data_6390 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6390 _Entry.Title ; NMR assignment of the R-module from the Azotobacter vinelandii mannuronan C5-epimerase AlgE4 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2004-11-15 _Entry.Accession_date 2004-11-15 _Entry.Last_release_date 2005-04-08 _Entry.Original_release_date 2005-04-08 _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 Finn Aachmann . L. . 6390 2 'Britt Iren' Svanem . Glarum . 6390 3 Svein Valla . . . 6390 4 Steffen Petersen . Bjorn . 6390 5 Reinhard Wimmer . . . 6390 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6390 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 571 6390 '1H chemical shifts' 924 6390 '15N chemical shifts' 166 6390 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2005-04-08 2004-11-15 original author . 6390 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6390 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; NMR assignment of the R-module from the Azotobacter vinelandii mannuronan C5-epimerase AlgE4 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 31 _Citation.Journal_issue 3 _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 259 _Citation.Page_last 259 _Citation.Year 2005 _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 Finn Aachmann . L. . 6390 1 2 'Britt Iren' Svanem . Glaerum . 6390 1 3 Svein Valla . . . 6390 1 4 Steffen Petersen . Bjorn . 6390 1 5 Reinhard Wimmer . . . 6390 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID Alginate 6390 1 'Azotobacter vinelandii' 6390 1 R-module 6390 1 'Mannuronan C5-epimerase' 6390 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_R-module _Assembly.Sf_category assembly _Assembly.Sf_framecode system_R-module _Assembly.Entry_ID 6390 _Assembly.ID 1 _Assembly.Name R-module _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _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 6390 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 R-module 1 $R-module . . . native . . . . . 6390 1 2 'CALCIUM (II) ION' 2 $CA . . . native . . . . . 6390 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID R-module system 6390 1 R-module abbreviation 6390 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_R-module _Entity.Sf_category entity _Entity.Sf_framecode R-module _Entity.Entry_ID 6390 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name R-module _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 ; GSDGEPLVGGDTDDQLQGGS GADRLDGGAGDDILDGGAGR DRLSGGAGADTFVFSAREDS YRTDTAVFNDLILDFEASED RIDLSALGFSGLGDGYGGTL LLKTNAEGTRTYLKSFEADA EGRRFEVALDGDHTGDLSAA NVVFAATGTTTELEVLGDSG TQAGAIV ; _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 167 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2AGM . "Solution Structure Of The R-Module From Alge4" . . . . . 100.00 167 100.00 100.00 8.12e-106 . . . . 6390 1 2 no GB AAA87310 . "mannuronan C-5-epimerase [Azotobacter vinelandii]" . . . . . 100.00 553 100.00 100.00 1.07e-102 . . . . 6390 1 3 no GB ACO81204 . "Secreted mannuronan C-5 epimerase [Azotobacter vinelandii DJ]" . . . . . 100.00 553 98.80 98.80 2.58e-101 . . . . 6390 1 4 no GB ADG44967 . "IntC-R-H6 [Expression vector pSABAD92A]" . . . . . 88.02 196 100.00 100.00 2.19e-92 . . . . 6390 1 5 no GB AGK13234 . "Secreted mannuronan C-5 epimerase [Azotobacter vinelandii CA]" . . . . . 100.00 553 98.80 98.80 2.58e-101 . . . . 6390 1 6 no GB AGK17521 . "Secreted mannuronan C-5 epimerase [Azotobacter vinelandii CA6]" . . . . . 100.00 553 98.80 98.80 2.58e-101 . . . . 6390 1 7 no REF WP_012703557 . "poly(beta-D-mannuronate) C5 epimerase 4 [Azotobacter vinelandii]" . . . . . 100.00 553 98.80 98.80 2.58e-101 . . . . 6390 1 8 no REF YP_002802179 . "secreted mannuronan C-5 epimerase [Azotobacter vinelandii DJ]" . . . . . 100.00 553 98.80 98.80 2.58e-101 . . . . 6390 1 9 no REF YP_007895988 . "Secreted mannuronan C-5 epimerase [Azotobacter vinelandii CA]" . . . . . 100.00 553 98.80 98.80 2.58e-101 . . . . 6390 1 10 no REF YP_007900994 . "Secreted mannuronan C-5 epimerase [Azotobacter vinelandii CA6]" . . . . . 100.00 553 98.80 98.80 2.58e-101 . . . . 6390 1 11 no SP Q44493 . "RecName: Full=Poly(beta-D-mannuronate) C5 epimerase 4; AltName: Full=Mannuronan epimerase 4 [Azotobacter vinelandii]" . . . . . 100.00 553 100.00 100.00 1.07e-102 . . . . 6390 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID R-module common 6390 1 R-module abbreviation 6390 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 . 6390 1 2 . SER . 6390 1 3 . ASP . 6390 1 4 . GLY . 6390 1 5 . GLU . 6390 1 6 . PRO . 6390 1 7 . LEU . 6390 1 8 . VAL . 6390 1 9 . GLY . 6390 1 10 . GLY . 6390 1 11 . ASP . 6390 1 12 . THR . 6390 1 13 . ASP . 6390 1 14 . ASP . 6390 1 15 . GLN . 6390 1 16 . LEU . 6390 1 17 . GLN . 6390 1 18 . GLY . 6390 1 19 . GLY . 6390 1 20 . SER . 6390 1 21 . GLY . 6390 1 22 . ALA . 6390 1 23 . ASP . 6390 1 24 . ARG . 6390 1 25 . LEU . 6390 1 26 . ASP . 6390 1 27 . GLY . 6390 1 28 . GLY . 6390 1 29 . ALA . 6390 1 30 . GLY . 6390 1 31 . ASP . 6390 1 32 . ASP . 6390 1 33 . ILE . 6390 1 34 . LEU . 6390 1 35 . ASP . 6390 1 36 . GLY . 6390 1 37 . GLY . 6390 1 38 . ALA . 6390 1 39 . GLY . 6390 1 40 . ARG . 6390 1 41 . ASP . 6390 1 42 . ARG . 6390 1 43 . LEU . 6390 1 44 . SER . 6390 1 45 . GLY . 6390 1 46 . GLY . 6390 1 47 . ALA . 6390 1 48 . GLY . 6390 1 49 . ALA . 6390 1 50 . ASP . 6390 1 51 . THR . 6390 1 52 . PHE . 6390 1 53 . VAL . 6390 1 54 . PHE . 6390 1 55 . SER . 6390 1 56 . ALA . 6390 1 57 . ARG . 6390 1 58 . GLU . 6390 1 59 . ASP . 6390 1 60 . SER . 6390 1 61 . TYR . 6390 1 62 . ARG . 6390 1 63 . THR . 6390 1 64 . ASP . 6390 1 65 . THR . 6390 1 66 . ALA . 6390 1 67 . VAL . 6390 1 68 . PHE . 6390 1 69 . ASN . 6390 1 70 . ASP . 6390 1 71 . LEU . 6390 1 72 . ILE . 6390 1 73 . LEU . 6390 1 74 . ASP . 6390 1 75 . PHE . 6390 1 76 . GLU . 6390 1 77 . ALA . 6390 1 78 . SER . 6390 1 79 . GLU . 6390 1 80 . ASP . 6390 1 81 . ARG . 6390 1 82 . ILE . 6390 1 83 . ASP . 6390 1 84 . LEU . 6390 1 85 . SER . 6390 1 86 . ALA . 6390 1 87 . LEU . 6390 1 88 . GLY . 6390 1 89 . PHE . 6390 1 90 . SER . 6390 1 91 . GLY . 6390 1 92 . LEU . 6390 1 93 . GLY . 6390 1 94 . ASP . 6390 1 95 . GLY . 6390 1 96 . TYR . 6390 1 97 . GLY . 6390 1 98 . GLY . 6390 1 99 . THR . 6390 1 100 . LEU . 6390 1 101 . LEU . 6390 1 102 . LEU . 6390 1 103 . LYS . 6390 1 104 . THR . 6390 1 105 . ASN . 6390 1 106 . ALA . 6390 1 107 . GLU . 6390 1 108 . GLY . 6390 1 109 . THR . 6390 1 110 . ARG . 6390 1 111 . THR . 6390 1 112 . TYR . 6390 1 113 . LEU . 6390 1 114 . LYS . 6390 1 115 . SER . 6390 1 116 . PHE . 6390 1 117 . GLU . 6390 1 118 . ALA . 6390 1 119 . ASP . 6390 1 120 . ALA . 6390 1 121 . GLU . 6390 1 122 . GLY . 6390 1 123 . ARG . 6390 1 124 . ARG . 6390 1 125 . PHE . 6390 1 126 . GLU . 6390 1 127 . VAL . 6390 1 128 . ALA . 6390 1 129 . LEU . 6390 1 130 . ASP . 6390 1 131 . GLY . 6390 1 132 . ASP . 6390 1 133 . HIS . 6390 1 134 . THR . 6390 1 135 . GLY . 6390 1 136 . ASP . 6390 1 137 . LEU . 6390 1 138 . SER . 6390 1 139 . ALA . 6390 1 140 . ALA . 6390 1 141 . ASN . 6390 1 142 . VAL . 6390 1 143 . VAL . 6390 1 144 . PHE . 6390 1 145 . ALA . 6390 1 146 . ALA . 6390 1 147 . THR . 6390 1 148 . GLY . 6390 1 149 . THR . 6390 1 150 . THR . 6390 1 151 . THR . 6390 1 152 . GLU . 6390 1 153 . LEU . 6390 1 154 . GLU . 6390 1 155 . VAL . 6390 1 156 . LEU . 6390 1 157 . GLY . 6390 1 158 . ASP . 6390 1 159 . SER . 6390 1 160 . GLY . 6390 1 161 . THR . 6390 1 162 . GLN . 6390 1 163 . ALA . 6390 1 164 . GLY . 6390 1 165 . ALA . 6390 1 166 . ILE . 6390 1 167 . VAL . 6390 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 6390 1 . SER 2 2 6390 1 . ASP 3 3 6390 1 . GLY 4 4 6390 1 . GLU 5 5 6390 1 . PRO 6 6 6390 1 . LEU 7 7 6390 1 . VAL 8 8 6390 1 . GLY 9 9 6390 1 . GLY 10 10 6390 1 . ASP 11 11 6390 1 . THR 12 12 6390 1 . ASP 13 13 6390 1 . ASP 14 14 6390 1 . GLN 15 15 6390 1 . LEU 16 16 6390 1 . GLN 17 17 6390 1 . GLY 18 18 6390 1 . GLY 19 19 6390 1 . SER 20 20 6390 1 . GLY 21 21 6390 1 . ALA 22 22 6390 1 . ASP 23 23 6390 1 . ARG 24 24 6390 1 . LEU 25 25 6390 1 . ASP 26 26 6390 1 . GLY 27 27 6390 1 . GLY 28 28 6390 1 . ALA 29 29 6390 1 . GLY 30 30 6390 1 . ASP 31 31 6390 1 . ASP 32 32 6390 1 . ILE 33 33 6390 1 . LEU 34 34 6390 1 . ASP 35 35 6390 1 . GLY 36 36 6390 1 . GLY 37 37 6390 1 . ALA 38 38 6390 1 . GLY 39 39 6390 1 . ARG 40 40 6390 1 . ASP 41 41 6390 1 . ARG 42 42 6390 1 . LEU 43 43 6390 1 . SER 44 44 6390 1 . GLY 45 45 6390 1 . GLY 46 46 6390 1 . ALA 47 47 6390 1 . GLY 48 48 6390 1 . ALA 49 49 6390 1 . ASP 50 50 6390 1 . THR 51 51 6390 1 . PHE 52 52 6390 1 . VAL 53 53 6390 1 . PHE 54 54 6390 1 . SER 55 55 6390 1 . ALA 56 56 6390 1 . ARG 57 57 6390 1 . GLU 58 58 6390 1 . ASP 59 59 6390 1 . SER 60 60 6390 1 . TYR 61 61 6390 1 . ARG 62 62 6390 1 . THR 63 63 6390 1 . ASP 64 64 6390 1 . THR 65 65 6390 1 . ALA 66 66 6390 1 . VAL 67 67 6390 1 . PHE 68 68 6390 1 . ASN 69 69 6390 1 . ASP 70 70 6390 1 . LEU 71 71 6390 1 . ILE 72 72 6390 1 . LEU 73 73 6390 1 . ASP 74 74 6390 1 . PHE 75 75 6390 1 . GLU 76 76 6390 1 . ALA 77 77 6390 1 . SER 78 78 6390 1 . GLU 79 79 6390 1 . ASP 80 80 6390 1 . ARG 81 81 6390 1 . ILE 82 82 6390 1 . ASP 83 83 6390 1 . LEU 84 84 6390 1 . SER 85 85 6390 1 . ALA 86 86 6390 1 . LEU 87 87 6390 1 . GLY 88 88 6390 1 . PHE 89 89 6390 1 . SER 90 90 6390 1 . GLY 91 91 6390 1 . LEU 92 92 6390 1 . GLY 93 93 6390 1 . ASP 94 94 6390 1 . GLY 95 95 6390 1 . TYR 96 96 6390 1 . GLY 97 97 6390 1 . GLY 98 98 6390 1 . THR 99 99 6390 1 . LEU 100 100 6390 1 . LEU 101 101 6390 1 . LEU 102 102 6390 1 . LYS 103 103 6390 1 . THR 104 104 6390 1 . ASN 105 105 6390 1 . ALA 106 106 6390 1 . GLU 107 107 6390 1 . GLY 108 108 6390 1 . THR 109 109 6390 1 . ARG 110 110 6390 1 . THR 111 111 6390 1 . TYR 112 112 6390 1 . LEU 113 113 6390 1 . LYS 114 114 6390 1 . SER 115 115 6390 1 . PHE 116 116 6390 1 . GLU 117 117 6390 1 . ALA 118 118 6390 1 . ASP 119 119 6390 1 . ALA 120 120 6390 1 . GLU 121 121 6390 1 . GLY 122 122 6390 1 . ARG 123 123 6390 1 . ARG 124 124 6390 1 . PHE 125 125 6390 1 . GLU 126 126 6390 1 . VAL 127 127 6390 1 . ALA 128 128 6390 1 . LEU 129 129 6390 1 . ASP 130 130 6390 1 . GLY 131 131 6390 1 . ASP 132 132 6390 1 . HIS 133 133 6390 1 . THR 134 134 6390 1 . GLY 135 135 6390 1 . ASP 136 136 6390 1 . LEU 137 137 6390 1 . SER 138 138 6390 1 . ALA 139 139 6390 1 . ALA 140 140 6390 1 . ASN 141 141 6390 1 . VAL 142 142 6390 1 . VAL 143 143 6390 1 . PHE 144 144 6390 1 . ALA 145 145 6390 1 . ALA 146 146 6390 1 . THR 147 147 6390 1 . GLY 148 148 6390 1 . THR 149 149 6390 1 . THR 150 150 6390 1 . THR 151 151 6390 1 . GLU 152 152 6390 1 . LEU 153 153 6390 1 . GLU 154 154 6390 1 . VAL 155 155 6390 1 . LEU 156 156 6390 1 . GLY 157 157 6390 1 . ASP 158 158 6390 1 . SER 159 159 6390 1 . GLY 160 160 6390 1 . THR 161 161 6390 1 . GLN 162 162 6390 1 . ALA 163 163 6390 1 . GLY 164 164 6390 1 . ALA 165 165 6390 1 . ILE 166 166 6390 1 . VAL 167 167 6390 1 stop_ save_ save_CA _Entity.Sf_category entity _Entity.Sf_framecode CA _Entity.Entry_ID 6390 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name CA _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID CA _Entity.Nonpolymer_comp_label $chem_comp_CA _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . CA . 6390 2 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 6390 _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 $R-module . 354 organism . 'Azotobacter vinelandii' 'Azotobacter vinelandii' . . Bacteria . Azotobacter vinelandii . . . . . . . . . . . . . . . . . . . . . 6390 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 6390 _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 $R-module . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli ER2566 . . . . . . . . . . . . plasmid . . pTYB11 . . . . . . 6390 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_CA _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_CA _Chem_comp.Entry_ID 6390 _Chem_comp.ID CA _Chem_comp.Provenance . _Chem_comp.Name 'CALCIUM ION' _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code CA _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 1999-07-08 _Chem_comp.Modified_date 2011-06-04 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code CA _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code . _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Ca _Chem_comp.Formula_weight 40.078 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Wed Jun 15 15:31:50 2011 ; _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID [Ca+2] SMILES ACDLabs 10.04 6390 CA [Ca++] SMILES_CANONICAL CACTVS 3.341 6390 CA [Ca++] SMILES CACTVS 3.341 6390 CA [Ca+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 6390 CA [Ca+2] SMILES 'OpenEye OEToolkits' 1.5.0 6390 CA InChI=1S/Ca/q+2 InChI InChI 1.03 6390 CA BHPQYMZQTOCNFJ-UHFFFAOYSA-N InChIKey InChI 1.03 6390 CA stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID calcium 'SYSTEMATIC NAME' ACDLabs 10.04 6390 CA 'calcium(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 6390 CA stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID CA . CA . . CA . . N 2 . . . . no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 6390 CA stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6390 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '95 % H2O, 5% D2O' _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 R-module '[U-99% 13C; U-99% 15N]' . . 1 $R-module . . 1.6 . . mM . . . . 6390 1 2 'CALCIUM (II) ION' . . . 2 $CA . . 1.6 . . mM . . . . 6390 1 3 CaCl2 . . . . . . . 50 . . mM . . . . 6390 1 4 Na-HEPES . . . . . . . 20 . . mM . . . . 6390 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 6390 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 R-module '[U-99% 13C; U-99% 15N]' . . 1 $R-module . . . 0.8 1.1 mM . . . . 6390 2 2 'CALCIUM (II) ION' . . . 2 $CA . . . 0.8 1.1 mM . . . . 6390 2 3 CaCl2 . . . . . . . 50 . . mM . . . . 6390 2 4 Na-HEPES . . . . . . . 20 . . mM . . . . 6390 2 stop_ save_ ####################### # Sample conditions # ####################### save_ex-rm _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode ex-rm _Sample_condition_list.Entry_ID 6390 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.9 0.1 n/a 6390 1 temperature 298 0.2 K 6390 1 'ionic strength' 0.17 0.02 M 6390 1 stop_ save_ ############################ # Computer software used # ############################ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 6390 _Software.ID 1 _Software.Name XEASY _Software.Version 1.3.13 _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 6390 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'Bruker DRX600 spectrometer equipped with a 5-mm xyz-grad TXI(H/C/N) probe.' _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 6390 _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 'Bruker DRX600 spectrometer equipped with a 5-mm xyz-grad TXI(H/C/N) probe.' . . 6390 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 6390 _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 'Aromatic side-chain atoms were assigned from a series of 2D H(CC)H-COSY, TOCSY' . . . . . . . . . . . . . . . . 1 $ex-rm . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6390 1 2 'and NOESY experiments optimized for aromatic signals.' . . . . . . . . . . . . . . . . 1 $ex-rm . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6390 1 3 'Due to the high content of Glycine and Alanine residues, MUSIC spectra have' . . . . . . . . . . . . . . . . 1 $ex-rm . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6390 1 4 'been very helpful to identify Gly/Ala residues and residues following after' . . . . . . . . . . . . . . . . 1 $ex-rm . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6390 1 5 Gly/Ala. . . . . . . . . . . . . . . . . 