . . . . . . 5770 1 1797 . 1 1 146 146 THR CB C 13 70.0 0.30 . 1 . . . . . . . . 5770 1 1798 . 1 1 146 146 THR HB H 1 4.28 0.02 . 1 . . . . . . . . 5770 1 1799 . 1 1 146 146 THR HG21 H 1 1.15 0.02 . 1 . . . . . . . . 5770 1 1800 . 1 1 146 146 THR HG22 H 1 1.15 0.02 . 1 . . . . . . . . 5770 1 1801 . 1 1 146 146 THR HG23 H 1 1.15 0.02 . 1 . . . . . . . . 5770 1 1802 . 1 1 146 146 THR CG2 C 13 21.5 0.30 . 1 . . . . . . . . 5770 1 1803 . 1 1 146 146 THR C C 13 174.1 0.30 . 1 . . . . . . . . 5770 1 1804 . 1 1 147 147 ALA N N 15 126.9 0.20 . 1 . . . . . . . . 5770 1 1805 . 1 1 147 147 ALA H H 1 7.54 0.02 . 1 . . . . . . . . 5770 1 1806 . 1 1 147 147 ALA CA C 13 53.0 0.30 . 1 . . . . . . . . 5770 1 1807 . 1 1 147 147 ALA HA H 1 4.33 0.02 . 1 . . . . . . . . 5770 1 1808 . 1 1 147 147 ALA HB1 H 1 1.52 0.02 . 1 . . . . . . . . 5770 1 1809 . 1 1 147 147 ALA HB2 H 1 1.52 0.02 . 1 . . . . . . . . 5770 1 1810 . 1 1 147 147 ALA HB3 H 1 1.52 0.02 . 1 . . . . . . . . 5770 1 1811 . 1 1 147 147 ALA CB C 13 19.0 0.30 . 1 . . . . . . . . 5770 1 1812 . 1 1 147 147 ALA C C 13 176.7 0.30 . 1 . . . . . . . . 5770 1 1813 . 1 1 148 148 LYS N N 15 126.0 0.20 . 1 . . . . . . . . 5770 1 1814 . 1 1 148 148 LYS H H 1 7.84 0.02 . 1 . . . . . . . . 5770 1 1815 . 1 1 148 148 LYS CA C 13 57.6 0.30 . 1 . . . . . . . . 5770 1 1816 . 1 1 148 148 LYS HA H 1 4.21 0.02 . 1 . . . . . . . . 5770 1 1817 . 1 1 148 148 LYS CB C 13 34.0 0.30 . 1 . . . . . . . . 5770 1 1818 . 1 1 148 148 LYS HB2 H 1 1.86 0.02 . 2 . . . . . . . . 5770 1 1819 . 1 1 148 148 LYS HB3 H 1 1.73 0.02 . 2 . . . . . . . . 5770 1 1820 . 1 1 148 148 LYS CG C 13 24.7 0.30 . 1 . . . . . . . . 5770 1 1821 . 1 1 148 148 LYS HG2 H 1 1.43 0.02 . 1 . . . . . . . . 5770 1 1822 . 1 1 148 148 LYS HG3 H 1 1.43 0.02 . 1 . . . . . . . . 5770 1 1823 . 1 1 148 148 LYS CD C 13 29.2 0.30 . 1 . . . . . . . . 5770 1 1824 . 1 1 148 148 LYS HD2 H 1 1.70 0.02 . 1 . . . . . . . . 5770 1 1825 . 1 1 148 148 LYS HD3 H 1 1.70 0.02 . 1 . . . . . . . . 5770 1 1826 . 1 1 148 148 LYS CE C 13 42.1 0.30 . 1 . . . . . . . . 5770 1 1827 . 1 1 148 148 LYS HE2 H 1 3.03 0.02 . 1 . . . . . . . . 5770 1 1828 . 1 1 148 148 LYS HE3 H 1 3.03 0.02 . 1 . . . . . . . . 5770 1 stop_ save_ save_shift_set_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode shift_set_2 _Assigned_chem_shift_list.Entry_ID 5770 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Ex-cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 . 5770 2 . . 2 $sample_2 . 5770 2 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 . 2 2 3 3 HIS CA C 13 55.9 0.30 . 1 . . . . . . . . 5770 2 2 . 2 2 3 3 HIS HA H 1 4.71 0.02 . 1 . . . . . . . . 5770 2 3 . 2 2 3 3 HIS CB C 13 30.2 0.30 . 1 . . . . . . . . 5770 2 4 . 2 2 3 3 HIS HB2 H 1 3.22 0.02 . 2 . . . . . . . . 5770 2 5 . 2 2 3 3 HIS HB3 H 1 3.16 0.02 . 2 . . . . . . . . 5770 2 6 . 2 2 3 3 HIS CD2 C 13 119.7 0.30 . 1 . . . . . . . . 5770 2 7 . 2 2 3 3 HIS HD2 H 1 7.14 0.02 . 1 . . . . . . . . 5770 2 8 . 2 2 3 3 HIS C C 13 174.5 0.30 . 1 . . . . . . . . 5770 2 9 . 2 2 4 4 LYS N N 15 123.8 0.20 . 1 . . . . . . . . 5770 2 10 . 2 2 4 4 LYS H H 1 8.32 0.02 . 1 . . . . . . . . 5770 2 11 . 2 2 4 4 LYS CA C 13 55.9 0.30 . 1 . . . . . . . . 5770 2 12 . 2 2 4 4 LYS HA H 1 4.31 0.02 . 1 . . . . . . . . 5770 2 13 . 2 2 4 4 LYS CB C 13 33.1 0.30 . 1 . . . . . . . . 5770 2 14 . 2 2 4 4 LYS HB2 H 1 1.85 0.02 . 1 . . . . . . . . 5770 2 15 . 2 2 4 4 LYS HB3 H 1 1.85 0.02 . 1 . . . . . . . . 5770 2 16 . 2 2 4 4 LYS CG C 13 24.5 0.30 . 1 . . . . . . . . 5770 2 17 . 2 2 4 4 LYS HG2 H 1 1.45 0.02 . 1 . . . . . . . . 5770 2 18 . 2 2 4 4 LYS HG3 H 1 1.45 0.02 . 1 . . . . . . . . 5770 2 19 . 2 2 4 4 LYS CD C 13 28.9 0.30 . 1 . . . . . . . . 5770 2 20 . 2 2 4 4 LYS HD2 H 1 1.72 0.02 . 1 . . . . . . . . 5770 2 21 . 2 2 4 4 LYS HD3 H 1 1.72 0.02 . 1 . . . . . . . . 5770 2 22 . 2 2 4 4 LYS CE C 13 42.2 0.30 . 1 . . . . . . . . 5770 2 23 . 2 2 4 4 LYS HE2 H 1 3.04 0.02 . 1 . . . . . . . . 5770 2 24 . 2 2 4 4 LYS HE3 H 1 3.04 0.02 . 1 . . . . . . . . 5770 2 25 . 2 2 4 4 LYS C C 13 176.3 0.30 . 1 . . . . . . . . 5770 2 26 . 2 2 5 5 LYS N N 15 124.2 0.20 . 1 . . . . . . . . 5770 2 27 . 2 2 5 5 LYS H H 1 8.42 0.02 . 1 . . . . . . . . 5770 2 28 . 2 2 5 5 LYS CA C 13 56.5 0.30 . 1 . . . . . . . . 5770 2 29 . 2 2 5 5 LYS HA H 1 4.46 0.02 . 1 . . . . . . . . 5770 2 30 . 2 2 5 5 LYS CB C 13 34.5 0.30 . 1 . . . . . . . . 5770 2 31 . 2 2 5 5 LYS HB2 H 1 1.85 0.02 . 2 . . . . . . . . 5770 2 32 . 2 2 5 5 LYS HB3 H 1 1.68 0.02 . 2 . . . . . . . . 5770 2 33 . 2 2 5 5 LYS CG C 13 25.7 0.30 . 1 . . . . . . . . 5770 2 34 . 2 2 5 5 LYS HG2 H 1 1.49 0.02 . 1 . . . . . . . . 5770 2 35 . 2 2 5 5 LYS HG3 H 1 1.49 0.02 . 1 . . . . . . . . 5770 2 36 . 2 2 5 5 LYS CD C 13 29.8 0.30 . 1 . . . . . . . . 5770 2 37 . 2 2 5 5 LYS HD2 H 1 1.69 0.02 . 1 . . . . . . . . 5770 2 38 . 2 2 5 5 LYS HD3 H 1 1.69 0.02 . 1 . . . . . . . . 5770 2 39 . 2 2 5 5 LYS CE C 13 42.0 0.30 . 1 . . . . . . . . 5770 2 40 . 2 2 5 5 LYS HE2 H 1 2.97 0.02 . 1 . . . . . . . . 5770 2 41 . 2 2 5 5 LYS HE3 H 1 2.97 0.02 . 1 . . . . . . . . 5770 2 42 . 2 2 5 5 LYS C C 13 177.3 0.30 . 1 . . . . . . . . 5770 2 43 . 2 2 6 6 THR N N 15 114.3 0.20 . 1 . . . . . . . . 5770 2 44 . 2 2 6 6 THR H H 1 8.65 0.02 . 1 . . . . . . . . 5770 2 45 . 2 2 6 6 THR CA C 13 61.2 0.30 . 1 . . . . . . . . 5770 2 46 . 2 2 6 6 THR HA H 1 4.44 0.02 . 1 . . . . . . . . 5770 2 47 . 2 2 6 6 THR CB C 13 70.9 0.30 . 1 . . . . . . . . 5770 2 48 . 2 2 6 6 THR HB H 1 4.65 0.02 . 1 . . . . . . . . 5770 2 49 . 2 2 6 6 THR HG21 H 1 1.37 0.02 . 1 . . . . . . . . 5770 2 50 . 2 2 6 6 THR HG22 H 1 1.37 0.02 . 1 . . . . . . . . 5770 2 51 . 2 2 6 6 THR HG23 H 1 1.37 0.02 . 1 . . . . . . . . 5770 2 52 . 2 2 6 6 THR CG2 C 13 22.0 0.30 . 1 . . . . . . . . 5770 2 53 . 2 2 6 6 THR C C 13 175.2 0.30 . 1 . . . . . . . . 5770 2 54 . 2 2 7 7 ASP N N 15 121.3 0.20 . 1 . . . . . . . . 5770 2 55 . 2 2 7 7 ASP H H 1 8.76 0.02 . 1 . . . . . . . . 5770 2 56 . 2 2 7 7 ASP CA C 13 57.4 0.30 . 1 . . . . . . . . 5770 2 57 . 2 2 7 7 ASP HA H 1 4.33 0.02 . 1 . . . . . . . . 5770 2 58 . 2 2 7 7 ASP CB C 13 39.7 0.30 . 1 . . . . . . . . 5770 2 59 . 2 2 7 7 ASP HB2 H 1 2.71 0.02 . 2 . . . . . . . . 5770 2 60 . 2 2 7 7 ASP HB3 H 1 2.64 0.02 . 