data_7007 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7007 _Entry.Title ; Solution structure of At5g39720.1 from Arabidopsis thaliana ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-02-28 _Entry.Accession_date 2006-02-28 _Entry.Last_release_date . _Entry.Original_release_date . _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 B. Volkman . F. . 7007 2 F. Peterson . C. . 7007 3 B. Lytle . L. . 7007 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 7007 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 660 7007 '15N chemical shifts' 162 7007 '1H chemical shifts' 1002 7007 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 3 . . 2009-06-29 2006-02-28 update BMRB 'added time domain data' 7007 2 . . 2007-01-04 2006-02-28 update author 'update the entry citation' 7007 1 . . 2006-03-10 2006-02-28 original author 'original release' 7007 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 7007 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16754964 _Citation.Full_citation . _Citation.Title ; Solution structure of Arabidopsis thaliana protein At5g39720.1, a member of the AIG2-like protein family ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Acta Crystallograph Sect. F Struct. Biol. Cryst. Commun.' _Citation.Journal_name_full . _Citation.Journal_volume 62 _Citation.Journal_issue 'Pt. 6' _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 490 _Citation.Page_last 493 _Citation.Year 2006 _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 B. Lytle . L. . 7007 1 2 F. Peterson . C. . 7007 1 3 E. Tyler . . . 7007 1 4 C. Newman . L. . 7007 1 5 D. Vinarov . . . 7007 1 6 J. Markley . L. . 7007 1 7 B. Volkman . F. . 7007 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID At5g39720.1 7007 1 'Center for Eukaryotic Structural Genomics' 7007 1 CESG 7007 1 'Protein Structure Initiative' 7007 1 PSI 7007 1 'Structural Genomics' 7007 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_AT5G39720 _Assembly.Sf_category assembly _Assembly.Sf_framecode system_AT5G39720 _Assembly.Entry_ID 7007 _Assembly.ID 1 _Assembly.Name AT5G39720.1 _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 7007 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 'AT5G39720.1 protein' 1 $AT5G39720 . . . native . . . . . 7007 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 yes PDB 2G0Q . . . . . . 7007 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID AT5G39720.1 abbreviation 7007 1 AT5G39720.1 system 7007 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_AT5G39720 _Entity.Sf_category entity _Entity.Sf_framecode AT5G39720 _Entity.Entry_ID 7007 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name AT5G39720 _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 ; GHHHHHHLECSSDSLQLHNV FVYGSFQDPDVINVMLDRTP EIVSATLPGFQRFRLKGRLY PCIVPSEKGEVHGKVLMGVT SDELENLDAVEGNEYERVTV GIVREDNSEKMAVKTYMWIN KADPDMFGEWNFEEWKRLHK KKFIETFKKIMECKKKPQGQ GNDDISHVLREDQ ; _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 173 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 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 2G0Q . "Solution Structure Of At5g39720.1 From Arabidopsis Thaliana" . . . . . 100.00 173 100.00 100.00 2.44e-125 . . . . 7007 1 2 no DBJ BAB11378 . "AIG2-like protein [Arabidopsis thaliana]" . . . . . 94.80 165 100.00 100.00 8.42e-118 . . . . 7007 1 3 no GB AAX49363 . "At5g39720 [Arabidopsis thaliana]" . . . . . 90.75 158 98.73 100.00 2.06e-111 . . . . 7007 1 4 no GB ABN04775 . "At5g39720 [Arabidopsis thaliana]" . . . . . 94.80 165 100.00 100.00 8.42e-118 . . . . 7007 1 5 no GB AED94467 . "avirulence induced protein 2 like protein [Arabidopsis thaliana]" . . . . . 94.80 165 100.00 100.00 8.42e-118 . . . . 7007 1 6 no REF NP_198788 . "avirulence induced protein 2 like protein [Arabidopsis thaliana]" . . . . . 94.80 165 100.00 100.00 8.42e-118 . . . . 7007 1 7 no SP Q9FIX2 . "RecName: Full=AIG2-like protein; AltName: Full=Putative gamma-glutamylcyclotransferase [Arabidopsis thaliana]" . . . . . 94.80 165 100.00 100.00 8.42e-118 . . . . 7007 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID AT5G39720 abbreviation 7007 1 AT5G39720 common 7007 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 7007 1 2 . HIS . 7007 1 3 . HIS . 7007 1 4 . HIS . 7007 1 5 . HIS . 7007 1 6 . HIS . 7007 1 7 . HIS . 7007 1 8 . LEU . 7007 1 9 . GLU . 7007 1 10 . CYS . 7007 1 11 . SER . 7007 1 12 . SER . 7007 1 13 . ASP . 7007 1 14 . SER . 7007 1 15 . LEU . 7007 1 16 . GLN . 7007 1 17 . LEU . 7007 1 18 . HIS . 7007 1 19 . ASN . 7007 1 20 . VAL . 7007 1 21 . PHE . 7007 1 22 . VAL . 7007 1 23 . TYR . 7007 1 24 . GLY . 7007 1 25 . SER . 7007 1 26 . PHE . 7007 1 27 . GLN . 7007 1 28 . ASP . 7007 1 29 . PRO . 7007 1 30 . ASP . 7007 1 31 . VAL . 7007 1 32 . ILE . 7007 1 33 . ASN . 7007 1 34 . VAL . 7007 1 35 . MET . 7007 1 36 . LEU . 7007 1 37 . ASP . 7007 1 38 . ARG . 7007 1 39 . THR . 7007 1 40 . PRO . 7007 1 41 . GLU . 7007 1 42 . ILE . 7007 1 43 . VAL . 7007 1 44 . SER . 7007 1 45 . ALA . 7007 1 46 . THR . 7007 1 47 . LEU . 7007 1 48 . PRO . 7007 1 49 . GLY . 7007 1 50 . PHE . 7007 1 51 . GLN . 7007 1 52 . ARG . 7007 1 53 . PHE . 7007 1 54 . ARG . 7007 1 55 . LEU . 7007 1 56 . LYS . 7007 1 57 . GLY . 7007 1 58 . ARG . 7007 1 59 . LEU . 7007 1 60 . TYR . 7007 1 61 . PRO . 7007 1 62 . CYS . 7007 1 63 . ILE . 7007 1 64 . VAL . 7007 1 65 . PRO . 7007 1 66 . SER . 7007 1 67 . GLU . 7007 1 68 . LYS . 7007 1 69 . GLY . 7007 1 70 . GLU . 7007 1 71 . VAL . 7007 1 72 . HIS . 7007 1 73 . GLY . 7007 1 74 . LYS . 7007 1 75 . VAL . 7007 1 76 . LEU . 7007 1 77 . MET . 7007 1 78 . GLY . 7007 1 79 . VAL . 7007 1 80 . THR . 7007 1 81 . SER . 7007 1 82 . ASP . 7007 1 83 . GLU . 7007 1 84 . LEU . 7007 1 85 . GLU . 7007 1 86 . ASN . 7007 1 87 . LEU . 7007 1 88 . ASP . 7007 1 89 . ALA . 7007 1 90 . VAL . 7007 1 91 . GLU . 7007 1 92 . GLY . 7007 1 93 . ASN . 7007 1 94 . GLU . 7007 1 95 . TYR . 7007 1 96 . GLU . 7007 1 97 . ARG . 7007 1 98 . VAL . 7007 1 99 . THR . 7007 1 100 . VAL . 7007 1 101 . GLY . 7007 1 102 . ILE . 7007 1 103 . VAL . 7007 1 104 . ARG . 7007 1 105 . GLU . 7007 1 106 . ASP . 7007 1 107 . ASN . 7007 1 108 . SER . 7007 1 109 . GLU . 7007 1 110 . LYS . 7007 1 111 . MET . 7007 1 112 . ALA . 7007 1 113 . VAL . 7007 1 114 . LYS . 7007 1 115 . THR . 7007 1 116 . TYR . 7007 1 117 . MET . 7007 1 118 . TRP . 7007 1 119 . ILE . 7007 1 120 . ASN . 7007 1 121 . LYS . 7007 1 122 . ALA . 7007 1 123 . ASP . 7007 1 124 . PRO . 7007 1 125 . ASP . 7007 1 126 . MET . 7007 1 127 . PHE . 7007 1 128 . GLY . 7007 1 129 . GLU . 7007 1 130 . TRP . 7007 1 131 . ASN . 7007 1 132 . PHE . 7007 1 133 . GLU . 7007 1 134 . GLU . 7007 1 135 . TRP . 7007 1 136 . LYS . 7007 1 137 . ARG . 7007 1 138 . LEU . 7007 1 139 . HIS . 7007 1 140 . LYS . 7007 1 141 . LYS . 7007 1 142 . LYS . 7007 1 143 . PHE . 7007 1 144 . ILE . 7007 1 145 . GLU . 7007 1 146 . THR . 7007 1 147 . PHE . 7007 1 148 . LYS . 7007 1 149 . LYS . 7007 1 150 . ILE . 7007 1 151 . MET . 7007 1 152 . GLU . 7007 1 153 . CYS . 7007 1 154 . LYS . 7007 1 155 . LYS . 7007 1 156 . LYS . 7007 1 157 . PRO . 7007 1 158 . GLN . 7007 1 159 . GLY . 7007 1 160 . GLN . 7007 1 161 . GLY . 7007 1 162 . ASN . 7007 1 163 . ASP . 7007 1 164 . ASP . 7007 1 165 . ILE . 7007 1 166 . SER . 7007 1 167 . HIS . 7007 1 168 . VAL . 7007 1 169 . LEU . 7007 1 170 . ARG . 7007 1 171 . GLU . 7007 1 172 . ASP . 7007 1 173 . GLN . 7007 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 7007 1 . HIS 2 2 7007 1 . HIS 3 3 7007 1 . HIS 4 4 7007 1 . HIS 5 5 7007 1 . HIS 6 6 7007 1 . HIS 7 7 7007 1 . LEU 8 8 7007 1 . GLU 9 9 7007 1 . CYS 10 10 7007 1 . SER 11 11 7007 1 . SER 12 12 7007 1 . ASP 13 13 7007 1 . SER 14 14 7007 1 . LEU 15 15 7007 1 . GLN 16 16 7007 1 . LEU 17 17 7007 1 . HIS 18 18 7007 1 . ASN 19 19 7007 1 . VAL 20 20 7007 1 . PHE 21 21 7007 1 . VAL 22 22 7007 1 . TYR 23 23 7007 1 . GLY 24 24 7007 1 . SER 25 25 7007 1 . PHE 26 26 7007 1 . GLN 27 27 7007 1 . ASP 28 28 7007 1 . PRO 29 29 7007 1 . ASP 30 30 7007 1 . VAL 31 31 7007 1 . ILE 32 32 7007 1 . ASN 33 33 7007 1 . VAL 34 34 7007 1 . MET 35 35 7007 1 . LEU 36 36 7007 1 . ASP 37 37 7007 1 . ARG 38 38 7007 1 . THR 39 39 7007 1 . PRO 40 40 7007 1 . GLU 41 41 7007 1 . ILE 42 42 7007 1 . VAL 43 43 7007 1 . SER 44 44 7007 1 . ALA 45 45 7007 1 . THR 46 46 7007 1 . LEU 47 47 7007 1 . PRO 48 48 7007 1 . GLY 49 49 7007 1 . PHE 50 50 7007 1 . GLN 51 51 7007 1 . ARG 52 52 7007 1 . PHE 53 53 7007 1 . ARG 54 54 7007 1 . LEU 55 55 7007 1 . LYS 56 56 7007 1 . GLY 57 57 7007 1 . ARG 58 58 7007 1 . LEU 59 59 7007 1 . TYR 60 60 7007 1 . PRO 61 61 7007 1 . CYS 62 62 7007 1 . ILE 63 63 7007 1 . VAL 64 64 7007 1 . PRO 65 65 7007 1 . SER 66 66 7007 1 . GLU 67 67 7007 1 . LYS 68 68 7007 1 . GLY 69 69 7007 1 . GLU 70 70 7007 1 . VAL 71 71 7007 1 . HIS 72 72 7007 1 . GLY 73 73 7007 1 . LYS 74 74 7007 1 . VAL 75 75 7007 1 . LEU 76 76 7007 1 . MET 77 77 7007 1 . GLY 78 78 7007 1 . VAL 79 79 7007 1 . THR 80 80 7007 1 . SER 81 81 7007 1 . ASP 82 82 7007 1 . GLU 83 83 7007 1 . LEU 84 84 7007 1 . GLU 85 85 7007 1 . ASN 86 86 7007 1 . LEU 87 87 7007 1 . ASP 88 88 7007 1 . ALA 89 89 7007 1 . VAL 90 90 7007 1 . GLU 91 91 7007 1 . GLY 92 92 7007 1 . ASN 93 93 7007 1 . GLU 94 94 7007 1 . TYR 95 95 7007 1 . GLU 96 96 7007 1 . ARG 97 97 7007 1 . VAL 98 98 7007 1 . THR 99 99 7007 1 . VAL 100 100 7007 1 . GLY 101 101 7007 1 . ILE 102 102 7007 1 . VAL 103 103 7007 1 . ARG 104 104 7007 1 . GLU 105 105 7007 1 . ASP 106 106 7007 1 . ASN 107 107 7007 1 . SER 108 108 7007 1 . GLU 109 109 7007 1 . LYS 110 110 7007 1 . MET 111 111 7007 1 . ALA 112 112 7007 1 . VAL 113 113 7007 1 . LYS 114 114 7007 1 . THR 115 115 7007 1 . TYR 116 116 7007 1 . MET 117 117 7007 1 . TRP 118 118 7007 1 . ILE 119 119 7007 1 . ASN 120 120 7007 1 . LYS 121 121 7007 1 . ALA 122 122 7007 1 . ASP 123 123 7007 1 . PRO 124 124 7007 1 . ASP 125 125 7007 1 . MET 126 126 7007 1 . PHE 127 127 7007 1 . GLY 128 128 7007 1 . GLU 129 129 7007 1 . TRP 130 130 7007 1 . ASN 131 131 7007 1 . PHE 132 132 7007 1 . GLU 133 133 7007 1 . GLU 134 134 7007 1 . TRP 135 135 7007 1 . LYS 136 136 7007 1 . ARG 137 137 7007 1 . LEU 138 138 7007 1 . HIS 139 139 7007 1 . LYS 140 140 7007 1 . LYS 141 141 7007 1 . LYS 142 142 7007 1 . PHE 143 143 7007 1 . ILE 144 144 7007 1 . GLU 145 145 7007 1 . THR 146 146 7007 1 . PHE 147 147 7007 1 . LYS 148 148 7007 1 . LYS 149 149 7007 1 . ILE 150 150 7007 1 . MET 151 151 7007 1 . GLU 152 152 7007 1 . CYS 153 153 7007 1 . LYS 154 154 7007 1 . LYS 155 155 7007 1 . LYS 156 156 7007 1 . PRO 157 157 7007 1 . GLN 158 158 7007 1 . GLY 159 159 7007 1 . GLN 160 160 7007 1 . GLY 161 161 7007 1 . ASN 162 162 7007 1 . ASP 163 163 7007 1 . ASP 164 164 7007 1 . ILE 165 165 7007 1 . SER 166 166 7007 1 . HIS 167 167 7007 1 . VAL 168 168 7007 1 . LEU 169 169 7007 1 . ARG 170 170 7007 1 . GLU 171 171 7007 1 . ASP 172 172 7007 1 . GLN 173 173 7007 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 7007 _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 $AT5G39720 . 3702 . . 'Arabidopsis thaliana' 'Thale cress' . . Eukaryota Viridiplantae Arabidopsis thaliana . . . . . . . . . . . . . . . . . . . . . 7007 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 7007 _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 $AT5G39720 . 'cell free synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7007 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 7007 _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 AT5G39720 '[U-15N; U-13C]' . . 1 $AT5G39720 . . 0.9 . . mM . . . . 7007 1 2 'deuterated Bis-Tris' . . . . . . . 10 . . mM . . . . 7007 1 3 NaCl . . . . . . . 100 . . mM . . . . 7007 1 4 Dithiothreitol . . . . . . . 5 . . mM . . . . 7007 1 5 H2O . . . . . . . 95 . . % . . . . 7007 1 6 D2O . . . . . . . 5 . . % . . . . 7007 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_cond_1 _Sample_condition_list.Entry_ID 7007 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 101 . mM 7007 1 pH 7.0 . pH 7007 1 pressure 1 . atm 7007 1 temperature 298 . K 7007 1 stop_ save_ ############################ # Computer software used # ############################ save_XPLOR-NIH _Software.Sf_category software _Software.Sf_framecode XPLOR-NIH _Software.Entry_ID 7007 _Software.ID 1 _Software.Name 'X-PLOR NIH' _Software.Version 2.9.3 _Software.Details 'SCHWIETERS, C.D.,KUSZEWSKI, J.J.,TJANDRA, N., CLORE, G.M.' loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 7007 1 stop_ save_ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 7007 _Software.ID 2 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 7007 _Software.ID 3 _Software.Name NMRPipe _Software.Version 2004 _Software.Details . save_ save_SPSCAN _Software.Sf_category software _Software.Sf_framecode SPSCAN _Software.Entry_ID 7007 _Software.ID 4 _Software.Name SPSCAN _Software.Version 1.1.0 _Software.Details . save_ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 7007 _Software.ID 5 _Software.Name XEASY _Software.Version 1.3 _Software.Details . save_ save_GARANT _Software.Sf_category software _Software.Sf_framecode GARANT _Software.Entry_ID 7007 _Software.ID 6 _Software.Name GARANT _Software.Version 2.1 _Software.Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer _NMR_spectrometer.Entry_ID 7007 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _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 7007 _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 Bruker DRX . 600 . . . 7007 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 7007 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 15N-separated NOESY' yes 1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7007 1 2 '3D 13C-separated NOESY' yes 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7007 1 3 '3D 13C-separated NOESY (AROMATIC)' yes 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7007 1 stop_ save_ save_NMR_spectrometer_expt_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_1 _NMR_spec_expt.Entry_ID 7007 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '3D 15N-separated NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7007/timedomain_data/030305.5g39720/5/' . . . . . . . 7007 1 procs 'processing parameters' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7007/timedomain_data/030305.5g39720/5/pdata/1/' . . . . . . . 7007 1 pulseprogram 'pulse program' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7007/timedomain_data/030305.5g39720/5/' . . . . . . . 7007 1 ser 'raw spectral data' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7007/timedomain_data/030305.5g39720/5/' . . . . . . . 7007 1 . 'NMR Experiment Directory' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7007/timedomain_data/030305.5g39720/5/' . . . . . . . 7007 1 stop_ save_ save_NMR_spectrometer_expt_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_2 _NMR_spec_expt.Entry_ID 7007 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '3D 13C-separated NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7007/timedomain_data/030305.5g39720/7/' . . . . . . . 7007 2 procs 'processing parameters' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7007/timedomain_data/030305.5g39720/7/pdata/1/' . . . . . . . 7007 2 pulseprogram 'pulse program' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7007/timedomain_data/030305.5g39720/7/' . . . . . . . 7007 2 ser 'raw spectral data' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7007/timedomain_data/030305.5g39720/7/' . . . . . . . 7007 2 . 'NMR Experiment Directory' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7007/timedomain_data/030305.5g39720/7/' . . . . . . . 7007 2 stop_ save_ save_NMR_spectrometer_expt_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_3 _NMR_spec_expt.Entry_ID 7007 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name '3D 13C-separated NOESY (AROMATIC)' _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 . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqus 'acquisition parameters' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7007/timedomain_data/030305.5g39720/10/' . . . . . . . 7007 3 procs 'processing parameters' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7007/timedomain_data/030305.5g39720/10/pdata/1/' . . . . . . . 7007 3 pulseprogram 'pulse program' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7007/timedomain_data/030305.5g39720/10/' . . . . . . . 7007 3 ser 'raw spectral data' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7007/timedomain_data/030305.5g39720/10/' . . . . . . . 7007 3 . 'NMR Experiment Directory' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7007/timedomain_data/030305.5g39720/10/' . . . . . . . 7007 3 stop_ 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 7007 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm . external indirect 0.251449530 . . . . . . . . . 7007 1 H 1 DSS 'methyl protons' . . . . ppm . external direct 1.000000000 . . . . . . . . . 7007 1 N 15 DSS 'methyl protons' . . . . ppm . external indirect 0.101329118 . . . . . . . . . 7007 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chemical_shift_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_set_1 _Assigned_chem_shift_list.Entry_ID 7007 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_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 . 7007 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 5 5 HIS N N 15 117.759 0.1 . 1 . . . . . . . . 7007 1 2 . 1 1 5 5 HIS H H 1 8.647 0.02 . 1 . . . . . . . . 7007 1 3 . 1 1 7 7 HIS CA C 13 56.695 0.1 . 1 . . . . . . . . 7007 1 4 . 