1 $ex-rm . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6390 1 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 6390 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.0 . direct 1.0 . . . 1 $entry_citation . . 1 $entry_citation 6390 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 6390 1 C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 6390 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_rm_shift_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode rm_shift_set_1 _Assigned_chem_shift_list.Entry_ID 6390 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $ex-rm _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 . 6390 1 . . 2 $sample_2 . 6390 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLY CA C 13 45.1 0.1 . 1 . . . . . . . . 6390 1 2 . 1 1 1 1 GLY HA2 H 1 4.05 0.02 . 2 . . . . . . . . 6390 1 3 . 1 1 1 1 GLY HA3 H 1 4.03 0.02 . 2 . . . . . . . . 6390 1 4 . 1 1 2 2 SER N N 15 116.3 0.1 . 1 . . . . . . . . 6390 1 5 . 1 1 2 2 SER H H 1 8.30 0.02 . 1 . . . . . . . . 6390 1 6 . 1 1 2 2 SER CA C 13 58.5 0.1 . 1 . . . . . . . . 6390 1 7 . 1 1 2 2 SER HA H 1 4.56 0.02 . 1 . . . . . . . . 6390 1 8 . 1 1 2 2 SER CB C 13 63.5 0.1 . 1 . . . . . . . . 6390 1 9 . 1 1 2 2 SER HB2 H 1 3.90 0.02 . 2 . . . . . . . . 6390 1 10 . 1 1 2 2 SER C C 13 174.4 0.1 . 1 . . . . . . . . 6390 1 11 . 1 1 3 3 ASP N N 15 122.9 0.1 . 1 . . . . . . . . 6390 1 12 . 1 1 3 3 ASP H H 1 8.48 0.02 . 1 . . . . . . . . 6390 1 13 . 1 1 3 3 ASP CA C 13 54.7 0.1 . 1 . . . . . . . . 6390 1 14 . 1 1 3 3 ASP HA H 1 4.67 0.02 . 1 . . . . . . . . 6390 1 15 . 1 1 3 3 ASP CB C 13 41.3 0.1 . 1 . . . . . . . . 6390 1 16 . 1 1 3 3 ASP HB2 H 1 2.73 0.02 . 2 . . . . . . . . 6390 1 17 . 1 1 3 3 ASP HB3 H 1 2.70 0.02 . 2 . . . . . . . . 6390 1 18 . 1 1 3 3 ASP C C 13 175.3 0.1 . 1 . . . . . . . . 6390 1 19 . 1 1 4 4 GLY N N 15 109.7 0.1 . 1 . . . . . . . . 6390 1 20 . 1 1 4 4 GLY H H 1 8.21 0.02 . 1 . . . . . . . . 6390 1 21 . 1 1 4 4 GLY CA C 13 45.1 0.1 . 1 . . . . . . . . 6390 1 22 . 1 1 4 4 GLY HA2 H 1 4.01 0.02 . 2 . . . . . . . . 6390 1 23 . 1 1 4 4 GLY HA3 H 1 3.97 0.02 . 2 . . . . . . . . 6390 1 24 . 1 1 4 4 GLY C C 13 176.5 0.1 . 1 . . . . . . . . 6390 1 25 . 1 1 5 5 GLU N N 15 122.7 0.1 . 1 . . . . . . . . 6390 1 26 . 1 1 5 5 GLU H H 1 8.37 0.02 . 1 . . . . . . . . 6390 1 27 . 1 1 5 5 GLU CA C 13 54.1 0.1 . 1 . . . . . . . . 6390 1 28 . 1 1 5 5 GLU HA H 1 4.72 0.02 . 1 . . . . . . . . 6390 1 29 . 1 1 5 5 GLU CB C 13 30.1 0.1 . 1 . . . . . . . . 6390 1 30 . 1 1 5 5 GLU HB2 H 1 2.09 0.02 . 2 . . . . . . . . 6390 1 31 . 1 1 5 5 GLU HB3 H 1 1.94 0.02 . 2 . . . . . . . . 6390 1 32 . 1 1 5 5 GLU CG C 13 35.7 0.1 . 1 . . . . . . . . 6390 1 33 . 1 1 5 5 GLU HG2 H 1 2.30 0.02 . 2 . . . . . . . . 6390 1 34 . 1 1 5 5 GLU C C 13 173.8 0.1 . 1 . . . . . . . . 6390 1 35 . 1 1 6 6 PRO CD C 13 50.3 0.1 . 1 . . . . . . . . 6390 1 36 . 1 1 6 6 PRO CA C 13 62.7 0.1 . 1 . . . . . . . . 6390 1 37 . 1 1 6 6 PRO HA H 1 4.78 0.02 . 1 . . . . . . . . 6390 1 38 . 1 1 6 6 PRO CB C 13 31.9 0.1 . 1 . . . . . . . . 6390 1 39 . 1 1 6 6 PRO HB2 H 1 2.13 0.02 . 2 . . . . . . . . 6390 1 40 . 1 1 6 6 PRO HB3 H 1 1.85 0.02 . 2 . . . . . . . . 6390 1 41 . 1 1 6 6 PRO CG C 13 27.2 0.1 . 1 . . . . . . . . 6390 1 42 . 1 1 6 6 PRO HG2 H 1 2.15 0.02 . 2 . . . . . . . . 6390 1 43 . 1 1 6 6 PRO HG3 H 1 2.00 0.02 . 2 . . . . . . . . 6390 1 44 . 1 1 6 6 PRO HD2 H 1 3.88 0.02 . 2 . . . . . . . . 6390 1 45 . 1 1 6 6 PRO HD3 H 1 3.78 0.02 . 2 . . . . . . . . 6390 1 46 . 1 1 7 7 LEU N N 15 126.0 0.1 . 1 . . . . . . . . 6390 1 47 . 1 1 7 7 LEU H H 1 8.74 0.02 . 1 . . . . . . . . 6390 1 48 . 1 1 7 7 LEU CA C 13 54.7 0.1 . 1 . . . . . . . . 6390 1 49 . 1 1 7 7 LEU HA H 1 4.57 0.02 . 1 . . . . . . . . 6390 1 50 . 1 1 7 7 LEU CB C 13 42.4 0.1 . 1 . . . . . . . . 6390 1 51 . 1 1 7 7 LEU HB2 H 1 1.73 0.02 . 2 . . . . . . . . 6390 1 52 . 1 1 7 7 LEU HB3 H 1 1.60 0.02 . 2 . . . . . . . . 6390 1 53 . 1 1 7 7 LEU CG C 13 22.8 0.1 . 1 . . . . . . . . 6390 1 54 . 1 1 7 7 LEU HG H 1 1.27 0.02 . 1 . . . . . . . . 6390 1 55 . 1 1 7 7 LEU HD11 H 1 0.92 0.02 . 2 . . . . . . . . 6390 1 56 . 1 1 7 7 LEU HD12 H 1 0.92 0.02 . 2 . . . . . . . . 6390 1 57 . 1 1 7 7 LEU HD13 H 1 0.92 0.02 . 2 . . . . . . . . 6390 1 58 . 1 1 7 7 LEU HD21 H 1 0.85 0.02 . 2 . . . . . . . . 6390 1 59 . 1 1 7 7 LEU HD22 H 1 0.85 0.02 . 2 . . . . . . . . 6390 1 60 . 1 1 7 7 LEU HD23 H 1 0.85 0.02 . 2 . . . . . . . . 6390 1 61 . 1 1 7 7 LEU CD1 C 13 24.6 0.1 . 1 . . . . . . . . 6390 1 62 . 1 1 7 7 LEU CD2 C 13 24.6 0.1 . 1 . . . . . . . . 6390 1 63 . 1 1 7 7 LEU C C 13 176.1 0.1 . 1 . . . . . . . . 6390 1 64 . 1 1 8 8 VAL N N 15 123.6 0.1 . 1 . . . . . . . . 6390 1 65 . 1 1 8 8 VAL H H 1 8.01 0.02 . 1 . . . . . . . . 6390 1 66 . 1 1 8 8 VAL CA C 13 60.6 0.1 . 1 . . . . . . . . 6390 1 67 . 1 1 8 8 VAL HA H 1 4.71 0.02 . 1 . . . . . . . . 6390 1 68 . 1 1 8 8 VAL CB C 13 33.4 0.1 . 1 . . . . . . . . 6390 1 69 . 1 1 8 8 VAL HB H 1 2.00 0.02 . 1 . . . . . . . . 6390 1 70 . 1 1 8 8 VAL HG11 H 1 1.03 0.02 . 2 . . . . . . . . 6390 1 71 . 1 1 8 8 VAL HG12 H 1 1.03 0.02 . 2 . . . . . . . . 6390 1 72 . 1 1 8 8 VAL HG13 H 1 1.03 0.02 . 2 . . . . . . . . 6390 1 73 . 1 1 8 8 VAL HG21 H 1 0.92 0.02 . 2 . . . . . . . . 6390 1 74 . 1 1 8 8 VAL HG22 H 1 0.92 0.02 . 2 . . . . . . . . 6390 1 75 . 1 1 8 8 VAL HG23 H 1 0.92 0.02 . 2 . . . . . . . . 6390 1 76 . 1 1 8 8 VAL CG1 C 13 21.0 0.1 . 1 . . . . . . . . 6390 1 77 . 1 1 8 8 VAL CG2 C 13 20.5 0.1 . 1 . . . . . . . . 6390 1 78 . 1 1 8 8 VAL C C 13 174.5 0.1 . 1 . . . . . . . . 6390 1 79 . 1 1 9 9 GLY N N 15 114.9 0.1 . 1 . . . . . . . . 6390 1 80 . 1 1 9 9 GLY H H 1 9.02 0.02 . 1 . . . . . . . . 6390 1 81 . 1 1 9 9 GLY CA C 13 43.3 0.1 . 1 . . . . . . . . 6390 1 82 . 1 1 9 9 GLY HA2 H 1 4.17 0.02 . 2 . . . . . . . . 6390 1 83 . 1 1 9 9 GLY HA3 H 1 3.75 0.02 . 2 . . . . . . . . 6390 1 84 . 1 1 9 9 GLY C C 13 177.0 0.1 . 1 . . . . . . . . 6390 1 85 . 1 1 11 11 ASP CA C 13 56.2 0.1 . 1 . . . . . . . . 6390 1 86 . 1 1 11 11 ASP HA H 1 4.25 0.02 . 1 . . . . . . . . 6390 1 87 . 1 1 11 11 ASP CB C 13 39.8 0.1 . 1 . . . . . . . . 6390 1 88 . 1 1 11 11 ASP HB2 H 1 2.74 0.02 . 2 . . . . . . . . 6390 1 89 . 1 1 11 11 ASP HB3 H 1 2.61 0.02 . 2 . . . . . . . . 6390 1 90 . 1 1 12 12 THR N N 15 106.7 0.1 . 1 . . . . . . . . 6390 1 91 . 1 1 12 12 THR H H 1 7.36 0.02 . 1 . . . . . . . . 6390 1 92 . 1 1 12 12 THR CA C 13 59.7 0.1 . 1 . . . . . . . . 6390 1 93 . 1 1 12 12 THR HA H 1 4.21 0.02 . 1 . . . . . . . . 6390 1 94 . 1 1 12 12 THR CB C 13 70.0 0.1 . 1 . . . . . . . . 6390 1 95 . 1 1 12 12 THR HB H 1 4.32 0.02 . 1 . . . . . . . . 6390 1 96 . 1 1 12 12 THR HG21 H 1 1.19 0.02 . 1 . . . . . . . . 6390 1 97 . 1 1 12 12 THR HG22 H 1 1.19 0.02 . 1 . . . . . . . . 6390 1 98 . 1 1 12 12 THR HG23 H 1 1.19 0.02 . 1 . . . . . . . . 6390 1 99 . 1 1 12 12 THR CG2 C 13 22.5 0.1 . 1 . . . . . . . . 6390 1 100 . 1 1 12 12 THR C C 13 174.7 0.1 . 1 . . . . . . . . 6390 1 101 . 1 1 13 13 ASP N N 15 126.4 0.1 . 1 . . . . . . . . 6390 1 102 . 1 1 13 13 ASP H H 1 8.65 0.02 . 1 . . . . . . . . 6390 1 103 . 1 1 13 13 ASP CA C 13 54.7 0.1 . 1 . . . . . . . . 6390 1 104 . 1 1 13 13 ASP HA H 1 4.14 0.02 . 1 . . . . . . . . 6390 1 105 . 1 1 13 13 ASP CB C 13 39.2 0.1 . 1 . . . . . . . . 6390 1 106 . 1 1 13 13 ASP HB2 H 1 2.88 0.02 . 2 . . . . . . . . 6390 1 107 . 1 1 13 13 ASP HB3 H 1 2.71 0.02 . 2 . . . . . . . . 6390 1 108 . 1 1 13 13 ASP C C 13 173.8 0.1 . 1 . . . . . . . . 6390 1 109 . 1 1 14 14 ASP N N 15 126.8 0.1 . 1 . . . . . . . . 6390 1 110 . 1 1 14 14 ASP H H 1 9.57 0.02 . 1 . . . . . . . . 6390 1 111 . 1 1 14 14 ASP CA C 13 54.4 0.1 . 1 . . . . . . . . 6390 1 112 . 1 1 14 14 ASP HA H 1 4.94 0.02 . 1 . . . . . . . . 6390 1 113 . 1 1 14 14 ASP CB C 13 44.8 0.1 . 1 . . . . . . . . 6390 1 114 . 1 1 14 14 ASP HB2 H 1 2.57 0.02 . 2 . . . . . . . . 6390 1 115 . 1 1 14 14 ASP HB3 H 1 2.51 0.02 . 2 . . . . . . . . 6390 1 116 . 1 1 14 14 ASP C C 13 174.3 0.1 . 1 . . . . . . . . 6390 1 117 . 1 1 15 15 GLN N N 15 122.8 0.1 . 1 . . . . . . . . 6390 1 118 . 1 1 15 15 GLN H H 1 8.67 0.02 . 1 . . . . . . . . 6390 1 119 . 1 1 15 15 GLN CA C 13 55.0 0.1 . 1 . . . . . . . . 6390 1 120 . 1 1 15 15 GLN HA H 1 5.02 0.02 . 1 . . . . . . . . 6390 1 121 . 1 1 15 15 GLN CB C 13 28.4 0.1 . 1 . . . . . . . . 6390 1 122 . 1 1 15 15 GLN HB2 H 1 2.02 0.02 . 2 . . . . . . . . 6390 1 123 . 1 1 15 15 GLN HB3 H 1 1.96 0.02 . 2 . . . . . . . . 6390 1 124 . 1 1 15 15 GLN CG C 13 33.4 0.1 . 1 . . . . . . . . 6390 1 125 . 1 1 15 15 GLN HG2 H 1 2.25 0.02 . 2 . . . . . . . . 6390 1 126 . 1 1 15 15 GLN HG3 H 1 2.18 0.02 . 2 . . . . . . . . 6390 1 127 . 1 1 15 15 GLN NE2 N 15 111.8 0.1 . 1 . . . . . . . . 6390 1 128 . 1 1 15 15 GLN HE21 H 1 6.60 0.02 . 2 . . . . . . . . 6390 1 129 . 1 1 15 15 GLN HE22 H 1 7.35 0.02 . 2 . . . . . . . . 6390 1 130 . 1 1 15 15 GLN C C 13 174.9 0.1 . 1 . . . . . . . . 6390 1 131 . 1 1 16 16 LEU N N 15 126.0 0.1 . 1 . . . . . . . . 6390 1 132 . 1 1 16 16 LEU H H 1 8.87 0.02 . 1 . . . . . . . . 6390 1 133 . 1 1 16 16 LEU CA C 13 53.6 0.1 . 1 . . . . . . . . 6390 1 134 . 1 1 16 16 LEU HA H 1 4.67 0.02 . 1 . . . . . . . . 6390 1 135 . 1 1 16 16 LEU CB C 13 44.2 0.1 . 1 . . . . . . . . 6390 1 136 . 1 1 16 16 LEU HB2 H 1 1.74 0.02 . 2 . . . . . . . . 6390 1 137 . 1 1 16 16 LEU HB3 H 1 1.12 0.02 . 2 . . . . . . . . 6390 1 138 . 1 1 16 16 LEU CG C 13 27.2 0.1 . 1 . . . . . . . . 6390 1 139 . 1 1 16 16 LEU HG H 1 1.41 0.02 . 1 . . . . . . . . 6390 1 140 . 1 1 16 16 LEU HD11 H 1 0.69 0.02 . 2 . . . . . . . . 6390 1 141 . 1 1 16 16 LEU HD12 H 1 0.69 0.02 . 2 . . . . . . . . 6390 1 142 . 1 1 16 16 LEU HD13 H 1 0.69 0.02 . 2 . . . . . . . . 6390 1 143 . 1 1 16 16 LEU HD21 H 1 0.66 0.02 . 2 . . . . . . . . 6390 1 144 . 1 1 16 16 LEU HD22 H 1 0.66 0.02 . 2 . . . . . . . . 6390 1 145 . 1 1 16 16 LEU HD23 H 1 0.66 0.02 . 2 . . . . . . . . 6390 1 146 . 1 1 16 16 LEU CD1 C 13 26.0 0.1 . 1 . . . . . . . . 6390 1 147 . 1 1 16 16 LEU CD2 C 13 26.0 0.1 . 1 . . . . . . . . 6390 1 148 . 1 1 16 16 LEU C C 13 174.5 0.1 . 1 . . . . . . . . 6390 1 149 . 1 1 17 17 GLN N N 15 125.7 0.1 . 1 . . . . . . . . 6390 1 150 . 1 1 17 17 GLN H H 1 8.51 0.02 . 1 . . . . . . . . 6390 1 151 . 1 1 17 17 GLN CA C 13 53.2 0.1 . 1 . . . . . . . . 6390 1 152 . 1 1 17 17 GLN HA H 1 5.16 0.02 . 1 . . . . . . . . 6390 1 153 . 1 1 17 17 GLN CB C 13 31.0 0.1 . 1 . . . . . . . . 6390 1 154 . 1 1 17 17 GLN HB2 H 1 2.00 0.02 . 2 . . . . . . . . 6390 1 155 . 1 1 17 17 GLN HB3 H 1 1.90 0.02 . 2 . . . . . . . . 6390 1 156 . 1 1 17 17 GLN CG C 13 33.6 0.1 . 1 . . . . . . . . 6390 1 157 . 1 1 17 17 GLN HG2 H 1 2.31 0.02 . 2 . . . . . . . . 6390 1 158 . 1 1 17 17 GLN HG3 H 1 2.25 0.02 . 2 . . . . . . . . 6390 1 159 . 1 1 17 17 GLN NE2 N 15 113.2 0.1 . 1 . . . . . . . . 6390 1 160 . 1 1 17 17 GLN HE21 H 1 7.48 0.02 . 2 . . . . . . . . 6390 1 161 . 1 1 17 17 GLN HE22 H 1 6.47 0.02 . 2 . . . . . . . . 6390 1 162 . 1 1 17 17 GLN C C 13 174.4 0.1 . 1 . . . . . . . . 6390 1 163 . 1 1 18 18 GLY N N 15 112.3 0.1 . 1 . . . . . . . . 6390 1 164 . 1 1 18 18 GLY H H 1 9.22 0.02 . 1 . . . . . . . . 6390 1 165 . 1 1 18 18 GLY CA C 13 43.6 0.1 . 1 . . . . . . . . 6390 1 166 . 1 1 18 18 GLY HA2 H 1 4.16 0.02 . 2 . . . . . . . . 6390 1 167 . 1 1 18 18 GLY HA3 H 1 3.75 0.02 . 2 . . . . . . . . 6390 1 168 . 1 1 18 18 GLY C C 13 175.6 0.1 . 1 . . . . . . . . 6390 1 169 . 1 1 19 19 GLY N N 15 108.1 0.1 . 1 . . . . . . . . 6390 1 170 . 1 1 19 19 GLY H H 1 8.01 0.02 . 1 . . . . . . . . 6390 1 171 . 1 1 19 19 GLY CA C 13 43.9 0.1 . 1 . . . . . . . . 6390 1 172 . 1 1 19 19 GLY HA2 H 1 4.69 0.02 . 2 . . . . . . . . 6390 1 173 . 1 1 19 19 GLY HA3 H 1 3.88 0.02 . 2 . . . . . . . . 6390 1 174 . 1 1 19 19 GLY C C 13 173.6 0.1 . 1 . . . . . . . . 6390 1 175 . 1 1 20 20 SER CA C 13 60.0 0.1 . 1 . . . . . . . . 6390 1 176 . 1 1 20 20 SER HA H 1 4.14 0.02 . 1 . . . . . . . . 6390 1 177 . 1 1 20 20 SER CB C 13 62.9 0.1 . 1 . . . . . . . . 6390 1 178 . 1 1 20 20 SER HB2 H 1 3.97 0.02 . 2 . . . . . . . . 6390 1 179 . 1 1 20 20 SER HB3 H 1 3.90 0.02 . 2 . . . . . . . . 6390 1 180 . 1 1 21 21 GLY N N 15 109.6 0.1 . 1 . . . . . . . . 6390 1 181 . 1 1 21 21 GLY H H 1 8.54 0.02 . 1 . . . . . . . . 6390 1 182 . 1 1 21 21 GLY CA C 13 43.3 0.1 . 1 . . . . . . . . 6390 1 183 . 1 1 21 21 GLY HA2 H 1 4.39 0.02 . 2 . . . . . . . . 6390 1 184 . 1 1 21 21 GLY HA3 H 1 3.64 0.02 . 2 . . . . . . . . 6390 1 185 . 1 1 21 21 GLY C C 13 173.6 0.1 . 1 . . . . . . . . 6390 1 186 . 1 1 22 22 ALA N N 15 127.4 0.1 . 1 . . . . . . . . 6390 1 187 . 1 1 22 22 ALA H H 1 8.46 0.02 . 1 . . . . . . . . 6390 1 188 . 1 1 22 22 ALA CA C 13 52.4 0.1 . 1 . . . . . . . . 6390 1 189 . 1 1 22 22 ALA HA H 1 4.34 0.02 . 1 . . . . . . . . 6390 1 190 . 1 1 22 22 ALA HB1 H 1 1.47 0.02 . 1 . . . . . . . . 6390 1 191 . 1 1 22 22 ALA HB2 H 1 1.47 0.02 . 1 . . . . . . . . 6390 1 192 . 1 1 22 22 ALA HB3 H 1 1.47 0.02 . 1 . . . . . . . . 6390 1 193 . 1 1 22 22 ALA CB C 13 18.2 0.1 . 1 . . . . . . . . 6390 1 194 . 1 1 22 22 ALA C C 13 172.7 0.1 . 1 . . . . . . . . 6390 1 195 . 1 1 23 23 ASP N N 15 125.3 0.1 . 1 . . . . . . . . 6390 1 196 . 1 1 23 23 ASP H H 1 8.96 0.02 . 1 . . . . . . . . 6390 1 197 . 1 1 23 23 ASP CA C 13 54.1 0.1 . 1 . . . . . . . . 6390 1 198 . 1 1 23 23 ASP HA H 1 5.10 0.02 . 1 . . . . . . . . 6390 1 199 . 1 1 23 23 ASP CB C 13 45.4 0.1 . 1 . . . . . . . . 6390 1 200 . 1 1 23 23 ASP HB2 H 1 2.61 0.02 . 2 . . . . . . . . 6390 1 201 . 1 1 23 23 ASP C C 13 176.2 0.1 . 1 . . . . . . . . 6390 1 202 . 1 1 24 24 ARG CA C 13 54.7 0.1 . 1 . . . . . . . . 6390 1 203 . 1 1 24 24 ARG HA H 1 5.22 0.02 . 1 . . . . . . . . 6390 1 204 . 1 1 24 24 ARG CB C 13 31.3 0.1 . 1 . . . . . . . . 6390 1 205 . 1 1 24 24 ARG HB2 H 1 1.84 0.02 . 2 . . . . . . . . 6390 1 206 . 1 1 24 24 ARG HB3 H 1 1.64 0.02 . 2 . . . . . . . . 6390 1 207 . 1 1 24 24 ARG CG C 13 27.5 0.1 . 1 . . . . . . . . 6390 1 208 . 1 1 24 24 ARG HG2 H 1 1.55 0.02 . 2 . . . . . . . . 6390 1 209 . 1 1 24 24 ARG CD C 13 43.3 0.1 . 1 . . . . . . . . 6390 1 210 . 1 1 24 24 ARG HD2 H 1 3.24 0.02 . 2 . . . . . . . . 6390 1 211 . 1 1 24 24 ARG HD3 H 1 3.13 0.02 . 2 . . . . . . . . 6390 1 212 . 1 1 25 25 LEU N N 15 126.6 0.1 . 1 . . . . . . . . 6390 1 213 . 1 1 25 25 LEU H H 1 8.56 0.02 . 1 . . . . . . . . 6390 1 214 . 1 1 25 25 LEU CA C 13 54.4 0.1 . 1 . . . . . . . . 6390 1 215 . 1 1 25 25 LEU HA H 1 5.35 0.02 . 1 . . . . . . . . 6390 1 216 . 1 1 25 25 LEU CB C 13 45.1 0.1 . 1 . . . . . . . . 6390 1 217 . 1 1 25 25 LEU HB2 H 1 1.68 0.02 . 2 . . . . . . . . 6390 1 218 . 1 1 25 25 LEU HB3 H 1 1.54 0.02 . 2 . . . . . . . . 6390 1 219 . 1 1 25 25 LEU CG C 13 29.8 0.1 . 1 . . . . . . . . 6390 1 220 . 1 1 25 25 LEU HG H 1 1.73 0.02 . 1 . . . . . . . . 6390 1 221 . 1 1 25 25 LEU HD11 H 1 0.70 0.02 . 2 . . . . . . . . 6390 1 222 . 1 1 25 25 LEU HD12 H 1 0.70 0.02 . 2 . . . . . . . . 6390 1 223 . 1 1 25 25 LEU HD13 H 1 0.70 0.02 . 2 . . . . . . . . 6390 1 224 . 1 1 25 25 LEU HD21 H 1 0.68 0.02 . 2 . . . . . . . . 6390 1 225 . 1 1 25 25 LEU HD22 H 1 0.68 0.02 . 2 . . . . . . . . 6390 1 226 . 1 1 25 25 LEU HD23 H 1 0.68 0.02 . 2 . . . . . . . . 6390 1 227 . 1 1 25 25 LEU CD1 C 13 23.4 0.1 . 1 . . . . . . . . 6390 1 228 . 1 1 25 25 LEU CD2 C 13 26.9 0.1 . 1 . . . . . . . . 6390 1 229 . 1 1 25 25 LEU C C 13 174.0 0.1 . 1 . . . . . . . . 6390 1 230 . 1 1 26 26 ASP N N 15 123.1 0.1 . 1 . . . . . . . . 6390 1 231 . 1 1 26 26 ASP H H 1 8.43 0.02 . 1 . . . . . . . . 6390 1 232 . 1 1 26 26 ASP CA C 13 51.5 0.1 . 1 . . . . . . . . 6390 1 233 . 1 1 26 26 ASP HA H 1 5.71 0.02 . 1 . . . . . . . . 6390 1 234 . 1 1 26 26 ASP CB C 13 43.3 0.1 . 1 . . . . . . . . 6390 1 235 . 1 1 26 26 ASP HB2 H 1 2.76 0.02 . 2 . . . . . . . . 6390 1 236 . 1 1 26 26 ASP HB3 H 1 2.42 0.02 . 2 . . . . . . . . 