data_5267 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 5267 _Entry.Title ; 1H, 13C, 15N NMR sequencespecific resonance assignment of a Clostridium thermocellum type II cohesin module ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2002-01-28 _Entry.Accession_date 2002-01-28 _Entry.Last_release_date 2002-08-23 _Entry.Original_release_date 2002-08-23 _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 Steven Smith . P . 5267 2 Pierre Beguin . . . 5267 3 Pedro Alzari . M . 5267 4 Kalle Gehring . . . 5267 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 5267 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 966 5267 '13C chemical shifts' 650 5267 '15N chemical shifts' 162 5267 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 . . 2002-08-23 2002-01-28 original author . 5267 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 5267 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code 22056594 _Citation.DOI . _Citation.PubMed_ID 12061722 _Citation.Full_citation . _Citation.Title ; Letter to the Editor: 1H, 13C, 15N NMR sequence-specific resonance assignment of a Clostridium thermocellum type II cohesin module ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 23 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 73 _Citation.Page_last 74 _Citation.Year 2002 _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 Steven Smith . P . 5267 1 2 Pierre Beguin . . . 5267 1 3 Pedro Alzari . M . 5267 1 4 Kalle Gehring . . . 5267 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'NMR resonance assignment' 5267 1 'type II cohesin' 5267 1 'Clostridium thermocellum' 5267 1 cellulosome 5267 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_type_II_cohesin _Assembly.Sf_category assembly _Assembly.Sf_framecode system_type_II_cohesin _Assembly.Entry_ID 5267 _Assembly.ID 1 _Assembly.Name 'SdbA type II cohesin 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 5267 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 'SdbA cohesin module' 1 $SdbA . . . native . . . . . 5267 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'SdbA type II cohesin module' system 5267 1 'type II cohesin' abbreviation 5267 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_SdbA _Entity.Sf_category entity _Entity.Sf_framecode SdbA _Entity.Entry_ID 5267 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'SdbA type II cohesin' _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 ; MRGSHHHHHHTDLRADKASS IELKFDRNKGEVGDILIGTV RINNIKNFAGFQVNIVYDPK VLMAVDPETGKEFTSSTFPP GRTVLKNNAYGPIQIADNDP EKGILNFALAYSYIAGYKET GVAEESGIIAKIGFKILQKK STAVKFQDTLSMPGAISGTQ LFDWDGEVITGYEVIQPDVL SLGDEPF ; _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 187 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2B59 . "The Type Ii Cohesin Dockerin Complex" . . . . . 100.00 187 100.00 100.00 1.54e-133 . . . . 5267 1 2 no PDB 2BM3 . "Structure Of The Type Ii Cohesin From Clostridium Thermocellum Sdba" . . . . . 88.77 166 98.19 99.40 2.53e-113 . . . . 5267 1 3 no PDB 3KCP . "Crystal Structure Of Interacting Clostridium Thermocellum Multimodular Components" . . . . . 100.00 187 99.47 100.00 3.77e-133 . . . . 5267 1 4 no PDB 4FL4 . "Scaffoldin Conformation And Dynamics Revealed By A Ternary Complex From The Clostridium Thermocellum Cellulosome" . . . . . 100.00 187 100.00 100.00 1.54e-133 . . . . 5267 1 5 no EMBL CDG35978 . "cellulosome anchoring protein cohesin subunit [Ruminiclostridium thermocellum BC1]" . . . . . 93.05 631 99.43 100.00 1.16e-116 . . . . 5267 1 6 no GB AAB07763 . "scaffolding dockerin binding protein A [Ruminiclostridium thermocellum]" . . . . . 93.05 631 99.43 100.00 1.16e-116 . . . . 5267 1 7 no GB ABN52539 . "cellulosome anchoring protein cohesin region [Ruminiclostridium thermocellum ATCC 27405]" . . . . . 93.05 631 99.43 100.00 1.16e-116 . . . . 5267 1 8 no GB ADU74018 . "cellulosome anchoring protein cohesin region [Ruminiclostridium thermocellum DSM 1313]" . . . . . 93.05 631 98.28 98.85 5.43e-115 . . . . 5267 1 9 no GB EEU01806 . "cellulosome anchoring protein cohesin region [Ruminiclostridium thermocellum DSM 2360]" . . . . . 93.05 631 98.28 98.85 5.43e-115 . . . . 5267 1 10 no GB EFB39640 . "cellulosome anchoring protein cohesin region [Ruminiclostridium thermocellum JW20]" . . . . . 93.05 631 99.43 100.00 1.16e-116 . . . . 5267 1 11 no REF WP_003516982 . "cellulosome anchoring protein cohesin region [Ruminiclostridium thermocellum]" . . . . . 93.05 631 98.28 98.85 5.43e-115 . . . . 5267 1 12 no REF WP_004463692 . "cellulosome anchoring protein cohesin region [Ruminiclostridium thermocellum]" . . . . . 93.05 631 99.43 100.00 1.16e-116 . . . . 5267 1 13 no REF YP_001037732 . "cellulosome anchoring protein cohesin subunit [Ruminiclostridium thermocellum ATCC 27405]" . . . . . 93.05 631 99.43 100.00 1.16e-116 . . . . 5267 1 14 no REF YP_005687469 . "cellulosome anchoring protein cohesin subunit [Ruminiclostridium thermocellum DSM 1313]" . . . . . 93.05 631 98.28 98.85 5.43e-115 . . . . 5267 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'SdbA type II cohesin' common 5267 1 SdbA abbreviation 5267 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 5267 1 2 . ARG . 5267 1 3 . GLY . 5267 1 4 . SER . 5267 1 5 . HIS . 5267 1 6 . HIS . 5267 1 7 . HIS . 5267 1 8 . HIS . 5267 1 9 . HIS . 5267 1 10 . HIS . 5267 1 11 . THR . 5267 1 12 . ASP . 5267 1 13 . LEU . 5267 1 14 . ARG . 5267 1 15 . ALA . 5267 1 16 . ASP . 5267 1 17 . LYS . 5267 1 18 . ALA . 5267 1 19 . SER . 5267 1 20 . SER . 5267 1 21 . ILE . 5267 1 22 . GLU . 5267 1 23 . LEU . 5267 1 24 . LYS . 5267 1 25 . PHE . 5267 1 26 . ASP . 5267 1 27 . ARG . 5267 1 28 . ASN . 5267 1 29 . LYS . 5267 1 30 . GLY . 5267 1 31 . GLU . 5267 1 32 . VAL . 5267 1 33 . GLY . 5267 1 34 . ASP . 5267 1 35 . ILE . 5267 1 36 . LEU . 5267 1 37 . ILE . 5267 1 38 . GLY . 5267 1 39 . THR . 5267 1 40 . VAL . 5267 1 41 . ARG . 5267 1 42 . ILE . 5267 1 43 . ASN . 5267 1 44 . ASN . 5267 1 45 . ILE . 5267 1 46 . LYS . 5267 1 47 . ASN . 5267 1 48 . PHE . 5267 1 49 . ALA . 5267 1 50 . GLY . 5267 1 51 . PHE . 5267 1 52 . GLN . 5267 1 53 . VAL . 5267 1 54 . ASN . 5267 1 55 . ILE . 5267 1 56 . VAL . 5267 1 57 . TYR . 5267 1 58 . ASP . 5267 1 59 . PRO . 5267 1 60 . LYS . 5267 1 61 . VAL . 5267 1 62 . LEU . 5267 1 63 . MET . 5267 1 64 . ALA . 5267 1 65 . VAL . 5267 1 66 . ASP . 5267 1 67 . PRO . 5267 1 68 . GLU . 5267 1 69 . THR . 5267 1 70 . GLY . 5267 1 71 . LYS . 5267 1 72 . GLU . 5267 1 73 . PHE . 5267 1 74 . THR . 5267 1 75 . SER . 5267 1 76 . SER . 5267 1 77 . THR . 5267 1 78 . PHE . 5267 1 79 . PRO . 5267 1 80 . PRO . 5267 1 81 . GLY . 5267 1 82 . ARG . 5267 1 83 . THR . 5267 1 84 . VAL . 5267 1 85 . LEU . 5267 1 86 . LYS . 5267 1 87 . ASN . 5267 1 88 . ASN . 5267 1 89 . ALA . 5267 1 90 . TYR . 5267 1 91 . GLY . 5267 1 92 . PRO . 5267 1 93 . ILE . 5267 1 94 . GLN . 5267 1 95 . ILE . 5267 1 96 . ALA . 5267 1 97 . ASP . 5267 1 98 . ASN . 5267 1 99 . ASP . 5267 1 100 . PRO . 5267 1 101 . GLU . 5267 1 102 . LYS . 5267 1 103 . GLY . 5267 1 104 . ILE . 5267 1 105 . LEU . 5267 1 106 . ASN . 5267 1 107 . PHE . 5267 1 108 . ALA . 5267 1 109 . LEU . 5267 1 110 . ALA . 5267 1 111 . TYR . 5267 1 112 . SER . 5267 1 113 . TYR . 5267 1 114 . ILE . 5267 1 115 . ALA . 5267 1 116 . GLY . 5267 1 117 . TYR . 5267 1 118 . LYS . 5267 1 119 . GLU . 5267 1 120 . THR . 5267 1 121 . GLY . 5267 1 122 . VAL . 5267 1 123 . ALA . 5267 1 124 . GLU . 5267 1 125 . GLU . 5267 1 126 . SER . 5267 1 127 . GLY . 5267 1 128 . ILE . 5267 1 129 . ILE . 5267 1 130 . ALA . 5267 1 131 . LYS . 5267 1 132 . ILE . 5267 1 133 . GLY . 5267 1 134 . PHE . 5267 1 135 . LYS . 5267 1 136 . ILE . 5267 1 137 . LEU . 5267 1 138 . GLN . 5267 1 139 . LYS . 5267 1 140 . LYS . 5267 1 141 . SER . 5267 1 142 . THR . 5267 1 143 . ALA . 5267 1 144 . VAL . 5267 1 145 . LYS . 5267 1 146 . PHE . 5267 1 147 . GLN . 5267 1 148 . ASP . 5267 1 149 . THR . 5267 1 150 . LEU . 5267 1 151 . SER . 5267 1 152 . MET . 5267 1 153 . PRO . 5267 1 154 . GLY . 5267 1 155 . ALA . 5267 1 156 . ILE . 5267 1 157 . SER . 5267 1 158 . GLY . 5267 1 159 . THR . 5267 1 160 . GLN . 5267 1 161 . LEU . 5267 1 162 . PHE . 5267 1 163 . ASP . 5267 1 164 . TRP . 5267 1 165 . ASP . 5267 1 166 . GLY . 5267 1 167 . GLU . 5267 1 168 . VAL . 5267 1 169 . ILE . 5267 1 170 . THR . 5267 1 171 . GLY . 5267 1 172 . TYR . 5267 1 173 . GLU . 5267 1 174 . VAL . 5267 1 175 . ILE . 5267 1 176 . GLN . 5267 1 177 . PRO . 5267 1 178 . ASP . 5267 1 179 . VAL . 5267 1 180 . LEU . 5267 1 181 . SER . 5267 1 182 . LEU . 5267 1 183 . GLY . 5267 1 184 . ASP . 5267 1 185 . GLU . 5267 1 186 . PRO . 5267 1 187 . PHE . 5267 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 5267 1 . ARG 2 2 5267 1 . GLY 3 3 5267 1 . SER 4 4 5267 1 . HIS 5 5 5267 1 . HIS 6 6 5267 1 . HIS 7 7 5267 1 . HIS 8 8 5267 1 . HIS 9 9 5267 1 . HIS 10 10 5267 1 . THR 11 11 5267 1 . ASP 12 12 5267 1 . LEU 13 13 5267 1 . ARG 14 14 5267 1 . ALA 15 15 5267 1 . ASP 16 16 5267 1 . LYS 17 17 5267 1 . ALA 18 18 5267 1 . SER 19 19 5267 1 . SER 20 20 5267 1 . ILE 21 21 5267 1 . GLU 22 22 5267 1 . LEU 23 23 5267 1 . LYS 24 24 5267 1 . PHE 25 25 5267 1 . ASP 26 26 5267 1 . ARG 27 27 5267 1 . ASN 28 28 5267 1 . LYS 29 29 5267 1 . GLY 30 30 5267 1 . GLU 31 31 5267 1 . VAL 32 32 5267 1 . GLY 33 33 5267 1 . ASP 34 34 5267 1 . ILE 35 35 5267 1 . LEU 36 36 5267 1 . ILE 37 37 5267 1 . GLY 38 38 5267 1 . THR 39 39 5267 1 . VAL 40 40 5267 1 . ARG 41 41 5267 1 . ILE 42 42 5267 1 . ASN 43 43 5267 1 . ASN 44 44 5267 1 . ILE 45 45 5267 1 . LYS 46 46 5267 1 . ASN 47 47 5267 1 . PHE 48 48 5267 1 . ALA 49 49 5267 1 . GLY 50 50 5267 1 . PHE 51 51 5267 1 . GLN 52 52 5267 1 . VAL 53 53 5267 1 . ASN 54 54 5267 1 . ILE 55 55 5267 1 . VAL 56 56 5267 1 . TYR 57 57 5267 1 . ASP 58 58 5267 1 . PRO 59 59 5267 1 . LYS 60 60 5267 1 . VAL 61 61 5267 1 . LEU 62 62 5267 1 . MET 63 63 5267 1 . ALA 64 64 5267 1 . VAL 65 65 5267 1 . ASP 66 66 5267 1 . PRO 67 67 5267 1 . GLU 68 68 5267 1 . THR 69 69 5267 1 . GLY 70 70 5267 1 . LYS 71 71 5267 1 . GLU 72 72 5267 1 . PHE 73 73 5267 1 . THR 74 74 5267 1 . SER 75 75 5267 1 . SER 76 76 5267 1 . THR 77 77 5267 1 . PHE 78 78 5267 1 . PRO 79 79 5267 1 . PRO 80 80 5267 1 . GLY 81 81 5267 1 . ARG 82 82 5267 1 . THR 83 83 5267 1 . VAL 84 84 5267 1 . LEU 85 85 5267 1 . LYS 86 86 5267 1 . ASN 87 87 5267 1 . ASN 88 88 5267 1 . ALA 89 89 5267 1 . TYR 90 90 5267 1 . GLY 91 91 5267 1 . PRO 92 92 5267 1 . ILE 93 93 5267 1 . GLN 94 94 5267 1 . ILE 95 95 5267 1 . ALA 96 96 5267 1 . ASP 97 97 5267 1 . ASN 98 98 5267 1 . ASP 99 99 5267 1 . PRO 100 100 5267 1 . GLU 101 101 5267 1 . LYS 102 102 5267 1 . GLY 103 103 5267 1 . ILE 104 104 5267 1 . LEU 105 105 5267 1 . ASN 106 106 5267 1 . PHE 107 107 5267 1 . ALA 108 108 5267 1 . LEU 109 109 5267 1 . ALA 110 110 5267 1 . TYR 111 111 5267 1 . SER 112 112 5267 1 . TYR 113 113 5267 1 . ILE 114 114 5267 1 . ALA 115 115 5267 1 . GLY 116 116 5267 1 . TYR 117 117 5267 1 . LYS 118 118 5267 1 . GLU 119 119 5267 1 . THR 120 120 5267 1 . GLY 121 121 5267 1 . VAL 122 122 5267 1 . ALA 123 123 5267 1 . GLU 124 124 5267 1 . GLU 125 125 5267 1 . SER 126 126 5267 1 . GLY 127 127 5267 1 . ILE 128 128 5267 1 . ILE 129 129 5267 1 . ALA 130 130 5267 1 . LYS 131 131 5267 1 . ILE 132 132 5267 1 . GLY 133 133 5267 1 . PHE 134 134 5267 1 . LYS 135 135 5267 1 . ILE 136 136 5267 1 . LEU 137 137 5267 1 . GLN 138 138 5267 1 . LYS 139 139 5267 1 . LYS 140 140 5267 1 . SER 141 141 5267 1 . THR 142 142 5267 1 . ALA 143 143 5267 1 . VAL 144 144 5267 1 . LYS 145 145 5267 1 . PHE 146 146 5267 1 . GLN 147 147 5267 1 . ASP 148 148 5267 1 . THR 149 149 5267 1 . LEU 150 150 5267 1 . SER 151 151 5267 1 . MET 152 152 5267 1 . PRO 153 153 5267 1 . GLY 154 154 5267 1 . ALA 155 155 5267 1 . ILE 156 156 5267 1 . SER 157 157 5267 1 . GLY 158 158 5267 1 . THR 159 159 5267 1 . GLN 160 160 5267 1 . LEU 161 161 5267 1 . PHE 162 162 5267 1 . ASP 163 163 5267 1 . TRP 164 164 5267 1 . ASP 165 165 5267 1 . GLY 166 166 5267 1 . GLU 167 167 5267 1 . VAL 168 168 5267 1 . ILE 169 169 5267 1 . THR 170 170 5267 1 . GLY 171 171 5267 1 . TYR 172 172 5267 1 . GLU 173 173 5267 1 . VAL 174 174 5267 1 . ILE 175 175 5267 1 . GLN 176 176 5267 1 . PRO 177 177 5267 1 . ASP 178 178 5267 1 . VAL 179 179 5267 1 . LEU 180 180 5267 1 . SER 181 181 5267 1 . LEU 182 182 5267 1 . GLY 183 183 5267 1 . ASP 184 184 5267 1 . GLU 185 185 5267 1 . PRO 186 186 5267 1 . PHE 187 187 5267 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 5267 _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 $SdbA . 1515 . . 'Clostridium thermocellum' 'Clostridium thermocellum' . . Eubacteria . Clostridium thermocellum . . . . . . . . . . . . . . . . . . . . . 5267 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 5267 _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 $SdbA . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5267 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 5267 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'SdbA type II cohesin' '[U-95% 13C; U-90% 15N]' . . 1 $SdbA . . 1.2 . . mM . . . . 5267 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 5267 _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 'SdbA type II cohesin' '[U-90% 15N]' . . 1 $SdbA . . 1.2 . . mM . . . . 5267 2 stop_ save_ ####################### # Sample conditions # ####################### save_Excond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Excond_1 _Sample_condition_list.Entry_ID 5267 _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 0.2 na 5267 1 temperature 303 1 K 5267 1 stop_ save_ ############################ # Computer software used # ############################ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 5267 _Software.ID 1 _Software.Name XEASY _Software.Version . _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'peak assignment' 5267 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 5267 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 5267 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 5267 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker AVANCE . 600 . . . 5267 1 2 NMR_spectrometer_2 Bruker DRX . 500 . . . 5267 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 5267 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H15N HSQC' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5267 1 2 '1H 13C HSQC' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5267 1 3 '3D HNHA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5267 1 4 '3D HNCO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5267 1 5 '3D HNCACB' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5267 1 6 '3D CBCA(CO)NH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5267 1 7 '15N NOESY HSQC' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5267 1 8 'CC(CO)NH TOCSY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5267 1 9 'HCC(CO)NH TOCSY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5267 1 10 '(H)CCH COSY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5267 1 11 'HCCH TOCSY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5267 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 5267 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '2D 1H15N HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 5267 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '1H 13C HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 5267 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name '3D HNHA' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 5267 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name '3D HNCO' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_5 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_5 _NMR_spec_expt.Entry_ID 5267 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name '3D HNCACB' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_6 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_6 _NMR_spec_expt.Entry_ID 5267 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name '3D CBCA(CO)NH' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_7 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_7 _NMR_spec_expt.Entry_ID 5267 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name '15N NOESY HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_8 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_8 _NMR_spec_expt.Entry_ID 5267 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name 'CC(CO)NH TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_9 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_9 _NMR_spec_expt.Entry_ID 5267 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name 'HCC(CO)NH TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_10 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_10 _NMR_spec_expt.Entry_ID 5267 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name '(H)CCH COSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_11 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_11 _NMR_spec_expt.Entry_ID 5267 _NMR_spec_expt.ID 11 _NMR_spec_expt.Name 'HCCH TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # 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 5267 _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 internal direct 1.000000000 . . . . . . . . . 