2 . . . . . . . . 5770 2 61 . 2 2 7 7 ASP C C 13 178.6 0.30 . 1 . . . . . . . . 5770 2 62 . 2 2 8 8 SER N N 15 114.0 0.20 . 1 . . . . . . . . 5770 2 63 . 2 2 8 8 SER H H 1 8.31 0.02 . 1 . . . . . . . . 5770 2 64 . 2 2 8 8 SER CA C 13 61.5 0.30 . 1 . . . . . . . . 5770 2 65 . 2 2 8 8 SER HA H 1 4.25 0.02 . 1 . . . . . . . . 5770 2 66 . 2 2 8 8 SER CB C 13 62.6 0.30 . 1 . . . . . . . . 5770 2 67 . 2 2 8 8 SER HB2 H 1 3.90 0.02 . 1 . . . . . . . . 5770 2 68 . 2 2 8 8 SER HB3 H 1 3.90 0.02 . 1 . . . . . . . . 5770 2 69 . 2 2 8 8 SER C C 13 176.3 0.30 . 1 . . . . . . . . 5770 2 70 . 2 2 9 9 GLU N N 15 122.8 0.20 . 1 . . . . . . . . 5770 2 71 . 2 2 9 9 GLU H H 1 7.68 0.02 . 1 . . . . . . . . 5770 2 72 . 2 2 9 9 GLU CA C 13 59.8 0.30 . 1 . . . . . . . . 5770 2 73 . 2 2 9 9 GLU HA H 1 4.06 0.02 . 1 . . . . . . . . 5770 2 74 . 2 2 9 9 GLU CB C 13 30.2 0.30 . 1 . . . . . . . . 5770 2 75 . 2 2 9 9 GLU HB2 H 1 2.07 0.02 . 1 . . . . . . . . 5770 2 76 . 2 2 9 9 GLU HB3 H 1 2.07 0.02 . 1 . . . . . . . . 5770 2 77 . 2 2 9 9 GLU CG C 13 37.3 0.30 . 1 . . . . . . . . 5770 2 78 . 2 2 9 9 GLU HG2 H 1 2.46 0.02 . 2 . . . . . . . . 5770 2 79 . 2 2 9 9 GLU HG3 H 1 2.33 0.02 . 2 . . . . . . . . 5770 2 80 . 2 2 9 9 GLU C C 13 179.5 0.30 . 1 . . . . . . . . 5770 2 81 . 2 2 10 10 VAL N N 15 120.5 0.20 . 1 . . . . . . . . 5770 2 82 . 2 2 10 10 VAL H H 1 8.16 0.02 . 1 . . . . . . . . 5770 2 83 . 2 2 10 10 VAL CA C 13 66.4 0.30 . 1 . . . . . . . . 5770 2 84 . 2 2 10 10 VAL HA H 1 3.78 0.02 . 1 . . . . . . . . 5770 2 85 . 2 2 10 10 VAL CB C 13 32.2 0.30 . 1 . . . . . . . . 5770 2 86 . 2 2 10 10 VAL HB H 1 2.26 0.02 . 1 . . . . . . . . 5770 2 87 . 2 2 10 10 VAL HG11 H 1 1.10 0.02 . 2 . . . . . . . . 5770 2 88 . 2 2 10 10 VAL HG12 H 1 1.10 0.02 . 2 . . . . . . . . 5770 2 89 . 2 2 10 10 VAL HG13 H 1 1.10 0.02 . 2 . . . . . . . . 5770 2 90 . 2 2 10 10 VAL HG21 H 1 1.13 0.02 . 2 . . . . . . . . 5770 2 91 . 2 2 10 10 VAL HG22 H 1 1.13 0.02 . 2 . . . . . . . . 5770 2 92 . 2 2 10 10 VAL HG23 H 1 1.13 0.02 . 2 . . . . . . . . 5770 2 93 . 2 2 10 10 VAL CG1 C 13 23.1 0.30 . 1 . . . . . . . . 5770 2 94 . 2 2 10 10 VAL CG2 C 13 21.8 0.30 . 1 . . . . . . . . 5770 2 95 . 2 2 10 10 VAL C C 13 178.4 0.30 . 1 . . . . . . . . 5770 2 96 . 2 2 11 11 GLN N N 15 118.2 0.20 . 1 . . . . . . . . 5770 2 97 . 2 2 11 11 GLN H H 1 8.43 0.02 . 1 . . . . . . . . 5770 2 98 . 2 2 11 11 GLN CA C 13 60.0 0.30 . 1 . . . . . . . . 5770 2 99 . 2 2 11 11 GLN HA H 1 3.93 0.02 . 1 . . . . . . . . 5770 2 100 . 2 2 11 11 GLN CB C 13 28.5 0.30 . 1 . . . . . . . . 5770 2 101 . 2 2 11 11 GLN HB2 H 1 1.76 0.02 . 1 . . . . . . . . 5770 2 102 . 2 2 11 11 GLN HB3 H 1 1.76 0.02 . 1 . . . . . . . . 5770 2 103 . 2 2 11 11 GLN CG C 13 34.7 0.30 . 1 . . . . . . . . 5770 2 104 . 2 2 11 11 GLN HG2 H 1 2.58 0.02 . 1 . . . . . . . . 5770 2 105 . 2 2 11 11 GLN HG3 H 1 2.58 0.02 . 1 . . . . . . . . 5770 2 106 . 2 2 11 11 GLN CD C 13 177.7 0.30 . 1 . . . . . . . . 5770 2 107 . 2 2 11 11 GLN NE2 N 15 107.8 0.20 . 1 . . . . . . . . 5770 2 108 . 2 2 11 11 GLN HE21 H 1 6.62 0.02 . 2 . . . . . . . . 5770 2 109 . 2 2 11 11 GLN HE22 H 1 6.56 0.02 . 2 . . . . . . . . 5770 2 110 . 2 2 11 11 GLN C C 13 178.3 0.30 . 1 . . . . . . . . 5770 2 111 . 2 2 12 12 LEU N N 15 119.1 0.20 . 1 . . . . . . . . 5770 2 112 . 2 2 12 12 LEU H H 1 8.28 0.02 . 1 . . . . . . . . 5770 2 113 . 2 2 12 12 LEU CA C 13 58.3 0.30 . 1 . . . . . . . . 5770 2 114 . 2 2 12 12 LEU HA H 1 4.17 0.02 . 1 . . . . . . . . 5770 2 115 . 2 2 12 12 LEU CB C 13 41.6 0.30 . 1 . . . . . . . . 5770 2 116 . 2 2 12 12 LEU HB2 H 1 1.90 0.02 . 2 . . . . . . . . 5770 2 117 . 2 2 12 12 LEU HB3 H 1 1.82 0.02 . 2 . . . . . . . . 5770 2 118 . 2 2 12 12 LEU CG C 13 27.2 0.30 . 1 . . . . . . . . 5770 2 119 . 2 2 12 12 LEU HG H 1 1.77 0.02 . 1 . . . . . . . . 5770 2 120 . 2 2 12 12 LEU HD11 H 1 1.03 0.02 . 2 . . . . . . . . 5770 2 121 . 2 2 12 12 LEU HD12 H 1 1.03 0.02 . 2 . . . . . . . . 5770 2 122 . 2 2 12 12 LEU HD13 H 1 1.03 0.02 . 2 . . . . . . . . 5770 2 123 . 2 2 12 12 LEU HD21 H 1 1.01 0.02 . 2 . . . . . . . . 5770 2 124 . 2 2 12 12 LEU HD22 H 1 1.01 0.02 . 2 . . . . . . . . 5770 2 125 . 2 2 12 12 LEU HD23 H 1 1.01 0.02 . 2 . . . . . . . . 5770 2 126 . 2 2 12 12 LEU CD1 C 13 25.0 0.30 . 1 . . . . . . . . 5770 2 127 . 2 2 12 12 LEU CD2 C 13 23.6 0.30 . 1 . . . . . . . . 5770 2 128 . 2 2 12 12 LEU C C 13 180.1 0.30 . 1 . . . . . . . . 5770 2 129 . 2 2 13 13 GLU N N 15 121.6 0.20 . 1 . . . . . . . . 5770 2 130 . 2 2 13 13 GLU H H 1 8.30 0.02 . 1 . . . . . . . . 5770 2 131 . 2 2 13 13 GLU CA C 13 60.2 0.30 . 1 . . . . . . . . 5770 2 132 . 2 2 13 13 GLU HA H 1 4.16 0.02 . 1 . . . . . . . . 5770 2 133 . 2 2 13 13 GLU CB C 13 29.6 0.30 . 1 . . . . . . . . 5770 2 134 . 2 2 13 13 GLU HB2 H 1 2.26 0.02 . 1 . . . . . . . . 5770 2 135 . 2 2 13 13 GLU HB3 H 1 2.26 0.02 . 1 . . . . . . . . 5770 2 136 . 2 2 13 13 GLU CG C 13 36.3 0.30 . 1 . . . . . . . . 5770 2 137 . 2 2 13 13 GLU HG2 H 1 2.58 0.02 . 2 . . . . . . . . 5770 2 138 . 2 2 13 13 GLU HG3 H 1 2.37 0.02 . 2 . . . . . . . . 5770 2 139 . 2 2 13 13 GLU C C 13 180.1 0.30 . 1 . . . . . . . . 5770 2 140 . 2 2 14 14 MET N N 15 118.1 0.20 . 1 . . . . . . . . 5770 2 141 . 2 2 14 14 MET H H 1 8.54 0.02 . 1 . . . . . . . . 5770 2 142 . 2 2 14 14 MET CA C 13 57.4 0.30 . 1 . . . . . . . . 5770 2 143 . 2 2 14 14 MET HA H 1 4.72 0.02 . 1 . . . . . . . . 5770 2 144 . 2 2 14 14 MET CB C 13 33.5 0.30 . 1 . . . . . . . . 5770 2 145 . 2 2 14 14 MET HB2 H 1 3.01 0.02 . 2 . . . . . . . . 5770 2 146 . 2 2 14 14 MET HB3 H 1 2.83 0.02 . 2 . . . . . . . . 5770 2 147 . 2 2 14 14 MET CG C 13 34.0 0.30 . 1 . . . . . . . . 5770 2 148 . 2 2 14 14 MET HG2 H 1 3.08 0.02 . 1 . . . . . . . . 5770 2 149 . 2 2 14 14 MET HG3 H 1 3.08 0.02 . 1 . . . . . . . . 5770 2 150 . 2 2 14 14 MET HE1 H 1 2.09 0.02 . 1 . . . . . . . . 5770 2 151 . 2 2 14 14 MET HE2 H 1 2.09 0.02 . 1 . . . . . . . . 5770 2 152 . 2 2 14 14 MET HE3 H 1 2.09 0.02 . 1 . . . . . . . . 5770 2 153 . 2 2 14 14 MET CE C 13 19.4 0.30 . 1 . . . . . . . . 5770 2 154 . 2 2 14 14 MET C C 13 179.1 0.30 . 1 . . . . . . . . 5770 2 155 . 2 2 15 15 ILE N N 15 120.5 0.20 . 1 . . . . . . . . 5770 2 156 . 2 2 15 15 ILE H H 1 8.96 0.02 . 1 . . . . . . . . 5770 2 157 . 