6390 1 237 . 1 1 26 26 ASP C C 13 175.3 0.1 . 1 . . . . . . . . 6390 1 238 . 1 1 27 27 GLY N N 15 109.9 0.1 . 1 . . . . . . . . 6390 1 239 . 1 1 27 27 GLY H H 1 9.11 0.02 . 1 . . . . . . . . 6390 1 240 . 1 1 27 27 GLY CA C 13 46.8 0.1 . 1 . . . . . . . . 6390 1 241 . 1 1 27 27 GLY HA2 H 1 3.73 0.02 . 2 . . . . . . . . 6390 1 242 . 1 1 27 27 GLY HA3 H 1 3.57 0.02 . 2 . . . . . . . . 6390 1 243 . 1 1 28 28 GLY N N 15 110.8 0.1 . 1 . . . . . . . . 6390 1 244 . 1 1 28 28 GLY H H 1 8.13 0.02 . 1 . . . . . . . . 6390 1 245 . 1 1 28 28 GLY CA C 13 44.2 0.1 . 1 . . . . . . . . 6390 1 246 . 1 1 28 28 GLY HA2 H 1 3.99 0.02 . 2 . . . . . . . . 6390 1 247 . 1 1 28 28 GLY HA3 H 1 3.83 0.02 . 2 . . . . . . . . 6390 1 248 . 1 1 28 28 GLY C C 13 175.0 0.1 . 1 . . . . . . . . 6390 1 249 . 1 1 29 29 ALA N N 15 125.7 0.1 . 1 . . . . . . . . 6390 1 250 . 1 1 29 29 ALA H H 1 8.96 0.02 . 1 . . . . . . . . 6390 1 251 . 1 1 29 29 ALA CA C 13 52.3 0.1 . 1 . . . . . . . . 6390 1 252 . 1 1 29 29 ALA HA H 1 4.37 0.02 . 1 . . . . . . . . 6390 1 253 . 1 1 29 29 ALA HB1 H 1 1.48 0.02 . 1 . . . . . . . . 6390 1 254 . 1 1 29 29 ALA HB2 H 1 1.48 0.02 . 1 . . . . . . . . 6390 1 255 . 1 1 29 29 ALA HB3 H 1 1.48 0.02 . 1 . . . . . . . . 6390 1 256 . 1 1 29 29 ALA CB C 13 17.8 0.1 . 1 . . . . . . . . 6390 1 257 . 1 1 29 29 ALA C C 13 173.4 0.1 . 1 . . . . . . . . 6390 1 258 . 1 1 30 30 GLY N N 15 110.7 0.1 . 1 . . . . . . . . 6390 1 259 . 1 1 30 30 GLY H H 1 8.58 0.02 . 1 . . . . . . . . 6390 1 260 . 1 1 30 30 GLY CA C 13 43.6 0.1 . 1 . . . . . . . . 6390 1 261 . 1 1 30 30 GLY HA2 H 1 4.09 0.02 . 2 . . . . . . . . 6390 1 262 . 1 1 30 30 GLY HA3 H 1 3.69 0.02 . 2 . . . . . . . . 6390 1 263 . 1 1 30 30 GLY C C 13 175.5 0.1 . 1 . . . . . . . . 6390 1 264 . 1 1 31 31 ASP N N 15 126.9 0.1 . 1 . . . . . . . . 6390 1 265 . 1 1 31 31 ASP H H 1 8.80 0.02 . 1 . . . . . . . . 6390 1 266 . 1 1 31 31 ASP CA C 13 53.8 0.1 . 1 . . . . . . . . 6390 1 267 . 1 1 31 31 ASP HA H 1 4.16 0.02 . 1 . . . . . . . . 6390 1 268 . 1 1 31 31 ASP CB C 13 39.2 0.1 . 1 . . . . . . . . 6390 1 269 . 1 1 31 31 ASP HB2 H 1 2.67 0.02 . 2 . . . . . . . . 6390 1 270 . 1 1 31 31 ASP HB3 H 1 2.57 0.02 . 2 . . . . . . . . 6390 1 271 . 1 1 31 31 ASP C C 13 172.2 0.1 . 1 . . . . . . . . 6390 1 272 . 1 1 32 32 ASP N N 15 123.1 0.1 . 1 . . . . . . . . 6390 1 273 . 1 1 32 32 ASP H H 1 8.88 0.02 . 1 . . . . . . . . 6390 1 274 . 1 1 32 32 ASP CA C 13 53.6 0.1 . 1 . . . . . . . . 6390 1 275 . 1 1 32 32 ASP HA H 1 5.42 0.02 . 1 . . . . . . . . 6390 1 276 . 1 1 32 32 ASP CB C 13 44.2 0.1 . 1 . . . . . . . . 6390 1 277 . 1 1 32 32 ASP HB2 H 1 2.60 0.02 . 2 . . . . . . . . 6390 1 278 . 1 1 32 32 ASP HB3 H 1 2.43 0.02 . 2 . . . . . . . . 6390 1 279 . 1 1 32 32 ASP C C 13 173.8 0.1 . 1 . . . . . . . . 6390 1 280 . 1 1 33 33 ILE N N 15 122.9 0.1 . 1 . . . . . . . . 6390 1 281 . 1 1 33 33 ILE H H 1 8.80 0.02 . 1 . . . . . . . . 6390 1 282 . 1 1 33 33 ILE CA C 13 60.6 0.1 . 1 . . . . . . . . 6390 1 283 . 1 1 33 33 ILE HA H 1 4.63 0.02 . 1 . . . . . . . . 6390 1 284 . 1 1 33 33 ILE CB C 13 40.1 0.1 . 1 . . . . . . . . 6390 1 285 . 1 1 33 33 ILE HB H 1 1.61 0.02 . 1 . . . . . . . . 6390 1 286 . 1 1 33 33 ILE HG21 H 1 0.24 0.02 . 1 . . . . . . . . 6390 1 287 . 1 1 33 33 ILE HG22 H 1 0.24 0.02 . 1 . . . . . . . . 6390 1 288 . 1 1 33 33 ILE HG23 H 1 0.24 0.02 . 1 . . . . . . . . 6390 1 289 . 1 1 33 33 ILE CG2 C 13 16.9 0.1 . 1 . . . . . . . . 6390 1 290 . 1 1 33 33 ILE CG1 C 13 18.1 0.1 . 1 . . . . . . . . 6390 1 291 . 1 1 33 33 ILE HG12 H 1 0.81 0.02 . 2 . . . . . . . . 6390 1 292 . 1 1 33 33 ILE HD11 H 1 0.51 0.02 . 1 . . . . . . . . 6390 1 293 . 1 1 33 33 ILE HD12 H 1 0.51 0.02 . 1 . . . . . . . . 6390 1 294 . 1 1 33 33 ILE HD13 H 1 0.51 0.02 . 1 . . . . . . . . 6390 1 295 . 1 1 33 33 ILE CD1 C 13 13.1 0.1 . 1 . . . . . . . . 6390 1 296 . 1 1 33 33 ILE C C 13 174.6 0.1 . 1 . . . . . . . . 6390 1 297 . 1 1 34 34 LEU N N 15 127.7 0.1 . 1 . . . . . . . . 6390 1 298 . 1 1 34 34 LEU H H 1 8.73 0.02 . 1 . . . . . . . . 6390 1 299 . 1 1 34 34 LEU CA C 13 54.7 0.1 . 1 . . . . . . . . 6390 1 300 . 1 1 34 34 LEU HA H 1 5.01 0.02 . 1 . . . . . . . . 6390 1 301 . 1 1 34 34 LEU CB C 13 45.4 0.1 . 1 . . . . . . . . 6390 1 302 . 1 1 34 34 LEU HB2 H 1 1.60 0.02 . 2 . . . . . . . . 6390 1 303 . 1 1 34 34 LEU HB3 H 1 1.45 0.02 . 2 . . . . . . . . 6390 1 304 . 1 1 34 34 LEU CG C 13 29.5 0.1 . 1 . . . . . . . . 6390 1 305 . 1 1 34 34 LEU HG H 1 1.50 0.02 . 1 . . . . . . . . 6390 1 306 . 1 1 34 34 LEU HD11 H 1 0.79 0.02 . 2 . . . . . . . . 6390 1 307 . 1 1 34 34 LEU HD12 H 1 0.79 0.02 . 2 . . . . . . . . 6390 1 308 . 1 1 34 34 LEU HD13 H 1 0.79 0.02 . 2 . . . . . . . . 6390 1 309 . 1 1 34 34 LEU HD21 H 1 0.58 0.02 . 2 . . . . . . . . 6390 1 310 . 1 1 34 34 LEU HD22 H 1 0.58 0.02 . 2 . . . . . . . . 6390 1 311 . 1 1 34 34 LEU HD23 H 1 0.58 0.02 . 2 . . . . . . . . 6390 1 312 . 1 1 34 34 LEU CD1 C 13 28.4 0.1 . 1 . . . . . . . . 6390 1 313 . 1 1 34 34 LEU CD2 C 13 26.0 0.1 . 1 . . . . . . . . 6390 1 314 . 1 1 34 34 LEU C C 13 174.6 0.1 . 1 . . . . . . . . 6390 1 315 . 1 1 35 35 ASP N N 15 121.0 0.1 . 1 . . . . . . . . 6390 1 316 . 1 1 35 35 ASP H H 1 7.79 0.02 . 1 . . . . . . . . 6390 1 317 . 1 1 35 35 ASP CA C 13 52.1 0.1 . 1 . . . . . . . . 6390 1 318 . 1 1 35 35 ASP HA H 1 5.02 0.02 . 1 . . . . . . . . 6390 1 319 . 1 1 35 35 ASP CB C 13 43.0 0.1 . 1 . . . . . . . . 6390 1 320 . 1 1 35 35 ASP HB2 H 1 2.86 0.02 . 2 . . . . . . . . 6390 1 321 . 1 1 35 35 ASP HB3 H 1 2.27 0.02 . 2 . . . . . . . . 6390 1 322 . 1 1 35 35 ASP C C 13 174.1 0.1 . 1 . . . . . . . . 6390 1 323 . 1 1 36 36 GLY N N 15 111.6 0.1 . 1 . . . . . . . . 6390 1 324 . 1 1 36 36 GLY H H 1 9.46 0.02 . 1 . . . . . . . . 6390 1 325 . 1 1 36 36 GLY CA C 13 46.5 0.1 . 1 . . . . . . . . 6390 1 326 . 1 1 36 36 GLY HA2 H 1 3.80 0.02 . 2 . . . . . . . . 6390 1 327 . 1 1 36 36 GLY HA3 H 1 3.61 0.02 . 2 . . . . . . . . 6390 1 328 . 1 1 36 36 GLY C C 13 177.1 0.1 . 1 . . . . . . . . 6390 1 329 . 1 1 37 37 GLY N N 15 113.3 0.1 . 1 . . . . . . . . 6390 1 330 . 1 1 37 37 GLY H H 1 8.96 0.02 . 1 . . . . . . . . 6390 1 331 . 1 1 37 37 GLY CA C 13 44.2 0.1 . 1 . . . . . . . . 6390 1 332 . 1 1 37 37 GLY HA2 H 1 3.87 0.02 . 2 . . . . . . . . 6390 1 333 . 1 1 37 37 GLY HA3 H 1 3.80 0.02 . 2 . . . . . . . . 6390 1 334 . 1 1 37 37 GLY C C 13 174.5 0.1 . 1 . . . . . . . . 6390 1 335 . 1 1 38 38 ALA N N 15 127.7 0.1 . 1 . . . . . . . . 6390 1 336 . 1 1 38 38 ALA H H 1 8.81 0.02 . 1 . . . . . . . . 6390 1 337 . 1 1 38 38 ALA CA C 13 52.9 0.1 . 1 . . . . . . . . 6390 1 338 . 1 1 38 38 ALA HA H 1 4.46 0.02 . 1 . . . . . . . . 6390 1 339 . 1 1 38 38 ALA HB1 H 1 1.52 0.02 . 1 . . . . . . . . 6390 1 340 . 1 1 38 38 ALA HB2 H 1 1.52 0.02 . 1 . . . . . . . . 6390 1 341 . 1 1 38 38 ALA HB3 H 1 1.52 0.02 . 1 . . . . . . . . 6390 1 342 . 1 1 38 38 ALA CB C 13 18.7 0.1 . 1 . . . . . . . . 6390 1 343 . 1 1 38 38 ALA C C 13 173.0 0.1 . 1 . . . . . . . . 6390 1 344 . 1 1 39 39 GLY N N 15 109.9 0.1 . 1 . . . . . . . . 6390 1 345 . 1 1 39 39 GLY H H 1 9.11 0.02 . 1 . . . . . . . . 6390 1 346 . 1 1 39 39 GLY CA C 13 43.9 0.1 . 1 . . . . . . . . 6390 1 347 . 1 1 39 39 GLY HA2 H 1 4.06 0.02 . 2 . . . . . . . . 6390 1 348 . 1 1 39 39 GLY HA3 H 1 3.80 0.02 . 2 . . . . . . . . 6390 1 349 . 1 1 39 39 GLY C C 13 176.2 0.1 . 1 . . . . . . . . 6390 1 350 . 1 1 40 40 ARG N N 15 121.9 0.1 . 1 . . . . . . . . 6390 1 351 . 1 1 40 40 ARG H H 1 8.65 0.02 . 1 . . . . . . . . 6390 1 352 . 1 1 40 40 ARG CA C 13 55.9 0.1 . 1 . . . . . . . . 6390 1 353 . 1 1 40 40 ARG HA H 1 4.34 0.02 . 1 . . . . . . . . 6390 1 354 . 1 1 40 40 ARG CB C 13 30.7 0.1 . 1 . . . . . . . . 6390 1 355 . 1 1 40 40 ARG HB2 H 1 1.85 0.02 . 2 . . . . . . . . 6390 1 356 . 1 1 40 40 ARG HB3 H 1 1.74 0.02 . 2 . . . . . . . . 6390 1 357 . 1 1 40 40 ARG CG C 13 28.3 0.1 . 1 . . . . . . . . 6390 1 358 . 1 1 40 40 ARG HG2 H 1 1.66 0.02 . 2 . . . . . . . . 6390 1 359 . 1 1 40 40 ARG HG3 H 1 1.71 0.02 . 2 . . . . . . . . 6390 1 360 . 1 1 40 40 ARG CD C 13 43.3 0.1 . 1 . . . . . . . . 6390 1 361 . 1 1 40 40 ARG HD2 H 1 3.23 0.02 . 2 . . . . . . . . 6390 1 362 . 1 1 40 40 ARG HD3 H 1 3.16 0.02 . 2 . . . . . . . . 6390 1 363 . 1 1 40 40 ARG C C 13 173.1 0.1 . 1 . . . . . . . . 6390 1 364 . 1 1 41 41 ASP N N 15 125.7 0.1 . 1 . . . . . . . . 6390 1 365 . 1 1 41 41 ASP H H 1 9.10 0.02 . 1 . . . . . . . . 6390 1 366 . 1 1 41 41 ASP CA C 13 53.0 0.1 . 1 . . . . . . . . 6390 1 367 . 1 1 41 41 ASP HA H 1 5.72 0.02 . 1 . . . . . . . . 6390 1 368 . 1 1 41 41 ASP CB C 13 45.1 0.1 . 1 . . . . . . . . 6390 1 369 . 1 1 41 41 ASP HB2 H 1 2.62 0.02 . 2 . . . . . . . . 6390 1 370 . 1 1 41 41 ASP HB3 H 1 2.51 0.02 . 2 . . . . . . . . 6390 1 371 . 1 1 41 41 ASP C C 13 174.3 0.1 . 1 . . . . . . . . 6390 1 372 . 1 1 42 42 ARG N N 15 123.0 0.1 . 1 . . . . . . . . 6390 1 373 . 1 1 42 42 ARG H H 1 8.75 0.02 . 1 . . . . . . . . 6390 1 374 . 1 1 42 42 ARG CA C 13 55.3 0.1 . 1 . . . . . . . . 6390 1 375 . 1 1 42 42 ARG HA H 1 5.14 0.02 . 1 . . . . . . . . 6390 1 376 . 1 1 42 42 ARG CB C 13 33.0 0.1 . 1 . . . . . . . . 6390 1 377 . 1 1 42 42 ARG HB2 H 1 1.82 0.02 . 2 . . . . . . . . 6390 1 378 . 1 1 42 42 ARG HB3 H 1 1.72 0.02 . 2 . . . . . . . . 6390 1 379 . 1 1 42 42 ARG C C 13 175.2 0.1 . 1 . . . . . . . . 6390 1 380 . 1 1 43 43 LEU N N 15 124.3 0.1 . 1 . . . . . . . . 6390 1 381 . 1 1 43 43 LEU H H 1 9.06 0.02 . 1 . . . . . . . . 6390 1 382 . 1 1 43 43 LEU CA C 13 54.4 0.1 . 1 . . . . . . . . 6390 1 383 . 1 1 43 43 LEU HA H 1 5.14 0.02 . 1 . . . . . . . . 6390 1 384 . 1 1 43 43 LEU CB C 13 45.3 0.1 . 1 . . . . . . . . 6390 1 385 . 1 1 43 43 LEU HB2 H 1 2.06 0.02 . 2 . . . . . . . . 6390 1 386 . 1 1 43 43 LEU HB3 H 1 1.65 0.02 . 2 . . . . . . . . 6390 1 387 . 1 1 43 43 LEU CG C 13 27.5 0.1 . 1 . . . . . . . . 6390 1 388 . 1 1 43 43 LEU HG H 1 1.69 0.02 . 1 . . . . . . . . 6390 1 389 . 1 1 43 43 LEU HD11 H 1 1.12 0.02 . 2 . . . . . . . . 6390 1 390 . 1 1 43 43 LEU HD12 H 1 1.12 0.02 . 2 . . . . . . . . 6390 1 391 . 1 1 43 43 LEU HD13 H 1 1.12 0.02 . 2 . . . . . . . . 6390 1 392 . 1 1 43 43 LEU CD1 C 13 26.6 0.1 . 1 . . . . . . . . 6390 1 393 . 1 1 43 43 LEU C C 13 175.3 0.1 . 1 . . . . . . . . 6390 1 394 . 1 1 44 44 SER N N 15 119.9 0.1 . 1 . . . . . . . . 6390 1 395 . 1 1 44 44 SER H H 1 8.93 0.02 . 1 . . . . . . . . 6390 1 396 . 1 1 44 44 SER CA C 13 55.9 0.1 . 1 . . . . . . . . 6390 1 397 . 1 1 44 44 SER HA H 1 5.38 0.02 . 1 . . . . . . . . 6390 1 398 . 1 1 44 44 SER CB C 13 64.1 0.1 . 1 . . . . . . . . 6390 1 399 . 1 1 44 44 SER HB2 H 1 3.88 0.02 . 2 . . . . . . . . 6390 1 400 . 1 1 44 44 SER C C 13 174.4 0.1 . 1 . . . . . . . . 6390 1 401 . 1 1 45 45 GLY N N 15 119.4 0.1 . 1 . . . . . . . . 6390 1 402 . 1 1 45 45 GLY H H 1 11.76 0.02 . 1 . . . . . . . . 6390 1 403 . 1 1 45 45 GLY CA C 13 46.5 0.1 . 1 . . . . . . . . 6390 1 404 . 1 1 45 45 GLY HA2 H 1 4.01 0.02 . 2 . . . . . . . . 6390 1 405 . 1 1 45 45 GLY HA3 H 1 3.70 0.02 . 2 . . . . . . . . 6390 1 406 . 1 1 45 45 GLY C C 13 174.3 0.1 . 1 . . . . . . . . 6390 1 407 . 1 1 46 46 GLY N N 15 114.6 0.1 . 1 . . . . . . . . 6390 1 408 . 1 1 46 46 GLY H H 1 10.46 0.02 . 1 . . . . . . . . 6390 1 409 . 1 1 46 46 GLY CA C 13 44.0 0.1 . 1 . . . . . . . . 6390 1 410 . 1 1 46 46 GLY HA2 H 1 4.12 0.02 . 2 . . . . . . . . 6390 1 411 . 1 1 46 46 GLY HA3 H 1 3.77 0.02 . 2 . . . . . . . . 6390 1 412 . 1 1 46 46 GLY C C 13 176.1 0.1 . 1 . . . . . . . . 6390 1 413 . 1 1 47 47 ALA N N 15 125.1 0.1 . 1 . . . . . . . . 6390 1 414 . 1 1 47 47 ALA H H 1 8.52 0.02 . 1 . . . . . . . . 6390 1 415 . 1 1 47 47 ALA CA C 13 52.7 0.1 . 1 . . . . . . . . 6390 1 416 . 1 1 47 47 ALA HA H 1 4.43 0.02 . 1 . . . . . . . . 6390 1 417 . 1 1 47 47 ALA HB1 H 1 1.40 0.02 . 1 . . . . . . . . 6390 1 418 . 1 1 47 47 ALA HB2 H 1 1.40 0.02 . 1 . . . . . . . . 6390 1 419 . 1 1 47 47 ALA HB3 H 1 1.40 0.02 . 1 . . . . . . . . 6390 1 420 . 1 1 47 47 ALA CB C 13 18.5 0.1 . 1 . . . . . . . . 6390 1 421 . 1 1 47 47 ALA C C 13 173.8 0.1 . 1 . . . . . . . . 6390 1 422 . 1 1 48 48 GLY N N 15 113.1 0.1 . 1 . . . . . . . . 6390 1 423 . 1 1 48 48 GLY H H 1 9.04 0.02 . 1 . . . . . . . . 6390 1 424 . 1 1 48 48 GLY CA C 13 43.6 0.1 . 1 . . . . . . . . 6390 1 425 . 1 1 48 48 GLY HA2 H 1 4.32 0.02 . 2 . . . . . . . . 6390 1 426 . 1 1 48 48 GLY HA3 H 1 3.61 0.02 . 2 . . . . . . . . 6390 1 427 . 1 1 48 48 GLY C C 13 177.5 0.1 . 1 . . . . . . . . 6390 1 428 . 1 1 49 49 ALA N N 15 127.3 0.1 . 1 . . . . . . . . 6390 1 429 . 1 1 49 49 ALA H H 1 8.62 0.02 . 1 . . . . . . . . 6390 1 430 . 1 1 49 49 ALA CA C 13 51.5 0.1 . 1 . . . . . . . . 6390 1 431 . 1 1 49 49 ALA HA H 1 4.14 0.02 . 1 . . . . . . . . 6390 1 432 . 1 1 49 49 ALA HB1 H 1 1.20 0.02 . 1 . . . . . . . . 6390 1 433 . 1 1 49 49 ALA HB2 H 1 1.20 0.02 . 1 . . . . . . . . 6390 1 434 . 1 1 49 49 ALA HB3 H 1 1.20 0.02 . 1 . . . . . . . . 6390 1 435 . 1 1 49 49 ALA CB C 13 18.1 0.1 . 1 . . . . . . . . 6390 1 436 . 1 1 49 49 ALA C C 13 172.6 0.1 . 1 . . . . . . . . 6390 1 437 . 1 1 50 50 ASP N N 15 124.3 0.1 . 1 . . . . . . . . 6390 1 438 . 1 1 50 50 ASP H H 1 8.63 0.02 . 1 . . . . . . . . 6390 1 439 . 1 1 50 50 ASP CA C 13 53.6 0.1 . 1 . . . . . . . . 6390 1 440 . 1 1 50 50 ASP HA H 1 5.37 0.02 . 1 . . . . . . . . 6390 1 441 . 1 1 50 50 ASP CB C 13 43.6 0.1 . 1 . . . . . . . . 6390 1 442 . 1 1 50 50 ASP HB2 H 1 2.05 0.02 . 2 . . . . . . . . 6390 1 443 . 1 1 50 50 ASP HB3 H 1 1.93 0.02 . 2 . . . . . . . . 6390 1 444 . 1 1 50 50 ASP C C 13 174.7 0.1 . 1 . . . . . . . . 6390 1 445 . 1 1 51 51 THR N N 15 118.3 0.1 . 1 . . . . . . . . 6390 1 446 . 1 1 51 51 THR H H 1 8.81 0.02 . 1 . . . . . . . . 6390 1 447 . 1 1 51 51 THR CA C 13 61.5 0.1 . 1 . . . . . . . . 6390 1 448 . 1 1 51 51 THR HA H 1 5.01 0.02 . 1 . . . . . . . . 6390 1 449 . 1 1 51 51 THR CB C 13 70.2 0.1 . 1 . . . . . . . . 6390 1 450 . 1 1 51 51 THR HB H 1 3.91 0.02 . 1 . . . . . . . . 6390 1 451 . 1 1 51 51 THR HG21 H 1 1.08 0.02 . 1 . . . . . . . . 6390 1 452 . 1 1 51 51 THR HG22 H 1 1.08 0.02 . 1 . . . . . . . . 6390 1 453 . 1 1 51 51 THR HG23 H 1 1.08 0.02 . 1 . . . . . . . . 6390 1 454 . 1 1 51 51 THR CG2 C 13 21.3 0.1 . 1 . . . . . . . . 6390 1 455 . 1 1 51 51 THR C C 13 174.7 0.1 . 1 . . . . . . . . 6390 1 456 . 1 1 52 52 PHE N N 15 127.7 0.1 . 1 . . . . . . . . 6390 1 457 . 1 1 52 52 PHE H H 1 8.94 0.02 . 1 . . . . . . . . 6390 1 458 . 1 1 52 52 PHE CA C 13 56.5 0.1 . 1 . . . . . . . . 6390 1 459 . 1 1 52 52 PHE HA H 1 4.93 0.02 . 1 . . . . . . . . 6390 1 460 . 1 1 52 52 PHE CB C 13 39.8 0.1 . 1 . . . . . . . . 6390 1 461 . 1 1 52 52 PHE HB2 H 1 3.28 0.02 . 2 . . . . . . . . 6390 1 462 . 1 1 52 52 PHE HB3 H 1 2.92 0.02 . 2 . . . . . . . . 6390 1 463 . 1 1 52 52 PHE HD1 H 1 7.37 0.02 . 1 . . . . . . . . 6390 1 464 . 1 1 52 52 PHE HE1 H 1 7.60 0.02 . 1 . . . . . . . . 6390 1 465 . 1 1 52 52 PHE HZ H 1 7.24 0.02 . 1 . . . . . . . . 6390 1 466 . 1 1 52 52 PHE C C 13 172.4 0.1 . 1 . . . . . . . . 6390 1 467 . 1 1 53 53 VAL N N 15 127.8 0.1 . 1 . . . . . . . . 6390 1 468 . 1 1 53 53 VAL H H 1 9.22 0.02 . 1 . . . . . . . . 6390 1 469 . 1 1 53 53 VAL CA C 13 62.3 0.1 . 1 . . . . . . . . 6390 1 470 . 1 1 53 53 VAL HA H 1 4.42 0.02 . 1 . . . . . . . . 6390 1 471 . 1 1 53 53 VAL CB C 13 33.9 0.1 . 1 . . . . . . . . 6390 1 472 . 1 1 53 53 VAL HB H 1 1.79 0.02 . 1 . . . . . . . . 6390 1 473 . 1 1 53 53 VAL HG11 H 1 0.88 0.02 . 2 . . . . . . . . 6390 1 474 . 1 1 53 53 VAL HG12 H 1 0.88 0.02 . 2 . . . . . . . . 6390 1 475 . 1 1 53 53 VAL HG13 H 1 0.88 0.02 . 2 . . . . . . . . 6390 1 476 . 1 1 53 53 VAL HG21 H 1 0.81 0.02 . 2 . . . . . . . . 6390 1 477 . 1 1 53 53 VAL HG22 H 1 0.81 0.02 . 2 . . . . . . . . 6390 1 478 . 1 1 53 53 VAL HG23 H 1 0.81 0.02 . 2 . . . . . . . . 6390 1 479 . 1 1 53 53 VAL CG1 C 13 22.5 0.1 . 1 . . . . . . . . 6390 1 480 . 