5267 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 5267 1 C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 5267 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_shift_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode shift_set_1 _Assigned_chem_shift_list.Entry_ID 5267 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Excond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H15N HSQC' 1 $sample_1 . 5267 1 2 '1H 13C HSQC' 1 $sample_1 . 5267 1 3 '3D HNHA' 1 $sample_1 . 5267 1 4 '3D HNCO' 1 $sample_1 . 5267 1 5 '3D HNCACB' 1 $sample_1 . 5267 1 6 '3D CBCA(CO)NH' 1 $sample_1 . 5267 1 7 '15N NOESY HSQC' 1 $sample_1 . 5267 1 8 'CC(CO)NH TOCSY' 1 $sample_1 . 5267 1 9 'HCC(CO)NH TOCSY' 1 $sample_1 . 5267 1 10 '(H)CCH COSY' 1 $sample_1 . 5267 1 11 'HCCH TOCSY' 1 $sample_1 . 5267 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 17 17 LYS HA H 1 4.38 0.03 . 1 . . . . . . . . 5267 1 2 . 1 1 17 17 LYS HB2 H 1 1.84 0.03 . 1 . . . . . . . . 5267 1 3 . 1 1 17 17 LYS HB3 H 1 1.74 0.03 . 1 . . . . . . . . 5267 1 4 . 1 1 17 17 LYS HG2 H 1 1.44 0.03 . 1 . . . . . . . . 5267 1 5 . 1 1 17 17 LYS HD2 H 1 1.64 0.03 . 1 . . . . . . . . 5267 1 6 . 1 1 17 17 LYS HE2 H 1 2.99 0.03 . 1 . . . . . . . . 5267 1 7 . 1 1 17 17 LYS C C 13 175.41 0.20 . 1 . . . . . . . . 5267 1 8 . 1 1 17 17 LYS CA C 13 53.44 0.20 . 1 . . . . . . . . 5267 1 9 . 1 1 17 17 LYS CB C 13 33.24 0.20 . 1 . . . . . . . . 5267 1 10 . 1 1 17 17 LYS CG C 13 25.19 0.20 . 1 . . . . . . . . 5267 1 11 . 1 1 17 17 LYS CD C 13 29.53 0.20 . 1 . . . . . . . . 5267 1 12 . 1 1 17 17 LYS CE C 13 41.01 0.20 . 1 . . . . . . . . 5267 1 13 . 1 1 18 18 ALA H H 1 8.28 0.03 . 1 . . . . . . . . 5267 1 14 . 1 1 18 18 ALA HA H 1 4.30 0.03 . 1 . . . . . . . . 5267 1 15 . 1 1 18 18 ALA HB1 H 1 1.41 0.03 . 1 . . . . . . . . 5267 1 16 . 1 1 18 18 ALA HB2 H 1 1.41 0.03 . 1 . . . . . . . . 5267 1 17 . 1 1 18 18 ALA HB3 H 1 1.41 0.03 . 1 . . . . . . . . 5267 1 18 . 1 1 18 18 ALA C C 13 174.16 0.20 . 1 . . . . . . . . 5267 1 19 . 1 1 18 18 ALA CA C 13 53.06 0.20 . 1 . . . . . . . . 5267 1 20 . 1 1 18 18 ALA CB C 13 19.80 0.20 . 1 . . . . . . . . 5267 1 21 . 1 1 18 18 ALA N N 15 123.45 0.20 . 1 . . . . . . . . 5267 1 22 . 1 1 19 19 SER H H 1 8.37 0.03 . 1 . . . . . . . . 5267 1 23 . 1 1 19 19 SER HA H 1 5.16 0.03 . 1 . . . . . . . . 5267 1 24 . 1 1 19 19 SER HB2 H 1 3.98 0.03 . 2 . . . . . . . . 5267 1 25 . 1 1 19 19 SER HB3 H 1 3.86 0.03 . 2 . . . . . . . . 5267 1 26 . 1 1 19 19 SER C C 13 174.22 0.20 . 1 . . . . . . . . 5267 1 27 . 1 1 19 19 SER CA C 13 58.55 0.20 . 1 . . . . . . . . 5267 1 28 . 1 1 19 19 SER CB C 13 65.13 0.20 . 1 . . . . . . . . 5267 1 29 . 1 1 19 19 SER N N 15 117.37 0.15 . 1 . . . . . . . . 5267 1 30 . 1 1 20 20 SER H H 1 9.03 0.03 . 1 . . . . . . . . 5267 1 31 . 1 1 20 20 SER HA H 1 5.70 0.03 . 1 . . . . . . . . 5267 1 32 . 1 1 20 20 SER HB2 H 1 4.04 0.03 . 2 . . . . . . . . 5267 1 33 . 1 1 20 20 SER HB3 H 1 3.78 0.03 . 2 . . . . . . . . 5267 1 34 . 1 1 20 20 SER C C 13 171.37 0.20 . 1 . . . . . . . . 5267 1 35 . 1 1 20 20 SER CA C 13 58.13 0.20 . 1 . . . . . . . . 5267 1 36 . 1 1 20 20 SER CB C 13 67.16 0.20 . 1 . . . . . . . . 5267 1 37 . 1 1 20 20 SER N N 15 116.67 0.15 . 1 . . . . . . . . 5267 1 38 . 1 1 21 21 ILE H H 1 8.71 0.03 . 1 . . . . . . . . 5267 1 39 . 1 1 21 21 ILE HA H 1 5.12 0.03 . 1 . . . . . . . . 5267 1 40 . 1 1 21 21 ILE HB H 1 1.19 0.03 . 1 . . . . . . . . 5267 1 41 . 1 1 21 21 ILE HG12 H 1 1.50 0.03 . 1 . . . . . . . . 5267 1 42 . 1 1 21 21 ILE HG21 H 1 0.75 0.03 . 1 . . . . . . . . 5267 1 43 . 1 1 21 21 ILE HG22 H 1 0.75 0.03 . 1 . . . . . . . . 5267 1 44 . 1 1 21 21 ILE HG23 H 1 0.75 0.03 . 1 . . . . . . . . 5267 1 45 . 1 1 21 21 ILE HD11 H 1 0.37 0.03 . 1 . . . . . . . . 5267 1 46 . 1 1 21 21 ILE HD12 H 1 0.37 0.03 . 1 . . . . . . . . 5267 1 47 . 1 1 21 21 ILE HD13 H 1 0.37 0.03 . 1 . . . . . . . . 5267 1 48 . 1 1 21 21 ILE C C 13 171.20 0.20 . 1 . . . . . . . . 5267 1 49 . 1 1 21 21 ILE CA C 13 59.82 0.20 . 1 . . . . . . . . 5267 1 50 . 1 1 21 21 ILE CB C 13 42.43 0.20 . 1 . . . . . . . . 5267 1 51 . 1 1 21 21 ILE CG1 C 13 28.43 0.20 . 1 . . . . . . . . 5267 1 52 . 1 1 21 21 ILE CG2 C 13 17.29 0.20 . 1 . . . . . . . . 5267 1 53 . 1 1 21 21 ILE CD1 C 13 14.68 0.20 . 1 . . . . . . . . 5267 1 54 . 1 1 21 21 ILE N N 15 117.14 0.15 . 1 . . . . . . . . 5267 1 55 . 1 1 22 22 GLU H H 1 8.87 0.03 . 1 . . . . . . . . 5267 1 56 . 1 1 22 22 GLU HA H 1 5.69 0.03 . 1 . . . . . . . . 5267 1 57 . 1 1 22 22 GLU HB2 H 1 2.27 0.03 . 2 . . . . . . . . 5267 1 58 . 1 1 22 22 GLU HB3 H 1 2.01 0.03 . 2 . . . . . . . . 5267 1 59 . 1 1 22 22 GLU HG2 H 1 1.87 0.03 . 1 . . . . . . . . 5267 1 60 . 1 1 22 22 GLU CA C 13 54.41 0.20 . 1 . . . . . . . . 5267 1 61 . 1 1 22 22 GLU CB C 13 32.80 0.20 . 1 . . . . . . . . 5267 1 62 . 1 1 22 22 GLU CG C 13 36.10 0.20 . 1 . . . . . . . . 5267 1 63 . 1 1 22 22 GLU CD C 13 173.41 0.20 . 1 . . . . . . . . 5267 1 64 . 1 1 22 22 GLU N N 15 123.45 0.15 . 1 . . . . . . . . 5267 1 65 . 1 1 23 23 LEU H H 1 7.56 0.03 . 1 . . . . . . . . 5267 1 66 . 1 1 23 23 LEU HA H 1 5.26 0.03 . 1 . . . . . . . . 5267 1 67 . 1 1 23 23 LEU HB2 H 1 1.44 0.03 . 2 . . . . . . . . 5267 1 68 . 1 1 23 23 LEU HB3 H 1 1.19 0.03 . 2 . . . . . . . . 5267 1 69 . 1 1 23 23 LEU HG H 1 0.99 0.03 . 1 . . . . . . . . 5267 1 70 . 1 1 23 23 LEU HD11 H 1 0.24 0.03 . 1 . . . . . . . . 5267 1 71 . 1 1 23 23 LEU HD12 H 1 0.24 0.03 . 1 . . . . . . . . 5267 1 72 . 1 1 23 23 LEU HD13 H 1 0.24 0.03 . 1 . . . . . . . . 5267 1 73 . 1 1 23 23 LEU HD21 H 1 0.24 0.03 . 1 . . . . . . . . 5267 1 74 . 1 1 23 23 LEU HD22 H 1 0.24 0.03 . 1 . . . . . . . . 5267 1 75 . 1 1 23 23 LEU HD23 H 1 0.24 0.03 . 1 . . . . . . . . 5267 1 76 . 1 1 23 23 LEU C C 13 173.44 0.20 . 1 . . . . . . . . 5267 1 77 . 1 1 23 23 LEU CA C 13 54.40 0.20 . 1 . . . . . . . . 5267 1 78 . 1 1 23 23 LEU CB C 13 45.38 0.20 . 1 . . . . . . . . 5267 1 79 . 1 1 23 23 LEU CG C 13 28.27 0.20 . 1 . . . . . . . . 5267 1 80 . 1 1 23 23 LEU CD1 C 13 25.56 0.20 . 2 . . . . . . . . 5267 1 81 . 1 1 23 23 LEU CD2 C 13 23.21 0.20 . 2 . . . . . . . . 5267 1 82 . 1 1 23 23 LEU N N 15 124.15 0.15 . 1 . . . . . . . . 5267 1 83 . 1 1 24 24 LYS H H 1 8.26 0.03 . 1 . . . . . . . . 5267 1 84 . 1 1 24 24 LYS HA H 1 4.76 0.03 . 1 . . . . . . . . 5267 1 85 . 1 1 24 24 LYS HB2 H 1 1.80 0.03 . 2 . . . . . . . . 5267 1 86 . 1 1 24 24 LYS HB3 H 1 1.69 0.03 . 2 . . . . . . . . 5267 1 87 . 1 1 24 24 LYS HG2 H 1 1.41 0.03 . 2 . . . . . . . . 5267 1 88 . 1 1 24 24 LYS HD2 H 1 1.67 0.03 . 2 . . . . . . . . 5267 1 89 . 1 1 24 24 LYS HE2 H 1 2.96 0.03 . 1 . . . . . . . . 5267 1 90 . 1 1 24 24 LYS C C 13 174.50 0.20 . 1 . . . . . . . . 5267 1 91 . 1 1 24 24 LYS CA C 13 54.58 0.20 . 1 . . . . . . . . 5267 1 92 . 1 1 24 24 LYS CB C 13 37.53 0.20 . 1 . . . . . . . . 5267 1 93 . 1 1 24 24 LYS CG C 13 25.27 0.20 . 1 . . . . . . . . 5267 1 94 . 1 1 24 24 LYS CD C 13 29.37 0.20 . 1 . . . . . . . . 5267 1 95 . 1 1 24 24 LYS CE C 13 42.24 0.20 . 1 . . . . . . . . 5267 1 96 . 1 1 24 24 LYS N N 15 123.91 0.15 . 1 . . . . . . . . 5267 1 97 . 1 1 25 25 PHE H H 1 9.04 0.03 . 1 . . . . . . . . 5267 1 98 . 1 1 25 25 PHE HA H 1 5.42 0.03 . 1 . . . . . . . . 5267 1 99 . 1 1 25 25 PHE HB2 H 1 3.29 0.03 . 2 . . . . . . . . 5267 1 100 . 1 1 25 25 PHE HB3 H 1 2.84 0.03 . 2 . . . . . . . . 5267 1 101 . 1 1 25 25 PHE HD1 H 1 7.25 0.03 . 3 . . . . . . . . 5267 1 102 . 1 1 25 25 PHE C C 13 176.32 0.20 . 1 . . . . . . . . 5267 1 103 . 1 1 25 25 PHE CA C 13 58.13 0.20 . 1 . . . . . . . . 5267 1 104 . 1 1 25 25 PHE CB C 13 41.75 0.20 . 1 . . . . . . . . 5267 1 105 . 1 1 25 25 PHE N N 15 122.04 0.15 . 1 . . . . . . . . 5267 1 106 . 1 1 26 26 ASP H H 1 9.35 0.03 . 1 . . . . . . . . 5267 1 107 . 1 1 26 26 ASP HA H 1 4.34 0.03 . 1 . . . . . . . . 5267 1 108 . 1 1 26 26 ASP HB2 H 1 2.87 0.03 . 2 . . . . . . . . 5267 1 109 . 1 1 26 26 ASP C C 13 175.62 0.20 . 1 . . . . . . . . 5267 1 110 . 1 1 26 26 ASP CA C 13 56.69 0.20 . 1 . . . . . . . . 5267 1 111 . 1 1 26 26 ASP CB C 13 40.40 0.20 . 1 . . . . . . . . 5267 1 112 . 1 1 26 26 ASP N N 15 122.04 0.15 . 1 . . . . . . . . 5267 1 113 . 1 1 27 27 ARG H H 1 8.12 0.03 . 1 . . . . . . . . 5267 1 114 . 1 1 27 27 ARG HA H 1 4.59 0.03 . 1 . . . . . . . . 5267 1 115 . 1 1 27 27 ARG HB2 H 1 2.07 0.03 . 2 . . . . . . . . 5267 1 116 . 1 1 27 27 ARG HG2 H 1 1.80 0.03 . 2 . . . . . . . . 5267 1 117 . 1 1 27 27 ARG HD3 H 1 3.27 0.03 . 1 . . . . . . . . 5267 1 118 . 1 1 27 27 ARG C C 13 173.15 0.20 . 1 . . . . . . . . 5267 1 119 . 1 1 27 27 ARG CA C 13 55.26 0.20 . 1 . . . . . . . . 5267 1 120 . 1 1 27 27 ARG CB C 13 33.82 0.20 . 1 . . . . . . . . 5267 1 121 . 1 1 27 27 ARG CG C 13 26.53 0.20 . 1 . . . . . . . . 5267 1 122 . 1 1 27 27 ARG CD C 13 44.37 0.20 . 1 . . . . . . . . 5267 1 123 . 1 1 27 27 ARG N N 15 117.84 0.15 . 1 . . . . . . . . 5267 1 124 . 1 1 28 28 ASN H H 1 8.17 0.03 . 1 . . . . . . . . 5267 1 125 . 1 1 28 28 ASN HA H 1 4.64 0.03 . 1 . . . . . . . . 5267 1 126 . 1 1 28 28 ASN HB2 H 1 2.92 0.03 . 2 . . . . . . . . 5267 1 127 . 1 1 28 28 ASN HB3 H 1 2.81 0.03 . 2 . . . . . . . . 5267 1 128 . 1 1 28 28 ASN C C 13 172.70 0.20 . 1 . . . . . . . . 5267 1 129 . 1 1 28 28 ASN CA C 13 52.56 0.20 . 1 . . . . . . . . 5267 1 130 . 1 1 28 28 ASN CB C 13 39.98 0.20 . 1 . . . . . . . . 5267 1 131 . 1 1 28 28 ASN N N 15 113.40 0.15 . 1 . . . . . . . . 5267 1 132 . 1 1 29 29 LYS H H 1 7.09 0.03 . 1 . . . . . . . . 5267 1 133 . 1 1 29 29 LYS HA H 1 4.39 0.03 . 1 . . . . . . . . 5267 1 134 . 1 1 29 29 LYS HB2 H 1 1.83 0.03 . 2 . . . . . . . . 5267 1 135 . 1 1 29 29 LYS HB3 H 1 1.66 0.03 . 2 . . . . . . . . 5267 1 136 . 1 1 29 29 LYS HG2 H 1 1.36 0.03 . 2 . . . . . . . . 5267 1 137 . 1 1 29 29 LYS HD2 H 1 1.66 0.03 . 2 . . . . . . . . 5267 1 138 . 1 1 29 29 LYS HE2 H 1 2.94 0.03 . 1 . . . . . . . . 5267 1 139 . 1 1 29 29 LYS C C 13 173.82 0.20 . 1 . . . . . . . . 5267 1 140 . 1 1 29 29 LYS CA C 13 55.17 0.20 . 1 . . . . . . . . 5267 1 141 . 1 1 29 29 LYS CB C 13 36.94 0.20 . 1 . . . . . . . . 5267 1 142 . 1 1 29 29 LYS CG C 13 24.16 0.20 . 1 . . . . . . . . 5267 1 143 . 1 1 29 29 LYS CD C 13 29.22 0.20 . 1 . . . . . . . . 5267 1 144 . 1 1 29 29 LYS CE C 13 42.09 0.20 . 1 . . . . . . . . 5267 1 145 . 1 1 29 29 LYS N N 15 112.24 0.15 . 1 . . . . . . . . 5267 1 146 . 1 1 30 30 GLY H H 1 7.16 0.03 . 1 . . . . . . . . 5267 1 147 . 1 1 30 30 GLY HA2 H 1 4.14 0.03 . 2 . . . . . . . . 5267 1 148 . 1 1 30 30 GLY HA3 H 1 3.77 0.03 . 2 . . . . . . . . 5267 1 149 . 1 1 30 30 GLY C C 13 174.16 0.20 . 1 . . . . . . . . 5267 1 150 . 1 1 30 30 GLY CA C 13 45.97 0.20 . 1 . . . . . . . . 5267 1 151 . 1 1 30 30 GLY N N 15 103.83 0.15 . 1 . . . . . . . . 5267 1 152 . 1 1 31 31 GLU H H 1 8.61 0.03 . 1 . . . . . . . . 5267 1 153 . 1 1 31 31 GLU HA H 1 4.52 0.03 . 1 . . . . . . . . 5267 1 154 . 1 1 31 31 GLU HB2 H 1 2.23 0.03 . 2 . . . . . . . . 5267 1 155 . 1 1 31 31 GLU HB3 H 1 1.67 0.03 . 2 . . . . . . . . 5267 1 156 . 1 1 31 31 GLU HG2 H 1 2.47 0.03 . 2 . . . . . . . . 5267 1 157 . 1 1 31 31 GLU C C 13 175.95 0.20 . 1 . . . . . . . . 5267 1 158 . 1 1 31 31 GLU CA C 13 53.74 0.20 . 1 . . . . . . . . 5267 1 159 . 1 1 31 31 GLU CB C 13 31.79 0.20 . 1 . . . . . . . . 5267 1 160 . 1 1 31 31 GLU CG C 13 35.85 0.20 . 1 . . . . . . . . 5267 1 161 . 1 1 31 31 GLU N N 15 117.37 0.15 . 1 . . . . . . . . 5267 1 162 . 1 1 32 32 VAL H H 1 8.61 0.03 . 1 . . . . . . . . 5267 1 163 . 1 1 32 32 VAL HA H 1 3.30 0.03 . 1 . . . . . . . . 5267 1 164 . 1 1 32 32 VAL HB H 1 1.95 0.03 . 1 . . . . . . . . 5267 1 165 . 1 1 32 32 VAL HG11 H 1 0.92 0.03 . 1 . . . . . . . . 5267 1 166 . 1 1 32 32 VAL HG12 H 1 0.92 0.03 . 1 . . . . . . . . 5267 1 167 . 1 1 32 32 VAL HG13 H 1 0.92 0.03 . 1 . . . . . . . . 5267 1 168 . 1 1 32 32 VAL HG21 H 1 0.92 0.03 . 1 . . . . . . . . 5267 1 169 . 1 1 32 32 VAL HG22 H 1 0.92 0.03 . 1 . . . . . . . . 5267 1 170 . 1 1 32 32 VAL HG23 H 1 0.92 0.03 . 1 . . . . . . . . 5267 1 171 . 1 1 32 32 VAL C C 13 177.73 0.20 . 1 . . . . . . . . 5267 1 172 . 1 1 32 32 VAL CA C 13 66.40 0.20 . 1 . . . . . . . . 5267 1 173 . 1 1 32 32 VAL CB C 13 31.45 0.20 . 1 . . . . . . . . 5267 1 174 . 1 1 32 32 VAL CG1 C 13 23.13 0.20 . 1 . . . . . . . . 5267 1 175 . 1 1 32 32 VAL CG2 C 13 21.16 0.20 . 1 . . . . . . . . 5267 1 176 . 1 1 32 32 VAL N N 15 118.77 0.15 . 1 . . . . . . . . 5267 1 177 . 1 1 33 33 GLY H H 1 9.28 0.03 . 1 . . . . . . . . 5267 1 178 . 1 1 33 33 GLY HA2 H 1 4.55 0.03 . 2 . . . . . . . . 5267 1 179 . 1 1 33 33 GLY HA3 H 1 3.35 0.03 . 2 . . . . . . . . 5267 1 180 . 1 1 33 33 GLY C C 13 175.71 0.20 . 1 . . . . . . . . 5267 1 181 . 1 1 33 33 GLY CA C 13 45.30 0.20 . 1 . . . . . . . . 5267 1 182 . 1 1 33 33 GLY N N 15 116.44 0.15 . 1 . . . . . . . . 5267 1 183 . 1 1 34 34 ASP H H 1 8.36 0.03 . 1 . . . . . . . . 5267 1 184 . 1 1 34 34 ASP HA H 1 4.56 0.03 . 1 . . . . . . . . 5267 1 185 . 1 1 34 34 ASP HB2 H 1 3.12 0.03 . 2 . . . . . . . . 5267 1 186 . 1 1 34 34 ASP HB3 H 1 2.50 0.03 . 2 . . . . . . . . 5267 1 187 . 1 1 34 34 ASP C C 13 177.66 0.20 . 1 . . . . . . . . 5267 1 188 . 1 1 34 34 ASP CA C 13 55.09 0.20 . 1 . . . . . . . . 5267 1 189 . 1 1 34 34 ASP CB C 13 41.67 0.20 . 1 . . . . . . . . 5267 1 190 . 1 1 34 34 ASP N N 15 120.88 0.15 . 1 . . . . . . . . 5267 1 191 . 1 1 35 35 ILE H H 1 8.40 0.03 . 1 . . . . . . . . 5267 1 192 . 1 1 35 35 ILE HA H 1 4.52 0.03 . 1 . . . . . . . . 5267 1 193 . 1 1 35 35 ILE HB H 1 1.70 0.03 . 1 . . . . . . . . 5267 1 194 . 1 1 35 35 ILE HG12 H 1 1.66 0.03 . 1 . . . . . . . . 5267 1 195 . 1 1 35 35 ILE HG21 H 1 0.61 0.03 . 1 . . . . . . . . 5267 1 196 . 1 1 35 35 ILE HG22 H 1 0.61 0.03 . 1 . . . . . . . . 5267 1 197 . 1 1 35 35 ILE HG23 H 1 0.61 0.03 . 1 . . . . . . . . 5267 1 198 . 1 1 35 35 ILE HD11 H 1 0.83 0.03 . 1 . . . . . . . . 5267 1 199 . 1 1 35 35 ILE HD12 H 1 0.83 0.03 . 1 . . . . . . . . 5267 1 200 . 1 1 35 35 ILE HD13 H 1 0.83 0.03 . 1 . . . . . . . . 5267 1 201 . 1 1 35 35 ILE C C 13 175.76 0.20 . 1 . . . . . . . . 5267 1 202 . 1 1 35 35 ILE CA C 13 61.00 0.20 . 1 . . . . . . . . 5267 1 203 . 1 1 35 35 ILE CB C 13 39.89 0.20 . 1 . . . . . . . . 5267 1 204 . 1 1 35 35 ILE CG1 C 13 28.35 0.20 . 1 . . . . . . . . 5267 1 205 . 1 1 35 35 ILE CG2 C 13 18.00 0.20 . 1 . . . . . . . . 5267 1 206 . 1 1 35 35 ILE CD1 C 13 13.50 0.20 . 1 . . . . . . . . 5267 1 207 . 1 1 35 35 ILE N N 15 117.37 0.15 . 1 . . . . . . . . 5267 1 208 . 1 1 36 36 LEU H H 1 8.92 0.03 . 1 . . . . . . . . 5267 1 209 . 1 1 36 36 LEU HA H 1 4.69 0.03 . 1 . . . . . . . . 5267 1 210 . 1 1 36 36 LEU HB2 H 1 1.93 0.03 . 2 . . . . . . . . 5267 1 211 . 1 1 36 36 LEU HB3 H 1 1.68 0.03 . 2 . . . . . . . . 5267 1 212 . 1 1 36 36 LEU HG H 1 1.64 0.03 . 1 . . . . . . . . 5267 1 213 . 1 1 36 36 LEU HD11 H 1 0.64 0.03 . 2 . . . . . . . . 5267 1 214 . 1 1 36 36 LEU HD12 H 1 0.64 0.03 . 2 . . . . . . . . 5267 1 215 . 1 1 36 36 LEU HD13 H 1 0.64 0.03 . 2 . . . . . . . . 5267 1 216 . 1 1 36 36 LEU HD21 H 1 0.58 0.03 . 2 . . . . . . . . 5267 1 217 . 1 1 36 36 LEU HD22 H 1 0.58 0.03 . 2 . . . . . . . . 5267 1 218 . 1 1 36 36 LEU HD23 H 1 0.58 0.03 . 2 . . . . . . . . 5267 1 219 . 1 1 36 36 LEU C C 13 176.13 0.20 . 1 . . . . . . . . 5267 1 220 . 1 1 36 36 LEU CA C 13 54.16 0.20 . 1 . . . . . . . . 5267 1 221 . 1 1 36 36 LEU CB C 13 43.61 0.20 . 1 . . . . . . . . 5267 1 222 . 1 1 36 36 LEU CG C 13 25.98 0.20 . 1 . . . . . . . . 5267 1 223 . 1 1 36 36 LEU CD1 C 13 22.82 0.20 . 1 . . . . . . . . 5267 1 224 . 1 1 36 36 LEU CD2 C 13 22.26 0.20 . 1 . . . . . . . . 5267 1 225 . 1 1 36 36 LEU N N 15 128.58 0.15 . 1 . . . . . . . . 5267 1 226 . 1 1 37 37 ILE H H 1 9.58 0.03 . 1 . . . . . . . . 5267 1 227 . 1 1 37 37 ILE HA H 1 4.70 0.03 . 1 . . . . . . . . 5267 1 228 . 1 1 37 37 ILE HB H 1 1.86 0.03 . 2 . . . . . . . . 5267 1 229 . 1 1 37 37 ILE HG12 H 1 1.60 0.03 . 2 . . . . . . . . 5267 1 230 . 1 1 37 37 ILE HG13 H 1 1.07 0.03 . 2 . . . . . . . . 5267 1 231 . 1 1 37 37 ILE HG21 H 1 0.67 0.03 . 1 . . . . . . . . 5267 1 232 . 1 1 37 37 ILE HG22 H 1 0.67 0.03 . 1 . . . . . . . . 5267 1 233 . 1 1 37 37 ILE HG23 H 1 0.67 0.03 . 1 . . . . . . . . 5267 1 234 . 1 1 37 37 ILE HD11 H 1 0.80 0.03 . 1 . . . . . . . . 5267 1 235 . 1 1 37 37 ILE HD12 H 1 0.80 0.03 . 1 . . . . . . . . 5267 1 236 . 1 1 37 37 ILE HD13 H 1 0.80 0.03 . 1 . . . . . . . . 5267 1 237 . 1 1 37 37 ILE C C 13 176.19 0.20 . 1 . . . . . . . . 5267 1 238 . 1 1 37 37 ILE CA C 13 60.91 0.20 . 1 . . . . . . . . 5267 1 239 . 1 1 37 37 ILE CB C 13 38.20 0.20 . 1 . . . . . . . . 5267 1 240 . 1 1 37 37 ILE CG2 C 13 17.52 0.20 . 1 . . . . . . . . 5267 1 241 . 1 1 37 37 ILE CD1 C 13 12.22 0.20 . 1 . . . . . . . . 5267 1 242 . 1 1 37 37 ILE N N 15 122.04 0.15 . 1 . . . . . . . . 5267 1 243 . 1 1 38 38 GLY H H 1 9.82 0.03 . 1 . . . . . . . . 5267 1 244 . 1 1 38 38 GLY HA2 H 1 4.20 0.03 . 2 . . . . . . . . 5267 1 245 . 1 1 38 38 GLY HA3 H 1 2.51 0.03 . 2 . . . . . . . . 5267 1 246 . 1 1 38 38 GLY C C 13 171.13 0.20 . 1 . . . . . . . . 5267 1 247 . 1 1 38 38 GLY CA C 13 45.04 0.20 . 1 . . . . . . . . 5267 1 248 . 1 1 38 38 GLY N N 15 118.07 0.15 . 1 . . . . . . . . 5267 1 249 . 1 1 39 39 THR H H 1 8.92 0.03 . 1 . . . . . . . . 