data_53440 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 53440 _Entry.Title ; Bevacizumab-Fab ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2025-11-24 _Entry.Accession_date 2025-11-24 _Entry.Last_release_date 2025-11-24 _Entry.Original_release_date 2025-11-24 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _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.ORCID _Entry_author.Entry_ID 1 Donald Gagne . . . 0000-0002-3938-6567 53440 2 Yves Aubin . . . 0000-0002-8554-0297 53440 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Centre for Oncology, Radiopharmaceuticals and Research, Biologics and Radiotherapeutic Drugs Directorate' . 53440 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 53440 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 1360 53440 '15N chemical shifts' 378 53440 '1H chemical shifts' 966 53440 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 . . 2026-03-31 . original BMRB . 53440 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 53440 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID . _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Differential labelling of Fab fragments from therapeutic monoclonal antibodies in Escherichia coli allows complete NMR assignment of backbone and side-chain methyl resonances ; _Citation.Status submitted _Citation.Type journal _Citation.Journal_abbrev 'Nat. Methods' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Donald Gagne . . . . 53440 1 2 Yves Aubin . . . . 53440 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Escherichia coli' 53440 1 'Fab and Fc' 53440 1 'Monoclonal antibody' 53440 1 'NMR spectroscopy' 53440 1 bevacizumab 53440 1 'fragment antigen binding' 53440 1 infliximab 53440 1 'protein refolding' 53440 1 rituximab 53440 1 trastuzumab 53440 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 53440 _Assembly.ID 1 _Assembly.Name Bevacizumab-Fab _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds yes _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 48462 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 HCfab 1 $entity_1 . . yes native no no . . . 53440 1 2 LC 2 $entity_2 . . yes native no no . . . 53440 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_asym_ID_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_asym_ID_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 227 227 SG . 2 . 2 CYS 215 215 SG . . . . . . . . . . . . 53440 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 53440 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _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 ; MEVQLVESGGGLVQPGGSLR LSCAASGYTFTNYGMNWVRQ APGKGLEWVGWINTYTGEPT YAADFKRRFTFSLDTSKSTA YLQMNSLRAEDTAVYYCAKY PHYYGSSHWYFDVWGQGTLV TVSSASTKGPSVFPLAPSSK STSGGTAALGCLVKDYFPEP VTVSWNSGALTSGVHTFPAV LQSSGLYSLSSVVTVPSSSL GTQTYICNVNHKPSNTKVDK KVEPKSCDKTH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq '0M, 1E, 2V' _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 231 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details Biopolymer _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 0 MET . 53440 1 2 1 GLU . 53440 1 3 2 VAL . 53440 1 4 3 GLN . 53440 1 5 4 LEU . 53440 1 6 5 VAL . 53440 1 7 6 GLU . 53440 1 8 7 SER . 53440 1 9 8 GLY . 53440 1 10 9 GLY . 53440 1 11 10 GLY . 53440 1 12 11 LEU . 53440 1 13 12 VAL . 53440 1 14 13 GLN . 53440 1 15 14 PRO . 53440 1 16 15 GLY . 53440 1 17 16 GLY . 53440 1 18 17 SER . 53440 1 19 18 LEU . 53440 1 20 19 ARG . 53440 1 21 20 LEU . 53440 1 22 21 SER . 53440 1 23 22 CYS . 53440 1 24 23 ALA . 53440 1 25 24 ALA . 53440 1 26 25 SER . 53440 1 27 26 GLY . 53440 1 28 27 TYR . 53440 1 29 28 THR . 53440 1 30 29 PHE . 53440 1 31 30 THR . 53440 1 32 31 ASN . 53440 1 33 32 TYR . 53440 1 34 33 GLY . 53440 1 35 34 MET . 53440 1 36 35 ASN . 53440 1 37 36 TRP . 53440 1 38 37 VAL . 53440 1 39 38 ARG . 53440 1 40 39 GLN . 53440 1 41 40 ALA . 53440 1 42 41 PRO . 53440 1 43 42 GLY . 53440 1 44 43 LYS . 53440 1 45 44 GLY . 53440 1 46 45 LEU . 53440 1 47 46 GLU . 53440 1 48 47 TRP . 53440 1 49 48 VAL . 53440 1 50 49 GLY . 53440 1 51 50 TRP . 53440 1 52 51 ILE . 53440 1 53 52 ASN . 53440 1 54 53 THR . 53440 1 55 54 TYR . 53440 1 56 55 THR . 53440 1 57 56 GLY . 53440 1 58 57 GLU . 53440 1 59 58 PRO . 53440 1 60 59 THR . 53440 1 61 60 TYR . 53440 1 62 61 ALA . 53440 1 63 62 ALA . 53440 1 64 63 ASP . 53440 1 65 64 PHE . 53440 1 66 65 LYS . 53440 1 67 66 ARG . 53440 1 68 67 ARG . 53440 1 69 68 PHE . 53440 1 70 69 THR . 53440 1 71 70 PHE . 53440 1 72 71 SER . 53440 1 73 72 LEU . 