1 1 7 7 HIS HA H 1 4.602 0.02 . 1 . . . . . . . . 7007 1 5 . 1 1 7 7 HIS CB C 13 30.747 0.1 . 1 . . . . . . . . 7007 1 6 . 1 1 7 7 HIS HB3 H 1 3.109 0.02 . 2 . . . . . . . . 7007 1 7 . 1 1 7 7 HIS C C 13 175.145 0.1 . 1 . . . . . . . . 7007 1 8 . 1 1 8 8 LEU N N 15 123.596 0.1 . 1 . . . . . . . . 7007 1 9 . 1 1 8 8 LEU H H 1 8.248 0.02 . 1 . . . . . . . . 7007 1 10 . 1 1 8 8 LEU CA C 13 55.335 0.1 . 1 . . . . . . . . 7007 1 11 . 1 1 8 8 LEU HA H 1 4.303 0.02 . 1 . . . . . . . . 7007 1 12 . 1 1 8 8 LEU CB C 13 42.507 0.1 . 1 . . . . . . . . 7007 1 13 . 1 1 8 8 LEU HB3 H 1 1.586 0.02 . 2 . . . . . . . . 7007 1 14 . 1 1 8 8 LEU CG C 13 27.123 0.1 . 1 . . . . . . . . 7007 1 15 . 1 1 8 8 LEU HG H 1 1.417 0.02 . 1 . . . . . . . . 7007 1 16 . 1 1 8 8 LEU HD11 H 1 0.808 0.02 . 2 . . . . . . . . 7007 1 17 . 1 1 8 8 LEU HD12 H 1 0.808 0.02 . 2 . . . . . . . . 7007 1 18 . 1 1 8 8 LEU HD13 H 1 0.808 0.02 . 2 . . . . . . . . 7007 1 19 . 1 1 8 8 LEU HD21 H 1 0.859 0.02 . 2 . . . . . . . . 7007 1 20 . 1 1 8 8 LEU HD22 H 1 0.859 0.02 . 2 . . . . . . . . 7007 1 21 . 1 1 8 8 LEU HD23 H 1 0.859 0.02 . 2 . . . . . . . . 7007 1 22 . 1 1 8 8 LEU CD1 C 13 23.839 0.1 . 1 . . . . . . . . 7007 1 23 . 1 1 8 8 LEU CD2 C 13 25.466 0.1 . 1 . . . . . . . . 7007 1 24 . 1 1 8 8 LEU C C 13 177.280 0.1 . 1 . . . . . . . . 7007 1 25 . 1 1 9 9 GLU N N 15 121.913 0.1 . 1 . . . . . . . . 7007 1 26 . 1 1 9 9 GLU H H 1 8.462 0.02 . 1 . . . . . . . . 7007 1 27 . 1 1 9 9 GLU CA C 13 57.169 0.1 . 1 . . . . . . . . 7007 1 28 . 1 1 9 9 GLU HA H 1 4.274 0.02 . 1 . . . . . . . . 7007 1 29 . 1 1 9 9 GLU CB C 13 30.470 0.1 . 1 . . . . . . . . 7007 1 30 . 1 1 9 9 GLU HB2 H 1 2.062 0.02 . 2 . . . . . . . . 7007 1 31 . 1 1 9 9 GLU HB3 H 1 1.947 0.02 . 2 . . . . . . . . 7007 1 32 . 1 1 9 9 GLU CG C 13 36.591 0.1 . 1 . . . . . . . . 7007 1 33 . 1 1 9 9 GLU HG3 H 1 2.283 0.02 . 2 . . . . . . . . 7007 1 34 . 1 1 9 9 GLU C C 13 176.490 0.1 . 1 . . . . . . . . 7007 1 35 . 1 1 10 10 CYS N N 15 120.157 0.1 . 1 . . . . . . . . 7007 1 36 . 1 1 10 10 CYS H H 1 8.375 0.02 . 1 . . . . . . . . 7007 1 37 . 1 1 10 10 CYS CA C 13 58.556 0.1 . 1 . . . . . . . . 7007 1 38 . 1 1 10 10 CYS HA H 1 4.554 0.02 . 1 . . . . . . . . 7007 1 39 . 1 1 10 10 CYS CB C 13 28.711 0.1 . 1 . . . . . . . . 7007 1 40 . 1 1 10 10 CYS HB2 H 1 3.017 0.02 . 2 . . . . . . . . 7007 1 41 . 1 1 10 10 CYS HB3 H 1 2.933 0.02 . 2 . . . . . . . . 7007 1 42 . 1 1 10 10 CYS C C 13 174.760 0.1 . 1 . . . . . . . . 7007 1 43 . 1 1 11 11 SER N N 15 118.749 0.1 . 1 . . . . . . . . 7007 1 44 . 1 1 11 11 SER H H 1 8.498 0.02 . 1 . . . . . . . . 7007 1 45 . 1 1 11 11 SER CA C 13 58.852 0.1 . 1 . . . . . . . . 7007 1 46 . 1 1 11 11 SER HA H 1 4.491 0.02 . 1 . . . . . . . . 7007 1 47 . 1 1 11 11 SER CB C 13 64.179 0.1 . 1 . . . . . . . . 7007 1 48 . 1 1 11 11 SER HB3 H 1 3.926 0.02 . 2 . . . . . . . . 7007 1 49 . 1 1 11 11 SER C C 13 175.031 0.1 . 1 . . . . . . . . 7007 1 50 . 1 1 12 12 SER H H 1 8.469 0.02 . 1 . . . . . . . . 7007 1 51 . 1 1 12 12 SER CA C 13 59.240 0.1 . 1 . . . . . . . . 7007 1 52 . 1 1 12 12 SER HA H 1 4.459 0.02 . 1 . . . . . . . . 7007 1 53 . 1 1 12 12 SER CB C 13 64.185 0.1 . 1 . . . . . . . . 7007 1 54 . 1 1 12 12 SER HB2 H 1 3.957 0.02 . 2 . . . . . . . . 7007 1 55 . 1 1 12 12 SER HB3 H 1 3.883 0.02 . 2 . . . . . . . . 7007 1 56 . 1 1 12 12 SER C C 13 174.802 0.1 . 1 . . . . . . . . 7007 1 57 . 1 1 13 13 ASP N N 15 122.391 0.1 . 1 . . . . . . . . 7007 1 58 . 1 1 13 13 ASP H H 1 8.339 0.02 . 1 . . . . . . . . 7007 1 59 . 1 1 13 13 ASP CA C 13 55.269 0.1 . 1 . . . . . . . . 7007 1 60 . 1 1 13 13 ASP HA H 1 4.625 0.02 . 1 . . . . . . . . 7007 1 61 . 1 1 13 13 ASP CB C 13 41.384 0.1 . 1 . . . . . . . . 7007 1 62 . 1 1 13 13 ASP HB3 H 1 2.709 0.02 . 2 . . . . . . . . 7007 1 63 . 1 1 13 13 ASP C C 13 176.840 0.1 . 1 . . . . . . . . 7007 1 64 . 1 1 14 14 SER N N 15 115.942 0.1 . 1 . . . . . . . . 7007 1 65 . 1 1 14 14 SER H H 1 8.188 0.02 . 1 . . . . . . . . 7007 1 66 . 1 1 14 14 SER CA C 13 59.381 0.1 . 1 . . . . . . . . 7007 1 67 . 1 1 14 14 SER HA H 1 4.413 0.02 . 1 . . . . . . . . 7007 1 68 . 1 1 14 14 SER CB C 13 63.879 0.1 . 1 . . . . . . . . 7007 1 69 . 1 1 14 14 SER HB3 H 1 3.895 0.02 . 2 . . . . . . . . 7007 1 70 . 1 1 14 14 SER C C 13 174.758 0.1 . 1 . . . . . . . . 7007 1 71 . 1 1 15 15 LEU N N 15 123.303 0.1 . 1 . . . . . . . . 7007 1 72 . 1 1 15 15 LEU H H 1 8.079 0.02 . 1 . . . . . . . . 7007 1 73 . 1 1 15 15 LEU CA C 13 55.587 0.1 . 1 . . . . . . . . 7007 1 74 . 1 1 15 15 LEU HA H 1 4.348 0.02 . 1 . . . . . . . . 7007 1 75 . 1 1 15 15 LEU CB C 13 42.534 0.1 . 1 . . . . . . . . 7007 1 76 . 1 1 15 15 LEU HB2 H 1 1.653 0.02 . 2 . . . . . . . . 7007 1 77 . 1 1 15 15 LEU HB3 H 1 1.571 0.02 . 2 . . . . . . . . 7007 1 78 . 1 1 15 15 LEU CG C 13 27.415 0.1 . 1 . . . . . . . . 7007 1 79 . 1 1 15 15 LEU HG H 1 1.581 0.02 . 1 . . . . . . . . 7007 1 80 . 1 1 15 15 LEU HD11 H 1 0.834 0.02 . 2 . . . . . . . . 7007 1 81 . 1 1 15 15 LEU HD12 H 1 0.834 0.02 . 2 . . . . . . . . 7007 1 82 . 1 1 15 15 LEU HD13 H 1 0.834 0.02 . 2 . . . . . . . . 7007 1 83 . 1 1 15 15 LEU HD21 H 1 0.904 0.02 . 2 . . . . . . . . 7007 1 84 . 1 1 15 15 LEU HD22 H 1 0.904 0.02 . 2 . . . . . . . . 7007 1 85 . 1 1 15 15 LEU HD23 H 1 0.904 0.02 . 2 . . . . . . . . 7007 1 86 . 1 1 15 15 LEU CD1 C 13 23.740 0.1 . 1 . . . . . . . . 7007 1 87 . 1 1 15 15 LEU CD2 C 13 25.415 0.1 . 1 . . . . . . . . 7007 1 88 . 1 1 15 15 LEU C C 13 176.999 0.1 . 1 . . . . . . . . 7007 1 89 . 1 1 16 16 GLN N N 15 120.783 0.1 . 1 . . . . . . . . 7007 1 90 . 1 1 16 16 GLN H H 1 8.081 0.02 . 1 . . . . . . . . 7007 1 91 . 1 1 16 16 GLN CA C 13 56.025 0.1 . 1 . . . . . . . . 7007 1 92 . 1 1 16 16 GLN HA H 1 4.233 0.02 . 1 . . . . . . . . 7007 1 93 . 1 1 16 16 GLN CB C 13 29.566 0.1 . 1 . . . . . . . . 7007 1 94 . 1 1 16 16 GLN HB2 H 1 1.918 0.02 . 2 . . . . . . . . 7007 1 95 . 1 1 16 16 GLN HB3 H 1 2.019 0.02 . 2 . . . . . . . . 7007 1 96 . 1 1 16 16 GLN CG C 13 34.104 0.1 . 1 . . . . . . . . 7007 1 97 . 1 1 16 16 GLN HG3 H 1 2.224 0.02 . 2 . . . . . . . . 7007 1 98 . 1 1 16 16 GLN C C 13 174.573 0.1 . 1 . . . . . . . . 7007 1 99 . 1 1 17 17 LEU N N 15 121.498 0.1 . 1 . . . . . . . . 7007 1 100 . 1 1 17 17 LEU H H 1 7.674 0.02 . 1 . . . . . . . . 7007 1 101 . 1 1 17 17 LEU CA C 13 53.707 0.1 . 1 . . . . . . . . 7007 1 102 . 1 1 17 17 LEU HA H 1 4.680 0.02 . 1 . . . . . . . . 7007 1 103 . 1 1 17 17 LEU CB C 13 45.166 0.1 . 1 . . . . . . . . 7007 1 104 . 1 1 17 17 LEU HB2 H 1 1.132 0.02 . 2 . . . . . . . . 7007 1 105 . 1 1 17 17 LEU HB3 H 1 1.581 0.02 . 2 . . . . . . . . 7007 1 106 . 1 1 17 17 LEU CG C 13 27.262 0.1 . 1 . . . . . . . . 7007 1 107 . 1 1 17 17 LEU HG H 1 1.498 0.02 . 1 . . . . . . . . 7007 1 108 . 1 1 17 17 LEU HD11 H 1 0.830 0.02 . 2 . . . . . . . . 7007 1 109 . 1 1 17 17 LEU HD12 H 1 0.830 0.02 . 2 . . . . . . . . 7007 1 110 . 1 1 17 17 LEU HD13 H 1 0.830 0.02 . 2 . . . . . . . . 7007 1 111 . 1 1 17 17 LEU HD21 H 1 0.702 0.02 . 2 . . . . . . . . 7007 1 112 . 1 1 17 17 LEU HD22 H 1 0.702 0.02 . 2 . . . . . . . . 7007 1 113 . 1 1 17 17 LEU HD23 H 1 0.702 0.02 . 2 . . . . . . . . 7007 1 114 . 1 1 17 17 LEU CD1 C 13 25.831 0.1 . 1 . . . . . . . . 7007 1 115 . 1 1 17 17 LEU CD2 C 13 23.642 0.1 . 1 . . . . . . . . 7007 1 116 . 1 1 17 17 LEU C C 13 176.469 0.1 . 1 . . . . . . . . 7007 1 117 . 1 1 18 18 HIS N N 15 120.238 0.1 . 1 . . . . . . . . 7007 1 118 . 1 1 18 18 HIS H H 1 9.376 0.02 . 1 . . . . . . . . 7007 1 119 . 1 1 18 18 HIS CA C 13 55.390 0.1 . 1 . . . . . . . . 7007 1 120 . 1 1 18 18 HIS HA H 1 4.648 0.02 . 1 . . . . . . . . 7007 1 121 . 1 1 18 18 HIS CB C 13 34.468 0.1 . 1 . . . . . . . . 7007 1 122 . 1 1 18 18 HIS HB3 H 1 2.617 0.02 . 2 . . . . . . . . 7007 1 123 . 1 1 18 18 HIS CD2 C 13 118.722 0.1 . 1 . . . . . . . . 7007 1 124 . 1 1 18 18 HIS CE1 C 13 138.375 0.1 . 1 . . . . . . . . 7007 1 125 . 1 1 18 18 HIS HD2 H 1 6.718 0.02 . 1 . . . . . . . . 7007 1 126 . 1 1 18 18 HIS HE1 H 1 7.549 0.02 . 1 . . . . . . . . 7007 1 127 . 1 1 18 18 HIS C C 13 173.780 0.1 . 1 . . . . . . . . 7007 1 128 . 1 1 19 19 ASN N N 15 121.104 0.1 . 1 . . . . . . . . 7007 1 129 . 1 1 19 19 ASN H H 1 8.773 0.02 . 1 . . . . . . . . 7007 1 130 . 1 1 19 19 ASN CA C 13 52.239 0.1 . 1 . . . . . . . . 7007 1 131 . 1 1 19 19 ASN HA H 1 6.046 0.02 . 1 . . . . . . . . 7007 1 132 . 1 1 19 19 ASN CB C 13 40.812 0.1 . 1 . . . . . . . . 7007 1 133 . 1 1 19 19 ASN HB2 H 1 2.476 0.02 . 2 . . . . . . . . 7007 1 134 . 1 1 19 19 ASN HB3 H 1 2.759 0.02 . 2 . . . . . . . . 7007 1 135 . 1 1 19 19 ASN ND2 N 15 114.626 0.1 . 1 . . . . . . . . 7007 1 136 . 1 1 19 19 ASN HD21 H 1 6.880 0.02 . 2 . . . . . . . . 7007 1 137 . 1 1 19 19 ASN HD22 H 1 7.740 0.02 . 2 . . . . . . . . 7007 1 138 . 1 1 19 19 ASN C C 13 175.234 0.1 . 1 . . . . . . . . 7007 1 139 . 1 1 20 20 VAL N N 15 123.888 0.1 . 1 . . . . . . . . 7007 1 140 . 1 1 20 20 VAL H H 1 8.959 0.02 . 1 . . . . . . . . 7007 1 141 . 1 1 20 20 VAL CA C 13 60.976 0.1 . 1 . . . . . . . . 7007 1 142 . 1 1 20 20 VAL HA H 1 4.993 0.02 . 1 . . . . . . . . 7007 1 143 . 1 1 20 20 VAL CB C 13 36.523 0.1 . 1 . . . . . . . . 7007 1 144 . 1 1 20 20 VAL HB H 1 1.873 0.02 . 1 . . . . . . . . 7007 1 145 . 1 1 20 20 VAL HG11 H 1 0.715 0.02 . 2 . . . . . . . . 7007 1 146 . 1 1 20 20 VAL HG12 H 1 0.715 0.02 . 2 . . . . . . . . 7007 1 147 . 1 1 20 20 VAL HG13 H 1 0.715 0.02 . 2 . . . . . . . . 7007 1 148 . 1 1 20 20 VAL HG21 H 1 0.767 0.02 . 2 . . . . . . . . 7007 1 149 . 1 1 20 20 VAL HG22 H 1 0.767 0.02 . 2 . . . . . . . . 7007 1 150 . 1 1 20 20 VAL HG23 H 1 0.767 0.02 . 2 . . . . . . . . 7007 1 151 . 1 1 20 20 VAL CG1 C 13 21.498 0.1 . 1 . . . . . . . . 7007 1 152 . 1 1 20 20 VAL CG2 C 13 20.527 0.1 . 1 . . . . . . . . 7007 1 153 . 1 1 20 20 VAL C C 13 175.135 0.1 . 1 . . . . . . . . 7007 1 154 . 1 1 21 21 PHE N N 15 128.618 0.1 . 1 . . . . . . . . 7007 1 155 . 1 1 21 21 PHE H H 1 9.751 0.02 . 1 . . . . . . . . 7007 1 156 . 1 1 21 21 PHE CA C 13 57.341 0.1 . 1 . . . . . . . . 7007 1 157 . 1 1 21 21 PHE HA H 1 5.305 0.02 . 1 . . . . . . . . 7007 1 158 . 1 1 21 21 PHE CB C 13 41.679 0.1 . 1 . . . . . . . . 7007 1 159 . 1 1 21 21 PHE HB2 H 1 2.784 0.02 . 2 . . . . . . . . 7007 1 160 . 1 1 21 21 PHE HB3 H 1 2.656 0.02 . 2 . . . . . . . . 7007 1 161 . 1 1 21 21 PHE CD1 C 13 132.198 0.1 . 1 . . . . . . . . 7007 1 162 . 1 1 21 21 PHE HD1 H 1 6.970 0.02 . 1 . . . . . . . . 7007 1 163 . 1 1 21 21 PHE CE1 C 13 130.755 0.1 . 1 . . . . . . . . 7007 1 164 . 1 1 21 21 PHE HE1 H 1 6.824 0.02 . 1 . . . . . . . . 7007 1 165 . 1 1 21 21 PHE HE2 H 1 6.824 0.02 . 1 . . . . . . . . 7007 1 166 . 1 1 21 21 PHE HD2 H 1 6.970 0.02 . 1 . . . . . . . . 7007 1 167 . 1 1 21 21 PHE C C 13 174.150 0.1 . 1 . . . . . . . . 7007 1 168 . 1 1 22 22 VAL N N 15 122.449 0.1 . 1 . . . . . . . . 7007 1 169 . 1 1 22 22 VAL H H 1 9.230 0.02 . 1 . . . . . . . . 7007 1 170 . 1 1 22 22 VAL CA C 13 59.023 0.1 . 1 . . . . . . . . 7007 1 171 . 1 1 22 22 VAL HA H 1 4.290 0.02 . 1 . . . . . . . . 7007 1 172 . 1 1 22 22 VAL CB C 13 35.273 0.1 . 1 . . . . . . . . 7007 1 173 . 1 1 22 22 VAL HB H 1 1.727 0.02 . 1 . . . . . . . . 7007 1 174 . 1 1 22 22 VAL HG11 H 1 0.444 0.02 . 2 . . . . . . . . 7007 1 175 . 1 1 22 22 VAL HG12 H 1 0.444 0.02 . 2 . . . . . . . . 7007 1 176 . 1 1 22 22 VAL HG13 H 1 0.444 0.02 . 2 . . . . . . . . 7007 1 177 . 1 1 22 22 VAL HG21 H 1 0.730 0.02 . 2 . . . . . . . . 7007 1 178 . 1 1 22 22 VAL HG22 H 1 0.730 0.02 . 2 . . . . . . . . 7007 1 179 . 1 1 22 22 VAL HG23 H 1 0.730 0.02 . 2 . . . . . . . . 7007 1 180 . 1 1 22 22 VAL CG1 C 13 17.290 0.1 . 1 . . . . . . . . 7007 1 181 . 1 1 22 22 VAL CG2 C 13 21.821 0.1 . 1 . . . . . . . . 7007 1 182 . 1 1 22 22 VAL C C 13 173.637 0.1 . 1 . . . . . . . . 7007 1 183 . 1 1 23 23 TYR N N 15 113.882 0.1 . 1 . . . . . . . . 7007 1 184 . 1 1 23 23 TYR H H 1 7.056 0.02 . 1 . . . . . . . . 7007 1 185 . 1 1 23 23 TYR CA C 13 56.110 0.1 . 1 . . . . . . . . 7007 1 186 . 1 1 23 23 TYR HA H 1 4.466 0.02 . 1 . . . . . . . . 7007 1 187 . 1 1 23 23 TYR CB C 13 38.954 0.1 . 1 . . . . . . . . 7007 1 188 . 1 1 23 23 TYR HB2 H 1 2.150 0.02 . 2 . . . . . . . . 7007 1 189 . 1 1 23 23 TYR HB3 H 1 3.126 0.02 . 2 . . . . . . . . 7007 1 190 . 1 1 23 23 TYR CD1 C 13 134.756 0.1 . 1 . . . . . . . . 7007 1 191 . 1 1 23 23 TYR HD1 H 1 6.655 0.02 . 1 . . . . . . . . 7007 1 192 . 1 1 23 23 TYR CE1 C 13 118.418 0.1 . 1 . . . . . . . . 7007 1 193 . 1 1 23 23 TYR HE1 H 1 6.158 0.02 . 1 . . . . . . . . 7007 1 194 . 1 1 23 23 TYR HE2 H 1 6.158 0.02 . 1 . . . . . . . . 7007 1 195 . 1 1 23 23 TYR HD2 H 1 6.655 0.02 . 1 . . . . . . . . 7007 1 196 . 1 1 23 23 TYR C C 13 174.221 0.1 . 1 . . . . . . . . 7007 1 197 . 1 1 25 25 SER C C 13 175.359 0.1 . 1 . . . . . . . . 7007 1 198 . 1 1 26 26 PHE N N 15 117.637 0.1 . 1 . . . . . . . . 7007 1 199 . 1 1 26 26 PHE H H 1 7.888 0.02 . 1 . . . . . . . . 7007 1 200 . 1 1 26 26 PHE CA C 13 57.920 0.1 . 1 . . . . . . . . 7007 1 201 . 1 1 26 26 PHE HA H 1 4.262 0.02 . 1 . . . . . . . . 7007 1 202 . 1 1 26 26 PHE CB C 13 37.026 0.1 . 1 . . . . . . . . 7007 1 203 . 1 1 26 26 PHE HB2 H 1 2.726 0.02 . 2 . . . . . . . . 7007 1 204 . 1 1 26 26 PHE HB3 H 1 3.165 0.02 . 2 . . . . . . . . 7007 1 205 . 1 1 26 26 PHE CD1 C 13 130.008 0.1 . 1 . . . . . . . . 7007 1 206 . 1 1 26 26 PHE HD1 H 1 6.900 0.02 . 1 . . . . . . . . 7007 1 207 . 1 1 26 26 PHE CE1 C 13 131.273 0.1 . 1 . . . . . . . . 7007 1 208 . 1 1 26 26 PHE HE1 H 1 6.792 0.02 . 1 . . . . . . . . 7007 1 209 . 1 1 26 26 PHE HE2 H 1 6.792 0.02 . 1 . . . . . . . . 7007 1 210 . 1 1 26 26 PHE HD2 H 1 6.900 0.02 . 1 . . . . . . . . 7007 1 211 . 1 1 26 26 PHE C C 13 173.128 0.1 . 1 . . . . . . . . 7007 1 212 . 1 1 27 27 GLN N N 15 110.185 0.1 . 1 . . . . . . . . 7007 1 213 . 1 1 27 27 GLN H H 1 6.971 0.02 . 1 . . . . . . . . 7007 1 214 . 1 1 27 27 GLN CA C 13 57.769 0.1 . 1 . . . . . . . . 7007 1 215 . 1 1 27 27 GLN HA H 1 3.649 0.02 . 1 . . . . . . . . 7007 1 216 . 1 1 27 27 GLN CB C 13 32.917 0.1 . 1 . . . . . . . . 7007 1 217 . 1 1 27 27 GLN HB2 H 1 1.607 0.02 . 1 . . . . . . . . 7007 1 218 . 1 1 27 27 GLN HB3 H 1 1.607 0.02 . 1 . . . . . . . . 7007 1 219 . 1 1 27 27 GLN CG C 13 36.364 0.1 . 1 . . . . . . . . 7007 1 220 . 1 1 27 27 GLN HG2 H 1 1.587 0.02 . 2 . . . . . . . . 7007 1 221 . 1 1 27 27 GLN HG3 H 1 1.898 0.02 . 2 . . . . . . . . 7007 1 222 . 1 1 27 27 GLN NE2 N 15 106.277 0.1 . 1 . . . . . . . . 7007 1 223 . 1 1 27 27 GLN HE21 H 1 6.556 0.02 . 2 . . . . . . . . 7007 1 224 . 1 1 27 27 GLN HE22 H 1 6.405 0.02 . 2 . . . . . . . . 7007 1 225 . 1 1 27 27 GLN C C 13 175.620 0.1 . 1 . . . . . . . . 7007 1 226 . 1 1 28 28 ASP N N 15 120.496 0.1 . 1 . . . . . . . . 7007 1 227 . 1 1 28 28 ASP H H 1 7.909 0.02 . 1 . . . . . . . . 7007 1 228 . 1 1 28 28 ASP CA C 13 51.902 0.1 . 1 . . . . . . . . 7007 1 229 . 1 1 28 28 ASP HA H 1 5.065 0.02 . 1 . . . . . . . . 7007 1 230 . 1 1 28 28 ASP CB C 13 44.457 0.1 . 1 . . . . . . . . 7007 1 231 . 1 1 28 28 ASP HB2 H 1 2.950 0.02 . 2 . . . . . . . . 7007 1 232 . 1 1 28 28 ASP HB3 H 1 3.454 0.02 . 2 . . . . . . . . 7007 1 233 . 1 1 28 28 ASP C C 13 174.794 0.1 . 1 . . . . . . . . 7007 1 234 . 1 1 29 29 PRO CD C 13 51.578 0.1 . 1 . . . . . . . . 7007 1 235 . 1 1 29 29 PRO CA C 13 65.255 0.1 . 1 . . . . . . . . 7007 1 236 . 1 1 29 29 PRO HA H 1 4.222 0.02 . 1 . . . . . . . . 7007 1 237 . 1 1 29 29 PRO CB C 13 32.958 0.1 . 1 . . . . . . . . 7007 1 238 . 1 1 29 29 PRO HB2 H 1 2.052 0.02 . 2 . . . . . . . . 7007 1 239 . 1 1 29 29 PRO HB3 H 1 2.311 0.02 . 2 . . . . . . . . 7007 1 240 . 1 1 29 29 PRO CG C 13 27.948 0.1 . 1 . . . . . . . . 7007 1 241 . 1 1 29 29 PRO HG2 H 1 2.034 0.02 . 2 . . . . . . . . 7007 1 242 . 1 1 29 29 PRO HG3 H 1 2.120 0.02 . 2 . . . . . . . . 7007 1 243 . 1 1 29 29 PRO HD2 H 1 3.933 0.02 . 2 . . . . . . . . 7007 1 244 . 1 1 29 29 PRO HD3 H 1 4.139 0.02 . 2 . . . . . . . . 7007 1 245 . 1 1 29 29 PRO C C 13 178.412 0.1 . 1 . . . . . . . . 7007 1 246 . 1 1 30 30 ASP N N 15 117.803 0.1 . 1 . . . . . . . . 7007 1 247 . 1 1 30 30 ASP H H 1 8.548 0.02 . 1 . . . . . . . . 7007 1 248 . 1 1 30 30 ASP CA C 13 57.822 0.1 . 1 . . . . . . . . 7007 1 249 . 1 1 30 30 ASP HA H 1 4.514 0.02 . 1 . . . . . . . . 7007 1 250 . 1 1 30 30 ASP CB C 13 41.287 0.1 . 1 . . . . . . . . 7007 1 251 . 1 1 30 30 ASP HB2 H 1 2.725 0.02 . 1 . . . . . . . . 7007 1 252 . 1 1 30 30 ASP HB3 H 1 2.725 0.02 . 1 . . . . . . . . 7007 1 253 . 1 1 30 30 ASP C C 13 179.039 0.1 . 1 . . . . . . . . 7007 1 254 . 1 1 31 31 VAL N N 15 121.607 0.1 . 1 . . . . . . . . 7007 1 255 . 1 1 31 31 VAL H H 1 8.262 0.02 . 1 . . . . . . . . 7007 1 256 . 1 1 31 31 VAL CA C 13 66.620 0.1 . 1 . . . . . . . . 7007 1 257 . 1 1 31 31 VAL HA H 1 3.691 0.02 . 1 . . . . . . . . 7007 1 258 . 1 1 31 31 VAL CB C 13 32.209 0.1 . 1 . . . . . . . . 7007 1 259 . 1 1 31 31 VAL HB H 1 2.675 0.02 . 1 . . . . . . . . 7007 1 260 . 1 1 31 31 VAL HG11 H 1 0.884 0.02 . 2 . . . . . . . . 7007 1 261 . 1 1 31 31 VAL HG12 H 1 0.884 0.02 . 2 . . . . . . . . 7007 1 262 . 1 1 31 31 VAL HG13 H 1 0.884 0.02 . 2 . . . . . . . . 7007 1 263 . 1 1 31 31 VAL HG21 H 1 1.435 0.02 . 2 . . . . . . . . 7007 1 264 . 1 1 31 31 VAL HG22 H 1 1.435 0.02 . 2 . . . . . . . . 7007 1 265 . 1 1 31 31 VAL HG23 H 1 1.435 0.02 . 2 . . . . . . . . 7007 1 266 . 1 1 31 31 VAL CG1 C 13 22.769 0.1 . 1 . . . . . . . . 7007 1 267 . 1 1 31 31 VAL CG2 C 13 23.136 0.1 . 1 . . . . . . . . 7007 1 268 . 1 1 31 31 VAL C C 13 178.152 0.1 . 1 . . . . . . . . 7007 1 269 . 1 1 32 32 ILE N N 15 118.148 0.1 . 1 . . . . . . . . 7007 1 270 . 1 1 32 32 ILE H H 1 8.176 0.02 . 1 . . . . . . . . 7007 1 271 . 1 1 32 32 ILE CA C 13 63.131 0.1 . 