2 2 15 15 ILE CA C 13 64.0 0.30 . 1 . . . . . . . . 5770 2 158 . 2 2 15 15 ILE HA H 1 4.15 0.02 . 1 . . . . . . . . 5770 2 159 . 2 2 15 15 ILE CB C 13 36.6 0.30 . 1 . . . . . . . . 5770 2 160 . 2 2 15 15 ILE HB H 1 2.27 0.02 . 1 . . . . . . . . 5770 2 161 . 2 2 15 15 ILE HG21 H 1 1.02 0.02 . 1 . . . . . . . . 5770 2 162 . 2 2 15 15 ILE HG22 H 1 1.02 0.02 . 1 . . . . . . . . 5770 2 163 . 2 2 15 15 ILE HG23 H 1 1.02 0.02 . 1 . . . . . . . . 5770 2 164 . 2 2 15 15 ILE CG2 C 13 18.4 0.30 . 1 . . . . . . . . 5770 2 165 . 2 2 15 15 ILE CG1 C 13 28.6 0.30 . 1 . . . . . . . . 5770 2 166 . 2 2 15 15 ILE HG12 H 1 1.71 0.02 . 1 . . . . . . . . 5770 2 167 . 2 2 15 15 ILE HG13 H 1 1.71 0.02 . 1 . . . . . . . . 5770 2 168 . 2 2 15 15 ILE HD11 H 1 0.84 0.02 . 1 . . . . . . . . 5770 2 169 . 2 2 15 15 ILE HD12 H 1 0.84 0.02 . 1 . . . . . . . . 5770 2 170 . 2 2 15 15 ILE HD13 H 1 0.84 0.02 . 1 . . . . . . . . 5770 2 171 . 2 2 15 15 ILE CD1 C 13 13.0 0.30 . 1 . . . . . . . . 5770 2 172 . 2 2 15 15 ILE C C 13 178.1 0.30 . 1 . . . . . . . . 5770 2 173 . 2 2 16 16 THR N N 15 118.2 0.20 . 1 . . . . . . . . 5770 2 174 . 2 2 16 16 THR H H 1 8.47 0.02 . 1 . . . . . . . . 5770 2 175 . 2 2 16 16 THR CA C 13 67.6 0.30 . 1 . . . . . . . . 5770 2 176 . 2 2 16 16 THR HA H 1 3.94 0.02 . 1 . . . . . . . . 5770 2 177 . 2 2 16 16 THR CB C 13 68.7 0.30 . 1 . . . . . . . . 5770 2 178 . 2 2 16 16 THR HB H 1 4.44 0.02 . 1 . . . . . . . . 5770 2 179 . 2 2 16 16 THR HG21 H 1 1.33 0.02 . 1 . . . . . . . . 5770 2 180 . 2 2 16 16 THR HG22 H 1 1.33 0.02 . 1 . . . . . . . . 5770 2 181 . 2 2 16 16 THR HG23 H 1 1.33 0.02 . 1 . . . . . . . . 5770 2 182 . 2 2 16 16 THR CG2 C 13 21.3 0.30 . 1 . . . . . . . . 5770 2 183 . 2 2 16 16 THR C C 13 176.5 0.30 . 1 . . . . . . . . 5770 2 184 . 2 2 17 17 ALA N N 15 124.2 0.20 . 1 . . . . . . . . 5770 2 185 . 2 2 17 17 ALA H H 1 7.90 0.02 . 1 . . . . . . . . 5770 2 186 . 2 2 17 17 ALA CA C 13 55.4 0.30 . 1 . . . . . . . . 5770 2 187 . 2 2 17 17 ALA HA H 1 4.23 0.02 . 1 . . . . . . . . 5770 2 188 . 2 2 17 17 ALA HB1 H 1 1.62 0.02 . 1 . . . . . . . . 5770 2 189 . 2 2 17 17 ALA HB2 H 1 1.62 0.02 . 1 . . . . . . . . 5770 2 190 . 2 2 17 17 ALA HB3 H 1 1.62 0.02 . 1 . . . . . . . . 5770 2 191 . 2 2 17 17 ALA CB C 13 18.6 0.30 . 1 . . . . . . . . 5770 2 192 . 2 2 17 17 ALA C C 13 179.7 0.30 . 1 . . . . . . . . 5770 2 193 . 2 2 18 18 TRP N N 15 124.3 0.20 . 1 . . . . . . . . 5770 2 194 . 2 2 18 18 TRP H H 1 8.74 0.02 . 1 . . . . . . . . 5770 2 195 . 2 2 18 18 TRP CA C 13 59.2 0.30 . 1 . . . . . . . . 5770 2 196 . 2 2 18 18 TRP HA H 1 4.61 0.02 . 1 . . . . . . . . 5770 2 197 . 2 2 18 18 TRP CB C 13 29.7 0.30 . 1 . . . . . . . . 5770 2 198 . 2 2 18 18 TRP HB2 H 1 3.44 0.02 . 1 . . . . . . . . 5770 2 199 . 2 2 18 18 TRP HB3 H 1 3.44 0.02 . 1 . . . . . . . . 5770 2 200 . 2 2 18 18 TRP CD1 C 13 124.9 0.30 . 1 . . . . . . . . 5770 2 201 . 2 2 18 18 TRP CE3 C 13 119.7 0.30 . 1 . . . . . . . . 5770 2 202 . 2 2 18 18 TRP NE1 N 15 128.1 0.20 . 1 . . . . . . . . 5770 2 203 . 2 2 18 18 TRP HD1 H 1 7.64 0.02 . 1 . . . . . . . . 5770 2 204 . 2 2 18 18 TRP HE3 H 1 7.11 0.02 . 1 . . . . . . . . 5770 2 205 . 2 2 18 18 TRP CZ3 C 13 121.1 0.30 . 1 . . . . . . . . 5770 2 206 . 2 2 18 18 TRP CZ2 C 13 113.4 0.30 . 1 . . . . . . . . 5770 2 207 . 2 2 18 18 TRP HE1 H 1 9.95 0.02 . 1 . . . . . . . . 5770 2 208 . 2 2 18 18 TRP HZ3 H 1 6.54 0.02 . 1 . . . . . . . . 5770 2 209 . 2 2 18 18 TRP CH2 C 13 122.8 0.30 . 1 . . . . . . . . 5770 2 210 . 2 2 18 18 TRP HZ2 H 1 7.24 0.02 . 1 . . . . . . . . 5770 2 211 . 2 2 18 18 TRP HH2 H 1 6.87 0.02 . 1 . . . . . . . . 5770 2 212 . 2 2 18 18 TRP C C 13 179.7 0.30 . 1 . . . . . . . . 5770 2 213 . 2 2 19 19 LYS N N 15 119.2 0.20 . 1 . . . . . . . . 5770 2 214 . 2 2 19 19 LYS H H 1 8.94 0.02 . 1 . . . . . . . . 5770 2 215 . 2 2 19 19 LYS CA C 13 60.7 0.30 . 1 . . . . . . . . 5770 2 216 . 2 2 19 19 LYS HA H 1 4.04 0.02 . 1 . . . . . . . . 5770 2 217 . 2 2 19 19 LYS CB C 13 32.6 0.30 . 1 . . . . . . . . 5770 2 218 . 2 2 19 19 LYS HB2 H 1 2.06 0.02 . 2 . . . . . . . . 5770 2 219 . 2 2 19 19 LYS HB3 H 1 2.02 0.02 . 2 . . . . . . . . 5770 2 220 . 2 2 19 19 LYS CG C 13 25.8 0.30 . 1 . . . . . . . . 5770 2 221 . 2 2 19 19 LYS HG2 H 1 1.83 0.02 . 2 . . . . . . . . 5770 2 222 . 2 2 19 19 LYS HG3 H 1 1.51 0.02 . 2 . . . . . . . . 5770 2 223 . 2 2 19 19 LYS CD C 13 30.0 0.30 . 1 . . . . . . . . 5770 2 224 . 2 2 19 19 LYS HD2 H 1 1.69 0.02 . 1 . . . . . . . . 5770 2 225 . 2 2 19 19 LYS HD3 H 1 1.69 0.02 . 1 . . . . . . . . 5770 2 226 . 2 2 19 19 LYS CE C 13 41.5 0.30 . 1 . . . . . . . . 5770 2 227 . 2 2 19 19 LYS HE2 H 1 2.87 0.02 . 1 . . . . . . . . 5770 2 228 . 2 2 19 19 LYS HE3 H 1 2.87 0.02 . 1 . . . . . . . . 5770 2 229 . 2 2 19 19 LYS C C 13 179.6 0.30 . 1 . . . . . . . . 5770 2 230 . 2 2 20 20 LYS N N 15 120.3 0.20 . 1 . . . . . . . . 5770 2 231 . 2 2 20 20 LYS H H 1 8.14 0.02 . 1 . . . . . . . . 5770 2 232 . 2 2 20 20 LYS CA C 13 59.4 0.30 . 1 . . . . . . . . 5770 2 233 . 2 2 20 20 LYS HA H 1 4.15 0.02 . 1 . . . . . . . . 5770 2 234 . 2 2 20 20 LYS CB C 13 32.2 0.30 . 1 . . . . . . . . 5770 2 235 . 2 2 20 20 LYS HB2 H 1 2.01 0.02 . 1 . . . . . . . . 5770 2 236 . 2 2 20 20 LYS HB3 H 1 2.01 0.02 . 1 . . . . . . . . 5770 2 237 . 2 2 20 20 LYS CG C 13 24.9 0.30 . 1 . . . . . . . . 5770 2 238 . 2 2 20 20 LYS HG2 H 1 1.52 0.02 . 1 . . . . . . . . 5770 2 239 . 2 2 20 20 LYS HG3 H 1 1.52 0.02 . 1 . . . . . . . . 5770 2 240 . 2 2 20 20 LYS CD C 13 29.2 0.30 . 1 . . . . . . . . 5770 2 241 . 2 2 20 20 LYS HD2 H 1 1.74 0.02 . 2 . . . . . . . . 5770 2 242 . 2 2 20 20 LYS HD3 H 1 1.66 0.02 . 2 . . . . . . . . 5770 2 243 . 2 2 20 20 LYS CE C 13 42.2 0.30 . 1 . . . . . . . . 5770 2 244 . 2 2 20 20 LYS HE2 H 1 3.01 0.02 . 1 . . . . . . . . 5770 2 245 . 2 2 20 20 LYS HE3 H 1 3.01 0.02 . 1 . . . . . . . . 5770 2 246 . 2 2 20 20 LYS C C 13 178.0 0.30 . 1 . . . . . . . . 5770 2 247 . 2 2 21 21 PHE N N 15 121.1 0.20 . 1 . . . . . . . . 5770 2 248 . 2 2 21 21 PHE H H 1 8.34 0.02 . 1 . . . . . . . . 5770 2 249 . 2 2 21 21 PHE CA C 13 61.1 0.30 . 1 . . . . . . . . 5770 2 250 . 2 2 21 21 PHE HA H 1 4.24 0.02 . 1 . . . . . . . . 5770 2 251 . 2 2 21 21 PHE CB C 13 38.7 0.30 . 1 . . . . . . . . 5770 2 252 . 2 2 21 21 PHE HB2 H 1 3.46 0.02 . 