53440 1 74 73 ASP . 53440 1 75 74 THR . 53440 1 76 75 SER . 53440 1 77 76 LYS . 53440 1 78 77 SER . 53440 1 79 78 THR . 53440 1 80 79 ALA . 53440 1 81 80 TYR . 53440 1 82 81 LEU . 53440 1 83 82 GLN . 53440 1 84 83 MET . 53440 1 85 84 ASN . 53440 1 86 85 SER . 53440 1 87 86 LEU . 53440 1 88 87 ARG . 53440 1 89 88 ALA . 53440 1 90 89 GLU . 53440 1 91 90 ASP . 53440 1 92 91 THR . 53440 1 93 92 ALA . 53440 1 94 93 VAL . 53440 1 95 94 TYR . 53440 1 96 95 TYR . 53440 1 97 96 CYS . 53440 1 98 97 ALA . 53440 1 99 98 LYS . 53440 1 100 99 TYR . 53440 1 101 100 PRO . 53440 1 102 101 HIS . 53440 1 103 102 TYR . 53440 1 104 103 TYR . 53440 1 105 104 GLY . 53440 1 106 105 SER . 53440 1 107 106 SER . 53440 1 108 107 HIS . 53440 1 109 108 TRP . 53440 1 110 109 TYR . 53440 1 111 110 PHE . 53440 1 112 111 ASP . 53440 1 113 112 VAL . 53440 1 114 113 TRP . 53440 1 115 114 GLY . 53440 1 116 115 GLN . 53440 1 117 116 GLY . 53440 1 118 117 THR . 53440 1 119 118 LEU . 53440 1 120 119 VAL . 53440 1 121 120 THR . 53440 1 122 121 VAL . 53440 1 123 122 SER . 53440 1 124 123 SER . 53440 1 125 124 ALA . 53440 1 126 125 SER . 53440 1 127 126 THR . 53440 1 128 127 LYS . 53440 1 129 128 GLY . 53440 1 130 129 PRO . 53440 1 131 130 SER . 53440 1 132 131 VAL . 53440 1 133 132 PHE . 53440 1 134 133 PRO . 53440 1 135 134 LEU . 53440 1 136 135 ALA . 53440 1 137 136 PRO . 53440 1 138 137 SER . 53440 1 139 138 SER . 53440 1 140 139 LYS . 53440 1 141 140 SER . 53440 1 142 141 THR . 53440 1 143 142 SER . 53440 1 144 143 GLY . 53440 1 145 144 GLY . 53440 1 146 145 THR . 53440 1 147 146 ALA . 53440 1 148 147 ALA . 53440 1 149 148 LEU . 53440 1 150 149 GLY . 53440 1 151 150 CYS . 53440 1 152 151 LEU . 53440 1 153 152 VAL . 53440 1 154 153 LYS . 53440 1 155 154 ASP . 53440 1 156 155 TYR . 53440 1 157 156 PHE . 53440 1 158 157 PRO . 53440 1 159 158 GLU . 53440 1 160 159 PRO . 53440 1 161 160 VAL . 53440 1 162 161 THR . 53440 1 163 162 VAL . 53440 1 164 163 SER . 53440 1 165 164 TRP . 53440 1 166 165 ASN . 53440 1 167 166 SER . 53440 1 168 167 GLY . 53440 1 169 168 ALA . 53440 1 170 169 LEU . 53440 1 171 170 THR . 53440 1 172 171 SER . 53440 1 173 172 GLY . 53440 1 174 173 VAL . 53440 1 175 174 HIS . 53440 1 176 175 THR . 53440 1 177 176 PHE . 53440 1 178 177 PRO . 53440 1 179 178 ALA . 53440 1 180 179 VAL . 53440 1 181 180 LEU . 53440 1 182 181 GLN . 53440 1 183 182 SER . 53440 1 184 183 SER . 53440 1 185 184 GLY . 53440 1 186 185 LEU . 53440 1 187 186 TYR . 53440 1 188 187 SER . 53440 1 189 188 LEU . 53440 1 190 189 SER . 53440 1 191 190 SER . 53440 1 192 191 VAL . 53440 1 193 192 VAL . 53440 1 194 193 THR . 53440 1 195 194 VAL . 53440 1 196 195 PRO . 53440 1 197 196 SER . 53440 1 198 197 SER . 53440 1 199 198 SER . 53440 1 200 199 LEU . 53440 1 201 200 GLY . 53440 1 202 201 THR . 53440 1 203 202 GLN . 53440 1 204 203 THR . 53440 1 205 204 TYR . 53440 1 206 205 ILE . 53440 1 207 206 CYS . 53440 1 208 207 ASN . 53440 1 209 208 VAL . 53440 1 210 209 ASN . 53440 1 211 210 HIS . 53440 1 212 211 LYS . 53440 1 213 212 PRO . 53440 1 214 213 SER . 53440 1 215 214 ASN . 53440 1 216 215 THR . 53440 1 217 216 LYS . 53440 1 218 217 VAL . 53440 1 219 218 ASP . 53440 1 220 219 LYS . 53440 1 221 220 LYS . 53440 1 222 221 VAL . 53440 1 223 222 GLU . 53440 1 224 223 PRO . 53440 1 225 224 LYS . 53440 1 226 225 SER . 53440 1 227 226 CYS . 53440 1 228 227 ASP . 53440 1 229 228 LYS . 53440 1 230 229 THR . 53440 1 231 230 HIS . 53440 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 53440 1 . GLU 2 2 53440 1 . VAL 3 3 53440 1 . GLN 4 4 53440 1 . LEU 5 5 53440 1 . VAL 6 6 53440 1 . GLU 7 7 53440 1 . SER 8 8 53440 1 . GLY 9 9 53440 1 . GLY 10 10 53440 1 . GLY 11 11 53440 1 . LEU 12 12 53440 1 . VAL 13 13 53440 1 . GLN 14 14 53440 1 . PRO 15 15 53440 1 . GLY 16 16 53440 1 . GLY 17 17 53440 1 . SER 18 18 53440 1 . LEU 19 19 53440 1 . ARG 20 20 53440 1 . LEU 21 21 53440 1 . SER 22 22 53440 1 . CYS 23 23 53440 1 . ALA 24 24 53440 1 . ALA 25 25 53440 1 . SER 26 26 53440 1 . GLY 27 27 53440 1 . TYR 28 28 53440 1 . THR 29 29 53440 1 . PHE 30 30 53440 1 . THR 31 31 53440 1 . ASN 32 32 53440 1 . TYR 33 33 53440 1 . GLY 34 34 53440 1 . MET 35 35 53440 1 . ASN 36 36 53440 1 . TRP 37 37 53440 1 . VAL 38 38 53440 1 . ARG 39 39 53440 1 . GLN 40 40 53440 1 . ALA 41 41 53440 1 . PRO 42 42 53440 1 . GLY 43 43 53440 1 . LYS 44 44 53440 1 . GLY 45 45 53440 1 . LEU 46 46 53440 1 . GLU 47 47 53440 1 . TRP 48 48 53440 1 . VAL 49 49 53440 1 . GLY 50 50 53440 1 . TRP 51 51 53440 1 . ILE 52 52 53440 1 . ASN 53 53 53440 1 . THR 54 