1 . . . . . . . . 7007 1 272 . 1 1 32 32 ILE HA H 1 3.778 0.02 . 1 . . . . . . . . 7007 1 273 . 1 1 32 32 ILE CB C 13 37.927 0.1 . 1 . . . . . . . . 7007 1 274 . 1 1 32 32 ILE HB H 1 2.014 0.02 . 1 . . . . . . . . 7007 1 275 . 1 1 32 32 ILE HG21 H 1 1.104 0.02 . 1 . . . . . . . . 7007 1 276 . 1 1 32 32 ILE HG22 H 1 1.104 0.02 . 1 . . . . . . . . 7007 1 277 . 1 1 32 32 ILE HG23 H 1 1.104 0.02 . 1 . . . . . . . . 7007 1 278 . 1 1 32 32 ILE CG2 C 13 19.879 0.1 . 1 . . . . . . . . 7007 1 279 . 1 1 32 32 ILE CG1 C 13 29.876 0.1 . 1 . . . . . . . . 7007 1 280 . 1 1 32 32 ILE HG12 H 1 1.204 0.02 . 2 . . . . . . . . 7007 1 281 . 1 1 32 32 ILE HG13 H 1 1.580 0.02 . 2 . . . . . . . . 7007 1 282 . 1 1 32 32 ILE HD11 H 1 0.694 0.02 . 1 . . . . . . . . 7007 1 283 . 1 1 32 32 ILE HD12 H 1 0.694 0.02 . 1 . . . . . . . . 7007 1 284 . 1 1 32 32 ILE HD13 H 1 0.694 0.02 . 1 . . . . . . . . 7007 1 285 . 1 1 32 32 ILE CD1 C 13 14.376 0.1 . 1 . . . . . . . . 7007 1 286 . 1 1 32 32 ILE C C 13 177.396 0.1 . 1 . . . . . . . . 7007 1 287 . 1 1 33 33 ASN N N 15 118.673 0.1 . 1 . . . . . . . . 7007 1 288 . 1 1 33 33 ASN H H 1 7.930 0.02 . 1 . . . . . . . . 7007 1 289 . 1 1 33 33 ASN CA C 13 57.226 0.1 . 1 . . . . . . . . 7007 1 290 . 1 1 33 33 ASN HA H 1 4.508 0.02 . 1 . . . . . . . . 7007 1 291 . 1 1 33 33 ASN CB C 13 40.326 0.1 . 1 . . . . . . . . 7007 1 292 . 1 1 33 33 ASN HB2 H 1 2.700 0.02 . 2 . . . . . . . . 7007 1 293 . 1 1 33 33 ASN HB3 H 1 2.944 0.02 . 2 . . . . . . . . 7007 1 294 . 1 1 33 33 ASN ND2 N 15 112.231 0.1 . 1 . . . . . . . . 7007 1 295 . 1 1 33 33 ASN HD21 H 1 6.930 0.02 . 2 . . . . . . . . 7007 1 296 . 1 1 33 33 ASN HD22 H 1 7.417 0.02 . 2 . . . . . . . . 7007 1 297 . 1 1 33 33 ASN C C 13 178.236 0.1 . 1 . . . . . . . . 7007 1 298 . 1 1 34 34 VAL N N 15 117.970 0.1 . 1 . . . . . . . . 7007 1 299 . 1 1 34 34 VAL H H 1 7.548 0.02 . 1 . . . . . . . . 7007 1 300 . 1 1 34 34 VAL CA C 13 65.692 0.1 . 1 . . . . . . . . 7007 1 301 . 1 1 34 34 VAL HA H 1 3.878 0.02 . 1 . . . . . . . . 7007 1 302 . 1 1 34 34 VAL CB C 13 31.875 0.1 . 1 . . . . . . . . 7007 1 303 . 1 1 34 34 VAL HB H 1 2.429 0.02 . 1 . . . . . . . . 7007 1 304 . 1 1 34 34 VAL HG11 H 1 1.291 0.02 . 2 . . . . . . . . 7007 1 305 . 1 1 34 34 VAL HG12 H 1 1.291 0.02 . 2 . . . . . . . . 7007 1 306 . 1 1 34 34 VAL HG13 H 1 1.291 0.02 . 2 . . . . . . . . 7007 1 307 . 1 1 34 34 VAL HG21 H 1 0.986 0.02 . 2 . . . . . . . . 7007 1 308 . 1 1 34 34 VAL HG22 H 1 0.986 0.02 . 2 . . . . . . . . 7007 1 309 . 1 1 34 34 VAL HG23 H 1 0.986 0.02 . 2 . . . . . . . . 7007 1 310 . 1 1 34 34 VAL CG1 C 13 23.740 0.1 . 1 . . . . . . . . 7007 1 311 . 1 1 34 34 VAL CG2 C 13 22.145 0.1 . 1 . . . . . . . . 7007 1 312 . 1 1 34 34 VAL C C 13 176.779 0.1 . 1 . . . . . . . . 7007 1 313 . 1 1 35 35 MET N N 15 116.392 0.1 . 1 . . . . . . . . 7007 1 314 . 1 1 35 35 MET H H 1 7.355 0.02 . 1 . . . . . . . . 7007 1 315 . 1 1 35 35 MET CA C 13 57.859 0.1 . 1 . . . . . . . . 7007 1 316 . 1 1 35 35 MET HA H 1 4.378 0.02 . 1 . . . . . . . . 7007 1 317 . 1 1 35 35 MET CB C 13 33.775 0.1 . 1 . . . . . . . . 7007 1 318 . 1 1 35 35 MET HB3 H 1 1.995 0.02 . 2 . . . . . . . . 7007 1 319 . 1 1 35 35 MET CG C 13 32.300 0.1 . 1 . . . . . . . . 7007 1 320 . 1 1 35 35 MET HG3 H 1 2.311 0.02 . 2 . . . . . . . . 7007 1 321 . 1 1 35 35 MET HE1 H 1 1.490 0.02 . 1 . . . . . . . . 7007 1 322 . 1 1 35 35 MET HE2 H 1 1.490 0.02 . 1 . . . . . . . . 7007 1 323 . 1 1 35 35 MET HE3 H 1 1.490 0.02 . 1 . . . . . . . . 7007 1 324 . 1 1 35 35 MET CE C 13 17.335 0.1 . 1 . . . . . . . . 7007 1 325 . 1 1 35 35 MET C C 13 177.083 0.1 . 1 . . . . . . . . 7007 1 326 . 1 1 36 36 LEU N N 15 114.038 0.1 . 1 . . . . . . . . 7007 1 327 . 1 1 36 36 LEU H H 1 8.329 0.02 . 1 . . . . . . . . 7007 1 328 . 1 1 36 36 LEU CA C 13 54.970 0.1 . 1 . . . . . . . . 7007 1 329 . 1 1 36 36 LEU HA H 1 4.497 0.02 . 1 . . . . . . . . 7007 1 330 . 1 1 36 36 LEU CB C 13 43.100 0.1 . 1 . . . . . . . . 7007 1 331 . 1 1 36 36 LEU HB2 H 1 1.655 0.02 . 2 . . . . . . . . 7007 1 332 . 1 1 36 36 LEU HB3 H 1 1.966 0.02 . 2 . . . . . . . . 7007 1 333 . 1 1 36 36 LEU CG C 13 27.173 0.1 . 1 . . . . . . . . 7007 1 334 . 1 1 36 36 LEU HG H 1 1.690 0.02 . 1 . . . . . . . . 7007 1 335 . 1 1 36 36 LEU HD21 H 1 0.730 0.02 . 2 . . . . . . . . 7007 1 336 . 1 1 36 36 LEU HD22 H 1 0.730 0.02 . 2 . . . . . . . . 7007 1 337 . 1 1 36 36 LEU HD23 H 1 0.730 0.02 . 2 . . . . . . . . 7007 1 338 . 1 1 36 36 LEU CD2 C 13 25.200 0.1 . 1 . . . . . . . . 7007 1 339 . 1 1 36 36 LEU C C 13 177.012 0.1 . 1 . . . . . . . . 7007 1 340 . 1 1 37 37 ASP N N 15 117.948 0.1 . 1 . . . . . . . . 7007 1 341 . 1 1 37 37 ASP H H 1 8.469 0.02 . 1 . . . . . . . . 7007 1 342 . 1 1 37 37 ASP CA C 13 56.252 0.1 . 1 . . . . . . . . 7007 1 343 . 1 1 37 37 ASP HA H 1 4.483 0.02 . 1 . . . . . . . . 7007 1 344 . 1 1 37 37 ASP CB C 13 40.644 0.1 . 1 . . . . . . . . 7007 1 345 . 1 1 37 37 ASP HB2 H 1 2.652 0.02 . 2 . . . . . . . . 7007 1 346 . 1 1 37 37 ASP HB3 H 1 3.061 0.02 . 2 . . . . . . . . 7007 1 347 . 1 1 37 37 ASP C C 13 173.983 0.1 . 1 . . . . . . . . 7007 1 348 . 1 1 38 38 ARG N N 15 111.619 0.1 . 1 . . . . . . . . 7007 1 349 . 1 1 38 38 ARG H H 1 7.559 0.02 . 1 . . . . . . . . 7007 1 350 . 1 1 38 38 ARG CA C 13 54.973 0.1 . 1 . . . . . . . . 7007 1 351 . 1 1 38 38 ARG HA H 1 4.477 0.02 . 1 . . . . . . . . 7007 1 352 . 1 1 38 38 ARG CB C 13 30.662 0.1 . 1 . . . . . . . . 7007 1 353 . 1 1 38 38 ARG HB2 H 1 1.709 0.02 . 2 . . . . . . . . 7007 1 354 . 1 1 38 38 ARG HB3 H 1 1.966 0.02 . 2 . . . . . . . . 7007 1 355 . 1 1 38 38 ARG CG C 13 26.329 0.1 . 1 . . . . . . . . 7007 1 356 . 1 1 38 38 ARG HG2 H 1 0.859 0.02 . 2 . . . . . . . . 7007 1 357 . 1 1 38 38 ARG HG3 H 1 1.403 0.02 . 2 . . . . . . . . 7007 1 358 . 1 1 38 38 ARG CD C 13 43.162 0.1 . 1 . . . . . . . . 7007 1 359 . 1 1 38 38 ARG HD2 H 1 3.008 0.02 . 2 . . . . . . . . 7007 1 360 . 1 1 38 38 ARG NE N 15 87.258 0.1 . 1 . . . . . . . . 7007 1 361 . 1 1 38 38 ARG HE H 1 9.417 0.02 . 1 . . . . . . . . 7007 1 362 . 1 1 38 38 ARG C C 13 173.414 0.1 . 1 . . . . . . . . 7007 1 363 . 1 1 39 39 THR N N 15 114.964 0.1 . 1 . . . . . . . . 7007 1 364 . 1 1 39 39 THR H H 1 8.631 0.02 . 1 . . . . . . . . 7007 1 365 . 1 1 39 39 THR CA C 13 59.347 0.1 . 1 . . . . . . . . 7007 1 366 . 1 1 39 39 THR HA H 1 4.843 0.02 . 1 . . . . . . . . 7007 1 367 . 1 1 39 39 THR CB C 13 70.005 0.1 . 1 . . . . . . . . 7007 1 368 . 1 1 39 39 THR HB H 1 4.072 0.02 . 1 . . . . . . . . 7007 1 369 . 1 1 39 39 THR HG21 H 1 1.295 0.02 . 1 . . . . . . . . 7007 1 370 . 1 1 39 39 THR HG22 H 1 1.295 0.02 . 1 . . . . . . . . 7007 1 371 . 1 1 39 39 THR HG23 H 1 1.295 0.02 . 1 . . . . . . . . 7007 1 372 . 1 1 39 39 THR CG2 C 13 22.145 0.1 . 1 . . . . . . . . 7007 1 373 . 1 1 39 39 THR C C 13 173.514 0.1 . 1 . . . . . . . . 7007 1 374 . 1 1 40 40 PRO CD C 13 51.481 0.1 . 1 . . . . . . . . 7007 1 375 . 1 1 40 40 PRO CA C 13 62.499 0.1 . 1 . . . . . . . . 7007 1 376 . 1 1 40 40 PRO HA H 1 4.641 0.02 . 1 . . . . . . . . 7007 1 377 . 1 1 40 40 PRO CB C 13 32.252 0.1 . 1 . . . . . . . . 7007 1 378 . 1 1 40 40 PRO HB3 H 1 2.165 0.02 . 2 . . . . . . . . 7007 1 379 . 1 1 40 40 PRO CG C 13 27.087 0.1 . 1 . . . . . . . . 7007 1 380 . 1 1 40 40 PRO HG2 H 1 1.613 0.02 . 2 . . . . . . . . 7007 1 381 . 1 1 40 40 PRO HG3 H 1 1.695 0.02 . 2 . . . . . . . . 7007 1 382 . 1 1 40 40 PRO HD2 H 1 3.619 0.02 . 2 . . . . . . . . 7007 1 383 . 1 1 40 40 PRO HD3 H 1 3.804 0.02 . 2 . . . . . . . . 7007 1 384 . 1 1 40 40 PRO C C 13 174.546 0.1 . 1 . . . . . . . . 7007 1 385 . 1 1 41 41 GLU N N 15 120.686 0.1 . 1 . . . . . . . . 7007 1 386 . 1 1 41 41 GLU H H 1 8.208 0.02 . 1 . . . . . . . . 7007 1 387 . 1 1 41 41 GLU CA C 13 57.969 0.1 . 1 . . . . . . . . 7007 1 388 . 1 1 41 41 GLU HA H 1 4.117 0.02 . 1 . . . . . . . . 7007 1 389 . 1 1 41 41 GLU CB C 13 30.128 0.1 . 1 . . . . . . . . 7007 1 390 . 1 1 41 41 GLU HB3 H 1 1.942 0.02 . 2 . . . . . . . . 7007 1 391 . 1 1 41 41 GLU CG C 13 36.777 0.1 . 1 . . . . . . . . 7007 1 392 . 1 1 41 41 GLU HG2 H 1 2.299 0.02 . 2 . . . . . . . . 7007 1 393 . 1 1 41 41 GLU HG3 H 1 2.163 0.02 . 2 . . . . . . . . 7007 1 394 . 1 1 41 41 GLU C C 13 175.094 0.1 . 1 . . . . . . . . 7007 1 395 . 1 1 42 42 ILE N N 15 123.977 0.1 . 1 . . . . . . . . 7007 1 396 . 1 1 42 42 ILE H H 1 7.990 0.02 . 1 . . . . . . . . 7007 1 397 . 1 1 42 42 ILE CA C 13 60.642 0.1 . 1 . . . . . . . . 7007 1 398 . 1 1 42 42 ILE HA H 1 5.179 0.02 . 1 . . . . . . . . 7007 1 399 . 1 1 42 42 ILE CB C 13 41.714 0.1 . 1 . . . . . . . . 7007 1 400 . 1 1 42 42 ILE HB H 1 1.580 0.02 . 1 . . . . . . . . 7007 1 401 . 1 1 42 42 ILE HG21 H 1 0.786 0.02 . 1 . . . . . . . . 7007 1 402 . 1 1 42 42 ILE HG22 H 1 0.786 0.02 . 1 . . . . . . . . 7007 1 403 . 1 1 42 42 ILE HG23 H 1 0.786 0.02 . 1 . . . . . . . . 7007 1 404 . 1 1 42 42 ILE CG2 C 13 18.932 0.1 . 1 . . . . . . . . 7007 1 405 . 1 1 42 42 ILE CG1 C 13 27.624 0.1 . 1 . . . . . . . . 7007 1 406 . 1 1 42 42 ILE HG12 H 1 1.819 0.02 . 2 . . . . . . . . 7007 1 407 . 1 1 42 42 ILE HG13 H 1 0.778 0.02 . 2 . . . . . . . . 7007 1 408 . 1 1 42 42 ILE HD11 H 1 0.744 0.02 . 1 . . . . . . . . 7007 1 409 . 1 1 42 42 ILE HD12 H 1 0.744 0.02 . 1 . . . . . . . . 7007 1 410 . 1 1 42 42 ILE HD13 H 1 0.744 0.02 . 1 . . . . . . . . 7007 1 411 . 1 1 42 42 ILE CD1 C 13 13.923 0.1 . 1 . . . . . . . . 7007 1 412 . 1 1 42 42 ILE C C 13 176.635 0.1 . 1 . . . . . . . . 7007 1 413 . 1 1 43 43 VAL N N 15 125.051 0.1 . 1 . . . . . . . . 7007 1 414 . 1 1 43 43 VAL H H 1 8.663 0.02 . 1 . . . . . . . . 7007 1 415 . 1 1 43 43 VAL CA C 13 60.480 0.1 . 1 . . . . . . . . 7007 1 416 . 1 1 43 43 VAL HA H 1 4.640 0.02 . 1 . . . . . . . . 7007 1 417 . 1 1 43 43 VAL CB C 13 36.514 0.1 . 1 . . . . . . . . 7007 1 418 . 1 1 43 43 VAL HB H 1 2.033 0.02 . 1 . . . . . . . . 7007 1 419 . 1 1 43 43 VAL HG11 H 1 1.002 0.02 . 2 . . . . . . . . 7007 1 420 . 1 1 43 43 VAL HG12 H 1 1.002 0.02 . 2 . . . . . . . . 7007 1 421 . 1 1 43 43 VAL HG13 H 1 1.002 0.02 . 2 . . . . . . . . 7007 1 422 . 1 1 43 43 VAL HG21 H 1 0.786 0.02 . 2 . . . . . . . . 7007 1 423 . 1 1 43 43 VAL HG22 H 1 0.786 0.02 . 2 . . . . . . . . 7007 1 424 . 1 1 43 43 VAL HG23 H 1 0.786 0.02 . 2 . . . . . . . . 7007 1 425 . 1 1 43 43 VAL CG1 C 13 20.850 0.1 . 1 . . . . . . . . 7007 1 426 . 1 1 43 43 VAL CG2 C 13 21.076 0.1 . 1 . . . . . . . . 7007 1 427 . 1 1 43 43 VAL C C 13 175.968 0.1 . 1 . . . . . . . . 7007 1 428 . 1 1 44 44 SER N N 15 123.596 0.1 . 1 . . . . . . . . 7007 1 429 . 1 1 44 44 SER H H 1 9.152 0.02 . 1 . . . . . . . . 7007 1 430 . 1 1 44 44 SER CA C 13 60.804 0.1 . 1 . . . . . . . . 7007 1 431 . 1 1 44 44 SER HA H 1 4.797 0.02 . 1 . . . . . . . . 7007 1 432 . 1 1 44 44 SER CB C 13 63.555 0.1 . 1 . . . . . . . . 7007 1 433 . 1 1 44 44 SER HB2 H 1 4.086 0.02 . 2 . . . . . . . . 7007 1 434 . 1 1 44 44 SER HB3 H 1 3.920 0.02 . 2 . . . . . . . . 7007 1 435 . 1 1 44 44 SER C C 13 174.094 0.1 . 1 . . . . . . . . 7007 1 436 . 1 1 45 45 ALA N N 15 125.566 0.1 . 1 . . . . . . . . 7007 1 437 . 1 1 45 45 ALA H H 1 8.552 0.02 . 1 . . . . . . . . 7007 1 438 . 1 1 45 45 ALA CA C 13 52.239 0.1 . 1 . . . . . . . . 7007 1 439 . 1 1 45 45 ALA HA H 1 5.220 0.02 . 1 . . . . . . . . 7007 1 440 . 1 1 45 45 ALA HB1 H 1 1.361 0.02 . 1 . . . . . . . . 7007 1 441 . 1 1 45 45 ALA HB2 H 1 1.361 0.02 . 1 . . . . . . . . 7007 1 442 . 1 1 45 45 ALA HB3 H 1 1.361 0.02 . 1 . . . . . . . . 7007 1 443 . 1 1 45 45 ALA CB C 13 26.221 0.1 . 1 . . . . . . . . 7007 1 444 . 1 1 45 45 ALA C C 13 174.623 0.1 . 1 . . . . . . . . 7007 1 445 . 1 1 46 46 THR N N 15 115.921 0.1 . 1 . . . . . . . . 7007 1 446 . 1 1 46 46 THR H H 1 8.812 0.02 . 1 . . . . . . . . 7007 1 447 . 1 1 46 46 THR CA C 13 61.739 0.1 . 1 . . . . . . . . 7007 1 448 . 1 1 46 46 THR HA H 1 4.935 0.02 . 1 . . . . . . . . 7007 1 449 . 1 1 46 46 THR CB C 13 71.300 0.1 . 1 . . . . . . . . 7007 1 450 . 1 1 46 46 THR HB H 1 3.764 0.02 . 1 . . . . . . . . 7007 1 451 . 1 1 46 46 THR HG21 H 1 0.778 0.02 . 1 . . . . . . . . 7007 1 452 . 1 1 46 46 THR HG22 H 1 0.778 0.02 . 1 . . . . . . . . 7007 1 453 . 1 1 46 46 THR HG23 H 1 0.778 0.02 . 1 . . . . . . . . 7007 1 454 . 1 1 46 46 THR CG2 C 13 22.267 0.1 . 1 . . . . . . . . 7007 1 455 . 1 1 46 46 THR C C 13 171.910 0.1 . 1 . . . . . . . . 7007 1 456 . 1 1 47 47 LEU N N 15 127.944 0.1 . 1 . . . . . . . . 7007 1 457 . 1 1 47 47 LEU H H 1 9.128 0.02 . 1 . . . . . . . . 7007 1 458 . 1 1 47 47 LEU CA C 13 50.931 0.1 . 1 . . . . . . . . 7007 1 459 . 1 1 47 47 LEU HA H 1 4.825 0.02 . 1 . . . . . . . . 7007 1 460 . 1 1 47 47 LEU CB C 13 43.486 0.1 . 1 . . . . . . . . 7007 1 461 . 1 1 47 47 LEU HB2 H 1 1.498 0.02 . 2 . . . . . . . . 7007 1 462 . 1 1 47 47 LEU HB3 H 1 -0.112 0.02 . 2 . . . . . . . . 7007 1 463 . 1 1 47 47 LEU CG C 13 26.977 0.1 . 1 . . . . . . . . 7007 1 464 . 1 1 47 47 LEU HG H 1 1.237 0.02 . 1 . . . . . . . . 7007 1 465 . 1 1 47 47 LEU HD11 H 1 -0.233 0.02 . 2 . . . . . . . . 7007 1 466 . 1 1 47 47 LEU HD12 H 1 -0.233 0.02 . 2 . . . . . . . . 7007 1 467 . 1 1 47 47 LEU HD13 H 1 -0.233 0.02 . 2 . . . . . . . . 7007 1 468 . 1 1 47 47 LEU HD21 H 1 0.396 0.02 . 2 . . . . . . . . 7007 1 469 . 1 1 47 47 LEU HD22 H 1 0.396 0.02 . 2 . . . . . . . . 7007 1 470 . 1 1 47 47 LEU HD23 H 1 0.396 0.02 . 2 . . . . . . . . 7007 1 471 . 1 1 47 47 LEU CD1 C 13 26.653 0.1 . 1 . . . . . . . . 7007 1 472 . 1 1 47 47 LEU CD2 C 13 23.092 0.1 . 1 . . . . . . . . 7007 1 473 . 1 1 47 47 LEU C C 13 173.197 0.1 . 1 . . . . . . . . 7007 1 474 . 1 1 48 48 PRO CD C 13 51.472 0.1 . 1 . . . . . . . . 7007 1 475 . 1 1 48 48 PRO CA C 13 62.584 0.1 . 1 . . . . . . . . 7007 1 476 . 1 1 48 48 PRO HA H 1 4.791 0.02 . 1 . . . . . . . . 7007 1 477 . 1 1 48 48 PRO CB C 13 32.879 0.1 . 1 . . . . . . . . 7007 1 478 . 1 1 48 48 PRO HB2 H 1 2.013 0.02 . 2 . . . . . . . . 7007 1 479 . 1 1 48 48 PRO HB3 H 1 2.448 0.02 . 2 . . . . . . . . 7007 1 480 . 1 1 48 48 PRO CG C 13 26.944 0.1 . 1 . . . . . . . . 7007 1 481 . 1 1 48 48 PRO HG2 H 1 2.079 0.02 . 2 . . . . . . . . 7007 1 482 . 1 1 48 48 PRO HG3 H 1 1.919 0.02 . 2 . . . . . . . . 7007 1 483 . 1 1 48 48 PRO HD2 H 1 3.940 0.02 . 2 . . . . . . . . 7007 1 484 . 1 1 48 48 PRO HD3 H 1 4.053 0.02 . 2 . . . . . . . . 7007 1 485 . 1 1 48 48 PRO C C 13 177.675 0.1 . 1 . . . . . . . . 7007 1 486 . 1 1 49 49 GLY N N 15 108.746 0.1 . 1 . . . . . . . . 7007 1 487 . 1 1 49 49 GLY H H 1 8.568 0.02 . 1 . . . . . . . . 7007 1 488 . 1 1 49 49 GLY CA C 13 46.529 0.1 . 1 . . . . . . . . 7007 1 489 . 1 1 49 49 GLY HA2 H 1 3.989 0.02 . 2 . . . . . . . . 7007 1 490 . 1 1 49 49 GLY HA3 H 1 3.823 0.02 . 2 . . . . . . . . 7007 1 491 . 1 1 49 49 GLY C C 13 174.919 0.1 . 1 . . . . . . . . 7007 1 492 . 1 1 50 50 PHE N N 15 118.379 0.1 . 1 . . . . . . . . 7007 1 493 . 1 1 50 50 PHE H H 1 7.286 0.02 . 1 . . . . . . . . 7007 1 494 . 1 1 50 50 PHE CA C 13 56.613 0.1 . 1 . . . . . . . . 7007 1 495 . 1 1 50 50 PHE HA H 1 4.920 0.02 . 1 . . . . . . . . 7007 1 496 . 1 1 50 50 PHE CB C 13 45.037 0.1 . 1 . . . . . . . . 7007 1 497 . 1 1 50 50 PHE HB2 H 1 2.341 0.02 . 2 . . . . . . . . 7007 1 498 . 1 1 50 50 PHE HB3 H 1 2.459 0.02 . 2 . . . . . . . . 7007 1 499 . 1 1 50 50 PHE CD1 C 13 131.710 0.1 . 1 . . . . . . . . 7007 1 500 . 1 1 50 50 PHE HD1 H 1 6.802 0.02 . 1 . . . . . . . . 7007 1 501 . 1 1 50 50 PHE CE1 C 13 130.606 0.1 . 1 . . . . . . . . 7007 1 502 . 1 1 50 50 PHE HE1 H 1 7.231 0.02 . 1 . . . . . . . . 7007 1 503 . 1 1 50 50 PHE HE2 H 1 7.231 0.02 . 1 . . . . . . . . 7007 1 504 . 1 1 50 50 PHE HD2 H 1 6.802 0.02 . 1 . . . . . . . . 7007 1 505 . 1 1 50 50 PHE C C 13 172.228 0.1 . 1 . . . . . . . . 7007 1 506 . 1 1 51 51 GLN N N 15 115.999 0.1 . 1 . . . . . . . . 7007 1 507 . 1 1 51 51 GLN H H 1 8.550 0.02 . 1 . . . . . . . . 7007 1 508 . 1 1 51 51 GLN CA C 13 54.486 0.1 . 1 . . . . . . . . 7007 1 509 . 1 1 51 51 GLN HA H 1 4.413 0.02 . 1 . . . . . . . . 7007 1 510 . 1 1 51 51 GLN CB C 13 33.500 0.1 . 1 . . . . . . . . 7007 1 511 . 1 1 51 51 GLN HB2 H 1 1.756 0.02 . 2 . . . . . . . . 7007 1 512 . 1 1 51 51 GLN HB3 H 1 1.549 0.02 . 2 . . . . . . . . 7007 1 513 . 1 1 51 51 GLN CG C 13 34.098 0.1 . 1 . . . . . . . . 7007 1 514 . 1 1 51 51 GLN HG2 H 1 1.645 0.02 . 2 . . . . . . . . 7007 1 515 . 1 1 51 51 GLN HG3 H 1 1.908 0.02 . 2 . . . . . . . . 7007 1 516 . 1 1 51 51 GLN NE2 N 15 112.660 0.1 . 1 . . . . . . . . 7007 1 517 . 1 1 51 51 GLN HE21 H 1 6.914 0.02 . 2 . . . . . . . . 7007 1 518 . 1 1 51 51 GLN HE22 H 1 7.406 0.02 . 2 . . . . . . . . 7007 1 519 . 1 1 51 51 GLN C C 13 172.846 0.1 . 1 . . . . . . . . 7007 1 520 . 1 1 52 52 ARG N N 15 124.028 0.1 . 1 . . . . . . . . 7007 1 521 . 1 1 52 52 ARG H H 1 8.489 0.02 . 1 . . . . . . . . 7007 1 522 . 1 1 52 52 ARG CA C 13 54.168 0.1 . 1 . . . . . . . . 7007 1 523 . 1 1 52 52 ARG HA H 1 5.372 0.02 . 1 . . . . . . . . 7007 1 524 . 1 1 52 52 ARG CB C 13 32.480 0.1 . 1 . . . . . . . . 7007 1 525 . 1 1 52 52 ARG HB2 H 1 1.304 0.02 . 2 . . . . . . . . 7007 1 526 . 1 1 52 52 ARG HB3 H 1 2.335 0.02 . 2 . . . . . . . . 7007 1 527 . 1 1 52 52 ARG C C 13 175.195 0.1 . 1 . . . . . . . . 7007 1 528 . 1 1 53 53 PHE N N 15 128.012 0.1 . 1 . . . . . . . . 7007 1 529 . 1 1 53 53 PHE H H 1 8.867 0.02 . 1 . . . . . . . . 7007 1 530 . 1 1 53 53 PHE CA C 13 57.405 0.1 . 1 . . . . . . . . 7007 1 531 . 1 1 53 53 PHE HA H 1 5.216 0.02 . 1 . . . . . . . . 7007 1 532 . 1 1 53 53 PHE CB C 13 44.780 0.1 . 1 . . . . . . . . 7007 1 533 . 1 1 53 53 PHE HB2 H 1 2.311 0.02 . 2 . . . . . . . . 7007 1 534 . 1 1 53 53 PHE HB3 H 1 3.400 0.02 . 2 . . . . . . . . 7007 1 535 . 1 1 53 53 PHE CD1 C 13 132.429 0.1 . 1 . . . . . . . . 7007 1 536 . 