5267 1 250 . 1 1 39 39 THR HA H 1 4.72 0.03 . 1 . . . . . . . . 5267 1 251 . 1 1 39 39 THR HB H 1 4.72 0.03 . 1 . . . . . . . . 5267 1 252 . 1 1 39 39 THR HG21 H 1 1.13 0.03 . 1 . . . . . . . . 5267 1 253 . 1 1 39 39 THR HG22 H 1 1.13 0.03 . 1 . . . . . . . . 5267 1 254 . 1 1 39 39 THR HG23 H 1 1.13 0.03 . 1 . . . . . . . . 5267 1 255 . 1 1 39 39 THR C C 13 173.59 0.20 . 1 . . . . . . . . 5267 1 256 . 1 1 39 39 THR CA C 13 63.11 0.20 . 1 . . . . . . . . 5267 1 257 . 1 1 39 39 THR CB C 13 70.20 0.20 . 1 . . . . . . . . 5267 1 258 . 1 1 39 39 THR CG2 C 13 22.90 0.20 . 1 . . . . . . . . 5267 1 259 . 1 1 39 39 THR N N 15 120.88 0.15 . 1 . . . . . . . . 5267 1 260 . 1 1 40 40 VAL H H 1 9.24 0.03 . 1 . . . . . . . . 5267 1 261 . 1 1 40 40 VAL HA H 1 5.33 0.03 . 1 . . . . . . . . 5267 1 262 . 1 1 40 40 VAL HB H 1 2.01 0.03 . 1 . . . . . . . . 5267 1 263 . 1 1 40 40 VAL HG11 H 1 0.97 0.03 . 2 . . . . . . . . 5267 1 264 . 1 1 40 40 VAL HG12 H 1 0.97 0.03 . 2 . . . . . . . . 5267 1 265 . 1 1 40 40 VAL HG13 H 1 0.97 0.03 . 2 . . . . . . . . 5267 1 266 . 1 1 40 40 VAL HG21 H 1 0.88 0.03 . 2 . . . . . . . . 5267 1 267 . 1 1 40 40 VAL HG22 H 1 0.88 0.03 . 2 . . . . . . . . 5267 1 268 . 1 1 40 40 VAL HG23 H 1 0.88 0.03 . 2 . . . . . . . . 5267 1 269 . 1 1 40 40 VAL C C 13 174.91 0.20 . 1 . . . . . . . . 5267 1 270 . 1 1 40 40 VAL CA C 13 60.74 0.20 . 1 . . . . . . . . 5267 1 271 . 1 1 40 40 VAL CB C 13 32.38 0.20 . 1 . . . . . . . . 5267 1 272 . 1 1 40 40 VAL CG1 C 13 22.42 0.20 . 1 . . . . . . . . 5267 1 273 . 1 1 40 40 VAL CG2 C 13 22.42 0.20 . 1 . . . . . . . . 5267 1 274 . 1 1 40 40 VAL N N 15 129.65 0.15 . 1 . . . . . . . . 5267 1 275 . 1 1 41 41 ARG H H 1 9.14 0.03 . 1 . . . . . . . . 5267 1 276 . 1 1 41 41 ARG HA H 1 5.18 0.03 . 1 . . . . . . . . 5267 1 277 . 1 1 41 41 ARG HB2 H 1 1.61 0.03 . 2 . . . . . . . . 5267 1 278 . 1 1 41 41 ARG HB3 H 1 1.39 0.03 . 2 . . . . . . . . 5267 1 279 . 1 1 41 41 ARG HG2 H 1 1.40 0.03 . 2 . . . . . . . . 5267 1 280 . 1 1 41 41 ARG HD2 H 1 3.11 0.03 . 1 . . . . . . . . 5267 1 281 . 1 1 41 41 ARG C C 13 174.05 0.20 . 1 . . . . . . . . 5267 1 282 . 1 1 41 41 ARG CA C 13 54.92 0.20 . 1 . . . . . . . . 5267 1 283 . 1 1 41 41 ARG CB C 13 35.25 0.20 . 1 . . . . . . . . 5267 1 284 . 1 1 41 41 ARG CG C 13 28.42 0.20 . 1 . . . . . . . . 5267 1 285 . 1 1 41 41 ARG CD C 13 43.51 0.20 . 1 . . . . . . . . 5267 1 286 . 1 1 41 41 ARG N N 15 126.72 0.15 . 1 . . . . . . . . 5267 1 287 . 1 1 42 42 ILE H H 1 8.61 0.03 . 1 . . . . . . . . 5267 1 288 . 1 1 42 42 ILE HA H 1 4.97 0.03 . 1 . . . . . . . . 5267 1 289 . 1 1 42 42 ILE HB H 1 1.45 0.03 . 1 . . . . . . . . 5267 1 290 . 1 1 42 42 ILE HG12 H 1 1.07 0.03 . 2 . . . . . . . . 5267 1 291 . 1 1 42 42 ILE HG13 H 1 0.38 0.03 . 2 . . . . . . . . 5267 1 292 . 1 1 42 42 ILE HG21 H 1 0.38 0.03 . 1 . . . . . . . . 5267 1 293 . 1 1 42 42 ILE HG22 H 1 0.38 0.03 . 1 . . . . . . . . 5267 1 294 . 1 1 42 42 ILE HG23 H 1 0.38 0.03 . 1 . . . . . . . . 5267 1 295 . 1 1 42 42 ILE HD11 H 1 0.36 0.03 . 1 . . . . . . . . 5267 1 296 . 1 1 42 42 ILE HD12 H 1 0.36 0.03 . 1 . . . . . . . . 5267 1 297 . 1 1 42 42 ILE HD13 H 1 0.36 0.03 . 1 . . . . . . . . 5267 1 298 . 1 1 42 42 ILE C C 13 174.71 0.20 . 1 . . . . . . . . 5267 1 299 . 1 1 42 42 ILE CA C 13 59.22 0.20 . 1 . . . . . . . . 5267 1 300 . 1 1 42 42 ILE CB C 13 40.74 0.20 . 1 . . . . . . . . 5267 1 301 . 1 1 42 42 ILE CG1 C 13 25.42 0.20 . 1 . . . . . . . . 5267 1 302 . 1 1 42 42 ILE CG2 C 13 18.40 0.20 . 1 . . . . . . . . 5267 1 303 . 1 1 42 42 ILE CD1 C 13 12.70 0.20 . 1 . . . . . . . . 5267 1 304 . 1 1 42 42 ILE N N 15 112.24 0.15 . 1 . . . . . . . . 5267 1 305 . 1 1 43 43 ASN H H 1 8.96 0.03 . 1 . . . . . . . . 5267 1 306 . 1 1 43 43 ASN HA H 1 4.96 0.03 . 1 . . . . . . . . 5267 1 307 . 1 1 43 43 ASN HB2 H 1 2.79 0.03 . 2 . . . . . . . . 5267 1 308 . 1 1 43 43 ASN HB3 H 1 2.53 0.03 . 2 . . . . . . . . 5267 1 309 . 1 1 43 43 ASN C C 13 172.13 0.20 . 1 . . . . . . . . 5267 1 310 . 1 1 43 43 ASN CA C 13 52.81 0.20 . 1 . . . . . . . . 5267 1 311 . 1 1 43 43 ASN CB C 13 42.68 0.20 . 1 . . . . . . . . 5267 1 312 . 1 1 43 43 ASN N N 15 119.48 0.15 . 1 . . . . . . . . 5267 1 313 . 1 1 44 44 ASN H H 1 8.71 0.03 . 1 . . . . . . . . 5267 1 314 . 1 1 44 44 ASN HA H 1 3.95 0.03 . 1 . . . . . . . . 5267 1 315 . 1 1 44 44 ASN HB2 H 1 2.77 0.03 . 2 . . . . . . . . 5267 1 316 . 1 1 44 44 ASN C C 13 173.08 0.20 . 1 . . . . . . . . 5267 1 317 . 1 1 44 44 ASN CA C 13 53.99 0.20 . 1 . . . . . . . . 5267 1 318 . 1 1 44 44 ASN CB C 13 37.78 0.20 . 1 . . . . . . . . 5267 1 319 . 1 1 44 44 ASN N N 15 119.94 0.15 . 1 . . . . . . . . 5267 1 320 . 1 1 45 45 ILE H H 1 9.29 0.03 . 1 . . . . . . . . 5267 1 321 . 1 1 45 45 ILE HA H 1 4.13 0.03 . 1 . . . . . . . . 5267 1 322 . 1 1 45 45 ILE HB H 1 1.85 0.03 . 1 . . . . . . . . 5267 1 323 . 1 1 45 45 ILE HG12 H 1 1.29 0.03 . 2 . . . . . . . . 5267 1 324 . 1 1 45 45 ILE HG13 H 1 0.61 0.03 . 2 . . . . . . . . 5267 1 325 . 1 1 45 45 ILE HG21 H 1 0.81 0.03 . 1 . . . . . . . . 5267 1 326 . 1 1 45 45 ILE HG22 H 1 0.81 0.03 . 1 . . . . . . . . 5267 1 327 . 1 1 45 45 ILE HG23 H 1 0.81 0.03 . 1 . . . . . . . . 5267 1 328 . 1 1 45 45 ILE HD11 H 1 0.25 0.03 . 1 . . . . . . . . 5267 1 329 . 1 1 45 45 ILE HD12 H 1 0.25 0.03 . 1 . . . . . . . . 5267 1 330 . 1 1 45 45 ILE HD13 H 1 0.25 0.03 . 1 . . . . . . . . 5267 1 331 . 1 1 45 45 ILE C C 13 173.82 0.20 . 1 . . . . . . . . 5267 1 332 . 1 1 45 45 ILE CA C 13 57.79 0.20 . 1 . . . . . . . . 5267 1 333 . 1 1 45 45 ILE CB C 13 33.98 0.20 . 1 . . . . . . . . 5267 1 334 . 1 1 45 45 ILE CG2 C 13 19.90 0.20 . 1 . . . . . . . . 5267 1 335 . 1 1 45 45 ILE CD1 C 13 8.61 0.20 . 1 . . . . . . . . 5267 1 336 . 1 1 45 45 ILE N N 15 122.28 0.15 . 1 . . . . . . . . 5267 1 337 . 1 1 46 46 LYS H H 1 7.92 0.03 . 1 . . . . . . . . 5267 1 338 . 1 1 46 46 LYS HA H 1 3.82 0.03 . 1 . . . . . . . . 5267 1 339 . 1 1 46 46 LYS HB2 H 1 1.62 0.03 . 2 . . . . . . . . 5267 1 340 . 1 1 46 46 LYS HG2 H 1 1.32 0.03 . 2 . . . . . . . . 5267 1 341 . 1 1 46 46 LYS HG3 H 1 1.20 0.03 . 2 . . . . . . . . 5267 1 342 . 1 1 46 46 LYS HD2 H 1 1.62 0.03 . 2 . . . . . . . . 5267 1 343 . 1 1 46 46 LYS HE2 H 1 2.96 0.03 . 1 . . . . . . . . 5267 1 344 . 1 1 46 46 LYS C C 13 176.81 0.20 . 1 . . . . . . . . 5267 1 345 . 1 1 46 46 LYS CA C 13 57.28 0.20 . 1 . . . . . . . . 5267 1 346 . 1 1 46 46 LYS CB C 13 31.87 0.20 . 1 . . . . . . . . 5267 1 347 . 1 1 46 46 LYS CG C 13 24.16 0.20 . 1 . . . . . . . . 5267 1 348 . 1 1 46 46 LYS CD C 13 28.84 0.20 . 1 . . . . . . . . 5267 1 349 . 1 1 46 46 LYS CE C 13 42.38 0.20 . 1 . . . . . . . . 5267 1 350 . 1 1 46 46 LYS N N 15 126.02 0.15 . 1 . . . . . . . . 5267 1 351 . 1 1 47 47 ASN H H 1 8.80 0.03 . 1 . . . . . . . . 5267 1 352 . 1 1 47 47 ASN HA H 1 4.88 0.03 . 1 . . . . . . . . 5267 1 353 . 1 1 47 47 ASN HB2 H 1 2.89 0.03 . 2 . . . . . . . . 5267 1 354 . 1 1 47 47 ASN C C 13 173.52 0.20 . 1 . . . . . . . . 5267 1 355 . 1 1 47 47 ASN CA C 13 53.48 0.20 . 1 . . . . . . . . 5267 1 356 . 1 1 47 47 ASN CB C 13 35.42 0.20 . 1 . . . . . . . . 5267 1 357 . 1 1 47 47 ASN N N 15 117.84 0.15 . 1 . . . . . . . . 5267 1 358 . 1 1 48 48 PHE H H 1 6.77 0.03 . 1 . . . . . . . . 5267 1 359 . 1 1 48 48 PHE HA H 1 4.48 0.03 . 1 . . . . . . . . 5267 1 360 . 1 1 48 48 PHE HB2 H 1 3.32 0.03 . 2 . . . . . . . . 5267 1 361 . 1 1 48 48 PHE HB3 H 1 3.12 0.03 . 2 . . . . . . . . 5267 1 362 . 1 1 48 48 PHE HD1 H 1 7.37 0.03 . 3 . . . . . . . . 5267 1 363 . 1 1 48 48 PHE C C 13 173.69 0.20 . 1 . . . . . . . . 5267 1 364 . 1 1 48 48 PHE CA C 13 60.15 0.20 . 1 . . . . . . . . 5267 1 365 . 1 1 48 48 PHE CB C 13 39.72 0.20 . 1 . . . . . . . . 5267 1 366 . 1 1 48 48 PHE N N 15 115.04 0.15 . 1 . . . . . . . . 5267 1 367 . 1 1 49 49 ALA H H 1 9.35 0.03 . 1 . . . . . . . . 5267 1 368 . 1 1 49 49 ALA HA H 1 4.52 0.03 . 1 . . . . . . . . 5267 1 369 . 1 1 49 49 ALA HB1 H 1 1.45 0.03 . 1 . . . . . . . . 5267 1 370 . 1 1 49 49 ALA HB2 H 1 1.45 0.03 . 1 . . . . . . . . 5267 1 371 . 1 1 49 49 ALA HB3 H 1 1.45 0.03 . 1 . . . . . . . . 5267 1 372 . 1 1 49 49 ALA C C 13 173.98 0.20 . 1 . . . . . . . . 5267 1 373 . 1 1 49 49 ALA CA C 13 51.71 0.20 . 1 . . . . . . . . 5267 1 374 . 1 1 49 49 ALA CB C 13 22.55 0.20 . 1 . . . . . . . . 5267 1 375 . 1 1 49 49 ALA N N 15 125.78 0.15 . 1 . . . . . . . . 5267 1 376 . 1 1 50 50 GLY H H 1 6.45 0.03 . 1 . . . . . . . . 5267 1 377 . 1 1 50 50 GLY HA2 H 1 4.17 0.03 . 2 . . . . . . . . 5267 1 378 . 1 1 50 50 GLY HA3 H 1 4.09 0.03 . 2 . . . . . . . . 5267 1 379 . 1 1 50 50 GLY C C 13 170.54 0.20 . 1 . . . . . . . . 5267 1 380 . 1 1 50 50 GLY CA C 13 46.82 0.20 . 1 . . . . . . . . 5267 1 381 . 1 1 50 50 GLY N N 15 102.18 0.15 . 1 . . . . . . . . 5267 1 382 . 1 1 51 51 PHE H H 1 9.01 0.03 . 1 . . . . . . . . 5267 1 383 . 1 1 51 51 PHE HA H 1 6.13 0.03 . 1 . . . . . . . . 5267 1 384 . 1 1 51 51 PHE HB2 H 1 3.28 0.03 . 2 . . . . . . . . 5267 1 385 . 1 1 51 51 PHE HB3 H 1 3.05 0.03 . 2 . . . . . . . . 5267 1 386 . 1 1 51 51 PHE C C 13 174.34 0.20 . 1 . . . . . . . . 5267 1 387 . 1 1 51 51 PHE CA C 13 56.86 0.20 . 1 . . . . . . . . 5267 1 388 . 1 1 51 51 PHE CB C 13 45.04 0.20 . 1 . . . . . . . . 5267 1 389 . 1 1 51 51 PHE N N 15 113.64 0.15 . 1 . . . . . . . . 5267 1 390 . 1 1 52 52 GLN H H 1 9.45 0.03 . 1 . . . . . . . . 5267 1 391 . 1 1 52 52 GLN HA H 1 5.06 0.03 . 1 . . . . . . . . 5267 1 392 . 1 1 52 52 GLN HB2 H 1 1.51 0.03 . 2 . . . . . . . . 5267 1 393 . 1 1 52 52 GLN HG2 H 1 2.33 0.03 . 2 . . . . . . . . 5267 1 394 . 1 1 52 52 GLN C C 13 170.14 0.20 . 1 . . . . . . . . 5267 1 395 . 1 1 52 52 GLN CA C 13 57.11 0.20 . 1 . . . . . . . . 5267 1 396 . 1 1 52 52 GLN CB C 13 32.30 0.20 . 1 . . . . . . . . 5267 1 397 . 1 1 52 52 GLN CG C 13 33.32 0.20 . 1 . . . . . . . . 5267 1 398 . 1 1 52 52 GLN N N 15 119.71 0.15 . 1 . . . . . . . . 5267 1 399 . 1 1 53 53 VAL H H 1 8.58 0.03 . 1 . . . . . . . . 5267 1 400 . 1 1 53 53 VAL HA H 1 5.34 0.03 . 1 . . . . . . . . 5267 1 401 . 1 1 53 53 VAL HB H 1 1.94 0.03 . 1 . . . . . . . . 5267 1 402 . 1 1 53 53 VAL HG11 H 1 0.81 0.03 . 2 . . . . . . . . 5267 1 403 . 1 1 53 53 VAL HG12 H 1 0.81 0.03 . 2 . . . . . . . . 5267 1 404 . 1 1 53 53 VAL HG13 H 1 0.81 0.03 . 2 . . . . . . . . 5267 1 405 . 1 1 53 53 VAL HG21 H 1 0.36 0.03 . 2 . . . . . . . . 5267 1 406 . 1 1 53 53 VAL HG22 H 1 0.36 0.03 . 2 . . . . . . . . 5267 1 407 . 1 1 53 53 VAL HG23 H 1 0.36 0.03 . 2 . . . . . . . . 5267 1 408 . 1 1 53 53 VAL C C 13 171.18 0.20 . 1 . . . . . . . . 5267 1 409 . 1 1 53 53 VAL CA C 13 59.73 0.20 . 1 . . . . . . . . 5267 1 410 . 1 1 53 53 VAL CB C 13 32.30 0.20 . 1 . . . . . . . . 5267 1 411 . 1 1 53 53 VAL CG1 C 13 23.05 0.20 . 1 . . . . . . . . 5267 1 412 . 1 1 53 53 VAL CG2 C 13 19.97 0.20 . 1 . . . . . . . . 5267 1 413 . 1 1 53 53 VAL N N 15 117.37 0.15 . 1 . . . . . . . . 5267 1 414 . 1 1 54 54 ASN H H 1 8.63 0.03 . 1 . . . . . . . . 5267 1 415 . 1 1 54 54 ASN HA H 1 5.71 0.03 . 1 . . . . . . . . 5267 1 416 . 1 1 54 54 ASN HB2 H 1 3.58 0.03 . 2 . . . . . . . . 5267 1 417 . 1 1 54 54 ASN HB3 H 1 2.40 0.03 . 2 . . . . . . . . 5267 1 418 . 1 1 54 54 ASN C C 13 173.13 0.20 . 1 . . . . . . . . 5267 1 419 . 1 1 54 54 ASN CA C 13 53.99 0.20 . 1 . . . . . . . . 5267 1 420 . 1 1 54 54 ASN CB C 13 43.35 0.20 . 1 . . . . . . . . 5267 1 421 . 1 1 54 54 ASN N N 15 121.81 0.15 . 1 . . . . . . . . 5267 1 422 . 1 1 55 55 ILE H H 1 8.75 0.03 . 1 . . . . . . . . 5267 1 423 . 1 1 55 55 ILE HA H 1 4.92 0.03 . 1 . . . . . . . . 5267 1 424 . 1 1 55 55 ILE HB H 1 1.65 0.03 . 1 . . . . . . . . 5267 1 425 . 1 1 55 55 ILE HG21 H 1 0.68 0.03 . 1 . . . . . . . . 5267 1 426 . 1 1 55 55 ILE HG22 H 1 0.68 0.03 . 1 . . . . . . . . 5267 1 427 . 1 1 55 55 ILE HG23 H 1 0.68 0.03 . 1 . . . . . . . . 5267 1 428 . 1 1 55 55 ILE HD11 H 1 0.62 0.03 . 1 . . . . . . . . 5267 1 429 . 1 1 55 55 ILE HD12 H 1 0.62 0.03 . 1 . . . . . . . . 5267 1 430 . 1 1 55 55 ILE HD13 H 1 0.62 0.03 . 1 . . . . . . . . 5267 1 431 . 1 1 55 55 ILE C C 13 173.53 0.20 . 1 . . . . . . . . 5267 1 432 . 1 1 55 55 ILE CA C 13 60.32 0.20 . 1 . . . . . . . . 5267 1 433 . 1 1 55 55 ILE CB C 13 43.02 0.20 . 1 . . . . . . . . 5267 1 434 . 1 1 55 55 ILE CG2 C 13 17.45 0.20 . 1 . . . . . . . . 5267 1 435 . 1 1 55 55 ILE CD1 C 13 14.68 0.20 . 1 . . . . . . . . 5267 1 436 . 1 1 55 55 ILE N N 15 126.48 0.15 . 1 . . . . . . . . 5267 1 437 . 1 1 56 56 VAL H H 1 9.10 0.03 . 1 . . . . . . . . 5267 1 438 . 1 1 56 56 VAL HA H 1 5.77 0.03 . 1 . . . . . . . . 5267 1 439 . 1 1 56 56 VAL HB H 1 1.95 0.03 . 1 . . . . . . . . 5267 1 440 . 1 1 56 56 VAL HG11 H 1 0.96 0.03 . 2 . . . . . . . . 5267 1 441 . 1 1 56 56 VAL HG12 H 1 0.96 0.03 . 2 . . . . . . . . 5267 1 442 . 1 1 56 56 VAL HG13 H 1 0.96 0.03 . 2 . . . . . . . . 5267 1 443 . 1 1 56 56 VAL HG21 H 1 0.93 0.03 . 2 . . . . . . . . 5267 1 444 . 1 1 56 56 VAL HG22 H 1 0.93 0.03 . 2 . . . . . . . . 5267 1 445 . 1 1 56 56 VAL HG23 H 1 0.93 0.03 . 2 . . . . . . . . 5267 1 446 . 1 1 56 56 VAL C C 13 174.26 0.20 . 1 . . . . . . . . 5267 1 447 . 1 1 56 56 VAL CA C 13 59.73 0.20 . 1 . . . . . . . . 5267 1 448 . 1 1 56 56 VAL CB C 13 35.59 0.20 . 1 . . . . . . . . 5267 1 449 . 1 1 56 56 VAL CG1 C 13 21.71 0.20 . 1 . . . . . . . . 5267 1 450 . 1 1 56 56 VAL CG2 C 13 21.71 0.20 . 1 . . . . . . . . 5267 1 451 . 1 1 56 56 VAL N N 15 121.34 0.15 . 1 . . . . . . . . 5267 1 452 . 1 1 57 57 TYR H H 1 9.16 0.03 . 1 . . . . . . . . 5267 1 453 . 1 1 57 57 TYR HA H 1 4.90 0.03 . 1 . . . . . . . . 5267 1 454 . 1 1 57 57 TYR HB2 H 1 2.90 0.03 . 2 . . . . . . . . 5267 1 455 . 1 1 57 57 TYR HB3 H 1 2.74 0.03 . 2 . . . . . . . . 5267 1 456 . 1 1 57 57 TYR HD1 H 1 6.81 0.03 . 3 . . . . . . . . 5267 1 457 . 1 1 57 57 TYR C C 13 171.81 0.20 . 1 . . . . . . . . 5267 1 458 . 1 1 57 57 TYR CA C 13 54.92 0.20 . 1 . . . . . . . . 5267 1 459 . 1 1 57 57 TYR CB C 13 42.34 0.20 . 1 . . . . . . . . 5267 1 460 . 1 1 57 57 TYR N N 15 121.11 0.15 . 1 . . . . . . . . 5267 1 461 . 1 1 58 58 ASP H H 1 9.99 0.03 . 1 . . . . . . . . 5267 1 462 . 1 1 58 58 ASP HA H 1 4.99 0.03 . 1 . . . . . . . . 5267 1 463 . 1 1 58 58 ASP HB2 H 1 3.04 0.03 . 2 . . . . . . . . 5267 1 464 . 1 1 58 58 ASP HB3 H 1 2.53 0.03 . 2 . . . . . . . . 5267 1 465 . 1 1 58 58 ASP CA C 13 50.70 0.20 . 1 . . . . . . . . 5267 1 466 . 1 1 58 58 ASP CB C 13 41.62 0.20 . 1 . . . . . . . . 5267 1 467 . 1 1 58 58 ASP N N 15 120.18 0.15 . 1 . . . . . . . . 5267 1 468 . 1 1 59 59 PRO HA H 1 4.42 0.03 . 1 . . . . . . . . 5267 1 469 . 1 1 59 59 PRO HB2 H 1 1.68 0.03 . 2 . . . . . . . . 5267 1 470 . 1 1 59 59 PRO HB3 H 1 1.60 0.03 . 2 . . . . . . . . 5267 1 471 . 1 1 59 59 PRO HG2 H 1 1.48 0.03 . 2 . . . . . . . . 5267 1 472 . 1 1 59 59 PRO HG3 H 1 1.31 0.03 . 2 . . . . . . . . 5267 1 473 . 1 1 59 59 PRO C C 13 177.32 0.20 . 1 . . . . . . . . 5267 1 474 . 1 1 59 59 PRO CA C 13 63.78 0.20 . 1 . . . . . . . . 5267 1 475 . 1 1 59 59 PRO CB C 13 32.58 0.20 . 1 . . . . . . . . 5267 1 476 . 1 1 60 60 LYS H H 1 8.36 0.03 . 1 . . . . . . . . 5267 1 477 . 1 1 60 60 LYS HA H 1 4.32 0.03 . 1 . . . . . . . . 5267 1 478 . 1 1 60 60 LYS HB2 H 1 1.98 0.03 . 2 . . . . . . . . 5267 1 479 . 1 1 60 60 LYS HG2 H 1 1.55 0.03 . 2 . . . . . . . . 5267 1 480 . 1 1 60 60 LYS HD2 H 1 1.71 0.03 . 2 . . . . . . . . 5267 1 481 . 1 1 60 60 LYS HE2 H 1 3.07 0.03 . 1 . . . . . . . . 5267 1 482 . 1 1 60 60 LYS C C 13 177.27 0.20 . 1 . . . . . . . . 5267 1 483 . 1 1 60 60 LYS CA C 13 56.86 0.20 . 1 . . . . . . . . 5267 1 484 . 1 1 60 60 LYS CB C 13 32.13 0.20 . 1 . . . . . . . . 5267 1 485 . 1 1 60 60 LYS CG C 13 25.74 0.20 . 1 . . . . . . . . 5267 1 486 . 1 1 60 60 LYS CD C 13 28.83 0.20 . 1 . . . . . . . . 5267 1 487 . 1 1 60 60 LYS N N 15 115.97 0.15 . 1 . . . . . . . . 5267 1 488 . 1 1 61 61 VAL H H 1 7.92 0.03 . 1 . . . . . . . . 5267 1 489 . 1 1 61 61 VAL HA H 1 4.10 0.03 . 1 . . . . . . . . 5267 1 490 . 1 1 61 61 VAL HB H 1 1.94 0.03 . 1 . . . . . . . . 5267 1 491 . 1 1 61 61 VAL HG11 H 1 1.25 0.03 . 2 . . . . . . . . 5267 1 492 . 1 1 61 61 VAL HG12 H 1 1.25 0.03 . 2 . . . . . . . . 5267 1 493 . 1 1 61 61 VAL HG13 H 1 1.25 0.03 . 2 . . . . . . . . 5267 1 494 . 1 1 61 61 VAL HG21 H 1 0.79 0.03 . 2 . . . . . . . . 5267 1 495 . 1 1 61 61 VAL HG22 H 1 0.79 0.03 . 2 . . . . . . . . 5267 1 496 . 1 1 61 61 VAL HG23 H 1 0.79 0.03 . 2 . . . . . . . . 5267 1 497 . 1 1 61 61 VAL C C 13 173.26 0.20 . 1 . . . . . . . . 5267 1 498 . 1 1 61 61 VAL CA C 13 65.13 0.20 . 1 . . . . . . . . 5267 1 499 . 1 1 61 61 VAL CB C 13 35.34 0.20 . 1 . . . . . . . . 5267 1 500 . 1 1 61 61 VAL CG1 C 13 23.13 0.20 . 1 . . . . . . . . 5267 1 501 . 1 1 61 61 VAL CG2 C 13 19.58 0.20 . 1 . . . . . . . . 5267 1 502 . 1 1 61 61 VAL N N 15 119.24 0.15 . 1 . . . . . . . . 5267 1 503 . 1 1 62 62 LEU H H 1 8.42 0.03 . 1 . . . . . . . . 5267 1 504 . 1 1 62 62 LEU HA H 1 5.44 0.03 . 1 . . . . . . . . 5267 1 505 . 1 1 62 62 LEU HB2 H 1 1.70 0.03 . 2 . . . . . . . . 5267 1 506 . 1 1 62 62 LEU HB3 H 1 1.22 0.03 . 2 . . . . . . . . 5267 1 507 . 1 1 62 62 LEU HG H 1 1.56 0.03 . 1 . . . . . . . . 5267 1 508 . 1 1 62 62 LEU HD11 H 1 0.79 0.03 . 2 . . . . . . . . 5267 1 509 . 1 1 62 62 LEU HD12 H 1 0.79 0.03 . 2 . . . . . . . . 5267 1 510 . 1 1 62 62 LEU HD13 H 1 0.79 0.03 . 2 . . . . . . . . 5267 1 511 . 1 1 62 62 LEU HD21 H 1 0.41 0.03 . 