2 . . . . . . . . 5770 2 253 . 2 2 21 21 PHE HB3 H 1 3.20 0.02 . 2 . . . . . . . . 5770 2 254 . 2 2 21 21 PHE HD1 H 1 7.29 0.02 . 1 . . . . . . . . 5770 2 255 . 2 2 21 21 PHE HD2 H 1 7.29 0.02 . 1 . . . . . . . . 5770 2 256 . 2 2 21 21 PHE HE1 H 1 7.23 0.02 . 1 . . . . . . . . 5770 2 257 . 2 2 21 21 PHE HE2 H 1 7.23 0.02 . 1 . . . . . . . . 5770 2 258 . 2 2 21 21 PHE CD1 C 13 132.6 0.30 . 1 . . . . . . . . 5770 2 259 . 2 2 21 21 PHE HZ H 1 7.11 0.02 . 1 . . . . . . . . 5770 2 260 . 2 2 21 21 PHE CD2 C 13 132.6 0.30 . 1 . . . . . . . . 5770 2 261 . 2 2 21 21 PHE C C 13 177.7 0.30 . 1 . . . . . . . . 5770 2 262 . 2 2 22 22 VAL N N 15 118.4 0.20 . 1 . . . . . . . . 5770 2 263 . 2 2 22 22 VAL H H 1 8.14 0.02 . 1 . . . . . . . . 5770 2 264 . 2 2 22 22 VAL CA C 13 66.8 0.30 . 1 . . . . . . . . 5770 2 265 . 2 2 22 22 VAL HA H 1 3.47 0.02 . 1 . . . . . . . . 5770 2 266 . 2 2 22 22 VAL CB C 13 31.9 0.30 . 1 . . . . . . . . 5770 2 267 . 2 2 22 22 VAL HB H 1 2.41 0.02 . 1 . . . . . . . . 5770 2 268 . 2 2 22 22 VAL HG11 H 1 1.47 0.02 . 2 . . . . . . . . 5770 2 269 . 2 2 22 22 VAL HG12 H 1 1.47 0.02 . 2 . . . . . . . . 5770 2 270 . 2 2 22 22 VAL HG13 H 1 1.47 0.02 . 2 . . . . . . . . 5770 2 271 . 2 2 22 22 VAL HG21 H 1 1.04 0.02 . 2 . . . . . . . . 5770 2 272 . 2 2 22 22 VAL HG22 H 1 1.04 0.02 . 2 . . . . . . . . 5770 2 273 . 2 2 22 22 VAL HG23 H 1 1.04 0.02 . 2 . . . . . . . . 5770 2 274 . 2 2 22 22 VAL CG1 C 13 24.6 0.30 . 1 . . . . . . . . 5770 2 275 . 2 2 22 22 VAL CG2 C 13 21.9 0.30 . 1 . . . . . . . . 5770 2 276 . 2 2 22 22 VAL C C 13 177.4 0.30 . 1 . . . . . . . . 5770 2 277 . 2 2 23 23 GLU N N 15 119.2 0.20 . 1 . . . . . . . . 5770 2 278 . 2 2 23 23 GLU H H 1 8.21 0.02 . 1 . . . . . . . . 5770 2 279 . 2 2 23 23 GLU CA C 13 59.3 0.30 . 1 . . . . . . . . 5770 2 280 . 2 2 23 23 GLU HA H 1 3.97 0.02 . 1 . . . . . . . . 5770 2 281 . 2 2 23 23 GLU CB C 13 29.6 0.30 . 1 . . . . . . . . 5770 2 282 . 2 2 23 23 GLU HB2 H 1 2.21 0.02 . 2 . . . . . . . . 5770 2 283 . 2 2 23 23 GLU HB3 H 1 2.17 0.02 . 2 . . . . . . . . 5770 2 284 . 2 2 23 23 GLU CG C 13 36.4 0.30 . 1 . . . . . . . . 5770 2 285 . 2 2 23 23 GLU HG2 H 1 2.44 0.02 . 2 . . . . . . . . 5770 2 286 . 2 2 23 23 GLU HG3 H 1 2.32 0.02 . 2 . . . . . . . . 5770 2 287 . 2 2 23 23 GLU C C 13 179.3 0.30 . 1 . . . . . . . . 5770 2 288 . 2 2 24 24 GLU N N 15 117.9 0.20 . 1 . . . . . . . . 5770 2 289 . 2 2 24 24 GLU H H 1 8.05 0.02 . 1 . . . . . . . . 5770 2 290 . 2 2 24 24 GLU CA C 13 58.6 0.30 . 1 . . . . . . . . 5770 2 291 . 2 2 24 24 GLU HA H 1 4.01 0.02 . 1 . . . . . . . . 5770 2 292 . 2 2 24 24 GLU CB C 13 29.4 0.30 . 1 . . . . . . . . 5770 2 293 . 2 2 24 24 GLU HB2 H 1 2.10 0.02 . 2 . . . . . . . . 5770 2 294 . 2 2 24 24 GLU HB3 H 1 2.05 0.02 . 2 . . . . . . . . 5770 2 295 . 2 2 24 24 GLU CG C 13 36.5 0.30 . 1 . . . . . . . . 5770 2 296 . 2 2 24 24 GLU HG2 H 1 2.45 0.02 . 2 . . . . . . . . 5770 2 297 . 2 2 24 24 GLU HG3 H 1 2.30 0.02 . 2 . . . . . . . . 5770 2 298 . 2 2 24 24 GLU C C 13 178.9 0.30 . 1 . . . . . . . . 5770 2 299 . 2 2 25 25 LYS N N 15 118.9 0.20 . 1 . . . . . . . . 5770 2 300 . 2 2 25 25 LYS H H 1 7.67 0.02 . 1 . . . . . . . . 5770 2 301 . 2 2 25 25 LYS CA C 13 57.4 0.30 . 1 . . . . . . . . 5770 2 302 . 2 2 25 25 LYS HA H 1 3.98 0.02 . 1 . . . . . . . . 5770 2 303 . 2 2 25 25 LYS CB C 13 32.1 0.30 . 1 . . . . . . . . 5770 2 304 . 2 2 25 25 LYS HB2 H 1 1.72 0.02 . 1 . . . . . . . . 5770 2 305 . 2 2 25 25 LYS HB3 H 1 1.72 0.02 . 1 . . . . . . . . 5770 2 306 . 2 2 25 25 LYS CG C 13 24.3 0.30 . 1 . . . . . . . . 5770 2 307 . 2 2 25 25 LYS HG2 H 1 1.29 0.02 . 1 . . . . . . . . 5770 2 308 . 2 2 25 25 LYS HG3 H 1 1.29 0.02 . 1 . . . . . . . . 5770 2 309 . 2 2 25 25 LYS CD C 13 28.5 0.30 . 1 . . . . . . . . 5770 2 310 . 2 2 25 25 LYS HD2 H 1 1.52 0.02 . 1 . . . . . . . . 5770 2 311 . 2 2 25 25 LYS HD3 H 1 1.52 0.02 . 1 . . . . . . . . 5770 2 312 . 2 2 25 25 LYS CE C 13 41.9 0.30 . 1 . . . . . . . . 5770 2 313 . 2 2 25 25 LYS HE2 H 1 2.99 0.02 . 2 . . . . . . . . 5770 2 314 . 2 2 25 25 LYS HE3 H 1 2.92 0.02 . 2 . . . . . . . . 5770 2 315 . 2 2 25 25 LYS C C 13 178.1 0.30 . 1 . . . . . . . . 5770 2 316 . 2 2 26 26 LYS N N 15 117.9 0.20 . 1 . . . . . . . . 5770 2 317 . 2 2 26 26 LYS H H 1 7.67 0.02 . 1 . . . . . . . . 5770 2 318 . 2 2 26 26 LYS CA C 13 57.2 0.30 . 1 . . . . . . . . 5770 2 319 . 2 2 26 26 LYS HA H 1 4.21 0.02 . 1 . . . . . . . . 5770 2 320 . 2 2 26 26 LYS CB C 13 32.7 0.30 . 1 . . . . . . . . 5770 2 321 . 2 2 26 26 LYS HB2 H 1 1.92 0.02 . 2 . . . . . . . . 5770 2 322 . 2 2 26 26 LYS HB3 H 1 1.83 0.02 . 2 . . . . . . . . 5770 2 323 . 2 2 26 26 LYS CG C 13 25.1 0.30 . 1 . . . . . . . . 5770 2 324 . 2 2 26 26 LYS HG2 H 1 1.46 0.02 . 1 . . . . . . . . 5770 2 325 . 2 2 26 26 LYS HG3 H 1 1.46 0.02 . 1 . . . . . . . . 5770 2 326 . 2 2 26 26 LYS CD C 13 29.4 0.30 . 1 . . . . . . . . 5770 2 327 . 2 2 26 26 LYS HD2 H 1 1.64 0.02 . 1 . . . . . . . . 5770 2 328 . 2 2 26 26 LYS HD3 H 1 1.64 0.02 . 1 . . . . . . . . 5770 2 329 . 2 2 26 26 LYS CE C 13 42.0 0.30 . 1 . . . . . . . . 5770 2 330 . 2 2 26 26 LYS HE2 H 1 2.94 0.02 . 1 . . . . . . . . 5770 2 331 . 2 2 26 26 LYS HE3 H 1 2.94 0.02 . 1 . . . . . . . . 5770 2 332 . 2 2 26 26 LYS C C 13 176.9 0.30 . 1 . . . . . . . . 5770 2 333 . 2 2 27 27 LYS N N 15 120.9 0.20 . 1 . . . . . . . . 5770 2 334 . 2 2 27 27 LYS H H 1 7.64 0.02 . 1 . . . . . . . . 5770 2 335 . 2 2 27 27 LYS CA C 13 56.8 0.30 . 1 . . . . . . . . 5770 2 336 . 2 2 27 27 LYS HA H 1 4.29 0.02 . 1 . . . . . . . . 5770 2 337 . 2 2 27 27 LYS CB C 13 32.6 0.30 . 1 . . . . . . . . 5770 2 338 . 2 2 27 27 LYS HB2 H 1 1.93 0.02 . 2 . . . . . . . . 5770 2 339 . 2 2 27 27 LYS HB3 H 1 1.85 0.02 . 2 . . . . . . . . 5770 2 340 . 2 2 27 27 LYS CG C 13 24.9 0.30 . 1 . . . . . . . . 5770 2 341 . 2 2 27 27 LYS HG2 H 1 1.54 0.02 . 2 . . . . . . . . 5770 2 342 . 2 2 27 27 LYS HG3 H 1 1.46 0.02 . 2 . . . . . . . . 5770 2 343 . 2 2 27 27 LYS CD C 13 29.3 0.30 . 1 . . . . . . . . 5770 2 344 . 2 2 27 27 LYS HD2 H 1 1.72 0.02 . 1 . . . . . . . . 5770 2 345 . 2 2 27 27 LYS HD3 H 1 1.72 0.02 . 1 . . . . . . . . 5770 2 346 . 2 2 27 27 LYS CE C 13 42.2 0.30 . 1 . . . . . . . . 5770 2 347 . 2 2 27 27 LYS HE2 H 1 3.04 0.02 . 1 . . . . . . . . 