1 1 53 53 PHE HD1 H 1 7.135 0.02 . 1 . . . . . . . . 7007 1 537 . 1 1 53 53 PHE CE1 C 13 131.127 0.1 . 1 . . . . . . . . 7007 1 538 . 1 1 53 53 PHE HE1 H 1 7.143 0.02 . 1 . . . . . . . . 7007 1 539 . 1 1 53 53 PHE HE2 H 1 7.143 0.02 . 1 . . . . . . . . 7007 1 540 . 1 1 53 53 PHE HD2 H 1 7.135 0.02 . 1 . . . . . . . . 7007 1 541 . 1 1 53 53 PHE C C 13 175.888 0.1 . 1 . . . . . . . . 7007 1 542 . 1 1 54 54 ARG N N 15 117.461 0.1 . 1 . . . . . . . . 7007 1 543 . 1 1 54 54 ARG H H 1 7.935 0.02 . 1 . . . . . . . . 7007 1 544 . 1 1 54 54 ARG CA C 13 55.786 0.1 . 1 . . . . . . . . 7007 1 545 . 1 1 54 54 ARG HA H 1 4.263 0.02 . 1 . . . . . . . . 7007 1 546 . 1 1 54 54 ARG CB C 13 31.832 0.1 . 1 . . . . . . . . 7007 1 547 . 1 1 54 54 ARG HB2 H 1 1.539 0.02 . 2 . . . . . . . . 7007 1 548 . 1 1 54 54 ARG HB3 H 1 1.727 0.02 . 2 . . . . . . . . 7007 1 549 . 1 1 54 54 ARG CG C 13 27.948 0.1 . 1 . . . . . . . . 7007 1 550 . 1 1 54 54 ARG HG3 H 1 1.551 0.02 . 2 . . . . . . . . 7007 1 551 . 1 1 54 54 ARG CD C 13 44.457 0.1 . 1 . . . . . . . . 7007 1 552 . 1 1 54 54 ARG HD2 H 1 3.122 0.02 . 2 . . . . . . . . 7007 1 553 . 1 1 54 54 ARG HD3 H 1 3.337 0.02 . 2 . . . . . . . . 7007 1 554 . 1 1 54 54 ARG C C 13 174.149 0.1 . 1 . . . . . . . . 7007 1 555 . 1 1 58 58 ARG N N 15 118.614 0.1 . 1 . . . . . . . . 7007 1 556 . 1 1 58 58 ARG H H 1 8.176 0.02 . 1 . . . . . . . . 7007 1 557 . 1 1 58 58 ARG CA C 13 58.951 0.1 . 1 . . . . . . . . 7007 1 558 . 1 1 58 58 ARG HA H 1 4.263 0.02 . 1 . . . . . . . . 7007 1 559 . 1 1 58 58 ARG CB C 13 31.568 0.1 . 1 . . . . . . . . 7007 1 560 . 1 1 58 58 ARG CD C 13 43.486 0.1 . 1 . . . . . . . . 7007 1 561 . 1 1 58 58 ARG HD2 H 1 2.743 0.02 . 2 . . . . . . . . 7007 1 562 . 1 1 58 58 ARG HD3 H 1 3.201 0.02 . 2 . . . . . . . . 7007 1 563 . 1 1 58 58 ARG NE N 15 84.480 0.1 . 1 . . . . . . . . 7007 1 564 . 1 1 58 58 ARG HE H 1 7.279 0.02 . 1 . . . . . . . . 7007 1 565 . 1 1 58 58 ARG C C 13 174.084 0.1 . 1 . . . . . . . . 7007 1 566 . 1 1 59 59 LEU N N 15 122.213 0.1 . 1 . . . . . . . . 7007 1 567 . 1 1 59 59 LEU H H 1 8.706 0.02 . 1 . . . . . . . . 7007 1 568 . 1 1 59 59 LEU CA C 13 53.031 0.1 . 1 . . . . . . . . 7007 1 569 . 1 1 59 59 LEU HA H 1 4.753 0.02 . 1 . . . . . . . . 7007 1 570 . 1 1 59 59 LEU CB C 13 46.075 0.1 . 1 . . . . . . . . 7007 1 571 . 1 1 59 59 LEU HB2 H 1 0.922 0.02 . 2 . . . . . . . . 7007 1 572 . 1 1 59 59 LEU HB3 H 1 1.200 0.02 . 2 . . . . . . . . 7007 1 573 . 1 1 59 59 LEU CG C 13 26.977 0.1 . 1 . . . . . . . . 7007 1 574 . 1 1 59 59 LEU HG H 1 0.966 0.02 . 1 . . . . . . . . 7007 1 575 . 1 1 59 59 LEU HD11 H 1 -0.129 0.02 . 2 . . . . . . . . 7007 1 576 . 1 1 59 59 LEU HD12 H 1 -0.129 0.02 . 2 . . . . . . . . 7007 1 577 . 1 1 59 59 LEU HD13 H 1 -0.129 0.02 . 2 . . . . . . . . 7007 1 578 . 1 1 59 59 LEU HD21 H 1 0.102 0.02 . 2 . . . . . . . . 7007 1 579 . 1 1 59 59 LEU HD22 H 1 0.102 0.02 . 2 . . . . . . . . 7007 1 580 . 1 1 59 59 LEU HD23 H 1 0.102 0.02 . 2 . . . . . . . . 7007 1 581 . 1 1 59 59 LEU CD1 C 13 26.006 0.1 . 1 . . . . . . . . 7007 1 582 . 1 1 59 59 LEU CD2 C 13 24.063 0.1 . 1 . . . . . . . . 7007 1 583 . 1 1 59 59 LEU C C 13 174.288 0.1 . 1 . . . . . . . . 7007 1 584 . 1 1 60 60 TYR N N 15 124.383 0.1 . 1 . . . . . . . . 7007 1 585 . 1 1 60 60 TYR H H 1 8.915 0.02 . 1 . . . . . . . . 7007 1 586 . 1 1 60 60 TYR CA C 13 58.868 0.1 . 1 . . . . . . . . 7007 1 587 . 1 1 60 60 TYR HA H 1 4.052 0.02 . 1 . . . . . . . . 7007 1 588 . 1 1 60 60 TYR CB C 13 33.127 0.1 . 1 . . . . . . . . 7007 1 589 . 1 1 60 60 TYR HB3 H 1 1.695 0.02 . 2 . . . . . . . . 7007 1 590 . 1 1 60 60 TYR CD1 C 13 135.187 0.1 . 1 . . . . . . . . 7007 1 591 . 1 1 60 60 TYR HD1 H 1 7.106 0.02 . 1 . . . . . . . . 7007 1 592 . 1 1 60 60 TYR HD2 H 1 7.106 0.02 . 1 . . . . . . . . 7007 1 593 . 1 1 61 61 PRO CA C 13 62.009 0.1 . 1 . . . . . . . . 7007 1 594 . 1 1 61 61 PRO HA H 1 4.971 0.02 . 1 . . . . . . . . 7007 1 595 . 1 1 61 61 PRO C C 13 175.773 0.1 . 1 . . . . . . . . 7007 1 596 . 1 1 62 62 CYS N N 15 112.128 0.1 . 1 . . . . . . . . 7007 1 597 . 1 1 62 62 CYS H H 1 8.589 0.02 . 1 . . . . . . . . 7007 1 598 . 1 1 62 62 CYS CA C 13 55.925 0.1 . 1 . . . . . . . . 7007 1 599 . 1 1 62 62 CYS HA H 1 5.587 0.02 . 1 . . . . . . . . 7007 1 600 . 1 1 62 62 CYS CB C 13 34.506 0.1 . 1 . . . . . . . . 7007 1 601 . 1 1 62 62 CYS HB2 H 1 2.920 0.02 . 2 . . . . . . . . 7007 1 602 . 1 1 62 62 CYS HB3 H 1 2.396 0.02 . 2 . . . . . . . . 7007 1 603 . 1 1 62 62 CYS C C 13 172.084 0.1 . 1 . . . . . . . . 7007 1 604 . 1 1 63 63 ILE N N 15 107.637 0.1 . 1 . . . . . . . . 7007 1 605 . 1 1 63 63 ILE H H 1 6.594 0.02 . 1 . . . . . . . . 7007 1 606 . 1 1 63 63 ILE CA C 13 59.280 0.1 . 1 . . . . . . . . 7007 1 607 . 1 1 63 63 ILE HA H 1 5.916 0.02 . 1 . . . . . . . . 7007 1 608 . 1 1 63 63 ILE CB C 13 42.514 0.1 . 1 . . . . . . . . 7007 1 609 . 1 1 63 63 ILE HB H 1 1.598 0.02 . 1 . . . . . . . . 7007 1 610 . 1 1 63 63 ILE HG21 H 1 0.270 0.02 . 1 . . . . . . . . 7007 1 611 . 1 1 63 63 ILE HG22 H 1 0.270 0.02 . 1 . . . . . . . . 7007 1 612 . 1 1 63 63 ILE HG23 H 1 0.270 0.02 . 1 . . . . . . . . 7007 1 613 . 1 1 63 63 ILE CG2 C 13 14.376 0.1 . 1 . . . . . . . . 7007 1 614 . 1 1 63 63 ILE CG1 C 13 23.740 0.1 . 1 . . . . . . . . 7007 1 615 . 1 1 63 63 ILE HG12 H 1 1.480 0.02 . 2 . . . . . . . . 7007 1 616 . 1 1 63 63 ILE HG13 H 1 1.164 0.02 . 2 . . . . . . . . 7007 1 617 . 1 1 63 63 ILE HD11 H 1 -0.253 0.02 . 1 . . . . . . . . 7007 1 618 . 1 1 63 63 ILE HD12 H 1 -0.253 0.02 . 1 . . . . . . . . 7007 1 619 . 1 1 63 63 ILE HD13 H 1 -0.253 0.02 . 1 . . . . . . . . 7007 1 620 . 1 1 63 63 ILE CD1 C 13 14.700 0.1 . 1 . . . . . . . . 7007 1 621 . 1 1 63 63 ILE C C 13 174.860 0.1 . 1 . . . . . . . . 7007 1 622 . 1 1 64 64 VAL N N 15 112.515 0.1 . 1 . . . . . . . . 7007 1 623 . 1 1 64 64 VAL H H 1 8.326 0.02 . 1 . . . . . . . . 7007 1 624 . 1 1 64 64 VAL CA C 13 59.671 0.1 . 1 . . . . . . . . 7007 1 625 . 1 1 64 64 VAL HA H 1 5.025 0.02 . 1 . . . . . . . . 7007 1 626 . 1 1 64 64 VAL CB C 13 34.746 0.1 . 1 . . . . . . . . 7007 1 627 . 1 1 64 64 VAL HB H 1 2.500 0.02 . 1 . . . . . . . . 7007 1 628 . 1 1 64 64 VAL HG11 H 1 1.337 0.02 . 2 . . . . . . . . 7007 1 629 . 1 1 64 64 VAL HG12 H 1 1.337 0.02 . 2 . . . . . . . . 7007 1 630 . 1 1 64 64 VAL HG13 H 1 1.337 0.02 . 2 . . . . . . . . 7007 1 631 . 1 1 64 64 VAL HG21 H 1 1.055 0.02 . 2 . . . . . . . . 7007 1 632 . 1 1 64 64 VAL HG22 H 1 1.055 0.02 . 2 . . . . . . . . 7007 1 633 . 1 1 64 64 VAL HG23 H 1 1.055 0.02 . 2 . . . . . . . . 7007 1 634 . 1 1 64 64 VAL CG1 C 13 25.358 0.1 . 1 . . . . . . . . 7007 1 635 . 1 1 64 64 VAL CG2 C 13 18.261 0.1 . 1 . . . . . . . . 7007 1 636 . 1 1 64 64 VAL C C 13 173.974 0.1 . 1 . . . . . . . . 7007 1 637 . 1 1 65 65 PRO CD C 13 51.511 0.1 . 1 . . . . . . . . 7007 1 638 . 1 1 65 65 PRO CA C 13 63.403 0.1 . 1 . . . . . . . . 7007 1 639 . 1 1 65 65 PRO HA H 1 3.724 0.02 . 1 . . . . . . . . 7007 1 640 . 1 1 65 65 PRO CB C 13 32.245 0.1 . 1 . . . . . . . . 7007 1 641 . 1 1 65 65 PRO HB2 H 1 1.640 0.02 . 2 . . . . . . . . 7007 1 642 . 1 1 65 65 PRO HB3 H 1 1.905 0.02 . 2 . . . . . . . . 7007 1 643 . 1 1 65 65 PRO CG C 13 27.948 0.1 . 1 . . . . . . . . 7007 1 644 . 1 1 65 65 PRO HG2 H 1 2.053 0.02 . 2 . . . . . . . . 7007 1 645 . 1 1 65 65 PRO HG3 H 1 1.777 0.02 . 2 . . . . . . . . 7007 1 646 . 1 1 65 65 PRO HD2 H 1 3.717 0.02 . 2 . . . . . . . . 7007 1 647 . 1 1 65 65 PRO HD3 H 1 4.052 0.02 . 2 . . . . . . . . 7007 1 648 . 1 1 65 65 PRO C C 13 176.173 0.1 . 1 . . . . . . . . 7007 1 649 . 1 1 66 66 SER N N 15 117.377 0.1 . 1 . . . . . . . . 7007 1 650 . 1 1 66 66 SER H H 1 8.134 0.02 . 1 . . . . . . . . 7007 1 651 . 1 1 66 66 SER CA C 13 57.290 0.1 . 1 . . . . . . . . 7007 1 652 . 1 1 66 66 SER HA H 1 4.405 0.02 . 1 . . . . . . . . 7007 1 653 . 1 1 66 66 SER CB C 13 65.351 0.1 . 1 . . . . . . . . 7007 1 654 . 1 1 66 66 SER HB2 H 1 3.730 0.02 . 2 . . . . . . . . 7007 1 655 . 1 1 66 66 SER HB3 H 1 3.172 0.02 . 2 . . . . . . . . 7007 1 656 . 1 1 66 66 SER HG H 1 4.807 0.02 . 1 . . . . . . . . 7007 1 657 . 1 1 66 66 SER C C 13 174.191 0.1 . 1 . . . . . . . . 7007 1 658 . 1 1 67 67 GLU N N 15 127.761 0.1 . 1 . . . . . . . . 7007 1 659 . 1 1 67 67 GLU H H 1 8.854 0.02 . 1 . . . . . . . . 7007 1 660 . 1 1 67 67 GLU CA C 13 59.881 0.1 . 1 . . . . . . . . 7007 1 661 . 1 1 67 67 GLU HA H 1 3.976 0.02 . 1 . . . . . . . . 7007 1 662 . 1 1 67 67 GLU CB C 13 29.505 0.1 . 1 . . . . . . . . 7007 1 663 . 1 1 67 67 GLU HB3 H 1 2.055 0.02 . 2 . . . . . . . . 7007 1 664 . 1 1 67 67 GLU CG C 13 36.520 0.1 . 1 . . . . . . . . 7007 1 665 . 1 1 67 67 GLU HG3 H 1 2.307 0.02 . 2 . . . . . . . . 7007 1 666 . 1 1 67 67 GLU C C 13 177.330 0.1 . 1 . . . . . . . . 7007 1 667 . 1 1 68 68 LYS N N 15 115.813 0.1 . 1 . . . . . . . . 7007 1 668 . 1 1 68 68 LYS H H 1 8.300 0.02 . 1 . . . . . . . . 7007 1 669 . 1 1 68 68 LYS CA C 13 55.929 0.1 . 1 . . . . . . . . 7007 1 670 . 1 1 68 68 LYS HA H 1 4.493 0.02 . 1 . . . . . . . . 7007 1 671 . 1 1 68 68 LYS CB C 13 33.192 0.1 . 1 . . . . . . . . 7007 1 672 . 1 1 68 68 LYS HB2 H 1 2.001 0.02 . 2 . . . . . . . . 7007 1 673 . 1 1 68 68 LYS HB3 H 1 1.722 0.02 . 2 . . . . . . . . 7007 1 674 . 1 1 68 68 LYS CG C 13 25.381 0.1 . 1 . . . . . . . . 7007 1 675 . 1 1 68 68 LYS HG3 H 1 1.379 0.02 . 2 . . . . . . . . 7007 1 676 . 1 1 68 68 LYS CD C 13 29.243 0.1 . 1 . . . . . . . . 7007 1 677 . 1 1 68 68 LYS HD3 H 1 1.685 0.02 . 2 . . . . . . . . 7007 1 678 . 1 1 68 68 LYS CE C 13 42.363 0.1 . 1 . . . . . . . . 7007 1 679 . 1 1 68 68 LYS HE3 H 1 2.993 0.02 . 2 . . . . . . . . 7007 1 680 . 1 1 68 68 LYS C C 13 176.661 0.1 . 1 . . . . . . . . 7007 1 681 . 1 1 69 69 GLY N N 15 108.538 0.1 . 1 . . . . . . . . 7007 1 682 . 1 1 69 69 GLY H H 1 7.883 0.02 . 1 . . . . . . . . 7007 1 683 . 1 1 69 69 GLY CA C 13 45.464 0.1 . 1 . . . . . . . . 7007 1 684 . 1 1 69 69 GLY HA2 H 1 4.213 0.02 . 2 . . . . . . . . 7007 1 685 . 1 1 69 69 GLY HA3 H 1 3.530 0.02 . 2 . . . . . . . . 7007 1 686 . 1 1 69 69 GLY C C 13 173.278 0.1 . 1 . . . . . . . . 7007 1 687 . 1 1 70 70 GLU N N 15 117.266 0.1 . 1 . . . . . . . . 7007 1 688 . 1 1 70 70 GLU H H 1 8.103 0.02 . 1 . . . . . . . . 7007 1 689 . 1 1 70 70 GLU CA C 13 56.573 0.1 . 1 . . . . . . . . 7007 1 690 . 1 1 70 70 GLU HA H 1 5.210 0.02 . 1 . . . . . . . . 7007 1 691 . 1 1 70 70 GLU CB C 13 33.775 0.1 . 1 . . . . . . . . 7007 1 692 . 1 1 70 70 GLU HB2 H 1 2.003 0.02 . 2 . . . . . . . . 7007 1 693 . 1 1 70 70 GLU HB3 H 1 1.653 0.02 . 2 . . . . . . . . 7007 1 694 . 1 1 70 70 GLU CG C 13 35.544 0.1 . 1 . . . . . . . . 7007 1 695 . 1 1 70 70 GLU HG2 H 1 2.174 0.02 . 2 . . . . . . . . 7007 1 696 . 1 1 70 70 GLU HG3 H 1 1.937 0.02 . 2 . . . . . . . . 7007 1 697 . 1 1 70 70 GLU C C 13 175.534 0.1 . 1 . . . . . . . . 7007 1 698 . 1 1 71 71 VAL N N 15 120.671 0.1 . 1 . . . . . . . . 7007 1 699 . 1 1 71 71 VAL H H 1 8.319 0.02 . 1 . . . . . . . . 7007 1 700 . 1 1 71 71 VAL CA C 13 61.304 0.1 . 1 . . . . . . . . 7007 1 701 . 1 1 71 71 VAL HA H 1 4.419 0.02 . 1 . . . . . . . . 7007 1 702 . 1 1 71 71 VAL CB C 13 35.480 0.1 . 1 . . . . . . . . 7007 1 703 . 1 1 71 71 VAL HB H 1 2.023 0.02 . 1 . . . . . . . . 7007 1 704 . 1 1 71 71 VAL HG11 H 1 0.955 0.02 . 2 . . . . . . . . 7007 1 705 . 1 1 71 71 VAL HG12 H 1 0.955 0.02 . 2 . . . . . . . . 7007 1 706 . 1 1 71 71 VAL HG13 H 1 0.955 0.02 . 2 . . . . . . . . 7007 1 707 . 1 1 71 71 VAL HG21 H 1 0.791 0.02 . 2 . . . . . . . . 7007 1 708 . 1 1 71 71 VAL HG22 H 1 0.791 0.02 . 2 . . . . . . . . 7007 1 709 . 1 1 71 71 VAL HG23 H 1 0.791 0.02 . 2 . . . . . . . . 7007 1 710 . 1 1 71 71 VAL CG1 C 13 21.821 0.1 . 1 . . . . . . . . 7007 1 711 . 1 1 71 71 VAL CG2 C 13 21.498 0.1 . 1 . . . . . . . . 7007 1 712 . 1 1 71 71 VAL C C 13 175.107 0.1 . 1 . . . . . . . . 7007 1 713 . 1 1 72 72 HIS N N 15 128.682 0.1 . 1 . . . . . . . . 7007 1 714 . 1 1 72 72 HIS H H 1 9.233 0.02 . 1 . . . . . . . . 7007 1 715 . 1 1 72 72 HIS CA C 13 56.259 0.1 . 1 . . . . . . . . 7007 1 716 . 1 1 72 72 HIS HA H 1 5.144 0.02 . 1 . . . . . . . . 7007 1 717 . 1 1 72 72 HIS CB C 13 29.749 0.1 . 1 . . . . . . . . 7007 1 718 . 1 1 72 72 HIS HB2 H 1 3.483 0.02 . 2 . . . . . . . . 7007 1 719 . 1 1 72 72 HIS HB3 H 1 3.304 0.02 . 2 . . . . . . . . 7007 1 720 . 1 1 72 72 HIS CD2 C 13 119.989 0.1 . 1 . . . . . . . . 7007 1 721 . 1 1 72 72 HIS CE1 C 13 137.632 0.1 . 1 . . . . . . . . 7007 1 722 . 1 1 72 72 HIS HD2 H 1 7.343 0.02 . 1 . . . . . . . . 7007 1 723 . 1 1 72 72 HIS HE1 H 1 8.318 0.02 . 1 . . . . . . . . 7007 1 724 . 1 1 72 72 HIS C C 13 174.499 0.1 . 1 . . . . . . . . 7007 1 725 . 1 1 73 73 GLY N N 15 111.645 0.1 . 1 . . . . . . . . 7007 1 726 . 1 1 73 73 GLY H H 1 8.789 0.02 . 1 . . . . . . . . 7007 1 727 . 1 1 73 73 GLY CA C 13 45.598 0.1 . 1 . . . . . . . . 7007 1 728 . 1 1 73 73 GLY HA2 H 1 3.428 0.02 . 2 . . . . . . . . 7007 1 729 . 1 1 73 73 GLY HA3 H 1 4.570 0.02 . 2 . . . . . . . . 7007 1 730 . 1 1 73 73 GLY C C 13 173.188 0.1 . 1 . . . . . . . . 7007 1 731 . 1 1 74 74 LYS N N 15 120.404 0.1 . 1 . . . . . . . . 7007 1 732 . 1 1 74 74 LYS H H 1 8.134 0.02 . 1 . . . . . . . . 7007 1 733 . 1 1 74 74 LYS CA C 13 53.295 0.1 . 1 . . . . . . . . 7007 1 734 . 1 1 74 74 LYS HA H 1 5.327 0.02 . 1 . . . . . . . . 7007 1 735 . 1 1 74 74 LYS CB C 13 37.366 0.1 . 1 . . . . . . . . 7007 1 736 . 1 1 74 74 LYS HB2 H 1 1.629 0.02 . 2 . . . . . . . . 7007 1 737 . 1 1 74 74 LYS HB3 H 1 1.303 0.02 . 2 . . . . . . . . 7007 1 738 . 1 1 74 74 LYS CG C 13 24.711 0.1 . 1 . . . . . . . . 7007 1 739 . 1 1 74 74 LYS HG2 H 1 1.494 0.02 . 2 . . . . . . . . 7007 1 740 . 1 1 74 74 LYS HG3 H 1 1.375 0.02 . 2 . . . . . . . . 7007 1 741 . 1 1 74 74 LYS CD C 13 29.514 0.1 . 1 . . . . . . . . 7007 1 742 . 1 1 74 74 LYS HD2 H 1 1.344 0.02 . 2 . . . . . . . . 7007 1 743 . 1 1 74 74 LYS HD3 H 1 1.828 0.02 . 2 . . . . . . . . 7007 1 744 . 1 1 74 74 LYS CE C 13 42.659 0.1 . 1 . . . . . . . . 7007 1 745 . 1 1 74 74 LYS HE2 H 1 2.961 0.02 . 2 . . . . . . . . 7007 1 746 . 1 1 74 74 LYS HE3 H 1 2.911 0.02 . 2 . . . . . . . . 7007 1 747 . 1 1 74 74 LYS C C 13 174.139 0.1 . 1 . . . . . . . . 7007 1 748 . 1 1 75 75 VAL N N 15 120.744 0.1 . 1 . . . . . . . . 7007 1 749 . 1 1 75 75 VAL H H 1 9.774 0.02 . 1 . . . . . . . . 7007 1 750 . 1 1 75 75 VAL CA C 13 60.611 0.1 . 1 . . . . . . . . 7007 1 751 . 1 1 75 75 VAL HA H 1 4.828 0.02 . 1 . . . . . . . . 7007 1 752 . 1 1 75 75 VAL CB C 13 34.039 0.1 . 1 . . . . . . . . 7007 1 753 . 1 1 75 75 VAL HB H 1 1.979 0.02 . 1 . . . . . . . . 7007 1 754 . 1 1 75 75 VAL HG11 H 1 0.748 0.02 . 2 . . . . . . . . 7007 1 755 . 1 1 75 75 VAL HG12 H 1 0.748 0.02 . 2 . . . . . . . . 7007 1 756 . 1 1 75 75 VAL HG13 H 1 0.748 0.02 . 2 . . . . . . . . 7007 1 757 . 1 1 75 75 VAL HG21 H 1 0.941 0.02 . 2 . . . . . . . . 7007 1 758 . 1 1 75 75 VAL HG22 H 1 0.941 0.02 . 2 . . . . . . . . 7007 1 759 . 1 1 75 75 VAL HG23 H 1 0.941 0.02 . 2 . . . . . . . . 7007 1 760 . 1 1 75 75 VAL CG1 C 13 23.416 0.1 . 1 . . . . . . . . 7007 1 761 . 1 1 75 75 VAL CG2 C 13 23.639 0.1 . 1 . . . . . . . . 7007 1 762 . 1 1 75 75 VAL C C 13 175.094 0.1 . 1 . . . . . . . . 7007 1 763 . 1 1 76 76 LEU N N 15 126.425 0.1 . 1 . . . . . . . . 7007 1 764 . 1 1 76 76 LEU H H 1 9.339 0.02 . 1 . . . . . . . . 7007 1 765 . 1 1 76 76 LEU CA C 13 53.505 0.1 . 1 . . . . . . . . 7007 1 766 . 1 1 76 76 LEU HA H 1 4.616 0.02 . 1 . . . . . . . . 7007 1 767 . 1 1 76 76 LEU CB C 13 42.331 0.1 . 1 . . . . . . . . 7007 1 768 . 1 1 76 76 LEU HB2 H 1 0.955 0.02 . 2 . . . . . . . . 7007 1 769 . 1 1 76 76 LEU HB3 H 1 1.940 0.02 . 2 . . . . . . . . 7007 1 770 . 1 1 76 76 LEU CG C 13 26.496 0.1 . 1 . . . . . . . . 7007 1 771 . 1 1 76 76 LEU HG H 1 1.744 0.02 . 1 . . . . . . . . 7007 1 772 . 1 1 76 76 LEU HD21 H 1 0.716 0.02 . 2 . . . . . . . . 7007 1 773 . 1 1 76 76 LEU HD22 H 1 0.716 0.02 . 2 . . . . . . . . 7007 1 774 . 1 1 76 76 LEU HD23 H 1 0.716 0.02 . 2 . . . . . . . . 7007 1 775 . 1 1 76 76 LEU CD2 C 13 23.836 0.1 . 1 . . . . . . . . 7007 1 776 . 1 1 76 76 LEU C C 13 175.769 0.1 . 1 . . . . . . . . 7007 1 777 . 1 1 77 77 MET N N 15 123.182 0.1 . 1 . . . . . . . . 7007 1 778 . 1 1 77 77 MET H H 1 8.593 0.02 . 1 . . . . . . . . 7007 1 779 . 1 1 77 77 MET CA C 13 53.998 0.1 . 1 . . . . . . . . 7007 1 780 . 1 1 77 77 MET HA H 1 5.144 0.02 . 1 . . . . . . . . 7007 1 781 . 1 1 77 77 MET CB C 13 32.896 0.1 . 1 . . . . . . . . 7007 1 782 . 1 1 77 77 MET HB2 H 1 2.027 0.02 . 2 . . . . . . . . 7007 1 783 . 1 1 77 77 MET HB3 H 1 1.918 0.02 . 2 . . . . . . . . 7007 1 784 . 1 1 77 77 MET CG C 13 32.509 0.1 . 1 . . . . . . . . 7007 1 785 . 1 1 77 77 MET HG2 H 1 2.313 0.02 . 2 . . . . . . . . 7007 1 786 . 1 1 77 77 MET HG3 H 1 2.443 0.02 . 2 . . . . . . . . 7007 1 787 . 1 1 77 77 MET HE1 H 1 1.994 0.02 . 1 . . . . . . . . 7007 1 788 . 1 1 77 77 MET HE2 H 1 1.994 0.02 . 1 . . . . . . . . 7007 1 789 . 1 1 77 77 MET HE3 H 1 1.994 0.02 . 1 . . . . . . . . 7007 1 790 . 1 1 77 77 MET CE C 13 16.966 0.1 . 1 . . . . . . . . 7007 1 791 . 1 1 77 77 MET C C 13 177.589 0.1 . 1 . . . . . . . . 7007 1 792 . 1 1 78 78 GLY N N 15 111.148 0.1 . 1 . . . . . . . . 7007 1 793 . 1 1 78 78 GLY H H 1 8.361 0.02 . 1 . . . . . . . . 7007 1 794 . 1 1 78 78 GLY CA C 13 48.765 0.1 . 1 . . . . . . . . 7007 1 795 . 1 1 78 78 GLY HA2 H 1 3.842 0.02 . 2 . . . . . . . . 7007 1 796 . 1 1 78 78 GLY HA3 H 1 3.664 0.02 . 2 . . . . . . . . 7007 1 797 . 1 1 78 78 GLY C C 13 174.574 0.1 . 1 . . . . . . . . 7007 1 798 . 1 1 79 79 VAL N N 15 122.582 0.1 . 1 . . . . . . . . 7007 1 799 . 1 1 79 79 VAL H H 1 9.161 0.02 . 1 . . . . . . . . 7007 1 800 . 1 1 79 79 VAL CA C 13 62.418 0.1 . 1 . . . . . . . . 7007 1 801 . 