2 . . . . . . . . 5267 1 512 . 1 1 62 62 LEU HD22 H 1 0.41 0.03 . 2 . . . . . . . . 5267 1 513 . 1 1 62 62 LEU HD23 H 1 0.41 0.03 . 2 . . . . . . . . 5267 1 514 . 1 1 62 62 LEU C C 13 173.61 0.20 . 1 . . . . . . . . 5267 1 515 . 1 1 62 62 LEU CA C 13 53.15 0.20 . 1 . . . . . . . . 5267 1 516 . 1 1 62 62 LEU CB C 13 47.74 0.20 . 1 . . . . . . . . 5267 1 517 . 1 1 62 62 LEU CG C 13 26.92 0.20 . 1 . . . . . . . . 5267 1 518 . 1 1 62 62 LEU CD1 C 13 26.53 0.20 . 1 . . . . . . . . 5267 1 519 . 1 1 62 62 LEU CD2 C 13 23.69 0.20 . 1 . . . . . . . . 5267 1 520 . 1 1 62 62 LEU N N 15 117.61 0.15 . 1 . . . . . . . . 5267 1 521 . 1 1 63 63 MET H H 1 8.52 0.03 . 1 . . . . . . . . 5267 1 522 . 1 1 63 63 MET HA H 1 5.04 0.03 . 1 . . . . . . . . 5267 1 523 . 1 1 63 63 MET HB2 H 1 2.21 0.03 . 2 . . . . . . . . 5267 1 524 . 1 1 63 63 MET HB3 H 1 1.90 0.03 . 2 . . . . . . . . 5267 1 525 . 1 1 63 63 MET HG2 H 1 2.62 0.03 . 2 . . . . . . . . 5267 1 526 . 1 1 63 63 MET HG3 H 1 2.26 0.03 . 2 . . . . . . . . 5267 1 527 . 1 1 63 63 MET C C 13 175.37 0.20 . 1 . . . . . . . . 5267 1 528 . 1 1 63 63 MET CA C 13 53.40 0.20 . 1 . . . . . . . . 5267 1 529 . 1 1 63 63 MET CB C 13 38.54 0.20 . 1 . . . . . . . . 5267 1 530 . 1 1 63 63 MET CG C 13 31.43 0.20 . 1 . . . . . . . . 5267 1 531 . 1 1 63 63 MET N N 15 116.21 0.15 . 1 . . . . . . . . 5267 1 532 . 1 1 64 64 ALA H H 1 7.82 0.03 . 1 . . . . . . . . 5267 1 533 . 1 1 64 64 ALA HA H 1 4.27 0.03 . 1 . . . . . . . . 5267 1 534 . 1 1 64 64 ALA HB1 H 1 0.51 0.03 . 1 . . . . . . . . 5267 1 535 . 1 1 64 64 ALA HB2 H 1 0.51 0.03 . 1 . . . . . . . . 5267 1 536 . 1 1 64 64 ALA HB3 H 1 0.51 0.03 . 1 . . . . . . . . 5267 1 537 . 1 1 64 64 ALA C C 13 176.83 0.20 . 1 . . . . . . . . 5267 1 538 . 1 1 64 64 ALA CA C 13 52.05 0.20 . 1 . . . . . . . . 5267 1 539 . 1 1 64 64 ALA CB C 13 17.27 0.20 . 1 . . . . . . . . 5267 1 540 . 1 1 64 64 ALA N N 15 128.82 0.15 . 1 . . . . . . . . 5267 1 541 . 1 1 65 65 VAL H H 1 8.83 0.03 . 1 . . . . . . . . 5267 1 542 . 1 1 65 65 VAL HA H 1 4.92 0.03 . 1 . . . . . . . . 5267 1 543 . 1 1 65 65 VAL HB H 1 1.61 0.03 . 1 . . . . . . . . 5267 1 544 . 1 1 65 65 VAL HG11 H 1 0.69 0.03 . 2 . . . . . . . . 5267 1 545 . 1 1 65 65 VAL HG12 H 1 0.69 0.03 . 2 . . . . . . . . 5267 1 546 . 1 1 65 65 VAL HG13 H 1 0.69 0.03 . 2 . . . . . . . . 5267 1 547 . 1 1 65 65 VAL HG21 H 1 0.44 0.03 . 2 . . . . . . . . 5267 1 548 . 1 1 65 65 VAL HG22 H 1 0.44 0.03 . 2 . . . . . . . . 5267 1 549 . 1 1 65 65 VAL HG23 H 1 0.44 0.03 . 2 . . . . . . . . 5267 1 550 . 1 1 65 65 VAL C C 13 173.64 0.20 . 1 . . . . . . . . 5267 1 551 . 1 1 65 65 VAL CA C 13 58.63 0.20 . 1 . . . . . . . . 5267 1 552 . 1 1 65 65 VAL CB C 13 37.02 0.20 . 1 . . . . . . . . 5267 1 553 . 1 1 65 65 VAL CG1 C 13 22.13 0.20 . 1 . . . . . . . . 5267 1 554 . 1 1 65 65 VAL CG2 C 13 19.50 0.20 . 1 . . . . . . . . 5267 1 555 . 1 1 65 65 VAL N N 15 117.84 0.15 . 1 . . . . . . . . 5267 1 556 . 1 1 66 66 ASP H H 1 8.91 0.03 . 1 . . . . . . . . 5267 1 557 . 1 1 66 66 ASP HA H 1 4.91 0.03 . 1 . . . . . . . . 5267 1 558 . 1 1 66 66 ASP HB2 H 1 3.09 0.03 . 2 . . . . . . . . 5267 1 559 . 1 1 66 66 ASP HB3 H 1 2.52 0.03 . 2 . . . . . . . . 5267 1 560 . 1 1 66 66 ASP CA C 13 52.56 0.20 . 1 . . . . . . . . 5267 1 561 . 1 1 66 66 ASP CB C 13 43.10 0.20 . 1 . . . . . . . . 5267 1 562 . 1 1 66 66 ASP N N 15 123.21 0.15 . 1 . . . . . . . . 5267 1 563 . 1 1 67 67 PRO HA H 1 4.06 0.03 . 1 . . . . . . . . 5267 1 564 . 1 1 67 67 PRO C C 13 175.66 0.20 . 1 . . . . . . . . 5267 1 565 . 1 1 67 67 PRO CA C 13 64.71 0.20 . 1 . . . . . . . . 5267 1 566 . 1 1 67 67 PRO CB C 13 32.38 0.20 . 1 . . . . . . . . 5267 1 567 . 1 1 67 67 PRO CG C 13 27.63 0.20 . 1 . . . . . . . . 5267 1 568 . 1 1 68 68 GLU H H 1 8.88 0.03 . 1 . . . . . . . . 5267 1 569 . 1 1 68 68 GLU HA H 1 4.41 0.03 . 1 . . . . . . . . 5267 1 570 . 1 1 68 68 GLU HB2 H 1 2.24 0.03 . 2 . . . . . . . . 5267 1 571 . 1 1 68 68 GLU HB3 H 1 2.18 0.03 . 2 . . . . . . . . 5267 1 572 . 1 1 68 68 GLU HG2 H 1 2.23 0.03 . 2 . . . . . . . . 5267 1 573 . 1 1 68 68 GLU HG3 H 1 2.14 0.03 . 2 . . . . . . . . 5267 1 574 . 1 1 68 68 GLU C C 13 178.01 0.20 . 1 . . . . . . . . 5267 1 575 . 1 1 68 68 GLU CA C 13 58.13 0.20 . 1 . . . . . . . . 5267 1 576 . 1 1 68 68 GLU CB C 13 31.03 0.20 . 1 . . . . . . . . 5267 1 577 . 1 1 68 68 GLU CG C 13 36.95 0.20 . 1 . . . . . . . . 5267 1 578 . 1 1 68 68 GLU N N 15 117.14 0.15 . 1 . . . . . . . . 5267 1 579 . 1 1 69 69 THR H H 1 8.17 0.03 . 1 . . . . . . . . 5267 1 580 . 1 1 69 69 THR HA H 1 4.42 0.03 . 1 . . . . . . . . 5267 1 581 . 1 1 69 69 THR HB H 1 4.38 0.03 . 1 . . . . . . . . 5267 1 582 . 1 1 69 69 THR HG21 H 1 1.23 0.03 . 1 . . . . . . . . 5267 1 583 . 1 1 69 69 THR HG22 H 1 1.23 0.03 . 1 . . . . . . . . 5267 1 584 . 1 1 69 69 THR HG23 H 1 1.23 0.03 . 1 . . . . . . . . 5267 1 585 . 1 1 69 69 THR C C 13 176.41 0.20 . 1 . . . . . . . . 5267 1 586 . 1 1 69 69 THR CA C 13 62.10 0.20 . 1 . . . . . . . . 5267 1 587 . 1 1 69 69 THR CB C 13 71.55 0.20 . 1 . . . . . . . . 5267 1 588 . 1 1 69 69 THR CG2 C 13 21.16 0.20 . 1 . . . . . . . . 5267 1 589 . 1 1 69 69 THR N N 15 106.41 0.15 . 1 . . . . . . . . 5267 1 590 . 1 1 70 70 GLY H H 1 8.43 0.03 . 1 . . . . . . . . 5267 1 591 . 1 1 70 70 GLY HA2 H 1 4.17 0.03 . 2 . . . . . . . . 5267 1 592 . 1 1 70 70 GLY HA3 H 1 3.50 0.03 . 2 . . . . . . . . 5267 1 593 . 1 1 70 70 GLY C C 13 172.94 0.20 . 1 . . . . . . . . 5267 1 594 . 1 1 70 70 GLY CA C 13 45.97 0.20 . 1 . . . . . . . . 5267 1 595 . 1 1 70 70 GLY N N 15 110.13 0.15 . 1 . . . . . . . . 5267 1 596 . 1 1 71 71 LYS H H 1 7.60 0.03 . 1 . . . . . . . . 5267 1 597 . 1 1 71 71 LYS HA H 1 4.19 0.03 . 1 . . . . . . . . 5267 1 598 . 1 1 71 71 LYS HB2 H 1 1.80 0.03 . 2 . . . . . . . . 5267 1 599 . 1 1 71 71 LYS HB3 H 1 1.71 0.03 . 2 . . . . . . . . 5267 1 600 . 1 1 71 71 LYS HG2 H 1 1.48 0.03 . 2 . . . . . . . . 5267 1 601 . 1 1 71 71 LYS HD2 H 1 1.71 0.03 . 2 . . . . . . . . 5267 1 602 . 1 1 71 71 LYS HE2 H 1 3.07 0.03 . 1 . . . . . . . . 5267 1 603 . 1 1 71 71 LYS C C 13 176.72 0.20 . 1 . . . . . . . . 5267 1 604 . 1 1 71 71 LYS CA C 13 57.03 0.20 . 1 . . . . . . . . 5267 1 605 . 1 1 71 71 LYS CB C 13 33.31 0.20 . 1 . . . . . . . . 5267 1 606 . 1 1 71 71 LYS CG C 13 25.19 0.20 . 1 . . . . . . . . 5267 1 607 . 1 1 71 71 LYS CD C 13 29.06 0.20 . 1 . . . . . . . . 5267 1 608 . 1 1 71 71 LYS N N 15 119.01 0.15 . 1 . . . . . . . . 5267 1 609 . 1 1 72 72 GLU H H 1 9.36 0.03 . 1 . . . . . . . . 5267 1 610 . 1 1 72 72 GLU HA H 1 4.41 0.03 . 1 . . . . . . . . 5267 1 611 . 1 1 72 72 GLU HB2 H 1 2.12 0.03 . 2 . . . . . . . . 5267 1 612 . 1 1 72 72 GLU HB3 H 1 2.08 0.03 . 2 . . . . . . . . 5267 1 613 . 1 1 72 72 GLU HG2 H 1 2.63 0.03 . 2 . . . . . . . . 5267 1 614 . 1 1 72 72 GLU HG3 H 1 2.42 0.03 . 2 . . . . . . . . 5267 1 615 . 1 1 72 72 GLU C C 13 176.67 0.20 . 1 . . . . . . . . 5267 1 616 . 1 1 72 72 GLU CA C 13 58.21 0.20 . 1 . . . . . . . . 5267 1 617 . 1 1 72 72 GLU CB C 13 30.02 0.20 . 1 . . . . . . . . 5267 1 618 . 1 1 72 72 GLU CG C 13 36.80 0.20 . 1 . . . . . . . . 5267 1 619 . 1 1 72 72 GLU N N 15 124.62 0.15 . 1 . . . . . . . . 5267 1 620 . 1 1 73 73 PHE H H 1 8.43 0.03 . 1 . . . . . . . . 5267 1 621 . 1 1 73 73 PHE HA H 1 4.44 0.03 . 1 . . . . . . . . 5267 1 622 . 1 1 73 73 PHE HB2 H 1 3.11 0.03 . 2 . . . . . . . . 5267 1 623 . 1 1 73 73 PHE HB3 H 1 2.90 0.03 . 2 . . . . . . . . 5267 1 624 . 1 1 73 73 PHE HD1 H 1 7.08 0.03 . 3 . . . . . . . . 5267 1 625 . 1 1 73 73 PHE C C 13 176.28 0.20 . 1 . . . . . . . . 5267 1 626 . 1 1 73 73 PHE CA C 13 58.38 0.20 . 1 . . . . . . . . 5267 1 627 . 1 1 73 73 PHE CB C 13 39.98 0.20 . 1 . . . . . . . . 5267 1 628 . 1 1 73 73 PHE N N 15 122.78 0.15 . 1 . . . . . . . . 5267 1 629 . 1 1 74 74 THR H H 1 9.04 0.03 . 1 . . . . . . . . 5267 1 630 . 1 1 74 74 THR HA H 1 4.78 0.03 . 1 . . . . . . . . 5267 1 631 . 1 1 74 74 THR HB H 1 4.46 0.03 . 1 . . . . . . . . 5267 1 632 . 1 1 74 74 THR HG21 H 1 1.29 0.03 . 1 . . . . . . . . 5267 1 633 . 1 1 74 74 THR HG22 H 1 1.29 0.03 . 1 . . . . . . . . 5267 1 634 . 1 1 74 74 THR HG23 H 1 1.29 0.03 . 1 . . . . . . . . 5267 1 635 . 1 1 74 74 THR C C 13 176.18 0.20 . 1 . . . . . . . . 5267 1 636 . 1 1 74 74 THR CA C 13 60.15 0.20 . 1 . . . . . . . . 5267 1 637 . 1 1 74 74 THR CB C 13 71.72 0.20 . 1 . . . . . . . . 5267 1 638 . 1 1 74 74 THR CG2 C 13 21.71 0.20 . 1 . . . . . . . . 5267 1 639 . 1 1 74 74 THR N N 15 111.30 0.15 . 1 . . . . . . . . 5267 1 640 . 1 1 75 75 SER H H 1 9.15 0.03 . 1 . . . . . . . . 5267 1 641 . 1 1 75 75 SER HA H 1 4.71 0.03 . 1 . . . . . . . . 5267 1 642 . 1 1 75 75 SER HB2 H 1 4.51 0.03 . 2 . . . . . . . . 5267 1 643 . 1 1 75 75 SER HB3 H 1 4.33 0.03 . 2 . . . . . . . . 5267 1 644 . 1 1 75 75 SER C C 13 173.95 0.20 . 1 . . . . . . . . 5267 1 645 . 1 1 75 75 SER CA C 13 61.93 0.20 . 1 . . . . . . . . 5267 1 646 . 1 1 75 75 SER CB C 13 63.62 0.20 . 1 . . . . . . . . 5267 1 647 . 1 1 75 75 SER N N 15 115.04 0.15 . 1 . . . . . . . . 5267 1 648 . 1 1 76 76 SER H H 1 7.81 0.03 . 1 . . . . . . . . 5267 1 649 . 1 1 76 76 SER HA H 1 4.84 0.03 . 1 . . . . . . . . 5267 1 650 . 1 1 76 76 SER HB2 H 1 4.19 0.03 . 2 . . . . . . . . 5267 1 651 . 1 1 76 76 SER C C 13 174.91 0.20 . 1 . . . . . . . . 5267 1 652 . 1 1 76 76 SER CA C 13 57.71 0.20 . 1 . . . . . . . . 5267 1 653 . 1 1 76 76 SER CB C 13 64.88 0.20 . 1 . . . . . . . . 5267 1 654 . 1 1 76 76 SER N N 15 109.20 0.15 . 1 . . . . . . . . 5267 1 655 . 1 1 77 77 THR H H 1 7.23 0.03 . 1 . . . . . . . . 5267 1 656 . 1 1 77 77 THR HA H 1 3.74 0.03 . 1 . . . . . . . . 5267 1 657 . 1 1 77 77 THR HB H 1 3.33 0.03 . 1 . . . . . . . . 5267 1 658 . 1 1 77 77 THR HG21 H 1 0.23 0.03 . 1 . . . . . . . . 5267 1 659 . 1 1 77 77 THR HG22 H 1 0.23 0.03 . 1 . . . . . . . . 5267 1 660 . 1 1 77 77 THR HG23 H 1 0.23 0.03 . 1 . . . . . . . . 5267 1 661 . 1 1 77 77 THR C C 13 170.76 0.20 . 1 . . . . . . . . 5267 1 662 . 1 1 77 77 THR CA C 13 65.22 0.20 . 1 . . . . . . . . 5267 1 663 . 1 1 77 77 THR CB C 13 70.20 0.20 . 1 . . . . . . . . 5267 1 664 . 1 1 77 77 THR CG2 C 13 20.84 0.20 . 1 . . . . . . . . 5267 1 665 . 1 1 77 77 THR N N 15 119.24 0.15 . 1 . . . . . . . . 5267 1 666 . 1 1 78 78 PHE H H 1 8.70 0.03 . 1 . . . . . . . . 5267 1 667 . 1 1 78 78 PHE HA H 1 4.62 0.03 . 1 . . . . . . . . 5267 1 668 . 1 1 78 78 PHE HB2 H 1 3.11 0.03 . 2 . . . . . . . . 5267 1 669 . 1 1 78 78 PHE HB3 H 1 2.88 0.03 . 2 . . . . . . . . 5267 1 670 . 1 1 78 78 PHE CA C 13 55.34 0.20 . 1 . . . . . . . . 5267 1 671 . 1 1 78 78 PHE CB C 13 41.92 0.20 . 1 . . . . . . . . 5267 1 672 . 1 1 78 78 PHE N N 15 129.75 0.15 . 1 . . . . . . . . 5267 1 673 . 1 1 80 80 PRO C C 13 173.88 0.20 . 1 . . . . . . . . 5267 1 674 . 1 1 80 80 PRO CA C 13 62.85 0.20 . 1 . . . . . . . . 5267 1 675 . 1 1 80 80 PRO CB C 13 33.65 0.20 . 1 . . . . . . . . 5267 1 676 . 1 1 81 81 GLY H H 1 8.23 0.03 . 1 . . . . . . . . 5267 1 677 . 1 1 81 81 GLY HA2 H 1 3.94 0.03 . 2 . . . . . . . . 5267 1 678 . 1 1 81 81 GLY HA3 H 1 3.70 0.03 . 2 . . . . . . . . 5267 1 679 . 1 1 81 81 GLY C C 13 174.59 0.20 . 1 . . . . . . . . 5267 1 680 . 1 1 81 81 GLY CA C 13 46.48 0.20 . 1 . . . . . . . . 5267 1 681 . 1 1 81 81 GLY N N 15 99.86 0.15 . 1 . . . . . . . . 5267 1 682 . 1 1 82 82 ARG H H 1 7.57 0.03 . 1 . . . . . . . . 5267 1 683 . 1 1 82 82 ARG C C 13 175.95 0.20 . 1 . . . . . . . . 5267 1 684 . 1 1 82 82 ARG CA C 13 56.19 0.20 . 1 . . . . . . . . 5267 1 685 . 1 1 82 82 ARG CB C 13 30.19 0.20 . 1 . . . . . . . . 5267 1 686 . 1 1 82 82 ARG N N 15 114.57 0.15 . 1 . . . . . . . . 5267 1 687 . 1 1 83 83 THR H H 1 9.25 0.03 . 1 . . . . . . . . 5267 1 688 . 1 1 83 83 THR HA H 1 4.61 0.03 . 1 . . . . . . . . 5267 1 689 . 1 1 83 83 THR HB H 1 4.12 0.03 . 1 . . . . . . . . 5267 1 690 . 1 1 83 83 THR HG21 H 1 1.30 0.03 . 1 . . . . . . . . 5267 1 691 . 1 1 83 83 THR HG22 H 1 1.30 0.03 . 1 . . . . . . . . 5267 1 692 . 1 1 83 83 THR HG23 H 1 1.30 0.03 . 1 . . . . . . . . 5267 1 693 . 1 1 83 83 THR C C 13 173.66 0.20 . 1 . . . . . . . . 5267 1 694 . 1 1 83 83 THR CA C 13 61.16 0.20 . 1 . . . . . . . . 5267 1 695 . 1 1 83 83 THR CB C 13 70.28 0.20 . 1 . . . . . . . . 5267 1 696 . 1 1 83 83 THR CG2 C 13 22.50 0.20 . 1 . . . . . . . . 5267 1 697 . 1 1 83 83 THR N N 15 107.33 0.15 . 1 . . . . . . . . 5267 1 698 . 1 1 84 84 VAL H H 1 7.05 0.03 . 1 . . . . . . . . 5267 1 699 . 1 1 84 84 VAL HA H 1 4.87 0.03 . 1 . . . . . . . . 5267 1 700 . 1 1 84 84 VAL HB H 1 2.01 0.03 . 1 . . . . . . . . 5267 1 701 . 1 1 84 84 VAL HG11 H 1 0.87 0.03 . 2 . . . . . . . . 5267 1 702 . 1 1 84 84 VAL HG12 H 1 0.87 0.03 . 2 . . . . . . . . 5267 1 703 . 1 1 84 84 VAL HG13 H 1 0.87 0.03 . 2 . . . . . . . . 5267 1 704 . 1 1 84 84 VAL HG21 H 1 0.78 0.03 . 2 . . . . . . . . 5267 1 705 . 1 1 84 84 VAL HG22 H 1 0.78 0.03 . 2 . . . . . . . . 5267 1 706 . 1 1 84 84 VAL HG23 H 1 0.78 0.03 . 2 . . . . . . . . 5267 1 707 . 1 1 84 84 VAL C C 13 173.44 0.20 . 1 . . . . . . . . 5267 1 708 . 1 1 84 84 VAL CA C 13 58.97 0.20 . 1 . . . . . . . . 5267 1 709 . 1 1 84 84 VAL CB C 13 35.98 0.20 . 1 . . . . . . . . 5267 1 710 . 1 1 84 84 VAL CG1 C 13 22.96 0.20 . 1 . . . . . . . . 5267 1 711 . 1 1 84 84 VAL CG2 C 13 19.18 0.20 . 1 . . . . . . . . 5267 1 712 . 1 1 84 84 VAL N N 15 111.77 0.15 . 1 . . . . . . . . 5267 1 713 . 1 1 85 85 LEU H H 1 9.70 0.03 . 1 . . . . . . . . 5267 1 714 . 1 1 85 85 LEU HA H 1 3.86 0.03 . 1 . . . . . . . . 5267 1 715 . 1 1 85 85 LEU HB2 H 1 1.87 0.03 . 2 . . . . . . . . 5267 1 716 . 1 1 85 85 LEU HB3 H 1 0.84 0.03 . 2 . . . . . . . . 5267 1 717 . 1 1 85 85 LEU HG H 1 1.12 0.03 . 1 . . . . . . . . 5267 1 718 . 1 1 85 85 LEU HD11 H 1 0.53 0.03 . 2 . . . . . . . . 5267 1 719 . 1 1 85 85 LEU HD12 H 1 0.53 0.03 . 2 . . . . . . . . 5267 1 720 . 1 1 85 85 LEU HD13 H 1 0.53 0.03 . 2 . . . . . . . . 5267 1 721 . 1 1 85 85 LEU HD21 H 1 0.05 0.03 . 2 . . . . . . . . 5267 1 722 . 1 1 85 85 LEU HD22 H 1 0.05 0.03 . 2 . . . . . . . . 5267 1 723 . 1 1 85 85 LEU HD23 H 1 0.05 0.03 . 2 . . . . . . . . 5267 1 724 . 1 1 85 85 LEU C C 13 177.21 0.20 . 1 . . . . . . . . 5267 1 725 . 1 1 85 85 LEU CA C 13 55.34 0.20 . 1 . . . . . . . . 5267 1 726 . 1 1 85 85 LEU CB C 13 38.21 0.20 . 1 . . . . . . . . 5267 1 727 . 1 1 85 85 LEU CG C 13 26.77 0.20 . 1 . . . . . . . . 5267 1 728 . 1 1 85 85 LEU CD1 C 13 26.38 0.20 . 1 . . . . . . . . 5267 1 729 . 1 1 85 85 LEU CD2 C 13 22.10 0.20 . 1 . . . . . . . . 5267 1 730 . 1 1 85 85 LEU N N 15 115.5 0.15 . 1 . . . . . . . . 5267 1 731 . 1 1 86 86 LYS H H 1 8.96 0.03 . 1 . . . . . . . . 5267 1 732 . 1 1 86 86 LYS HA H 1 4.48 0.03 . 1 . . . . . . . . 5267 1 733 . 1 1 86 86 LYS HB2 H 1 1.88 0.03 . 2 . . . . . . . . 5267 1 734 . 1 1 86 86 LYS HB3 H 1 1.65 0.03 . 2 . . . . . . . . 5267 1 735 . 1 1 86 86 LYS HG2 H 1 1.28 0.03 . 2 . . . . . . . . 5267 1 736 . 1 1 86 86 LYS HG3 H 1 1.16 0.03 . 2 . . . . . . . . 5267 1 737 . 1 1 86 86 LYS HD2 H 1 1.35 0.03 . 2 . . . . . . . . 5267 1 738 . 1 1 86 86 LYS HE2 H 1 2.97 0.03 . 1 . . . . . . . . 5267 1 739 . 1 1 86 86 LYS C C 13 176.02 0.20 . 1 . . . . . . . . 5267 1 740 . 1 1 86 86 LYS CA C 13 55.76 0.20 . 1 . . . . . . . . 5267 1 741 . 1 1 86 86 LYS CB C 13 33.56 0.20 . 1 . . . . . . . . 5267 1 742 . 1 1 86 86 LYS CG C 13 24.71 0.20 . 1 . . . . . . . . 5267 1 743 . 1 1 86 86 LYS CD C 13 29.21 0.20 . 1 . . . . . . . . 5267 1 744 . 1 1 86 86 LYS CE C 13 41.85 0.20 . 1 . . . . . . . . 5267 1 745 . 1 1 86 86 LYS N N 15 115.04 0.15 . 1 . . . . . . . . 5267 1 746 . 1 1 87 87 ASN H H 1 8.50 0.03 . 1 . . . . . . . . 5267 1 747 . 1 1 87 87 ASN HA H 1 4.60 0.03 . 1 . . . . . . . . 5267 1 748 . 1 1 87 87 ASN HB2 H 1 3.25 0.03 . 2 . . . . . . . . 5267 1 749 . 1 1 87 87 ASN HB3 H 1 2.86 0.03 . 2 . . . . . . . . 5267 1 750 . 1 1 87 87 ASN C C 13 175.97 0.20 . 1 . . . . . . . . 5267 1 751 . 1 1 87 87 ASN CA C 13 53.91 0.20 . 1 . . . . . . . . 5267 1 752 . 1 1 87 87 ASN CB C 13 38.54 0.20 . 1 . . . . . . . . 5267 1 753 . 1 1 87 87 ASN N N 15 120.41 0.15 . 1 . . . . . . . . 5267 1 754 . 1 1 88 88 ASN H H 1 8.78 0.03 . 1 . . . . . . . . 5267 1 755 . 1 1 88 88 ASN HA H 1 4.26 0.03 . 1 . . . . . . . . 5267 1 756 . 1 1 88 88 ASN HB2 H 1 2.83 0.03 . 2 . . . . . . . . 5267 1 757 . 1 1 88 88 ASN HB3 H 1 2.82 0.03 . 2 . . . . . . . . 5267 1 758 . 1 1 88 88 ASN C C 13 176.92 0.20 . 1 . . . . . . . . 5267 1 759 . 1 1 88 88 ASN CA C 13 56.35 0.20 . 1 . . . . . . . . 5267 1 760 . 1 1 88 88 ASN CB C 13 38.71 0.20 . 1 . . . . . . . . 5267 1 761 . 1 1 88 88 ASN N N 15 124.15 0.15 . 1 . . . . . . . . 5267 1 762 . 1 1 89 89 ALA H H 1 8.24 0.03 . 1 . . . . . . . . 5267 1 763 . 1 1 89 89 ALA HA H 1 3.97 0.03 . 1 . . . . . . . . 5267 1 764 . 1 1 89 89 ALA HB1 H 1 0.78 0.03 . 1 . . . . . . . . 5267 1 765 . 1 1 89 89 ALA HB2 H 1 0.78 0.03 . 1 . . . . . . . . 5267 1 766 . 1 1 89 89 ALA HB3 H 1 0.78 0.03 . 1 . . . . . . . . 5267 1 767 . 1 1 89 89 ALA C C 13 178.44 0.20 . 1 . . . . . . . . 5267 1 768 . 1 1 89 89 ALA CA C 13 54.50 0.20 . 1 . . . . . . . . 5267 1 769 . 1 1 89 89 ALA CB C 13 17.86 0.20 . 1 . . . . . . . . 5267 1 770 . 1 1 89 89 ALA N N 15 120.41 0.15 . 1 . . . . . . . . 5267 1 771 . 1 1 90 90 TYR H H 1 6.79 0.03 . 1 . . . . . . . . 5267 1 772 . 1 1 90 90 TYR HA H 1 5.20 0.03 . 1 . . . . . . . . 5267 1 773 . 