54 53440 1 . TYR 55 55 53440 1 . THR 56 56 53440 1 . GLY 57 57 53440 1 . GLU 58 58 53440 1 . PRO 59 59 53440 1 . THR 60 60 53440 1 . TYR 61 61 53440 1 . ALA 62 62 53440 1 . ALA 63 63 53440 1 . ASP 64 64 53440 1 . PHE 65 65 53440 1 . LYS 66 66 53440 1 . ARG 67 67 53440 1 . ARG 68 68 53440 1 . PHE 69 69 53440 1 . THR 70 70 53440 1 . PHE 71 71 53440 1 . SER 72 72 53440 1 . LEU 73 73 53440 1 . ASP 74 74 53440 1 . THR 75 75 53440 1 . SER 76 76 53440 1 . LYS 77 77 53440 1 . SER 78 78 53440 1 . THR 79 79 53440 1 . ALA 80 80 53440 1 . TYR 81 81 53440 1 . LEU 82 82 53440 1 . GLN 83 83 53440 1 . MET 84 84 53440 1 . ASN 85 85 53440 1 . SER 86 86 53440 1 . LEU 87 87 53440 1 . ARG 88 88 53440 1 . ALA 89 89 53440 1 . GLU 90 90 53440 1 . ASP 91 91 53440 1 . THR 92 92 53440 1 . ALA 93 93 53440 1 . VAL 94 94 53440 1 . TYR 95 95 53440 1 . TYR 96 96 53440 1 . CYS 97 97 53440 1 . ALA 98 98 53440 1 . LYS 99 99 53440 1 . TYR 100 100 53440 1 . PRO 101 101 53440 1 . HIS 102 102 53440 1 . TYR 103 103 53440 1 . TYR 104 104 53440 1 . GLY 105 105 53440 1 . SER 106 106 53440 1 . SER 107 107 53440 1 . HIS 108 108 53440 1 . TRP 109 109 53440 1 . TYR 110 110 53440 1 . PHE 111 111 53440 1 . ASP 112 112 53440 1 . VAL 113 113 53440 1 . TRP 114 114 53440 1 . GLY 115 115 53440 1 . GLN 116 116 53440 1 . GLY 117 117 53440 1 . THR 118 118 53440 1 . LEU 119 119 53440 1 . VAL 120 120 53440 1 . THR 121 121 53440 1 . VAL 122 122 53440 1 . SER 123 123 53440 1 . SER 124 124 53440 1 . ALA 125 125 53440 1 . SER 126 126 53440 1 . THR 127 127 53440 1 . LYS 128 128 53440 1 . GLY 129 129 53440 1 . PRO 130 130 53440 1 . SER 131 131 53440 1 . VAL 132 132 53440 1 . PHE 133 133 53440 1 . PRO 134 134 53440 1 . LEU 135 135 53440 1 . ALA 136 136 53440 1 . PRO 137 137 53440 1 . SER 138 138 53440 1 . SER 139 139 53440 1 . LYS 140 140 53440 1 . SER 141 141 53440 1 . THR 142 142 53440 1 . SER 143 143 53440 1 . GLY 144 144 53440 1 . GLY 145 145 53440 1 . THR 146 146 53440 1 . ALA 147 147 53440 1 . ALA 148 148 53440 1 . LEU 149 149 53440 1 . GLY 150 150 53440 1 . CYS 151 151 53440 1 . LEU 152 152 53440 1 . VAL 153 153 53440 1 . LYS 154 154 53440 1 . ASP 155 155 53440 1 . TYR 156 156 53440 1 . PHE 157 157 53440 1 . PRO 158 158 53440 1 . GLU 159 159 53440 1 . PRO 160 160 53440 1 . VAL 161 161 53440 1 . THR 162 162 53440 1 . VAL 163 163 53440 1 . SER 164 164 53440 1 . TRP 165 165 53440 1 . ASN 166 166 53440 1 . SER 167 167 53440 1 . GLY 168 168 53440 1 . ALA 169 169 53440 1 . LEU 170 170 53440 1 . THR 171 171 53440 1 . SER 172 172 53440 1 . GLY 173 173 53440 1 . VAL 174 174 53440 1 . HIS 175 175 53440 1 . THR 176 176 53440 1 . PHE 177 177 53440 1 . PRO 178 178 53440 1 . ALA 179 179 53440 1 . VAL 180 180 53440 1 . LEU 181 181 53440 1 . GLN 182 182 53440 1 . SER 183 183 53440 1 . SER 184 184 53440 1 . GLY 185 185 53440 1 . LEU 186 186 53440 1 . TYR 187 187 53440 1 . SER 188 188 53440 1 . LEU 189 189 53440 1 . SER 190 190 53440 1 . SER 191 191 53440 1 . VAL 192 192 53440 1 . VAL 193 193 53440 1 . THR 194 194 53440 1 . VAL 195 195 53440 1 . PRO 196 196 53440 1 . SER 197 197 53440 1 . SER 198 198 53440 1 . SER 199 199 53440 1 . LEU 200 200 53440 1 . GLY 201 201 53440 1 . THR 202 202 53440 1 . GLN 203 203 53440 1 . THR 204 204 53440 1 . TYR 205 205 53440 1 . ILE 206 206 53440 1 . CYS 207 207 53440 1 . ASN 208 208 53440 1 . VAL 209 209 53440 1 . ASN 210 210 53440 1 . HIS 211 211 53440 1 . LYS 212 212 53440 1 . PRO 213 213 53440 1 . SER 214 214 53440 1 . ASN 215 215 53440 1 . THR 216 216 53440 1 . LYS 217 217 53440 1 . VAL 218 218 53440 1 . ASP 219 219 53440 1 . LYS 220 220 53440 1 . LYS 221 221 53440 1 . VAL 222 222 53440 1 . GLU 223 223 53440 1 . PRO 224 224 53440 1 . LYS 225 225 53440 1 . SER 226 226 53440 1 . CYS 227 227 53440 1 . ASP 228 228 53440 1 . LYS 229 229 53440 1 . THR 230 230 53440 1 . HIS 231 231 53440 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 53440 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _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 ; MDIQMTQSPSSLSASVGDRV TITCSASQDISNYLNWYQQK PGKAPKVLIYFTSSLHSGVP SRFSGSGSGTDFTLTISSLQ PEDFATYYCQQYSTVPWTFG QGTKVEIKRTVAAPSVFIFP PSDEQLKSGTASVVCLLNNF YPREAKVQWKVDNALQSGNS QESVTEQDSKDSTYSLSSTL TLSKADYEKHKVYACEVTHQ GLSSPVTKSFNRGEC ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq '0M, 1D, 2I' _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 215 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details Biopolymer _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 0 MET . 53440 2 2 1 ASP . 53440 2 3 2 ILE . 53440 2 4 3 GLN . 