1 1 79 79 VAL HA H 1 4.097 0.02 . 1 . . . . . . . . 7007 1 802 . 1 1 79 79 VAL CB C 13 33.007 0.1 . 1 . . . . . . . . 7007 1 803 . 1 1 79 79 VAL HB H 1 2.080 0.02 . 1 . . . . . . . . 7007 1 804 . 1 1 79 79 VAL HG11 H 1 0.976 0.02 . 2 . . . . . . . . 7007 1 805 . 1 1 79 79 VAL HG12 H 1 0.976 0.02 . 2 . . . . . . . . 7007 1 806 . 1 1 79 79 VAL HG13 H 1 0.976 0.02 . 2 . . . . . . . . 7007 1 807 . 1 1 79 79 VAL HG21 H 1 0.748 0.02 . 2 . . . . . . . . 7007 1 808 . 1 1 79 79 VAL HG22 H 1 0.748 0.02 . 2 . . . . . . . . 7007 1 809 . 1 1 79 79 VAL HG23 H 1 0.748 0.02 . 2 . . . . . . . . 7007 1 810 . 1 1 79 79 VAL CG1 C 13 21.766 0.1 . 1 . . . . . . . . 7007 1 811 . 1 1 79 79 VAL CG2 C 13 22.166 0.1 . 1 . . . . . . . . 7007 1 812 . 1 1 79 79 VAL C C 13 176.954 0.1 . 1 . . . . . . . . 7007 1 813 . 1 1 80 80 THR N N 15 119.143 0.1 . 1 . . . . . . . . 7007 1 814 . 1 1 80 80 THR H H 1 9.451 0.02 . 1 . . . . . . . . 7007 1 815 . 1 1 80 80 THR CA C 13 61.838 0.1 . 1 . . . . . . . . 7007 1 816 . 1 1 80 80 THR HA H 1 4.867 0.02 . 1 . . . . . . . . 7007 1 817 . 1 1 80 80 THR CB C 13 71.180 0.1 . 1 . . . . . . . . 7007 1 818 . 1 1 80 80 THR HB H 1 4.880 0.02 . 1 . . . . . . . . 7007 1 819 . 1 1 80 80 THR HG21 H 1 1.289 0.02 . 1 . . . . . . . . 7007 1 820 . 1 1 80 80 THR HG22 H 1 1.289 0.02 . 1 . . . . . . . . 7007 1 821 . 1 1 80 80 THR HG23 H 1 1.289 0.02 . 1 . . . . . . . . 7007 1 822 . 1 1 80 80 THR CG2 C 13 21.821 0.1 . 1 . . . . . . . . 7007 1 823 . 1 1 80 80 THR C C 13 176.763 0.1 . 1 . . . . . . . . 7007 1 824 . 1 1 81 81 SER N N 15 116.603 0.1 . 1 . . . . . . . . 7007 1 825 . 1 1 81 81 SER H H 1 9.182 0.02 . 1 . . . . . . . . 7007 1 826 . 1 1 81 81 SER CA C 13 63.007 0.1 . 1 . . . . . . . . 7007 1 827 . 1 1 81 81 SER HA H 1 4.093 0.02 . 1 . . . . . . . . 7007 1 828 . 1 1 81 81 SER C C 13 176.502 0.1 . 1 . . . . . . . . 7007 1 829 . 1 1 82 82 ASP N N 15 121.192 0.1 . 1 . . . . . . . . 7007 1 830 . 1 1 82 82 ASP H H 1 8.367 0.02 . 1 . . . . . . . . 7007 1 831 . 1 1 82 82 ASP CA C 13 57.589 0.1 . 1 . . . . . . . . 7007 1 832 . 1 1 82 82 ASP HA H 1 4.381 0.02 . 1 . . . . . . . . 7007 1 833 . 1 1 82 82 ASP CB C 13 41.013 0.1 . 1 . . . . . . . . 7007 1 834 . 1 1 82 82 ASP HB2 H 1 2.637 0.02 . 2 . . . . . . . . 7007 1 835 . 1 1 82 82 ASP HB3 H 1 2.527 0.02 . 2 . . . . . . . . 7007 1 836 . 1 1 82 82 ASP C C 13 178.818 0.1 . 1 . . . . . . . . 7007 1 837 . 1 1 83 83 GLU N N 15 121.389 0.1 . 1 . . . . . . . . 7007 1 838 . 1 1 83 83 GLU H H 1 7.617 0.02 . 1 . . . . . . . . 7007 1 839 . 1 1 83 83 GLU CA C 13 59.259 0.1 . 1 . . . . . . . . 7007 1 840 . 1 1 83 83 GLU HA H 1 3.870 0.02 . 1 . . . . . . . . 7007 1 841 . 1 1 83 83 GLU CB C 13 30.480 0.1 . 1 . . . . . . . . 7007 1 842 . 1 1 83 83 GLU HB2 H 1 1.604 0.02 . 2 . . . . . . . . 7007 1 843 . 1 1 83 83 GLU HB3 H 1 2.520 0.02 . 2 . . . . . . . . 7007 1 844 . 1 1 83 83 GLU CG C 13 38.090 0.1 . 1 . . . . . . . . 7007 1 845 . 1 1 83 83 GLU HG2 H 1 2.334 0.02 . 2 . . . . . . . . 7007 1 846 . 1 1 83 83 GLU HG3 H 1 2.458 0.02 . 2 . . . . . . . . 7007 1 847 . 1 1 83 83 GLU C C 13 179.333 0.1 . 1 . . . . . . . . 7007 1 848 . 1 1 84 84 LEU N N 15 121.060 0.1 . 1 . . . . . . . . 7007 1 849 . 1 1 84 84 LEU H H 1 8.669 0.02 . 1 . . . . . . . . 7007 1 850 . 1 1 84 84 LEU CA C 13 57.936 0.1 . 1 . . . . . . . . 7007 1 851 . 1 1 84 84 LEU HA H 1 3.823 0.02 . 1 . . . . . . . . 7007 1 852 . 1 1 84 84 LEU CB C 13 42.350 0.1 . 1 . . . . . . . . 7007 1 853 . 1 1 84 84 LEU HB2 H 1 1.709 0.02 . 2 . . . . . . . . 7007 1 854 . 1 1 84 84 LEU HB3 H 1 1.131 0.02 . 2 . . . . . . . . 7007 1 855 . 1 1 84 84 LEU CG C 13 26.176 0.1 . 1 . . . . . . . . 7007 1 856 . 1 1 84 84 LEU HG H 1 1.445 0.02 . 1 . . . . . . . . 7007 1 857 . 1 1 84 84 LEU HD11 H 1 0.029 0.02 . 2 . . . . . . . . 7007 1 858 . 1 1 84 84 LEU HD12 H 1 0.029 0.02 . 2 . . . . . . . . 7007 1 859 . 1 1 84 84 LEU HD13 H 1 0.029 0.02 . 2 . . . . . . . . 7007 1 860 . 1 1 84 84 LEU HD21 H 1 0.528 0.02 . 2 . . . . . . . . 7007 1 861 . 1 1 84 84 LEU HD22 H 1 0.528 0.02 . 2 . . . . . . . . 7007 1 862 . 1 1 84 84 LEU HD23 H 1 0.528 0.02 . 2 . . . . . . . . 7007 1 863 . 1 1 84 84 LEU CD1 C 13 24.780 0.1 . 1 . . . . . . . . 7007 1 864 . 1 1 84 84 LEU CD2 C 13 24.387 0.1 . 1 . . . . . . . . 7007 1 865 . 1 1 84 84 LEU C C 13 177.809 0.1 . 1 . . . . . . . . 7007 1 866 . 1 1 85 85 GLU N N 15 116.986 0.1 . 1 . . . . . . . . 7007 1 867 . 1 1 85 85 GLU H H 1 7.609 0.02 . 1 . . . . . . . . 7007 1 868 . 1 1 85 85 GLU CA C 13 59.725 0.1 . 1 . . . . . . . . 7007 1 869 . 1 1 85 85 GLU HA H 1 4.036 0.02 . 1 . . . . . . . . 7007 1 870 . 1 1 85 85 GLU CB C 13 29.521 0.1 . 1 . . . . . . . . 7007 1 871 . 1 1 85 85 GLU HB3 H 1 2.113 0.02 . 2 . . . . . . . . 7007 1 872 . 1 1 85 85 GLU CG C 13 37.051 0.1 . 1 . . . . . . . . 7007 1 873 . 1 1 85 85 GLU HG2 H 1 2.257 0.02 . 2 . . . . . . . . 7007 1 874 . 1 1 85 85 GLU HG3 H 1 2.508 0.02 . 2 . . . . . . . . 7007 1 875 . 1 1 85 85 GLU C C 13 179.782 0.1 . 1 . . . . . . . . 7007 1 876 . 1 1 86 86 ASN N N 15 119.148 0.1 . 1 . . . . . . . . 7007 1 877 . 1 1 86 86 ASN H H 1 7.418 0.02 . 1 . . . . . . . . 7007 1 878 . 1 1 86 86 ASN CA C 13 56.265 0.1 . 1 . . . . . . . . 7007 1 879 . 1 1 86 86 ASN HA H 1 4.484 0.02 . 1 . . . . . . . . 7007 1 880 . 1 1 86 86 ASN CB C 13 37.917 0.1 . 1 . . . . . . . . 7007 1 881 . 1 1 86 86 ASN HB2 H 1 2.687 0.02 . 2 . . . . . . . . 7007 1 882 . 1 1 86 86 ASN HB3 H 1 3.015 0.02 . 2 . . . . . . . . 7007 1 883 . 1 1 86 86 ASN ND2 N 15 111.271 0.1 . 1 . . . . . . . . 7007 1 884 . 1 1 86 86 ASN HD21 H 1 6.813 0.02 . 2 . . . . . . . . 7007 1 885 . 1 1 86 86 ASN HD22 H 1 7.449 0.02 . 2 . . . . . . . . 7007 1 886 . 1 1 86 86 ASN C C 13 177.215 0.1 . 1 . . . . . . . . 7007 1 887 . 1 1 87 87 LEU N N 15 121.949 0.1 . 1 . . . . . . . . 7007 1 888 . 1 1 87 87 LEU H H 1 7.871 0.02 . 1 . . . . . . . . 7007 1 889 . 1 1 87 87 LEU CA C 13 58.796 0.1 . 1 . . . . . . . . 7007 1 890 . 1 1 87 87 LEU HA H 1 3.758 0.02 . 1 . . . . . . . . 7007 1 891 . 1 1 87 87 LEU CB C 13 41.054 0.1 . 1 . . . . . . . . 7007 1 892 . 1 1 87 87 LEU HB2 H 1 1.901 0.02 . 2 . . . . . . . . 7007 1 893 . 1 1 87 87 LEU HB3 H 1 1.494 0.02 . 2 . . . . . . . . 7007 1 894 . 1 1 87 87 LEU CG C 13 26.977 0.1 . 1 . . . . . . . . 7007 1 895 . 1 1 87 87 LEU HG H 1 1.524 0.02 . 1 . . . . . . . . 7007 1 896 . 1 1 87 87 LEU HD11 H 1 0.307 0.02 . 2 . . . . . . . . 7007 1 897 . 1 1 87 87 LEU HD12 H 1 0.307 0.02 . 2 . . . . . . . . 7007 1 898 . 1 1 87 87 LEU HD13 H 1 0.307 0.02 . 2 . . . . . . . . 7007 1 899 . 1 1 87 87 LEU HD21 H 1 0.521 0.02 . 2 . . . . . . . . 7007 1 900 . 1 1 87 87 LEU HD22 H 1 0.521 0.02 . 2 . . . . . . . . 7007 1 901 . 1 1 87 87 LEU HD23 H 1 0.521 0.02 . 2 . . . . . . . . 7007 1 902 . 1 1 87 87 LEU CD1 C 13 23.740 0.1 . 1 . . . . . . . . 7007 1 903 . 1 1 87 87 LEU CD2 C 13 25.007 0.1 . 1 . . . . . . . . 7007 1 904 . 1 1 87 87 LEU C C 13 178.772 0.1 . 1 . . . . . . . . 7007 1 905 . 1 1 88 88 ASP N N 15 118.528 0.1 . 1 . . . . . . . . 7007 1 906 . 1 1 88 88 ASP H H 1 8.780 0.02 . 1 . . . . . . . . 7007 1 907 . 1 1 88 88 ASP CA C 13 57.477 0.1 . 1 . . . . . . . . 7007 1 908 . 1 1 88 88 ASP HA H 1 4.151 0.02 . 1 . . . . . . . . 7007 1 909 . 1 1 88 88 ASP CB C 13 40.852 0.1 . 1 . . . . . . . . 7007 1 910 . 1 1 88 88 ASP HB2 H 1 2.631 0.02 . 2 . . . . . . . . 7007 1 911 . 1 1 88 88 ASP HB3 H 1 2.964 0.02 . 2 . . . . . . . . 7007 1 912 . 1 1 88 88 ASP C C 13 179.517 0.1 . 1 . . . . . . . . 7007 1 913 . 1 1 89 89 ALA N N 15 121.179 0.1 . 1 . . . . . . . . 7007 1 914 . 1 1 89 89 ALA H H 1 7.547 0.02 . 1 . . . . . . . . 7007 1 915 . 1 1 89 89 ALA CA C 13 54.711 0.1 . 1 . . . . . . . . 7007 1 916 . 1 1 89 89 ALA HA H 1 4.102 0.02 . 1 . . . . . . . . 7007 1 917 . 1 1 89 89 ALA HB1 H 1 1.532 0.02 . 1 . . . . . . . . 7007 1 918 . 1 1 89 89 ALA HB2 H 1 1.532 0.02 . 1 . . . . . . . . 7007 1 919 . 1 1 89 89 ALA HB3 H 1 1.532 0.02 . 1 . . . . . . . . 7007 1 920 . 1 1 89 89 ALA CB C 13 18.521 0.1 . 1 . . . . . . . . 7007 1 921 . 1 1 89 89 ALA C C 13 179.620 0.1 . 1 . . . . . . . . 7007 1 922 . 1 1 90 90 VAL N N 15 117.383 0.1 . 1 . . . . . . . . 7007 1 923 . 1 1 90 90 VAL H H 1 7.619 0.02 . 1 . . . . . . . . 7007 1 924 . 1 1 90 90 VAL CA C 13 65.473 0.1 . 1 . . . . . . . . 7007 1 925 . 1 1 90 90 VAL HA H 1 3.742 0.02 . 1 . . . . . . . . 7007 1 926 . 1 1 90 90 VAL CB C 13 32.480 0.1 . 1 . . . . . . . . 7007 1 927 . 1 1 90 90 VAL HB H 1 2.031 0.02 . 1 . . . . . . . . 7007 1 928 . 1 1 90 90 VAL HG11 H 1 0.772 0.02 . 2 . . . . . . . . 7007 1 929 . 1 1 90 90 VAL HG12 H 1 0.772 0.02 . 2 . . . . . . . . 7007 1 930 . 1 1 90 90 VAL HG13 H 1 0.772 0.02 . 2 . . . . . . . . 7007 1 931 . 1 1 90 90 VAL HG21 H 1 0.997 0.02 . 2 . . . . . . . . 7007 1 932 . 1 1 90 90 VAL HG22 H 1 0.997 0.02 . 2 . . . . . . . . 7007 1 933 . 1 1 90 90 VAL HG23 H 1 0.997 0.02 . 2 . . . . . . . . 7007 1 934 . 1 1 90 90 VAL CG1 C 13 21.821 0.1 . 1 . . . . . . . . 7007 1 935 . 1 1 90 90 VAL CG2 C 13 23.092 0.1 . 1 . . . . . . . . 7007 1 936 . 1 1 91 91 GLU N N 15 118.871 0.1 . 1 . . . . . . . . 7007 1 937 . 1 1 91 91 GLU H H 1 7.899 0.02 . 1 . . . . . . . . 7007 1 938 . 1 1 91 91 GLU CA C 13 58.052 0.1 . 1 . . . . . . . . 7007 1 939 . 1 1 91 91 GLU HA H 1 4.105 0.02 . 1 . . . . . . . . 7007 1 940 . 1 1 91 91 GLU CB C 13 28.595 0.1 . 1 . . . . . . . . 7007 1 941 . 1 1 91 91 GLU HB2 H 1 1.400 0.02 . 1 . . . . . . . . 7007 1 942 . 1 1 91 91 GLU HB3 H 1 1.400 0.02 . 1 . . . . . . . . 7007 1 943 . 1 1 91 91 GLU CG C 13 32.156 0.1 . 1 . . . . . . . . 7007 1 944 . 1 1 91 91 GLU HG2 H 1 0.205 0.02 . 2 . . . . . . . . 7007 1 945 . 1 1 91 91 GLU HG3 H 1 1.568 0.02 . 2 . . . . . . . . 7007 1 946 . 1 1 91 91 GLU C C 13 178.339 0.1 . 1 . . . . . . . . 7007 1 947 . 1 1 92 92 GLY N N 15 101.825 0.1 . 1 . . . . . . . . 7007 1 948 . 1 1 92 92 GLY H H 1 7.440 0.02 . 1 . . . . . . . . 7007 1 949 . 1 1 92 92 GLY CA C 13 45.834 0.1 . 1 . . . . . . . . 7007 1 950 . 1 1 92 92 GLY HA2 H 1 3.878 0.02 . 2 . . . . . . . . 7007 1 951 . 1 1 92 92 GLY HA3 H 1 4.242 0.02 . 2 . . . . . . . . 7007 1 952 . 1 1 92 92 GLY C C 13 175.526 0.1 . 1 . . . . . . . . 7007 1 953 . 1 1 93 93 ASN N N 15 114.464 0.1 . 1 . . . . . . . . 7007 1 954 . 1 1 93 93 ASN H H 1 8.256 0.02 . 1 . . . . . . . . 7007 1 955 . 1 1 93 93 ASN CA C 13 54.926 0.1 . 1 . . . . . . . . 7007 1 956 . 1 1 93 93 ASN HA H 1 4.669 0.02 . 1 . . . . . . . . 7007 1 957 . 1 1 93 93 ASN CB C 13 39.052 0.1 . 1 . . . . . . . . 7007 1 958 . 1 1 93 93 ASN HB2 H 1 2.864 0.02 . 2 . . . . . . . . 7007 1 959 . 1 1 93 93 ASN HB3 H 1 2.955 0.02 . 2 . . . . . . . . 7007 1 960 . 1 1 93 93 ASN ND2 N 15 111.675 0.1 . 1 . . . . . . . . 7007 1 961 . 1 1 93 93 ASN HD21 H 1 6.868 0.02 . 2 . . . . . . . . 7007 1 962 . 1 1 93 93 ASN HD22 H 1 7.573 0.02 . 2 . . . . . . . . 7007 1 963 . 1 1 93 93 ASN C C 13 177.055 0.1 . 1 . . . . . . . . 7007 1 964 . 1 1 94 94 GLU N N 15 117.675 0.1 . 1 . . . . . . . . 7007 1 965 . 1 1 94 94 GLU H H 1 8.659 0.02 . 1 . . . . . . . . 7007 1 966 . 1 1 94 94 GLU CA C 13 57.829 0.1 . 1 . . . . . . . . 7007 1 967 . 1 1 94 94 GLU HA H 1 3.768 0.02 . 1 . . . . . . . . 7007 1 968 . 1 1 94 94 GLU CB C 13 31.185 0.1 . 1 . . . . . . . . 7007 1 969 . 1 1 94 94 GLU HB2 H 1 0.734 0.02 . 2 . . . . . . . . 7007 1 970 . 1 1 94 94 GLU HB3 H 1 1.604 0.02 . 2 . . . . . . . . 7007 1 971 . 1 1 94 94 GLU CG C 13 37.983 0.1 . 1 . . . . . . . . 7007 1 972 . 1 1 94 94 GLU HG2 H 1 1.823 0.02 . 2 . . . . . . . . 7007 1 973 . 1 1 94 94 GLU HG3 H 1 2.194 0.02 . 2 . . . . . . . . 7007 1 974 . 1 1 94 94 GLU C C 13 175.037 0.1 . 1 . . . . . . . . 7007 1 975 . 1 1 95 95 TYR N N 15 114.288 0.1 . 1 . . . . . . . . 7007 1 976 . 1 1 95 95 TYR H H 1 7.404 0.02 . 1 . . . . . . . . 7007 1 977 . 1 1 95 95 TYR CA C 13 56.635 0.1 . 1 . . . . . . . . 7007 1 978 . 1 1 95 95 TYR HA H 1 5.378 0.02 . 1 . . . . . . . . 7007 1 979 . 1 1 95 95 TYR CB C 13 43.486 0.1 . 1 . . . . . . . . 7007 1 980 . 1 1 95 95 TYR HB2 H 1 3.037 0.02 . 2 . . . . . . . . 7007 1 981 . 1 1 95 95 TYR HB3 H 1 2.844 0.02 . 2 . . . . . . . . 7007 1 982 . 1 1 95 95 TYR CD1 C 13 134.201 0.1 . 1 . . . . . . . . 7007 1 983 . 1 1 95 95 TYR HD1 H 1 6.996 0.02 . 1 . . . . . . . . 7007 1 984 . 1 1 95 95 TYR CE1 C 13 118.678 0.1 . 1 . . . . . . . . 7007 1 985 . 1 1 95 95 TYR HE1 H 1 7.079 0.02 . 1 . . . . . . . . 7007 1 986 . 1 1 95 95 TYR HE2 H 1 7.079 0.02 . 1 . . . . . . . . 7007 1 987 . 1 1 95 95 TYR HD2 H 1 6.996 0.02 . 1 . . . . . . . . 7007 1 988 . 1 1 95 95 TYR C C 13 174.941 0.1 . 1 . . . . . . . . 7007 1 989 . 1 1 96 96 GLU N N 15 118.266 0.1 . 1 . . . . . . . . 7007 1 990 . 1 1 96 96 GLU H H 1 9.449 0.02 . 1 . . . . . . . . 7007 1 991 . 1 1 96 96 GLU CA C 13 54.031 0.1 . 1 . . . . . . . . 7007 1 992 . 1 1 96 96 GLU HA H 1 4.854 0.02 . 1 . . . . . . . . 7007 1 993 . 1 1 96 96 GLU CB C 13 32.918 0.1 . 1 . . . . . . . . 7007 1 994 . 1 1 96 96 GLU HB2 H 1 1.953 0.02 . 2 . . . . . . . . 7007 1 995 . 1 1 96 96 GLU HB3 H 1 1.853 0.02 . 2 . . . . . . . . 7007 1 996 . 1 1 96 96 GLU CG C 13 35.969 0.1 . 1 . . . . . . . . 7007 1 997 . 1 1 96 96 GLU HG3 H 1 2.190 0.02 . 2 . . . . . . . . 7007 1 998 . 1 1 96 96 GLU C C 13 174.926 0.1 . 1 . . . . . . . . 7007 1 999 . 1 1 97 97 ARG N N 15 127.022 0.1 . 1 . . . . . . . . 7007 1 1000 . 1 1 97 97 ARG H H 1 8.915 0.02 . 1 . . . . . . . . 7007 1 1001 . 1 1 97 97 ARG CA C 13 55.618 0.1 . 1 . . . . . . . . 7007 1 1002 . 1 1 97 97 ARG HA H 1 4.893 0.02 . 1 . . . . . . . . 7007 1 1003 . 1 1 97 97 ARG CB C 13 30.344 0.1 . 1 . . . . . . . . 7007 1 1004 . 1 1 97 97 ARG HB2 H 1 1.387 0.02 . 2 . . . . . . . . 7007 1 1005 . 1 1 97 97 ARG HB3 H 1 1.648 0.02 . 2 . . . . . . . . 7007 1 1006 . 1 1 97 97 ARG CG C 13 27.003 0.1 . 1 . . . . . . . . 7007 1 1007 . 1 1 97 97 ARG HG2 H 1 0.929 0.02 . 2 . . . . . . . . 7007 1 1008 . 1 1 97 97 ARG HG3 H 1 1.254 0.02 . 2 . . . . . . . . 7007 1 1009 . 1 1 97 97 ARG CD C 13 43.439 0.1 . 1 . . . . . . . . 7007 1 1010 . 1 1 97 97 ARG HD2 H 1 2.825 0.02 . 2 . . . . . . . . 7007 1 1011 . 1 1 97 97 ARG HD3 H 1 2.758 0.02 . 2 . . . . . . . . 7007 1 1012 . 1 1 97 97 ARG C C 13 176.156 0.1 . 1 . . . . . . . . 7007 1 1013 . 1 1 98 98 VAL N N 15 122.265 0.1 . 1 . . . . . . . . 7007 1 1014 . 1 1 98 98 VAL H H 1 8.734 0.02 . 1 . . . . . . . . 7007 1 1015 . 1 1 98 98 VAL CA C 13 59.522 0.1 . 1 . . . . . . . . 7007 1 1016 . 1 1 98 98 VAL HA H 1 4.739 0.02 . 1 . . . . . . . . 7007 1 1017 . 1 1 98 98 VAL CB C 13 36.112 0.1 . 1 . . . . . . . . 7007 1 1018 . 1 1 98 98 VAL HB H 1 2.184 0.02 . 1 . . . . . . . . 7007 1 1019 . 1 1 98 98 VAL HG11 H 1 0.915 0.02 . 2 . . . . . . . . 7007 1 1020 . 1 1 98 98 VAL HG12 H 1 0.915 0.02 . 2 . . . . . . . . 7007 1 1021 . 1 1 98 98 VAL HG13 H 1 0.915 0.02 . 2 . . . . . . . . 7007 1 1022 . 1 1 98 98 VAL HG21 H 1 0.749 0.02 . 2 . . . . . . . . 7007 1 1023 . 1 1 98 98 VAL HG22 H 1 0.749 0.02 . 2 . . . . . . . . 7007 1 1024 . 1 1 98 98 VAL HG23 H 1 0.749 0.02 . 2 . . . . . . . . 7007 1 1025 . 1 1 98 98 VAL CG1 C 13 21.676 0.1 . 1 . . . . . . . . 7007 1 1026 . 1 1 98 98 VAL CG2 C 13 19.105 0.1 . 1 . . . . . . . . 7007 1 1027 . 1 1 98 98 VAL C C 13 174.400 0.1 . 1 . . . . . . . . 7007 1 1028 . 1 1 99 99 THR N N 15 118.766 0.1 . 1 . . . . . . . . 7007 1 1029 . 1 1 99 99 THR H H 1 8.374 0.02 . 1 . . . . . . . . 7007 1 1030 . 1 1 99 99 THR CA C 13 62.762 0.1 . 1 . . . . . . . . 7007 1 1031 . 1 1 99 99 THR HA H 1 5.194 0.02 . 1 . . . . . . . . 7007 1 1032 . 1 1 99 99 THR CB C 13 69.886 0.1 . 1 . . . . . . . . 7007 1 1033 . 1 1 99 99 THR HB H 1 3.938 0.02 . 1 . . . . . . . . 7007 1 1034 . 1 1 99 99 THR HG21 H 1 1.126 0.02 . 1 . . . . . . . . 7007 1 1035 . 1 1 99 99 THR HG22 H 1 1.126 0.02 . 1 . . . . . . . . 7007 1 1036 . 1 1 99 99 THR HG23 H 1 1.126 0.02 . 1 . . . . . . . . 7007 1 1037 . 1 1 99 99 THR CG2 C 13 21.892 0.1 . 1 . . . . . . . . 7007 1 1038 . 1 1 99 99 THR C C 13 174.710 0.1 . 1 . . . . . . . . 7007 1 1039 . 1 1 100 100 VAL N N 15 120.607 0.1 . 1 . . . . . . . . 7007 1 1040 . 1 1 100 100 VAL H H 1 9.308 0.02 . 1 . . . . . . . . 7007 1 1041 . 1 1 100 100 VAL CA C 13 59.204 0.1 . 1 . . . . . . . . 7007 1 1042 . 1 1 100 100 VAL HA H 1 4.677 0.02 . 1 . . . . . . . . 7007 1 1043 . 1 1 100 100 VAL CB C 13 36.497 0.1 . 1 . . . . . . . . 7007 1 1044 . 1 1 100 100 VAL HB H 1 1.963 0.02 . 1 . . . . . . . . 7007 1 1045 . 1 1 100 100 VAL HG11 H 1 0.261 0.02 . 2 . . . . . . . . 7007 1 1046 . 1 1 100 100 VAL HG12 H 1 0.261 0.02 . 2 . . . . . . . . 7007 1 1047 . 1 1 100 100 VAL HG13 H 1 0.261 0.02 . 2 . . . . . . . . 7007 1 1048 . 1 1 100 100 VAL HG21 H 1 0.555 0.02 . 2 . . . . . . . . 7007 1 1049 . 1 1 100 100 VAL HG22 H 1 0.555 0.02 . 2 . . . . . . . . 7007 1 1050 . 1 1 100 100 VAL HG23 H 1 0.555 0.02 . 2 . . . . . . . . 7007 1 1051 . 1 1 100 100 VAL CG1 C 13 19.041 0.1 . 1 . . . . . . . . 7007 1 1052 . 1 1 100 100 VAL CG2 C 13 23.112 0.1 . 1 . . . . . . . . 7007 1 1053 . 1 1 100 100 VAL C C 13 174.091 0.1 . 1 . . . . . . . . 7007 1 1054 . 1 1 101 101 GLY N N 15 108.224 0.1 . 1 . . . . . . . . 7007 1 1055 . 1 1 101 101 GLY H H 1 8.336 0.02 . 1 . . . . . . . . 7007 1 1056 . 1 1 101 101 GLY CA C 13 45.495 0.1 . 1 . . . . . . . . 7007 1 1057 . 1 1 101 101 GLY HA2 H 1 4.957 0.02 . 2 . . . . . . . . 7007 1 1058 . 1 1 101 101 GLY HA3 H 1 3.391 0.02 . 2 . . . . . . . . 7007 1 1059 . 1 1 101 101 GLY C C 13 174.078 0.1 . 1 . . . . . . . . 7007 1 1060 . 1 1 102 102 ILE N N 15 114.651 0.1 . 1 . . . . . . . . 7007 1 1061 . 1 1 102 102 ILE H H 1 8.657 0.02 . 1 . . . . . . . . 7007 1 1062 . 1 1 102 102 ILE CA C 13 57.266 0.1 . 1 . . . . . . . . 7007 1 1063 . 1 1 102 102 ILE HA H 1 4.878 0.02 . 1 . . . . . . . . 7007 1 1064 . 1 1 102 102 ILE CB C 13 42.802 0.1 . 