1 1 90 90 TYR HB2 H 1 2.73 0.03 . 2 . . . . . . . . 5267 1 774 . 1 1 90 90 TYR C C 13 176.26 0.20 . 1 . . . . . . . . 5267 1 775 . 1 1 90 90 TYR CA C 13 55.00 0.20 . 1 . . . . . . . . 5267 1 776 . 1 1 90 90 TYR CB C 13 35.67 0.20 . 1 . . . . . . . . 5267 1 777 . 1 1 90 90 TYR N N 15 112.00 0.15 . 1 . . . . . . . . 5267 1 778 . 1 1 91 91 GLY H H 1 7.60 0.03 . 1 . . . . . . . . 5267 1 779 . 1 1 91 91 GLY HA2 H 1 4.21 0.03 . 2 . . . . . . . . 5267 1 780 . 1 1 91 91 GLY HA3 H 1 3.72 0.03 . 2 . . . . . . . . 5267 1 781 . 1 1 91 91 GLY CA C 13 49.26 0.20 . 1 . . . . . . . . 5267 1 782 . 1 1 91 91 GLY N N 15 106.40 0.15 . 1 . . . . . . . . 5267 1 783 . 1 1 92 92 PRO C C 13 176.35 0.20 . 1 . . . . . . . . 5267 1 784 . 1 1 92 92 PRO CA C 13 64.04 0.20 . 1 . . . . . . . . 5267 1 785 . 1 1 92 92 PRO CB C 13 31.96 0.20 . 1 . . . . . . . . 5267 1 786 . 1 1 93 93 ILE H H 1 8.68 0.03 . 1 . . . . . . . . 5267 1 787 . 1 1 93 93 ILE HA H 1 4.37 0.03 . 1 . . . . . . . . 5267 1 788 . 1 1 93 93 ILE HB H 1 1.83 0.03 . 1 . . . . . . . . 5267 1 789 . 1 1 93 93 ILE HG12 H 1 1.59 0.03 . 2 . . . . . . . . 5267 1 790 . 1 1 93 93 ILE HG13 H 1 1.25 0.03 . 2 . . . . . . . . 5267 1 791 . 1 1 93 93 ILE HG21 H 1 0.83 0.03 . 1 . . . . . . . . 5267 1 792 . 1 1 93 93 ILE HG22 H 1 0.83 0.03 . 1 . . . . . . . . 5267 1 793 . 1 1 93 93 ILE HG23 H 1 0.83 0.03 . 1 . . . . . . . . 5267 1 794 . 1 1 93 93 ILE HD11 H 1 0.83 0.03 . 1 . . . . . . . . 5267 1 795 . 1 1 93 93 ILE HD12 H 1 0.83 0.03 . 1 . . . . . . . . 5267 1 796 . 1 1 93 93 ILE HD13 H 1 0.83 0.03 . 1 . . . . . . . . 5267 1 797 . 1 1 93 93 ILE C C 13 174.27 0.20 . 1 . . . . . . . . 5267 1 798 . 1 1 93 93 ILE CA C 13 60.41 0.20 . 1 . . . . . . . . 5267 1 799 . 1 1 93 93 ILE CB C 13 40.15 0.20 . 1 . . . . . . . . 5267 1 800 . 1 1 93 93 ILE CG1 C 13 26.45 0.20 . 1 . . . . . . . . 5267 1 801 . 1 1 93 93 ILE CG2 C 13 17.37 0.20 . 1 . . . . . . . . 5267 1 802 . 1 1 93 93 ILE CD1 C 13 12.71 0.20 . 1 . . . . . . . . 5267 1 803 . 1 1 93 93 ILE N N 15 125.08 0.15 . 1 . . . . . . . . 5267 1 804 . 1 1 94 94 GLN H H 1 8.37 0.03 . 1 . . . . . . . . 5267 1 805 . 1 1 94 94 GLN HA H 1 4.86 0.03 . 1 . . . . . . . . 5267 1 806 . 1 1 94 94 GLN HB2 H 1 1.30 0.03 . 1 . . . . . . . . 5267 1 807 . 1 1 94 94 GLN HB3 H 1 1.30 0.03 . 1 . . . . . . . . 5267 1 808 . 1 1 94 94 GLN HG2 H 1 1.83 0.03 . 2 . . . . . . . . 5267 1 809 . 1 1 94 94 GLN HG3 H 1 1.56 0.03 . 2 . . . . . . . . 5267 1 810 . 1 1 94 94 GLN C C 13 174.39 0.20 . 1 . . . . . . . . 5267 1 811 . 1 1 94 94 GLN CA C 13 53.91 0.20 . 1 . . . . . . . . 5267 1 812 . 1 1 94 94 GLN CB C 13 31.62 0.20 . 1 . . . . . . . . 5267 1 813 . 1 1 94 94 GLN CG C 13 33.56 0.20 . 1 . . . . . . . . 5267 1 814 . 1 1 94 94 GLN N N 15 124.85 0.15 . 1 . . . . . . . . 5267 1 815 . 1 1 95 95 ILE H H 1 9.21 0.03 . 1 . . . . . . . . 5267 1 816 . 1 1 95 95 ILE HA H 1 4.50 0.03 . 1 . . . . . . . . 5267 1 817 . 1 1 95 95 ILE HB H 1 1.84 0.03 . 1 . . . . . . . . 5267 1 818 . 1 1 95 95 ILE HG12 H 1 1.45 0.03 . 2 . . . . . . . . 5267 1 819 . 1 1 95 95 ILE HG13 H 1 1.10 0.03 . 2 . . . . . . . . 5267 1 820 . 1 1 95 95 ILE HG21 H 1 0.93 0.03 . 1 . . . . . . . . 5267 1 821 . 1 1 95 95 ILE HG22 H 1 0.93 0.03 . 1 . . . . . . . . 5267 1 822 . 1 1 95 95 ILE HG23 H 1 0.93 0.03 . 1 . . . . . . . . 5267 1 823 . 1 1 95 95 ILE HD11 H 1 0.86 0.03 . 1 . . . . . . . . 5267 1 824 . 1 1 95 95 ILE HD12 H 1 0.86 0.03 . 1 . . . . . . . . 5267 1 825 . 1 1 95 95 ILE HD13 H 1 0.86 0.03 . 1 . . . . . . . . 5267 1 826 . 1 1 95 95 ILE C C 13 173.25 0.20 . 1 . . . . . . . . 5267 1 827 . 1 1 95 95 ILE CA C 13 61.42 0.20 . 1 . . . . . . . . 5267 1 828 . 1 1 95 95 ILE CB C 13 42.26 0.20 . 1 . . . . . . . . 5267 1 829 . 1 1 95 95 ILE CG1 C 13 28.11 0.20 . 1 . . . . . . . . 5267 1 830 . 1 1 95 95 ILE CG2 C 13 17.76 0.20 . 1 . . . . . . . . 5267 1 831 . 1 1 95 95 ILE CD1 C 13 13.74 0.20 . 1 . . . . . . . . 5267 1 832 . 1 1 95 95 ILE N N 15 122.28 0.15 . 1 . . . . . . . . 5267 1 833 . 1 1 96 96 ALA H H 1 8.52 0.03 . 1 . . . . . . . . 5267 1 834 . 1 1 96 96 ALA HA H 1 5.32 0.03 . 1 . . . . . . . . 5267 1 835 . 1 1 96 96 ALA HB1 H 1 1.49 0.03 . 1 . . . . . . . . 5267 1 836 . 1 1 96 96 ALA HB2 H 1 1.49 0.03 . 1 . . . . . . . . 5267 1 837 . 1 1 96 96 ALA HB3 H 1 1.49 0.03 . 1 . . . . . . . . 5267 1 838 . 1 1 96 96 ALA C C 13 174.76 0.20 . 1 . . . . . . . . 5267 1 839 . 1 1 96 96 ALA CA C 13 52.13 0.20 . 1 . . . . . . . . 5267 1 840 . 1 1 96 96 ALA CB C 13 23.35 0.20 . 1 . . . . . . . . 5267 1 841 . 1 1 96 96 ALA N N 15 127.65 0.15 . 1 . . . . . . . . 5267 1 842 . 1 1 97 97 ASP H H 1 9.24 0.03 . 1 . . . . . . . . 5267 1 843 . 1 1 97 97 ASP HA H 1 5.02 0.03 . 1 . . . . . . . . 5267 1 844 . 1 1 97 97 ASP HB2 H 1 2.77 0.03 . 2 . . . . . . . . 5267 1 845 . 1 1 97 97 ASP HB3 H 1 2.40 0.03 . 2 . . . . . . . . 5267 1 846 . 1 1 97 97 ASP C C 13 174.08 0.20 . 1 . . . . . . . . 5267 1 847 . 1 1 97 97 ASP CA C 13 53.57 0.20 . 1 . . . . . . . . 5267 1 848 . 1 1 97 97 ASP CB C 13 41.75 0.20 . 1 . . . . . . . . 5267 1 849 . 1 1 97 97 ASP N N 15 123.68 0.15 . 1 . . . . . . . . 5267 1 850 . 1 1 98 98 ASN H H 1 9.32 0.03 . 1 . . . . . . . . 5267 1 851 . 1 1 98 98 ASN HA H 1 4.98 0.03 . 1 . . . . . . . . 5267 1 852 . 1 1 98 98 ASN HB2 H 1 3.33 0.03 . 2 . . . . . . . . 5267 1 853 . 1 1 98 98 ASN HB3 H 1 2.88 0.03 . 2 . . . . . . . . 5267 1 854 . 1 1 98 98 ASN C C 13 175.28 0.20 . 1 . . . . . . . . 5267 1 855 . 1 1 98 98 ASN CA C 13 53.40 0.20 . 1 . . . . . . . . 5267 1 856 . 1 1 98 98 ASN CB C 13 41.08 0.20 . 1 . . . . . . . . 5267 1 857 . 1 1 98 98 ASN N N 15 116.91 0.15 . 1 . . . . . . . . 5267 1 858 . 1 1 99 99 ASP H H 1 9.53 0.03 . 1 . . . . . . . . 5267 1 859 . 1 1 99 99 ASP HA H 1 5.17 0.03 . 1 . . . . . . . . 5267 1 860 . 1 1 99 99 ASP HB2 H 1 3.10 0.03 . 2 . . . . . . . . 5267 1 861 . 1 1 99 99 ASP HB3 H 1 2.52 0.03 . 2 . . . . . . . . 5267 1 862 . 1 1 99 99 ASP CA C 13 51.80 0.20 . 1 . . . . . . . . 5267 1 863 . 1 1 99 99 ASP CB C 13 41.75 0.20 . 1 . . . . . . . . 5267 1 864 . 1 1 99 99 ASP N N 15 116.44 0.15 . 1 . . . . . . . . 5267 1 865 . 1 1 100 100 PRO HA H 1 4.64 0.03 . 1 . . . . . . . . 5267 1 866 . 1 1 100 100 PRO HB2 H 1 2.61 0.03 . 2 . . . . . . . . 5267 1 867 . 1 1 100 100 PRO HB3 H 1 2.23 0.03 . 2 . . . . . . . . 5267 1 868 . 1 1 100 100 PRO C C 13 178.55 0.20 . 1 . . . . . . . . 5267 1 869 . 1 1 100 100 PRO CA C 13 65.13 0.20 . 1 . . . . . . . . 5267 1 870 . 1 1 100 100 PRO CB C 13 32.75 0.20 . 1 . . . . . . . . 5267 1 871 . 1 1 100 100 PRO CG C 13 28.03 0.20 . 1 . . . . . . . . 5267 1 872 . 1 1 101 101 GLU H H 1 8.26 0.03 . 1 . . . . . . . . 5267 1 873 . 1 1 101 101 GLU HA H 1 4.18 0.03 . 1 . . . . . . . . 5267 1 874 . 1 1 101 101 GLU HB2 H 1 2.20 0.03 . 2 . . . . . . . . 5267 1 875 . 1 1 101 101 GLU HG2 H 1 2.38 0.03 . 2 . . . . . . . . 5267 1 876 . 1 1 101 101 GLU HG3 H 1 2.31 0.03 . 2 . . . . . . . . 5267 1 877 . 1 1 101 101 GLU C C 13 177.58 0.20 . 1 . . . . . . . . 5267 1 878 . 1 1 101 101 GLU CA C 13 59.39 0.20 . 1 . . . . . . . . 5267 1 879 . 1 1 101 101 GLU CB C 13 29.93 0.20 . 1 . . . . . . . . 5267 1 880 . 1 1 101 101 GLU CG C 13 37.35 0.20 . 1 . . . . . . . . 5267 1 881 . 1 1 101 101 GLU N N 15 115.74 0.15 . 1 . . . . . . . . 5267 1 882 . 1 1 102 102 LYS H H 1 7.32 0.03 . 1 . . . . . . . . 5267 1 883 . 1 1 102 102 LYS HA H 1 4.38 0.03 . 1 . . . . . . . . 5267 1 884 . 1 1 102 102 LYS HB2 H 1 2.02 0.03 . 2 . . . . . . . . 5267 1 885 . 1 1 102 102 LYS HB3 H 1 1.53 0.03 . 2 . . . . . . . . 5267 1 886 . 1 1 102 102 LYS HG2 H 1 1.53 0.03 . 2 . . . . . . . . 5267 1 887 . 1 1 102 102 LYS HG3 H 1 1.34 0.03 . 2 . . . . . . . . 5267 1 888 . 1 1 102 102 LYS HD2 H 1 1.72 0.03 . 2 . . . . . . . . 5267 1 889 . 1 1 102 102 LYS HE2 H 1 3.04 0.03 . 1 . . . . . . . . 5267 1 890 . 1 1 102 102 LYS C C 13 176.17 0.20 . 1 . . . . . . . . 5267 1 891 . 1 1 102 102 LYS CA C 13 56.10 0.20 . 1 . . . . . . . . 5267 1 892 . 1 1 102 102 LYS CB C 13 34.49 0.20 . 1 . . . . . . . . 5267 1 893 . 1 1 102 102 LYS CG C 13 26.06 0.20 . 1 . . . . . . . . 5267 1 894 . 1 1 102 102 LYS CD C 13 29.37 0.20 . 1 . . . . . . . . 5267 1 895 . 1 1 102 102 LYS CE C 13 42.38 0.20 . 1 . . . . . . . . 5267 1 896 . 1 1 102 102 LYS N N 15 114.57 0.15 . 1 . . . . . . . . 5267 1 897 . 1 1 103 103 GLY H H 1 7.84 0.03 . 1 . . . . . . . . 5267 1 898 . 1 1 103 103 GLY HA2 H 1 3.95 0.03 . 2 . . . . . . . . 5267 1 899 . 1 1 103 103 GLY HA3 H 1 2.38 0.03 . 2 . . . . . . . . 5267 1 900 . 1 1 103 103 GLY C C 13 171.57 0.20 . 1 . . . . . . . . 5267 1 901 . 1 1 103 103 GLY CA C 13 45.72 0.20 . 1 . . . . . . . . 5267 1 902 . 1 1 103 103 GLY N N 15 108.50 0.15 . 1 . . . . . . . . 5267 1 903 . 1 1 104 104 ILE H H 1 7.47 0.03 . 1 . . . . . . . . 5267 1 904 . 1 1 104 104 ILE HA H 1 4.83 0.03 . 1 . . . . . . . . 5267 1 905 . 1 1 104 104 ILE HB H 1 1.98 0.03 . 1 . . . . . . . . 5267 1 906 . 1 1 104 104 ILE HG12 H 1 1.47 0.03 . 1 . . . . . . . . 5267 1 907 . 1 1 104 104 ILE HG21 H 1 1.02 0.03 . 1 . . . . . . . . 5267 1 908 . 1 1 104 104 ILE HG22 H 1 1.02 0.03 . 1 . . . . . . . . 5267 1 909 . 1 1 104 104 ILE HG23 H 1 1.02 0.03 . 1 . . . . . . . . 5267 1 910 . 1 1 104 104 ILE HD11 H 1 1.02 0.03 . 1 . . . . . . . . 5267 1 911 . 1 1 104 104 ILE HD12 H 1 1.02 0.03 . 1 . . . . . . . . 5267 1 912 . 1 1 104 104 ILE HD13 H 1 1.02 0.03 . 1 . . . . . . . . 5267 1 913 . 1 1 104 104 ILE C C 13 176.30 0.20 . 1 . . . . . . . . 5267 1 914 . 1 1 104 104 ILE CA C 13 60.66 0.20 . 1 . . . . . . . . 5267 1 915 . 1 1 104 104 ILE CB C 13 29.68 0.20 . 1 . . . . . . . . 5267 1 916 . 1 1 104 104 ILE CG1 C 13 27.56 0.20 . 1 . . . . . . . . 5267 1 917 . 1 1 104 104 ILE CG2 C 13 18.32 0.20 . 1 . . . . . . . . 5267 1 918 . 1 1 104 104 ILE CD1 C 13 14.29 0.20 . 1 . . . . . . . . 5267 1 919 . 1 1 104 104 ILE N N 15 116.91 0.15 . 1 . . . . . . . . 5267 1 920 . 1 1 105 105 LEU H H 1 9.81 0.03 . 1 . . . . . . . . 5267 1 921 . 1 1 105 105 LEU HA H 1 5.24 0.03 . 1 . . . . . . . . 5267 1 922 . 1 1 105 105 LEU HB2 H 1 2.08 0.03 . 2 . . . . . . . . 5267 1 923 . 1 1 105 105 LEU HB3 H 1 1.49 0.03 . 2 . . . . . . . . 5267 1 924 . 1 1 105 105 LEU HG H 1 1.87 0.03 . 2 . . . . . . . . 5267 1 925 . 1 1 105 105 LEU HD11 H 1 0.66 0.03 . 2 . . . . . . . . 5267 1 926 . 1 1 105 105 LEU HD12 H 1 0.66 0.03 . 2 . . . . . . . . 5267 1 927 . 1 1 105 105 LEU HD13 H 1 0.66 0.03 . 2 . . . . . . . . 5267 1 928 . 1 1 105 105 LEU HD21 H 1 0.79 0.03 . 2 . . . . . . . . 5267 1 929 . 1 1 105 105 LEU HD22 H 1 0.79 0.03 . 2 . . . . . . . . 5267 1 930 . 1 1 105 105 LEU HD23 H 1 0.79 0.03 . 2 . . . . . . . . 5267 1 931 . 1 1 105 105 LEU C C 13 174.31 0.20 . 1 . . . . . . . . 5267 1 932 . 1 1 105 105 LEU CA C 13 53.48 0.20 . 1 . . . . . . . . 5267 1 933 . 1 1 105 105 LEU CB C 13 44.03 0.20 . 1 . . . . . . . . 5267 1 934 . 1 1 105 105 LEU CG C 13 27.06 0.20 . 1 . . . . . . . . 5267 1 935 . 1 1 105 105 LEU CD1 C 13 27.06 0.20 . 1 . . . . . . . . 5267 1 936 . 1 1 105 105 LEU CD2 C 13 24.71 0.20 . 1 . . . . . . . . 5267 1 937 . 1 1 105 105 LEU N N 15 127.89 0.15 . 1 . . . . . . . . 5267 1 938 . 1 1 106 106 ASN H H 1 8.91 0.03 . 1 . . . . . . . . 5267 1 939 . 1 1 106 106 ASN HA H 1 5.94 0.03 . 1 . . . . . . . . 5267 1 940 . 1 1 106 106 ASN HB2 H 1 2.87 0.03 . 2 . . . . . . . . 5267 1 941 . 1 1 106 106 ASN HB3 H 1 2.72 0.03 . 2 . . . . . . . . 5267 1 942 . 1 1 106 106 ASN C C 13 172.22 0.20 . 1 . . . . . . . . 5267 1 943 . 1 1 106 106 ASN CA C 13 53.57 0.20 . 1 . . . . . . . . 5267 1 944 . 1 1 106 106 ASN CB C 13 41.50 0.20 . 1 . . . . . . . . 5267 1 945 . 1 1 106 106 ASN N N 15 121.81 0.15 . 1 . . . . . . . . 5267 1 946 . 1 1 107 107 PHE H H 1 8.02 0.03 . 1 . . . . . . . . 5267 1 947 . 1 1 107 107 PHE HA H 1 5.66 0.03 . 1 . . . . . . . . 5267 1 948 . 1 1 107 107 PHE HB2 H 1 3.48 0.03 . 2 . . . . . . . . 5267 1 949 . 1 1 107 107 PHE HB3 H 1 3.35 0.03 . 2 . . . . . . . . 5267 1 950 . 1 1 107 107 PHE HD1 H 1 7.18 0.03 . 3 . . . . . . . . 5267 1 951 . 1 1 107 107 PHE C C 13 172.47 0.20 . 1 . . . . . . . . 5267 1 952 . 1 1 107 107 PHE CA C 13 55.85 0.20 . 1 . . . . . . . . 5267 1 953 . 1 1 107 107 PHE CB C 13 40.06 0.20 . 1 . . . . . . . . 5267 1 954 . 1 1 107 107 PHE N N 15 119.00 0.20 . 1 . . . . . . . . 5267 1 955 . 1 1 108 108 ALA H H 1 9.52 0.03 . 1 . . . . . . . . 5267 1 956 . 1 1 108 108 ALA HA H 1 4.88 0.03 . 1 . . . . . . . . 5267 1 957 . 1 1 108 108 ALA HB1 H 1 1.41 0.03 . 1 . . . . . . . . 5267 1 958 . 1 1 108 108 ALA HB2 H 1 1.41 0.03 . 1 . . . . . . . . 5267 1 959 . 1 1 108 108 ALA HB3 H 1 1.41 0.03 . 1 . . . . . . . . 5267 1 960 . 1 1 108 108 ALA C C 13 173.76 0.20 . 1 . . . . . . . . 5267 1 961 . 1 1 108 108 ALA CA C 13 51.71 0.20 . 1 . . . . . . . . 5267 1 962 . 1 1 108 108 ALA CB C 13 24.36 0.20 . 1 . . . . . . . . 5267 1 963 . 1 1 108 108 ALA N N 15 122.28 0.15 . 1 . . . . . . . . 5267 1 964 . 1 1 109 109 LEU H H 1 7.32 0.03 . 1 . . . . . . . . 5267 1 965 . 1 1 109 109 LEU HA H 1 5.18 0.03 . 1 . . . . . . . . 5267 1 966 . 1 1 109 109 LEU HB2 H 1 1.63 0.03 . 2 . . . . . . . . 5267 1 967 . 1 1 109 109 LEU HB3 H 1 1.37 0.03 . 2 . . . . . . . . 5267 1 968 . 1 1 109 109 LEU HG H 1 1.37 0.03 . 2 . . . . . . . . 5267 1 969 . 1 1 109 109 LEU HD11 H 1 0.98 0.03 . 2 . . . . . . . . 5267 1 970 . 1 1 109 109 LEU HD12 H 1 0.98 0.03 . 2 . . . . . . . . 5267 1 971 . 1 1 109 109 LEU HD13 H 1 0.98 0.03 . 2 . . . . . . . . 5267 1 972 . 1 1 109 109 LEU HD21 H 1 0.71 0.03 . 2 . . . . . . . . 5267 1 973 . 1 1 109 109 LEU HD22 H 1 0.71 0.03 . 2 . . . . . . . . 5267 1 974 . 1 1 109 109 LEU HD23 H 1 0.71 0.03 . 2 . . . . . . . . 5267 1 975 . 1 1 109 109 LEU C C 13 173.21 0.20 . 1 . . . . . . . . 5267 1 976 . 1 1 109 109 LEU CA C 13 54.24 0.20 . 1 . . . . . . . . 5267 1 977 . 1 1 109 109 LEU CB C 13 47.24 0.20 . 1 . . . . . . . . 5267 1 978 . 1 1 109 109 LEU CG C 13 27.71 0.20 . 1 . . . . . . . . 5267 1 979 . 1 1 109 109 LEU CD1 C 13 27.71 0.20 . 1 . . . . . . . . 5267 1 980 . 1 1 109 109 LEU CD2 C 13 24.71 0.20 . 1 . . . . . . . . 5267 1 981 . 1 1 109 109 LEU N N 15 120.64 0.15 . 1 . . . . . . . . 5267 1 982 . 1 1 110 110 ALA H H 1 7.74 0.03 . 1 . . . . . . . . 5267 1 983 . 1 1 110 110 ALA HA H 1 4.78 0.03 . 1 . . . . . . . . 5267 1 984 . 1 1 110 110 ALA HB1 H 1 1.29 0.03 . 1 . . . . . . . . 5267 1 985 . 1 1 110 110 ALA HB2 H 1 1.29 0.03 . 1 . . . . . . . . 5267 1 986 . 1 1 110 110 ALA HB3 H 1 1.29 0.03 . 1 . . . . . . . . 5267 1 987 . 1 1 110 110 ALA C C 13 177.28 0.20 . 1 . . . . . . . . 5267 1 988 . 1 1 110 110 ALA CA C 13 51.54 0.20 . 1 . . . . . . . . 5267 1 989 . 1 1 110 110 ALA CB C 13 23.18 0.20 . 1 . . . . . . . . 5267 1 990 . 1 1 110 110 ALA N N 15 123.45 0.15 . 1 . . . . . . . . 5267 1 991 . 1 1 111 111 TYR H H 1 7.61 0.03 . 1 . . . . . . . . 5267 1 992 . 1 1 111 111 TYR HA H 1 4.62 0.03 . 1 . . . . . . . . 5267 1 993 . 1 1 111 111 TYR HB2 H 1 3.07 0.03 . 2 . . . . . . . . 5267 1 994 . 1 1 111 111 TYR HB3 H 1 2.58 0.03 . 2 . . . . . . . . 5267 1 995 . 1 1 111 111 TYR HD1 H 1 7.60 0.03 . 3 . . . . . . . . 5267 1 996 . 1 1 111 111 TYR C C 13 173.43 0.20 . 1 . . . . . . . . 5267 1 997 . 1 1 111 111 TYR CA C 13 55.51 0.20 . 1 . . . . . . . . 5267 1 998 . 1 1 111 111 TYR CB C 13 38.21 0.20 . 1 . . . . . . . . 5267 1 999 . 1 1 111 111 TYR N N 15 117.14 0.15 . 1 . . . . . . . . 5267 1 1000 . 1 1 112 112 SER H H 1 8.39 0.03 . 1 . . . . . . . . 5267 1 1001 . 1 1 112 112 SER HA H 1 4.52 0.03 . 1 . . . . . . . . 5267 1 1002 . 1 1 112 112 SER HB2 H 1 3.98 0.03 . 2 . . . . . . . . 5267 1 1003 . 1 1 112 112 SER HB3 H 1 3.92 0.03 . 2 . . . . . . . . 5267 1 1004 . 1 1 112 112 SER C C 13 175.96 0.20 . 1 . . . . . . . . 5267 1 1005 . 1 1 112 112 SER CA C 13 60.07 0.20 . 1 . . . . . . . . 5267 1 1006 . 1 1 112 112 SER CB C 13 64.71 0.20 . 1 . . . . . . . . 5267 1 1007 . 1 1 112 112 SER N N 15 116.21 0.15 . 1 . . . . . . . . 5267 1 1008 . 1 1 113 113 TYR H H 1 8.31 0.03 . 1 . . . . . . . . 5267 1 1009 . 1 1 113 113 TYR HA H 1 5.43 0.03 . 1 . . . . . . . . 5267 1 1010 . 1 1 113 113 TYR HB2 H 1 3.24 0.03 . 2 . . . . . . . . 5267 1 1011 . 1 1 113 113 TYR HB3 H 1 2.99 0.03 . 2 . . . . . . . . 5267 1 1012 . 1 1 113 113 TYR HD1 H 1 7.41 0.03 . 3 . . . . . . . . 5267 1 1013 . 1 1 113 113 TYR C C 13 175.92 0.20 . 1 . . . . . . . . 5267 1 1014 . 1 1 113 113 TYR CA C 13 54.08 0.20 . 1 . . . . . . . . 5267 1 1015 . 1 1 113 113 TYR CB C 13 36.18 0.20 . 1 . . . . . . . . 5267 1 1016 . 1 1 113 113 TYR N N 15 125.55 0.15 . 1 . . . . . . . . 5267 1 1017 . 1 1 114 114 ILE H H 1 7.41 0.03 . 1 . . . . . . . . 5267 1 1018 . 1 1 114 114 ILE HA H 1 4.03 0.03 . 1 . . . . . . . . 5267 1 1019 . 1 1 114 114 ILE HB H 1 2.31 0.03 . 1 . . . . . . . . 5267 1 1020 . 1 1 114 114 ILE HG12 H 1 1.58 0.03 . 2 . . . . . . . . 5267 1 1021 . 1 1 114 114 ILE HG13 H 1 1.25 0.03 . 2 . . . . . . . . 5267 1 1022 . 1 1 114 114 ILE HG21 H 1 1.14 0.03 . 1 . . . . . . . . 5267 1 1023 . 1 1 114 114 ILE HG22 H 1 1.14 0.03 . 1 . . . . . . . . 5267 1 1024 . 1 1 114 114 ILE HG23 H 1 1.14 0.03 . 1 . . . . . . . . 5267 1 1025 . 1 1 114 114 ILE HD11 H 1 0.92 0.03 . 1 . . . . . . . . 5267 1 1026 . 1 1 114 114 ILE HD12 H 1 0.92 0.03 . 1 . . . . . . . . 5267 1 1027 . 1 1 114 114 ILE HD13 H 1 0.92 0.03 . 1 . . . . . . . . 5267 1 1028 . 1 1 114 114 ILE C C 13 176.97 0.20 . 1 . . . . . . . . 5267 1 1029 . 