53440 2 5 4 MET . 53440 2 6 5 THR . 53440 2 7 6 GLN . 53440 2 8 7 SER . 53440 2 9 8 PRO . 53440 2 10 9 SER . 53440 2 11 10 SER . 53440 2 12 11 LEU . 53440 2 13 12 SER . 53440 2 14 13 ALA . 53440 2 15 14 SER . 53440 2 16 15 VAL . 53440 2 17 16 GLY . 53440 2 18 17 ASP . 53440 2 19 18 ARG . 53440 2 20 19 VAL . 53440 2 21 20 THR . 53440 2 22 21 ILE . 53440 2 23 22 THR . 53440 2 24 23 CYS . 53440 2 25 24 SER . 53440 2 26 25 ALA . 53440 2 27 26 SER . 53440 2 28 27 GLN . 53440 2 29 28 ASP . 53440 2 30 29 ILE . 53440 2 31 30 SER . 53440 2 32 31 ASN . 53440 2 33 32 TYR . 53440 2 34 33 LEU . 53440 2 35 34 ASN . 53440 2 36 35 TRP . 53440 2 37 36 TYR . 53440 2 38 37 GLN . 53440 2 39 38 GLN . 53440 2 40 39 LYS . 53440 2 41 40 PRO . 53440 2 42 41 GLY . 53440 2 43 42 LYS . 53440 2 44 43 ALA . 53440 2 45 44 PRO . 53440 2 46 45 LYS . 53440 2 47 46 VAL . 53440 2 48 47 LEU . 53440 2 49 48 ILE . 53440 2 50 49 TYR . 53440 2 51 50 PHE . 53440 2 52 51 THR . 53440 2 53 52 SER . 53440 2 54 53 SER . 53440 2 55 54 LEU . 53440 2 56 55 HIS . 53440 2 57 56 SER . 53440 2 58 57 GLY . 53440 2 59 58 VAL . 53440 2 60 59 PRO . 53440 2 61 60 SER . 53440 2 62 61 ARG . 53440 2 63 62 PHE . 53440 2 64 63 SER . 53440 2 65 64 GLY . 53440 2 66 65 SER . 53440 2 67 66 GLY . 53440 2 68 67 SER . 53440 2 69 68 GLY . 53440 2 70 69 THR . 53440 2 71 70 ASP . 53440 2 72 71 PHE . 53440 2 73 72 THR . 53440 2 74 73 LEU . 53440 2 75 74 THR . 53440 2 76 75 ILE . 53440 2 77 76 SER . 53440 2 78 77 SER . 53440 2 79 78 LEU . 53440 2 80 79 GLN . 53440 2 81 80 PRO . 53440 2 82 81 GLU . 53440 2 83 82 ASP . 53440 2 84 83 PHE . 53440 2 85 84 ALA . 53440 2 86 85 THR . 53440 2 87 86 TYR . 53440 2 88 87 TYR . 53440 2 89 88 CYS . 53440 2 90 89 GLN . 53440 2 91 90 GLN . 53440 2 92 91 TYR . 53440 2 93 92 SER . 53440 2 94 93 THR . 53440 2 95 94 VAL . 53440 2 96 95 PRO . 53440 2 97 96 TRP . 53440 2 98 97 THR . 53440 2 99 98 PHE . 53440 2 100 99 GLY . 53440 2 101 100 GLN . 53440 2 102 101 GLY . 53440 2 103 102 THR . 53440 2 104 103 LYS . 53440 2 105 104 VAL . 53440 2 106 105 GLU . 53440 2 107 106 ILE . 53440 2 108 107 LYS . 53440 2 109 108 ARG . 53440 2 110 109 THR . 53440 2 111 110 VAL . 53440 2 112 111 ALA . 53440 2 113 112 ALA . 53440 2 114 113 PRO . 53440 2 115 114 SER . 53440 2 116 115 VAL . 53440 2 117 116 PHE . 53440 2 118 117 ILE . 53440 2 119 118 PHE . 53440 2 120 119 PRO . 53440 2 121 120 PRO . 53440 2 122 121 SER . 53440 2 123 122 ASP . 53440 2 124 123 GLU . 53440 2 125 124 GLN . 53440 2 126 125 LEU . 53440 2 127 126 LYS . 53440 2 128 127 SER . 53440 2 129 128 GLY . 53440 2 130 129 THR . 53440 2 131 130 ALA . 53440 2 132 131 SER . 53440 2 133 132 VAL . 53440 2 134 133 VAL . 53440 2 135 134 CYS . 53440 2 136 135 LEU . 53440 2 137 136 LEU . 53440 2 138 137 ASN . 53440 2 139 138 ASN . 53440 2 140 139 PHE . 53440 2 141 140 TYR . 53440 2 142 141 PRO . 53440 2 143 142 ARG . 53440 2 144 143 GLU . 53440 2 145 144 ALA . 53440 2 146 145 LYS . 53440 2 147 146 VAL . 53440 2 148 147 GLN . 53440 2 149 148 TRP . 53440 2 150 149 LYS . 53440 2 151 150 VAL . 53440 2 152 151 ASP . 53440 2 153 152 ASN . 53440 2 154 153 ALA . 53440 2 155 154 LEU . 53440 2 156 155 GLN . 53440 2 157 156 SER . 53440 2 158 157 GLY . 53440 2 159 158 ASN . 53440 2 160 159 SER . 53440 2 161 160 GLN . 53440 2 162 161 GLU . 53440 2 163 162 SER . 53440 2 164 163 VAL . 53440 2 165 164 THR . 53440 2 166 165 GLU . 53440 2 167 166 GLN . 53440 2 168 167 ASP . 53440 2 169 168 SER . 53440 2 170 169 LYS . 53440 2 171 170 ASP . 53440 2 172 171 SER . 53440 2 173 172 THR . 53440 2 174 173 TYR . 53440 2 175 174 SER . 53440 2 176 175 LEU . 53440 2 177 176 SER . 53440 2 178 177 SER . 53440 2 179 178 THR . 53440 2 180 179 LEU . 53440 2 181 180 THR . 53440 2 182 181 LEU . 53440 2 183 182 SER . 53440 2 184 183 LYS . 53440 2 185 184 ALA . 53440 2 186 185 ASP . 53440 2 187 186 TYR . 53440 2 188 187 GLU . 53440 2 189 188 LYS . 53440 2 190 189 HIS . 53440 2 191 190 LYS . 53440 2 192 191 VAL . 53440 2 193 192 TYR . 53440 2 194 193 ALA . 53440 2 195 194 CYS . 53440 2 196 195 GLU . 53440 2 197 196 VAL . 53440 2 198 197 THR . 53440 2 199 198 HIS . 53440 2 200 199 GLN . 53440 2 201 200 GLY . 53440 2 202 201 LEU . 53440 2 203 202 SER . 53440 2 204 203 SER . 53440 2 205 204 PRO . 53440 2 206 205 VAL . 53440 2 207 206 THR . 53440 2 208 207 LYS . 53440 2 209 208 SER . 53440 2 210 209 PHE . 53440 2 211 210 ASN . 53440 2 212 211 ARG . 53440 2 213 212 GLY . 53440 2 214 213 GLU . 53440 2 215 214 CYS . 