1 1 53 53 VAL CG2 C 13 21.6 0.1 . 1 . . . . . . . . 6390 1 481 . 1 1 53 53 VAL C C 13 173.8 0.1 . 1 . . . . . . . . 6390 1 482 . 1 1 54 54 PHE N N 15 123.6 0.1 . 1 . . . . . . . . 6390 1 483 . 1 1 54 54 PHE H H 1 7.47 0.02 . 1 . . . . . . . . 6390 1 484 . 1 1 54 54 PHE CA C 13 56.5 0.1 . 1 . . . . . . . . 6390 1 485 . 1 1 54 54 PHE HA H 1 4.91 0.02 . 1 . . . . . . . . 6390 1 486 . 1 1 54 54 PHE CB C 13 41.3 0.1 . 1 . . . . . . . . 6390 1 487 . 1 1 54 54 PHE HB2 H 1 2.99 0.02 . 2 . . . . . . . . 6390 1 488 . 1 1 54 54 PHE HD1 H 1 7.33 0.02 . 1 . . . . . . . . 6390 1 489 . 1 1 54 54 PHE HE1 H 1 7.59 0.02 . 1 . . . . . . . . 6390 1 490 . 1 1 54 54 PHE C C 13 173.9 0.1 . 1 . . . . . . . . 6390 1 491 . 1 1 55 55 SER N N 15 122.2 0.1 . 1 . . . . . . . . 6390 1 492 . 1 1 55 55 SER H H 1 9.64 0.02 . 1 . . . . . . . . 6390 1 493 . 1 1 55 55 SER CA C 13 60.9 0.1 . 1 . . . . . . . . 6390 1 494 . 1 1 55 55 SER HA H 1 4.15 0.02 . 1 . . . . . . . . 6390 1 495 . 1 1 55 55 SER CB C 13 63.5 0.1 . 1 . . . . . . . . 6390 1 496 . 1 1 55 55 SER HB2 H 1 3.86 0.02 . 2 . . . . . . . . 6390 1 497 . 1 1 55 55 SER HB3 H 1 3.73 0.02 . 2 . . . . . . . . 6390 1 498 . 1 1 55 55 SER C C 13 176.3 0.1 . 1 . . . . . . . . 6390 1 499 . 1 1 56 56 ALA N N 15 122.2 0.1 . 1 . . . . . . . . 6390 1 500 . 1 1 56 56 ALA H H 1 7.15 0.02 . 1 . . . . . . . . 6390 1 501 . 1 1 56 56 ALA CA C 13 51.5 0.1 . 1 . . . . . . . . 6390 1 502 . 1 1 56 56 ALA HA H 1 4.32 0.02 . 1 . . . . . . . . 6390 1 503 . 1 1 56 56 ALA HB1 H 1 1.26 0.02 . 1 . . . . . . . . 6390 1 504 . 1 1 56 56 ALA HB2 H 1 1.26 0.02 . 1 . . . . . . . . 6390 1 505 . 1 1 56 56 ALA HB3 H 1 1.26 0.02 . 1 . . . . . . . . 6390 1 506 . 1 1 56 56 ALA CB C 13 20.7 0.1 . 1 . . . . . . . . 6390 1 507 . 1 1 56 56 ALA C C 13 172.6 0.1 . 1 . . . . . . . . 6390 1 508 . 1 1 57 57 ARG N N 15 125.2 0.1 . 1 . . . . . . . . 6390 1 509 . 1 1 57 57 ARG H H 1 9.31 0.02 . 1 . . . . . . . . 6390 1 510 . 1 1 57 57 ARG CA C 13 60.3 0.1 . 1 . . . . . . . . 6390 1 511 . 1 1 57 57 ARG HA H 1 4.26 0.02 . 1 . . . . . . . . 6390 1 512 . 1 1 57 57 ARG CB C 13 29.8 0.1 . 1 . . . . . . . . 6390 1 513 . 1 1 57 57 ARG HB2 H 1 1.98 0.02 . 2 . . . . . . . . 6390 1 514 . 1 1 57 57 ARG NE N 15 111.9 0.1 . 1 . . . . . . . . 6390 1 515 . 1 1 57 57 ARG HE H 1 5.96 0.02 . 1 . . . . . . . . 6390 1 516 . 1 1 57 57 ARG C C 13 178.0 0.1 . 1 . . . . . . . . 6390 1 517 . 1 1 58 58 GLU N N 15 112.4 0.1 . 1 . . . . . . . . 6390 1 518 . 1 1 58 58 GLU H H 1 9.14 0.02 . 1 . . . . . . . . 6390 1 519 . 1 1 58 58 GLU CA C 13 56.8 0.1 . 1 . . . . . . . . 6390 1 520 . 1 1 58 58 GLU HA H 1 3.92 0.02 . 1 . . . . . . . . 6390 1 521 . 1 1 58 58 GLU CB C 13 26.6 0.1 . 1 . . . . . . . . 6390 1 522 . 1 1 58 58 GLU HB2 H 1 1.96 0.02 . 2 . . . . . . . . 6390 1 523 . 1 1 58 58 GLU HB3 H 1 1.64 0.02 . 2 . . . . . . . . 6390 1 524 . 1 1 58 58 GLU CG C 13 35.7 0.1 . 1 . . . . . . . . 6390 1 525 . 1 1 58 58 GLU HG2 H 1 2.13 0.02 . 2 . . . . . . . . 6390 1 526 . 1 1 58 58 GLU C C 13 177.5 0.1 . 1 . . . . . . . . 6390 1 527 . 1 1 59 59 ASP N N 15 120.6 0.1 . 1 . . . . . . . . 6390 1 528 . 1 1 59 59 ASP H H 1 7.54 0.02 . 1 . . . . . . . . 6390 1 529 . 1 1 59 59 ASP CA C 13 55.6 0.1 . 1 . . . . . . . . 6390 1 530 . 1 1 59 59 ASP HA H 1 4.82 0.02 . 1 . . . . . . . . 6390 1 531 . 1 1 59 59 ASP CB C 13 39.2 0.1 . 1 . . . . . . . . 6390 1 532 . 1 1 59 59 ASP HB2 H 1 3.20 0.02 . 2 . . . . . . . . 6390 1 533 . 1 1 59 59 ASP HB3 H 1 2.99 0.02 . 2 . . . . . . . . 6390 1 534 . 1 1 59 59 ASP C C 13 174.8 0.1 . 1 . . . . . . . . 6390 1 535 . 1 1 60 60 SER N N 15 118.5 0.1 . 1 . . . . . . . . 6390 1 536 . 1 1 60 60 SER H H 1 7.42 0.02 . 1 . . . . . . . . 6390 1 537 . 1 1 60 60 SER CA C 13 59.1 0.1 . 1 . . . . . . . . 6390 1 538 . 1 1 60 60 SER HA H 1 4.80 0.02 . 1 . . . . . . . . 6390 1 539 . 1 1 60 60 SER CB C 13 62.0 0.1 . 1 . . . . . . . . 6390 1 540 . 1 1 60 60 SER HB2 H 1 4.09 0.02 . 2 . . . . . . . . 6390 1 541 . 1 1 60 60 SER HB3 H 1 4.02 0.02 . 2 . . . . . . . . 6390 1 542 . 1 1 60 60 SER C C 13 179.4 0.1 . 1 . . . . . . . . 6390 1 543 . 1 1 61 61 TYR N N 15 122.7 0.1 . 1 . . . . . . . . 6390 1 544 . 1 1 61 61 TYR H H 1 7.12 0.02 . 1 . . . . . . . . 6390 1 545 . 1 1 61 61 TYR CA C 13 56.5 0.1 . 1 . . . . . . . . 6390 1 546 . 1 1 61 61 TYR HA H 1 5.79 0.02 . 1 . . . . . . . . 6390 1 547 . 1 1 61 61 TYR CB C 13 41.6 0.1 . 1 . . . . . . . . 6390 1 548 . 1 1 61 61 TYR HB2 H 1 3.17 0.02 . 2 . . . . . . . . 6390 1 549 . 1 1 61 61 TYR HB3 H 1 2.91 0.02 . 2 . . . . . . . . 6390 1 550 . 1 1 61 61 TYR HD1 H 1 6.79 0.02 . 1 . . . . . . . . 6390 1 551 . 1 1 61 61 TYR HE1 H 1 6.76 0.02 . 1 . . . . . . . . 6390 1 552 . 1 1 61 61 TYR C C 13 170.8 0.1 . 1 . . . . . . . . 6390 1 553 . 1 1 62 62 ARG N N 15 116.7 0.1 . 1 . . . . . . . . 6390 1 554 . 1 1 62 62 ARG H H 1 9.50 0.02 . 1 . . . . . . . . 6390 1 555 . 1 1 62 62 ARG CA C 13 55.0 0.1 . 1 . . . . . . . . 6390 1 556 . 1 1 62 62 ARG HA H 1 4.93 0.02 . 1 . . . . . . . . 6390 1 557 . 1 1 62 62 ARG CB C 13 34.5 0.1 . 1 . . . . . . . . 6390 1 558 . 1 1 62 62 ARG HB2 H 1 2.32 0.02 . 2 . . . . . . . . 6390 1 559 . 1 1 62 62 ARG HB3 H 1 1.79 0.02 . 2 . . . . . . . . 6390 1 560 . 1 1 62 62 ARG C C 13 172.7 0.1 . 1 . . . . . . . . 6390 1 561 . 1 1 63 63 THR N N 15 113.5 0.1 . 1 . . . . . . . . 6390 1 562 . 1 1 63 63 THR H H 1 9.03 0.02 . 1 . . . . . . . . 6390 1 563 . 1 1 63 63 THR CA C 13 59.4 0.1 . 1 . . . . . . . . 6390 1 564 . 1 1 63 63 THR HA H 1 5.37 0.02 . 1 . . . . . . . . 6390 1 565 . 1 1 63 63 THR CB C 13 71.4 0.1 . 1 . . . . . . . . 6390 1 566 . 1 1 63 63 THR HB H 1 4.93 0.02 . 1 . . . . . . . . 6390 1 567 . 1 1 63 63 THR HG21 H 1 1.47 0.02 . 1 . . . . . . . . 6390 1 568 . 1 1 63 63 THR HG22 H 1 1.47 0.02 . 1 . . . . . . . . 6390 1 569 . 1 1 63 63 THR HG23 H 1 1.47 0.02 . 1 . . . . . . . . 6390 1 570 . 1 1 63 63 THR CG2 C 13 22.2 0.1 . 1 . . . . . . . . 6390 1 571 . 1 1 63 63 THR C C 13 174.5 0.1 . 1 . . . . . . . . 6390 1 572 . 1 1 64 64 ASP N N 15 118.9 0.1 . 1 . . . . . . . . 6390 1 573 . 1 1 64 64 ASP H H 1 9.11 0.02 . 1 . . . . . . . . 6390 1 574 . 1 1 64 64 ASP CA C 13 57.1 0.1 . 1 . . . . . . . . 6390 1 575 . 1 1 64 64 ASP HA H 1 4.54 0.02 . 1 . . . . . . . . 6390 1 576 . 1 1 64 64 ASP CB C 13 40.1 0.1 . 1 . . . . . . . . 6390 1 577 . 1 1 64 64 ASP HB2 H 1 2.86 0.02 . 2 . . . . . . . . 6390 1 578 . 1 1 64 64 ASP HB3 H 1 2.79 0.02 . 2 . . . . . . . . 6390 1 579 . 1 1 64 64 ASP C C 13 175.3 0.1 . 1 . . . . . . . . 6390 1 580 . 1 1 65 65 THR N N 15 106.1 0.1 . 1 . . . . . . . . 6390 1 581 . 1 1 65 65 THR H H 1 7.89 0.02 . 1 . . . . . . . . 6390 1 582 . 1 1 65 65 THR CA C 13 61.2 0.1 . 1 . . . . . . . . 6390 1 583 . 1 1 65 65 THR HA H 1 4.50 0.02 . 1 . . . . . . . . 6390 1 584 . 1 1 65 65 THR CB C 13 70.5 0.1 . 1 . . . . . . . . 6390 1 585 . 1 1 65 65 THR HB H 1 4.36 0.02 . 1 . . . . . . . . 6390 1 586 . 1 1 65 65 THR HG21 H 1 1.19 0.02 . 1 . . . . . . . . 6390 1 587 . 1 1 65 65 THR HG22 H 1 1.19 0.02 . 1 . . . . . . . . 6390 1 588 . 1 1 65 65 THR HG23 H 1 1.19 0.02 . 1 . . . . . . . . 6390 1 589 . 1 1 65 65 THR CG2 C 13 21.1 0.1 . 1 . . . . . . . . 6390 1 590 . 1 1 65 65 THR C C 13 177.7 0.1 . 1 . . . . . . . . 6390 1 591 . 1 1 66 66 ALA N N 15 126.5 0.1 . 1 . . . . . . . . 6390 1 592 . 1 1 66 66 ALA H H 1 7.74 0.02 . 1 . . . . . . . . 6390 1 593 . 1 1 66 66 ALA CA C 13 51.5 0.1 . 1 . . . . . . . . 6390 1 594 . 1 1 66 66 ALA HA H 1 4.58 0.02 . 1 . . . . . . . . 6390 1 595 . 1 1 66 66 ALA HB1 H 1 1.28 0.02 . 1 . . . . . . . . 6390 1 596 . 1 1 66 66 ALA HB2 H 1 1.28 0.02 . 1 . . . . . . . . 6390 1 597 . 1 1 66 66 ALA HB3 H 1 1.28 0.02 . 1 . . . . . . . . 6390 1 598 . 1 1 66 66 ALA CB C 13 22.8 0.1 . 1 . . . . . . . . 6390 1 599 . 1 1 66 66 ALA C C 13 174.0 0.1 . 1 . . . . . . . . 6390 1 600 . 1 1 67 67 VAL N N 15 115.9 0.1 . 1 . . . . . . . . 6390 1 601 . 1 1 67 67 VAL H H 1 7.72 0.02 . 1 . . . . . . . . 6390 1 602 . 1 1 67 67 VAL CA C 13 61.8 0.1 . 1 . . . . . . . . 6390 1 603 . 1 1 67 67 VAL HA H 1 4.12 0.02 . 1 . . . . . . . . 6390 1 604 . 1 1 67 67 VAL CB C 13 33.6 0.1 . 1 . . . . . . . . 6390 1 605 . 1 1 67 67 VAL HB H 1 1.97 0.02 . 1 . . . . . . . . 6390 1 606 . 1 1 67 67 VAL HG11 H 1 0.83 0.02 . 2 . . . . . . . . 6390 1 607 . 1 1 67 67 VAL HG12 H 1 0.83 0.02 . 2 . . . . . . . . 6390 1 608 . 1 1 67 67 VAL HG13 H 1 0.83 0.02 . 2 . . . . . . . . 6390 1 609 . 1 1 67 67 VAL HG21 H 1 0.81 0.02 . 2 . . . . . . . . 6390 1 610 . 1 1 67 67 VAL HG22 H 1 0.81 0.02 . 2 . . . . . . . . 6390 1 611 . 1 1 67 67 VAL HG23 H 1 0.81 0.02 . 2 . . . . . . . . 6390 1 612 . 1 1 67 67 VAL CG1 C 13 21.9 0.1 . 1 . . . . . . . . 6390 1 613 . 1 1 67 67 VAL CG2 C 13 21.9 0.1 . 1 . . . . . . . . 6390 1 614 . 1 1 67 67 VAL C C 13 174.4 0.1 . 1 . . . . . . . . 6390 1 615 . 1 1 68 68 PHE N N 15 125.2 0.1 . 1 . . . . . . . . 6390 1 616 . 1 1 68 68 PHE H H 1 8.00 0.02 . 1 . . . . . . . . 6390 1 617 . 1 1 68 68 PHE CA C 13 56.2 0.1 . 1 . . . . . . . . 6390 1 618 . 1 1 68 68 PHE HA H 1 4.40 0.02 . 1 . . . . . . . . 6390 1 619 . 1 1 68 68 PHE CB C 13 38.4 0.1 . 1 . . . . . . . . 6390 1 620 . 1 1 68 68 PHE HB2 H 1 2.75 0.02 . 2 . . . . . . . . 6390 1 621 . 1 1 68 68 PHE HB3 H 1 1.16 0.02 . 2 . . . . . . . . 6390 1 622 . 1 1 68 68 PHE HD1 H 1 6.79 0.02 . 1 . . . . . . . . 6390 1 623 . 1 1 68 68 PHE HE1 H 1 7.25 0.02 . 1 . . . . . . . . 6390 1 624 . 1 1 68 68 PHE HZ H 1 7.21 0.02 . 1 . . . . . . . . 6390 1 625 . 1 1 68 68 PHE C C 13 173.9 0.1 . 1 . . . . . . . . 6390 1 626 . 1 1 69 69 ASN N N 15 116.7 0.1 . 1 . . . . . . . . 6390 1 627 . 1 1 69 69 ASN H H 1 7.18 0.02 . 1 . . . . . . . . 6390 1 628 . 1 1 69 69 ASN CA C 13 53.3 0.1 . 1 . . . . . . . . 6390 1 629 . 1 1 69 69 ASN HA H 1 4.74 0.02 . 1 . . . . . . . . 6390 1 630 . 1 1 69 69 ASN CB C 13 40.7 0.1 . 1 . . . . . . . . 6390 1 631 . 1 1 69 69 ASN HB2 H 1 2.65 0.02 . 2 . . . . . . . . 6390 1 632 . 1 1 69 69 ASN HB3 H 1 2.16 0.02 . 2 . . . . . . . . 6390 1 633 . 1 1 69 69 ASN ND2 N 15 115.9 0.1 . 1 . . . . . . . . 6390 1 634 . 1 1 69 69 ASN HD21 H 1 7.30 0.02 . 2 . . . . . . . . 6390 1 635 . 1 1 69 69 ASN HD22 H 1 7.12 0.02 . 2 . . . . . . . . 6390 1 636 . 1 1 69 69 ASN C C 13 177.0 0.1 . 1 . . . . . . . . 6390 1 637 . 1 1 70 70 ASP N N 15 124.3 0.1 . 1 . . . . . . . . 6390 1 638 . 1 1 70 70 ASP H H 1 9.35 0.02 . 1 . . . . . . . . 6390 1 639 . 1 1 70 70 ASP CA C 13 53.6 0.1 . 1 . . . . . . . . 6390 1 640 . 1 1 70 70 ASP HA H 1 5.27 0.02 . 1 . . . . . . . . 6390 1 641 . 1 1 70 70 ASP CB C 13 41.2 0.1 . 1 . . . . . . . . 6390 1 642 . 1 1 70 70 ASP HB2 H 1 3.09 0.02 . 2 . . . . . . . . 6390 1 643 . 1 1 70 70 ASP HB3 H 1 2.74 0.02 . 2 . . . . . . . . 6390 1 644 . 1 1 70 70 ASP C C 13 174.4 0.1 . 1 . . . . . . . . 6390 1 645 . 1 1 71 71 LEU N N 15 122.0 0.1 . 1 . . . . . . . . 6390 1 646 . 1 1 71 71 LEU H H 1 8.25 0.02 . 1 . . . . . . . . 6390 1 647 . 1 1 71 71 LEU CA C 13 53.0 0.1 . 1 . . . . . . . . 6390 1 648 . 1 1 71 71 LEU HA H 1 5.09 0.02 . 1 . . . . . . . . 6390 1 649 . 1 1 71 71 LEU CB C 13 46.5 0.1 . 1 . . . . . . . . 6390 1 650 . 1 1 71 71 LEU HB2 H 1 1.62 0.02 . 2 . . . . . . . . 6390 1 651 . 1 1 71 71 LEU HB3 H 1 1.32 0.02 . 2 . . . . . . . . 6390 1 652 . 1 1 71 71 LEU CG C 13 27.8 0.1 . 1 . . . . . . . . 6390 1 653 . 1 1 71 71 LEU HG H 1 1.08 0.02 . 1 . . . . . . . . 6390 1 654 . 1 1 71 71 LEU HD11 H 1 0.81 0.02 . 2 . . . . . . . . 6390 1 655 . 1 1 71 71 LEU HD12 H 1 0.81 0.02 . 2 . . . . . . . . 6390 1 656 . 1 1 71 71 LEU HD13 H 1 0.81 0.02 . 2 . . . . . . . . 6390 1 657 . 1 1 71 71 LEU HD21 H 1 0.58 0.02 . 2 . . . . . . . . 6390 1 658 . 1 1 71 71 LEU HD22 H 1 0.58 0.02 . 2 . . . . . . . . 6390 1 659 . 1 1 71 71 LEU HD23 H 1 0.58 0.02 . 2 . . . . . . . . 6390 1 660 . 1 1 71 71 LEU CD2 C 13 22.5 0.1 . 1 . . . . . . . . 6390 1 661 . 1 1 71 71 LEU C C 13 174.8 0.1 . 1 . . . . . . . . 6390 1 662 . 1 1 72 72 ILE N N 15 126.3 0.1 . 1 . . . . . . . . 6390 1 663 . 1 1 72 72 ILE H H 1 8.98 0.02 . 1 . . . . . . . . 6390 1 664 . 1 1 72 72 ILE CA C 13 60.6 0.1 . 1 . . . . . . . . 6390 1 665 . 1 1 72 72 ILE HA H 1 4.64 0.02 . 1 . . . . . . . . 6390 1 666 . 1 1 72 72 ILE CB C 13 38.0 0.1 . 1 . . . . . . . . 6390 1 667 . 1 1 72 72 ILE HB H 1 1.56 0.02 . 1 . . . . . . . . 6390 1 668 . 1 1 72 72 ILE HG21 H 1 0.24 0.02 . 1 . . . . . . . . 6390 1 669 . 1 1 72 72 ILE HG22 H 1 0.24 0.02 . 1 . . . . . . . . 6390 1 670 . 1 1 72 72 ILE HG23 H 1 0.24 0.02 . 1 . . . . . . . . 6390 1 671 . 1 1 72 72 ILE CG2 C 13 17.2 0.1 . 1 . . . . . . . . 6390 1 672 . 1 1 72 72 ILE HD11 H 1 0.51 0.02 . 1 . . . . . . . . 6390 1 673 . 1 1 72 72 ILE HD12 H 1 0.51 0.02 . 1 . . . . . . . . 6390 1 674 . 1 1 72 72 ILE HD13 H 1 0.51 0.02 . 1 . . . . . . . . 6390 1 675 . 1 1 72 72 ILE CD1 C 13 13.1 0.1 . 1 . . . . . . . . 6390 1 676 . 1 1 72 72 ILE C C 13 175.2 0.1 . 1 . . . . . . . . 6390 1 677 . 1 1 73 73 LEU N N 15 131.4 0.1 . 1 . . . . . . . . 6390 1 678 . 1 1 73 73 LEU H H 1 9.18 0.02 . 1 . . . . . . . . 6390 1 679 . 1 1 73 73 LEU CA C 13 58.0 0.1 . 1 . . . . . . . . 6390 1 680 . 1 1 73 73 LEU HA H 1 4.28 0.02 . 1 . . . . . . . . 6390 1 681 . 1 1 73 73 LEU CB C 13 42.7 0.1 . 1 . . . . . . . . 6390 1 682 . 1 1 73 73 LEU HB2 H 1 1.74 0.02 . 2 . . . . . . . . 6390 1 683 . 1 1 73 73 LEU HB3 H 1 1.63 0.02 . 2 . . . . . . . . 6390 1 684 . 1 1 73 73 LEU HD11 H 1 0.85 0.02 . 2 . . . . . . . . 6390 1 685 . 1 1 73 73 LEU HD12 H 1 0.85 0.02 . 2 . . . . . . . . 6390 1 686 . 1 1 73 73 LEU HD13 H 1 0.85 0.02 . 2 . . . . . . . . 6390 1 687 . 1 1 73 73 LEU CD1 C 13 24.0 0.1 . 1 . . . . . . . . 6390 1 688 . 1 1 73 73 LEU C C 13 178.0 0.1 . 1 . . . . . . . . 6390 1 689 . 1 1 74 74 ASP N N 15 122.3 0.1 . 1 . . . . . . . . 6390 1 690 . 1 1 74 74 ASP H H 1 7.97 0.02 . 1 . . . . . . . . 6390 1 691 . 1 1 74 74 ASP CA C 13 52.7 0.1 . 1 . . . . . . . . 6390 1 692 . 1 1 74 74 ASP HA H 1 4.83 0.02 . 1 . . . . . . . . 6390 1 693 . 1 1 74 74 ASP CB C 13 40.4 0.1 . 1 . . . . . . . . 6390 1 694 . 1 1 74 74 ASP HB2 H 1 2.87 0.02 . 2 . . . . . . . . 6390 1 695 . 1 1 74 74 ASP HB3 H 1 2.33 0.02 . 2 . . . . . . . . 6390 1 696 . 1 1 74 74 ASP C C 13 178.2 0.1 . 1 . . . . . . . . 6390 1 697 . 1 1 75 75 PHE N N 15 122.5 0.1 . 1 . . . . . . . . 6390 1 698 . 1 1 75 75 PHE H H 1 9.02 0.02 . 1 . . . . . . . . 6390 1 699 . 1 1 75 75 PHE CA C 13 60.3 0.1 . 1 . . . . . . . . 6390 1 700 . 1 1 75 75 PHE HA H 1 4.17 0.02 . 1 . . . . . . . . 6390 1 701 . 1 1 75 75 PHE CB C 13 40.1 0.1 . 1 . . . . . . . . 6390 1 702 . 1 1 75 75 PHE HB2 H 1 2.61 0.02 . 2 . . . . . . . . 6390 1 703 . 1 1 75 75 PHE HB3 H 1 2.27 0.02 . 2 . . . . . . . . 6390 1 704 . 1 1 75 75 PHE HD1 H 1 6.52 0.02 . 1 . . . . . . . . 6390 1 705 . 1 1 75 75 PHE HE1 H 1 6.99 0.02 . 1 . . . . . . . . 6390 1 706 . 1 1 75 75 PHE C C 13 175.4 0.1 . 1 . . . . . . . . 6390 1 707 . 1 1 76 76 GLU N N 15 132.2 0.1 . 1 . . . . . . . . 6390 1 708 . 1 1 76 76 GLU H H 1 9.13 0.02 . 1 . . . . . . . . 6390 1 709 . 1 1 76 76 GLU CA C 13 53.6 0.1 . 1 . . . . . . . . 6390 1 710 . 1 1 76 76 GLU HA H 1 4.53 0.02 . 1 . . . . . . . . 6390 1 711 . 1 1 76 76 GLU CB C 13 29.8 0.1 . 1 . . . . . . . . 6390 1 712 . 1 1 76 76 GLU HB2 H 1 2.01 0.02 . 2 . . . . . . . . 6390 1 713 . 1 1 76 76 GLU HB3 H 1 1.89 0.02 . 2 . . . . . . . . 6390 1 714 . 1 1 76 76 GLU HG2 H 1 2.26 0.02 . 2 . . . . . . . . 6390 1 715 . 1 1 76 76 GLU HG3 H 1 2.14 0.02 . 2 . . . . . . . . 6390 1 716 . 1 1 76 76 GLU C C 13 175.4 0.1 . 1 . . . . . . . . 6390 1 717 . 1 1 77 77 ALA N N 15 130.2 0.1 . 1 . . . . . . . . 6390 1 718 . 1 1 77 77 ALA H H 1 9.21 0.02 . 1 . . . . . . . . 6390 1 719 . 1 1 77 77 ALA CA C 13 54.7 0.1 . 1 . . . . . . . . 6390 1 720 . 1 1 77 77 ALA HA H 1 3.74 0.02 . 1 . . . . . . . . 6390 1 721 . 1 1 77 77 ALA HB1 H 1 1.53 0.02 . 1 . . . . . . . . 6390 1 722 . 1 1 77 77 ALA HB2 H 1 1.53 0.02 . 1 . . . . . . . . 6390 1 723 . 