1 1 114 114 ILE CA C 13 64.96 0.20 . 1 . . . . . . . . 5267 1 1030 . 1 1 114 114 ILE CB C 13 37.78 0.20 . 1 . . . . . . . . 5267 1 1031 . 1 1 114 114 ILE CG1 C 13 26.52 0.20 . 1 . . . . . . . . 5267 1 1032 . 1 1 114 114 ILE CG2 C 13 20.37 0.20 . 1 . . . . . . . . 5267 1 1033 . 1 1 114 114 ILE CD1 C 13 13.67 0.20 . 1 . . . . . . . . 5267 1 1034 . 1 1 114 114 ILE N N 15 115.97 0.15 . 1 . . . . . . . . 5267 1 1035 . 1 1 115 115 ALA H H 1 8.54 0.03 . 1 . . . . . . . . 5267 1 1036 . 1 1 115 115 ALA HA H 1 3.99 0.03 . 1 . . . . . . . . 5267 1 1037 . 1 1 115 115 ALA HB1 H 1 1.36 0.03 . 1 . . . . . . . . 5267 1 1038 . 1 1 115 115 ALA HB2 H 1 1.36 0.03 . 1 . . . . . . . . 5267 1 1039 . 1 1 115 115 ALA HB3 H 1 1.36 0.03 . 1 . . . . . . . . 5267 1 1040 . 1 1 115 115 ALA C C 13 180.16 0.20 . 1 . . . . . . . . 5267 1 1041 . 1 1 115 115 ALA CA C 13 55.51 0.20 . 1 . . . . . . . . 5267 1 1042 . 1 1 115 115 ALA CB C 13 18.20 0.20 . 1 . . . . . . . . 5267 1 1043 . 1 1 115 115 ALA N N 15 122.51 0.15 . 1 . . . . . . . . 5267 1 1044 . 1 1 116 116 GLY H H 1 6.51 0.03 . 1 . . . . . . . . 5267 1 1045 . 1 1 116 116 GLY HA2 H 1 3.73 0.03 . 2 . . . . . . . . 5267 1 1046 . 1 1 116 116 GLY HA3 H 1 3.33 0.03 . 2 . . . . . . . . 5267 1 1047 . 1 1 116 116 GLY C C 13 174.45 0.20 . 1 . . . . . . . . 5267 1 1048 . 1 1 116 116 GLY CA C 13 47.15 0.20 . 1 . . . . . . . . 5267 1 1049 . 1 1 116 116 GLY N N 15 103.13 0.15 . 1 . . . . . . . . 5267 1 1050 . 1 1 117 117 TYR H H 1 6.69 0.03 . 1 . . . . . . . . 5267 1 1051 . 1 1 117 117 TYR HA H 1 4.01 0.03 . 1 . . . . . . . . 5267 1 1052 . 1 1 117 117 TYR HB2 H 1 2.87 0.03 . 2 . . . . . . . . 5267 1 1053 . 1 1 117 117 TYR HB3 H 1 2.20 0.03 . 2 . . . . . . . . 5267 1 1054 . 1 1 117 117 TYR C C 13 176.47 0.20 . 1 . . . . . . . . 5267 1 1055 . 1 1 117 117 TYR CA C 13 58.04 0.20 . 1 . . . . . . . . 5267 1 1056 . 1 1 117 117 TYR CB C 13 38.40 0.20 . 1 . . . . . . . . 5267 1 1057 . 1 1 117 117 TYR N N 15 123.45 0.15 . 1 . . . . . . . . 5267 1 1058 . 1 1 118 118 LYS H H 1 8.21 0.03 . 1 . . . . . . . . 5267 1 1059 . 1 1 118 118 LYS HA H 1 4.00 0.03 . 1 . . . . . . . . 5267 1 1060 . 1 1 118 118 LYS HB2 H 1 1.99 0.03 . 2 . . . . . . . . 5267 1 1061 . 1 1 118 118 LYS HG2 H 1 1.22 0.03 . 2 . . . . . . . . 5267 1 1062 . 1 1 118 118 LYS C C 13 178.40 0.20 . 1 . . . . . . . . 5267 1 1063 . 1 1 118 118 LYS CA C 13 58.89 0.20 . 1 . . . . . . . . 5267 1 1064 . 1 1 118 118 LYS CB C 13 32.21 0.20 . 1 . . . . . . . . 5267 1 1065 . 1 1 118 118 LYS CG C 13 24.56 0.20 . 1 . . . . . . . . 5267 1 1066 . 1 1 118 118 LYS N N 15 119.48 0.15 . 1 . . . . . . . . 5267 1 1067 . 1 1 119 119 GLU H H 1 7.47 0.03 . 1 . . . . . . . . 5267 1 1068 . 1 1 119 119 GLU HA H 1 3.70 0.03 . 1 . . . . . . . . 5267 1 1069 . 1 1 119 119 GLU HB2 H 1 2.01 0.03 . 2 . . . . . . . . 5267 1 1070 . 1 1 119 119 GLU HB3 H 1 1.98 0.03 . 2 . . . . . . . . 5267 1 1071 . 1 1 119 119 GLU HG2 H 1 2.25 0.03 . 2 . . . . . . . . 5267 1 1072 . 1 1 119 119 GLU C C 13 178.09 0.20 . 1 . . . . . . . . 5267 1 1073 . 1 1 119 119 GLU CA C 13 59.06 0.20 . 1 . . . . . . . . 5267 1 1074 . 1 1 119 119 GLU CB C 13 29.68 0.20 . 1 . . . . . . . . 5267 1 1075 . 1 1 119 119 GLU CG C 13 36.48 0.20 . 1 . . . . . . . . 5267 1 1076 . 1 1 119 119 GLU N N 15 116.91 0.15 . 1 . . . . . . . . 5267 1 1077 . 1 1 120 120 THR H H 1 7.43 0.03 . 1 . . . . . . . . 5267 1 1078 . 1 1 120 120 THR HA H 1 4.11 0.03 . 1 . . . . . . . . 5267 1 1079 . 1 1 120 120 THR HB H 1 4.38 0.03 . 1 . . . . . . . . 5267 1 1080 . 1 1 120 120 THR HG21 H 1 1.56 0.03 . 1 . . . . . . . . 5267 1 1081 . 1 1 120 120 THR HG22 H 1 1.56 0.03 . 1 . . . . . . . . 5267 1 1082 . 1 1 120 120 THR HG23 H 1 1.56 0.03 . 1 . . . . . . . . 5267 1 1083 . 1 1 120 120 THR C C 13 176.73 0.20 . 1 . . . . . . . . 5267 1 1084 . 1 1 120 120 THR CA C 13 65.22 0.20 . 1 . . . . . . . . 5267 1 1085 . 1 1 120 120 THR CB C 13 70.11 0.20 . 1 . . . . . . . . 5267 1 1086 . 1 1 120 120 THR CG2 C 13 22.26 0.20 . 1 . . . . . . . . 5267 1 1087 . 1 1 120 120 THR N N 15 109.90 0.15 . 1 . . . . . . . . 5267 1 1088 . 1 1 121 121 GLY H H 1 7.26 0.03 . 1 . . . . . . . . 5267 1 1089 . 1 1 121 121 GLY HA2 H 1 4.09 0.03 . 2 . . . . . . . . 5267 1 1090 . 1 1 121 121 GLY HA3 H 1 3.78 0.03 . 2 . . . . . . . . 5267 1 1091 . 1 1 121 121 GLY C C 13 173.40 0.20 . 1 . . . . . . . . 5267 1 1092 . 1 1 121 121 GLY CA C 13 46.82 0.20 . 1 . . . . . . . . 5267 1 1093 . 1 1 121 121 GLY N N 15 105.93 0.15 . 1 . . . . . . . . 5267 1 1094 . 1 1 122 122 VAL H H 1 8.12 0.03 . 1 . . . . . . . . 5267 1 1095 . 1 1 122 122 VAL HA H 1 4.42 0.03 . 1 . . . . . . . . 5267 1 1096 . 1 1 122 122 VAL HB H 1 2.14 0.03 . 1 . . . . . . . . 5267 1 1097 . 1 1 122 122 VAL HG11 H 1 1.03 0.03 . 2 . . . . . . . . 5267 1 1098 . 1 1 122 122 VAL HG12 H 1 1.03 0.03 . 2 . . . . . . . . 5267 1 1099 . 1 1 122 122 VAL HG13 H 1 1.03 0.03 . 2 . . . . . . . . 5267 1 1100 . 1 1 122 122 VAL HG21 H 1 1.00 0.03 . 2 . . . . . . . . 5267 1 1101 . 1 1 122 122 VAL HG22 H 1 1.00 0.03 . 2 . . . . . . . . 5267 1 1102 . 1 1 122 122 VAL HG23 H 1 1.00 0.03 . 2 . . . . . . . . 5267 1 1103 . 1 1 122 122 VAL C C 13 173.65 0.20 . 1 . . . . . . . . 5267 1 1104 . 1 1 122 122 VAL CA C 13 62.09 0.20 . 1 . . . . . . . . 5267 1 1105 . 1 1 122 122 VAL CB C 13 33.48 0.20 . 1 . . . . . . . . 5267 1 1106 . 1 1 122 122 VAL CG1 C 13 21.71 0.20 . 1 . . . . . . . . 5267 1 1107 . 1 1 122 122 VAL CG2 C 13 21.16 0.20 . 1 . . . . . . . . 5267 1 1108 . 1 1 122 122 VAL N N 15 121.58 0.15 . 1 . . . . . . . . 5267 1 1109 . 1 1 123 123 ALA H H 1 8.70 0.03 . 1 . . . . . . . . 5267 1 1110 . 1 1 123 123 ALA HA H 1 4.63 0.03 . 1 . . . . . . . . 5267 1 1111 . 1 1 123 123 ALA HB1 H 1 1.04 0.03 . 1 . . . . . . . . 5267 1 1112 . 1 1 123 123 ALA HB2 H 1 1.04 0.03 . 1 . . . . . . . . 5267 1 1113 . 1 1 123 123 ALA HB3 H 1 1.04 0.03 . 1 . . . . . . . . 5267 1 1114 . 1 1 123 123 ALA CA C 13 51.80 0.20 . 1 . . . . . . . . 5267 1 1115 . 1 1 123 123 ALA CB C 13 20.48 0.20 . 1 . . . . . . . . 5267 1 1116 . 1 1 123 123 ALA N N 15 128.35 0.15 . 1 . . . . . . . . 5267 1 1117 . 1 1 124 124 GLU H H 1 8.56 0.03 . 1 . . . . . . . . 5267 1 1118 . 1 1 124 124 GLU HA H 1 4.62 0.03 . 1 . . . . . . . . 5267 1 1119 . 1 1 124 124 GLU HB2 H 1 2.48 0.03 . 2 . . . . . . . . 5267 1 1120 . 1 1 124 124 GLU HG2 H 1 2.82 0.03 . 2 . . . . . . . . 5267 1 1121 . 1 1 124 124 GLU C C 13 173.76 0.20 . 1 . . . . . . . . 5267 1 1122 . 1 1 124 124 GLU CA C 13 55.93 0.20 . 1 . . . . . . . . 5267 1 1123 . 1 1 124 124 GLU CB C 13 29.34 0.20 . 1 . . . . . . . . 5267 1 1124 . 1 1 124 124 GLU CG C 13 36.95 0.20 . 1 . . . . . . . . 5267 1 1125 . 1 1 124 124 GLU N N 15 123.68 0.15 . 1 . . . . . . . . 5267 1 1126 . 1 1 125 125 GLU H H 1 7.42 0.03 . 1 . . . . . . . . 5267 1 1127 . 1 1 125 125 GLU HA H 1 4.56 0.03 . 1 . . . . . . . . 5267 1 1128 . 1 1 125 125 GLU HB2 H 1 1.81 0.03 . 2 . . . . . . . . 5267 1 1129 . 1 1 125 125 GLU HG2 H 1 2.23 0.03 . 2 . . . . . . . . 5267 1 1130 . 1 1 125 125 GLU C C 13 175.81 0.20 . 1 . . . . . . . . 5267 1 1131 . 1 1 125 125 GLU CA C 13 57.54 0.20 . 1 . . . . . . . . 5267 1 1132 . 1 1 125 125 GLU CB C 13 32.63 0.20 . 1 . . . . . . . . 5267 1 1133 . 1 1 125 125 GLU CG C 13 38.22 0.20 . 1 . . . . . . . . 5267 1 1134 . 1 1 125 125 GLU N N 15 115.04 0.15 . 1 . . . . . . . . 5267 1 1135 . 1 1 126 126 SER H H 1 7.28 0.03 . 1 . . . . . . . . 5267 1 1136 . 1 1 126 126 SER HA H 1 4.85 0.03 . 1 . . . . . . . . 5267 1 1137 . 1 1 126 126 SER HB2 H 1 3.98 0.03 . 2 . . . . . . . . 5267 1 1138 . 1 1 126 126 SER HB3 H 1 3.63 0.03 . 2 . . . . . . . . 5267 1 1139 . 1 1 126 126 SER C C 13 171.89 0.20 . 1 . . . . . . . . 5267 1 1140 . 1 1 126 126 SER CA C 13 56.86 0.20 . 1 . . . . . . . . 5267 1 1141 . 1 1 126 126 SER CB C 13 67.75 0.20 . 1 . . . . . . . . 5267 1 1142 . 1 1 126 126 SER N N 15 107.56 0.15 . 1 . . . . . . . . 5267 1 1143 . 1 1 127 127 GLY H H 1 8.33 0.03 . 1 . . . . . . . . 5267 1 1144 . 1 1 127 127 GLY HA2 H 1 4.24 0.03 . 2 . . . . . . . . 5267 1 1145 . 1 1 127 127 GLY HA3 H 1 3.90 0.03 . 2 . . . . . . . . 5267 1 1146 . 1 1 127 127 GLY C C 13 170.41 0.20 . 1 . . . . . . . . 5267 1 1147 . 1 1 127 127 GLY CA C 13 44.96 0.20 . 1 . . . . . . . . 5267 1 1148 . 1 1 127 127 GLY N N 15 107.80 0.20 . 1 . . . . . . . . 5267 1 1149 . 1 1 128 128 ILE H H 1 7.98 0.03 . 1 . . . . . . . . 5267 1 1150 . 1 1 128 128 ILE HA H 1 4.21 0.03 . 1 . . . . . . . . 5267 1 1151 . 1 1 128 128 ILE HB H 1 1.92 0.03 . 1 . . . . . . . . 5267 1 1152 . 1 1 128 128 ILE HG12 H 1 1.71 0.03 . 1 . . . . . . . . 5267 1 1153 . 1 1 128 128 ILE HG21 H 1 0.80 0.03 . 1 . . . . . . . . 5267 1 1154 . 1 1 128 128 ILE HG22 H 1 0.80 0.03 . 1 . . . . . . . . 5267 1 1155 . 1 1 128 128 ILE HG23 H 1 0.80 0.03 . 1 . . . . . . . . 5267 1 1156 . 1 1 128 128 ILE HD11 H 1 0.87 0.03 . 1 . . . . . . . . 5267 1 1157 . 1 1 128 128 ILE HD12 H 1 0.87 0.03 . 1 . . . . . . . . 5267 1 1158 . 1 1 128 128 ILE HD13 H 1 0.87 0.03 . 1 . . . . . . . . 5267 1 1159 . 1 1 128 128 ILE C C 13 176.71 0.20 . 1 . . . . . . . . 5267 1 1160 . 1 1 128 128 ILE CA C 13 61.92 0.20 . 1 . . . . . . . . 5267 1 1161 . 1 1 128 128 ILE CB C 13 39.98 0.20 . 1 . . . . . . . . 5267 1 1162 . 1 1 128 128 ILE CG1 C 13 28.30 0.20 . 1 . . . . . . . . 5267 1 1163 . 1 1 128 128 ILE CG2 C 13 19.18 0.20 . 1 . . . . . . . . 5267 1 1164 . 1 1 128 128 ILE CD1 C 13 14.13 0.20 . 1 . . . . . . . . 5267 1 1165 . 1 1 128 128 ILE N N 15 118.31 0.15 . 1 . . . . . . . . 5267 1 1166 . 1 1 129 129 ILE H H 1 8.96 0.03 . 1 . . . . . . . . 5267 1 1167 . 1 1 129 129 ILE HA H 1 4.56 0.03 . 1 . . . . . . . . 5267 1 1168 . 1 1 129 129 ILE HB H 1 1.86 0.03 . 1 . . . . . . . . 5267 1 1169 . 1 1 129 129 ILE HG12 H 1 1.15 0.03 . 1 . . . . . . . . 5267 1 1170 . 1 1 129 129 ILE HG21 H 1 0.86 0.03 . 1 . . . . . . . . 5267 1 1171 . 1 1 129 129 ILE HG22 H 1 0.86 0.03 . 1 . . . . . . . . 5267 1 1172 . 1 1 129 129 ILE HG23 H 1 0.86 0.03 . 1 . . . . . . . . 5267 1 1173 . 1 1 129 129 ILE HD11 H 1 0.60 0.03 . 1 . . . . . . . . 5267 1 1174 . 1 1 129 129 ILE HD12 H 1 0.60 0.03 . 1 . . . . . . . . 5267 1 1175 . 1 1 129 129 ILE HD13 H 1 0.60 0.03 . 1 . . . . . . . . 5267 1 1176 . 1 1 129 129 ILE C C 13 173.35 0.20 . 1 . . . . . . . . 5267 1 1177 . 1 1 129 129 ILE CA C 13 61.76 0.20 . 1 . . . . . . . . 5267 1 1178 . 1 1 129 129 ILE CB C 13 38.17 0.20 . 1 . . . . . . . . 5267 1 1179 . 1 1 129 129 ILE CG2 C 13 18.40 0.20 . 1 . . . . . . . . 5267 1 1180 . 1 1 129 129 ILE N N 15 118.78 0.15 . 1 . . . . . . . . 5267 1 1181 . 1 1 130 130 ALA H H 1 7.40 0.03 . 1 . . . . . . . . 5267 1 1182 . 1 1 130 130 ALA HA H 1 4.21 0.03 . 1 . . . . . . . . 5267 1 1183 . 1 1 130 130 ALA HB1 H 1 1.23 0.03 . 1 . . . . . . . . 5267 1 1184 . 1 1 130 130 ALA HB2 H 1 1.23 0.03 . 1 . . . . . . . . 5267 1 1185 . 1 1 130 130 ALA HB3 H 1 1.23 0.03 . 1 . . . . . . . . 5267 1 1186 . 1 1 130 130 ALA C C 13 173.94 0.20 . 1 . . . . . . . . 5267 1 1187 . 1 1 130 130 ALA CA C 13 53.32 0.20 . 1 . . . . . . . . 5267 1 1188 . 1 1 130 130 ALA CB C 13 23.60 0.20 . 1 . . . . . . . . 5267 1 1189 . 1 1 130 130 ALA N N 15 118.31 0.15 . 1 . . . . . . . . 5267 1 1190 . 1 1 131 131 LYS H H 1 8.38 0.03 . 1 . . . . . . . . 5267 1 1191 . 1 1 131 131 LYS HA H 1 5.07 0.03 . 1 . . . . . . . . 5267 1 1192 . 1 1 131 131 LYS C C 13 173.10 0.20 . 1 . . . . . . . . 5267 1 1193 . 1 1 131 131 LYS CA C 13 55.34 0.20 . 1 . . . . . . . . 5267 1 1194 . 1 1 131 131 LYS CB C 13 35.95 0.20 . 1 . . . . . . . . 5267 1 1195 . 1 1 131 131 LYS CG C 13 25.98 0.20 . 1 . . . . . . . . 5267 1 1196 . 1 1 131 131 LYS CD C 13 30.08 0.20 . 1 . . . . . . . . 5267 1 1197 . 1 1 131 131 LYS N N 15 119.71 0.15 . 1 . . . . . . . . 5267 1 1198 . 1 1 132 132 ILE H H 1 8.80 0.03 . 1 . . . . . . . . 5267 1 1199 . 1 1 132 132 ILE HA H 1 3.92 0.03 . 1 . . . . . . . . 5267 1 1200 . 1 1 132 132 ILE HB H 1 1.19 0.03 . 1 . . . . . . . . 5267 1 1201 . 1 1 132 132 ILE HG12 H 1 1.25 0.03 . 2 . . . . . . . . 5267 1 1202 . 1 1 132 132 ILE HG13 H 1 0.60 0.03 . 2 . . . . . . . . 5267 1 1203 . 1 1 132 132 ILE HG21 H 1 0.13 0.03 . 1 . . . . . . . . 5267 1 1204 . 1 1 132 132 ILE HG22 H 1 0.13 0.03 . 1 . . . . . . . . 5267 1 1205 . 1 1 132 132 ILE HG23 H 1 0.13 0.03 . 1 . . . . . . . . 5267 1 1206 . 1 1 132 132 ILE HD11 H 1 0.54 0.03 . 1 . . . . . . . . 5267 1 1207 . 1 1 132 132 ILE HD12 H 1 0.54 0.03 . 1 . . . . . . . . 5267 1 1208 . 1 1 132 132 ILE HD13 H 1 0.54 0.03 . 1 . . . . . . . . 5267 1 1209 . 1 1 132 132 ILE C C 13 174.63 0.20 . 1 . . . . . . . . 5267 1 1210 . 1 1 132 132 ILE CA C 13 60.83 0.20 . 1 . . . . . . . . 5267 1 1211 . 1 1 132 132 ILE CB C 13 42.77 0.20 . 1 . . . . . . . . 5267 1 1212 . 1 1 132 132 ILE CG1 C 13 28.42 0.20 . 1 . . . . . . . . 5267 1 1213 . 1 1 132 132 ILE CG2 C 13 19.13 0.20 . 1 . . . . . . . . 5267 1 1214 . 1 1 132 132 ILE CD1 C 13 15.31 0.20 . 1 . . . . . . . . 5267 1 1215 . 1 1 132 132 ILE N N 15 118.31 0.15 . 1 . . . . . . . . 5267 1 1216 . 1 1 133 133 GLY H H 1 7.73 0.03 . 1 . . . . . . . . 5267 1 1217 . 1 1 133 133 GLY HA2 H 1 4.89 0.03 . 2 . . . . . . . . 5267 1 1218 . 1 1 133 133 GLY HA3 H 1 2.87 0.03 . 2 . . . . . . . . 5267 1 1219 . 1 1 133 133 GLY C C 13 171.25 0.20 . 1 . . . . . . . . 5267 1 1220 . 1 1 133 133 GLY CA C 13 44.37 0.20 . 1 . . . . . . . . 5267 1 1221 . 1 1 133 133 GLY N N 15 112.47 0.15 . 1 . . . . . . . . 5267 1 1222 . 1 1 134 134 PHE H H 1 9.55 0.03 . 1 . . . . . . . . 5267 1 1223 . 1 1 134 134 PHE HA H 1 4.97 0.03 . 1 . . . . . . . . 5267 1 1224 . 1 1 134 134 PHE HB2 H 1 2.86 0.03 . 2 . . . . . . . . 5267 1 1225 . 1 1 134 134 PHE HB3 H 1 2.67 0.03 . 2 . . . . . . . . 5267 1 1226 . 1 1 134 134 PHE HD1 H 1 6.73 0.03 . 3 . . . . . . . . 5267 1 1227 . 1 1 134 134 PHE C C 13 173.61 0.20 . 1 . . . . . . . . 5267 1 1228 . 1 1 134 134 PHE CA C 13 57.03 0.20 . 1 . . . . . . . . 5267 1 1229 . 1 1 134 134 PHE CB C 13 41.75 0.20 . 1 . . . . . . . . 5267 1 1230 . 1 1 134 134 PHE N N 15 121.35 0.15 . 1 . . . . . . . . 5267 1 1231 . 1 1 135 135 LYS H H 1 9.62 0.03 . 1 . . . . . . . . 5267 1 1232 . 1 1 135 135 LYS C C 13 175.95 0.20 . 1 . . . . . . . . 5267 1 1233 . 1 1 135 135 LYS CA C 13 55.34 0.20 . 1 . . . . . . . . 5267 1 1234 . 1 1 135 135 LYS CB C 13 35.08 0.20 . 1 . . . . . . . . 5267 1 1235 . 1 1 135 135 LYS CG C 13 24.95 0.20 . 1 . . . . . . . . 5267 1 1236 . 1 1 135 135 LYS N N 15 125.78 0.15 . 1 . . . . . . . . 5267 1 1237 . 1 1 136 136 ILE H H 1 8.72 0.03 . 1 . . . . . . . . 5267 1 1238 . 1 1 136 136 ILE HA H 1 3.95 0.03 . 1 . . . . . . . . 5267 1 1239 . 1 1 136 136 ILE HB H 1 1.96 0.03 . 1 . . . . . . . . 5267 1 1240 . 1 1 136 136 ILE HG12 H 1 1.70 0.03 . 2 . . . . . . . . 5267 1 1241 . 1 1 136 136 ILE HG21 H 1 0.64 0.03 . 1 . . . . . . . . 5267 1 1242 . 1 1 136 136 ILE HG22 H 1 0.64 0.03 . 1 . . . . . . . . 5267 1 1243 . 1 1 136 136 ILE HG23 H 1 0.64 0.03 . 1 . . . . . . . . 5267 1 1244 . 1 1 136 136 ILE HD11 H 1 0.64 0.03 . 1 . . . . . . . . 5267 1 1245 . 1 1 136 136 ILE HD12 H 1 0.64 0.03 . 1 . . . . . . . . 5267 1 1246 . 1 1 136 136 ILE HD13 H 1 0.64 0.03 . 1 . . . . . . . . 5267 1 1247 . 1 1 136 136 ILE C C 13 176.56 0.20 . 1 . . . . . . . . 5267 1 1248 . 1 1 136 136 ILE CA C 13 63.78 0.20 . 1 . . . . . . . . 5267 1 1249 . 1 1 136 136 ILE CB C 13 38.37 0.20 . 1 . . . . . . . . 5267 1 1250 . 1 1 136 136 ILE CG1 C 13 28.57 0.20 . 1 . . . . . . . . 5267 1 1251 . 1 1 136 136 ILE CG2 C 13 18.16 0.20 . 1 . . . . . . . . 5267 1 1252 . 1 1 136 136 ILE CD1 C 13 13.80 0.20 . 1 . . . . . . . . 5267 1 1253 . 1 1 136 136 ILE N N 15 126.01 0.15 . 1 . . . . . . . . 5267 1 1254 . 1 1 137 137 LEU H H 1 9.54 0.03 . 1 . . . . . . . . 5267 1 1255 . 1 1 137 137 LEU HA H 1 4.48 0.03 . 1 . . . . . . . . 5267 1 1256 . 1 1 137 137 LEU HB2 H 1 1.42 0.03 . 2 . . . . . . . . 5267 1 1257 . 1 1 137 137 LEU HB3 H 1 1.13 0.03 . 2 . . . . . . . . 5267 1 1258 . 1 1 137 137 LEU HG H 1 1.60 0.03 . 1 . . . . . . . . 5267 1 1259 . 1 1 137 137 LEU HD11 H 1 0.75 0.03 . 2 . . . . . . . . 5267 1 1260 . 1 1 137 137 LEU HD12 H 1 0.75 0.03 . 2 . . . . . . . . 5267 1 1261 . 1 1 137 137 LEU HD13 H 1 0.75 0.03 . 2 . . . . . . . . 5267 1 1262 . 1 1 137 137 LEU HD21 H 1 0.73 0.03 . 2 . . . . . . . . 5267 1 1263 . 1 1 137 137 LEU HD22 H 1 0.73 0.03 . 2 . . . . . . . . 5267 1 1264 . 1 1 137 137 LEU HD23 H 1 0.73 0.03 . 2 . . . . . . . . 5267 1 1265 . 1 1 137 137 LEU C C 13 177.42 0.20 . 1 . . . . . . . . 5267 1 1266 . 1 1 137 137 LEU CA C 13 55.93 0.20 . 1 . . . . . . . . 5267 1 1267 . 1 1 137 137 LEU CB C 13 42.76 0.20 . 1 . . . . . . . . 5267 1 1268 . 1 1 137 137 LEU CG C 13 26.11 0.20 . 1 . . . . . . . . 5267 1 1269 . 1 1 137 137 LEU CD1 C 13 26.06 0.20 . 2 . . . . . . . . 5267 1 1270 . 1 1 137 137 LEU CD2 C 13 21.87 0.20 . 2 . . . . . . . . 5267 1 1271 . 1 1 137 137 LEU N N 15 127.42 0.15 . 1 . . . . . . . . 5267 1 1272 . 1 1 138 138 GLN H H 1 7.57 0.03 . 1 . . . . . . . . 5267 1 1273 . 1 1 138 138 GLN HA H 1 4.52 0.03 . 1 . . . . . . . . 5267 1 1274 . 1 1 138 138 GLN HB2 H 1 2.10 0.03 . 2 . . . . . . . . 5267 1 1275 . 1 1 138 138 GLN HB3 H 1 1.84 0.03 . 2 . . . . . . . . 5267 1 1276 . 1 1 138 138 GLN HG2 H 1 2.31 0.03 . 2 . . . . . . . . 5267 1 1277 . 1 1 138 138 GLN C C 13 172.86 0.20 . 1 . . . . . . . . 5267 1 1278 . 1 1 138 138 GLN CA C 13 54.75 0.20 . 1 . . . . . . . . 5267 1 1279 . 