1 . . . . . . . . 7007 1 1065 . 1 1 102 102 ILE HB H 1 1.713 0.02 . 1 . . . . . . . . 7007 1 1066 . 1 1 102 102 ILE HG21 H 1 0.176 0.02 . 1 . . . . . . . . 7007 1 1067 . 1 1 102 102 ILE HG22 H 1 0.176 0.02 . 1 . . . . . . . . 7007 1 1068 . 1 1 102 102 ILE HG23 H 1 0.176 0.02 . 1 . . . . . . . . 7007 1 1069 . 1 1 102 102 ILE CG2 C 13 22.997 0.1 . 1 . . . . . . . . 7007 1 1070 . 1 1 102 102 ILE CG1 C 13 27.948 0.1 . 1 . . . . . . . . 7007 1 1071 . 1 1 102 102 ILE HG12 H 1 0.825 0.02 . 2 . . . . . . . . 7007 1 1072 . 1 1 102 102 ILE HG13 H 1 1.473 0.02 . 2 . . . . . . . . 7007 1 1073 . 1 1 102 102 ILE HD11 H 1 0.750 0.02 . 1 . . . . . . . . 7007 1 1074 . 1 1 102 102 ILE HD12 H 1 0.750 0.02 . 1 . . . . . . . . 7007 1 1075 . 1 1 102 102 ILE HD13 H 1 0.750 0.02 . 1 . . . . . . . . 7007 1 1076 . 1 1 102 102 ILE CD1 C 13 16.318 0.1 . 1 . . . . . . . . 7007 1 1077 . 1 1 102 102 ILE C C 13 176.258 0.1 . 1 . . . . . . . . 7007 1 1078 . 1 1 103 103 VAL N N 15 120.716 0.1 . 1 . . . . . . . . 7007 1 1079 . 1 1 103 103 VAL H H 1 8.869 0.02 . 1 . . . . . . . . 7007 1 1080 . 1 1 103 103 VAL CA C 13 61.725 0.1 . 1 . . . . . . . . 7007 1 1081 . 1 1 103 103 VAL HA H 1 4.451 0.02 . 1 . . . . . . . . 7007 1 1082 . 1 1 103 103 VAL CB C 13 34.260 0.1 . 1 . . . . . . . . 7007 1 1083 . 1 1 103 103 VAL HB H 1 1.871 0.02 . 1 . . . . . . . . 7007 1 1084 . 1 1 103 103 VAL HG21 H 1 0.797 0.02 . 2 . . . . . . . . 7007 1 1085 . 1 1 103 103 VAL HG22 H 1 0.797 0.02 . 2 . . . . . . . . 7007 1 1086 . 1 1 103 103 VAL HG23 H 1 0.797 0.02 . 2 . . . . . . . . 7007 1 1087 . 1 1 103 103 VAL CG2 C 13 20.874 0.1 . 1 . . . . . . . . 7007 1 1088 . 1 1 103 103 VAL C C 13 177.016 0.1 . 1 . . . . . . . . 7007 1 1089 . 1 1 104 104 ARG N N 15 129.455 0.1 . 1 . . . . . . . . 7007 1 1090 . 1 1 104 104 ARG H H 1 9.096 0.02 . 1 . . . . . . . . 7007 1 1091 . 1 1 104 104 ARG CA C 13 57.728 0.1 . 1 . . . . . . . . 7007 1 1092 . 1 1 104 104 ARG HA H 1 4.199 0.02 . 1 . . . . . . . . 7007 1 1093 . 1 1 104 104 ARG CB C 13 32.144 0.1 . 1 . . . . . . . . 7007 1 1094 . 1 1 104 104 ARG HB2 H 1 2.526 0.02 . 2 . . . . . . . . 7007 1 1095 . 1 1 104 104 ARG HB3 H 1 2.130 0.02 . 2 . . . . . . . . 7007 1 1096 . 1 1 104 104 ARG CG C 13 28.919 0.1 . 1 . . . . . . . . 7007 1 1097 . 1 1 104 104 ARG HG2 H 1 1.375 0.02 . 2 . . . . . . . . 7007 1 1098 . 1 1 104 104 ARG HG3 H 1 1.713 0.02 . 2 . . . . . . . . 7007 1 1099 . 1 1 104 104 ARG CD C 13 44.133 0.1 . 1 . . . . . . . . 7007 1 1100 . 1 1 104 104 ARG HD3 H 1 3.420 0.02 . 2 . . . . . . . . 7007 1 1101 . 1 1 104 104 ARG NE N 15 85.407 0.1 . 1 . . . . . . . . 7007 1 1102 . 1 1 104 104 ARG HE H 1 8.838 0.02 . 1 . . . . . . . . 7007 1 1103 . 1 1 104 104 ARG C C 13 178.087 0.1 . 1 . . . . . . . . 7007 1 1104 . 1 1 105 105 GLU N N 15 122.470 0.1 . 1 . . . . . . . . 7007 1 1105 . 1 1 105 105 GLU H H 1 8.519 0.02 . 1 . . . . . . . . 7007 1 1106 . 1 1 105 105 GLU CA C 13 58.613 0.1 . 1 . . . . . . . . 7007 1 1107 . 1 1 105 105 GLU HA H 1 4.156 0.02 . 1 . . . . . . . . 7007 1 1108 . 1 1 105 105 GLU CB C 13 30.343 0.1 . 1 . . . . . . . . 7007 1 1109 . 1 1 105 105 GLU HB2 H 1 1.745 0.02 . 2 . . . . . . . . 7007 1 1110 . 1 1 105 105 GLU HB3 H 1 2.076 0.02 . 2 . . . . . . . . 7007 1 1111 . 1 1 105 105 GLU CG C 13 37.366 0.1 . 1 . . . . . . . . 7007 1 1112 . 1 1 105 105 GLU HG3 H 1 2.277 0.02 . 2 . . . . . . . . 7007 1 1113 . 1 1 105 105 GLU C C 13 177.495 0.1 . 1 . . . . . . . . 7007 1 1114 . 1 1 106 106 ASP N N 15 116.972 0.1 . 1 . . . . . . . . 7007 1 1115 . 1 1 106 106 ASP H H 1 8.691 0.02 . 1 . . . . . . . . 7007 1 1116 . 1 1 106 106 ASP CA C 13 56.050 0.1 . 1 . . . . . . . . 7007 1 1117 . 1 1 106 106 ASP HA H 1 4.372 0.02 . 1 . . . . . . . . 7007 1 1118 . 1 1 106 106 ASP CB C 13 39.343 0.1 . 1 . . . . . . . . 7007 1 1119 . 1 1 106 106 ASP HB2 H 1 2.757 0.02 . 2 . . . . . . . . 7007 1 1120 . 1 1 106 106 ASP HB3 H 1 2.874 0.02 . 2 . . . . . . . . 7007 1 1121 . 1 1 106 106 ASP C C 13 178.547 0.1 . 1 . . . . . . . . 7007 1 1122 . 1 1 107 107 ASN N N 15 117.482 0.1 . 1 . . . . . . . . 7007 1 1123 . 1 1 107 107 ASN H H 1 8.318 0.02 . 1 . . . . . . . . 7007 1 1124 . 1 1 107 107 ASN CA C 13 52.107 0.1 . 1 . . . . . . . . 7007 1 1125 . 1 1 107 107 ASN HA H 1 4.802 0.02 . 1 . . . . . . . . 7007 1 1126 . 1 1 107 107 ASN CB C 13 39.154 0.1 . 1 . . . . . . . . 7007 1 1127 . 1 1 107 107 ASN HB2 H 1 3.209 0.02 . 2 . . . . . . . . 7007 1 1128 . 1 1 107 107 ASN HB3 H 1 2.602 0.02 . 2 . . . . . . . . 7007 1 1129 . 1 1 107 107 ASN ND2 N 15 107.160 0.1 . 1 . . . . . . . . 7007 1 1130 . 1 1 107 107 ASN HD21 H 1 7.223 0.02 . 2 . . . . . . . . 7007 1 1131 . 1 1 107 107 ASN HD22 H 1 6.391 0.02 . 2 . . . . . . . . 7007 1 1132 . 1 1 107 107 ASN C C 13 176.532 0.1 . 1 . . . . . . . . 7007 1 1133 . 1 1 108 108 SER N N 15 110.815 0.1 . 1 . . . . . . . . 7007 1 1134 . 1 1 108 108 SER H H 1 7.650 0.02 . 1 . . . . . . . . 7007 1 1135 . 1 1 108 108 SER CA C 13 60.629 0.1 . 1 . . . . . . . . 7007 1 1136 . 1 1 108 108 SER HA H 1 4.320 0.02 . 1 . . . . . . . . 7007 1 1137 . 1 1 108 108 SER CB C 13 62.504 0.1 . 1 . . . . . . . . 7007 1 1138 . 1 1 108 108 SER HB3 H 1 4.095 0.02 . 2 . . . . . . . . 7007 1 1139 . 1 1 108 108 SER C C 13 173.306 0.1 . 1 . . . . . . . . 7007 1 1140 . 1 1 109 109 GLU N N 15 120.372 0.1 . 1 . . . . . . . . 7007 1 1141 . 1 1 109 109 GLU H H 1 8.051 0.02 . 1 . . . . . . . . 7007 1 1142 . 1 1 109 109 GLU CA C 13 56.935 0.1 . 1 . . . . . . . . 7007 1 1143 . 1 1 109 109 GLU HA H 1 4.242 0.02 . 1 . . . . . . . . 7007 1 1144 . 1 1 109 109 GLU CB C 13 31.159 0.1 . 1 . . . . . . . . 7007 1 1145 . 1 1 109 109 GLU HB2 H 1 1.891 0.02 . 2 . . . . . . . . 7007 1 1146 . 1 1 109 109 GLU HB3 H 1 1.972 0.02 . 2 . . . . . . . . 7007 1 1147 . 1 1 109 109 GLU CG C 13 36.734 0.1 . 1 . . . . . . . . 7007 1 1148 . 1 1 109 109 GLU HG2 H 1 2.157 0.02 . 2 . . . . . . . . 7007 1 1149 . 1 1 109 109 GLU HG3 H 1 1.904 0.02 . 2 . . . . . . . . 7007 1 1150 . 1 1 109 109 GLU C C 13 176.246 0.1 . 1 . . . . . . . . 7007 1 1151 . 1 1 110 110 LYS N N 15 122.692 0.1 . 1 . . . . . . . . 7007 1 1152 . 1 1 110 110 LYS H H 1 8.497 0.02 . 1 . . . . . . . . 7007 1 1153 . 1 1 110 110 LYS CA C 13 55.727 0.1 . 1 . . . . . . . . 7007 1 1154 . 1 1 110 110 LYS HA H 1 5.194 0.02 . 1 . . . . . . . . 7007 1 1155 . 1 1 110 110 LYS CB C 13 33.377 0.1 . 1 . . . . . . . . 7007 1 1156 . 1 1 110 110 LYS HB2 H 1 1.676 0.02 . 2 . . . . . . . . 7007 1 1157 . 1 1 110 110 LYS HB3 H 1 1.838 0.02 . 2 . . . . . . . . 7007 1 1158 . 1 1 110 110 LYS CG C 13 25.682 0.1 . 1 . . . . . . . . 7007 1 1159 . 1 1 110 110 LYS HG2 H 1 1.359 0.02 . 2 . . . . . . . . 7007 1 1160 . 1 1 110 110 LYS HG3 H 1 1.565 0.02 . 2 . . . . . . . . 7007 1 1161 . 1 1 110 110 LYS CD C 13 29.510 0.1 . 1 . . . . . . . . 7007 1 1162 . 1 1 110 110 LYS HD3 H 1 1.660 0.02 . 2 . . . . . . . . 7007 1 1163 . 1 1 110 110 LYS CE C 13 42.403 0.1 . 1 . . . . . . . . 7007 1 1164 . 1 1 110 110 LYS HE3 H 1 2.932 0.02 . 2 . . . . . . . . 7007 1 1165 . 1 1 110 110 LYS C C 13 177.606 0.1 . 1 . . . . . . . . 7007 1 1166 . 1 1 111 111 MET N N 15 119.933 0.1 . 1 . . . . . . . . 7007 1 1167 . 1 1 111 111 MET H H 1 8.315 0.02 . 1 . . . . . . . . 7007 1 1168 . 1 1 111 111 MET CA C 13 55.355 0.1 . 1 . . . . . . . . 7007 1 1169 . 1 1 111 111 MET HA H 1 4.625 0.02 . 1 . . . . . . . . 7007 1 1170 . 1 1 111 111 MET CB C 13 38.525 0.1 . 1 . . . . . . . . 7007 1 1171 . 1 1 111 111 MET HB2 H 1 1.681 0.02 . 2 . . . . . . . . 7007 1 1172 . 1 1 111 111 MET HB3 H 1 2.032 0.02 . 2 . . . . . . . . 7007 1 1173 . 1 1 111 111 MET CG C 13 31.280 0.1 . 1 . . . . . . . . 7007 1 1174 . 1 1 111 111 MET HG2 H 1 2.215 0.02 . 2 . . . . . . . . 7007 1 1175 . 1 1 111 111 MET HG3 H 1 2.492 0.02 . 2 . . . . . . . . 7007 1 1176 . 1 1 111 111 MET HE1 H 1 1.893 0.02 . 1 . . . . . . . . 7007 1 1177 . 1 1 111 111 MET HE2 H 1 1.893 0.02 . 1 . . . . . . . . 7007 1 1178 . 1 1 111 111 MET HE3 H 1 1.893 0.02 . 1 . . . . . . . . 7007 1 1179 . 1 1 111 111 MET CE C 13 16.990 0.1 . 1 . . . . . . . . 7007 1 1180 . 1 1 111 111 MET C C 13 173.573 0.1 . 1 . . . . . . . . 7007 1 1181 . 1 1 112 112 ALA N N 15 127.404 0.1 . 1 . . . . . . . . 7007 1 1182 . 1 1 112 112 ALA H H 1 8.606 0.02 . 1 . . . . . . . . 7007 1 1183 . 1 1 112 112 ALA CA C 13 51.550 0.1 . 1 . . . . . . . . 7007 1 1184 . 1 1 112 112 ALA HA H 1 5.196 0.02 . 1 . . . . . . . . 7007 1 1185 . 1 1 112 112 ALA HB1 H 1 1.264 0.02 . 1 . . . . . . . . 7007 1 1186 . 1 1 112 112 ALA HB2 H 1 1.264 0.02 . 1 . . . . . . . . 7007 1 1187 . 1 1 112 112 ALA HB3 H 1 1.264 0.02 . 1 . . . . . . . . 7007 1 1188 . 1 1 112 112 ALA CB C 13 19.100 0.1 . 1 . . . . . . . . 7007 1 1189 . 1 1 112 112 ALA C C 13 177.694 0.1 . 1 . . . . . . . . 7007 1 1190 . 1 1 113 113 VAL N N 15 117.177 0.1 . 1 . . . . . . . . 7007 1 1191 . 1 1 113 113 VAL H H 1 9.341 0.02 . 1 . . . . . . . . 7007 1 1192 . 1 1 113 113 VAL CA C 13 58.989 0.1 . 1 . . . . . . . . 7007 1 1193 . 1 1 113 113 VAL HA H 1 4.965 0.02 . 1 . . . . . . . . 7007 1 1194 . 1 1 113 113 VAL CB C 13 35.863 0.1 . 1 . . . . . . . . 7007 1 1195 . 1 1 113 113 VAL HB H 1 2.226 0.02 . 1 . . . . . . . . 7007 1 1196 . 1 1 113 113 VAL HG11 H 1 0.684 0.02 . 2 . . . . . . . . 7007 1 1197 . 1 1 113 113 VAL HG12 H 1 0.684 0.02 . 2 . . . . . . . . 7007 1 1198 . 1 1 113 113 VAL HG13 H 1 0.684 0.02 . 2 . . . . . . . . 7007 1 1199 . 1 1 113 113 VAL HG21 H 1 0.828 0.02 . 2 . . . . . . . . 7007 1 1200 . 1 1 113 113 VAL HG22 H 1 0.828 0.02 . 2 . . . . . . . . 7007 1 1201 . 1 1 113 113 VAL HG23 H 1 0.828 0.02 . 2 . . . . . . . . 7007 1 1202 . 1 1 113 113 VAL CG1 C 13 21.665 0.1 . 1 . . . . . . . . 7007 1 1203 . 1 1 113 113 VAL CG2 C 13 23.416 0.1 . 1 . . . . . . . . 7007 1 1204 . 1 1 113 113 VAL C C 13 173.966 0.1 . 1 . . . . . . . . 7007 1 1205 . 1 1 114 114 LYS N N 15 117.366 0.1 . 1 . . . . . . . . 7007 1 1206 . 1 1 114 114 LYS H H 1 8.463 0.02 . 1 . . . . . . . . 7007 1 1207 . 1 1 114 114 LYS CA C 13 54.949 0.1 . 1 . . . . . . . . 7007 1 1208 . 1 1 114 114 LYS HA H 1 5.444 0.02 . 1 . . . . . . . . 7007 1 1209 . 1 1 114 114 LYS CB C 13 35.299 0.1 . 1 . . . . . . . . 7007 1 1210 . 1 1 114 114 LYS HB2 H 1 1.395 0.02 . 2 . . . . . . . . 7007 1 1211 . 1 1 114 114 LYS HB3 H 1 1.625 0.02 . 2 . . . . . . . . 7007 1 1212 . 1 1 114 114 LYS CD C 13 29.890 0.1 . 1 . . . . . . . . 7007 1 1213 . 1 1 114 114 LYS HD2 H 1 1.396 0.02 . 2 . . . . . . . . 7007 1 1214 . 1 1 114 114 LYS HD3 H 1 1.596 0.02 . 2 . . . . . . . . 7007 1 1215 . 1 1 114 114 LYS CE C 13 42.446 0.1 . 1 . . . . . . . . 7007 1 1216 . 1 1 114 114 LYS HE3 H 1 2.897 0.02 . 2 . . . . . . . . 7007 1 1217 . 1 1 114 114 LYS C C 13 176.530 0.1 . 1 . . . . . . . . 7007 1 1218 . 1 1 115 115 THR N N 15 114.911 0.1 . 1 . . . . . . . . 7007 1 1219 . 1 1 115 115 THR H H 1 9.021 0.02 . 1 . . . . . . . . 7007 1 1220 . 1 1 115 115 THR CA C 13 62.178 0.1 . 1 . . . . . . . . 7007 1 1221 . 1 1 115 115 THR HA H 1 4.493 0.02 . 1 . . . . . . . . 7007 1 1222 . 1 1 115 115 THR CB C 13 70.344 0.1 . 1 . . . . . . . . 7007 1 1223 . 1 1 115 115 THR HB H 1 4.106 0.02 . 1 . . . . . . . . 7007 1 1224 . 1 1 115 115 THR HG21 H 1 0.675 0.02 . 1 . . . . . . . . 7007 1 1225 . 1 1 115 115 THR HG22 H 1 0.675 0.02 . 1 . . . . . . . . 7007 1 1226 . 1 1 115 115 THR HG23 H 1 0.675 0.02 . 1 . . . . . . . . 7007 1 1227 . 1 1 115 115 THR HG1 H 1 5.345 0.02 . 1 . . . . . . . . 7007 1 1228 . 1 1 115 115 THR CG2 C 13 19.232 0.1 . 1 . . . . . . . . 7007 1 1229 . 1 1 115 115 THR C C 13 170.540 0.1 . 1 . . . . . . . . 7007 1 1230 . 1 1 116 116 TYR N N 15 121.567 0.1 . 1 . . . . . . . . 7007 1 1231 . 1 1 116 116 TYR H H 1 8.233 0.02 . 1 . . . . . . . . 7007 1 1232 . 1 1 116 116 TYR CA C 13 58.517 0.1 . 1 . . . . . . . . 7007 1 1233 . 1 1 116 116 TYR HA H 1 4.992 0.02 . 1 . . . . . . . . 7007 1 1234 . 1 1 116 116 TYR CB C 13 39.601 0.1 . 1 . . . . . . . . 7007 1 1235 . 1 1 116 116 TYR HB3 H 1 2.507 0.02 . 2 . . . . . . . . 7007 1 1236 . 1 1 116 116 TYR CD1 C 13 132.814 0.1 . 1 . . . . . . . . 7007 1 1237 . 1 1 116 116 TYR HD1 H 1 6.848 0.02 . 1 . . . . . . . . 7007 1 1238 . 1 1 116 116 TYR CE1 C 13 116.917 0.1 . 1 . . . . . . . . 7007 1 1239 . 1 1 116 116 TYR HE1 H 1 6.573 0.02 . 1 . . . . . . . . 7007 1 1240 . 1 1 116 116 TYR HE2 H 1 6.573 0.02 . 1 . . . . . . . . 7007 1 1241 . 1 1 116 116 TYR HD2 H 1 6.848 0.02 . 1 . . . . . . . . 7007 1 1242 . 1 1 116 116 TYR C C 13 175.117 0.1 . 1 . . . . . . . . 7007 1 1243 . 1 1 117 117 MET N N 15 126.163 0.1 . 1 . . . . . . . . 7007 1 1244 . 1 1 117 117 MET H H 1 9.774 0.02 . 1 . . . . . . . . 7007 1 1245 . 1 1 117 117 MET CA C 13 53.988 0.1 . 1 . . . . . . . . 7007 1 1246 . 1 1 117 117 MET HA H 1 5.242 0.02 . 1 . . . . . . . . 7007 1 1247 . 1 1 117 117 MET CB C 13 37.170 0.1 . 1 . . . . . . . . 7007 1 1248 . 1 1 117 117 MET HB3 H 1 2.158 0.02 . 2 . . . . . . . . 7007 1 1249 . 1 1 117 117 MET CG C 13 31.361 0.1 . 1 . . . . . . . . 7007 1 1250 . 1 1 117 117 MET HG2 H 1 2.687 0.02 . 2 . . . . . . . . 7007 1 1251 . 1 1 117 117 MET HG3 H 1 2.939 0.02 . 2 . . . . . . . . 7007 1 1252 . 1 1 117 117 MET HE1 H 1 2.117 0.02 . 1 . . . . . . . . 7007 1 1253 . 1 1 117 117 MET HE2 H 1 2.117 0.02 . 1 . . . . . . . . 7007 1 1254 . 1 1 117 117 MET HE3 H 1 2.117 0.02 . 1 . . . . . . . . 7007 1 1255 . 1 1 117 117 MET CE C 13 17.937 0.1 . 1 . . . . . . . . 7007 1 1256 . 1 1 117 117 MET C C 13 174.577 0.1 . 1 . . . . . . . . 7007 1 1257 . 1 1 118 118 TRP N N 15 128.349 0.1 . 1 . . . . . . . . 7007 1 1258 . 1 1 118 118 TRP H H 1 8.795 0.02 . 1 . . . . . . . . 7007 1 1259 . 1 1 118 118 TRP CA C 13 57.405 0.1 . 1 . . . . . . . . 7007 1 1260 . 1 1 118 118 TRP HA H 1 4.754 0.02 . 1 . . . . . . . . 7007 1 1261 . 1 1 118 118 TRP CB C 13 33.451 0.1 . 1 . . . . . . . . 7007 1 1262 . 1 1 118 118 TRP HB2 H 1 2.962 0.02 . 2 . . . . . . . . 7007 1 1263 . 1 1 118 118 TRP HB3 H 1 3.334 0.02 . 2 . . . . . . . . 7007 1 1264 . 1 1 118 118 TRP CD1 C 13 128.574 0.1 . 1 . . . . . . . . 7007 1 1265 . 1 1 118 118 TRP CE3 C 13 119.545 0.1 . 1 . . . . . . . . 7007 1 1266 . 1 1 118 118 TRP NE1 N 15 130.452 0.1 . 1 . . . . . . . . 7007 1 1267 . 1 1 118 118 TRP HD1 H 1 7.519 0.02 . 1 . . . . . . . . 7007 1 1268 . 1 1 118 118 TRP HE3 H 1 6.994 0.02 . 1 . . . . . . . . 7007 1 1269 . 1 1 118 118 TRP CZ3 C 13 123.099 0.1 . 1 . . . . . . . . 7007 1 1270 . 1 1 118 118 TRP CZ2 C 13 115.035 0.1 . 1 . . . . . . . . 7007 1 1271 . 1 1 118 118 TRP HE1 H 1 11.209 0.02 . 1 . . . . . . . . 7007 1 1272 . 1 1 118 118 TRP HZ3 H 1 6.488 0.02 . 1 . . . . . . . . 7007 1 1273 . 1 1 118 118 TRP CH2 C 13 125.733 0.1 . 1 . . . . . . . . 7007 1 1274 . 1 1 118 118 TRP HZ2 H 1 7.300 0.02 . 1 . . . . . . . . 7007 1 1275 . 1 1 118 118 TRP HH2 H 1 6.981 0.02 . 1 . . . . . . . . 7007 1 1276 . 1 1 118 118 TRP C C 13 177.074 0.1 . 1 . . . . . . . . 7007 1 1277 . 1 1 119 119 ILE N N 15 125.303 0.1 . 1 . . . . . . . . 7007 1 1278 . 1 1 119 119 ILE H H 1 7.606 0.02 . 1 . . . . . . . . 7007 1 1279 . 1 1 119 119 ILE CA C 13 65.150 0.1 . 1 . . . . . . . . 7007 1 1280 . 1 1 119 119 ILE HA H 1 3.674 0.02 . 1 . . . . . . . . 7007 1 1281 . 1 1 119 119 ILE CB C 13 38.630 0.1 . 1 . . . . . . . . 7007 1 1282 . 1 1 119 119 ILE HB H 1 1.281 0.02 . 1 . . . . . . . . 7007 1 1283 . 1 1 119 119 ILE HG21 H 1 0.731 0.02 . 1 . . . . . . . . 7007 1 1284 . 1 1 119 119 ILE HG22 H 1 0.731 0.02 . 1 . . . . . . . . 7007 1 1285 . 1 1 119 119 ILE HG23 H 1 0.731 0.02 . 1 . . . . . . . . 7007 1 1286 . 1 1 119 119 ILE CG2 C 13 17.290 0.1 . 1 . . . . . . . . 7007 1 1287 . 1 1 119 119 ILE CG1 C 13 30.537 0.1 . 1 . . . . . . . . 7007 1 1288 . 1 1 119 119 ILE HG12 H 1 1.336 0.02 . 2 . . . . . . . . 7007 1 1289 . 1 1 119 119 ILE HG13 H 1 0.830 0.02 . 2 . . . . . . . . 7007 1 1290 . 1 1 119 119 ILE HD11 H 1 0.672 0.02 . 1 . . . . . . . . 7007 1 1291 . 1 1 119 119 ILE HD12 H 1 0.672 0.02 . 1 . . . . . . . . 7007 1 1292 . 1 1 119 119 ILE HD13 H 1 0.672 0.02 . 1 . . . . . . . . 7007 1 1293 . 1 1 119 119 ILE CD1 C 13 14.053 0.1 . 1 . . . . . . . . 7007 1 1294 . 1 1 119 119 ILE C C 13 177.060 0.1 . 1 . . . . . . . . 7007 1 1295 . 1 1 120 120 ASN N N 15 115.918 0.1 . 1 . . . . . . . . 7007 1 1296 . 1 1 120 120 ASN H H 1 7.282 0.02 . 1 . . . . . . . . 7007 1 1297 . 1 1 120 120 ASN CA C 13 52.038 0.1 . 1 . . . . . . . . 7007 1 1298 . 1 1 120 120 ASN HA H 1 4.758 0.02 . 1 . . . . . . . . 7007 1 1299 . 1 1 120 120 ASN CB C 13 37.487 0.1 . 1 . . . . . . . . 7007 1 1300 . 1 1 120 120 ASN HB2 H 1 2.546 0.02 . 2 . . . . . . . . 7007 1 1301 . 1 1 120 120 ASN HB3 H 1 3.016 0.02 . 2 . . . . . . . . 7007 1 1302 . 1 1 120 120 ASN ND2 N 15 110.284 0.1 . 1 . . . . . . . . 7007 1 1303 . 1 1 120 120 ASN HD21 H 1 7.065 0.02 . 2 . . . . . . . . 7007 1 1304 . 1 1 120 120 ASN HD22 H 1 7.722 0.02 . 2 . . . . . . . . 7007 1 1305 . 1 1 120 120 ASN C C 13 175.408 0.1 . 1 . . . . . . . . 7007 1 1306 . 1 1 121 121 LYS N N 15 123.276 0.1 . 1 . . . . . . . . 7007 1 1307 . 1 1 121 121 LYS H H 1 8.249 0.02 . 1 . . . . . . . . 7007 1 1308 . 1 1 121 121 LYS CA C 13 58.208 0.1 . 1 . . . . . . . . 7007 1 1309 . 1 1 121 121 LYS HA H 1 4.112 0.02 . 1 . . . . . . . . 7007 1 1310 . 1 1 121 121 LYS CB C 13 31.705 0.1 . 1 . . . . . . . . 7007 1 1311 . 1 1 121 121 LYS HB2 H 1 1.875 0.02 . 2 . . . . . . . . 7007 1 1312 . 1 1 121 121 LYS HB3 H 1 2.065 0.02 . 2 . . . . . . . . 7007 1 1313 . 1 1 121 121 LYS CG C 13 25.035 0.1 . 1 . . . . . . . . 7007 1 1314 . 1 1 121 121 LYS HG3 H 1 1.665 0.02 . 2 . . . . . . . . 7007 1 1315 . 1 1 121 121 LYS CD C 13 29.031 0.1 . 1 . . . . . . . . 7007 1 1316 . 1 1 121 121 LYS HD3 H 1 1.833 0.02 . 2 . . . . . . . . 7007 1 1317 . 1 1 121 121 LYS CE C 13 42.560 0.1 . 