1 1 77 77 ALA HB3 H 1 1.53 0.02 . 1 . . . . . . . . 6390 1 724 . 1 1 77 77 ALA CB C 13 19.0 0.1 . 1 . . . . . . . . 6390 1 725 . 1 1 77 77 ALA C C 13 175.9 0.1 . 1 . . . . . . . . 6390 1 726 . 1 1 78 78 SER N N 15 111.3 0.1 . 1 . . . . . . . . 6390 1 727 . 1 1 78 78 SER H H 1 8.45 0.02 . 1 . . . . . . . . 6390 1 728 . 1 1 78 78 SER CA C 13 59.7 0.1 . 1 . . . . . . . . 6390 1 729 . 1 1 78 78 SER HA H 1 4.33 0.02 . 1 . . . . . . . . 6390 1 730 . 1 1 78 78 SER CB C 13 63.2 0.1 . 1 . . . . . . . . 6390 1 731 . 1 1 78 78 SER HB2 H 1 4.00 0.02 . 2 . . . . . . . . 6390 1 732 . 1 1 78 78 SER HB3 H 1 3.87 0.02 . 2 . . . . . . . . 6390 1 733 . 1 1 78 78 SER C C 13 178.5 0.1 . 1 . . . . . . . . 6390 1 734 . 1 1 79 79 GLU N N 15 118.4 0.1 . 1 . . . . . . . . 6390 1 735 . 1 1 79 79 GLU H H 1 7.39 0.02 . 1 . . . . . . . . 6390 1 736 . 1 1 79 79 GLU CA C 13 56.8 0.1 . 1 . . . . . . . . 6390 1 737 . 1 1 79 79 GLU HA H 1 4.69 0.02 . 1 . . . . . . . . 6390 1 738 . 1 1 79 79 GLU CB C 13 32.8 0.1 . 1 . . . . . . . . 6390 1 739 . 1 1 79 79 GLU HB2 H 1 1.88 0.02 . 2 . . . . . . . . 6390 1 740 . 1 1 79 79 GLU HB3 H 1 1.73 0.02 . 2 . . . . . . . . 6390 1 741 . 1 1 79 79 GLU CG C 13 34.8 0.1 . 1 . . . . . . . . 6390 1 742 . 1 1 79 79 GLU HG2 H 1 2.20 0.02 . 2 . . . . . . . . 6390 1 743 . 1 1 79 79 GLU HG3 H 1 1.99 0.02 . 2 . . . . . . . . 6390 1 744 . 1 1 79 79 GLU C C 13 174.5 0.1 . 1 . . . . . . . . 6390 1 745 . 1 1 80 80 ASP N N 15 120.3 0.1 . 1 . . . . . . . . 6390 1 746 . 1 1 80 80 ASP H H 1 8.23 0.02 . 1 . . . . . . . . 6390 1 747 . 1 1 80 80 ASP CA C 13 53.8 0.1 . 1 . . . . . . . . 6390 1 748 . 1 1 80 80 ASP HA H 1 5.29 0.02 . 1 . . . . . . . . 6390 1 749 . 1 1 80 80 ASP CB C 13 43.9 0.1 . 1 . . . . . . . . 6390 1 750 . 1 1 80 80 ASP HB2 H 1 2.90 0.02 . 2 . . . . . . . . 6390 1 751 . 1 1 80 80 ASP HB3 H 1 1.98 0.02 . 2 . . . . . . . . 6390 1 752 . 1 1 80 80 ASP C C 13 174.9 0.1 . 1 . . . . . . . . 6390 1 753 . 1 1 81 81 ARG N N 15 115.1 0.1 . 1 . . . . . . . . 6390 1 754 . 1 1 81 81 ARG H H 1 8.96 0.02 . 1 . . . . . . . . 6390 1 755 . 1 1 81 81 ARG CA C 13 54.7 0.1 . 1 . . . . . . . . 6390 1 756 . 1 1 81 81 ARG HA H 1 5.63 0.02 . 1 . . . . . . . . 6390 1 757 . 1 1 81 81 ARG CB C 13 35.1 0.1 . 1 . . . . . . . . 6390 1 758 . 1 1 81 81 ARG HB2 H 1 1.73 0.02 . 2 . . . . . . . . 6390 1 759 . 1 1 81 81 ARG HB3 H 1 1.70 0.02 . 2 . . . . . . . . 6390 1 760 . 1 1 81 81 ARG CG C 13 27.5 0.1 . 1 . . . . . . . . 6390 1 761 . 1 1 81 81 ARG HG2 H 1 1.63 0.02 . 2 . . . . . . . . 6390 1 762 . 1 1 81 81 ARG HG3 H 1 1.57 0.02 . 2 . . . . . . . . 6390 1 763 . 1 1 81 81 ARG CD C 13 43.8 0.1 . 1 . . . . . . . . 6390 1 764 . 1 1 81 81 ARG HD2 H 1 3.07 0.02 . 2 . . . . . . . . 6390 1 765 . 1 1 81 81 ARG HD3 H 1 3.02 0.02 . 2 . . . . . . . . 6390 1 766 . 1 1 81 81 ARG C C 13 174.8 0.1 . 1 . . . . . . . . 6390 1 767 . 1 1 82 82 ILE N N 15 122.5 0.1 . 1 . . . . . . . . 6390 1 768 . 1 1 82 82 ILE H H 1 8.90 0.02 . 1 . . . . . . . . 6390 1 769 . 1 1 82 82 ILE CA C 13 60.0 0.1 . 1 . . . . . . . . 6390 1 770 . 1 1 82 82 ILE HA H 1 5.14 0.02 . 1 . . . . . . . . 6390 1 771 . 1 1 82 82 ILE CB C 13 40.1 0.1 . 1 . . . . . . . . 6390 1 772 . 1 1 82 82 ILE HB H 1 1.80 0.02 . 1 . . . . . . . . 6390 1 773 . 1 1 82 82 ILE HG21 H 1 0.94 0.02 . 1 . . . . . . . . 6390 1 774 . 1 1 82 82 ILE HG22 H 1 0.94 0.02 . 1 . . . . . . . . 6390 1 775 . 1 1 82 82 ILE HG23 H 1 0.94 0.02 . 1 . . . . . . . . 6390 1 776 . 1 1 82 82 ILE CG2 C 13 17.2 0.1 . 1 . . . . . . . . 6390 1 777 . 1 1 82 82 ILE CG1 C 13 28.4 0.1 . 1 . . . . . . . . 6390 1 778 . 1 1 82 82 ILE HG12 H 1 1.78 0.02 . 2 . . . . . . . . 6390 1 779 . 1 1 82 82 ILE HG13 H 1 1.56 0.02 . 2 . . . . . . . . 6390 1 780 . 1 1 82 82 ILE HD11 H 1 0.25 0.02 . 1 . . . . . . . . 6390 1 781 . 1 1 82 82 ILE HD12 H 1 0.25 0.02 . 1 . . . . . . . . 6390 1 782 . 1 1 82 82 ILE HD13 H 1 0.25 0.02 . 1 . . . . . . . . 6390 1 783 . 1 1 82 82 ILE CD1 C 13 13.7 0.1 . 1 . . . . . . . . 6390 1 784 . 1 1 82 82 ILE C C 13 175.6 0.1 . 1 . . . . . . . . 6390 1 785 . 1 1 83 83 ASP N N 15 127.5 0.1 . 1 . . . . . . . . 6390 1 786 . 1 1 83 83 ASP H H 1 9.50 0.02 . 1 . . . . . . . . 6390 1 787 . 1 1 83 83 ASP CA C 13 53.6 0.1 . 1 . . . . . . . . 6390 1 788 . 1 1 83 83 ASP HA H 1 4.94 0.02 . 1 . . . . . . . . 6390 1 789 . 1 1 83 83 ASP CB C 13 42.1 0.1 . 1 . . . . . . . . 6390 1 790 . 1 1 83 83 ASP HB2 H 1 3.02 0.02 . 2 . . . . . . . . 6390 1 791 . 1 1 83 83 ASP HB3 H 1 2.12 0.02 . 2 . . . . . . . . 6390 1 792 . 1 1 83 83 ASP C C 13 174.3 0.1 . 1 . . . . . . . . 6390 1 793 . 1 1 84 84 LEU N N 15 125.9 0.1 . 1 . . . . . . . . 6390 1 794 . 1 1 84 84 LEU H H 1 8.38 0.02 . 1 . . . . . . . . 6390 1 795 . 1 1 84 84 LEU CA C 13 52.7 0.1 . 1 . . . . . . . . 6390 1 796 . 1 1 84 84 LEU HA H 1 4.87 0.02 . 1 . . . . . . . . 6390 1 797 . 1 1 84 84 LEU CB C 13 41.2 0.1 . 1 . . . . . . . . 6390 1 798 . 1 1 84 84 LEU HB2 H 1 1.74 0.02 . 2 . . . . . . . . 6390 1 799 . 1 1 84 84 LEU HD11 H 1 0.40 0.02 . 2 . . . . . . . . 6390 1 800 . 1 1 84 84 LEU HD12 H 1 0.40 0.02 . 2 . . . . . . . . 6390 1 801 . 1 1 84 84 LEU HD13 H 1 0.40 0.02 . 2 . . . . . . . . 6390 1 802 . 1 1 84 84 LEU HD21 H 1 0.47 0.02 . 2 . . . . . . . . 6390 1 803 . 1 1 84 84 LEU HD22 H 1 0.47 0.02 . 2 . . . . . . . . 6390 1 804 . 1 1 84 84 LEU HD23 H 1 0.47 0.02 . 2 . . . . . . . . 6390 1 805 . 1 1 84 84 LEU CD2 C 13 26.9 0.1 . 1 . . . . . . . . 6390 1 806 . 1 1 84 84 LEU C C 13 175.3 0.1 . 1 . . . . . . . . 6390 1 807 . 1 1 85 85 SER N N 15 122.3 0.1 . 1 . . . . . . . . 6390 1 808 . 1 1 85 85 SER H H 1 8.92 0.02 . 1 . . . . . . . . 6390 1 809 . 1 1 85 85 SER CA C 13 57.5 0.1 . 1 . . . . . . . . 6390 1 810 . 1 1 85 85 SER HA H 1 4.14 0.02 . 1 . . . . . . . . 6390 1 811 . 1 1 85 85 SER CB C 13 62.6 0.1 . 1 . . . . . . . . 6390 1 812 . 1 1 85 85 SER HB2 H 1 3.76 0.02 . 2 . . . . . . . . 6390 1 813 . 1 1 85 85 SER HB3 H 1 3.66 0.02 . 2 . . . . . . . . 6390 1 814 . 1 1 85 85 SER C C 13 179.9 0.1 . 1 . . . . . . . . 6390 1 815 . 1 1 86 86 ALA N N 15 124.6 0.1 . 1 . . . . . . . . 6390 1 816 . 1 1 86 86 ALA H H 1 8.64 0.02 . 1 . . . . . . . . 6390 1 817 . 1 1 86 86 ALA CA C 13 53.0 0.1 . 1 . . . . . . . . 6390 1 818 . 1 1 86 86 ALA HA H 1 4.42 0.02 . 1 . . . . . . . . 6390 1 819 . 1 1 86 86 ALA HB1 H 1 1.41 0.02 . 1 . . . . . . . . 6390 1 820 . 1 1 86 86 ALA HB2 H 1 1.41 0.02 . 1 . . . . . . . . 6390 1 821 . 1 1 86 86 ALA HB3 H 1 1.41 0.02 . 1 . . . . . . . . 6390 1 822 . 1 1 86 86 ALA CB C 13 19.6 0.1 . 1 . . . . . . . . 6390 1 823 . 1 1 86 86 ALA C C 13 176.0 0.1 . 1 . . . . . . . . 6390 1 824 . 1 1 87 87 LEU N N 15 113.1 0.1 . 1 . . . . . . . . 6390 1 825 . 1 1 87 87 LEU H H 1 7.91 0.02 . 1 . . . . . . . . 6390 1 826 . 1 1 87 87 LEU CA C 13 55.6 0.1 . 1 . . . . . . . . 6390 1 827 . 1 1 87 87 LEU HA H 1 4.00 0.02 . 1 . . . . . . . . 6390 1 828 . 1 1 87 87 LEU CB C 13 42.7 0.1 . 1 . . . . . . . . 6390 1 829 . 1 1 87 87 LEU HB2 H 1 1.84 0.02 . 2 . . . . . . . . 6390 1 830 . 1 1 87 87 LEU HB3 H 1 1.11 0.02 . 2 . . . . . . . . 6390 1 831 . 1 1 87 87 LEU HD11 H 1 0.39 0.02 . 2 . . . . . . . . 6390 1 832 . 1 1 87 87 LEU HD12 H 1 0.39 0.02 . 2 . . . . . . . . 6390 1 833 . 1 1 87 87 LEU HD13 H 1 0.39 0.02 . 2 . . . . . . . . 6390 1 834 . 1 1 87 87 LEU HD21 H 1 0.29 0.02 . 2 . . . . . . . . 6390 1 835 . 1 1 87 87 LEU HD22 H 1 0.29 0.02 . 2 . . . . . . . . 6390 1 836 . 1 1 87 87 LEU HD23 H 1 0.29 0.02 . 2 . . . . . . . . 6390 1 837 . 1 1 87 87 LEU CD1 C 13 27.8 0.1 . 1 . . . . . . . . 6390 1 838 . 1 1 87 87 LEU CD2 C 13 21.3 0.1 . 1 . . . . . . . . 6390 1 839 . 1 1 87 87 LEU C C 13 179.7 0.1 . 1 . . . . . . . . 6390 1 840 . 1 1 88 88 GLY N N 15 108.0 0.1 . 1 . . . . . . . . 6390 1 841 . 1 1 88 88 GLY H H 1 7.93 0.02 . 1 . . . . . . . . 6390 1 842 . 1 1 88 88 GLY CA C 13 46.4 0.1 . 1 . . . . . . . . 6390 1 843 . 1 1 88 88 GLY HA2 H 1 3.75 0.02 . 2 . . . . . . . . 6390 1 844 . 1 1 88 88 GLY C C 13 177.8 0.1 . 1 . . . . . . . . 6390 1 845 . 1 1 89 89 PHE N N 15 121.0 0.1 . 1 . . . . . . . . 6390 1 846 . 1 1 89 89 PHE H H 1 8.80 0.02 . 1 . . . . . . . . 6390 1 847 . 1 1 89 89 PHE CA C 13 57.4 0.1 . 1 . . . . . . . . 6390 1 848 . 1 1 89 89 PHE HA H 1 5.12 0.02 . 1 . . . . . . . . 6390 1 849 . 1 1 89 89 PHE CB C 13 39.5 0.1 . 1 . . . . . . . . 6390 1 850 . 1 1 89 89 PHE HB2 H 1 3.20 0.02 . 2 . . . . . . . . 6390 1 851 . 1 1 89 89 PHE HB3 H 1 3.10 0.02 . 2 . . . . . . . . 6390 1 852 . 1 1 89 89 PHE HD1 H 1 6.95 0.02 . 1 . . . . . . . . 6390 1 853 . 1 1 89 89 PHE HE1 H 1 7.26 0.02 . 1 . . . . . . . . 6390 1 854 . 1 1 89 89 PHE C C 13 174.7 0.1 . 1 . . . . . . . . 6390 1 855 . 1 1 90 90 SER N N 15 115.0 0.1 . 1 . . . . . . . . 6390 1 856 . 1 1 90 90 SER H H 1 9.24 0.02 . 1 . . . . . . . . 6390 1 857 . 1 1 90 90 SER CA C 13 58.5 0.1 . 1 . . . . . . . . 6390 1 858 . 1 1 90 90 SER HA H 1 4.43 0.02 . 1 . . . . . . . . 6390 1 859 . 1 1 90 90 SER CB C 13 64.1 0.1 . 1 . . . . . . . . 6390 1 860 . 1 1 90 90 SER HB2 H 1 3.77 0.02 . 2 . . . . . . . . 6390 1 861 . 1 1 90 90 SER HB3 H 1 3.72 0.02 . 2 . . . . . . . . 6390 1 862 . 1 1 90 90 SER C C 13 176.3 0.1 . 1 . . . . . . . . 6390 1 863 . 1 1 91 91 GLY N N 15 108.3 0.1 . 1 . . . . . . . . 6390 1 864 . 1 1 91 91 GLY H H 1 6.38 0.02 . 1 . . . . . . . . 6390 1 865 . 1 1 91 91 GLY CA C 13 43.9 0.1 . 1 . . . . . . . . 6390 1 866 . 1 1 91 91 GLY HA2 H 1 3.60 0.02 . 2 . . . . . . . . 6390 1 867 . 1 1 91 91 GLY HA3 H 1 1.68 0.02 . 2 . . . . . . . . 6390 1 868 . 1 1 91 91 GLY C C 13 174.6 0.1 . 1 . . . . . . . . 6390 1 869 . 1 1 92 92 LEU N N 15 119.4 0.1 . 1 . . . . . . . . 6390 1 870 . 1 1 92 92 LEU H H 1 8.16 0.02 . 1 . . . . . . . . 6390 1 871 . 1 1 92 92 LEU CA C 13 53.9 0.1 . 1 . . . . . . . . 6390 1 872 . 1 1 92 92 LEU HA H 1 4.93 0.02 . 1 . . . . . . . . 6390 1 873 . 1 1 92 92 LEU CB C 13 41.9 0.1 . 1 . . . . . . . . 6390 1 874 . 1 1 92 92 LEU HB2 H 1 1.82 0.02 . 2 . . . . . . . . 6390 1 875 . 1 1 92 92 LEU HB3 H 1 1.62 0.02 . 2 . . . . . . . . 6390 1 876 . 1 1 92 92 LEU CG C 13 25.5 0.1 . 1 . . . . . . . . 6390 1 877 . 1 1 92 92 LEU HG H 1 0.98 0.02 . 1 . . . . . . . . 6390 1 878 . 1 1 92 92 LEU HD11 H 1 0.94 0.02 . 2 . . . . . . . . 6390 1 879 . 1 1 92 92 LEU HD12 H 1 0.94 0.02 . 2 . . . . . . . . 6390 1 880 . 1 1 92 92 LEU HD13 H 1 0.94 0.02 . 2 . . . . . . . . 6390 1 881 . 1 1 92 92 LEU HD21 H 1 0.87 0.02 . 2 . . . . . . . . 6390 1 882 . 1 1 92 92 LEU HD22 H 1 0.87 0.02 . 2 . . . . . . . . 6390 1 883 . 1 1 92 92 LEU HD23 H 1 0.87 0.02 . 2 . . . . . . . . 6390 1 884 . 1 1 92 92 LEU CD1 C 13 23.6 0.1 . 1 . . . . . . . . 6390 1 885 . 1 1 92 92 LEU CD2 C 13 23.4 0.1 . 1 . . . . . . . . 6390 1 886 . 1 1 92 92 LEU C C 13 171.8 0.1 . 1 . . . . . . . . 6390 1 887 . 1 1 93 93 GLY N N 15 112.8 0.1 . 1 . . . . . . . . 6390 1 888 . 1 1 93 93 GLY H H 1 8.99 0.02 . 1 . . . . . . . . 6390 1 889 . 1 1 93 93 GLY CA C 13 47.7 0.1 . 1 . . . . . . . . 6390 1 890 . 1 1 93 93 GLY HA2 H 1 3.84 0.02 . 2 . . . . . . . . 6390 1 891 . 1 1 93 93 GLY HA3 H 1 3.81 0.02 . 2 . . . . . . . . 6390 1 892 . 1 1 93 93 GLY C C 13 178.4 0.1 . 1 . . . . . . . . 6390 1 893 . 1 1 94 94 ASP N N 15 126.8 0.1 . 1 . . . . . . . . 6390 1 894 . 1 1 94 94 ASP H H 1 8.21 0.02 . 1 . . . . . . . . 6390 1 895 . 1 1 94 94 ASP CA C 13 53.3 0.1 . 1 . . . . . . . . 6390 1 896 . 1 1 94 94 ASP HA H 1 4.72 0.02 . 1 . . . . . . . . 6390 1 897 . 1 1 94 94 ASP CB C 13 41.0 0.1 . 1 . . . . . . . . 6390 1 898 . 1 1 94 94 ASP HB2 H 1 3.21 0.02 . 2 . . . . . . . . 6390 1 899 . 1 1 94 94 ASP HB3 H 1 2.71 0.02 . 2 . . . . . . . . 6390 1 900 . 1 1 94 94 ASP C C 13 172.0 0.1 . 1 . . . . . . . . 6390 1 901 . 1 1 95 95 GLY N N 15 107.7 0.1 . 1 . . . . . . . . 6390 1 902 . 1 1 95 95 GLY H H 1 7.75 0.02 . 1 . . . . . . . . 6390 1 903 . 1 1 95 95 GLY CA C 13 45.9 0.1 . 1 . . . . . . . . 6390 1 904 . 1 1 95 95 GLY HA2 H 1 3.82 0.02 . 2 . . . . . . . . 6390 1 905 . 1 1 95 95 GLY HA3 H 1 3.76 0.02 . 2 . . . . . . . . 6390 1 906 . 1 1 95 95 GLY C C 13 176.5 0.1 . 1 . . . . . . . . 6390 1 907 . 1 1 96 96 TYR N N 15 117.5 0.1 . 1 . . . . . . . . 6390 1 908 . 1 1 96 96 TYR H H 1 8.16 0.02 . 1 . . . . . . . . 6390 1 909 . 1 1 96 96 TYR CA C 13 56.8 0.1 . 1 . . . . . . . . 6390 1 910 . 1 1 96 96 TYR HA H 1 4.91 0.02 . 1 . . . . . . . . 6390 1 911 . 1 1 96 96 TYR CB C 13 40.4 0.1 . 1 . . . . . . . . 6390 1 912 . 1 1 96 96 TYR HB2 H 1 3.12 0.02 . 2 . . . . . . . . 6390 1 913 . 1 1 96 96 TYR HB3 H 1 3.02 0.02 . 2 . . . . . . . . 6390 1 914 . 1 1 96 96 TYR HD1 H 1 7.04 0.02 . 1 . . . . . . . . 6390 1 915 . 1 1 96 96 TYR C C 13 172.9 0.1 . 1 . . . . . . . . 6390 1 916 . 1 1 97 97 GLY N N 15 112.3 0.1 . 1 . . . . . . . . 6390 1 917 . 1 1 97 97 GLY H H 1 9.35 0.02 . 1 . . . . . . . . 6390 1 918 . 1 1 97 97 GLY CA C 13 47.7 0.1 . 1 . . . . . . . . 6390 1 919 . 1 1 97 97 GLY HA2 H 1 4.07 0.02 . 2 . . . . . . . . 6390 1 920 . 1 1 97 97 GLY HA3 H 1 3.90 0.02 . 2 . . . . . . . . 6390 1 921 . 1 1 97 97 GLY C C 13 178.7 0.1 . 1 . . . . . . . . 6390 1 922 . 1 1 98 98 GLY N N 15 109.1 0.1 . 1 . . . . . . . . 6390 1 923 . 1 1 98 98 GLY H H 1 9.66 0.02 . 1 . . . . . . . . 6390 1 924 . 1 1 98 98 GLY CA C 13 45.6 0.1 . 1 . . . . . . . . 6390 1 925 . 1 1 98 98 GLY HA2 H 1 4.41 0.02 . 2 . . . . . . . . 6390 1 926 . 1 1 98 98 GLY HA3 H 1 4.01 0.02 . 2 . . . . . . . . 6390 1 927 . 1 1 98 98 GLY C C 13 176.8 0.1 . 1 . . . . . . . . 6390 1 928 . 1 1 99 99 THR N N 15 109.4 0.1 . 1 . . . . . . . . 6390 1 929 . 1 1 99 99 THR H H 1 7.25 0.02 . 1 . . . . . . . . 6390 1 930 . 1 1 99 99 THR CA C 13 59.7 0.1 . 1 . . . . . . . . 6390 1 931 . 1 1 99 99 THR HA H 1 5.25 0.02 . 1 . . . . . . . . 6390 1 932 . 1 1 99 99 THR CB C 13 72.6 0.1 . 1 . . . . . . . . 6390 1 933 . 1 1 99 99 THR HB H 1 3.89 0.02 . 1 . . . . . . . . 6390 1 934 . 1 1 99 99 THR HG21 H 1 1.09 0.02 . 1 . . . . . . . . 6390 1 935 . 1 1 99 99 THR HG22 H 1 1.09 0.02 . 1 . . . . . . . . 6390 1 936 . 1 1 99 99 THR HG23 H 1 1.09 0.02 . 1 . . . . . . . . 6390 1 937 . 1 1 99 99 THR CG2 C 13 21.0 0.1 . 1 . . . . . . . . 6390 1 938 . 1 1 99 99 THR C C 13 173.6 0.1 . 1 . . . . . . . . 6390 1 939 . 1 1 100 100 LEU N N 15 115.7 0.1 . 1 . . . . . . . . 6390 1 940 . 1 1 100 100 LEU H H 1 7.71 0.02 . 1 . . . . . . . . 6390 1 941 . 1 1 100 100 LEU CA C 13 52.1 0.1 . 1 . . . . . . . . 6390 1 942 . 1 1 100 100 LEU HA H 1 4.73 0.02 . 1 . . . . . . . . 6390 1 943 . 1 1 100 100 LEU CB C 13 45.7 0.1 . 1 . . . . . . . . 6390 1 944 . 1 1 100 100 LEU HB2 H 1 1.36 0.02 . 2 . . . . . . . . 6390 1 945 . 1 1 100 100 LEU HB3 H 1 0.85 0.02 . 2 . . . . . . . . 6390 1 946 . 1 1 100 100 LEU CG C 13 26.9 0.1 . 1 . . . . . . . . 6390 1 947 . 1 1 100 100 LEU HG H 1 0.48 0.02 . 1 . . . . . . . . 6390 1 948 . 1 1 100 100 LEU HD11 H 1 0.89 0.02 . 2 . . . . . . . . 6390 1 949 . 1 1 100 100 LEU HD12 H 1 0.89 0.02 . 2 . . . . . . . . 6390 1 950 . 1 1 100 100 LEU HD13 H 1 0.89 0.02 . 2 . . . . . . . . 6390 1 951 . 1 1 100 100 LEU HD21 H 1 -0.23 0.02 . 2 . . . . . . . . 6390 1 952 . 1 1 100 100 LEU HD22 H 1 -0.23 0.02 . 2 . . . . . . . . 6390 1 953 . 1 1 100 100 LEU HD23 H 1 -0.23 0.02 . 2 . . . . . . . . 6390 1 954 . 1 1 100 100 LEU CD1 C 13 26.3 0.1 . 1 . . . . . . . . 6390 1 955 . 1 1 100 100 LEU CD2 C 13 23.4 0.1 . 1 . . . . . . . . 6390 1 956 . 1 1 100 100 LEU C C 13 173.6 0.1 . 1 . . . . . . . . 6390 1 957 . 1 1 101 101 LEU N N 15 125.5 0.1 . 1 . . . . . . . . 6390 1 958 . 1 1 101 101 LEU H H 1 9.14 0.02 . 1 . . . . . . . . 6390 1 959 . 1 1 101 101 LEU CA C 13 53.6 0.1 . 1 . . . . . . . . 6390 1 960 . 1 1 101 101 LEU HA H 1 4.61 0.02 . 1 . . . . . . . . 6390 1 961 . 1 1 101 101 LEU CB C 13 43.9 0.1 . 1 . . . . . . . . 6390 1 962 . 1 1 101 101 LEU HB2 H 1 1.50 0.02 . 2 . . . . . . . . 6390 1 963 . 1 1 101 101 LEU HB3 H 1 1.13 0.02 . 2 . . . . . . . . 6390 1 964 . 1 1 101 101 LEU HG H 1 1.00 0.02 . 1 . . . . . . . . 6390 1 965 . 1 1 101 101 LEU C C 13 175.2 0.1 . 