53440 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 53440 2 . ASP 2 2 53440 2 . ILE 3 3 53440 2 . GLN 4 4 53440 2 . MET 5 5 53440 2 . THR 6 6 53440 2 . GLN 7 7 53440 2 . SER 8 8 53440 2 . PRO 9 9 53440 2 . SER 10 10 53440 2 . SER 11 11 53440 2 . LEU 12 12 53440 2 . SER 13 13 53440 2 . ALA 14 14 53440 2 . SER 15 15 53440 2 . VAL 16 16 53440 2 . GLY 17 17 53440 2 . ASP 18 18 53440 2 . ARG 19 19 53440 2 . VAL 20 20 53440 2 . THR 21 21 53440 2 . ILE 22 22 53440 2 . THR 23 23 53440 2 . CYS 24 24 53440 2 . SER 25 25 53440 2 . ALA 26 26 53440 2 . SER 27 27 53440 2 . GLN 28 28 53440 2 . ASP 29 29 53440 2 . ILE 30 30 53440 2 . SER 31 31 53440 2 . ASN 32 32 53440 2 . TYR 33 33 53440 2 . LEU 34 34 53440 2 . ASN 35 35 53440 2 . TRP 36 36 53440 2 . TYR 37 37 53440 2 . GLN 38 38 53440 2 . GLN 39 39 53440 2 . LYS 40 40 53440 2 . PRO 41 41 53440 2 . GLY 42 42 53440 2 . LYS 43 43 53440 2 . ALA 44 44 53440 2 . PRO 45 45 53440 2 . LYS 46 46 53440 2 . VAL 47 47 53440 2 . LEU 48 48 53440 2 . ILE 49 49 53440 2 . TYR 50 50 53440 2 . PHE 51 51 53440 2 . THR 52 52 53440 2 . SER 53 53 53440 2 . SER 54 54 53440 2 . LEU 55 55 53440 2 . HIS 56 56 53440 2 . SER 57 57 53440 2 . GLY 58 58 53440 2 . VAL 59 59 53440 2 . PRO 60 60 53440 2 . SER 61 61 53440 2 . ARG 62 62 53440 2 . PHE 63 63 53440 2 . SER 64 64 53440 2 . GLY 65 65 53440 2 . SER 66 66 53440 2 . GLY 67 67 53440 2 . SER 68 68 53440 2 . GLY 69 69 53440 2 . THR 70 70 53440 2 . ASP 71 71 53440 2 . PHE 72 72 53440 2 . THR 73 73 53440 2 . LEU 74 74 53440 2 . THR 75 75 53440 2 . ILE 76 76 53440 2 . SER 77 77 53440 2 . SER 78 78 53440 2 . LEU 79 79 53440 2 . GLN 80 80 53440 2 . PRO 81 81 53440 2 . GLU 82 82 53440 2 . ASP 83 83 53440 2 . PHE 84 84 53440 2 . ALA 85 85 53440 2 . THR 86 86 53440 2 . TYR 87 87 53440 2 . TYR 88 88 53440 2 . CYS 89 89 53440 2 . GLN 90 90 53440 2 . GLN 91 91 53440 2 . TYR 92 92 53440 2 . SER 93 93 53440 2 . THR 94 94 53440 2 . VAL 95 95 53440 2 . PRO 96 96 53440 2 . TRP 97 97 53440 2 . THR 98 98 53440 2 . PHE 99 99 53440 2 . GLY 100 100 53440 2 . GLN 101 101 53440 2 . GLY 102 102 53440 2 . THR 103 103 53440 2 . LYS 104 104 53440 2 . VAL 105 105 53440 2 . GLU 106 106 53440 2 . ILE 107 107 53440 2 . LYS 108 108 53440 2 . ARG 109 109 53440 2 . THR 110 110 53440 2 . VAL 111 111 53440 2 . ALA 112 112 53440 2 . ALA 113 113 53440 2 . PRO 114 114 53440 2 . SER 115 115 53440 2 . VAL 116 116 53440 2 . PHE 117 117 53440 2 . ILE 118 118 53440 2 . PHE 119 119 53440 2 . PRO 120 120 53440 2 . PRO 121 121 53440 2 . SER 122 122 53440 2 . ASP 123 123 53440 2 . GLU 124 124 53440 2 . GLN 125 125 53440 2 . LEU 126 126 53440 2 . LYS 127 127 53440 2 . SER 128 128 53440 2 . GLY 129 129 53440 2 . THR 130 130 53440 2 . ALA 131 131 53440 2 . SER 132 132 53440 2 . VAL 133 133 53440 2 . VAL 134 134 53440 2 . CYS 135 135 53440 2 . LEU 136 136 53440 2 . LEU 137 137 53440 2 . ASN 138 138 53440 2 . ASN 139 139 53440 2 . PHE 140 140 53440 2 . TYR 141 141 53440 2 . PRO 142 142 53440 2 . ARG 143 143 53440 2 . GLU 144 144 53440 2 . ALA 145 145 53440 2 . LYS 146 146 53440 2 . VAL 147 147 53440 2 . GLN 148 148 53440 2 . TRP 149 149 53440 2 . LYS 150 150 53440 2 . VAL 151 151 53440 2 . ASP 152 152 53440 2 . ASN 153 153 53440 2 . ALA 154 154 53440 2 . LEU 155 155 53440 2 . GLN 156 156 53440 2 . SER 157 157 53440 2 . GLY 158 158 53440 2 . ASN 159 159 53440 2 . SER 160 160 53440 2 . GLN 161 161 53440 2 . GLU 162 162 53440 2 . SER 163 163 53440 2 . VAL 164 164 53440 2 . THR 165 165 53440 2 . GLU 166 166 53440 2 . GLN 167 167 53440 2 . ASP 168 168 53440 2 . SER 169 169 53440 2 . LYS 170 170 53440 2 . ASP 171 171 53440 2 . SER 172 172 53440 2 . THR 173 173 53440 2 . TYR 174 174 53440 2 . SER 175 175 53440 2 . LEU 176 176 53440 2 . SER 177 177 53440 2 . SER 178 178 53440 2 . THR 179 179 53440 2 . LEU 180 180 53440 2 . THR 181 181 53440 2 . LEU 182 182 53440 2 . SER 183 183 53440 2 . LYS 184 184 53440 2 . ALA 185 185 53440 2 . ASP 186 186 53440 2 . TYR 187 187 53440 2 . GLU 188 188 53440 2 . LYS 189 189 53440 2 . HIS 190 190 53440 2 . LYS 191 191 53440 2 . VAL 192 192 53440 2 . TYR 193 193 53440 2 . ALA 194 194 53440 2 . CYS 195 195 53440 2 . GLU 196 196 53440 2 . VAL 197 197 53440 2 . THR 198 198 53440 2 . HIS 199 199 53440 2 . GLN 200 200 53440 2 . GLY 201 201 53440 2 . LEU 202 202 53440 2 . SER 203 203 53440 2 . SER 204 204 53440 2 . PRO 205 205 53440 2 . VAL 206 206 53440 2 . THR 207 207 53440 2 . LYS 208 208 53440 2 . SER 209 209 53440 2 . PHE 210 210 53440 2 . ASN 211 211 53440 2 . ARG 212 212 53440 2 . GLY 213 213 53440 2 . GLU 214 214 53440 2 . CYS 215 215 53440 2 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 53440 _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . . . 53440 1 2 2 $entity_2 . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . . . 53440 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 53440 _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pET11a . . . 53440 1 2 2 $entity_2 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pET11a . . . 53440 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 53440 _Sample.ID 1 _Sample.Name Bevacizumab-Fab _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Four versions of Bevacizumab-Fab were prepared to complete the resonance assignment. All data were acquired for each sample. HCfab: fab fragment of the Heavy Chain LC: Light Chain Sample 1: ILV-HCfab labeled with 2H13C-Glucose and refolded with Natural Abundance LC. ; _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 HCfab '[U-13C; U-15N; U-2H; 99% 1HD-Ile,Leu; 99% 1HG-Val]' . . 1 $entity_1 . . . . . mM . . . . 53440 1 2 LC 'natural abundance' . . 2 $entity_2 . . . . . mM . . . . 53440 1 3 'ammonium acetate' 'natural abundance' . . . . . . 20 . . mM . . . . 53440 1 4 DSS 'natural abundance' . . . . . . 5 . . mM . . . . 53440 1 5 D2O [U-2H] . . . . . . 5 . . % . . . . 53440 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 53440 _Sample.ID 2 _Sample.Name Bevacizumab-Fab _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Four versions of Bevacizumab-Fab were prepared to complete the resonance assignment. All data were acquired for each sample. HCfab: fab fragment of the Heavy Chain LC: Light Chain Sample 2: AILTV-HCfab labeled with 1H13C-Glucose and refolded with Natural Abundance LC. ; _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 HCfab '[U-13C; U-15N; U-2H; 99% 1HD-Ile,Leu; 99% 1HG-Val]' . . 1 $entity_1 . . . . . mM . . . . 53440 2 2 LC 'natural abundance' . . 2 $entity_2 . . . . . mM . . . . 53440 2 3 'ammonium acetate' 'natural abundance' . . . . . . 20 . . mM . . . . 53440 2 4 DSS 'natural abundance' . . . . . . 5 . . mM . . . . 53440 2 5 D2O [U-2H] . . . . . . 5 . . % . . . . 53440 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 53440 _Sample.ID 3 _Sample.Name Bevacizumab-Fab _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Four versions of Bevacizumab-Fab were prepared to complete the resonance assignment. All data were acquired for each sample. HCfab: fab fragment of the Heavy Chain LC: Light Chain Sample 3: ILV-LC labeled with 2H13C-Glucose and refolded with Natural Abundance HCfab. ; _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 HCfab 'natural abundance' . . 1 $entity_1 . . . . . mM . . . . 53440 3 2 LC '[U-13C; U-15N; U-2H; 99% 1HD-Ile,Leu; 99% 1HG-Val]' . . 2 $entity_2 . . . . . mM . . . . 53440 3 3 'ammonium acetate' 'natural abundance' . . . . . . 20 . . mM . . . . 53440 3 4 DSS 'natural abundance' . . . . . . 5 . . mM . . . . 53440 3 5 D2O [U-2H] . . . . . . 5 . . % . . . . 53440 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 53440 _Sample.ID 4 _Sample.Name Bevacizumab-Fab _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Four versions of Bevacizumab-Fab were prepared to complete the resonance assignment. All data were acquired for each sample. HCfab: fab fragment of the Heavy Chain LC: Light Chain Sample 4: AILTV-LC labeled with 1H13C-Glucose and refolded with Natural Abundance HCfab. ; _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 HCfab 'natural abundance' . . 1 $entity_1 . . . . . mM . . . . 53440 4 2 LC '[U-13C; U-15N; U-2H; 99% 1HD-Ile,Leu; 99% 1HG-Val]' . . 2 $entity_2 . . . . . mM . . . . 53440 4 3 'ammonium acetate' 'natural abundance' . . . . . . 20 . . mM . . . . 53440 4 4 DSS 'natural abundance' . . . . . . 5 . . mM . . . . 53440 4 5 D2O [U-2H] . . . . . . 5 . . % . . . . 53440 4 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 53440 _Sample_condition_list.ID 1 _Sample_condition_list.Name Sample_condition_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 5.0 . pH 53440 1 temperature 313 . K 53440 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 53440 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 53440 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 53440 _Software.ID 2 _Software.Type . _Software.Name NMRViewJ _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 53440 2 'data analysis' . 53440 2 'peak picking' . 