1 . . . . . . . . 7007 1 1318 . 1 1 121 121 LYS HE2 H 1 3.160 0.02 . 2 . . . . . . . . 7007 1 1319 . 1 1 121 121 LYS HE3 H 1 3.227 0.02 . 2 . . . . . . . . 7007 1 1320 . 1 1 121 121 LYS C C 13 175.510 0.1 . 1 . . . . . . . . 7007 1 1321 . 1 1 122 122 ALA N N 15 120.916 0.1 . 1 . . . . . . . . 7007 1 1322 . 1 1 122 122 ALA H H 1 7.858 0.02 . 1 . . . . . . . . 7007 1 1323 . 1 1 122 122 ALA CA C 13 50.802 0.1 . 1 . . . . . . . . 7007 1 1324 . 1 1 122 122 ALA HA H 1 4.580 0.02 . 1 . . . . . . . . 7007 1 1325 . 1 1 122 122 ALA HB1 H 1 1.367 0.02 . 1 . . . . . . . . 7007 1 1326 . 1 1 122 122 ALA HB2 H 1 1.367 0.02 . 1 . . . . . . . . 7007 1 1327 . 1 1 122 122 ALA HB3 H 1 1.367 0.02 . 1 . . . . . . . . 7007 1 1328 . 1 1 122 122 ALA CB C 13 19.169 0.1 . 1 . . . . . . . . 7007 1 1329 . 1 1 122 122 ALA C C 13 176.848 0.1 . 1 . . . . . . . . 7007 1 1330 . 1 1 123 123 ASP N N 15 122.303 0.1 . 1 . . . . . . . . 7007 1 1331 . 1 1 123 123 ASP H H 1 7.166 0.02 . 1 . . . . . . . . 7007 1 1332 . 1 1 123 123 ASP CA C 13 53.197 0.1 . 1 . . . . . . . . 7007 1 1333 . 1 1 123 123 ASP HA H 1 4.523 0.02 . 1 . . . . . . . . 7007 1 1334 . 1 1 123 123 ASP CB C 13 42.838 0.1 . 1 . . . . . . . . 7007 1 1335 . 1 1 123 123 ASP HB3 H 1 3.097 0.02 . 2 . . . . . . . . 7007 1 1336 . 1 1 123 123 ASP C C 13 176.298 0.1 . 1 . . . . . . . . 7007 1 1337 . 1 1 124 124 PRO CD C 13 51.578 0.1 . 1 . . . . . . . . 7007 1 1338 . 1 1 124 124 PRO CA C 13 64.280 0.1 . 1 . . . . . . . . 7007 1 1339 . 1 1 124 124 PRO HA H 1 4.475 0.02 . 1 . . . . . . . . 7007 1 1340 . 1 1 124 124 PRO CB C 13 32.230 0.1 . 1 . . . . . . . . 7007 1 1341 . 1 1 124 124 PRO HB2 H 1 2.071 0.02 . 2 . . . . . . . . 7007 1 1342 . 1 1 124 124 PRO HB3 H 1 2.319 0.02 . 2 . . . . . . . . 7007 1 1343 . 1 1 124 124 PRO CG C 13 27.320 0.1 . 1 . . . . . . . . 7007 1 1344 . 1 1 124 124 PRO HG3 H 1 2.051 0.02 . 2 . . . . . . . . 7007 1 1345 . 1 1 124 124 PRO HD3 H 1 4.030 0.02 . 2 . . . . . . . . 7007 1 1346 . 1 1 124 124 PRO C C 13 177.232 0.1 . 1 . . . . . . . . 7007 1 1347 . 1 1 125 125 ASP N N 15 118.949 0.1 . 1 . . . . . . . . 7007 1 1348 . 1 1 125 125 ASP H H 1 8.811 0.02 . 1 . . . . . . . . 7007 1 1349 . 1 1 125 125 ASP CA C 13 55.364 0.1 . 1 . . . . . . . . 7007 1 1350 . 1 1 125 125 ASP HA H 1 4.528 0.02 . 1 . . . . . . . . 7007 1 1351 . 1 1 125 125 ASP CB C 13 40.977 0.1 . 1 . . . . . . . . 7007 1 1352 . 1 1 125 125 ASP HB2 H 1 2.687 0.02 . 2 . . . . . . . . 7007 1 1353 . 1 1 125 125 ASP HB3 H 1 2.840 0.02 . 2 . . . . . . . . 7007 1 1354 . 1 1 125 125 ASP C C 13 176.714 0.1 . 1 . . . . . . . . 7007 1 1355 . 1 1 126 126 MET N N 15 120.095 0.1 . 1 . . . . . . . . 7007 1 1356 . 1 1 126 126 MET H H 1 7.303 0.02 . 1 . . . . . . . . 7007 1 1357 . 1 1 126 126 MET CA C 13 55.980 0.1 . 1 . . . . . . . . 7007 1 1358 . 1 1 126 126 MET HA H 1 4.747 0.02 . 1 . . . . . . . . 7007 1 1359 . 1 1 126 126 MET CB C 13 33.775 0.1 . 1 . . . . . . . . 7007 1 1360 . 1 1 126 126 MET HB2 H 1 1.321 0.02 . 2 . . . . . . . . 7007 1 1361 . 1 1 126 126 MET HB3 H 1 1.639 0.02 . 2 . . . . . . . . 7007 1 1362 . 1 1 126 126 MET CG C 13 31.832 0.1 . 1 . . . . . . . . 7007 1 1363 . 1 1 126 126 MET HG2 H 1 1.696 0.02 . 2 . . . . . . . . 7007 1 1364 . 1 1 126 126 MET HG3 H 1 2.032 0.02 . 2 . . . . . . . . 7007 1 1365 . 1 1 126 126 MET HE1 H 1 1.915 0.02 . 1 . . . . . . . . 7007 1 1366 . 1 1 126 126 MET HE2 H 1 1.915 0.02 . 1 . . . . . . . . 7007 1 1367 . 1 1 126 126 MET HE3 H 1 1.915 0.02 . 1 . . . . . . . . 7007 1 1368 . 1 1 126 126 MET CE C 13 16.990 0.1 . 1 . . . . . . . . 7007 1 1369 . 1 1 126 126 MET C C 13 175.435 0.1 . 1 . . . . . . . . 7007 1 1370 . 1 1 127 127 PHE H H 1 7.142 0.02 . 1 . . . . . . . . 7007 1 1371 . 1 1 127 127 PHE CA C 13 58.010 0.1 . 1 . . . . . . . . 7007 1 1372 . 1 1 127 127 PHE HA H 1 4.740 0.02 . 1 . . . . . . . . 7007 1 1373 . 1 1 127 127 PHE CB C 13 41.167 0.1 . 1 . . . . . . . . 7007 1 1374 . 1 1 127 127 PHE HB3 H 1 3.069 0.02 . 2 . . . . . . . . 7007 1 1375 . 1 1 127 127 PHE CD1 C 13 132.309 0.1 . 1 . . . . . . . . 7007 1 1376 . 1 1 127 127 PHE HD1 H 1 7.166 0.02 . 1 . . . . . . . . 7007 1 1377 . 1 1 127 127 PHE HD2 H 1 7.166 0.02 . 1 . . . . . . . . 7007 1 1378 . 1 1 127 127 PHE C C 13 174.074 0.1 . 1 . . . . . . . . 7007 1 1379 . 1 1 128 128 GLY N N 15 108.957 0.1 . 1 . . . . . . . . 7007 1 1380 . 1 1 128 128 GLY H H 1 8.602 0.02 . 1 . . . . . . . . 7007 1 1381 . 1 1 128 128 GLY CA C 13 45.104 0.1 . 1 . . . . . . . . 7007 1 1382 . 1 1 128 128 GLY HA2 H 1 3.931 0.02 . 1 . . . . . . . . 7007 1 1383 . 1 1 128 128 GLY HA3 H 1 3.931 0.02 . 1 . . . . . . . . 7007 1 1384 . 1 1 128 128 GLY C C 13 172.725 0.1 . 1 . . . . . . . . 7007 1 1385 . 1 1 129 129 GLU N N 15 118.259 0.1 . 1 . . . . . . . . 7007 1 1386 . 1 1 129 129 GLU H H 1 8.189 0.02 . 1 . . . . . . . . 7007 1 1387 . 1 1 129 129 GLU CA C 13 55.960 0.1 . 1 . . . . . . . . 7007 1 1388 . 1 1 129 129 GLU HA H 1 4.622 0.02 . 1 . . . . . . . . 7007 1 1389 . 1 1 129 129 GLU CB C 13 32.027 0.1 . 1 . . . . . . . . 7007 1 1390 . 1 1 129 129 GLU HB3 H 1 2.026 0.02 . 2 . . . . . . . . 7007 1 1391 . 1 1 129 129 GLU CG C 13 36.559 0.1 . 1 . . . . . . . . 7007 1 1392 . 1 1 129 129 GLU HG3 H 1 2.338 0.02 . 2 . . . . . . . . 7007 1 1393 . 1 1 129 129 GLU C C 13 175.862 0.1 . 1 . . . . . . . . 7007 1 1394 . 1 1 130 130 TRP N N 15 127.210 0.1 . 1 . . . . . . . . 7007 1 1395 . 1 1 130 130 TRP H H 1 9.306 0.02 . 1 . . . . . . . . 7007 1 1396 . 1 1 130 130 TRP CA C 13 58.836 0.1 . 1 . . . . . . . . 7007 1 1397 . 1 1 130 130 TRP HA H 1 4.587 0.02 . 1 . . . . . . . . 7007 1 1398 . 1 1 130 130 TRP CB C 13 31.509 0.1 . 1 . . . . . . . . 7007 1 1399 . 1 1 130 130 TRP HB2 H 1 2.722 0.02 . 2 . . . . . . . . 7007 1 1400 . 1 1 130 130 TRP HB3 H 1 3.086 0.02 . 2 . . . . . . . . 7007 1 1401 . 1 1 130 130 TRP CD1 C 13 128.001 0.1 . 1 . . . . . . . . 7007 1 1402 . 1 1 130 130 TRP NE1 N 15 131.115 0.1 . 1 . . . . . . . . 7007 1 1403 . 1 1 130 130 TRP HD1 H 1 7.228 0.02 . 1 . . . . . . . . 7007 1 1404 . 1 1 130 130 TRP CZ3 C 13 123.033 0.1 . 1 . . . . . . . . 7007 1 1405 . 1 1 130 130 TRP CZ2 C 13 114.834 0.1 . 1 . . . . . . . . 7007 1 1406 . 1 1 130 130 TRP HE1 H 1 10.332 0.02 . 1 . . . . . . . . 7007 1 1407 . 1 1 130 130 TRP HZ3 H 1 6.374 0.02 . 1 . . . . . . . . 7007 1 1408 . 1 1 130 130 TRP HZ2 H 1 6.863 0.02 . 1 . . . . . . . . 7007 1 1409 . 1 1 130 130 TRP HH2 H 1 6.384 0.02 . 1 . . . . . . . . 7007 1 1410 . 1 1 130 130 TRP C C 13 174.077 0.1 . 1 . . . . . . . . 7007 1 1411 . 1 1 131 131 ASN N N 15 125.433 0.1 . 1 . . . . . . . . 7007 1 1412 . 1 1 131 131 ASN H H 1 7.874 0.02 . 1 . . . . . . . . 7007 1 1413 . 1 1 131 131 ASN HB2 H 1 2.632 0.02 . 2 . . . . . . . . 7007 1 1414 . 1 1 131 131 ASN HB3 H 1 2.744 0.02 . 2 . . . . . . . . 7007 1 1415 . 1 1 131 131 ASN ND2 N 15 113.764 0.1 . 1 . . . . . . . . 7007 1 1416 . 1 1 131 131 ASN HD21 H 1 7.127 0.02 . 2 . . . . . . . . 7007 1 1417 . 1 1 131 131 ASN HD22 H 1 7.775 0.02 . 2 . . . . . . . . 7007 1 1418 . 1 1 132 132 PHE H H 1 6.924 0.02 . 1 . . . . . . . . 7007 1 1419 . 1 1 132 132 PHE CA C 13 60.320 0.1 . 1 . . . . . . . . 7007 1 1420 . 1 1 132 132 PHE HA H 1 3.707 0.02 . 1 . . . . . . . . 7007 1 1421 . 1 1 132 132 PHE CB C 13 40.088 0.1 . 1 . . . . . . . . 7007 1 1422 . 1 1 132 132 PHE HB2 H 1 3.127 0.02 . 2 . . . . . . . . 7007 1 1423 . 1 1 132 132 PHE HB3 H 1 3.386 0.02 . 2 . . . . . . . . 7007 1 1424 . 1 1 132 132 PHE CD1 C 13 131.856 0.1 . 1 . . . . . . . . 7007 1 1425 . 1 1 132 132 PHE HD1 H 1 7.345 0.02 . 1 . . . . . . . . 7007 1 1426 . 1 1 132 132 PHE HD2 H 1 7.345 0.02 . 1 . . . . . . . . 7007 1 1427 . 1 1 132 132 PHE C C 13 176.258 0.1 . 1 . . . . . . . . 7007 1 1428 . 1 1 133 133 GLU N N 15 118.928 0.1 . 1 . . . . . . . . 7007 1 1429 . 1 1 133 133 GLU H H 1 8.326 0.02 . 1 . . . . . . . . 7007 1 1430 . 1 1 133 133 GLU CA C 13 60.357 0.1 . 1 . . . . . . . . 7007 1 1431 . 1 1 133 133 GLU HA H 1 3.738 0.02 . 1 . . . . . . . . 7007 1 1432 . 1 1 133 133 GLU CB C 13 28.595 0.1 . 1 . . . . . . . . 7007 1 1433 . 1 1 133 133 GLU HB2 H 1 2.179 0.02 . 2 . . . . . . . . 7007 1 1434 . 1 1 133 133 GLU HB3 H 1 2.050 0.02 . 2 . . . . . . . . 7007 1 1435 . 1 1 133 133 GLU CG C 13 36.868 0.1 . 1 . . . . . . . . 7007 1 1436 . 1 1 133 133 GLU HG2 H 1 2.420 0.02 . 2 . . . . . . . . 7007 1 1437 . 1 1 133 133 GLU HG3 H 1 2.443 0.02 . 2 . . . . . . . . 7007 1 1438 . 1 1 133 133 GLU C C 13 179.659 0.1 . 1 . . . . . . . . 7007 1 1439 . 1 1 134 134 GLU N N 15 121.273 0.1 . 1 . . . . . . . . 7007 1 1440 . 1 1 134 134 GLU H H 1 7.958 0.02 . 1 . . . . . . . . 7007 1 1441 . 1 1 134 134 GLU CA C 13 59.023 0.1 . 1 . . . . . . . . 7007 1 1442 . 1 1 134 134 GLU HA H 1 3.929 0.02 . 1 . . . . . . . . 7007 1 1443 . 1 1 134 134 GLU CB C 13 30.383 0.1 . 1 . . . . . . . . 7007 1 1444 . 1 1 134 134 GLU HB3 H 1 1.897 0.02 . 2 . . . . . . . . 7007 1 1445 . 1 1 134 134 GLU CG C 13 36.688 0.1 . 1 . . . . . . . . 7007 1 1446 . 1 1 134 134 GLU HG2 H 1 2.048 0.02 . 2 . . . . . . . . 7007 1 1447 . 1 1 134 134 GLU HG3 H 1 2.161 0.02 . 2 . . . . . . . . 7007 1 1448 . 1 1 134 134 GLU C C 13 177.527 0.1 . 1 . . . . . . . . 7007 1 1449 . 1 1 135 135 TRP N N 15 120.291 0.1 . 1 . . . . . . . . 7007 1 1450 . 1 1 135 135 TRP H H 1 7.631 0.02 . 1 . . . . . . . . 7007 1 1451 . 1 1 135 135 TRP CA C 13 62.908 0.1 . 1 . . . . . . . . 7007 1 1452 . 1 1 135 135 TRP HA H 1 3.908 0.02 . 1 . . . . . . . . 7007 1 1453 . 1 1 135 135 TRP CB C 13 28.272 0.1 . 1 . . . . . . . . 7007 1 1454 . 1 1 135 135 TRP HB2 H 1 2.874 0.02 . 2 . . . . . . . . 7007 1 1455 . 1 1 135 135 TRP HB3 H 1 3.224 0.02 . 2 . . . . . . . . 7007 1 1456 . 1 1 135 135 TRP CD1 C 13 126.927 0.1 . 1 . . . . . . . . 7007 1 1457 . 1 1 135 135 TRP CE3 C 13 119.042 0.1 . 1 . . . . . . . . 7007 1 1458 . 1 1 135 135 TRP HD1 H 1 7.307 0.02 . 1 . . . . . . . . 7007 1 1459 . 1 1 135 135 TRP HE3 H 1 7.082 0.02 . 1 . . . . . . . . 7007 1 1460 . 1 1 135 135 TRP CZ2 C 13 113.194 0.1 . 1 . . . . . . . . 7007 1 1461 . 1 1 135 135 TRP CH2 C 13 123.630 0.1 . 1 . . . . . . . . 7007 1 1462 . 1 1 135 135 TRP HZ2 H 1 6.864 0.02 . 1 . . . . . . . . 7007 1 1463 . 1 1 135 135 TRP HH2 H 1 7.001 0.02 . 1 . . . . . . . . 7007 1 1464 . 1 1 135 135 TRP C C 13 178.130 0.1 . 1 . . . . . . . . 7007 1 1465 . 1 1 136 136 LYS N N 15 119.386 0.1 . 1 . . . . . . . . 7007 1 1466 . 1 1 136 136 LYS H H 1 8.391 0.02 . 1 . . . . . . . . 7007 1 1467 . 1 1 136 136 LYS CB C 13 32.579 0.1 . 1 . . . . . . . . 7007 1 1468 . 1 1 136 136 LYS HB3 H 1 1.578 0.02 . 2 . . . . . . . . 7007 1 1469 . 1 1 136 136 LYS HG3 H 1 1.213 0.02 . 2 . . . . . . . . 7007 1 1470 . 1 1 136 136 LYS CE C 13 41.771 0.1 . 1 . . . . . . . . 7007 1 1471 . 1 1 136 136 LYS HE3 H 1 2.693 0.02 . 2 . . . . . . . . 7007 1 1472 . 1 1 136 136 LYS C C 13 178.036 0.1 . 1 . . . . . . . . 7007 1 1473 . 1 1 137 137 ARG N N 15 117.342 0.1 . 1 . . . . . . . . 7007 1 1474 . 1 1 137 137 ARG H H 1 7.475 0.02 . 1 . . . . . . . . 7007 1 1475 . 1 1 137 137 ARG CA C 13 59.215 0.1 . 1 . . . . . . . . 7007 1 1476 . 1 1 137 137 ARG HA H 1 3.890 0.02 . 1 . . . . . . . . 7007 1 1477 . 1 1 137 137 ARG CB C 13 31.651 0.1 . 1 . . . . . . . . 7007 1 1478 . 1 1 137 137 ARG HB3 H 1 1.759 0.02 . 2 . . . . . . . . 7007 1 1479 . 1 1 137 137 ARG CG C 13 28.038 0.1 . 1 . . . . . . . . 7007 1 1480 . 1 1 137 137 ARG HG2 H 1 1.593 0.02 . 2 . . . . . . . . 7007 1 1481 . 1 1 137 137 ARG HG3 H 1 1.430 0.02 . 2 . . . . . . . . 7007 1 1482 . 1 1 137 137 ARG CD C 13 43.486 0.1 . 1 . . . . . . . . 7007 1 1483 . 1 1 137 137 ARG HD2 H 1 3.120 0.02 . 2 . . . . . . . . 7007 1 1484 . 1 1 137 137 ARG HD3 H 1 3.211 0.02 . 2 . . . . . . . . 7007 1 1485 . 1 1 137 137 ARG C C 13 177.974 0.1 . 1 . . . . . . . . 7007 1 1486 . 1 1 138 138 LEU N N 15 115.043 0.1 . 1 . . . . . . . . 7007 1 1487 . 1 1 138 138 LEU H H 1 7.751 0.02 . 1 . . . . . . . . 7007 1 1488 . 1 1 138 138 LEU CA C 13 56.723 0.1 . 1 . . . . . . . . 7007 1 1489 . 1 1 138 138 LEU HA H 1 4.103 0.02 . 1 . . . . . . . . 7007 1 1490 . 1 1 138 138 LEU CB C 13 42.984 0.1 . 1 . . . . . . . . 7007 1 1491 . 1 1 138 138 LEU HB2 H 1 0.894 0.02 . 2 . . . . . . . . 7007 1 1492 . 1 1 138 138 LEU HB3 H 1 0.405 0.02 . 2 . . . . . . . . 7007 1 1493 . 1 1 138 138 LEU CG C 13 26.977 0.1 . 1 . . . . . . . . 7007 1 1494 . 1 1 138 138 LEU HG H 1 1.395 0.02 . 1 . . . . . . . . 7007 1 1495 . 1 1 138 138 LEU HD11 H 1 0.683 0.02 . 2 . . . . . . . . 7007 1 1496 . 1 1 138 138 LEU HD12 H 1 0.683 0.02 . 2 . . . . . . . . 7007 1 1497 . 1 1 138 138 LEU HD13 H 1 0.683 0.02 . 2 . . . . . . . . 7007 1 1498 . 1 1 138 138 LEU HD21 H 1 0.733 0.02 . 2 . . . . . . . . 7007 1 1499 . 1 1 138 138 LEU HD22 H 1 0.733 0.02 . 2 . . . . . . . . 7007 1 1500 . 1 1 138 138 LEU HD23 H 1 0.733 0.02 . 2 . . . . . . . . 7007 1 1501 . 1 1 138 138 LEU CD1 C 13 22.302 0.1 . 1 . . . . . . . . 7007 1 1502 . 1 1 138 138 LEU CD2 C 13 25.682 0.1 . 1 . . . . . . . . 7007 1 1503 . 1 1 138 138 LEU C C 13 179.280 0.1 . 1 . . . . . . . . 7007 1 1504 . 1 1 139 139 HIS N N 15 115.622 0.1 . 1 . . . . . . . . 7007 1 1505 . 1 1 139 139 HIS H H 1 8.025 0.02 . 1 . . . . . . . . 7007 1 1506 . 1 1 139 139 HIS CA C 13 56.750 0.1 . 1 . . . . . . . . 7007 1 1507 . 1 1 139 139 HIS HA H 1 5.009 0.02 . 1 . . . . . . . . 7007 1 1508 . 1 1 139 139 HIS CB C 13 34.174 0.1 . 1 . . . . . . . . 7007 1 1509 . 1 1 139 139 HIS HB2 H 1 2.261 0.02 . 2 . . . . . . . . 7007 1 1510 . 1 1 139 139 HIS HB3 H 1 3.187 0.02 . 2 . . . . . . . . 7007 1 1511 . 1 1 139 139 HIS C C 13 175.926 0.1 . 1 . . . . . . . . 7007 1 1512 . 1 1 140 140 LYS N N 15 122.165 0.1 . 1 . . . . . . . . 7007 1 1513 . 1 1 140 140 LYS H H 1 6.613 0.02 . 1 . . . . . . . . 7007 1 1514 . 1 1 140 140 LYS CA C 13 60.642 0.1 . 1 . . . . . . . . 7007 1 1515 . 1 1 140 140 LYS HA H 1 3.304 0.02 . 1 . . . . . . . . 7007 1 1516 . 1 1 140 140 LYS CB C 13 33.127 0.1 . 1 . . . . . . . . 7007 1 1517 . 1 1 140 140 LYS HB3 H 1 1.590 0.02 . 2 . . . . . . . . 7007 1 1518 . 1 1 140 140 LYS HG3 H 1 1.425 0.02 . 2 . . . . . . . . 7007 1 1519 . 1 1 140 140 LYS HD3 H 1 1.972 0.02 . 2 . . . . . . . . 7007 1 1520 . 1 1 140 140 LYS HE3 H 1 2.992 0.02 . 2 . . . . . . . . 7007 1 1521 . 1 1 140 140 LYS C C 13 176.857 0.1 . 1 . . . . . . . . 7007 1 1522 . 1 1 141 141 LYS N N 15 117.989 0.1 . 1 . . . . . . . . 7007 1 1523 . 1 1 141 141 LYS H H 1 8.179 0.02 . 1 . . . . . . . . 7007 1 1524 . 1 1 141 141 LYS CA C 13 60.751 0.1 . 1 . . . . . . . . 7007 1 1525 . 1 1 141 141 LYS HA H 1 3.907 0.02 . 1 . . . . . . . . 7007 1 1526 . 1 1 141 141 LYS CB C 13 32.217 0.1 . 1 . . . . . . . . 7007 1 1527 . 1 1 141 141 LYS HB3 H 1 1.768 0.02 . 2 . . . . . . . . 7007 1 1528 . 1 1 141 141 LYS CG C 13 25.483 0.1 . 1 . . . . . . . . 7007 1 1529 . 1 1 141 141 LYS HG3 H 1 1.337 0.02 . 2 . . . . . . . . 7007 1 1530 . 1 1 141 141 LYS CD C 13 29.691 0.1 . 1 . . . . . . . . 7007 1 1531 . 1 1 141 141 LYS HD2 H 1 1.644 0.02 . 2 . . . . . . . . 7007 1 1532 . 1 1 141 141 LYS HD3 H 1 1.686 0.02 . 2 . . . . . . . . 7007 1 1533 . 1 1 141 141 LYS CE C 13 42.467 0.1 . 1 . . . . . . . . 7007 1 1534 . 1 1 141 141 LYS HE3 H 1 2.997 0.02 . 2 . . . . . . . . 7007 1 1535 . 1 1 141 141 LYS C C 13 179.005 0.1 . 1 . . . . . . . . 7007 1 1536 . 1 1 142 142 LYS N N 15 119.210 0.1 . 1 . . . . . . . . 7007 1 1537 . 1 1 142 142 LYS H H 1 7.951 0.02 . 1 . . . . . . . . 7007 1 1538 . 1 1 142 142 LYS CA C 13 58.798 0.1 . 1 . . . . . . . . 7007 1 1539 . 1 1 142 142 LYS HA H 1 4.218 0.02 . 1 . . . . . . . . 7007 1 1540 . 1 1 142 142 LYS CB C 13 32.294 0.1 . 1 . . . . . . . . 7007 1 1541 . 1 1 142 142 LYS HB3 H 1 2.058 0.02 . 2 . . . . . . . . 7007 1 1542 . 1 1 142 142 LYS CG C 13 25.043 0.1 . 1 . . . . . . . . 7007 1 1543 . 1 1 142 142 LYS HG3 H 1 1.524 0.02 . 2 . . . . . . . . 7007 1 1544 . 1 1 142 142 LYS CE C 13 42.498 0.1 . 1 . . . . . . . . 7007 1 1545 . 1 1 142 142 LYS HE3 H 1 3.046 0.02 . 2 . . . . . . . . 7007 1 1546 . 1 1 142 142 LYS C C 13 179.693 0.1 . 1 . . . . . . . . 7007 1 1547 . 1 1 143 143 PHE N N 15 122.602 0.1 . 1 . . . . . . . . 7007 1 1548 . 1 1 143 143 PHE H H 1 8.643 0.02 . 1 . . . . . . . . 7007 1 1549 . 1 1 143 143 PHE CA C 13 62.908 0.1 . 1 . . . . . . . . 7007 1 1550 . 1 1 143 143 PHE HA H 1 4.107 0.02 . 1 . . . . . . . . 7007 1 1551 . 1 1 143 143 PHE CB C 13 39.419 0.1 . 1 . . . . . . . . 7007 1 1552 . 1 1 143 143 PHE HB2 H 1 3.089 0.02 . 2 . . . . . . . . 7007 1 1553 . 1 1 143 143 PHE HB3 H 1 3.718 0.02 . 2 . . . . . . . . 7007 1 1554 . 1 1 143 143 PHE CD1 C 13 132.405 0.1 . 1 . . . . . . . . 7007 1 1555 . 1 1 143 143 PHE HD1 H 1 7.654 0.02 . 1 . . . . . . . . 7007 1 1556 . 1 1 143 143 PHE HD2 H 1 7.654 0.02 . 1 . . . . . . . . 7007 1 1557 . 1 1 143 143 PHE C C 13 177.195 0.1 . 1 . . . . . . . . 7007 1 1558 . 1 1 144 144 ILE N N 15 119.207 0.1 . 1 . . . . . . . . 7007 1 1559 . 1 1 144 144 ILE H H 1 8.740 0.02 . 1 . . . . . . . . 7007 1 1560 . 1 1 144 144 ILE CA C 13 66.880 0.1 . 1 . . . . . . . . 7007 1 1561 . 1 1 144 144 ILE HA H 1 3.682 0.02 . 1 . . . . . . . . 7007 1 1562 . 1 1 144 144 ILE CB C 13 37.623 0.1 . 1 . . . . . . . . 7007 1 1563 . 1 1 144 144 ILE HB H 1 2.113 0.02 . 1 . . . . . . . . 7007 1 1564 . 1 1 144 144 ILE HG21 H 1 1.007 0.02 . 1 . . . . . . . . 7007 1 1565 . 1 1 144 144 ILE HG22 H 1 1.007 0.02 . 1 . . . . . . . . 7007 1 1566 . 1 1 144 144 ILE HG23 H 1 1.007 0.02 . 1 . . . . . . . . 7007 1 1567 . 1 1 144 144 ILE CG2 C 13 17.290 0.1 . 1 . . . . . . . . 7007 1 1568 . 1 1 144 144 ILE CG1 C 13 31.185 0.1 . 1 . . . . . . . . 7007 1 1569 . 1 1 144 144 ILE HG12 H 1 1.223 0.02 . 2 . . . . . . . . 7007 1 1570 . 1 1 144 144 ILE HG13 H 1 2.005 0.02 . 2 . . . . . . . . 7007 1 1571 . 1 1 144 144 ILE HD11 H 1 0.903 0.02 . 