1 . . . . . . . . 6390 1 966 . 1 1 102 102 LEU N N 15 128.9 0.1 . 1 . . . . . . . . 6390 1 967 . 1 1 102 102 LEU H H 1 8.32 0.02 . 1 . . . . . . . . 6390 1 968 . 1 1 102 102 LEU CA C 13 53.3 0.1 . 1 . . . . . . . . 6390 1 969 . 1 1 102 102 LEU HA H 1 5.36 0.02 . 1 . . . . . . . . 6390 1 970 . 1 1 102 102 LEU CB C 13 44.2 0.1 . 1 . . . . . . . . 6390 1 971 . 1 1 102 102 LEU HB2 H 1 1.77 0.02 . 2 . . . . . . . . 6390 1 972 . 1 1 102 102 LEU HB3 H 1 1.43 0.02 . 2 . . . . . . . . 6390 1 973 . 1 1 102 102 LEU HD11 H 1 0.95 0.02 . 2 . . . . . . . . 6390 1 974 . 1 1 102 102 LEU HD12 H 1 0.95 0.02 . 2 . . . . . . . . 6390 1 975 . 1 1 102 102 LEU HD13 H 1 0.95 0.02 . 2 . . . . . . . . 6390 1 976 . 1 1 102 102 LEU HD21 H 1 0.86 0.02 . 2 . . . . . . . . 6390 1 977 . 1 1 102 102 LEU HD22 H 1 0.86 0.02 . 2 . . . . . . . . 6390 1 978 . 1 1 102 102 LEU HD23 H 1 0.86 0.02 . 2 . . . . . . . . 6390 1 979 . 1 1 102 102 LEU CD1 C 13 26.6 0.1 . 1 . . . . . . . . 6390 1 980 . 1 1 102 102 LEU CD2 C 13 26.0 0.1 . 1 . . . . . . . . 6390 1 981 . 1 1 102 102 LEU C C 13 175.3 0.1 . 1 . . . . . . . . 6390 1 982 . 1 1 103 103 LYS N N 15 125.3 0.1 . 1 . . . . . . . . 6390 1 983 . 1 1 103 103 LYS H H 1 8.67 0.02 . 1 . . . . . . . . 6390 1 984 . 1 1 103 103 LYS CA C 13 55.0 0.1 . 1 . . . . . . . . 6390 1 985 . 1 1 103 103 LYS HA H 1 4.88 0.02 . 1 . . . . . . . . 6390 1 986 . 1 1 103 103 LYS CB C 13 36.6 0.1 . 1 . . . . . . . . 6390 1 987 . 1 1 103 103 LYS HB2 H 1 1.81 0.02 . 2 . . . . . . . . 6390 1 988 . 1 1 103 103 LYS HB3 H 1 1.79 0.02 . 2 . . . . . . . . 6390 1 989 . 1 1 103 103 LYS CG C 13 23.7 0.1 . 1 . . . . . . . . 6390 1 990 . 1 1 103 103 LYS HG2 H 1 1.54 0.02 . 2 . . . . . . . . 6390 1 991 . 1 1 103 103 LYS HG3 H 1 1.43 0.02 . 2 . . . . . . . . 6390 1 992 . 1 1 103 103 LYS CD C 13 29.0 0.1 . 1 . . . . . . . . 6390 1 993 . 1 1 103 103 LYS HD2 H 1 1.74 0.02 . 2 . . . . . . . . 6390 1 994 . 1 1 103 103 LYS HD3 H 1 1.69 0.02 . 2 . . . . . . . . 6390 1 995 . 1 1 103 103 LYS CE C 13 41.8 0.1 . 1 . . . . . . . . 6390 1 996 . 1 1 103 103 LYS HE2 H 1 3.07 0.02 . 2 . . . . . . . . 6390 1 997 . 1 1 103 103 LYS HE3 H 1 2.99 0.02 . 2 . . . . . . . . 6390 1 998 . 1 1 103 103 LYS C C 13 176.0 0.1 . 1 . . . . . . . . 6390 1 999 . 1 1 104 104 THR N N 15 114.9 0.1 . 1 . . . . . . . . 6390 1 1000 . 1 1 104 104 THR H H 1 8.65 0.02 . 1 . . . . . . . . 6390 1 1001 . 1 1 104 104 THR CA C 13 60.3 0.1 . 1 . . . . . . . . 6390 1 1002 . 1 1 104 104 THR HA H 1 5.65 0.02 . 1 . . . . . . . . 6390 1 1003 . 1 1 104 104 THR CB C 13 72.0 0.1 . 1 . . . . . . . . 6390 1 1004 . 1 1 104 104 THR HB H 1 4.52 0.02 . 1 . . . . . . . . 6390 1 1005 . 1 1 104 104 THR HG21 H 1 1.28 0.02 . 1 . . . . . . . . 6390 1 1006 . 1 1 104 104 THR HG22 H 1 1.28 0.02 . 1 . . . . . . . . 6390 1 1007 . 1 1 104 104 THR HG23 H 1 1.28 0.02 . 1 . . . . . . . . 6390 1 1008 . 1 1 104 104 THR CG2 C 13 21.0 0.1 . 1 . . . . . . . . 6390 1 1009 . 1 1 104 104 THR C C 13 175.0 0.1 . 1 . . . . . . . . 6390 1 1010 . 1 1 105 105 ASN N N 15 117.6 0.1 . 1 . . . . . . . . 6390 1 1011 . 1 1 105 105 ASN H H 1 8.34 0.02 . 1 . . . . . . . . 6390 1 1012 . 1 1 105 105 ASN CA C 13 52.1 0.1 . 1 . . . . . . . . 6390 1 1013 . 1 1 105 105 ASN HA H 1 4.82 0.02 . 1 . . . . . . . . 6390 1 1014 . 1 1 105 105 ASN CB C 13 37.7 0.1 . 1 . . . . . . . . 6390 1 1015 . 1 1 105 105 ASN HB2 H 1 3.20 0.02 . 2 . . . . . . . . 6390 1 1016 . 1 1 105 105 ASN HB3 H 1 3.69 0.02 . 2 . . . . . . . . 6390 1 1017 . 1 1 105 105 ASN ND2 N 15 112.0 0.1 . 1 . . . . . . . . 6390 1 1018 . 1 1 105 105 ASN HD21 H 1 7.70 0.02 . 2 . . . . . . . . 6390 1 1019 . 1 1 105 105 ASN HD22 H 1 6.85 0.02 . 2 . . . . . . . . 6390 1 1020 . 1 1 105 105 ASN C C 13 176.5 0.1 . 1 . . . . . . . . 6390 1 1021 . 1 1 106 106 ALA CA C 13 55.6 0.1 . 1 . . . . . . . . 6390 1 1022 . 1 1 106 106 ALA HA H 1 4.06 0.02 . 1 . . . . . . . . 6390 1 1023 . 1 1 106 106 ALA HB1 H 1 1.44 0.02 . 1 . . . . . . . . 6390 1 1024 . 1 1 106 106 ALA HB2 H 1 1.44 0.02 . 1 . . . . . . . . 6390 1 1025 . 1 1 106 106 ALA HB3 H 1 1.44 0.02 . 1 . . . . . . . . 6390 1 1026 . 1 1 106 106 ALA CB C 13 17.9 0.1 . 1 . . . . . . . . 6390 1 1027 . 1 1 107 107 GLU N N 15 114.6 0.1 . 1 . . . . . . . . 6390 1 1028 . 1 1 107 107 GLU H H 1 8.76 0.02 . 1 . . . . . . . . 6390 1 1029 . 1 1 107 107 GLU CA C 13 57.4 0.1 . 1 . . . . . . . . 6390 1 1030 . 1 1 107 107 GLU HA H 1 4.14 0.02 . 1 . . . . . . . . 6390 1 1031 . 1 1 107 107 GLU CB C 13 29.8 0.1 . 1 . . . . . . . . 6390 1 1032 . 1 1 107 107 GLU HB2 H 1 2.07 0.02 . 2 . . . . . . . . 6390 1 1033 . 1 1 107 107 GLU HB3 H 1 2.00 0.02 . 2 . . . . . . . . 6390 1 1034 . 1 1 107 107 GLU CG C 13 37.1 0.1 . 1 . . . . . . . . 6390 1 1035 . 1 1 107 107 GLU HG2 H 1 2.44 0.02 . 2 . . . . . . . . 6390 1 1036 . 1 1 107 107 GLU HG3 H 1 2.27 0.02 . 2 . . . . . . . . 6390 1 1037 . 1 1 107 107 GLU C C 13 179.9 0.1 . 1 . . . . . . . . 6390 1 1038 . 1 1 108 108 GLY N N 15 109.3 0.1 . 1 . . . . . . . . 6390 1 1039 . 1 1 108 108 GLY H H 1 7.82 0.02 . 1 . . . . . . . . 6390 1 1040 . 1 1 108 108 GLY CA C 13 46.0 0.1 . 1 . . . . . . . . 6390 1 1041 . 1 1 108 108 GLY HA2 H 1 4.13 0.02 . 2 . . . . . . . . 6390 1 1042 . 1 1 108 108 GLY HA3 H 1 3.67 0.02 . 2 . . . . . . . . 6390 1 1043 . 1 1 108 108 GLY C C 13 177.0 0.1 . 1 . . . . . . . . 6390 1 1044 . 1 1 109 109 THR N N 15 107.7 0.1 . 1 . . . . . . . . 6390 1 1045 . 1 1 109 109 THR H H 1 8.43 0.02 . 1 . . . . . . . . 6390 1 1046 . 1 1 109 109 THR CA C 13 60.5 0.1 . 1 . . . . . . . . 6390 1 1047 . 1 1 109 109 THR HA H 1 4.43 0.02 . 1 . . . . . . . . 6390 1 1048 . 1 1 109 109 THR CB C 13 70.0 0.1 . 1 . . . . . . . . 6390 1 1049 . 1 1 109 109 THR HB H 1 4.25 0.02 . 1 . . . . . . . . 6390 1 1050 . 1 1 109 109 THR HG21 H 1 1.24 0.02 . 1 . . . . . . . . 6390 1 1051 . 1 1 109 109 THR HG22 H 1 1.24 0.02 . 1 . . . . . . . . 6390 1 1052 . 1 1 109 109 THR HG23 H 1 1.24 0.02 . 1 . . . . . . . . 6390 1 1053 . 1 1 109 109 THR CG2 C 13 21.6 0.1 . 1 . . . . . . . . 6390 1 1054 . 1 1 109 109 THR C C 13 174.3 0.1 . 1 . . . . . . . . 6390 1 1055 . 1 1 110 110 ARG N N 15 124.5 0.1 . 1 . . . . . . . . 6390 1 1056 . 1 1 110 110 ARG H H 1 7.56 0.02 . 1 . . . . . . . . 6390 1 1057 . 1 1 110 110 ARG CA C 13 55.9 0.1 . 1 . . . . . . . . 6390 1 1058 . 1 1 110 110 ARG HA H 1 4.96 0.02 . 1 . . . . . . . . 6390 1 1059 . 1 1 110 110 ARG CB C 13 33.9 0.1 . 1 . . . . . . . . 6390 1 1060 . 1 1 110 110 ARG HB2 H 1 1.80 0.02 . 2 . . . . . . . . 6390 1 1061 . 1 1 110 110 ARG HB3 H 1 1.39 0.02 . 2 . . . . . . . . 6390 1 1062 . 1 1 110 110 ARG CG C 13 27.2 0.1 . 1 . . . . . . . . 6390 1 1063 . 1 1 110 110 ARG HG2 H 1 1.32 0.02 . 2 . . . . . . . . 6390 1 1064 . 1 1 110 110 ARG HG3 H 1 1.16 0.02 . 2 . . . . . . . . 6390 1 1065 . 1 1 110 110 ARG CD C 13 43.3 0.1 . 1 . . . . . . . . 6390 1 1066 . 1 1 110 110 ARG HD2 H 1 2.99 0.02 . 2 . . . . . . . . 6390 1 1067 . 1 1 110 110 ARG HD3 H 1 2.89 0.02 . 2 . . . . . . . . 6390 1 1068 . 1 1 110 110 ARG C C 13 175.0 0.1 . 1 . . . . . . . . 6390 1 1069 . 1 1 111 111 THR N N 15 120.7 0.1 . 1 . . . . . . . . 6390 1 1070 . 1 1 111 111 THR H H 1 9.29 0.02 . 1 . . . . . . . . 6390 1 1071 . 1 1 111 111 THR CA C 13 61.8 0.1 . 1 . . . . . . . . 6390 1 1072 . 1 1 111 111 THR HA H 1 4.65 0.02 . 1 . . . . . . . . 6390 1 1073 . 1 1 111 111 THR CB C 13 70.6 0.1 . 1 . . . . . . . . 6390 1 1074 . 1 1 111 111 THR HB H 1 3.82 0.02 . 1 . . . . . . . . 6390 1 1075 . 1 1 111 111 THR HG21 H 1 1.02 0.02 . 1 . . . . . . . . 6390 1 1076 . 1 1 111 111 THR HG22 H 1 1.02 0.02 . 1 . . . . . . . . 6390 1 1077 . 1 1 111 111 THR HG23 H 1 1.02 0.02 . 1 . . . . . . . . 6390 1 1078 . 1 1 111 111 THR CG2 C 13 21.9 0.1 . 1 . . . . . . . . 6390 1 1079 . 1 1 111 111 THR C C 13 173.7 0.1 . 1 . . . . . . . . 6390 1 1080 . 1 1 112 112 TYR N N 15 124.6 0.1 . 1 . . . . . . . . 6390 1 1081 . 1 1 112 112 TYR H H 1 9.28 0.02 . 1 . . . . . . . . 6390 1 1082 . 1 1 112 112 TYR CA C 13 56.2 0.1 . 1 . . . . . . . . 6390 1 1083 . 1 1 112 112 TYR HA H 1 5.19 0.02 . 1 . . . . . . . . 6390 1 1084 . 1 1 112 112 TYR CB C 13 41.8 0.1 . 1 . . . . . . . . 6390 1 1085 . 1 1 112 112 TYR HB2 H 1 2.55 0.02 . 2 . . . . . . . . 6390 1 1086 . 1 1 112 112 TYR HB3 H 1 2.48 0.02 . 2 . . . . . . . . 6390 1 1087 . 1 1 112 112 TYR HD1 H 1 6.77 0.02 . 1 . . . . . . . . 6390 1 1088 . 1 1 112 112 TYR HE1 H 1 6.61 0.02 . 1 . . . . . . . . 6390 1 1089 . 1 1 112 112 TYR C C 13 170.9 0.1 . 1 . . . . . . . . 6390 1 1090 . 1 1 113 113 LEU N N 15 121.9 0.1 . 1 . . . . . . . . 6390 1 1091 . 1 1 113 113 LEU H H 1 8.12 0.02 . 1 . . . . . . . . 6390 1 1092 . 1 1 113 113 LEU CA C 13 53.3 0.1 . 1 . . . . . . . . 6390 1 1093 . 1 1 113 113 LEU HA H 1 5.06 0.02 . 1 . . . . . . . . 6390 1 1094 . 1 1 113 113 LEU CB C 13 43.6 0.1 . 1 . . . . . . . . 6390 1 1095 . 1 1 113 113 LEU HB2 H 1 1.25 0.02 . 2 . . . . . . . . 6390 1 1096 . 1 1 113 113 LEU HB3 H 1 1.14 0.02 . 2 . . . . . . . . 6390 1 1097 . 1 1 113 113 LEU CG C 13 26.3 0.1 . 1 . . . . . . . . 6390 1 1098 . 1 1 113 113 LEU HG H 1 1.23 0.02 . 1 . . . . . . . . 6390 1 1099 . 1 1 113 113 LEU HD11 H 1 0.62 0.02 . 2 . . . . . . . . 6390 1 1100 . 1 1 113 113 LEU HD12 H 1 0.62 0.02 . 2 . . . . . . . . 6390 1 1101 . 1 1 113 113 LEU HD13 H 1 0.62 0.02 . 2 . . . . . . . . 6390 1 1102 . 1 1 113 113 LEU HD21 H 1 0.51 0.02 . 2 . . . . . . . . 6390 1 1103 . 1 1 113 113 LEU HD22 H 1 0.51 0.02 . 2 . . . . . . . . 6390 1 1104 . 1 1 113 113 LEU HD23 H 1 0.51 0.02 . 2 . . . . . . . . 6390 1 1105 . 1 1 113 113 LEU CD1 C 13 25.1 0.1 . 1 . . . . . . . . 6390 1 1106 . 1 1 113 113 LEU CD2 C 13 24.8 0.1 . 1 . . . . . . . . 6390 1 1107 . 1 1 113 113 LEU C C 13 174.2 0.1 . 1 . . . . . . . . 6390 1 1108 . 1 1 114 114 LYS N N 15 119.8 0.1 . 1 . . . . . . . . 6390 1 1109 . 1 1 114 114 LYS H H 1 8.89 0.02 . 1 . . . . . . . . 6390 1 1110 . 1 1 114 114 LYS CA C 13 55.0 0.1 . 1 . . . . . . . . 6390 1 1111 . 1 1 114 114 LYS HA H 1 4.72 0.02 . 1 . . . . . . . . 6390 1 1112 . 1 1 114 114 LYS CB C 13 36.8 0.1 . 1 . . . . . . . . 6390 1 1113 . 1 1 114 114 LYS HB2 H 1 1.36 0.02 . 2 . . . . . . . . 6390 1 1114 . 1 1 114 114 LYS HB3 H 1 1.28 0.02 . 2 . . . . . . . . 6390 1 1115 . 1 1 114 114 LYS CG C 13 23.7 0.1 . 1 . . . . . . . . 6390 1 1116 . 1 1 114 114 LYS HG2 H 1 1.09 0.02 . 2 . . . . . . . . 6390 1 1117 . 1 1 114 114 LYS CD C 13 29.6 0.1 . 1 . . . . . . . . 6390 1 1118 . 1 1 114 114 LYS HD2 H 1 1.37 0.02 . 2 . . . . . . . . 6390 1 1119 . 1 1 114 114 LYS HD3 H 1 1.28 0.02 . 2 . . . . . . . . 6390 1 1120 . 1 1 114 114 LYS CE C 13 40.7 0.1 . 1 . . . . . . . . 6390 1 1121 . 1 1 114 114 LYS HE2 H 1 2.60 0.02 . 2 . . . . . . . . 6390 1 1122 . 1 1 114 114 LYS HE3 H 1 2.47 0.02 . 2 . . . . . . . . 6390 1 1123 . 1 1 114 114 LYS C C 13 176.1 0.1 . 1 . . . . . . . . 6390 1 1124 . 1 1 115 115 SER N N 15 115.2 0.1 . 1 . . . . . . . . 6390 1 1125 . 1 1 115 115 SER H H 1 7.97 0.02 . 1 . . . . . . . . 6390 1 1126 . 1 1 115 115 SER CA C 13 55.4 0.1 . 1 . . . . . . . . 6390 1 1127 . 1 1 115 115 SER HA H 1 4.66 0.02 . 1 . . . . . . . . 6390 1 1128 . 1 1 115 115 SER CB C 13 65.0 0.1 . 1 . . . . . . . . 6390 1 1129 . 1 1 115 115 SER HB2 H 1 3.93 0.02 . 2 . . . . . . . . 6390 1 1130 . 1 1 115 115 SER HB3 H 1 3.69 0.02 . 2 . . . . . . . . 6390 1 1131 . 1 1 115 115 SER C C 13 174.4 0.1 . 1 . . . . . . . . 6390 1 1132 . 1 1 116 116 PHE N N 15 124.3 0.1 . 1 . . . . . . . . 6390 1 1133 . 1 1 116 116 PHE H H 1 8.98 0.02 . 1 . . . . . . . . 6390 1 1134 . 1 1 116 116 PHE CA C 13 57.4 0.1 . 1 . . . . . . . . 6390 1 1135 . 1 1 116 116 PHE HA H 1 4.70 0.02 . 1 . . . . . . . . 6390 1 1136 . 1 1 116 116 PHE CB C 13 38.6 0.1 . 1 . . . . . . . . 6390 1 1137 . 1 1 116 116 PHE HB2 H 1 3.22 0.02 . 2 . . . . . . . . 6390 1 1138 . 1 1 116 116 PHE HB3 H 1 1.44 0.02 . 2 . . . . . . . . 6390 1 1139 . 1 1 116 116 PHE HD1 H 1 6.91 0.02 . 1 . . . . . . . . 6390 1 1140 . 1 1 116 116 PHE HE1 H 1 7.28 0.02 . 1 . . . . . . . . 6390 1 1141 . 1 1 116 116 PHE C C 13 175.1 0.1 . 1 . . . . . . . . 6390 1 1142 . 1 1 117 117 GLU CA C 13 55.9 0.1 . 1 . . . . . . . . 6390 1 1143 . 1 1 117 117 GLU HA H 1 4.52 0.02 . 1 . . . . . . . . 6390 1 1144 . 1 1 117 117 GLU CB C 13 30.1 0.1 . 1 . . . . . . . . 6390 1 1145 . 1 1 117 117 GLU HB2 H 1 2.12 0.02 . 2 . . . . . . . . 6390 1 1146 . 1 1 117 117 GLU CG C 13 35.6 0.1 . 1 . . . . . . . . 6390 1 1147 . 1 1 117 117 GLU HG2 H 1 2.35 0.02 . 2 . . . . . . . . 6390 1 1148 . 1 1 117 117 GLU HG3 H 1 2.12 0.02 . 2 . . . . . . . . 6390 1 1149 . 1 1 118 118 ALA N N 15 127.6 0.1 . 1 . . . . . . . . 6390 1 1150 . 1 1 118 118 ALA H H 1 8.34 0.02 . 1 . . . . . . . . 6390 1 1151 . 1 1 118 118 ALA CA C 13 50.6 0.1 . 1 . . . . . . . . 6390 1 1152 . 1 1 118 118 ALA HA H 1 4.68 0.02 . 1 . . . . . . . . 6390 1 1153 . 1 1 118 118 ALA HB1 H 1 1.34 0.02 . 1 . . . . . . . . 6390 1 1154 . 1 1 118 118 ALA HB2 H 1 1.34 0.02 . 1 . . . . . . . . 6390 1 1155 . 1 1 118 118 ALA HB3 H 1 1.34 0.02 . 1 . . . . . . . . 6390 1 1156 . 1 1 118 118 ALA CB C 13 20.8 0.1 . 1 . . . . . . . . 6390 1 1157 . 1 1 118 118 ALA C C 13 174.1 0.1 . 1 . . . . . . . . 6390 1 1158 . 1 1 119 119 ASP N N 15 120.7 0.1 . 1 . . . . . . . . 6390 1 1159 . 1 1 119 119 ASP H H 1 7.90 0.02 . 1 . . . . . . . . 6390 1 1160 . 1 1 119 119 ASP CA C 13 52.1 0.1 . 1 . . . . . . . . 6390 1 1161 . 1 1 119 119 ASP HA H 1 4.33 0.02 . 1 . . . . . . . . 6390 1 1162 . 1 1 119 119 ASP CB C 13 40.2 0.1 . 1 . . . . . . . . 6390 1 1163 . 1 1 119 119 ASP HB2 H 1 2.78 0.02 . 2 . . . . . . . . 6390 1 1164 . 1 1 119 119 ASP HB3 H 1 2.57 0.02 . 2 . . . . . . . . 6390 1 1165 . 1 1 119 119 ASP C C 13 178.6 0.1 . 1 . . . . . . . . 6390 1 1166 . 1 1 120 120 ALA N N 15 120.7 0.1 . 1 . . . . . . . . 6390 1 1167 . 1 1 120 120 ALA H H 1 8.29 0.02 . 1 . . . . . . . . 6390 1 1168 . 1 1 120 120 ALA CA C 13 54.5 0.1 . 1 . . . . . . . . 6390 1 1169 . 1 1 120 120 ALA HA H 1 4.14 0.02 . 1 . . . . . . . . 6390 1 1170 . 1 1 120 120 ALA HB1 H 1 1.45 0.02 . 1 . . . . . . . . 6390 1 1171 . 1 1 120 120 ALA HB2 H 1 1.45 0.02 . 1 . . . . . . . . 6390 1 1172 . 1 1 120 120 ALA HB3 H 1 1.45 0.02 . 1 . . . . . . . . 6390 1 1173 . 1 1 120 120 ALA CB C 13 18.4 0.1 . 1 . . . . . . . . 6390 1 1174 . 1 1 120 120 ALA C C 13 178.1 0.1 . 1 . . . . . . . . 6390 1 1175 . 1 1 121 121 GLU N N 15 116.6 0.1 . 1 . . . . . . . . 6390 1 1176 . 1 1 121 121 GLU H H 1 7.92 0.02 . 1 . . . . . . . . 6390 1 1177 . 1 1 121 121 GLU CA C 13 55.3 0.1 . 1 . . . . . . . . 6390 1 1178 . 1 1 121 121 GLU HA H 1 4.42 0.02 . 1 . . . . . . . . 6390 1 1179 . 1 1 121 121 GLU CB C 13 29.2 0.1 . 1 . . . . . . . . 6390 1 1180 . 1 1 121 121 GLU HB2 H 1 2.21 0.02 . 2 . . . . . . . . 6390 1 1181 . 1 1 121 121 GLU HB3 H 1 1.80 0.02 . 2 . . . . . . . . 6390 1 1182 . 1 1 121 121 GLU C C 13 178.8 0.1 . 1 . . . . . . . . 6390 1 1183 . 1 1 122 122 GLY N N 15 108.7 0.1 . 1 . . . . . . . . 6390 1 1184 . 1 1 122 122 GLY H H 1 8.03 0.02 . 1 . . . . . . . . 6390 1 1185 . 1 1 122 122 GLY CA C 13 45.6 0.1 . 1 . . . . . . . . 6390 1 1186 . 1 1 122 122 GLY HA2 H 1 4.26 0.02 . 2 . . . . . . . . 6390 1 1187 . 1 1 122 122 GLY HA3 H 1 3.68 0.02 . 2 . . . . . . . . 6390 1 1188 . 1 1 122 122 GLY C C 13 176.5 0.1 . 1 . . . . . . . . 6390 1 1189 . 1 1 123 123 ARG N N 15 121.1 0.1 . 1 . . . . . . . . 6390 1 1190 . 1 1 123 123 ARG H H 1 8.49 0.02 . 1 . . . . . . . . 6390 1 1191 . 1 1 123 123 ARG CA C 13 56.2 0.1 . 1 . . . . . . . . 6390 1 1192 . 1 1 123 123 ARG HA H 1 4.47 0.02 . 1 . . . . . . . . 6390 1 1193 . 1 1 123 123 ARG CB C 13 30.2 0.1 . 1 . . . . . . . . 6390 1 1194 . 1 1 123 123 ARG HB2 H 1 2.05 0.02 . 2 . . . . . . . . 6390 1 1195 . 1 1 123 123 ARG C C 13 174.3 0.1 . 1 . . . . . . . . 6390 1 1196 . 1 1 124 124 ARG N N 15 124.7 0.1 . 1 . . . . . . . . 6390 1 1197 . 1 1 124 124 ARG H H 1 9.21 0.02 . 1 . . . . . . . . 6390 1 1198 . 