5770 2 348 . 2 2 27 27 LYS HE3 H 1 3.04 0.02 . 1 . . . . . . . . 5770 2 349 . 2 2 28 28 LYS N N 15 127.5 0.20 . 1 . . . . . . . . 5770 2 350 . 2 2 28 28 LYS H H 1 7.74 0.02 . 1 . . . . . . . . 5770 2 351 . 2 2 28 28 LYS CA C 13 57.4 0.30 . 1 . . . . . . . . 5770 2 352 . 2 2 28 28 LYS HA H 1 4.18 0.02 . 1 . . . . . . . . 5770 2 353 . 2 2 28 28 LYS CB C 13 33.6 0.30 . 1 . . . . . . . . 5770 2 354 . 2 2 28 28 LYS HB2 H 1 1.86 0.02 . 2 . . . . . . . . 5770 2 355 . 2 2 28 28 LYS HB3 H 1 1.75 0.02 . 2 . . . . . . . . 5770 2 356 . 2 2 28 28 LYS CG C 13 25.2 0.30 . 1 . . . . . . . . 5770 2 357 . 2 2 28 28 LYS HG2 H 1 1.46 0.02 . 1 . . . . . . . . 5770 2 358 . 2 2 28 28 LYS HG3 H 1 1.46 0.02 . 1 . . . . . . . . 5770 2 359 . 2 2 28 28 LYS CD C 13 29.2 0.30 . 1 . . . . . . . . 5770 2 360 . 2 2 28 28 LYS HD2 H 1 1.71 0.02 . 1 . . . . . . . . 5770 2 361 . 2 2 28 28 LYS HD3 H 1 1.71 0.02 . 1 . . . . . . . . 5770 2 362 . 2 2 28 28 LYS CE C 13 42.4 0.30 . 1 . . . . . . . . 5770 2 363 . 2 2 28 28 LYS HE2 H 1 3.04 0.02 . 1 . . . . . . . . 5770 2 364 . 2 2 28 28 LYS HE3 H 1 3.04 0.02 . 1 . . . . . . . . 5770 2 stop_ save_ save_shift_set_3 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode shift_set_3 _Assigned_chem_shift_list.Entry_ID 5770 _Assigned_chem_shift_list.ID 3 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Ex-cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 . 5770 3 . . 2 $sample_2 . 5770 3 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 . 3 2 3 3 HIS CA C 13 55.9 0.30 . 1 . . . . . . . . 5770 3 2 . 3 2 3 3 HIS HA H 1 4.72 0.02 . 1 . . . . . . . . 5770 3 3 . 3 2 3 3 HIS CB C 13 30.2 0.30 . 1 . . . . . . . . 5770 3 4 . 3 2 3 3 HIS HB2 H 1 3.23 0.02 . 2 . . . . . . . . 5770 3 5 . 3 2 3 3 HIS HB3 H 1 3.16 0.02 . 2 . . . . . . . . 5770 3 6 . 3 2 3 3 HIS CD2 C 13 119.7 0.30 . 1 . . . . . . . . 5770 3 7 . 3 2 3 3 HIS HD2 H 1 7.14 0.02 . 1 . . . . . . . . 5770 3 8 . 3 2 3 3 HIS C C 13 174.5 0.30 . 1 . . . . . . . . 5770 3 9 . 3 2 4 4 LYS N N 15 123.8 0.20 . 1 . . . . . . . . 5770 3 10 . 3 2 4 4 LYS H H 1 8.32 0.02 . 1 . . . . . . . . 5770 3 11 . 3 2 4 4 LYS CA C 13 55.8 0.30 . 1 . . . . . . . . 5770 3 12 . 3 2 4 4 LYS HA H 1 4.33 0.02 . 1 . . . . . . . . 5770 3 13 . 3 2 4 4 LYS CB C 13 33.1 0.30 . 1 . . . . . . . . 5770 3 14 . 3 2 4 4 LYS HB2 H 1 1.80 0.02 . 1 . . . . . . . . 5770 3 15 . 3 2 4 4 LYS HB3 H 1 1.80 0.02 . 1 . . . . . . . . 5770 3 16 . 3 2 4 4 LYS CG C 13 24.5 0.30 . 1 . . . . . . . . 5770 3 17 . 3 2 4 4 LYS HG2 H 1 1.44 0.02 . 1 . . . . . . . . 5770 3 18 . 3 2 4 4 LYS HG3 H 1 1.44 0.02 . 1 . . . . . . . . 5770 3 19 . 3 2 4 4 LYS CD C 13 28.9 0.30 . 1 . . . . . . . . 5770 3 20 . 3 2 4 4 LYS HD2 H 1 1.73 0.02 . 1 . . . . . . . . 5770 3 21 . 3 2 4 4 LYS HD3 H 1 1.73 0.02 . 1 . . . . . . . . 5770 3 22 . 3 2 4 4 LYS CE C 13 42.2 0.30 . 1 . . . . . . . . 5770 3 23 . 3 2 4 4 LYS HE2 H 1 3.04 0.02 . 1 . . . . . . . . 5770 3 24 . 3 2 4 4 LYS HE3 H 1 3.04 0.02 . 1 . . . . . . . . 5770 3 25 . 3 2 4 4 LYS C C 13 176.3 0.30 . 1 . . . . . . . . 5770 3 26 . 3 2 5 5 LYS N N 15 124.1 0.20 . 1 . . . . . . . . 5770 3 27 . 3 2 5 5 LYS H H 1 8.38 0.02 . 1 . . . . . . . . 5770 3 28 . 3 2 5 5 LYS CA C 13 56.5 0.30 . 1 . . . . . . . . 5770 3 29 . 3 2 5 5 LYS HA H 1 4.49 0.02 . 1 . . . . . . . . 5770 3 30 . 3 2 5 5 LYS CB C 13 34.5 0.30 . 1 . . . . . . . . 5770 3 31 . 3 2 5 5 LYS HB2 H 1 1.89 0.02 . 2 . . . . . . . . 5770 3 32 . 3 2 5 5 LYS HB3 H 1 1.67 0.02 . 2 . . . . . . . . 5770 3 33 . 3 2 5 5 LYS CG C 13 25.7 0.30 . 1 . . . . . . . . 5770 3 34 . 3 2 5 5 LYS HG2 H 1 1.49 0.02 . 1 . . . . . . . . 5770 3 35 . 3 2 5 5 LYS HG3 H 1 1.49 0.02 . 1 . . . . . . . . 5770 3 36 . 3 2 5 5 LYS CD C 13 29.9 0.30 . 1 . . . . . . . . 5770 3 37 . 3 2 5 5 LYS HD2 H 1 1.64 0.02 . 1 . . . . . . . . 5770 3 38 . 3 2 5 5 LYS HD3 H 1 1.64 0.02 . 1 . . . . . . . . 5770 3 39 . 3 2 5 5 LYS CE C 13 42.0 0.30 . 1 . . . . . . . . 5770 3 40 . 3 2 5 5 LYS HE2 H 1 2.98 0.02 . 1 . . . . . . . . 5770 3 41 . 3 2 5 5 LYS HE3 H 1 2.98 0.02 . 1 . . . . . . . . 5770 3 42 . 3 2 5 5 LYS C C 13 177.3 0.30 . 1 . . . . . . . . 5770 3 43 . 3 2 6 6 THR N N 15 114.2 0.20 . 1 . . . . . . . . 5770 3 44 . 3 2 6 6 THR H H 1 8.65 0.02 . 1 . . . . . . . . 5770 3 45 . 3 2 6 6 THR CA C 13 61.2 0.30 . 1 . . . . . . . . 5770 3 46 . 3 2 6 6 THR HA H 1 4.47 0.02 . 1 . . . . . . . . 5770 3 47 . 3 2 6 6 THR CB C 13 70.9 0.30 . 1 . . . . . . . . 5770 3 48 . 3 2 6 6 THR HB H 1 4.65 0.02 . 1 . . . . . . . . 5770 3 49 . 3 2 6 6 THR HG21 H 1 1.38 0.02 . 1 . . . . . . . . 5770 3 50 . 3 2 6 6 THR HG22 H 1 1.38 0.02 . 1 . . . . . . . . 5770 3 51 . 3 2 6 6 THR HG23 H 1 1.38 0.02 . 1 . . . . . . . . 5770 3 52 . 3 2 6 6 THR CG2 C 13 22.1 0.30 . 1 . . . . . . . . 5770 3 53 . 3 2 6 6 THR C C 13 175.2 0.30 . 1 . . . . . . . . 5770 3 54 . 3 2 7 7 ASP N N 15 121.3 0.20 . 1 . . . . . . . . 5770 3 55 . 3 2 7 7 ASP H H 1 8.75 0.02 . 1 . . . . . . . . 5770 3 56 . 3 2 7 7 ASP CA C 13 57.4 0.30 . 1 . . . . . . . . 5770 3 57 . 3 2 7 7 ASP HA H 1 4.31 0.02 . 1 . . . . . . . . 5770 3 58 . 3 2 7 7 ASP CB C 13 39.7 0.30 . 1 . . . . . . . . 5770 3 59 . 3 2 7 7 ASP HB2 H 1 2.71 0.02 . 2 . . . . . . . . 5770 3 60 . 3 2 7 7 ASP HB3 H 1 2.58 0.02 . 2 . . . . . . . . 5770 3 61 . 3 2 7 7 ASP C C 13 178.7 0.30 . 1 . . . . . . . . 5770 3 62 . 3 2 8 8 SER N N 15 114.0 0.20 . 1 . . . . . . . . 5770 3 63 . 3 2 8 8 SER H H 1 8.30 0.02 . 1 . . . . . . . . 5770 3 64 . 3 2 8 8 SER CA C 13 61.5 0.30 . 1 . . . . . . . . 5770 3 65 . 3 2 8 8 SER HA H 1 4.41 0.02 . 1 . . . . . . . . 5770 3 66 . 3 2 8 8 SER CB C 13 64.0 0.30 . 1 . . . . . . . . 5770 3 67 . 3 2 8 8 SER HB2 H 1 3.86 0.02 . 1 . . . . . . . . 5770 3 68 . 3 2 8 8 SER HB3 H 1 3.86 0.02 . 1 . . . . . . . . 5770 3 69 . 3 2 8 8 SER C C 13 176.5 0.30 . 1 . . . . . . . . 5770 3 70 . 3 2 9 9 GLU N N 15 122.7 0.20 . 1 . . . . . . . . 5770 3 71 . 3 2 9 9 GLU H H 1 7.58 0.02 . 1 . . . . . . . . 5770 3 72 . 3 2 9 9 GLU CA C 13 59.6 0.30 . 1 . . . . . . . . 5770 3 73 . 3 2 9 9 GLU HA H 1 4.06 0.02 . 1 . . . . . . . . 5770 3 74 . 3 2 9 9 GLU CB C 13 30.1 0.30 . 1 . . . . . . . . 5770 3 75 . 3 2 9 9 GLU HB2 H 1 2.08 0.02 . 1 . . . . . . . . 5770 3 76 . 3 2 9 9 GLU HB3 H 1 2.08 0.02 . 1 . . . . . . . . 5770 3 77 . 3 2 9 9 GLU CG C 13 37.5 0.30 . 