53440 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 53440 _Software.ID 3 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 53440 3 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 53440 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name '700 MHz Spectrometer' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 53440 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name '600 MHz Spectrometer' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 53440 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53440 1 2 '2D 1H-15N TROSY' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53440 1 3 '2D 1H-13C HSQC' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53440 1 4 '3D HNCO' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53440 1 5 '3D HNCACO' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53440 1 6 '3D HNCA' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53440 1 7 '3D HN(CO)CA' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53440 1 8 '3D HNCACB' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53440 1 9 '3D HN(CO)CACB' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53440 1 10 '3D CCH-TOCSY' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 53440 1 11 '3D CCH-TOCSY' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 53440 1 12 '3D HCCH-TOCSY' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 53440 1 13 '3D HCCH-TOCSY' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 53440 1 14 '3D CCH-TOCSY' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 53440 1 15 '3D CCH-TOCSY' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 53440 1 16 '3D HCCH-TOCSY' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 53440 1 17 '3D HCCH-TOCSY' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 53440 1 stop_ loop_ _Experiment_file.Experiment_ID _Experiment_file.Experiment_name _Experiment_file.Name _Experiment_file.Type _Experiment_file.Content _Experiment_file.Directory_path _Experiment_file.Details _Experiment_file.Entry_ID _Experiment_file.Experiment_list_ID 1 '2D 1H-15N HSQC' Nhsqc_HCfab_ILV.zip . 'NMR experiment directory' . . 53440 1 1 '2D 1H-15N HSQC' Nhsqc_LC_ILV.zip . 'NMR experiment directory' . . 53440 1 2 '2D 1H-15N TROSY' trosy_HCfab_ILV.zip . 'NMR experiment directory' . . 53440 1 2 '2D 1H-15N TROSY' trosy_LC_ILV.zip . 'NMR experiment directory' . . 53440 1 3 '2D 1H-13C HSQC' Chsqc_HCfab_ILV.zip . 'NMR experiment directory' . . 53440 1 3 '2D 1H-13C HSQC' Chsqc_LC_ILV.zip . 'NMR experiment directory' . . 53440 1 4 '3D HNCO' trhnco_HCfab_ILV.zip . 'NMR experiment directory' . . 53440 1 4 '3D HNCO' trhnco_LC_ILV.zip . 'NMR experiment directory' . . 53440 1 5 '3D HNCACO' trhncaco_HCfab_ILV.zip . 'NMR experiment directory' . . 53440 1 5 '3D HNCACO' trhncaco_LC_ILV.zip . 'NMR experiment directory' . . 53440 1 6 '3D HNCA' trhnca3_HCfab_ILV.zip . 'NMR experiment directory' . . 53440 1 6 '3D HNCA' trhnca_LC_ILV.zip . 'NMR experiment directory' . . 53440 1 7 '3D HN(CO)CA' trhncoca3_HCfab_ILV.zip . 'NMR experiment directory' . . 53440 1 7 '3D HN(CO)CA' trhncoca_LC_ILV.zip . 'NMR experiment directory' . . 53440 1 8 '3D HNCACB' trhncacb3_HCfab_ILV.zip . 'NMR experiment directory' . . 53440 1 8 '3D HNCACB' trhncacb_LC_ILV.zip . 'NMR experiment directory' . . 53440 1 9 '3D HN(CO)CACB' trhncocacb3_HCfab_ILV.zip . 'NMR experiment directory' . . 53440 1 9 '3D HN(CO)CACB' trhncocacb_LC_ILV.zip . 'NMR experiment directory' . . 53440 1 10 '3D CCH-TOCSY' cccCAtocsy_LC_ILV.zip . 'NMR experiment directory' . . 53440 1 10 '3D CCH-TOCSY' ccctocsy_LC_ILV.zip . 'NMR experiment directory' . . 53440 1 14 '3D CCH-TOCSY' cccCAtocsy_HCfab_AILTV.zip . 'NMR experiment directory' . . 53440 1 14 '3D CCH-TOCSY' cccCAtocsy_HCfab_ILV.zip . 'NMR experiment directory' . . 53440 1 14 '3D CCH-TOCSY' cccCAtocsy_LC_AILTV.zip . 'NMR experiment directory' . . 53440 1 14 '3D CCH-TOCSY' ccctocsy_HCfab_AILTV.zip . 'NMR experiment directory' . . 53440 1 14 '3D CCH-TOCSY' ccctocsy_HCfab_ILV.zip . 'NMR experiment directory' . . 53440 1 14 '3D CCH-TOCSY' ccctocsy_LC_AILTV.zip . 'NMR experiment directory' . . 53440 1 16 '3D HCCH-TOCSY' hccCAtocsy_HCfab_AILTV.zip . 'NMR experiment directory' . . 53440 1 16 '3D HCCH-TOCSY' hccCAtocsy_HCfab_ILV.zip . 'NMR experiment directory' . . 53440 1 16 '3D HCCH-TOCSY' hccCAtocsy_LC_AILTV.zip . 'NMR experiment directory' . . 53440 1 16 '3D HCCH-TOCSY' hccCAtocsy_LC_ILV.zip . 'NMR experiment directory' . . 53440 1 16 '3D HCCH-TOCSY' hcctocsy_HCfab_AILTV.zip . 'NMR experiment directory' . . 53440 1 16 '3D HCCH-TOCSY' hcctocsy_HCfab_ILV.zip . 'NMR experiment directory' . . 53440 1 16 '3D HCCH-TOCSY' hcctocsy_LC_AILTV.zip . 'NMR experiment directory' . . 