1 . . . . . . . . 7007 1 1572 . 1 1 144 144 ILE HD12 H 1 0.903 0.02 . 1 . . . . . . . . 7007 1 1573 . 1 1 144 144 ILE HD13 H 1 0.903 0.02 . 1 . . . . . . . . 7007 1 1574 . 1 1 144 144 ILE CD1 C 13 14.053 0.1 . 1 . . . . . . . . 7007 1 1575 . 1 1 144 144 ILE C C 13 177.619 0.1 . 1 . . . . . . . . 7007 1 1576 . 1 1 145 145 GLU N N 15 118.181 0.1 . 1 . . . . . . . . 7007 1 1577 . 1 1 145 145 GLU H H 1 8.063 0.02 . 1 . . . . . . . . 7007 1 1578 . 1 1 145 145 GLU CA C 13 60.005 0.1 . 1 . . . . . . . . 7007 1 1579 . 1 1 145 145 GLU HA H 1 4.018 0.02 . 1 . . . . . . . . 7007 1 1580 . 1 1 145 145 GLU CB C 13 29.700 0.1 . 1 . . . . . . . . 7007 1 1581 . 1 1 145 145 GLU HB3 H 1 2.143 0.02 . 2 . . . . . . . . 7007 1 1582 . 1 1 145 145 GLU CG C 13 36.591 0.1 . 1 . . . . . . . . 7007 1 1583 . 1 1 145 145 GLU HG2 H 1 2.332 0.02 . 2 . . . . . . . . 7007 1 1584 . 1 1 145 145 GLU HG3 H 1 2.490 0.02 . 2 . . . . . . . . 7007 1 1585 . 1 1 145 145 GLU C C 13 179.678 0.1 . 1 . . . . . . . . 7007 1 1586 . 1 1 146 146 THR N N 15 115.598 0.1 . 1 . . . . . . . . 7007 1 1587 . 1 1 146 146 THR H H 1 8.058 0.02 . 1 . . . . . . . . 7007 1 1588 . 1 1 146 146 THR CA C 13 66.650 0.1 . 1 . . . . . . . . 7007 1 1589 . 1 1 146 146 THR HA H 1 3.998 0.02 . 1 . . . . . . . . 7007 1 1590 . 1 1 146 146 THR CB C 13 69.358 0.1 . 1 . . . . . . . . 7007 1 1591 . 1 1 146 146 THR HB H 1 4.193 0.02 . 1 . . . . . . . . 7007 1 1592 . 1 1 146 146 THR HG21 H 1 1.192 0.02 . 1 . . . . . . . . 7007 1 1593 . 1 1 146 146 THR HG22 H 1 1.192 0.02 . 1 . . . . . . . . 7007 1 1594 . 1 1 146 146 THR HG23 H 1 1.192 0.02 . 1 . . . . . . . . 7007 1 1595 . 1 1 146 146 THR CG2 C 13 21.434 0.1 . 1 . . . . . . . . 7007 1 1596 . 1 1 146 146 THR C C 13 176.393 0.1 . 1 . . . . . . . . 7007 1 1597 . 1 1 147 147 PHE N N 15 122.988 0.1 . 1 . . . . . . . . 7007 1 1598 . 1 1 147 147 PHE H H 1 8.888 0.02 . 1 . . . . . . . . 7007 1 1599 . 1 1 147 147 PHE CA C 13 59.879 0.1 . 1 . . . . . . . . 7007 1 1600 . 1 1 147 147 PHE HA H 1 4.364 0.02 . 1 . . . . . . . . 7007 1 1601 . 1 1 147 147 PHE CB C 13 38.650 0.1 . 1 . . . . . . . . 7007 1 1602 . 1 1 147 147 PHE HB2 H 1 2.965 0.02 . 2 . . . . . . . . 7007 1 1603 . 1 1 147 147 PHE HB3 H 1 2.867 0.02 . 2 . . . . . . . . 7007 1 1604 . 1 1 147 147 PHE CD1 C 13 130.893 0.1 . 1 . . . . . . . . 7007 1 1605 . 1 1 147 147 PHE HD1 H 1 6.961 0.02 . 1 . . . . . . . . 7007 1 1606 . 1 1 147 147 PHE CE1 C 13 130.901 0.1 . 1 . . . . . . . . 7007 1 1607 . 1 1 147 147 PHE HE1 H 1 7.297 0.02 . 1 . . . . . . . . 7007 1 1608 . 1 1 147 147 PHE CZ C 13 130.171 0.1 . 1 . . . . . . . . 7007 1 1609 . 1 1 147 147 PHE HZ H 1 6.954 0.02 . 1 . . . . . . . . 7007 1 1610 . 1 1 147 147 PHE HE2 H 1 7.297 0.02 . 1 . . . . . . . . 7007 1 1611 . 1 1 147 147 PHE HD2 H 1 6.961 0.02 . 1 . . . . . . . . 7007 1 1612 . 1 1 147 147 PHE C C 13 177.939 0.1 . 1 . . . . . . . . 7007 1 1613 . 1 1 148 148 LYS N N 15 119.723 0.1 . 1 . . . . . . . . 7007 1 1614 . 1 1 148 148 LYS H H 1 8.681 0.02 . 1 . . . . . . . . 7007 1 1615 . 1 1 148 148 LYS CA C 13 60.471 0.1 . 1 . . . . . . . . 7007 1 1616 . 1 1 148 148 LYS HA H 1 3.852 0.02 . 1 . . . . . . . . 7007 1 1617 . 1 1 148 148 LYS CB C 13 32.807 0.1 . 1 . . . . . . . . 7007 1 1618 . 1 1 148 148 LYS HB3 H 1 1.908 0.02 . 2 . . . . . . . . 7007 1 1619 . 1 1 148 148 LYS CG C 13 26.488 0.1 . 1 . . . . . . . . 7007 1 1620 . 1 1 148 148 LYS HG3 H 1 1.495 0.02 . 2 . . . . . . . . 7007 1 1621 . 1 1 148 148 LYS CD C 13 30.172 0.1 . 1 . . . . . . . . 7007 1 1622 . 1 1 148 148 LYS HD3 H 1 1.706 0.02 . 2 . . . . . . . . 7007 1 1623 . 1 1 148 148 LYS CE C 13 42.346 0.1 . 1 . . . . . . . . 7007 1 1624 . 1 1 148 148 LYS HE3 H 1 3.013 0.02 . 2 . . . . . . . . 7007 1 1625 . 1 1 148 148 LYS C C 13 179.043 0.1 . 1 . . . . . . . . 7007 1 1626 . 1 1 149 149 LYS N N 15 118.844 0.1 . 1 . . . . . . . . 7007 1 1627 . 1 1 149 149 LYS H H 1 7.376 0.02 . 1 . . . . . . . . 7007 1 1628 . 1 1 149 149 LYS C C 13 179.372 0.1 . 1 . . . . . . . . 7007 1 1629 . 1 1 150 150 ILE N N 15 120.783 0.1 . 1 . . . . . . . . 7007 1 1630 . 1 1 150 150 ILE H H 1 7.971 0.02 . 1 . . . . . . . . 7007 1 1631 . 1 1 150 150 ILE CA C 13 65.630 0.1 . 1 . . . . . . . . 7007 1 1632 . 1 1 150 150 ILE HA H 1 3.791 0.02 . 1 . . . . . . . . 7007 1 1633 . 1 1 150 150 ILE CB C 13 38.573 0.1 . 1 . . . . . . . . 7007 1 1634 . 1 1 150 150 ILE HB H 1 1.935 0.02 . 1 . . . . . . . . 7007 1 1635 . 1 1 150 150 ILE HG21 H 1 0.886 0.02 . 1 . . . . . . . . 7007 1 1636 . 1 1 150 150 ILE HG22 H 1 0.886 0.02 . 1 . . . . . . . . 7007 1 1637 . 1 1 150 150 ILE HG23 H 1 0.886 0.02 . 1 . . . . . . . . 7007 1 1638 . 1 1 150 150 ILE CG2 C 13 17.127 0.1 . 1 . . . . . . . . 7007 1 1639 . 1 1 150 150 ILE CG1 C 13 29.243 0.1 . 1 . . . . . . . . 7007 1 1640 . 1 1 150 150 ILE HG12 H 1 1.175 0.02 . 2 . . . . . . . . 7007 1 1641 . 1 1 150 150 ILE HG13 H 1 1.807 0.02 . 2 . . . . . . . . 7007 1 1642 . 1 1 150 150 ILE HD11 H 1 0.872 0.02 . 1 . . . . . . . . 7007 1 1643 . 1 1 150 150 ILE HD12 H 1 0.872 0.02 . 1 . . . . . . . . 7007 1 1644 . 1 1 150 150 ILE HD13 H 1 0.872 0.02 . 1 . . . . . . . . 7007 1 1645 . 1 1 150 150 ILE CD1 C 13 13.810 0.1 . 1 . . . . . . . . 7007 1 1646 . 1 1 150 150 ILE C C 13 178.956 0.1 . 1 . . . . . . . . 7007 1 1647 . 1 1 151 151 MET N N 15 117.876 0.1 . 1 . . . . . . . . 7007 1 1648 . 1 1 151 151 MET H H 1 8.216 0.02 . 1 . . . . . . . . 7007 1 1649 . 1 1 151 151 MET CA C 13 56.716 0.1 . 1 . . . . . . . . 7007 1 1650 . 1 1 151 151 MET HA H 1 4.375 0.02 . 1 . . . . . . . . 7007 1 1651 . 1 1 151 151 MET CB C 13 31.398 0.1 . 1 . . . . . . . . 7007 1 1652 . 1 1 151 151 MET HB3 H 1 2.038 0.02 . 2 . . . . . . . . 7007 1 1653 . 1 1 151 151 MET CG C 13 32.306 0.1 . 1 . . . . . . . . 7007 1 1654 . 1 1 151 151 MET HG2 H 1 2.312 0.02 . 2 . . . . . . . . 7007 1 1655 . 1 1 151 151 MET HG3 H 1 2.617 0.02 . 2 . . . . . . . . 7007 1 1656 . 1 1 151 151 MET C C 13 179.250 0.1 . 1 . . . . . . . . 7007 1 1657 . 1 1 152 152 GLU N N 15 120.657 0.1 . 1 . . . . . . . . 7007 1 1658 . 1 1 152 152 GLU H H 1 8.117 0.02 . 1 . . . . . . . . 7007 1 1659 . 1 1 152 152 GLU CA C 13 59.311 0.1 . 1 . . . . . . . . 7007 1 1660 . 1 1 152 152 GLU HA H 1 4.095 0.02 . 1 . . . . . . . . 7007 1 1661 . 1 1 152 152 GLU CB C 13 29.505 0.1 . 1 . . . . . . . . 7007 1 1662 . 1 1 152 152 GLU HB3 H 1 2.188 0.02 . 2 . . . . . . . . 7007 1 1663 . 1 1 152 152 GLU CG C 13 36.635 0.1 . 1 . . . . . . . . 7007 1 1664 . 1 1 152 152 GLU HG2 H 1 2.301 0.02 . 2 . . . . . . . . 7007 1 1665 . 1 1 152 152 GLU HG3 H 1 2.477 0.02 . 2 . . . . . . . . 7007 1 1666 . 1 1 152 152 GLU C C 13 178.895 0.1 . 1 . . . . . . . . 7007 1 1667 . 1 1 153 153 CYS N N 15 116.765 0.1 . 1 . . . . . . . . 7007 1 1668 . 1 1 153 153 CYS H H 1 7.888 0.02 . 1 . . . . . . . . 7007 1 1669 . 1 1 153 153 CYS CA C 13 61.674 0.1 . 1 . . . . . . . . 7007 1 1670 . 1 1 153 153 CYS HA H 1 4.318 0.02 . 1 . . . . . . . . 7007 1 1671 . 1 1 153 153 CYS CB C 13 27.504 0.1 . 1 . . . . . . . . 7007 1 1672 . 1 1 153 153 CYS HB3 H 1 3.048 0.02 . 2 . . . . . . . . 7007 1 1673 . 1 1 153 153 CYS C C 13 175.979 0.1 . 1 . . . . . . . . 7007 1 1674 . 1 1 154 154 LYS N N 15 120.025 0.1 . 1 . . . . . . . . 7007 1 1675 . 1 1 154 154 LYS H H 1 7.838 0.02 . 1 . . . . . . . . 7007 1 1676 . 1 1 154 154 LYS CA C 13 58.143 0.1 . 1 . . . . . . . . 7007 1 1677 . 1 1 154 154 LYS HA H 1 4.214 0.02 . 1 . . . . . . . . 7007 1 1678 . 1 1 154 154 LYS CB C 13 32.770 0.1 . 1 . . . . . . . . 7007 1 1679 . 1 1 154 154 LYS HB3 H 1 1.925 0.02 . 2 . . . . . . . . 7007 1 1680 . 1 1 154 154 LYS CG C 13 25.282 0.1 . 1 . . . . . . . . 7007 1 1681 . 1 1 154 154 LYS HG3 H 1 1.537 0.02 . 2 . . . . . . . . 7007 1 1682 . 1 1 154 154 LYS CD C 13 29.409 0.1 . 1 . . . . . . . . 7007 1 1683 . 1 1 154 154 LYS HD3 H 1 1.693 0.02 . 2 . . . . . . . . 7007 1 1684 . 1 1 154 154 LYS CE C 13 42.439 0.1 . 1 . . . . . . . . 7007 1 1685 . 1 1 154 154 LYS HE3 H 1 2.979 0.02 . 2 . . . . . . . . 7007 1 1686 . 1 1 154 154 LYS C C 13 177.337 0.1 . 1 . . . . . . . . 7007 1 1687 . 1 1 155 155 LYS N N 15 118.388 0.1 . 1 . . . . . . . . 7007 1 1688 . 1 1 155 155 LYS H H 1 7.737 0.02 . 1 . . . . . . . . 7007 1 1689 . 1 1 155 155 LYS CA C 13 57.187 0.1 . 1 . . . . . . . . 7007 1 1690 . 1 1 155 155 LYS HA H 1 4.266 0.02 . 1 . . . . . . . . 7007 1 1691 . 1 1 155 155 LYS CB C 13 33.317 0.1 . 1 . . . . . . . . 7007 1 1692 . 1 1 155 155 LYS HB2 H 1 1.792 0.02 . 2 . . . . . . . . 7007 1 1693 . 1 1 155 155 LYS HB3 H 1 1.897 0.02 . 2 . . . . . . . . 7007 1 1694 . 1 1 155 155 LYS CG C 13 25.837 0.1 . 1 . . . . . . . . 7007 1 1695 . 1 1 155 155 LYS HG3 H 1 1.459 0.02 . 2 . . . . . . . . 7007 1 1696 . 1 1 155 155 LYS CD C 13 29.688 0.1 . 1 . . . . . . . . 7007 1 1697 . 1 1 155 155 LYS HD3 H 1 1.664 0.02 . 2 . . . . . . . . 7007 1 1698 . 1 1 155 155 LYS CE C 13 42.376 0.1 . 1 . . . . . . . . 7007 1 1699 . 1 1 155 155 LYS HE3 H 1 2.977 0.02 . 2 . . . . . . . . 7007 1 1700 . 1 1 155 155 LYS C C 13 176.633 0.1 . 1 . . . . . . . . 7007 1 1701 . 1 1 156 156 LYS N N 15 122.006 0.1 . 1 . . . . . . . . 7007 1 1702 . 1 1 156 156 LYS H H 1 7.899 0.02 . 1 . . . . . . . . 7007 1 1703 . 1 1 156 156 LYS C C 13 174.174 0.1 . 1 . . . . . . . . 7007 1 1704 . 1 1 157 157 PRO CD C 13 50.828 0.1 . 1 . . . . . . . . 7007 1 1705 . 1 1 157 157 PRO CA C 13 63.985 0.1 . 1 . . . . . . . . 7007 1 1706 . 1 1 157 157 PRO HA H 1 4.451 0.02 . 1 . . . . . . . . 7007 1 1707 . 1 1 157 157 PRO CB C 13 32.297 0.1 . 1 . . . . . . . . 7007 1 1708 . 1 1 157 157 PRO HB2 H 1 1.921 0.02 . 2 . . . . . . . . 7007 1 1709 . 1 1 157 157 PRO HB3 H 1 2.318 0.02 . 2 . . . . . . . . 7007 1 1710 . 1 1 157 157 PRO CG C 13 28.080 0.1 . 1 . . . . . . . . 7007 1 1711 . 1 1 157 157 PRO HG3 H 1 2.033 0.02 . 2 . . . . . . . . 7007 1 1712 . 1 1 157 157 PRO HD2 H 1 3.759 0.02 . 2 . . . . . . . . 7007 1 1713 . 1 1 157 157 PRO HD3 H 1 3.625 0.02 . 2 . . . . . . . . 7007 1 1714 . 1 1 157 157 PRO C C 13 177.438 0.1 . 1 . . . . . . . . 7007 1 1715 . 1 1 158 158 GLN N N 15 120.496 0.1 . 1 . . . . . . . . 7007 1 1716 . 1 1 158 158 GLN H H 1 8.577 0.02 . 1 . . . . . . . . 7007 1 1717 . 1 1 158 158 GLN CA C 13 56.501 0.1 . 1 . . . . . . . . 7007 1 1718 . 1 1 158 158 GLN HA H 1 4.367 0.02 . 1 . . . . . . . . 7007 1 1719 . 1 1 158 158 GLN CB C 13 29.812 0.1 . 1 . . . . . . . . 7007 1 1720 . 1 1 158 158 GLN HB2 H 1 2.036 0.02 . 2 . . . . . . . . 7007 1 1721 . 1 1 158 158 GLN HB3 H 1 2.154 0.02 . 2 . . . . . . . . 7007 1 1722 . 1 1 158 158 GLN CG C 13 34.230 0.1 . 1 . . . . . . . . 7007 1 1723 . 1 1 158 158 GLN HG2 H 1 2.227 0.02 . 2 . . . . . . . . 7007 1 1724 . 1 1 158 158 GLN HG3 H 1 2.433 0.02 . 2 . . . . . . . . 7007 1 1725 . 1 1 158 158 GLN C C 13 176.726 0.1 . 1 . . . . . . . . 7007 1 1726 . 1 1 159 159 GLY N N 15 110.270 0.1 . 1 . . . . . . . . 7007 1 1727 . 1 1 159 159 GLY H H 1 8.481 0.02 . 1 . . . . . . . . 7007 1 1728 . 1 1 159 159 GLY CA C 13 45.637 0.1 . 1 . . . . . . . . 7007 1 1729 . 1 1 159 159 GLY HA2 H 1 4.004 0.02 . 2 . . . . . . . . 7007 1 1730 . 1 1 159 159 GLY HA3 H 1 3.804 0.02 . 2 . . . . . . . . 7007 1 1731 . 1 1 159 159 GLY C C 13 174.304 0.1 . 1 . . . . . . . . 7007 1 1732 . 1 1 160 160 GLN N N 15 119.855 0.1 . 1 . . . . . . . . 7007 1 1733 . 1 1 160 160 GLN H H 1 8.374 0.02 . 1 . . . . . . . . 7007 1 1734 . 1 1 160 160 GLN CA C 13 56.276 0.1 . 1 . . . . . . . . 7007 1 1735 . 1 1 160 160 GLN HA H 1 4.394 0.02 . 1 . . . . . . . . 7007 1 1736 . 1 1 160 160 GLN CB C 13 29.904 0.1 . 1 . . . . . . . . 7007 1 1737 . 1 1 160 160 GLN HB2 H 1 2.004 0.02 . 2 . . . . . . . . 7007 1 1738 . 1 1 160 160 GLN HB3 H 1 2.179 0.02 . 2 . . . . . . . . 7007 1 1739 . 1 1 160 160 GLN CG C 13 34.286 0.1 . 1 . . . . . . . . 7007 1 1740 . 1 1 160 160 GLN HG2 H 1 2.359 0.02 . 2 . . . . . . . . 7007 1 1741 . 1 1 160 160 GLN HG3 H 1 2.378 0.02 . 2 . . . . . . . . 7007 1 1742 . 1 1 160 160 GLN C C 13 176.547 0.1 . 1 . . . . . . . . 7007 1 1743 . 1 1 161 161 GLY N N 15 110.177 0.1 . 1 . . . . . . . . 7007 1 1744 . 1 1 161 161 GLY H H 1 8.537 0.02 . 1 . . . . . . . . 7007 1 1745 . 1 1 161 161 GLY CA C 13 45.878 0.1 . 1 . . . . . . . . 7007 1 1746 . 1 1 161 161 GLY HA3 H 1 3.974 0.02 . 2 . . . . . . . . 7007 1 1747 . 1 1 161 161 GLY C C 13 173.989 0.1 . 1 . . . . . . . . 7007 1 1748 . 1 1 162 162 ASN N N 15 118.851 0.1 . 1 . . . . . . . . 7007 1 1749 . 1 1 162 162 ASN H H 1 8.368 0.02 . 1 . . . . . . . . 7007 1 1750 . 1 1 162 162 ASN CA C 13 53.638 0.1 . 1 . . . . . . . . 7007 1 1751 . 1 1 162 162 ASN HA H 1 4.714 0.02 . 1 . . . . . . . . 7007 1 1752 . 1 1 162 162 ASN CB C 13 39.401 0.1 . 1 . . . . . . . . 7007 1 1753 . 1 1 162 162 ASN HB3 H 1 2.690 0.02 . 2 . . . . . . . . 7007 1 1754 . 1 1 162 162 ASN C C 13 174.991 0.1 . 1 . . . . . . . . 7007 1 1755 . 1 1 163 163 ASP N N 15 120.695 0.1 . 1 . . . . . . . . 7007 1 1756 . 1 1 163 163 ASP H H 1 8.368 0.02 . 1 . . . . . . . . 7007 1 1757 . 1 1 163 163 ASP CA C 13 54.741 0.1 . 1 . . . . . . . . 7007 1 1758 . 1 1 163 163 ASP HA H 1 4.656 0.02 . 1 . . . . . . . . 7007 1 1759 . 1 1 163 163 ASP CB C 13 41.774 0.1 . 1 . . . . . . . . 7007 1 1760 . 1 1 163 163 ASP HB3 H 1 2.625 0.02 . 2 . . . . . . . . 7007 1 1761 . 1 1 163 163 ASP C C 13 175.490 0.1 . 1 . . . . . . . . 7007 1 1762 . 1 1 164 164 ASP N N 15 119.610 0.1 . 1 . . . . . . . . 7007 1 1763 . 1 1 164 164 ASP H H 1 8.239 0.02 . 1 . . . . . . . . 7007 1 1764 . 1 1 164 164 ASP C C 13 177.166 0.1 . 1 . . . . . . . . 7007 1 1765 . 1 1 165 165 ILE HA H 1 4.073 0.02 . 1 . . . . . . . . 7007 1 1766 . 1 1 165 165 ILE CB C 13 38.630 0.1 . 1 . . . . . . . . 7007 1 1767 . 1 1 165 165 ILE HB H 1 1.866 0.02 . 1 . . . . . . . . 7007 1 1768 . 1 1 165 165 ILE HG21 H 1 0.904 0.02 . 1 . . . . . . . . 7007 1 1769 . 1 1 165 165 ILE HG22 H 1 0.904 0.02 . 1 . . . . . . . . 7007 1 1770 . 1 1 165 165 ILE HG23 H 1 0.904 0.02 . 1 . . . . . . . . 7007 1 1771 . 1 1 165 165 ILE CG2 C 13 18.261 0.1 . 1 . . . . . . . . 7007 1 1772 . 1 1 165 165 ILE HD11 H 1 0.642 0.02 . 1 . . . . . . . . 7007 1 1773 . 1 1 165 165 ILE HD12 H 1 0.642 0.02 . 1 . . . . . . . . 7007 1 1774 . 1 1 165 165 ILE HD13 H 1 0.642 0.02 . 1 . . . . . . . . 7007 1 1775 . 1 1 165 165 ILE CD1 C 13 13.729 0.1 . 1 . . . . . . . . 7007 1 1776 . 1 1 167 167 HIS HA H 1 4.705 0.02 . 1 . . . . . . . . 7007 1 1777 . 1 1 167 167 HIS CB C 13 30.537 0.1 . 1 . . . . . . . . 7007 1 1778 . 1 1 167 167 HIS HB2 H 1 3.164 0.02 . 2 . . . . . . . . 7007 1 1779 . 1 1 167 167 HIS HB3 H 1 3.304 0.02 . 2 . . . . . . . . 7007 1 1780 . 1 1 167 167 HIS CD2 C 13 120.201 0.1 . 1 . . . . . . . . 7007 1 1781 . 1 1 167 167 HIS CE1 C 13 139.106 0.1 . 1 . . . . . . . . 7007 1 1782 . 1 1 167 167 HIS HD2 H 1 7.189 0.02 . 1 . . . . . . . . 7007 1 1783 . 1 1 167 167 HIS HE1 H 1 7.771 0.02 . 1 . . . . . . . . 7007 1 1784 . 1 1 168 168 VAL N N 15 117.637 0.1 . 1 . . . . . . . . 7007 1 1785 . 1 1 168 168 VAL H H 1 7.867 0.02 . 1 . . . . . . . . 7007 1 1786 . 1 1 168 168 VAL CA C 13 63.321 0.1 . 1 . . . . . . . . 7007 1 1787 . 1 1 168 168 VAL HA H 1 4.208 0.02 . 1 . . . . . . . . 7007 1 1788 . 1 1 168 168 VAL CB C 13 33.302 0.1 . 1 . . . . . . . . 7007 1 1789 . 1 1 168 168 VAL HB H 1 2.072 0.02 . 1 . . . . . . . . 7007 1 1790 . 1 1 168 168 VAL HG21 H 1 0.941 0.02 . 2 . . . . . . . . 7007 1 1791 . 1 1 168 168 VAL HG22 H 1 0.941 0.02 . 2 . . . . . . . . 7007 1 1792 . 1 1 168 168 VAL HG23 H 1 0.941 0.02 . 2 . . . . . . . . 7007 1 1793 . 1 1 168 168 VAL CG2 C 13 21.174 0.1 . 1 . . . . . . . . 7007 1 1794 . 1 1 169 169 LEU N N 15 124.012 0.1 . 1 . . . . . . . . 7007 1 1795 . 1 1 169 169 LEU H H 1 8.432 0.02 . 1 . . . . . . . . 7007 1 1796 . 1 1 169 169 LEU CA C 13 54.815 0.1 . 1 . . . . . . . . 7007 1 1797 . 1 1 169 169 LEU HA H 1 4.492 0.02 . 1 . . . . . . . . 7007 1 1798 . 1 1 169 169 LEU CB C 13 41.220 0.1 . 1 . . . . . . . . 7007 1 1799 . 1 1 169 169 LEU HB2 H 1 1.506 0.02 . 2 . . . . . . . . 7007 1 1800 . 1 1 169 169 LEU HB3 H 1 1.896 0.02 . 2 . . . . . . . . 7007 1 1801 . 1 1 169 169 LEU HD21 H 1 0.677 0.02 . 2 . . . . . . . . 7007 1 1802 . 1 1 169 169 LEU HD22 H 1 0.677 0.02 . 2 . . . . . . . . 7007 1 1803 . 1 1 169 169 LEU HD23 H 1 0.677 0.02 . 2 . . . . . . . . 7007 1 1804 . 1 1 169 169 LEU CD2 C 13 23.416 0.1 . 1 . . . . . . . . 7007 1 1805 . 1 1 170 170 ARG N N 15 119.167 0.1 . 1 . . . . . . . . 7007 1 1806 . 1 1 170 170 ARG H H 1 7.973 0.02 . 1 . . . . . . . . 7007 1 1807 . 1 1 171 171 GLU CA C 13 56.699 0.1 . 1 . . . . . . . . 7007 1 1808 . 1 1 171 171 GLU HA H 1 4.295 0.02 . 1 . . . . . . . . 7007 1 1809 . 1 1 171 171 GLU CB C 13 30.788 0.1 . 1 . . . . . . . . 7007 1 1810 . 1 1 171 171 GLU HB2 H 1 2.039 0.02 . 2 . . . . . . . . 7007 1 1811 . 1 1 171 171 GLU HB3 H 1 1.867 0.02 . 2 . . . . . . . . 7007 1 1812 . 1 1 171 171 GLU CG C 13 36.541 0.1 . 1 . . . . . . . . 7007 1 1813 . 1 1 171 171 GLU HG3 H 1 2.201 0.02 . 2 . . . . . . . . 7007 1 1814 . 1 1 171 171 GLU C C 13 176.142 0.1 . 1 . . . . . . . . 7007 1 1815 . 1 1 172 172 ASP N N 15 121.640 0.1 . 1 . . . . . . . . 7007 1 1816 . 1 1 172 172 ASP H H 1 8.532 0.02 . 1 . . . . . . . . 7007 1 1817 . 1 1 172 172 ASP CA C 13 54.756 0.1 . 1 . . . . . . . . 7007 1 1818 . 1 1 172 172 ASP HA H 1 4.636 0.02 . 1 . . . . . . . . 7007 1 1819 . 1 1 172 172 ASP CB C 13 41.399 0.1 . 1 . . . . . . . . 7007 1 1820 . 1 1 172 172 ASP HB3 H 1 2.730 0.02 . 2 . . . . . . . . 7007 1 1821 . 1 1 172 172 ASP C C 13 175.329 0.1 . 1 . . . . . . . . 7007 1 1822 . 1 1 173 173 GLN N N 15 124.957 0.1 . 1 . . . . . . . . 7007 1 1823 . 1 1 173 173 GLN H H 1 7.875 0.02 . 1 . . . . . . . . 7007 1 1824 . 1 1 173 173 GLN C C 13 180.626 0.1 . 1 . . . . . . . . 7007 1 stop_ save_