1 1 138 138 GLN CB C 13 34.24 0.20 . 1 . . . . . . . . 5267 1 1280 . 1 1 138 138 GLN N N 15 112.47 0.15 . 1 . . . . . . . . 5267 1 1281 . 1 1 139 139 LYS H H 1 8.70 0.03 . 1 . . . . . . . . 5267 1 1282 . 1 1 139 139 LYS HA H 1 4.05 0.03 . 1 . . . . . . . . 5267 1 1283 . 1 1 139 139 LYS HB2 H 1 1.85 0.03 . 2 . . . . . . . . 5267 1 1284 . 1 1 139 139 LYS HB3 H 1 1.62 0.03 . 2 . . . . . . . . 5267 1 1285 . 1 1 139 139 LYS HG2 H 1 1.49 0.03 . 2 . . . . . . . . 5267 1 1286 . 1 1 139 139 LYS HG3 H 1 1.28 0.03 . 2 . . . . . . . . 5267 1 1287 . 1 1 139 139 LYS HD2 H 1 1.87 0.03 . 1 . . . . . . . . 5267 1 1288 . 1 1 139 139 LYS C C 13 173.71 0.20 . 1 . . . . . . . . 5267 1 1289 . 1 1 139 139 LYS CA C 13 56.02 0.20 . 1 . . . . . . . . 5267 1 1290 . 1 1 139 139 LYS CB C 13 30.10 0.20 . 1 . . . . . . . . 5267 1 1291 . 1 1 139 139 LYS CG C 13 25.42 0.20 . 1 . . . . . . . . 5267 1 1292 . 1 1 139 139 LYS CD C 13 30.10 0.20 . 1 . . . . . . . . 5267 1 1293 . 1 1 139 139 LYS CE C 13 41.69 0.20 . 1 . . . . . . . . 5267 1 1294 . 1 1 139 139 LYS N N 15 120.64 0.15 . 1 . . . . . . . . 5267 1 1295 . 1 1 140 140 LYS H H 1 7.01 0.03 . 1 . . . . . . . . 5267 1 1296 . 1 1 140 140 LYS HA H 1 4.42 0.03 . 1 . . . . . . . . 5267 1 1297 . 1 1 140 140 LYS HB2 H 1 1.70 0.03 . 2 . . . . . . . . 5267 1 1298 . 1 1 140 140 LYS HB3 H 1 1.57 0.03 . 2 . . . . . . . . 5267 1 1299 . 1 1 140 140 LYS HG2 H 1 1.29 0.03 . 2 . . . . . . . . 5267 1 1300 . 1 1 140 140 LYS HD2 H 1 1.61 0.03 . 2 . . . . . . . . 5267 1 1301 . 1 1 140 140 LYS HE2 H 1 2.93 0.03 . 1 . . . . . . . . 5267 1 1302 . 1 1 140 140 LYS C C 13 173.38 0.20 . 1 . . . . . . . . 5267 1 1303 . 1 1 140 140 LYS CA C 13 54.50 0.20 . 1 . . . . . . . . 5267 1 1304 . 1 1 140 140 LYS CB C 13 36.43 0.20 . 1 . . . . . . . . 5267 1 1305 . 1 1 140 140 LYS CG C 13 24.74 0.20 . 1 . . . . . . . . 5267 1 1306 . 1 1 140 140 LYS CD C 13 29.39 0.20 . 1 . . . . . . . . 5267 1 1307 . 1 1 140 140 LYS CE C 13 41.55 0.20 . 1 . . . . . . . . 5267 1 1308 . 1 1 140 140 LYS N N 15 124.15 0.15 . 1 . . . . . . . . 5267 1 1309 . 1 1 141 141 SER H H 1 8.53 0.03 . 1 . . . . . . . . 5267 1 1310 . 1 1 141 141 SER HA H 1 4.78 0.03 . 1 . . . . . . . . 5267 1 1311 . 1 1 141 141 SER HB2 H 1 4.07 0.03 . 2 . . . . . . . . 5267 1 1312 . 1 1 141 141 SER HB3 H 1 3.83 0.03 . 2 . . . . . . . . 5267 1 1313 . 1 1 141 141 SER C C 13 173.70 0.20 . 1 . . . . . . . . 5267 1 1314 . 1 1 141 141 SER CA C 13 60.07 0.20 . 1 . . . . . . . . 5267 1 1315 . 1 1 141 141 SER CB C 13 63.19 0.20 . 1 . . . . . . . . 5267 1 1316 . 1 1 141 141 SER N N 15 117.14 0.15 . 1 . . . . . . . . 5267 1 1317 . 1 1 142 142 THR H H 1 8.42 0.03 . 1 . . . . . . . . 5267 1 1318 . 1 1 142 142 THR HA H 1 4.65 0.03 . 1 . . . . . . . . 5267 1 1319 . 1 1 142 142 THR HB H 1 4.05 0.03 . 1 . . . . . . . . 5267 1 1320 . 1 1 142 142 THR HG21 H 1 1.04 0.03 . 1 . . . . . . . . 5267 1 1321 . 1 1 142 142 THR HG22 H 1 1.04 0.03 . 1 . . . . . . . . 5267 1 1322 . 1 1 142 142 THR HG23 H 1 1.04 0.03 . 1 . . . . . . . . 5267 1 1323 . 1 1 142 142 THR C C 13 169.10 0.20 . 1 . . . . . . . . 5267 1 1324 . 1 1 142 142 THR CA C 13 61.84 0.20 . 1 . . . . . . . . 5267 1 1325 . 1 1 142 142 THR CB C 13 69.94 0.20 . 1 . . . . . . . . 5267 1 1326 . 1 1 142 142 THR CG2 C 13 18.71 0.20 . 1 . . . . . . . . 5267 1 1327 . 1 1 142 142 THR N N 15 118.07 0.15 . 1 . . . . . . . . 5267 1 1328 . 1 1 143 143 ALA H H 1 7.94 0.03 . 1 . . . . . . . . 5267 1 1329 . 1 1 143 143 ALA HA H 1 5.18 0.03 . 1 . . . . . . . . 5267 1 1330 . 1 1 143 143 ALA HB1 H 1 1.32 0.03 . 1 . . . . . . . . 5267 1 1331 . 1 1 143 143 ALA HB2 H 1 1.32 0.03 . 1 . . . . . . . . 5267 1 1332 . 1 1 143 143 ALA HB3 H 1 1.32 0.03 . 1 . . . . . . . . 5267 1 1333 . 1 1 143 143 ALA C C 13 176.60 0.20 . 1 . . . . . . . . 5267 1 1334 . 1 1 143 143 ALA CA C 13 50.78 0.20 . 1 . . . . . . . . 5267 1 1335 . 1 1 143 143 ALA CB C 13 22.59 0.20 . 1 . . . . . . . . 5267 1 1336 . 1 1 143 143 ALA N N 15 123.21 0.15 . 1 . . . . . . . . 5267 1 1337 . 1 1 144 144 VAL H H 1 8.44 0.03 . 1 . . . . . . . . 5267 1 1338 . 1 1 144 144 VAL HA H 1 4.60 0.03 . 1 . . . . . . . . 5267 1 1339 . 1 1 144 144 VAL HB H 1 1.62 0.03 . 1 . . . . . . . . 5267 1 1340 . 1 1 144 144 VAL HG11 H 1 0.61 0.03 . 2 . . . . . . . . 5267 1 1341 . 1 1 144 144 VAL HG12 H 1 0.61 0.03 . 2 . . . . . . . . 5267 1 1342 . 1 1 144 144 VAL HG13 H 1 0.61 0.03 . 2 . . . . . . . . 5267 1 1343 . 1 1 144 144 VAL HG21 H 1 0.31 0.03 . 2 . . . . . . . . 5267 1 1344 . 1 1 144 144 VAL HG22 H 1 0.31 0.03 . 2 . . . . . . . . 5267 1 1345 . 1 1 144 144 VAL HG23 H 1 0.31 0.03 . 2 . . . . . . . . 5267 1 1346 . 1 1 144 144 VAL C C 13 174.17 0.20 . 1 . . . . . . . . 5267 1 1347 . 1 1 144 144 VAL CA C 13 61.92 0.20 . 1 . . . . . . . . 5267 1 1348 . 1 1 144 144 VAL CB C 13 33.65 0.20 . 1 . . . . . . . . 5267 1 1349 . 1 1 144 144 VAL CG1 C 13 22.11 0.20 . 1 . . . . . . . . 5267 1 1350 . 1 1 144 144 VAL CG2 C 13 21.73 0.20 . 1 . . . . . . . . 5267 1 1351 . 1 1 144 144 VAL N N 15 126.48 0.15 . 1 . . . . . . . . 5267 1 1352 . 1 1 145 145 LYS H H 1 8.28 0.03 . 1 . . . . . . . . 5267 1 1353 . 1 1 145 145 LYS HA H 1 4.98 0.03 . 1 . . . . . . . . 5267 1 1354 . 1 1 145 145 LYS HB2 H 1 1.79 0.03 . 2 . . . . . . . . 5267 1 1355 . 1 1 145 145 LYS HB3 H 1 1.63 0.03 . 2 . . . . . . . . 5267 1 1356 . 1 1 145 145 LYS HG2 H 1 1.27 0.03 . 2 . . . . . . . . 5267 1 1357 . 1 1 145 145 LYS HG3 H 1 1.19 0.03 . 2 . . . . . . . . 5267 1 1358 . 1 1 145 145 LYS HD2 H 1 1.60 0.03 . 2 . . . . . . . . 5267 1 1359 . 1 1 145 145 LYS HE2 H 1 2.88 0.03 . 1 . . . . . . . . 5267 1 1360 . 1 1 145 145 LYS C C 13 176.19 0.20 . 1 . . . . . . . . 5267 1 1361 . 1 1 145 145 LYS CA C 13 54.91 0.20 . 1 . . . . . . . . 5267 1 1362 . 1 1 145 145 LYS CB C 13 36.68 0.20 . 1 . . . . . . . . 5267 1 1363 . 1 1 145 145 LYS CG C 13 24.71 0.20 . 1 . . . . . . . . 5267 1 1364 . 1 1 145 145 LYS CD C 13 30.24 0.20 . 1 . . . . . . . . 5267 1 1365 . 1 1 145 145 LYS CE C 13 42.24 0.20 . 1 . . . . . . . . 5267 1 1366 . 1 1 145 145 LYS N N 15 120.40 0.15 . 1 . . . . . . . . 5267 1 1367 . 1 1 146 146 PHE H H 1 9.61 0.03 . 1 . . . . . . . . 5267 1 1368 . 1 1 146 146 PHE HA H 1 5.37 0.03 . 1 . . . . . . . . 5267 1 1369 . 1 1 146 146 PHE HB2 H 1 3.86 0.03 . 2 . . . . . . . . 5267 1 1370 . 1 1 146 146 PHE HB3 H 1 2.82 0.03 . 2 . . . . . . . . 5267 1 1371 . 1 1 146 146 PHE HD1 H 1 7.06 0.03 . 3 . . . . . . . . 5267 1 1372 . 1 1 146 146 PHE C C 13 177.34 0.20 . 1 . . . . . . . . 5267 1 1373 . 1 1 146 146 PHE CA C 13 58.97 0.20 . 1 . . . . . . . . 5267 1 1374 . 1 1 146 146 PHE CB C 13 39.81 0.20 . 1 . . . . . . . . 5267 1 1375 . 1 1 146 146 PHE N N 15 121.11 0.15 . 1 . . . . . . . . 5267 1 1376 . 1 1 147 147 GLN H H 1 8.65 0.03 . 1 . . . . . . . . 5267 1 1377 . 1 1 147 147 GLN HA H 1 4.60 0.03 . 1 . . . . . . . . 5267 1 1378 . 1 1 147 147 GLN HB2 H 1 1.84 0.03 . 2 . . . . . . . . 5267 1 1379 . 1 1 147 147 GLN HB3 H 1 1.77 0.03 . 2 . . . . . . . . 5267 1 1380 . 1 1 147 147 GLN HG2 H 1 2.68 0.03 . 2 . . . . . . . . 5267 1 1381 . 1 1 147 147 GLN HG3 H 1 2.48 0.03 . 2 . . . . . . . . 5267 1 1382 . 1 1 147 147 GLN C C 13 174.97 0.20 . 1 . . . . . . . . 5267 1 1383 . 1 1 147 147 GLN CA C 13 55.42 0.20 . 1 . . . . . . . . 5267 1 1384 . 1 1 147 147 GLN CB C 13 34.91 0.20 . 1 . . . . . . . . 5267 1 1385 . 1 1 147 147 GLN CG C 13 34.91 0.20 . 1 . . . . . . . . 5267 1 1386 . 1 1 147 147 GLN N N 15 124.62 0.15 . 1 . . . . . . . . 5267 1 1387 . 1 1 148 148 ASP H H 1 8.52 0.03 . 1 . . . . . . . . 5267 1 1388 . 1 1 148 148 ASP HA H 1 4.40 0.03 . 1 . . . . . . . . 5267 1 1389 . 1 1 148 148 ASP HB2 H 1 2.71 0.03 . 2 . . . . . . . . 5267 1 1390 . 1 1 148 148 ASP HB3 H 1 2.47 0.03 . 2 . . . . . . . . 5267 1 1391 . 1 1 148 148 ASP C C 13 174.70 0.20 . 1 . . . . . . . . 5267 1 1392 . 1 1 148 148 ASP CA C 13 55.93 0.20 . 1 . . . . . . . . 5267 1 1393 . 1 1 148 148 ASP CB C 13 42.76 0.20 . 1 . . . . . . . . 5267 1 1394 . 1 1 148 148 ASP N N 15 123.45 0.15 . 1 . . . . . . . . 5267 1 1395 . 1 1 149 149 THR H H 1 9.18 0.03 . 1 . . . . . . . . 5267 1 1396 . 1 1 149 149 THR HA H 1 4.76 0.03 . 1 . . . . . . . . 5267 1 1397 . 1 1 149 149 THR HB H 1 4.09 0.03 . 1 . . . . . . . . 5267 1 1398 . 1 1 149 149 THR HG21 H 1 1.02 0.03 . 1 . . . . . . . . 5267 1 1399 . 1 1 149 149 THR HG22 H 1 1.02 0.03 . 1 . . . . . . . . 5267 1 1400 . 1 1 149 149 THR HG23 H 1 1.02 0.03 . 1 . . . . . . . . 5267 1 1401 . 1 1 149 149 THR C C 13 174.17 0.20 . 1 . . . . . . . . 5267 1 1402 . 1 1 149 149 THR CA C 13 58.72 0.20 . 1 . . . . . . . . 5267 1 1403 . 1 1 149 149 THR CB C 13 69.69 0.20 . 1 . . . . . . . . 5267 1 1404 . 1 1 149 149 THR CG2 C 13 21.00 0.20 . 1 . . . . . . . . 5267 1 1405 . 1 1 149 149 THR N N 15 113.87 0.15 . 1 . . . . . . . . 5267 1 1406 . 1 1 150 150 LEU H H 1 8.59 0.03 . 1 . . . . . . . . 5267 1 1407 . 1 1 150 150 LEU HA H 1 4.09 0.03 . 1 . . . . . . . . 5267 1 1408 . 1 1 150 150 LEU HB2 H 1 1.78 0.03 . 2 . . . . . . . . 5267 1 1409 . 1 1 150 150 LEU HB3 H 1 1.62 0.03 . 2 . . . . . . . . 5267 1 1410 . 1 1 150 150 LEU HG H 1 1.72 0.03 . 1 . . . . . . . . 5267 1 1411 . 1 1 150 150 LEU HD11 H 1 0.95 0.03 . 1 . . . . . . . . 5267 1 1412 . 1 1 150 150 LEU HD12 H 1 0.95 0.03 . 1 . . . . . . . . 5267 1 1413 . 1 1 150 150 LEU HD13 H 1 0.95 0.03 . 1 . . . . . . . . 5267 1 1414 . 1 1 150 150 LEU HD21 H 1 0.95 0.03 . 1 . . . . . . . . 5267 1 1415 . 1 1 150 150 LEU HD22 H 1 0.95 0.03 . 1 . . . . . . . . 5267 1 1416 . 1 1 150 150 LEU HD23 H 1 0.95 0.03 . 1 . . . . . . . . 5267 1 1417 . 1 1 150 150 LEU C C 13 177.68 0.20 . 1 . . . . . . . . 5267 1 1418 . 1 1 150 150 LEU CA C 13 58.04 0.20 . 1 . . . . . . . . 5267 1 1419 . 1 1 150 150 LEU CB C 13 41.75 0.20 . 1 . . . . . . . . 5267 1 1420 . 1 1 150 150 LEU CG C 13 27.32 0.20 . 1 . . . . . . . . 5267 1 1421 . 1 1 150 150 LEU CD1 C 13 25.03 0.20 . 2 . . . . . . . . 5267 1 1422 . 1 1 150 150 LEU CD2 C 13 23.84 0.20 . 2 . . . . . . . . 5267 1 1423 . 1 1 150 150 LEU N N 15 129.09 0.15 . 1 . . . . . . . . 5267 1 1424 . 1 1 151 151 SER H H 1 8.02 0.03 . 1 . . . . . . . . 5267 1 1425 . 1 1 151 151 SER HA H 1 4.37 0.03 . 1 . . . . . . . . 5267 1 1426 . 1 1 151 151 SER HB2 H 1 4.05 0.03 . 2 . . . . . . . . 5267 1 1427 . 1 1 151 151 SER HB3 H 1 3.86 0.03 . 2 . . . . . . . . 5267 1 1428 . 1 1 151 151 SER C C 13 173.49 0.20 . 1 . . . . . . . . 5267 1 1429 . 1 1 151 151 SER CA C 13 59.56 0.20 . 1 . . . . . . . . 5267 1 1430 . 1 1 151 151 SER CB C 13 63.28 0.20 . 1 . . . . . . . . 5267 1 1431 . 1 1 151 151 SER N N 15 110.37 0.15 . 1 . . . . . . . . 5267 1 1432 . 1 1 152 152 MET H H 1 7.71 0.03 . 1 . . . . . . . . 5267 1 1433 . 1 1 152 152 MET HA H 1 4.91 0.03 . 1 . . . . . . . . 5267 1 1434 . 1 1 152 152 MET HB2 H 1 2.10 0.03 . 2 . . . . . . . . 5267 1 1435 . 1 1 152 152 MET HB3 H 1 1.79 0.03 . 2 . . . . . . . . 5267 1 1436 . 1 1 152 152 MET HG2 H 1 2.31 0.03 . 2 . . . . . . . . 5267 1 1437 . 1 1 152 152 MET CA C 13 53.65 0.20 . 1 . . . . . . . . 5267 1 1438 . 1 1 152 152 MET CB C 13 35.34 0.20 . 1 . . . . . . . . 5267 1 1439 . 1 1 152 152 MET N N 15 119.71 0.15 . 1 . . . . . . . . 5267 1 1440 . 1 1 153 153 PRO HA H 1 4.49 0.03 . 1 . . . . . . . . 5267 1 1441 . 1 1 153 153 PRO C C 13 178.17 0.20 . 1 . . . . . . . . 5267 1 1442 . 1 1 153 153 PRO CA C 13 64.29 0.20 . 1 . . . . . . . . 5267 1 1443 . 1 1 153 153 PRO CB C 13 31.54 0.20 . 1 . . . . . . . . 5267 1 1444 . 1 1 154 154 GLY H H 1 8.86 0.03 . 1 . . . . . . . . 5267 1 1445 . 1 1 154 154 GLY HA2 H 1 4.01 0.03 . 2 . . . . . . . . 5267 1 1446 . 1 1 154 154 GLY HA3 H 1 3.94 0.03 . 2 . . . . . . . . 5267 1 1447 . 1 1 154 154 GLY C C 13 173.57 0.20 . 1 . . . . . . . . 5267 1 1448 . 1 1 154 154 GLY CA C 13 45.89 0.20 . 1 . . . . . . . . 5267 1 1449 . 1 1 154 154 GLY N N 15 109.67 0.15 . 1 . . . . . . . . 5267 1 1450 . 1 1 155 155 ALA H H 1 7.28 0.03 . 1 . . . . . . . . 5267 1 1451 . 1 1 155 155 ALA HA H 1 4.51 0.03 . 1 . . . . . . . . 5267 1 1452 . 1 1 155 155 ALA HB1 H 1 1.50 0.03 . 1 . . . . . . . . 5267 1 1453 . 1 1 155 155 ALA HB2 H 1 1.50 0.03 . 1 . . . . . . . . 5267 1 1454 . 1 1 155 155 ALA HB3 H 1 1.50 0.03 . 1 . . . . . . . . 5267 1 1455 . 1 1 155 155 ALA C C 13 176.02 0.20 . 1 . . . . . . . . 5267 1 1456 . 1 1 155 155 ALA CA C 13 52.22 0.20 . 1 . . . . . . . . 5267 1 1457 . 1 1 155 155 ALA CB C 13 20.82 0.20 . 1 . . . . . . . . 5267 1 1458 . 1 1 155 155 ALA N N 15 120.64 0.15 . 1 . . . . . . . . 5267 1 1459 . 1 1 156 156 ILE H H 1 8.79 0.03 . 1 . . . . . . . . 5267 1 1460 . 1 1 156 156 ILE HA H 1 4.24 0.03 . 1 . . . . . . . . 5267 1 1461 . 1 1 156 156 ILE HB H 1 1.62 0.03 . 1 . . . . . . . . 5267 1 1462 . 1 1 156 156 ILE HG12 H 1 1.60 0.03 . 2 . . . . . . . . 5267 1 1463 . 1 1 156 156 ILE HG13 H 1 0.97 0.03 . 2 . . . . . . . . 5267 1 1464 . 1 1 156 156 ILE HG21 H 1 0.67 0.03 . 1 . . . . . . . . 5267 1 1465 . 1 1 156 156 ILE HG22 H 1 0.67 0.03 . 1 . . . . . . . . 5267 1 1466 . 1 1 156 156 ILE HG23 H 1 0.67 0.03 . 1 . . . . . . . . 5267 1 1467 . 1 1 156 156 ILE HD11 H 1 0.67 0.03 . 1 . . . . . . . . 5267 1 1468 . 1 1 156 156 ILE HD12 H 1 0.67 0.03 . 1 . . . . . . . . 5267 1 1469 . 1 1 156 156 ILE HD13 H 1 0.67 0.03 . 1 . . . . . . . . 5267 1 1470 . 1 1 156 156 ILE C C 13 175.57 0.20 . 1 . . . . . . . . 5267 1 1471 . 1 1 156 156 ILE CA C 13 61.16 0.20 . 1 . . . . . . . . 5267 1 1472 . 1 1 156 156 ILE CB C 13 37.78 0.20 . 1 . . . . . . . . 5267 1 1473 . 1 1 156 156 ILE CG1 C 13 27.47 0.20 . 2 . . . . . . . . 5267 1 1474 . 1 1 156 156 ILE CG2 C 13 17.53 0.20 . 2 . . . . . . . . 5267 1 1475 . 1 1 156 156 ILE CD1 C 13 13.18 0.20 . 1 . . . . . . . . 5267 1 1476 . 1 1 156 156 ILE N N 15 119.01 0.15 . 1 . . . . . . . . 5267 1 1477 . 1 1 157 157 SER H H 1 9.46 0.03 . 1 . . . . . . . . 5267 1 1478 . 1 1 157 157 SER HA H 1 4.78 0.03 . 1 . . . . . . . . 5267 1 1479 . 1 1 157 157 SER HB2 H 1 4.21 0.03 . 2 . . . . . . . . 5267 1 1480 . 1 1 157 157 SER HB3 H 1 3.89 0.03 . 2 . . . . . . . . 5267 1 1481 . 1 1 157 157 SER C C 13 176.32 0.20 . 1 . . . . . . . . 5267 1 1482 . 1 1 157 157 SER CA C 13 57.96 0.20 . 1 . . . . . . . . 5267 1 1483 . 1 1 157 157 SER CB C 13 63.61 0.20 . 1 . . . . . . . . 5267 1 1484 . 1 1 157 157 SER N N 15 125.55 0.15 . 1 . . . . . . . . 5267 1 1485 . 1 1 158 158 GLY H H 1 8.17 0.03 . 1 . . . . . . . . 5267 1 1486 . 1 1 158 158 GLY HA2 H 1 4.28 0.03 . 2 . . . . . . . . 5267 1 1487 . 1 1 158 158 GLY HA3 H 1 3.48 0.03 . 2 . . . . . . . . 5267 1 1488 . 1 1 158 158 GLY C C 13 172.11 0.20 . 1 . . . . . . . . 5267 1 1489 . 1 1 158 158 GLY CA C 13 46.65 0.20 . 1 . . . . . . . . 5267 1 1490 . 1 1 158 158 GLY N N 15 99.40 0.15 . 1 . . . . . . . . 5267 1 1491 . 1 1 159 159 THR H H 1 7.55 0.03 . 1 . . . . . . . . 5267 1 1492 . 1 1 159 159 THR HA H 1 5.12 0.03 . 1 . . . . . . . . 5267 1 1493 . 1 1 159 159 THR HB H 1 3.71 0.03 . 1 . . . . . . . . 5267 1 1494 . 1 1 159 159 THR HG21 H 1 0.74 0.03 . 1 . . . . . . . . 5267 1 1495 . 1 1 159 159 THR HG22 H 1 0.74 0.03 . 1 . . . . . . . . 5267 1 1496 . 1 1 159 159 THR HG23 H 1 0.74 0.03 . 1 . . . . . . . . 5267 1 1497 . 1 1 159 159 THR C C 13 171.71 0.20 . 1 . . . . . . . . 5267 1 1498 . 1 1 159 159 THR CA C 13 59.56 0.20 . 1 . . . . . . . . 5267 1 1499 . 1 1 159 159 THR CB C 13 73.66 0.20 . 1 . . . . . . . . 5267 1 1500 . 1 1 159 159 THR N N 15 106.63 0.15 . 1 . . . . . . . . 5267 1 1501 . 1 1 160 160 GLN H H 1 8.89 0.03 . 1 . . . . . . . . 5267 1 1502 . 1 1 160 160 GLN HA H 1 4.79 0.03 . 1 . . . . . . . . 5267 1 1503 . 1 1 160 160 GLN HB2 H 1 2.01 0.03 . 2 . . . . . . . . 5267 1 1504 . 1 1 160 160 GLN HB3 H 1 1.61 0.03 . 2 . . . . . . . . 5267 1 1505 . 1 1 160 160 GLN HG2 H 1 2.01 0.03 . 2 . . . . . . . . 5267 1 1506 . 1 1 160 160 GLN C C 13 172.25 0.20 . 1 . . . . . . . . 5267 1 1507 . 1 1 160 160 GLN CA C 13 56.02 0.20 . 1 . . . . . . . . 5267 1 1508 . 1 1 160 160 GLN CB C 13 33.65 0.20 . 1 . . . . . . . . 5267 1 1509 . 1 1 160 160 GLN CG C 13 35.37 0.20 . 1 . . . . . . . . 5267 1 1510 . 1 1 160 160 GLN N N 15 122.28 0.15 . 1 . . . . . . . . 5267 1 1511 . 1 1 161 161 LEU H H 1 8.86 0.03 . 1 . . . . . . . . 5267 1 1512 . 1 1 161 161 LEU HA H 1 5.30 0.03 . 1 . . . . . . . . 5267 1 1513 . 1 1 161 161 LEU HB2 H 1 1.59 0.03 . 2 . . . . . . . . 5267 1 1514 . 1 1 161 161 LEU HB3 H 1 1.48 0.03 . 2 . . . . . . . . 5267 1 1515 . 1 1 161 161 LEU HG H 1 1.54 0.03 . 1 . . . . . . . . 5267 1 1516 . 1 1 161 161 LEU HD11 H 1 0.03 0.03 . 2 . . . . . . . . 5267 1 1517 . 1 1 161 161 LEU HD12 H 1 0.03 0.03 . 2 . . . . . . . . 5267 1 1518 . 1 1 161 161 LEU HD13 H 1 0.03 0.03 . 2 . . . . . . . . 5267 1 1519 . 1 1 161 161 LEU HD21 H 1 0.80 0.03 . 2 . . . . . . . . 5267 1 1520 . 1 1 161 161 LEU HD22 H 1 0.80 0.03 . 2 . . . . . . . . 5267 1 1521 . 1 1 161 161 LEU HD23 H 1 0.80 0.03 . 2 . . . . . . . . 5267 1 1522 . 1 1 161 161 LEU C C 13 173.81 0.20 . 1 . . . . . . . . 5267 1 1523 . 1 1 161 161 LEU CA C 13 53.32 0.20 . 1 . . . . . . . . 5267 1 1524 . 1 1 161 161 LEU CB C 13 44.96 0.20 . 1 . . . . . . . . 5267 1 1525 . 1 1 161 161 LEU CG C 13 27.40 0.20 . 1 . . . . . . . . 5267 1 1526 . 1 1 161 161 LEU CD1 C 13 25.11 0.20 . 1 . . . . . . . . 5267 1 1527 . 1 1 161 161 LEU CD2 C 13 23.92 0.20 . 1 . . . . . . . . 5267 1 1528 . 1 1 161 161 LEU N N 15 125.32 0.15 . 1 . . . . . . . . 5267 1 1529 . 