1 . . . . . . . . 5770 3 78 . 3 2 9 9 GLU HG2 H 1 2.47 0.02 . 2 . . . . . . . . 5770 3 79 . 3 2 9 9 GLU HG3 H 1 2.34 0.02 . 2 . . . . . . . . 5770 3 80 . 3 2 9 9 GLU C C 13 179.7 0.30 . 1 . . . . . . . . 5770 3 81 . 3 2 10 10 VAL N N 15 121.0 0.20 . 1 . . . . . . . . 5770 3 82 . 3 2 10 10 VAL H H 1 8.21 0.02 . 1 . . . . . . . . 5770 3 83 . 3 2 10 10 VAL CA C 13 66.8 0.30 . 1 . . . . . . . . 5770 3 84 . 3 2 10 10 VAL HA H 1 3.82 0.02 . 1 . . . . . . . . 5770 3 85 . 3 2 10 10 VAL CB C 13 31.8 0.30 . 1 . . . . . . . . 5770 3 86 . 3 2 10 10 VAL HB H 1 2.28 0.02 . 1 . . . . . . . . 5770 3 87 . 3 2 10 10 VAL HG11 H 1 1.12 0.02 . 1 . . . . . . . . 5770 3 88 . 3 2 10 10 VAL HG12 H 1 1.12 0.02 . 1 . . . . . . . . 5770 3 89 . 3 2 10 10 VAL HG13 H 1 1.12 0.02 . 1 . . . . . . . . 5770 3 90 . 3 2 10 10 VAL HG21 H 1 1.12 0.02 . 1 . . . . . . . . 5770 3 91 . 3 2 10 10 VAL HG22 H 1 1.12 0.02 . 1 . . . . . . . . 5770 3 92 . 3 2 10 10 VAL HG23 H 1 1.12 0.02 . 1 . . . . . . . . 5770 3 93 . 3 2 10 10 VAL CG1 C 13 23.1 0.30 . 1 . . . . . . . . 5770 3 94 . 3 2 10 10 VAL CG2 C 13 22.1 0.30 . 1 . . . . . . . . 5770 3 95 . 3 2 10 10 VAL C C 13 178.9 0.30 . 1 . . . . . . . . 5770 3 96 . 3 2 11 11 GLN N N 15 117.7 0.20 . 1 . . . . . . . . 5770 3 97 . 3 2 11 11 GLN H H 1 8.58 0.02 . 1 . . . . . . . . 5770 3 98 . 3 2 11 11 GLN CA C 13 60.2 0.30 . 1 . . . . . . . . 5770 3 99 . 3 2 11 11 GLN HA H 1 3.93 0.02 . 1 . . . . . . . . 5770 3 100 . 3 2 11 11 GLN CB C 13 28.8 0.30 . 1 . . . . . . . . 5770 3 101 . 3 2 11 11 GLN HB2 H 1 1.46 0.02 . 1 . . . . . . . . 5770 3 102 . 3 2 11 11 GLN HB3 H 1 1.46 0.02 . 1 . . . . . . . . 5770 3 103 . 3 2 11 11 GLN CG C 13 35.5 0.30 . 1 . . . . . . . . 5770 3 104 . 3 2 11 11 GLN HG2 H 1 2.54 0.02 . 1 . . . . . . . . 5770 3 105 . 3 2 11 11 GLN HG3 H 1 2.54 0.02 . 1 . . . . . . . . 5770 3 106 . 3 2 11 11 GLN CD C 13 176.9 0.30 . 1 . . . . . . . . 5770 3 107 . 3 2 11 11 GLN NE2 N 15 108.0 0.20 . 1 . . . . . . . . 5770 3 108 . 3 2 11 11 GLN HE21 H 1 6.69 0.02 . 2 . . . . . . . . 5770 3 109 . 3 2 11 11 GLN HE22 H 1 5.97 0.02 . 2 . . . . . . . . 5770 3 110 . 3 2 11 11 GLN C C 13 178.4 0.30 . 1 . . . . . . . . 5770 3 111 . 3 2 12 12 LEU N N 15 119.2 0.20 . 1 . . . . . . . . 5770 3 112 . 3 2 12 12 LEU H H 1 8.46 0.02 . 1 . . . . . . . . 5770 3 113 . 3 2 12 12 LEU CA C 13 58.4 0.30 . 1 . . . . . . . . 5770 3 114 . 3 2 12 12 LEU HA H 1 4.12 0.02 . 1 . . . . . . . . 5770 3 115 . 3 2 12 12 LEU CB C 13 41.7 0.30 . 1 . . . . . . . . 5770 3 116 . 3 2 12 12 LEU HB2 H 1 1.90 0.02 . 2 . . . . . . . . 5770 3 117 . 3 2 12 12 LEU HB3 H 1 1.82 0.02 . 2 . . . . . . . . 5770 3 118 . 3 2 12 12 LEU CG C 13 27.1 0.30 . 1 . . . . . . . . 5770 3 119 . 3 2 12 12 LEU HG H 1 1.78 0.02 . 1 . . . . . . . . 5770 3 120 . 3 2 12 12 LEU HD11 H 1 1.04 0.02 . 2 . . . . . . . . 5770 3 121 . 3 2 12 12 LEU HD12 H 1 1.04 0.02 . 2 . . . . . . . . 5770 3 122 . 3 2 12 12 LEU HD13 H 1 1.04 0.02 . 2 . . . . . . . . 5770 3 123 . 3 2 12 12 LEU HD21 H 1 1.01 0.02 . 2 . . . . . . . . 5770 3 124 . 3 2 12 12 LEU HD22 H 1 1.01 0.02 . 2 . . . . . . . . 5770 3 125 . 3 2 12 12 LEU HD23 H 1 1.01 0.02 . 2 . . . . . . . . 5770 3 126 . 3 2 12 12 LEU CD1 C 13 25.1 0.30 . 1 . . . . . . . . 5770 3 127 . 3 2 12 12 LEU CD2 C 13 23.6 0.30 . 1 . . . . . . . . 5770 3 128 . 3 2 12 12 LEU C C 13 179.9 0.30 . 1 . . . . . . . . 5770 3 129 . 3 2 13 13 GLU N N 15 122.2 0.20 . 1 . . . . . . . . 5770 3 130 . 3 2 13 13 GLU H H 1 8.36 0.02 . 1 . . . . . . . . 5770 3 131 . 3 2 13 13 GLU CA C 13 60.0 0.30 . 1 . . . . . . . . 5770 3 132 . 3 2 13 13 GLU HA H 1 4.13 0.02 . 1 . . . . . . . . 5770 3 133 . 3 2 13 13 GLU CB C 13 29.7 0.30 . 1 . . . . . . . . 5770 3 134 . 3 2 13 13 GLU HB2 H 1 2.37 0.02 . 1 . . . . . . . . 5770 3 135 . 3 2 13 13 GLU HB3 H 1 2.37 0.02 . 1 . . . . . . . . 5770 3 136 . 3 2 13 13 GLU CG C 13 36.4 0.30 . 1 . . . . . . . . 5770 3 137 . 3 2 13 13 GLU HG2 H 1 2.58 0.02 . 1 . . . . . . . . 5770 3 138 . 3 2 13 13 GLU HG3 H 1 2.58 0.02 . 1 . . . . . . . . 5770 3 139 . 3 2 13 13 GLU C C 13 180.2 0.30 . 1 . . . . . . . . 5770 3 140 . 3 2 14 14 MET N N 15 118.3 0.20 . 1 . . . . . . . . 5770 3 141 . 3 2 14 14 MET H H 1 8.67 0.02 . 1 . . . . . . . . 5770 3 142 . 3 2 14 14 MET CA C 13 57.5 0.30 . 1 . . . . . . . . 5770 3 143 . 3 2 14 14 MET HA H 1 4.66 0.02 . 1 . . . . . . . . 5770 3 144 . 3 2 14 14 MET CB C 13 33.8 0.30 . 1 . . . . . . . . 5770 3 145 . 3 2 14 14 MET HB2 H 1 3.11 0.02 . 1 . . . . . . . . 5770 3 146 . 3 2 14 14 MET HB3 H 1 3.11 0.02 . 1 . . . . . . . . 5770 3 147 . 3 2 14 14 MET CG C 13 34.0 0.30 . 1 . . . . . . . . 5770 3 148 . 3 2 14 14 MET HG2 H 1 3.23 0.02 . 1 . . . . . . . . 5770 3 149 . 3 2 14 14 MET HG3 H 1 3.23 0.02 . 1 . . . . . . . . 5770 3 150 . 3 2 14 14 MET HE1 H 1 2.26 0.02 . 1 . . . . . . . . 5770 3 151 . 3 2 14 14 MET HE2 H 1 2.26 0.02 . 1 . . . . . . . . 5770 3 152 . 3 2 14 14 MET HE3 H 1 2.26 0.02 . 1 . . . . . . . . 5770 3 153 . 3 2 14 14 MET CE C 13 19.9 0.30 . 1 . . . . . . . . 5770 3 154 . 3 2 14 14 MET C C 13 178.9 0.30 . 1 . . . . . . . . 5770 3 155 . 3 2 15 15 ILE N N 15 120.5 0.20 . 1 . . . . . . . . 5770 3 156 . 3 2 15 15 ILE H H 1 9.03 0.02 . 1 . . . . . . . . 5770 3 157 . 3 2 15 15 ILE CA C 13 64.5 0.30 . 1 . . . . . . . . 5770 3 158 . 3 2 15 15 ILE HA H 1 3.97 0.02 . 1 . . . . . . . . 5770 3 159 . 3 2 15 15 ILE CB C 13 37.1 0.30 . 1 . . . . . . . . 5770 3 160 . 3 2 15 15 ILE HB H 1 2.23 0.02 . 1 . . . . . . . . 5770 3 161 . 3 2 15 15 ILE HG21 H 1 1.04 0.02 . 1 . . . . . . . . 5770 3 162 . 3 2 15 15 ILE HG22 H 1 1.04 0.02 . 1 . . . . . . . . 5770 3 163 . 3 2 15 15 ILE HG23 H 1 1.04 0.02 . 1 . . . . . . . . 5770 3 164 . 3 2 15 15 ILE CG2 C 13 18.4 0.30 . 1 . . . . . . . . 5770 3 165 . 3 2 15 15 ILE CG1 C 13 29.2 0.30 . 1 . . . . . . . . 5770 3 166 . 3 2 15 15 ILE HG12 H 1 1.54 0.02 . 1 . . . . . . . . 5770 3 167 . 3 2 15 15 ILE HG13 H 1 1.54 0.02 . 1 . . . . . . . . 5770 3 168 . 3 2 15 15 ILE HD11 H 1 0.89 0.02 . 1 . . . . . . . . 5770 3 169 . 3 2 15 15 ILE HD12 H 1 0.89 0.02 . 1 . . . . . . . . 5770 3 170 . 3 2 15 15 ILE HD13 H 1 0.89 0.02 . 1 . . . . . . . . 5770 3 171 . 3 2 15 15 ILE CD1 C 13 13.8 0.30 . 1 . . . . . . . . 5770 3 172 . 3 2 15 15 ILE C C 13 177.8 0.30 . 1 . . . . . . . . 5770 3 173 . 