1 1 124 124 ARG CA C 13 55.0 0.1 . 1 . . . . . . . . 6390 1 1199 . 1 1 124 124 ARG HA H 1 4.82 0.02 . 1 . . . . . . . . 6390 1 1200 . 1 1 124 124 ARG CB C 13 31.9 0.1 . 1 . . . . . . . . 6390 1 1201 . 1 1 124 124 ARG HB2 H 1 1.93 0.02 . 2 . . . . . . . . 6390 1 1202 . 1 1 124 124 ARG HB3 H 1 1.78 0.02 . 2 . . . . . . . . 6390 1 1203 . 1 1 124 124 ARG CG C 13 27.5 0.1 . 1 . . . . . . . . 6390 1 1204 . 1 1 124 124 ARG HG2 H 1 1.59 0.02 . 2 . . . . . . . . 6390 1 1205 . 1 1 124 124 ARG HG3 H 1 1.32 0.02 . 2 . . . . . . . . 6390 1 1206 . 1 1 124 124 ARG CD C 13 44.2 0.1 . 1 . . . . . . . . 6390 1 1207 . 1 1 124 124 ARG HD2 H 1 3.31 0.02 . 2 . . . . . . . . 6390 1 1208 . 1 1 124 124 ARG HD3 H 1 3.24 0.02 . 2 . . . . . . . . 6390 1 1209 . 1 1 124 124 ARG C C 13 177.0 0.1 . 1 . . . . . . . . 6390 1 1210 . 1 1 125 125 PHE N N 15 125.5 0.1 . 1 . . . . . . . . 6390 1 1211 . 1 1 125 125 PHE H H 1 9.36 0.02 . 1 . . . . . . . . 6390 1 1212 . 1 1 125 125 PHE CA C 13 59.1 0.1 . 1 . . . . . . . . 6390 1 1213 . 1 1 125 125 PHE HA H 1 4.92 0.02 . 1 . . . . . . . . 6390 1 1214 . 1 1 125 125 PHE CB C 13 41.0 0.1 . 1 . . . . . . . . 6390 1 1215 . 1 1 125 125 PHE HB2 H 1 3.37 0.02 . 2 . . . . . . . . 6390 1 1216 . 1 1 125 125 PHE HB3 H 1 2.95 0.02 . 2 . . . . . . . . 6390 1 1217 . 1 1 125 125 PHE HD1 H 1 7.38 0.02 . 1 . . . . . . . . 6390 1 1218 . 1 1 125 125 PHE C C 13 174.8 0.1 . 1 . . . . . . . . 6390 1 1219 . 1 1 126 126 GLU N N 15 124.6 0.1 . 1 . . . . . . . . 6390 1 1220 . 1 1 126 126 GLU H H 1 7.28 0.02 . 1 . . . . . . . . 6390 1 1221 . 1 1 126 126 GLU CA C 13 55.6 0.1 . 1 . . . . . . . . 6390 1 1222 . 1 1 126 126 GLU HA H 1 4.70 0.02 . 1 . . . . . . . . 6390 1 1223 . 1 1 126 126 GLU CB C 13 33.9 0.1 . 1 . . . . . . . . 6390 1 1224 . 1 1 126 126 GLU HB2 H 1 2.00 0.02 . 2 . . . . . . . . 6390 1 1225 . 1 1 126 126 GLU HB3 H 1 1.56 0.02 . 2 . . . . . . . . 6390 1 1226 . 1 1 126 126 GLU CG C 13 36.9 0.1 . 1 . . . . . . . . 6390 1 1227 . 1 1 126 126 GLU HG2 H 1 1.91 0.02 . 2 . . . . . . . . 6390 1 1228 . 1 1 126 126 GLU HG3 H 1 1.71 0.02 . 2 . . . . . . . . 6390 1 1229 . 1 1 126 126 GLU C C 13 173.8 0.1 . 1 . . . . . . . . 6390 1 1230 . 1 1 127 127 VAL N N 15 123.4 0.1 . 1 . . . . . . . . 6390 1 1231 . 1 1 127 127 VAL H H 1 8.02 0.02 . 1 . . . . . . . . 6390 1 1232 . 1 1 127 127 VAL CA C 13 60.6 0.1 . 1 . . . . . . . . 6390 1 1233 . 1 1 127 127 VAL HA H 1 3.82 0.02 . 1 . . . . . . . . 6390 1 1234 . 1 1 127 127 VAL CB C 13 35.1 0.1 . 1 . . . . . . . . 6390 1 1235 . 1 1 127 127 VAL HB H 1 1.20 0.02 . 1 . . . . . . . . 6390 1 1236 . 1 1 127 127 VAL HG11 H 1 0.42 0.02 . 2 . . . . . . . . 6390 1 1237 . 1 1 127 127 VAL HG12 H 1 0.42 0.02 . 2 . . . . . . . . 6390 1 1238 . 1 1 127 127 VAL HG13 H 1 0.42 0.02 . 2 . . . . . . . . 6390 1 1239 . 1 1 127 127 VAL HG21 H 1 0.23 0.02 . 2 . . . . . . . . 6390 1 1240 . 1 1 127 127 VAL HG22 H 1 0.23 0.02 . 2 . . . . . . . . 6390 1 1241 . 1 1 127 127 VAL HG23 H 1 0.23 0.02 . 2 . . . . . . . . 6390 1 1242 . 1 1 127 127 VAL CG1 C 13 20.4 0.1 . 1 . . . . . . . . 6390 1 1243 . 1 1 127 127 VAL CG2 C 13 22.2 0.1 . 1 . . . . . . . . 6390 1 1244 . 1 1 127 127 VAL C C 13 173.9 0.1 . 1 . . . . . . . . 6390 1 1245 . 1 1 128 128 ALA N N 15 127.0 0.1 . 1 . . . . . . . . 6390 1 1246 . 1 1 128 128 ALA H H 1 7.69 0.02 . 1 . . . . . . . . 6390 1 1247 . 1 1 128 128 ALA CA C 13 49.5 0.1 . 1 . . . . . . . . 6390 1 1248 . 1 1 128 128 ALA HA H 1 5.15 0.02 . 1 . . . . . . . . 6390 1 1249 . 1 1 128 128 ALA HB1 H 1 1.01 0.02 . 1 . . . . . . . . 6390 1 1250 . 1 1 128 128 ALA HB2 H 1 1.01 0.02 . 1 . . . . . . . . 6390 1 1251 . 1 1 128 128 ALA HB3 H 1 1.01 0.02 . 1 . . . . . . . . 6390 1 1252 . 1 1 128 128 ALA CB C 13 23.1 0.1 . 1 . . . . . . . . 6390 1 1253 . 1 1 128 128 ALA C C 13 171.5 0.1 . 1 . . . . . . . . 6390 1 1254 . 1 1 129 129 LEU N N 15 120.3 0.1 . 1 . . . . . . . . 6390 1 1255 . 1 1 129 129 LEU H H 1 9.19 0.02 . 1 . . . . . . . . 6390 1 1256 . 1 1 129 129 LEU CA C 13 54.1 0.1 . 1 . . . . . . . . 6390 1 1257 . 1 1 129 129 LEU HA H 1 5.07 0.02 . 1 . . . . . . . . 6390 1 1258 . 1 1 129 129 LEU CB C 13 44.8 0.1 . 1 . . . . . . . . 6390 1 1259 . 1 1 129 129 LEU HB2 H 1 1.60 0.02 . 2 . . . . . . . . 6390 1 1260 . 1 1 129 129 LEU HB3 H 1 1.13 0.02 . 2 . . . . . . . . 6390 1 1261 . 1 1 129 129 LEU CG C 13 28.4 0.1 . 1 . . . . . . . . 6390 1 1262 . 1 1 129 129 LEU HG H 1 1.31 0.02 . 1 . . . . . . . . 6390 1 1263 . 1 1 129 129 LEU HD11 H 1 0.26 0.02 . 2 . . . . . . . . 6390 1 1264 . 1 1 129 129 LEU HD12 H 1 0.26 0.02 . 2 . . . . . . . . 6390 1 1265 . 1 1 129 129 LEU HD13 H 1 0.26 0.02 . 2 . . . . . . . . 6390 1 1266 . 1 1 129 129 LEU HD21 H 1 -0.08 0.02 . 2 . . . . . . . . 6390 1 1267 . 1 1 129 129 LEU HD22 H 1 -0.08 0.02 . 2 . . . . . . . . 6390 1 1268 . 1 1 129 129 LEU HD23 H 1 -0.08 0.02 . 2 . . . . . . . . 6390 1 1269 . 1 1 129 129 LEU CD1 C 13 24.9 0.1 . 1 . . . . . . . . 6390 1 1270 . 1 1 129 129 LEU CD2 C 13 27.5 0.1 . 1 . . . . . . . . 6390 1 1271 . 1 1 129 129 LEU C C 13 175.5 0.1 . 1 . . . . . . . . 6390 1 1272 . 1 1 130 130 ASP N N 15 123.4 0.1 . 1 . . . . . . . . 6390 1 1273 . 1 1 130 130 ASP H H 1 7.68 0.02 . 1 . . . . . . . . 6390 1 1274 . 1 1 130 130 ASP CA C 13 57.1 0.1 . 1 . . . . . . . . 6390 1 1275 . 1 1 130 130 ASP HA H 1 4.85 0.02 . 1 . . . . . . . . 6390 1 1276 . 1 1 130 130 ASP CB C 13 41.0 0.1 . 1 . . . . . . . . 6390 1 1277 . 1 1 130 130 ASP HB2 H 1 2.80 0.02 . 2 . . . . . . . . 6390 1 1278 . 1 1 130 130 ASP HB3 H 1 2.69 0.02 . 2 . . . . . . . . 6390 1 1279 . 1 1 130 130 ASP C C 13 175.7 0.1 . 1 . . . . . . . . 6390 1 1280 . 1 1 131 131 GLY N N 15 110.0 0.1 . 1 . . . . . . . . 6390 1 1281 . 1 1 131 131 GLY H H 1 7.94 0.02 . 1 . . . . . . . . 6390 1 1282 . 1 1 131 131 GLY CA C 13 43.3 0.1 . 1 . . . . . . . . 6390 1 1283 . 1 1 131 131 GLY HA2 H 1 4.21 0.02 . 2 . . . . . . . . 6390 1 1284 . 1 1 131 131 GLY HA3 H 1 3.51 0.02 . 2 . . . . . . . . 6390 1 1285 . 1 1 131 131 GLY C C 13 177.0 0.1 . 1 . . . . . . . . 6390 1 1286 . 1 1 132 132 ASP N N 15 117.8 0.1 . 1 . . . . . . . . 6390 1 1287 . 1 1 132 132 ASP H H 1 8.17 0.02 . 1 . . . . . . . . 6390 1 1288 . 1 1 132 132 ASP CA C 13 52.4 0.1 . 1 . . . . . . . . 6390 1 1289 . 1 1 132 132 ASP HA H 1 4.27 0.02 . 1 . . . . . . . . 6390 1 1290 . 1 1 132 132 ASP CB C 13 39.5 0.1 . 1 . . . . . . . . 6390 1 1291 . 1 1 132 132 ASP HB2 H 1 2.75 0.02 . 2 . . . . . . . . 6390 1 1292 . 1 1 132 132 ASP HB3 H 1 2.58 0.02 . 2 . . . . . . . . 6390 1 1293 . 1 1 132 132 ASP C C 13 172.4 0.1 . 1 . . . . . . . . 6390 1 1294 . 1 1 133 133 HIS N N 15 124.7 0.1 . 1 . . . . . . . . 6390 1 1295 . 1 1 133 133 HIS H H 1 8.88 0.02 . 1 . . . . . . . . 6390 1 1296 . 1 1 133 133 HIS CA C 13 54.6 0.1 . 1 . . . . . . . . 6390 1 1297 . 1 1 133 133 HIS HA H 1 4.17 0.02 . 1 . . . . . . . . 6390 1 1298 . 1 1 133 133 HIS CB C 13 29.0 0.1 . 1 . . . . . . . . 6390 1 1299 . 1 1 133 133 HIS HB2 H 1 2.12 0.02 . 2 . . . . . . . . 6390 1 1300 . 1 1 133 133 HIS HB3 H 1 1.98 0.02 . 2 . . . . . . . . 6390 1 1301 . 1 1 133 133 HIS C C 13 177.0 0.1 . 1 . . . . . . . . 6390 1 1302 . 1 1 134 134 THR N N 15 113.4 0.1 . 1 . . . . . . . . 6390 1 1303 . 1 1 134 134 THR H H 1 8.41 0.02 . 1 . . . . . . . . 6390 1 1304 . 1 1 134 134 THR CA C 13 65.3 0.1 . 1 . . . . . . . . 6390 1 1305 . 1 1 134 134 THR HA H 1 3.89 0.02 . 1 . . . . . . . . 6390 1 1306 . 1 1 134 134 THR CB C 13 68.8 0.1 . 1 . . . . . . . . 6390 1 1307 . 1 1 134 134 THR HB H 1 4.19 0.02 . 1 . . . . . . . . 6390 1 1308 . 1 1 134 134 THR HG21 H 1 1.29 0.02 . 1 . . . . . . . . 6390 1 1309 . 1 1 134 134 THR HG22 H 1 1.29 0.02 . 1 . . . . . . . . 6390 1 1310 . 1 1 134 134 THR HG23 H 1 1.29 0.02 . 1 . . . . . . . . 6390 1 1311 . 1 1 134 134 THR CG2 C 13 22.8 0.1 . 1 . . . . . . . . 6390 1 1312 . 1 1 134 134 THR C C 13 170.8 0.1 . 1 . . . . . . . . 6390 1 1313 . 1 1 135 135 GLY N N 15 108.9 0.1 . 1 . . . . . . . . 6390 1 1314 . 1 1 135 135 GLY H H 1 8.58 0.02 . 1 . . . . . . . . 6390 1 1315 . 1 1 135 135 GLY CA C 13 44.8 0.1 . 1 . . . . . . . . 6390 1 1316 . 1 1 135 135 GLY HA2 H 1 4.33 0.02 . 2 . . . . . . . . 6390 1 1317 . 1 1 135 135 GLY HA3 H 1 3.72 0.02 . 2 . . . . . . . . 6390 1 1318 . 1 1 135 135 GLY C C 13 176.2 0.1 . 1 . . . . . . . . 6390 1 1319 . 1 1 136 136 ASP N N 15 116.9 0.1 . 1 . . . . . . . . 6390 1 1320 . 1 1 136 136 ASP H H 1 7.32 0.02 . 1 . . . . . . . . 6390 1 1321 . 1 1 136 136 ASP CA C 13 53.3 0.1 . 1 . . . . . . . . 6390 1 1322 . 1 1 136 136 ASP HA H 1 4.83 0.02 . 1 . . . . . . . . 6390 1 1323 . 1 1 136 136 ASP CB C 13 41.3 0.1 . 1 . . . . . . . . 6390 1 1324 . 1 1 136 136 ASP HB2 H 1 2.87 0.02 . 2 . . . . . . . . 6390 1 1325 . 1 1 136 136 ASP HB3 H 1 2.65 0.02 . 2 . . . . . . . . 6390 1 1326 . 1 1 136 136 ASP C C 13 175.0 0.1 . 1 . . . . . . . . 6390 1 1327 . 1 1 137 137 LEU N N 15 122.2 0.1 . 1 . . . . . . . . 6390 1 1328 . 1 1 137 137 LEU H H 1 7.22 0.02 . 1 . . . . . . . . 6390 1 1329 . 1 1 137 137 LEU CA C 13 54.5 0.1 . 1 . . . . . . . . 6390 1 1330 . 1 1 137 137 LEU HA H 1 5.20 0.02 . 1 . . . . . . . . 6390 1 1331 . 1 1 137 137 LEU CB C 13 43.0 0.1 . 1 . . . . . . . . 6390 1 1332 . 1 1 137 137 LEU HB2 H 1 1.77 0.02 . 2 . . . . . . . . 6390 1 1333 . 1 1 137 137 LEU HB3 H 1 1.33 0.02 . 2 . . . . . . . . 6390 1 1334 . 1 1 137 137 LEU CG C 13 27.2 0.1 . 1 . . . . . . . . 6390 1 1335 . 1 1 137 137 LEU HG H 1 1.78 0.02 . 1 . . . . . . . . 6390 1 1336 . 1 1 137 137 LEU HD11 H 1 0.52 0.02 . 2 . . . . . . . . 6390 1 1337 . 1 1 137 137 LEU HD12 H 1 0.52 0.02 . 2 . . . . . . . . 6390 1 1338 . 1 1 137 137 LEU HD13 H 1 0.52 0.02 . 2 . . . . . . . . 6390 1 1339 . 1 1 137 137 LEU HD21 H 1 0.47 0.02 . 2 . . . . . . . . 6390 1 1340 . 1 1 137 137 LEU HD22 H 1 0.47 0.02 . 2 . . . . . . . . 6390 1 1341 . 1 1 137 137 LEU HD23 H 1 0.47 0.02 . 2 . . . . . . . . 6390 1 1342 . 1 1 137 137 LEU CD1 C 13 26.3 0.1 . 1 . . . . . . . . 6390 1 1343 . 1 1 137 137 LEU CD2 C 13 26.3 0.1 . 1 . . . . . . . . 6390 1 1344 . 1 1 137 137 LEU C C 13 175.9 0.1 . 1 . . . . . . . . 6390 1 1345 . 1 1 138 138 SER N N 15 118.8 0.1 . 1 . . . . . . . . 6390 1 1346 . 1 1 138 138 SER H H 1 9.23 0.02 . 1 . . . . . . . . 6390 1 1347 . 1 1 138 138 SER CA C 13 57.1 0.1 . 1 . . . . . . . . 6390 1 1348 . 1 1 138 138 SER HA H 1 4.71 0.02 . 1 . . . . . . . . 6390 1 1349 . 1 1 138 138 SER CB C 13 66.4 0.1 . 1 . . . . . . . . 6390 1 1350 . 1 1 138 138 SER HB2 H 1 4.23 0.02 . 2 . . . . . . . . 6390 1 1351 . 1 1 138 138 SER HB3 H 1 3.95 0.02 . 2 . . . . . . . . 6390 1 1352 . 1 1 138 138 SER C C 13 175.7 0.1 . 1 . . . . . . . . 6390 1 1353 . 1 1 139 139 ALA N N 15 120.8 0.1 . 1 . . . . . . . . 6390 1 1354 . 1 1 139 139 ALA H H 1 8.84 0.02 . 1 . . . . . . . . 6390 1 1355 . 1 1 139 139 ALA CA C 13 53.9 0.1 . 1 . . . . . . . . 6390 1 1356 . 1 1 139 139 ALA HA H 1 4.83 0.02 . 1 . . . . . . . . 6390 1 1357 . 1 1 139 139 ALA HB1 H 1 1.70 0.02 . 1 . . . . . . . . 6390 1 1358 . 1 1 139 139 ALA HB2 H 1 1.70 0.02 . 1 . . . . . . . . 6390 1 1359 . 1 1 139 139 ALA HB3 H 1 1.70 0.02 . 1 . . . . . . . . 6390 1 1360 . 1 1 139 139 ALA CB C 13 18.1 0.1 . 1 . . . . . . . . 6390 1 1361 . 1 1 139 139 ALA C C 13 173.5 0.1 . 1 . . . . . . . . 6390 1 1362 . 1 1 140 140 ALA N N 15 118.3 0.1 . 1 . . . . . . . . 6390 1 1363 . 1 1 140 140 ALA H H 1 8.15 0.02 . 1 . . . . . . . . 6390 1 1364 . 1 1 140 140 ALA CA C 13 53.8 0.1 . 1 . . . . . . . . 6390 1 1365 . 1 1 140 140 ALA HA H 1 4.28 0.02 . 1 . . . . . . . . 6390 1 1366 . 1 1 140 140 ALA HB1 H 1 1.36 0.02 . 1 . . . . . . . . 6390 1 1367 . 1 1 140 140 ALA HB2 H 1 1.36 0.02 . 1 . . . . . . . . 6390 1 1368 . 1 1 140 140 ALA HB3 H 1 1.36 0.02 . 1 . . . . . . . . 6390 1 1369 . 1 1 140 140 ALA CB C 13 18.7 0.1 . 1 . . . . . . . . 6390 1 1370 . 1 1 140 140 ALA C C 13 177.5 0.1 . 1 . . . . . . . . 6390 1 1371 . 1 1 141 141 ASN N N 15 113.4 0.1 . 1 . . . . . . . . 6390 1 1372 . 1 1 141 141 ASN H H 1 7.75 0.02 . 1 . . . . . . . . 6390 1 1373 . 1 1 141 141 ASN CA C 13 52.4 0.1 . 1 . . . . . . . . 6390 1 1374 . 1 1 141 141 ASN HA H 1 4.81 0.02 . 1 . . . . . . . . 6390 1 1375 . 1 1 141 141 ASN CB C 13 38.9 0.1 . 1 . . . . . . . . 6390 1 1376 . 1 1 141 141 ASN HB2 H 1 3.86 0.02 . 2 . . . . . . . . 6390 1 1377 . 1 1 141 141 ASN HB3 H 1 3.00 0.02 . 2 . . . . . . . . 6390 1 1378 . 1 1 141 141 ASN ND2 N 15 107.2 0.1 . 1 . . . . . . . . 6390 1 1379 . 1 1 141 141 ASN HD21 H 1 7.68 0.02 . 2 . . . . . . . . 6390 1 1380 . 1 1 141 141 ASN HD22 H 1 7.32 0.02 . 2 . . . . . . . . 6390 1 1381 . 1 1 141 141 ASN C C 13 179.2 0.1 . 1 . . . . . . . . 6390 1 1382 . 1 1 142 142 VAL N N 15 120.9 0.1 . 1 . . . . . . . . 6390 1 1383 . 1 1 142 142 VAL H H 1 7.66 0.02 . 1 . . . . . . . . 6390 1 1384 . 1 1 142 142 VAL CA C 13 61.2 0.1 . 1 . . . . . . . . 6390 1 1385 . 1 1 142 142 VAL HA H 1 4.72 0.02 . 1 . . . . . . . . 6390 1 1386 . 1 1 142 142 VAL CB C 13 33.1 0.1 . 1 . . . . . . . . 6390 1 1387 . 1 1 142 142 VAL HB H 1 1.73 0.02 . 1 . . . . . . . . 6390 1 1388 . 1 1 142 142 VAL HG11 H 1 -0.05 0.02 . 2 . . . . . . . . 6390 1 1389 . 1 1 142 142 VAL HG12 H 1 -0.05 0.02 . 2 . . . . . . . . 6390 1 1390 . 1 1 142 142 VAL HG13 H 1 -0.05 0.02 . 2 . . . . . . . . 6390 1 1391 . 1 1 142 142 VAL HG21 H 1 0.88 0.02 . 2 . . . . . . . . 6390 1 1392 . 1 1 142 142 VAL HG22 H 1 0.88 0.02 . 2 . . . . . . . . 6390 1 1393 . 1 1 142 142 VAL HG23 H 1 0.88 0.02 . 2 . . . . . . . . 6390 1 1394 . 1 1 142 142 VAL CG1 C 13 22.2 0.1 . 1 . . . . . . . . 6390 1 1395 . 1 1 142 142 VAL CG2 C 13 21.9 0.1 . 1 . . . . . . . . 6390 1 1396 . 1 1 142 142 VAL C C 13 172.9 0.1 . 1 . . . . . . . . 6390 1 1397 . 1 1 143 143 VAL N N 15 125.5 0.1 . 1 . . . . . . . . 6390 1 1398 . 1 1 143 143 VAL H H 1 8.73 0.02 . 1 . . . . . . . . 6390 1 1399 . 1 1 143 143 VAL CA C 13 61.5 0.1 . 1 . . . . . . . . 6390 1 1400 . 1 1 143 143 VAL HA H 1 3.98 0.02 . 1 . . . . . . . . 6390 1 1401 . 1 1 143 143 VAL CB C 13 32.4 0.1 . 1 . . . . . . . . 6390 1 1402 . 1 1 143 143 VAL HB H 1 2.14 0.02 . 1 . . . . . . . . 6390 1 1403 . 1 1 143 143 VAL HG11 H 1 0.99 0.02 . 2 . . . . . . . . 6390 1 1404 . 1 1 143 143 VAL HG12 H 1 0.99 0.02 . 2 . . . . . . . . 6390 1 1405 . 1 1 143 143 VAL HG13 H 1 0.99 0.02 . 2 . . . . . . . . 6390 1 1406 . 1 1 143 143 VAL HG21 H 1 0.89 0.02 . 2 . . . . . . . . 6390 1 1407 . 1 1 143 143 VAL HG22 H 1 0.89 0.02 . 2 . . . . . . . . 6390 1 1408 . 1 1 143 143 VAL HG23 H 1 0.89 0.02 . 2 . . . . . . . . 6390 1 1409 . 1 1 143 143 VAL CG1 C 13 21.9 0.1 . 1 . . . . . . . . 6390 1 1410 . 1 1 143 143 VAL CG2 C 13 19.6 0.1 . 1 . . . . . . . . 6390 1 1411 . 1 1 143 143 VAL C C 13 174.1 0.1 . 1 . . . . . . . . 6390 1 1412 . 1 1 144 144 PHE N N 15 124.6 0.1 . 1 . . . . . . . . 6390 1 1413 . 1 1 144 144 PHE H H 1 8.48 0.02 . 1 . . . . . . . . 6390 1 1414 . 1 1 144 144 PHE CA C 13 59.4 0.1 . 1 . . . . . . . . 6390 1 1415 . 1 1 144 144 PHE HA H 1 4.38 0.02 . 1 . . . . . . . . 6390 1 1416 . 1 1 144 144 PHE CB C 13 40.1 0.1 . 1 . . . . . . . . 6390 1 1417 . 1 1 144 144 PHE HB2 H 1 3.39 0.02 . 2 . . . . . . . . 6390 1 1418 . 1 1 144 144 PHE HB3 H 1 2.66 0.02 . 2 . . . . . . . . 6390 1 1419 . 1 1 144 144 PHE HD1 H 1 7.30 0.02 . 1 . . . . . . . . 6390 1 1420 . 1 1 144 144 PHE C C 13 175.5 0.1 . 1 . . . . . . . . 6390 1 1421 . 1 1 145 145 ALA N N 15 120.5 0.1 . 1 . . . . . . . . 6390 1 1422 . 1 1 145 145 ALA H H 1 7.77 0.02 . 1 . . . . . . . . 6390 1 1423 . 1 1 145 145 ALA CA C 13 51.5 0.1 . 1 . . . . . . . . 6390 1 1424 . 1 1 145 145 ALA HA H 1 4.53 0.02 . 1 . . . . . . . . 6390 1 1425 . 1 1 145 145 ALA HB1 H 1 1.43 0.02 . 1 . . . . . . . . 6390 1 1426 . 1 1 145 145 ALA HB2 H 1 1.43 0.02 . 1 . . . . . . . . 6390 1 1427 . 1 1 145 145 ALA HB3 H 1 1.43 0.02 . 1 . . . . . . . . 6390 1 1428 . 1 1 145 145 ALA CB C 13 21.0 0.1 . 1 . . . . . . . . 6390 1 1429 . 1 1 145 145 ALA C C 13 175.3 0.1 . 1 . . . . . . . . 6390 1 1430 . 