1 1 162 162 PHE H H 1 8.57 0.03 . 1 . . . . . . . . 5267 1 1530 . 1 1 162 162 PHE HA H 1 5.48 0.03 . 1 . . . . . . . . 5267 1 1531 . 1 1 162 162 PHE HB2 H 1 3.08 0.03 . 2 . . . . . . . . 5267 1 1532 . 1 1 162 162 PHE HB3 H 1 2.37 0.03 . 2 . . . . . . . . 5267 1 1533 . 1 1 162 162 PHE HD1 H 1 6.82 0.03 . 3 . . . . . . . . 5267 1 1534 . 1 1 162 162 PHE HE1 H 1 7.19 0.03 . 3 . . . . . . . . 5267 1 1535 . 1 1 162 162 PHE C C 13 175.26 0.20 . 1 . . . . . . . . 5267 1 1536 . 1 1 162 162 PHE CA C 13 56.61 0.20 . 1 . . . . . . . . 5267 1 1537 . 1 1 162 162 PHE CB C 13 43.95 0.20 . 1 . . . . . . . . 5267 1 1538 . 1 1 162 162 PHE N N 15 117.84 0.15 . 1 . . . . . . . . 5267 1 1539 . 1 1 163 163 ASP H H 1 9.22 0.03 . 1 . . . . . . . . 5267 1 1540 . 1 1 163 163 ASP HA H 1 5.44 0.03 . 1 . . . . . . . . 5267 1 1541 . 1 1 163 163 ASP HB2 H 1 3.08 0.03 . 2 . . . . . . . . 5267 1 1542 . 1 1 163 163 ASP HB3 H 1 2.64 0.03 . 2 . . . . . . . . 5267 1 1543 . 1 1 163 163 ASP C C 13 179.77 0.20 . 1 . . . . . . . . 5267 1 1544 . 1 1 163 163 ASP CA C 13 52.39 0.20 . 1 . . . . . . . . 5267 1 1545 . 1 1 163 163 ASP CB C 13 44.11 0.20 . 1 . . . . . . . . 5267 1 1546 . 1 1 163 163 ASP N N 15 119.94 0.15 . 1 . . . . . . . . 5267 1 1547 . 1 1 164 164 TRP H H 1 8.13 0.03 . 1 . . . . . . . . 5267 1 1548 . 1 1 164 164 TRP HE1 H 1 10.02 0.03 . 1 . . . . . . . . 5267 1 1549 . 1 1 164 164 TRP C C 13 173.81 0.20 . 1 . . . . . . . . 5267 1 1550 . 1 1 164 164 TRP CA C 13 56.61 0.20 . 1 . . . . . . . . 5267 1 1551 . 1 1 164 164 TRP CB C 13 28.58 0.20 . 1 . . . . . . . . 5267 1 1552 . 1 1 164 164 TRP N N 15 113.64 0.15 . 1 . . . . . . . . 5267 1 1553 . 1 1 164 164 TRP NE1 N 15 128.76 0.15 . 1 . . . . . . . . 5267 1 1554 . 1 1 165 165 ASP H H 1 8.83 0.03 . 1 . . . . . . . . 5267 1 1555 . 1 1 165 165 ASP HA H 1 5.08 0.03 . 1 . . . . . . . . 5267 1 1556 . 1 1 165 165 ASP HB2 H 1 3.03 0.03 . 2 . . . . . . . . 5267 1 1557 . 1 1 165 165 ASP HB3 H 1 2.97 0.03 . 2 . . . . . . . . 5267 1 1558 . 1 1 165 165 ASP C C 13 176.79 0.20 . 1 . . . . . . . . 5267 1 1559 . 1 1 165 165 ASP CA C 13 55.51 0.20 . 1 . . . . . . . . 5267 1 1560 . 1 1 165 165 ASP CB C 13 42.43 0.20 . 1 . . . . . . . . 5267 1 1561 . 1 1 165 165 ASP N N 15 117.37 0.15 . 1 . . . . . . . . 5267 1 1562 . 1 1 166 166 GLY H H 1 8.75 0.03 . 1 . . . . . . . . 5267 1 1563 . 1 1 166 166 GLY HA2 H 1 4.21 0.03 . 2 . . . . . . . . 5267 1 1564 . 1 1 166 166 GLY HA3 H 1 3.88 0.03 . 2 . . . . . . . . 5267 1 1565 . 1 1 166 166 GLY CA C 13 45.63 0.20 . 1 . . . . . . . . 5267 1 1566 . 1 1 166 166 GLY N N 15 109.67 0.15 . 1 . . . . . . . . 5267 1 1567 . 1 1 167 167 GLU H H 1 8.38 0.03 . 1 . . . . . . . . 5267 1 1568 . 1 1 167 167 GLU HA H 1 4.60 0.03 . 1 . . . . . . . . 5267 1 1569 . 1 1 167 167 GLU HB2 H 1 2.13 0.03 . 2 . . . . . . . . 5267 1 1570 . 1 1 167 167 GLU HG2 H 1 2.28 0.03 . 2 . . . . . . . . 5267 1 1571 . 1 1 167 167 GLU C C 13 175.55 0.20 . 1 . . . . . . . . 5267 1 1572 . 1 1 167 167 GLU CA C 13 55.34 0.20 . 1 . . . . . . . . 5267 1 1573 . 1 1 167 167 GLU CB C 13 31.03 0.20 . 1 . . . . . . . . 5267 1 1574 . 1 1 167 167 GLU CG C 13 36.17 0.20 . 1 . . . . . . . . 5267 1 1575 . 1 1 167 167 GLU N N 15 119.71 0.15 . 1 . . . . . . . . 5267 1 1576 . 1 1 168 168 VAL H H 1 8.55 0.03 . 1 . . . . . . . . 5267 1 1577 . 1 1 168 168 VAL HA H 1 4.07 0.03 . 1 . . . . . . . . 5267 1 1578 . 1 1 168 168 VAL HB H 1 1.95 0.03 . 1 . . . . . . . . 5267 1 1579 . 1 1 168 168 VAL HG11 H 1 0.96 0.03 . 1 . . . . . . . . 5267 1 1580 . 1 1 168 168 VAL HG12 H 1 0.96 0.03 . 1 . . . . . . . . 5267 1 1581 . 1 1 168 168 VAL HG13 H 1 0.96 0.03 . 1 . . . . . . . . 5267 1 1582 . 1 1 168 168 VAL HG21 H 1 0.96 0.03 . 1 . . . . . . . . 5267 1 1583 . 1 1 168 168 VAL HG22 H 1 0.96 0.03 . 1 . . . . . . . . 5267 1 1584 . 1 1 168 168 VAL HG23 H 1 0.96 0.03 . 1 . . . . . . . . 5267 1 1585 . 1 1 168 168 VAL C C 13 176.56 0.20 . 1 . . . . . . . . 5267 1 1586 . 1 1 168 168 VAL CA C 13 63.53 0.20 . 1 . . . . . . . . 5267 1 1587 . 1 1 168 168 VAL CB C 13 33.06 0.20 . 1 . . . . . . . . 5267 1 1588 . 1 1 168 168 VAL CG1 C 13 22.50 0.20 . 1 . . . . . . . . 5267 1 1589 . 1 1 168 168 VAL CG2 C 13 21.70 0.20 . 1 . . . . . . . . 5267 1 1590 . 1 1 168 168 VAL N N 15 120.41 0.15 . 1 . . . . . . . . 5267 1 1591 . 1 1 169 169 ILE H H 1 8.86 0.03 . 1 . . . . . . . . 5267 1 1592 . 1 1 169 169 ILE HB H 1 1.58 0.03 . 1 . . . . . . . . 5267 1 1593 . 1 1 169 169 ILE C C 13 174.93 0.20 . 1 . . . . . . . . 5267 1 1594 . 1 1 169 169 ILE CA C 13 61.84 0.20 . 1 . . . . . . . . 5267 1 1595 . 1 1 169 169 ILE CB C 13 40.23 0.20 . 1 . . . . . . . . 5267 1 1596 . 1 1 169 169 ILE CG1 C 13 28.09 0.20 . 1 . . . . . . . . 5267 1 1597 . 1 1 169 169 ILE CG2 C 13 17.53 0.20 . 1 . . . . . . . . 5267 1 1598 . 1 1 169 169 ILE CD1 C 13 11.29 0.20 . 1 . . . . . . . . 5267 1 1599 . 1 1 169 169 ILE N N 15 130.45 0.15 . 1 . . . . . . . . 5267 1 1600 . 1 1 170 170 THR H H 1 8.42 0.03 . 1 . . . . . . . . 5267 1 1601 . 1 1 170 170 THR HA H 1 4.72 0.03 . 1 . . . . . . . . 5267 1 1602 . 1 1 170 170 THR HB H 1 4.24 0.03 . 1 . . . . . . . . 5267 1 1603 . 1 1 170 170 THR HG21 H 1 1.17 0.03 . 1 . . . . . . . . 5267 1 1604 . 1 1 170 170 THR HG22 H 1 1.17 0.03 . 1 . . . . . . . . 5267 1 1605 . 1 1 170 170 THR HG23 H 1 1.17 0.03 . 1 . . . . . . . . 5267 1 1606 . 1 1 170 170 THR C C 13 175.02 0.20 . 1 . . . . . . . . 5267 1 1607 . 1 1 170 170 THR CA C 13 60.41 0.20 . 1 . . . . . . . . 5267 1 1608 . 1 1 170 170 THR CB C 13 71.55 0.20 . 1 . . . . . . . . 5267 1 1609 . 1 1 170 170 THR CG2 C 13 21.55 0.20 . 1 . . . . . . . . 5267 1 1610 . 1 1 170 170 THR N N 15 114.80 0.15 . 1 . . . . . . . . 5267 1 1611 . 1 1 171 171 GLY H H 1 8.38 0.03 . 1 . . . . . . . . 5267 1 1612 . 1 1 171 171 GLY HA2 H 1 4.08 0.03 . 2 . . . . . . . . 5267 1 1613 . 1 1 171 171 GLY HA3 H 1 3.71 0.03 . 2 . . . . . . . . 5267 1 1614 . 1 1 171 171 GLY C C 13 172.99 0.20 . 1 . . . . . . . . 5267 1 1615 . 1 1 171 171 GLY CA C 13 46.98 0.20 . 1 . . . . . . . . 5267 1 1616 . 1 1 171 171 GLY N N 15 105.70 0.15 . 1 . . . . . . . . 5267 1 1617 . 1 1 172 172 TYR H H 1 6.57 0.03 . 1 . . . . . . . . 5267 1 1618 . 1 1 172 172 TYR HA H 1 4.79 0.03 . 1 . . . . . . . . 5267 1 1619 . 1 1 172 172 TYR HB2 H 1 2.65 0.03 . 2 . . . . . . . . 5267 1 1620 . 1 1 172 172 TYR HB3 H 1 2.44 0.03 . 2 . . . . . . . . 5267 1 1621 . 1 1 172 172 TYR HD1 H 1 6.59 0.03 . 3 . . . . . . . . 5267 1 1622 . 1 1 172 172 TYR C C 13 172.66 0.20 . 1 . . . . . . . . 5267 1 1623 . 1 1 172 172 TYR CA C 13 54.33 0.20 . 1 . . . . . . . . 5267 1 1624 . 1 1 172 172 TYR CB C 13 40.32 0.20 . 1 . . . . . . . . 5267 1 1625 . 1 1 172 172 TYR N N 15 113.64 0.15 . 1 . . . . . . . . 5267 1 1626 . 1 1 173 173 GLU H H 1 8.30 0.03 . 1 . . . . . . . . 5267 1 1627 . 1 1 173 173 GLU HA H 1 4.46 0.03 . 1 . . . . . . . . 5267 1 1628 . 1 1 173 173 GLU HB2 H 1 1.93 0.03 . 2 . . . . . . . . 5267 1 1629 . 1 1 173 173 GLU HG2 H 1 2.36 0.03 . 2 . . . . . . . . 5267 1 1630 . 1 1 173 173 GLU HG3 H 1 2.45 0.03 . 2 . . . . . . . . 5267 1 1631 . 1 1 173 173 GLU CA C 13 55.42 0.20 . 1 . . . . . . . . 5267 1 1632 . 1 1 173 173 GLU CB C 13 32.46 0.20 . 1 . . . . . . . . 5267 1 1633 . 1 1 173 173 GLU CG C 13 36.64 0.20 . 1 . . . . . . . . 5267 1 1634 . 1 1 173 173 GLU N N 15 119.01 0.15 . 1 . . . . . . . . 5267 1 1635 . 1 1 174 174 VAL H H 1 8.49 0.03 . 1 . . . . . . . . 5267 1 1636 . 1 1 174 174 VAL HA H 1 4.39 0.03 . 1 . . . . . . . . 5267 1 1637 . 1 1 174 174 VAL HB H 1 2.00 0.03 . 1 . . . . . . . . 5267 1 1638 . 1 1 174 174 VAL HG11 H 1 0.80 0.03 . 2 . . . . . . . . 5267 1 1639 . 1 1 174 174 VAL HG12 H 1 0.80 0.03 . 2 . . . . . . . . 5267 1 1640 . 1 1 174 174 VAL HG13 H 1 0.80 0.03 . 2 . . . . . . . . 5267 1 1641 . 1 1 174 174 VAL HG21 H 1 0.73 0.03 . 2 . . . . . . . . 5267 1 1642 . 1 1 174 174 VAL HG22 H 1 0.73 0.03 . 2 . . . . . . . . 5267 1 1643 . 1 1 174 174 VAL HG23 H 1 0.73 0.03 . 2 . . . . . . . . 5267 1 1644 . 1 1 174 174 VAL C C 13 175.10 0.20 . 1 . . . . . . . . 5267 1 1645 . 1 1 174 174 VAL CA C 13 62.35 0.20 . 1 . . . . . . . . 5267 1 1646 . 1 1 174 174 VAL CB C 13 32.55 0.20 . 1 . . . . . . . . 5267 1 1647 . 1 1 174 174 VAL CG1 C 13 21.87 0.20 . 1 . . . . . . . . 5267 1 1648 . 1 1 174 174 VAL CG2 C 13 21.87 0.20 . 1 . . . . . . . . 5267 1 1649 . 1 1 174 174 VAL N N 15 123.45 0.15 . 1 . . . . . . . . 5267 1 1650 . 1 1 175 175 ILE H H 1 9.27 0.03 . 1 . . . . . . . . 5267 1 1651 . 1 1 175 175 ILE HA H 1 4.38 0.03 . 1 . . . . . . . . 5267 1 1652 . 1 1 175 175 ILE HB H 1 1.98 0.03 . 1 . . . . . . . . 5267 1 1653 . 1 1 175 175 ILE HG12 H 1 1.57 0.03 . 1 . . . . . . . . 5267 1 1654 . 1 1 175 175 ILE HG13 H 1 1.57 0.03 . 1 . . . . . . . . 5267 1 1655 . 1 1 175 175 ILE HG21 H 1 0.98 0.03 . 1 . . . . . . . . 5267 1 1656 . 1 1 175 175 ILE HG22 H 1 0.98 0.03 . 1 . . . . . . . . 5267 1 1657 . 1 1 175 175 ILE HG23 H 1 0.98 0.03 . 1 . . . . . . . . 5267 1 1658 . 1 1 175 175 ILE HD11 H 1 0.80 0.03 . 1 . . . . . . . . 5267 1 1659 . 1 1 175 175 ILE HD12 H 1 0.80 0.03 . 1 . . . . . . . . 5267 1 1660 . 1 1 175 175 ILE HD13 H 1 0.80 0.03 . 1 . . . . . . . . 5267 1 1661 . 1 1 175 175 ILE C C 13 175.05 0.20 . 1 . . . . . . . . 5267 1 1662 . 1 1 175 175 ILE CA C 13 61.84 0.20 . 1 . . . . . . . . 5267 1 1663 . 1 1 175 175 ILE CB C 13 37.61 0.20 . 1 . . . . . . . . 5267 1 1664 . 1 1 175 175 ILE CG1 C 13 26.45 0.20 . 1 . . . . . . . . 5267 1 1665 . 1 1 175 175 ILE CG2 C 13 17.37 0.20 . 1 . . . . . . . . 5267 1 1666 . 1 1 175 175 ILE CD1 C 13 12.71 0.20 . 1 . . . . . . . . 5267 1 1667 . 1 1 175 175 ILE N N 15 129.99 0.15 . 1 . . . . . . . . 5267 1 1668 . 1 1 176 176 GLN H H 1 8.37 0.03 . 1 . . . . . . . . 5267 1 1669 . 1 1 176 176 GLN CA C 13 53.82 0.20 . 1 . . . . . . . . 5267 1 1670 . 1 1 176 176 GLN CB C 13 27.74 0.20 . 1 . . . . . . . . 5267 1 1671 . 1 1 176 176 GLN N N 15 124.85 0.15 . 1 . . . . . . . . 5267 1 1672 . 1 1 177 177 PRO HA H 1 4.90 0.03 . 1 . . . . . . . . 5267 1 1673 . 1 1 177 177 PRO HB2 H 1 2.54 0.03 . 2 . . . . . . . . 5267 1 1674 . 1 1 177 177 PRO HB3 H 1 2.27 0.03 . 2 . . . . . . . . 5267 1 1675 . 1 1 177 177 PRO HG2 H 1 1.97 0.03 . 2 . . . . . . . . 5267 1 1676 . 1 1 177 177 PRO C C 13 177.21 0.20 . 1 . . . . . . . . 5267 1 1677 . 1 1 177 177 PRO CA C 13 62.77 0.20 . 1 . . . . . . . . 5267 1 1678 . 1 1 177 177 PRO CB C 13 32.38 0.20 . 1 . . . . . . . . 5267 1 1679 . 1 1 178 178 ASP H H 1 8.18 0.03 . 1 . . . . . . . . 5267 1 1680 . 1 1 178 178 ASP HA H 1 4.54 0.03 . 1 . . . . . . . . 5267 1 1681 . 1 1 178 178 ASP HB2 H 1 2.87 0.03 . 2 . . . . . . . . 5267 1 1682 . 1 1 178 178 ASP HB3 H 1 2.66 0.03 . 2 . . . . . . . . 5267 1 1683 . 1 1 178 178 ASP C C 13 176.66 0.20 . 1 . . . . . . . . 5267 1 1684 . 1 1 178 178 ASP CA C 13 54.83 0.20 . 1 . . . . . . . . 5267 1 1685 . 1 1 178 178 ASP CB C 13 41.75 0.20 . 1 . . . . . . . . 5267 1 1686 . 1 1 178 178 ASP N N 15 119.94 0.15 . 1 . . . . . . . . 5267 1 1687 . 1 1 179 179 VAL H H 1 8.36 0.03 . 1 . . . . . . . . 5267 1 1688 . 1 1 179 179 VAL HA H 1 3.77 0.03 . 1 . . . . . . . . 5267 1 1689 . 1 1 179 179 VAL HB H 1 1.91 0.03 . 1 . . . . . . . . 5267 1 1690 . 1 1 179 179 VAL HG11 H 1 1.00 0.03 . 2 . . . . . . . . 5267 1 1691 . 1 1 179 179 VAL HG12 H 1 1.00 0.03 . 2 . . . . . . . . 5267 1 1692 . 1 1 179 179 VAL HG13 H 1 1.00 0.03 . 2 . . . . . . . . 5267 1 1693 . 1 1 179 179 VAL HG21 H 1 0.87 0.03 . 2 . . . . . . . . 5267 1 1694 . 1 1 179 179 VAL HG22 H 1 0.87 0.03 . 2 . . . . . . . . 5267 1 1695 . 1 1 179 179 VAL HG23 H 1 0.87 0.03 . 2 . . . . . . . . 5267 1 1696 . 1 1 179 179 VAL C C 13 175.10 0.20 . 1 . . . . . . . . 5267 1 1697 . 1 1 179 179 VAL CA C 13 64.46 0.20 . 1 . . . . . . . . 5267 1 1698 . 1 1 179 179 VAL CB C 13 33.22 0.20 . 1 . . . . . . . . 5267 1 1699 . 1 1 179 179 VAL CG1 C 13 22.55 0.20 . 1 . . . . . . . . 5267 1 1700 . 1 1 179 179 VAL CG2 C 13 20.78 0.20 . 1 . . . . . . . . 5267 1 1701 . 1 1 179 179 VAL N N 15 120.41 0.15 . 1 . . . . . . . . 5267 1 1702 . 1 1 180 180 LEU H H 1 8.43 0.03 . 1 . . . . . . . . 5267 1 1703 . 1 1 180 180 LEU HA H 1 4.44 0.03 . 1 . . . . . . . . 5267 1 1704 . 1 1 180 180 LEU HB2 H 1 1.85 0.03 . 2 . . . . . . . . 5267 1 1705 . 1 1 180 180 LEU HB3 H 1 0.84 0.03 . 2 . . . . . . . . 5267 1 1706 . 1 1 180 180 LEU HG H 1 1.34 0.03 . 1 . . . . . . . . 5267 1 1707 . 1 1 180 180 LEU HD11 H 1 0.09 0.03 . 2 . . . . . . . . 5267 1 1708 . 1 1 180 180 LEU HD12 H 1 0.09 0.03 . 2 . . . . . . . . 5267 1 1709 . 1 1 180 180 LEU HD13 H 1 0.09 0.03 . 2 . . . . . . . . 5267 1 1710 . 1 1 180 180 LEU HD21 H 1 0.29 0.03 . 2 . . . . . . . . 5267 1 1711 . 1 1 180 180 LEU HD22 H 1 0.29 0.03 . 2 . . . . . . . . 5267 1 1712 . 1 1 180 180 LEU HD23 H 1 0.29 0.03 . 2 . . . . . . . . 5267 1 1713 . 1 1 180 180 LEU C C 13 176.14 0.20 . 1 . . . . . . . . 5267 1 1714 . 1 1 180 180 LEU CA C 13 53.99 0.20 . 1 . . . . . . . . 5267 1 1715 . 1 1 180 180 LEU CB C 13 41.41 0.20 . 1 . . . . . . . . 5267 1 1716 . 1 1 180 180 LEU CG C 13 26.38 0.20 . 1 . . . . . . . . 5267 1 1717 . 1 1 180 180 LEU CD1 C 13 25.74 0.20 . 2 . . . . . . . . 5267 1 1718 . 1 1 180 180 LEU CD2 C 13 23.10 0.20 . 2 . . . . . . . . 5267 1 1719 . 1 1 180 180 LEU N N 15 125.55 0.15 . 1 . . . . . . . . 5267 1 1720 . 1 1 181 181 SER H H 1 8.41 0.03 . 1 . . . . . . . . 5267 1 1721 . 1 1 181 181 SER HA H 1 4.67 0.03 . 1 . . . . . . . . 5267 1 1722 . 1 1 181 181 SER HB2 H 1 3.89 0.03 . 2 . . . . . . . . 5267 1 1723 . 1 1 181 181 SER HB3 H 1 3.83 0.03 . 2 . . . . . . . . 5267 1 1724 . 1 1 181 181 SER C C 13 175.25 0.20 . 1 . . . . . . . . 5267 1 1725 . 1 1 181 181 SER CA C 13 56.78 0.20 . 1 . . . . . . . . 5267 1 1726 . 1 1 181 181 SER CB C 13 61.84 0.20 . 1 . . . . . . . . 5267 1 1727 . 1 1 181 181 SER N N 15 123.91 0.15 . 1 . . . . . . . . 5267 1 1728 . 1 1 182 182 LEU H H 1 7.36 0.03 . 1 . . . . . . . . 5267 1 1729 . 1 1 182 182 LEU HA H 1 4.10 0.03 . 1 . . . . . . . . 5267 1 1730 . 1 1 182 182 LEU HB2 H 1 1.73 0.03 . 2 . . . . . . . . 5267 1 1731 . 1 1 182 182 LEU HB3 H 1 1.61 0.03 . 2 . . . . . . . . 5267 1 1732 . 1 1 182 182 LEU HG H 1 1.48 0.03 . 1 . . . . . . . . 5267 1 1733 . 1 1 182 182 LEU HD11 H 1 0.92 0.03 . 2 . . . . . . . . 5267 1 1734 . 1 1 182 182 LEU HD12 H 1 0.92 0.03 . 2 . . . . . . . . 5267 1 1735 . 1 1 182 182 LEU HD13 H 1 0.92 0.03 . 2 . . . . . . . . 5267 1 1736 . 1 1 182 182 LEU HD21 H 1 0.73 0.03 . 2 . . . . . . . . 5267 1 1737 . 1 1 182 182 LEU HD22 H 1 0.73 0.03 . 2 . . . . . . . . 5267 1 1738 . 1 1 182 182 LEU HD23 H 1 0.73 0.03 . 2 . . . . . . . . 5267 1 1739 . 1 1 182 182 LEU C C 13 177.20 0.20 . 1 . . . . . . . . 5267 1 1740 . 1 1 182 182 LEU CA C 13 55.93 0.20 . 1 . . . . . . . . 5267 1 1741 . 1 1 182 182 LEU CB C 13 42.00 0.20 . 1 . . . . . . . . 5267 1 1742 . 1 1 182 182 LEU CG C 13 26.29 0.20 . 1 . . . . . . . . 5267 1 1743 . 1 1 182 182 LEU CD1 C 13 25.84 0.20 . 2 . . . . . . . . 5267 1 1744 . 1 1 182 182 LEU CD2 C 13 23.45 0.20 . 2 . . . . . . . . 5267 1 1745 . 1 1 182 182 LEU N N 15 117.14 0.15 . 1 . . . . . . . . 5267 1 1746 . 1 1 183 183 GLY H H 1 8.03 0.03 . 1 . . . . . . . . 5267 1 1747 . 1 1 183 183 GLY HA2 H 1 4.08 0.03 . 2 . . . . . . . . 5267 1 1748 . 1 1 183 183 GLY HA3 H 1 3.77 0.03 . 2 . . . . . . . . 5267 1 1749 . 1 1 183 183 GLY C C 13 173.73 0.20 . 1 . . . . . . . . 5267 1 1750 . 1 1 183 183 GLY CA C 13 45.21 0.20 . 1 . . . . . . . . 5267 1 1751 . 1 1 183 183 GLY N N 15 103.13 0.15 . 1 . . . . . . . . 5267 1 1752 . 1 1 184 184 ASP H H 1 8.36 0.03 . 1 . . . . . . . . 5267 1 1753 . 1 1 184 184 ASP HA H 1 4.54 0.03 . 1 . . . . . . . . 5267 1 1754 . 1 1 184 184 ASP HB2 H 1 3.01 0.03 . 2 . . . . . . . . 5267 1 1755 . 1 1 184 184 ASP HB3 H 1 2.49 0.03 . 2 . . . . . . . . 5267 1 1756 . 1 1 184 184 ASP C C 13 174.58 0.20 . 1 . . . . . . . . 5267 1 1757 . 1 1 184 184 ASP CA C 13 55.00 0.20 . 1 . . . . . . . . 5267 1 1758 . 1 1 184 184 ASP CB C 13 41.75 0.20 . 1 . . . . . . . . 5267 1 1759 . 1 1 184 184 ASP N N 15 120.88 0.15 . 1 . . . . . . . . 5267 1 1760 . 1 1 185 185 GLU H H 1 8.18 0.03 . 1 . . . . . . . . 5267 1 1761 . 1 1 185 185 GLU CA C 13 55.00 0.20 . 1 . . . . . . . . 5267 1 1762 . 1 1 185 185 GLU CB C 13 30.35 0.20 . 1 . . . . . . . . 5267 1 1763 . 1 1 185 185 GLU N N 15 119.01 0.15 . 1 . . . . . . . . 5267 1 1764 . 1 1 186 186 PRO HA H 1 4.40 0.03 . 1 . . . . . . . . 5267 1 1765 . 1 1 186 186 PRO HB2 H 1 2.19 0.03 . 2 . . . . . . . . 5267 1 1766 . 1 1 186 186 PRO HB3 H 1 1.98 0.03 . 2 . . . . . . . . 5267 1 1767 . 1 1 186 186 PRO HG2 H 1 1.92 0.03 . 2 . . . . . . . . 5267 1 1768 . 1 1 186 186 PRO C C 13 175.18 0.20 . 1 . . . . . . . . 5267 1 1769 . 1 1 186 186 PRO CA C 13 63.78 0.20 . 1 . . . . . . . . 5267 1 1770 . 1 1 186 186 PRO CB C 13 32.13 0.20 . 1 . . . . . . . . 5267 1 1771 . 1 1 186 186 PRO CG C 13 27.40 0.20 . 1 . . . . . . . . 5267 1 1772 . 1 1 187 187 PHE H H 1 7.50 0.03 . 1 . . . . . . . . 5267 1 1773 . 1 1 187 187 PHE HA H 1 4.45 0.03 . 1 . . . . . . . . 5267 1 1774 . 1 1 187 187 PHE HB2 H 1 3.08 0.03 . 2 . . . . . . . . 5267 1 1775 . 1 1 187 187 PHE HB3 H 1 3.02 0.03 . 2 . . . . . . . . 5267 1 1776 . 1 1 187 187 PHE CA C 13 59.22 0.20 . 1 . . . . . . . . 5267 1 1777 . 1 1 187 187 PHE CB C 13 40.65 0.20 . 1 . . . . . . . . 5267 1 1778 . 1 1 187 187 PHE N N 15 123.21 0.15 . 1 . . . . . . . . 5267 1 stop_ save_