3 2 16 16 THR N N 15 117.8 0.20 . 1 . . . . . . . . 5770 3 174 . 3 2 16 16 THR H H 1 8.54 0.02 . 1 . . . . . . . . 5770 3 175 . 3 2 16 16 THR CA C 13 67.4 0.30 . 1 . . . . . . . . 5770 3 176 . 3 2 16 16 THR HA H 1 3.94 0.02 . 1 . . . . . . . . 5770 3 177 . 3 2 16 16 THR CB C 13 68.7 0.30 . 1 . . . . . . . . 5770 3 178 . 3 2 16 16 THR HB H 1 4.45 0.02 . 1 . . . . . . . . 5770 3 179 . 3 2 16 16 THR HG21 H 1 1.33 0.02 . 1 . . . . . . . . 5770 3 180 . 3 2 16 16 THR HG22 H 1 1.33 0.02 . 1 . . . . . . . . 5770 3 181 . 3 2 16 16 THR HG23 H 1 1.33 0.02 . 1 . . . . . . . . 5770 3 182 . 3 2 16 16 THR CG2 C 13 21.3 0.30 . 1 . . . . . . . . 5770 3 183 . 3 2 16 16 THR C C 13 176.4 0.30 . 1 . . . . . . . . 5770 3 184 . 3 2 17 17 ALA N N 15 124.0 0.20 . 1 . . . . . . . . 5770 3 185 . 3 2 17 17 ALA H H 1 7.89 0.02 . 1 . . . . . . . . 5770 3 186 . 3 2 17 17 ALA CA C 13 55.4 0.30 . 1 . . . . . . . . 5770 3 187 . 3 2 17 17 ALA HA H 1 4.17 0.02 . 1 . . . . . . . . 5770 3 188 . 3 2 17 17 ALA HB1 H 1 1.56 0.02 . 1 . . . . . . . . 5770 3 189 . 3 2 17 17 ALA HB2 H 1 1.56 0.02 . 1 . . . . . . . . 5770 3 190 . 3 2 17 17 ALA HB3 H 1 1.56 0.02 . 1 . . . . . . . . 5770 3 191 . 3 2 17 17 ALA CB C 13 18.4 0.30 . 1 . . . . . . . . 5770 3 192 . 3 2 17 17 ALA C C 13 179.1 0.30 . 1 . . . . . . . . 5770 3 193 . 3 2 18 18 TRP N N 15 123.6 0.20 . 1 . . . . . . . . 5770 3 194 . 3 2 18 18 TRP H H 1 8.71 0.02 . 1 . . . . . . . . 5770 3 195 . 3 2 18 18 TRP CA C 13 58.8 0.30 . 1 . . . . . . . . 5770 3 196 . 3 2 18 18 TRP HA H 1 4.65 0.02 . 1 . . . . . . . . 5770 3 197 . 3 2 18 18 TRP CB C 13 29.8 0.30 . 1 . . . . . . . . 5770 3 198 . 3 2 18 18 TRP HB2 H 1 3.44 0.02 . 1 . . . . . . . . 5770 3 199 . 3 2 18 18 TRP HB3 H 1 3.44 0.02 . 1 . . . . . . . . 5770 3 200 . 3 2 18 18 TRP CD1 C 13 123.6 0.30 . 1 . . . . . . . . 5770 3 201 . 3 2 18 18 TRP CE3 C 13 119.4 0.30 . 1 . . . . . . . . 5770 3 202 . 3 2 18 18 TRP NE1 N 15 129.7 0.20 . 1 . . . . . . . . 5770 3 203 . 3 2 18 18 TRP HD1 H 1 7.47 0.02 . 1 . . . . . . . . 5770 3 204 . 3 2 18 18 TRP HE3 H 1 6.99 0.02 . 1 . . . . . . . . 5770 3 205 . 3 2 18 18 TRP CZ3 C 13 120.9 0.30 . 1 . . . . . . . . 5770 3 206 . 3 2 18 18 TRP CZ2 C 13 113.7 0.30 . 1 . . . . . . . . 5770 3 207 . 3 2 18 18 TRP HE1 H 1 10.12 0.02 . 1 . . . . . . . . 5770 3 208 . 3 2 18 18 TRP HZ3 H 1 6.34 0.02 . 1 . . . . . . . . 5770 3 209 . 3 2 18 18 TRP CH2 C 13 122.6 0.30 . 1 . . . . . . . . 5770 3 210 . 3 2 18 18 TRP HZ2 H 1 7.17 0.02 . 1 . . . . . . . . 5770 3 211 . 3 2 18 18 TRP HH2 H 1 6.80 0.02 . 1 . . . . . . . . 5770 3 212 . 3 2 18 18 TRP C C 13 180.0 0.30 . 1 . . . . . . . . 5770 3 213 . 3 2 19 19 LYS N N 15 118.6 0.20 . 1 . . . . . . . . 5770 3 214 . 3 2 19 19 LYS H H 1 9.01 0.02 . 1 . . . . . . . . 5770 3 215 . 3 2 19 19 LYS CA C 13 60.8 0.30 . 1 . . . . . . . . 5770 3 216 . 3 2 19 19 LYS HA H 1 3.99 0.02 . 1 . . . . . . . . 5770 3 217 . 3 2 19 19 LYS CB C 13 32.5 0.30 . 1 . . . . . . . . 5770 3 218 . 3 2 19 19 LYS HB2 H 1 2.01 0.02 . 1 . . . . . . . . 5770 3 219 . 3 2 19 19 LYS HB3 H 1 2.01 0.02 . 1 . . . . . . . . 5770 3 220 . 3 2 19 19 LYS CG C 13 25.9 0.30 . 1 . . . . . . . . 5770 3 221 . 3 2 19 19 LYS HG2 H 1 1.83 0.02 . 2 . . . . . . . . 5770 3 222 . 3 2 19 19 LYS HG3 H 1 1.50 0.02 . 2 . . . . . . . . 5770 3 223 . 3 2 19 19 LYS CD C 13 29.8 0.30 . 1 . . . . . . . . 5770 3 224 . 3 2 19 19 LYS HD2 H 1 1.67 0.02 . 1 . . . . . . . . 5770 3 225 . 3 2 19 19 LYS HD3 H 1 1.67 0.02 . 1 . . . . . . . . 5770 3 226 . 3 2 19 19 LYS CE C 13 41.6 0.30 . 1 . . . . . . . . 5770 3 227 . 3 2 19 19 LYS HE2 H 1 2.95 0.02 . 1 . . . . . . . . 5770 3 228 . 3 2 19 19 LYS HE3 H 1 2.95 0.02 . 1 . . . . . . . . 5770 3 229 . 3 2 19 19 LYS C C 13 179.6 0.30 . 1 . . . . . . . . 5770 3 230 . 3 2 20 20 LYS N N 15 119.6 0.20 . 1 . . . . . . . . 5770 3 231 . 3 2 20 20 LYS H H 1 8.07 0.02 . 1 . . . . . . . . 5770 3 232 . 3 2 20 20 LYS CA C 13 59.4 0.30 . 1 . . . . . . . . 5770 3 233 . 3 2 20 20 LYS HA H 1 4.16 0.02 . 1 . . . . . . . . 5770 3 234 . 3 2 20 20 LYS CB C 13 32.1 0.30 . 1 . . . . . . . . 5770 3 235 . 3 2 20 20 LYS HB2 H 1 2.00 0.02 . 1 . . . . . . . . 5770 3 236 . 3 2 20 20 LYS HB3 H 1 2.00 0.02 . 1 . . . . . . . . 5770 3 237 . 3 2 20 20 LYS CG C 13 25.2 0.30 . 1 . . . . . . . . 5770 3 238 . 3 2 20 20 LYS HG2 H 1 1.54 0.02 . 1 . . . . . . . . 5770 3 239 . 3 2 20 20 LYS HG3 H 1 1.54 0.02 . 1 . . . . . . . . 5770 3 240 . 3 2 20 20 LYS CD C 13 29.1 0.30 . 1 . . . . . . . . 5770 3 241 . 3 2 20 20 LYS HD2 H 1 1.78 0.02 . 2 . . . . . . . . 5770 3 242 . 3 2 20 20 LYS HD3 H 1 1.67 0.02 . 2 . . . . . . . . 5770 3 243 . 3 2 20 20 LYS CE C 13 42.2 0.30 . 1 . . . . . . . . 5770 3 244 . 3 2 20 20 LYS HE2 H 1 3.04 0.02 . 2 . . . . . . . . 5770 3 245 . 3 2 20 20 LYS HE3 H 1 3.00 0.02 . 2 . . . . . . . . 5770 3 246 . 3 2 20 20 LYS C C 13 178.4 0.30 . 1 . . . . . . . . 5770 3 247 . 3 2 21 21 PHE N N 15 120.5 0.20 . 1 . . . . . . . . 5770 3 248 . 3 2 21 21 PHE H H 1 8.32 0.02 . 1 . . . . . . . . 5770 3 249 . 3 2 21 21 PHE CA C 13 61.3 0.30 . 1 . . . . . . . . 5770 3 250 . 3 2 21 21 PHE HA H 1 4.35 0.02 . 1 . . . . . . . . 5770 3 251 . 3 2 21 21 PHE CB C 13 39.2 0.30 . 1 . . . . . . . . 5770 3 252 . 3 2 21 21 PHE HB2 H 1 3.61 0.02 . 2 . . . . . . . . 5770 3 253 . 3 2 21 21 PHE HB3 H 1 3.29 0.02 . 2 . . . . . . . . 5770 3 254 . 3 2 21 21 PHE HD1 H 1 7.12 0.02 . 1 . . . . . . . . 5770 3 255 . 3 2 21 21 PHE HD2 H 1 7.12 0.02 . 1 . . . . . . . . 5770 3 256 . 3 2 21 21 PHE HE1 H 1 7.24 0.02 . 1 . . . . . . . . 5770 3 257 . 3 2 21 21 PHE HE2 H 1 7.24 0.02 . 1 . . . . . . . . 5770 3 258 . 3 2 21 21 PHE CD1 C 13 132.0 0.30 . 1 . . . . . . . . 5770 3 259 . 3 2 21 21 PHE HZ H 1 7.35 0.02 . 1 . . . . . . . . 5770 3 260 . 3 2 21 21 PHE C C 13 177.8 0.30 . 1 . . . . . . . . 5770 3 261 . 3 2 22 22 VAL N N 15 117.7 0.20 . 1 . . . . . . . . 5770 3 262 . 3 2 22 22 VAL H H 1 8.07 0.02 . 1 . . . . . . . . 5770 3 263 . 3 2 22 22 VAL CA C 13 66.8 0.30 . 1 . . . . . . . . 5770 3 264 . 3 2 22 22 VAL HA H 1 3.37 0.02 . 1 . . . . . . . . 5770 3 265 . 3 2 22 22 VAL CB C 13 31.8 0.30 . 1 . . . . . . . . 5770 3 266 . 3 2 22 22 VAL HB H 1 2.44 0.02 . 1 . . . . . . . . 5770 3 267 . 3 2 22 22 VAL HG11 H 1 1.43 0.02 . 2 . . . . . . . . 5770 3 268 . 3 2 22 22 VAL HG12 H 1 1.43 0.02 . 