1 1 146 146 ALA N N 15 124.3 0.1 . 1 . . . . . . . . 6390 1 1431 . 1 1 146 146 ALA H H 1 8.53 0.02 . 1 . . . . . . . . 6390 1 1432 . 1 1 146 146 ALA CA C 13 52.1 0.1 . 1 . . . . . . . . 6390 1 1433 . 1 1 146 146 ALA HA H 1 4.44 0.02 . 1 . . . . . . . . 6390 1 1434 . 1 1 146 146 ALA HB1 H 1 1.41 0.02 . 1 . . . . . . . . 6390 1 1435 . 1 1 146 146 ALA HB2 H 1 1.41 0.02 . 1 . . . . . . . . 6390 1 1436 . 1 1 146 146 ALA HB3 H 1 1.41 0.02 . 1 . . . . . . . . 6390 1 1437 . 1 1 146 146 ALA CB C 13 19.0 0.1 . 1 . . . . . . . . 6390 1 1438 . 1 1 146 146 ALA C C 13 176.2 0.1 . 1 . . . . . . . . 6390 1 1439 . 1 1 147 147 THR N N 15 114.2 0.1 . 1 . . . . . . . . 6390 1 1440 . 1 1 147 147 THR H H 1 8.13 0.02 . 1 . . . . . . . . 6390 1 1441 . 1 1 147 147 THR CA C 13 61.5 0.1 . 1 . . . . . . . . 6390 1 1442 . 1 1 147 147 THR HA H 1 4.26 0.02 . 1 . . . . . . . . 6390 1 1443 . 1 1 147 147 THR CB C 13 69.9 0.1 . 1 . . . . . . . . 6390 1 1444 . 1 1 147 147 THR HB H 1 4.17 0.02 . 1 . . . . . . . . 6390 1 1445 . 1 1 147 147 THR C C 13 178.0 0.1 . 1 . . . . . . . . 6390 1 1446 . 1 1 148 148 GLY N N 15 111.8 0.1 . 1 . . . . . . . . 6390 1 1447 . 1 1 148 148 GLY H H 1 8.37 0.02 . 1 . . . . . . . . 6390 1 1448 . 1 1 148 148 GLY CA C 13 45.1 0.1 . 1 . . . . . . . . 6390 1 1449 . 1 1 148 148 GLY HA2 H 1 4.08 0.02 . 2 . . . . . . . . 6390 1 1450 . 1 1 148 148 GLY HA3 H 1 4.01 0.02 . 2 . . . . . . . . 6390 1 1451 . 1 1 148 148 GLY C C 13 175.3 0.1 . 1 . . . . . . . . 6390 1 1452 . 1 1 149 149 THR N N 15 114.3 0.1 . 1 . . . . . . . . 6390 1 1453 . 1 1 149 149 THR H H 1 8.04 0.02 . 1 . . . . . . . . 6390 1 1454 . 1 1 149 149 THR CA C 13 61.8 0.1 . 1 . . . . . . . . 6390 1 1455 . 1 1 149 149 THR HA H 1 4.46 0.02 . 1 . . . . . . . . 6390 1 1456 . 1 1 149 149 THR CB C 13 69.5 0.1 . 1 . . . . . . . . 6390 1 1457 . 1 1 149 149 THR HB H 1 4.26 0.02 . 1 . . . . . . . . 6390 1 1458 . 1 1 149 149 THR HG21 H 1 1.20 0.02 . 1 . . . . . . . . 6390 1 1459 . 1 1 149 149 THR HG22 H 1 1.20 0.02 . 1 . . . . . . . . 6390 1 1460 . 1 1 149 149 THR HG23 H 1 1.20 0.02 . 1 . . . . . . . . 6390 1 1461 . 1 1 149 149 THR CG2 C 13 21.7 0.1 . 1 . . . . . . . . 6390 1 1462 . 1 1 149 149 THR C C 13 174.4 0.1 . 1 . . . . . . . . 6390 1 1463 . 1 1 150 150 THR N N 15 117.1 0.1 . 1 . . . . . . . . 6390 1 1464 . 1 1 150 150 THR H H 1 8.20 0.02 . 1 . . . . . . . . 6390 1 1465 . 1 1 150 150 THR CA C 13 61.5 0.1 . 1 . . . . . . . . 6390 1 1466 . 1 1 150 150 THR HA H 1 4.47 0.02 . 1 . . . . . . . . 6390 1 1467 . 1 1 150 150 THR CB C 13 69.7 0.1 . 1 . . . . . . . . 6390 1 1468 . 1 1 150 150 THR HB H 1 4.29 0.02 . 1 . . . . . . . . 6390 1 1469 . 1 1 150 150 THR HG21 H 1 1.28 0.02 . 1 . . . . . . . . 6390 1 1470 . 1 1 150 150 THR HG22 H 1 1.28 0.02 . 1 . . . . . . . . 6390 1 1471 . 1 1 150 150 THR HG23 H 1 1.28 0.02 . 1 . . . . . . . . 6390 1 1472 . 1 1 150 150 THR CG2 C 13 21.2 0.1 . 1 . . . . . . . . 6390 1 1473 . 1 1 150 150 THR C C 13 175.0 0.1 . 1 . . . . . . . . 6390 1 1474 . 1 1 151 151 THR N N 15 117.4 0.1 . 1 . . . . . . . . 6390 1 1475 . 1 1 151 151 THR H H 1 8.12 0.02 . 1 . . . . . . . . 6390 1 1476 . 1 1 151 151 THR CA C 13 62.0 0.1 . 1 . . . . . . . . 6390 1 1477 . 1 1 151 151 THR HA H 1 4.34 0.02 . 1 . . . . . . . . 6390 1 1478 . 1 1 151 151 THR CB C 13 69.4 0.1 . 1 . . . . . . . . 6390 1 1479 . 1 1 151 151 THR HB H 1 4.21 0.02 . 1 . . . . . . . . 6390 1 1480 . 1 1 151 151 THR HG21 H 1 1.19 0.02 . 1 . . . . . . . . 6390 1 1481 . 1 1 151 151 THR HG22 H 1 1.19 0.02 . 1 . . . . . . . . 6390 1 1482 . 1 1 151 151 THR HG23 H 1 1.19 0.02 . 1 . . . . . . . . 6390 1 1483 . 1 1 151 151 THR CG2 C 13 21.6 0.1 . 1 . . . . . . . . 6390 1 1484 . 1 1 151 151 THR C C 13 174.7 0.1 . 1 . . . . . . . . 6390 1 1485 . 1 1 152 152 GLU N N 15 124.1 0.1 . 1 . . . . . . . . 6390 1 1486 . 1 1 152 152 GLU H H 1 8.33 0.02 . 1 . . . . . . . . 6390 1 1487 . 1 1 152 152 GLU CA C 13 56.5 0.1 . 1 . . . . . . . . 6390 1 1488 . 1 1 152 152 GLU HA H 1 4.29 0.02 . 1 . . . . . . . . 6390 1 1489 . 1 1 152 152 GLU CB C 13 29.8 0.1 . 1 . . . . . . . . 6390 1 1490 . 1 1 152 152 GLU HB2 H 1 2.07 0.02 . 2 . . . . . . . . 6390 1 1491 . 1 1 152 152 GLU HB3 H 1 1.96 0.02 . 2 . . . . . . . . 6390 1 1492 . 1 1 152 152 GLU CG C 13 32.4 0.1 . 1 . . . . . . . . 6390 1 1493 . 1 1 152 152 GLU HG2 H 1 2.27 0.02 . 2 . . . . . . . . 6390 1 1494 . 1 1 152 152 GLU C C 13 174.5 0.1 . 1 . . . . . . . . 6390 1 1495 . 1 1 153 153 LEU N N 15 123.7 0.1 . 1 . . . . . . . . 6390 1 1496 . 1 1 153 153 LEU H H 1 8.11 0.02 . 1 . . . . . . . . 6390 1 1497 . 1 1 153 153 LEU CA C 13 55.0 0.1 . 1 . . . . . . . . 6390 1 1498 . 1 1 153 153 LEU HA H 1 4.32 0.02 . 1 . . . . . . . . 6390 1 1499 . 1 1 153 153 LEU CB C 13 42.1 0.1 . 1 . . . . . . . . 6390 1 1500 . 1 1 153 153 LEU HB2 H 1 1.68 0.02 . 2 . . . . . . . . 6390 1 1501 . 1 1 153 153 LEU HB3 H 1 1.59 0.02 . 2 . . . . . . . . 6390 1 1502 . 1 1 153 153 LEU HD11 H 1 0.95 0.02 . 2 . . . . . . . . 6390 1 1503 . 1 1 153 153 LEU HD12 H 1 0.95 0.02 . 2 . . . . . . . . 6390 1 1504 . 1 1 153 153 LEU HD13 H 1 0.95 0.02 . 2 . . . . . . . . 6390 1 1505 . 1 1 153 153 LEU HD21 H 1 0.84 0.02 . 2 . . . . . . . . 6390 1 1506 . 1 1 153 153 LEU HD22 H 1 0.84 0.02 . 2 . . . . . . . . 6390 1 1507 . 1 1 153 153 LEU HD23 H 1 0.84 0.02 . 2 . . . . . . . . 6390 1 1508 . 1 1 153 153 LEU CD1 C 13 24.5 0.1 . 1 . . . . . . . . 6390 1 1509 . 1 1 153 153 LEU CD2 C 13 24.5 0.1 . 1 . . . . . . . . 6390 1 1510 . 1 1 153 153 LEU C C 13 176.2 0.1 . 1 . . . . . . . . 6390 1 1511 . 1 1 154 154 GLU N N 15 122.9 0.1 . 1 . . . . . . . . 6390 1 1512 . 1 1 154 154 GLU H H 1 8.24 0.02 . 1 . . . . . . . . 6390 1 1513 . 1 1 154 154 GLU CA C 13 56.4 0.1 . 1 . . . . . . . . 6390 1 1514 . 1 1 154 154 GLU HA H 1 4.30 0.02 . 1 . . . . . . . . 6390 1 1515 . 1 1 154 154 GLU CB C 13 29.9 0.1 . 1 . . . . . . . . 6390 1 1516 . 1 1 154 154 GLU HB2 H 1 2.04 0.02 . 2 . . . . . . . . 6390 1 1517 . 1 1 154 154 GLU HB3 H 1 1.93 0.02 . 2 . . . . . . . . 6390 1 1518 . 1 1 154 154 GLU CG C 13 36.2 0.1 . 1 . . . . . . . . 6390 1 1519 . 1 1 154 154 GLU HG2 H 1 2.22 0.02 . 2 . . . . . . . . 6390 1 1520 . 1 1 154 154 GLU HG3 H 1 2.30 0.02 . 2 . . . . . . . . 6390 1 1521 . 1 1 154 154 GLU C C 13 177.4 0.1 . 1 . . . . . . . . 6390 1 1522 . 1 1 155 155 VAL N N 15 122.4 0.1 . 1 . . . . . . . . 6390 1 1523 . 1 1 155 155 VAL H H 1 8.06 0.02 . 1 . . . . . . . . 6390 1 1524 . 1 1 155 155 VAL CA C 13 62.1 0.1 . 1 . . . . . . . . 6390 1 1525 . 1 1 155 155 VAL HA H 1 4.13 0.02 . 1 . . . . . . . . 6390 1 1526 . 1 1 155 155 VAL CB C 13 32.4 0.1 . 1 . . . . . . . . 6390 1 1527 . 1 1 155 155 VAL HB H 1 2.07 0.02 . 1 . . . . . . . . 6390 1 1528 . 1 1 155 155 VAL HG11 H 1 0.94 0.02 . 2 . . . . . . . . 6390 1 1529 . 1 1 155 155 VAL HG12 H 1 0.94 0.02 . 2 . . . . . . . . 6390 1 1530 . 1 1 155 155 VAL HG13 H 1 0.94 0.02 . 2 . . . . . . . . 6390 1 1531 . 1 1 155 155 VAL HG21 H 1 0.92 0.02 . 2 . . . . . . . . 6390 1 1532 . 1 1 155 155 VAL HG22 H 1 0.92 0.02 . 2 . . . . . . . . 6390 1 1533 . 1 1 155 155 VAL HG23 H 1 0.92 0.02 . 2 . . . . . . . . 6390 1 1534 . 1 1 155 155 VAL CG1 C 13 21.0 0.1 . 1 . . . . . . . . 6390 1 1535 . 1 1 155 155 VAL CG2 C 13 21.0 0.1 . 1 . . . . . . . . 6390 1 1536 . 1 1 155 155 VAL C C 13 176.4 0.1 . 1 . . . . . . . . 6390 1 1537 . 1 1 156 156 LEU N N 15 126.7 0.1 . 1 . . . . . . . . 6390 1 1538 . 1 1 156 156 LEU H H 1 8.25 0.02 . 1 . . . . . . . . 6390 1 1539 . 1 1 156 156 LEU CA C 13 55.0 0.1 . 1 . . . . . . . . 6390 1 1540 . 1 1 156 156 LEU HA H 1 4.37 0.02 . 1 . . . . . . . . 6390 1 1541 . 1 1 156 156 LEU CB C 13 42.1 0.1 . 1 . . . . . . . . 6390 1 1542 . 1 1 156 156 LEU HB2 H 1 1.71 0.02 . 2 . . . . . . . . 6390 1 1543 . 1 1 156 156 LEU HB3 H 1 1.62 0.02 . 2 . . . . . . . . 6390 1 1544 . 1 1 156 156 LEU HD11 H 1 0.95 0.02 . 2 . . . . . . . . 6390 1 1545 . 1 1 156 156 LEU HD12 H 1 0.95 0.02 . 2 . . . . . . . . 6390 1 1546 . 1 1 156 156 LEU HD13 H 1 0.95 0.02 . 2 . . . . . . . . 6390 1 1547 . 1 1 156 156 LEU HD21 H 1 0.91 0.02 . 2 . . . . . . . . 6390 1 1548 . 1 1 156 156 LEU HD22 H 1 0.91 0.02 . 2 . . . . . . . . 6390 1 1549 . 1 1 156 156 LEU HD23 H 1 0.91 0.02 . 2 . . . . . . . . 6390 1 1550 . 1 1 156 156 LEU CD1 C 13 26.3 0.1 . 1 . . . . . . . . 6390 1 1551 . 1 1 156 156 LEU CD2 C 13 26.3 0.1 . 1 . . . . . . . . 6390 1 1552 . 1 1 156 156 LEU C C 13 176.2 0.1 . 1 . . . . . . . . 6390 1 1553 . 1 1 157 157 GLY N N 15 110.2 0.1 . 1 . . . . . . . . 6390 1 1554 . 1 1 157 157 GLY H H 1 8.23 0.02 . 1 . . . . . . . . 6390 1 1555 . 1 1 157 157 GLY CA C 13 45.0 0.1 . 1 . . . . . . . . 6390 1 1556 . 1 1 157 157 GLY HA2 H 1 4.00 0.02 . 2 . . . . . . . . 6390 1 1557 . 1 1 157 157 GLY HA3 H 1 3.94 0.02 . 2 . . . . . . . . 6390 1 1558 . 1 1 157 157 GLY C C 13 178.0 0.1 . 1 . . . . . . . . 6390 1 1559 . 1 1 158 158 ASP N N 15 121.2 0.1 . 1 . . . . . . . . 6390 1 1560 . 1 1 158 158 ASP H H 1 8.17 0.02 . 1 . . . . . . . . 6390 1 1561 . 1 1 158 158 ASP CA C 13 54.4 0.1 . 1 . . . . . . . . 6390 1 1562 . 1 1 158 158 ASP HA H 1 4.67 0.02 . 1 . . . . . . . . 6390 1 1563 . 1 1 158 158 ASP CB C 13 41.2 0.1 . 1 . . . . . . . . 6390 1 1564 . 1 1 158 158 ASP HB2 H 1 2.74 0.02 . 2 . . . . . . . . 6390 1 1565 . 1 1 158 158 ASP HB3 H 1 2.69 0.02 . 2 . . . . . . . . 6390 1 1566 . 1 1 158 158 ASP C C 13 173.9 0.1 . 1 . . . . . . . . 6390 1 1567 . 1 1 159 159 SER N N 15 117.2 0.1 . 1 . . . . . . . . 6390 1 1568 . 1 1 159 159 SER H H 1 8.31 0.02 . 1 . . . . . . . . 6390 1 1569 . 1 1 159 159 SER CA C 13 58.7 0.1 . 1 . . . . . . . . 6390 1 1570 . 1 1 159 159 SER HA H 1 4.50 0.02 . 1 . . . . . . . . 6390 1 1571 . 1 1 159 159 SER CB C 13 63.6 0.1 . 1 . . . . . . . . 6390 1 1572 . 1 1 159 159 SER HB2 H 1 4.00 0.02 . 2 . . . . . . . . 6390 1 1573 . 1 1 159 159 SER HB3 H 1 3.93 0.02 . 2 . . . . . . . . 6390 1 1574 . 1 1 159 159 SER C C 13 176.8 0.1 . 1 . . . . . . . . 6390 1 1575 . 1 1 160 160 GLY N N 15 111.3 0.1 . 1 . . . . . . . . 6390 1 1576 . 1 1 160 160 GLY H H 1 8.41 0.02 . 1 . . . . . . . . 6390 1 1577 . 1 1 160 160 GLY CA C 13 45.3 0.1 . 1 . . . . . . . . 6390 1 1578 . 1 1 160 160 GLY HA2 H 1 4.08 0.02 . 2 . . . . . . . . 6390 1 1579 . 1 1 160 160 GLY HA3 H 1 3.96 0.02 . 2 . . . . . . . . 6390 1 1580 . 1 1 160 160 GLY C C 13 175.3 0.1 . 1 . . . . . . . . 6390 1 1581 . 1 1 161 161 THR N N 15 114.3 0.1 . 1 . . . . . . . . 6390 1 1582 . 1 1 161 161 THR H H 1 7.95 0.02 . 1 . . . . . . . . 6390 1 1583 . 1 1 161 161 THR CA C 13 62.9 0.1 . 1 . . . . . . . . 6390 1 1584 . 1 1 161 161 THR HA H 1 4.41 0.02 . 1 . . . . . . . . 6390 1 1585 . 1 1 161 161 THR CB C 13 69.7 0.1 . 1 . . . . . . . . 6390 1 1586 . 1 1 161 161 THR HB H 1 4.22 0.02 . 1 . . . . . . . . 6390 1 1587 . 1 1 161 161 THR HG21 H 1 1.21 0.02 . 1 . . . . . . . . 6390 1 1588 . 1 1 161 161 THR HG22 H 1 1.21 0.02 . 1 . . . . . . . . 6390 1 1589 . 1 1 161 161 THR HG23 H 1 1.21 0.02 . 1 . . . . . . . . 6390 1 1590 . 1 1 161 161 THR CG2 C 13 21.3 0.1 . 1 . . . . . . . . 6390 1 1591 . 1 1 161 161 THR C C 13 174.6 0.1 . 1 . . . . . . . . 6390 1 1592 . 1 1 162 162 GLN N N 15 123.5 0.1 . 1 . . . . . . . . 6390 1 1593 . 1 1 162 162 GLN H H 1 8.34 0.02 . 1 . . . . . . . . 6390 1 1594 . 1 1 162 162 GLN CA C 13 55.6 0.1 . 1 . . . . . . . . 6390 1 1595 . 1 1 162 162 GLN HA H 1 4.35 0.02 . 1 . . . . . . . . 6390 1 1596 . 1 1 162 162 GLN CB C 13 28.9 0.1 . 1 . . . . . . . . 6390 1 1597 . 1 1 162 162 GLN HB2 H 1 2.14 0.02 . 2 . . . . . . . . 6390 1 1598 . 1 1 162 162 GLN HB3 H 1 2.01 0.02 . 2 . . . . . . . . 6390 1 1599 . 1 1 162 162 GLN CG C 13 32.1 0.1 . 1 . . . . . . . . 6390 1 1600 . 1 1 162 162 GLN HG2 H 1 2.38 0.02 . 2 . . . . . . . . 6390 1 1601 . 1 1 162 162 GLN NE2 N 15 113.2 0.1 . 1 . . . . . . . . 6390 1 1602 . 1 1 162 162 GLN HE21 H 1 7.42 0.02 . 2 . . . . . . . . 6390 1 1603 . 1 1 162 162 GLN HE22 H 1 6.74 0.02 . 2 . . . . . . . . 6390 1 1604 . 1 1 162 162 GLN C C 13 174.9 0.1 . 1 . . . . . . . . 6390 1 1605 . 1 1 163 163 ALA N N 15 126.2 0.1 . 1 . . . . . . . . 6390 1 1606 . 1 1 163 163 ALA H H 1 8.27 0.02 . 1 . . . . . . . . 6390 1 1607 . 1 1 163 163 ALA CA C 13 52.6 0.1 . 1 . . . . . . . . 6390 1 1608 . 1 1 163 163 ALA HA H 1 4.34 0.02 . 1 . . . . . . . . 6390 1 1609 . 1 1 163 163 ALA HB1 H 1 1.38 0.02 . 1 . . . . . . . . 6390 1 1610 . 1 1 163 163 ALA HB2 H 1 1.38 0.02 . 1 . . . . . . . . 6390 1 1611 . 1 1 163 163 ALA HB3 H 1 1.38 0.02 . 1 . . . . . . . . 6390 1 1612 . 1 1 163 163 ALA CB C 13 19.1 0.1 . 1 . . . . . . . . 6390 1 1613 . 1 1 163 163 ALA C C 13 175.9 0.1 . 1 . . . . . . . . 6390 1 1614 . 1 1 164 164 GLY N N 15 109.0 0.1 . 1 . . . . . . . . 6390 1 1615 . 1 1 164 164 GLY H H 1 8.26 0.02 . 1 . . . . . . . . 6390 1 1616 . 1 1 164 164 GLY CA C 13 44.8 0.1 . 1 . . . . . . . . 6390 1 1617 . 1 1 164 164 GLY HA2 H 1 4.00 0.02 . 2 . . . . . . . . 6390 1 1618 . 1 1 164 164 GLY HA3 H 1 3.90 0.02 . 2 . . . . . . . . 6390 1 1619 . 1 1 164 164 GLY C C 13 178.2 0.1 . 1 . . . . . . . . 6390 1 1620 . 1 1 165 165 ALA N N 15 124.2 0.1 . 1 . . . . . . . . 6390 1 1621 . 1 1 165 165 ALA H H 1 7.92 0.02 . 1 . . . . . . . . 6390 1 1622 . 1 1 165 165 ALA CA C 13 52.0 0.1 . 1 . . . . . . . . 6390 1 1623 . 1 1 165 165 ALA HA H 1 4.34 0.02 . 1 . . . . . . . . 6390 1 1624 . 1 1 165 165 ALA HB1 H 1 1.42 0.02 . 1 . . . . . . . . 6390 1 1625 . 1 1 165 165 ALA HB2 H 1 1.42 0.02 . 1 . . . . . . . . 6390 1 1626 . 1 1 165 165 ALA HB3 H 1 1.42 0.02 . 1 . . . . . . . . 6390 1 1627 . 1 1 165 165 ALA CB C 13 19.3 0.1 . 1 . . . . . . . . 6390 1 1628 . 1 1 165 165 ALA C C 13 173.8 0.1 . 1 . . . . . . . . 6390 1 1629 . 1 1 166 166 ILE N N 15 121.6 0.1 . 1 . . . . . . . . 6390 1 1630 . 1 1 166 166 ILE H H 1 8.08 0.02 . 1 . . . . . . . . 6390 1 1631 . 1 1 166 166 ILE CA C 13 61.2 0.1 . 1 . . . . . . . . 6390 1 1632 . 1 1 166 166 ILE HA H 1 4.12 0.02 . 1 . . . . . . . . 6390 1 1633 . 1 1 166 166 ILE CB C 13 38.3 0.1 . 1 . . . . . . . . 6390 1 1634 . 1 1 166 166 ILE HB H 1 1.88 0.02 . 1 . . . . . . . . 6390 1 1635 . 1 1 166 166 ILE HG21 H 1 0.94 0.02 . 1 . . . . . . . . 6390 1 1636 . 1 1 166 166 ILE HG22 H 1 0.94 0.02 . 1 . . . . . . . . 6390 1 1637 . 1 1 166 166 ILE HG23 H 1 0.94 0.02 . 1 . . . . . . . . 6390 1 1638 . 1 1 166 166 ILE CG2 C 13 17.4 0.1 . 1 . . . . . . . . 6390 1 1639 . 1 1 166 166 ILE CG1 C 13 27.2 0.1 . 1 . . . . . . . . 6390 1 1640 . 1 1 166 166 ILE HG12 H 1 1.50 0.02 . 2 . . . . . . . . 6390 1 1641 . 1 1 166 166 ILE HG13 H 1 1.27 0.02 . 2 . . . . . . . . 6390 1 1642 . 1 1 166 166 ILE HD11 H 1 0.85 0.02 . 1 . . . . . . . . 6390 1 1643 . 1 1 166 166 ILE HD12 H 1 0.85 0.02 . 1 . . . . . . . . 6390 1 1644 . 1 1 166 166 ILE HD13 H 1 0.85 0.02 . 1 . . . . . . . . 6390 1 1645 . 1 1 166 166 ILE CD1 C 13 12.6 0.1 . 1 . . . . . . . . 6390 1 1646 . 1 1 166 166 ILE C C 13 177.7 0.1 . 1 . . . . . . . . 6390 1 1647 . 1 1 167 167 VAL N N 15 129.2 0.1 . 1 . . . . . . . . 6390 1 1648 . 1 1 167 167 VAL H H 1 7.63 0.02 . 1 . . . . . . . . 6390 1 1649 . 1 1 167 167 VAL CA C 13 63.5 0.1 . 1 . . . . . . . . 6390 1 1650 . 1 1 167 167 VAL HA H 1 4.04 0.02 . 1 . . . . . . . . 6390 1 1651 . 1 1 167 167 VAL CB C 13 33.1 0.1 . 1 . . . . . . . . 6390 1 1652 . 1 1 167 167 VAL HB H 1 2.04 0.02 . 1 . . . . . . . . 6390 1 1653 . 1 1 167 167 VAL HG11 H 1 0.91 0.02 . 2 . . . . . . . . 6390 1 1654 . 1 1 167 167 VAL HG12 H 1 0.91 0.02 . 2 . . . . . . . . 6390 1 1655 . 1 1 167 167 VAL HG13 H 1 0.91 0.02 . 2 . . . . . . . . 6390 1 1656 . 1 1 167 167 VAL HG21 H 1 0.88 0.02 . 2 . . . . . . . . 6390 1 1657 . 1 1 167 167 VAL HG22 H 1 0.88 0.02 . 2 . . . . . . . . 6390 1 1658 . 1 1 167 167 VAL HG23 H 1 0.88 0.02 . 2 . . . . . . . . 6390 1 1659 . 1 1 167 167 VAL CG1 C 13 21.2 0.1 . 1 . . . . . . . . 6390 1 1660 . 1 1 167 167 VAL CG2 C 13 21.2 0.1 . 1 . . . . . . . . 6390 1 1661 . 1 1 167 167 VAL C C 13 175.6 0.1 . 1 . . . . . . . . 6390 1 stop_ save_