2 . . . . . . . . 5770 3 269 . 3 2 22 22 VAL HG13 H 1 1.43 0.02 . 2 . . . . . . . . 5770 3 270 . 3 2 22 22 VAL HG21 H 1 1.01 0.02 . 2 . . . . . . . . 5770 3 271 . 3 2 22 22 VAL HG22 H 1 1.01 0.02 . 2 . . . . . . . . 5770 3 272 . 3 2 22 22 VAL HG23 H 1 1.01 0.02 . 2 . . . . . . . . 5770 3 273 . 3 2 22 22 VAL CG1 C 13 24.4 0.30 . 1 . . . . . . . . 5770 3 274 . 3 2 22 22 VAL CG2 C 13 21.8 0.30 . 1 . . . . . . . . 5770 3 275 . 3 2 22 22 VAL C C 13 177.5 0.30 . 1 . . . . . . . . 5770 3 276 . 3 2 23 23 GLU N N 15 119.2 0.20 . 1 . . . . . . . . 5770 3 277 . 3 2 23 23 GLU H H 1 8.14 0.02 . 1 . . . . . . . . 5770 3 278 . 3 2 23 23 GLU CA C 13 59.4 0.30 . 1 . . . . . . . . 5770 3 279 . 3 2 23 23 GLU HA H 1 3.92 0.02 . 1 . . . . . . . . 5770 3 280 . 3 2 23 23 GLU CB C 13 29.7 0.30 . 1 . . . . . . . . 5770 3 281 . 3 2 23 23 GLU HB2 H 1 2.22 0.02 . 1 . . . . . . . . 5770 3 282 . 3 2 23 23 GLU HB3 H 1 2.22 0.02 . 1 . . . . . . . . 5770 3 283 . 3 2 23 23 GLU CG C 13 36.2 0.30 . 1 . . . . . . . . 5770 3 284 . 3 2 23 23 GLU HG2 H 1 2.44 0.02 . 2 . . . . . . . . 5770 3 285 . 3 2 23 23 GLU HG3 H 1 2.31 0.02 . 2 . . . . . . . . 5770 3 286 . 3 2 23 23 GLU C C 13 179.5 0.30 . 1 . . . . . . . . 5770 3 287 . 3 2 24 24 GLU N N 15 117.6 0.20 . 1 . . . . . . . . 5770 3 288 . 3 2 24 24 GLU H H 1 8.28 0.02 . 1 . . . . . . . . 5770 3 289 . 3 2 24 24 GLU CA C 13 58.6 0.30 . 1 . . . . . . . . 5770 3 290 . 3 2 24 24 GLU HA H 1 4.03 0.02 . 1 . . . . . . . . 5770 3 291 . 3 2 24 24 GLU CB C 13 29.5 0.30 . 1 . . . . . . . . 5770 3 292 . 3 2 24 24 GLU HB2 H 1 2.10 0.02 . 2 . . . . . . . . 5770 3 293 . 3 2 24 24 GLU HB3 H 1 2.05 0.02 . 2 . . . . . . . . 5770 3 294 . 3 2 24 24 GLU CG C 13 36.6 0.30 . 1 . . . . . . . . 5770 3 295 . 3 2 24 24 GLU HG2 H 1 2.43 0.02 . 2 . . . . . . . . 5770 3 296 . 3 2 24 24 GLU HG3 H 1 2.31 0.02 . 2 . . . . . . . . 5770 3 297 . 3 2 24 24 GLU C C 13 178.6 0.30 . 1 . . . . . . . . 5770 3 298 . 3 2 25 25 LYS N N 15 119.0 0.20 . 1 . . . . . . . . 5770 3 299 . 3 2 25 25 LYS H H 1 7.70 0.02 . 1 . . . . . . . . 5770 3 300 . 3 2 25 25 LYS CA C 13 57.7 0.30 . 1 . . . . . . . . 5770 3 301 . 3 2 25 25 LYS HA H 1 3.97 0.02 . 1 . . . . . . . . 5770 3 302 . 3 2 25 25 LYS CB C 13 32.0 0.30 . 1 . . . . . . . . 5770 3 303 . 3 2 25 25 LYS HB2 H 1 1.68 0.02 . 1 . . . . . . . . 5770 3 304 . 3 2 25 25 LYS HB3 H 1 1.68 0.02 . 1 . . . . . . . . 5770 3 305 . 3 2 25 25 LYS CG C 13 24.4 0.30 . 1 . . . . . . . . 5770 3 306 . 3 2 25 25 LYS HG2 H 1 1.24 0.02 . 1 . . . . . . . . 5770 3 307 . 3 2 25 25 LYS HG3 H 1 1.24 0.02 . 1 . . . . . . . . 5770 3 308 . 3 2 25 25 LYS CD C 13 28.8 0.30 . 1 . . . . . . . . 5770 3 309 . 3 2 25 25 LYS HD2 H 1 1.46 0.02 . 1 . . . . . . . . 5770 3 310 . 3 2 25 25 LYS HD3 H 1 1.46 0.02 . 1 . . . . . . . . 5770 3 311 . 3 2 25 25 LYS CE C 13 42.1 0.30 . 1 . . . . . . . . 5770 3 312 . 3 2 25 25 LYS HE2 H 1 2.95 0.02 . 2 . . . . . . . . 5770 3 313 . 3 2 25 25 LYS HE3 H 1 2.87 0.02 . 2 . . . . . . . . 5770 3 314 . 3 2 25 25 LYS C C 13 178.3 0.30 . 1 . . . . . . . . 5770 3 315 . 3 2 26 26 LYS N N 15 117.4 0.20 . 1 . . . . . . . . 5770 3 316 . 3 2 26 26 LYS H H 1 7.60 0.02 . 1 . . . . . . . . 5770 3 317 . 3 2 26 26 LYS CA C 13 57.0 0.30 . 1 . . . . . . . . 5770 3 318 . 3 2 26 26 LYS HA H 1 4.17 0.02 . 1 . . . . . . . . 5770 3 319 . 3 2 26 26 LYS CB C 13 32.8 0.30 . 1 . . . . . . . . 5770 3 320 . 3 2 26 26 LYS HB2 H 1 1.92 0.02 . 2 . . . . . . . . 5770 3 321 . 3 2 26 26 LYS HB3 H 1 1.83 0.02 . 2 . . . . . . . . 5770 3 322 . 3 2 26 26 LYS CG C 13 24.9 0.30 . 1 . . . . . . . . 5770 3 323 . 3 2 26 26 LYS HG2 H 1 1.48 0.02 . 1 . . . . . . . . 5770 3 324 . 3 2 26 26 LYS HG3 H 1 1.48 0.02 . 1 . . . . . . . . 5770 3 325 . 3 2 26 26 LYS CD C 13 29.3 0.30 . 1 . . . . . . . . 5770 3 326 . 3 2 26 26 LYS HD2 H 1 1.63 0.02 . 1 . . . . . . . . 5770 3 327 . 3 2 26 26 LYS HD3 H 1 1.63 0.02 . 1 . . . . . . . . 5770 3 328 . 3 2 26 26 LYS CE C 13 41.9 0.30 . 1 . . . . . . . . 5770 3 329 . 3 2 26 26 LYS HE2 H 1 2.94 0.02 . 1 . . . . . . . . 5770 3 330 . 3 2 26 26 LYS HE3 H 1 2.94 0.02 . 1 . . . . . . . . 5770 3 331 . 3 2 26 26 LYS C C 13 176.9 0.30 . 1 . . . . . . . . 5770 3 332 . 3 2 27 27 LYS N N 15 120.4 0.20 . 1 . . . . . . . . 5770 3 333 . 3 2 27 27 LYS H H 1 7.55 0.02 . 1 . . . . . . . . 5770 3 334 . 3 2 27 27 LYS CA C 13 56.8 0.30 . 1 . . . . . . . . 5770 3 335 . 3 2 27 27 LYS HA H 1 4.27 0.02 . 1 . . . . . . . . 5770 3 336 . 3 2 27 27 LYS CB C 13 32.6 0.30 . 1 . . . . . . . . 5770 3 337 . 3 2 27 27 LYS HB2 H 1 1.90 0.02 . 2 . . . . . . . . 5770 3 338 . 3 2 27 27 LYS HB3 H 1 1.84 0.02 . 2 . . . . . . . . 5770 3 339 . 3 2 27 27 LYS CG C 13 24.9 0.30 . 1 . . . . . . . . 5770 3 340 . 3 2 27 27 LYS HG2 H 1 1.56 0.02 . 2 . . . . . . . . 5770 3 341 . 3 2 27 27 LYS HG3 H 1 1.46 0.02 . 2 . . . . . . . . 5770 3 342 . 3 2 27 27 LYS CD C 13 29.2 0.30 . 1 . . . . . . . . 5770 3 343 . 3 2 27 27 LYS HD2 H 1 1.71 0.02 . 1 . . . . . . . . 5770 3 344 . 3 2 27 27 LYS HD3 H 1 1.71 0.02 . 1 . . . . . . . . 5770 3 345 . 3 2 27 27 LYS CE C 13 42.2 0.30 . 1 . . . . . . . . 5770 3 346 . 3 2 27 27 LYS HE2 H 1 3.02 0.02 . 1 . . . . . . . . 5770 3 347 . 3 2 27 27 LYS HE3 H 1 3.02 0.02 . 1 . . . . . . . . 5770 3 348 . 3 2 28 28 LYS N N 15 127.3 0.20 . 1 . . . . . . . . 5770 3 349 . 3 2 28 28 LYS H H 1 7.67 0.02 . 1 . . . . . . . . 5770 3 350 . 3 2 28 28 LYS CA C 13 57.8 0.30 . 1 . . . . . . . . 5770 3 351 . 3 2 28 28 LYS HA H 1 4.16 0.02 . 1 . . . . . . . . 5770 3 352 . 3 2 28 28 LYS CB C 13 33.7 0.30 . 1 . . . . . . . . 5770 3 353 . 3 2 28 28 LYS HB2 H 1 1.85 0.02 . 2 . . . . . . . . 5770 3 354 . 3 2 28 28 LYS HB3 H 1 1.71 0.02 . 2 . . . . . . . . 5770 3 355 . 3 2 28 28 LYS CG C 13 25.2 0.30 . 1 . . . . . . . . 5770 3 356 . 3 2 28 28 LYS HG2 H 1 1.46 0.02 . 1 . . . . . . . . 5770 3 357 . 3 2 28 28 LYS HG3 H 1 1.46 0.02 . 1 . . . . . . . . 5770 3 358 . 3 2 28 28 LYS CD C 13 29.2 0.30 . 1 . . . . . . . . 5770 3 359 . 3 2 28 28 LYS HD2 H 1 1.71 0.02 . 1 . . . . . . . . 5770 3 360 . 3 2 28 28 LYS HD3 H 1 1.71 0.02 . 1 . . . . . . . . 5770 3 361 . 3 2 28 28 LYS CE C 13 42.4 0.30 . 1 . . . . . . . . 5770 3 362 . 3 2 28 28 LYS HE2 H 1 3.04 0.02 . 1 . . . . . . . . 5770 3 363 . 3 2 28 28 LYS HE3 H 1 3.04 0.02 . 1 . . . . . . . . 5770 3 stop_ save_