53440 1 16 '3D HCCH-TOCSY' hcctocsy_LC_ILV.zip . 'NMR experiment directory' . . 53440 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 53440 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name Chem_shift_Reference1 _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 53440 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 53440 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 53440 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 53440 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'assigned chem shift list 1' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 53440 1 2 '2D 1H-15N TROSY' . . . 53440 1 3 '2D 1H-13C HSQC' . . . 53440 1 4 '3D HNCO' . . . 53440 1 5 '3D HNCACO' . . . 53440 1 6 '3D HNCA' . . . 53440 1 7 '3D HN(CO)CA' . . . 53440 1 8 '3D HNCACB' . . . 53440 1 9 '3D HN(CO)CACB' . . . 53440 1 14 '3D CCH-TOCSY' . . . 53440 1 16 '3D HCCH-TOCSY' . . . 53440 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 53440 1 2 $software_2 . . 53440 1 3 $software_3 . . 53440 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 2 2 GLU C C 13 175.5157 0.0000 . 1 . . 59241 . . 1 GLU C . 53440 1 2 . 1 . 1 2 2 GLU CA C 13 55.6446 0.0000 . 1 . . 59245 . . 1 GLU CA . 53440 1 3 . 1 . 1 2 2 GLU CB C 13 29.9298 0.0000 . 1 . . 68860 . . 1 GLU CB . 53440 1 4 . 1 . 1 3 3 VAL H H 1 8.2241 0.0000 . 1 . . 52321 . . 2 VAL H . 53440 1 5 . 1 . 1 3 3 VAL HG11 H 1 1.0100 0.0000 . 2 . . 23120 . . 2 VAL HG11 . 53440 1 6 . 1 . 1 3 3 VAL HG12 H 1 1.0100 0.0000 . 2 . . 23120 . . 2 VAL HG11 . 53440 1 7 . 1 . 1 3 3 VAL HG13 H 1 1.0100 0.0000 . 2 . . 23120 . . 2 VAL HG11 . 53440 1 8 . 1 . 1 3 3 VAL HG21 H 1 0.8680 0.0000 . 2 . . 23120 . . 2 VAL HG21 . 53440 1 9 . 1 . 1 3 3 VAL HG22 H 1 0.8680 0.0000 . 2 . . 23120 . . 2 VAL HG21 . 53440 1 10 . 1 . 1 3 3 VAL HG23 H 1 0.8680 0.0000 . 2 . . 23120 . . 2 VAL HG21 . 53440 1 11 . 1 . 1 3 3 VAL C C 13 175.7866 0.0000 . 1 . . 59240 . . 2 VAL C . 53440 1 12 . 1 . 1 3 3 VAL CA C 13 62.3157 0.0000 . 1 . . 59249 . . 2 VAL CA . 53440 1 13 . 1 . 1 3 3 VAL CB C 13 31.2942 0.0000 . 1 . . 59244 . . 2 VAL CB . 53440 1 14 . 1 . 1 3 3 VAL CG1 C 13 21.7740 0.0000 . 2 . . . . . 2 VAL CG1 . 53440 1 15 . 1 . 1 3 3 VAL CG2 C 13 21.9010 0.0000 . 2 . . . . . 2 VAL CG2 . 53440 1 16 . 1 . 1 3 3 VAL N N 15 123.5216 0.0000 . 1 . . 52323 . . 2 VAL N . 53440 1 17 . 1 . 1 4 4 GLN H H 1 8.2899 0.0000 . 1 . . 85676 . . 3 GLN H . 53440 1 18 . 1 . 1 4 4 GLN C C 13 173.3580 0.0000 . 1 . . 100851 . . 3 GLN C . 53440 1 19 . 1 . 1 4 4 GLN CA C 13 54.8400 0.0000 . 1 . . 100857 . . 3 GLN CA . 53440 1 20 . 1 . 1 4 4 GLN CB C 13 32.1519 0.0000 . 1 . . 100866 . . 3 GLN CB . 53440 1 21 . 1 . 1 4 4 GLN N N 15 124.7226 0.0000 . 1 . . 85678 . . 3 GLN N . 53440 1 22 . 1 . 1 5 5 LEU H H 1 8.4308 0.0000 . 1 . . 49339 . . 4 LEU H . 53440 1 23 . 1 . 1 5 5 LEU HD11 H 1 0.6560 0.0000 . 2 . . . . . 4 LEU HD11 . 53440 1 24 . 1 . 1 5 5 LEU HD12 H 1 0.6560 0.0000 . 2 . . . . . 4 LEU HD11 . 53440 1 25 . 1 . 1 5 5 LEU HD13 H 1 0.6560 0.0000 . 2 . . . . . 4 LEU HD11 . 53440 1 26 . 1 . 1 5 5 LEU HD21 H 1 1.0020 0.0000 . 2 . . . . . 4 LEU HD21 . 53440 1 27 . 1 . 1 5 5 LEU HD22 H 1 1.0020 0.0000 . 2 . . . . . 4 LEU HD21 . 53440 1 28 . 1 . 1 5 5 LEU HD23 H 1 1.0020 0.0000 . 2 . . . . . 4 LEU HD21 . 53440 1 29 . 1 . 1 5 5 LEU C C 13 175.8314 0.0000 . 1 . . 100896 . . 4 LEU C . 53440 1 30 . 1 . 1 5 5 LEU CA C 13 53.5218 0.0000 . 1 . . 100904 . . 4 LEU CA . 53440 1 31 . 1 . 1 5 5 LEU CB C 13 33.1690 0.0000 . 1 . . . . . 4 LEU CB . 53440 1 32 . 1 . 1 5 5 LEU CD1 C 13 25.8600 0.0000 . 2 . . . . . 4 LEU CD1 . 53440 1 33 . 1 . 1 5 5 LEU CD2 C 13 25.1350 0.0000 . 2 . . . . . 4 LEU CD2 . 53440 1 34 . 1 . 1 5 5 LEU N N 15 123.4292 0.0000 . 1 . . 49341 . . 4 LEU N . 53440 1 35 . 1 . 1 6 6 VAL H H 1 9.4262 0.0000 . 1 . . 96524 . . 5 VAL H . 53440 1 36 . 1 . 1 6 6 VAL C C 13 174.1505 0.0000 . 1 . . 101166 . . 5 VAL C . 53440 1 37 . 1 . 1 6 6 VAL N N 15 136.3321 0.0000 . 1 . . 96526 . . 5 VAL N . 53440 1 38 . 1 . 1 7 7 GLU C C 13 176.6403 0.0000 . 1 . . 54623 . . 6 GLU C . 53440 1 39 . 1 . 1 7 7 GLU CA C 13 63.1831 0.0000 . 1 . . 47252 . . 6 GLU CA . 53440 1 40 . 1 . 1 7 7 GLU CB C 13 33.8642 0.0000 . 1 . . 53159 . . 6 GLU CB . 53440 1 41 . 1 . 1 8 8 SER H H 1 7.9916 0.0000 . 1 . . 53122 . . 7 SER H . 53440 1 42 . 1 . 1 8 8 SER C C 13 173.3496 0.0000 . 1 . . 46145 . . 7 SER C . 53440 1 43 . 1 . 1 8 8 SER CA C 13 57.4472 0.0000 . 1 . . 47264 . . 7 SER CA . 53440 1 44 . 1 . 1 8 8 SER N N 15 119.1830 0.0000 . 1 . . 53124 . . 7 SER N . 53440 1 45 . 1 . 1 9 9 GLY H H 1 8.3775 0.0000 . 1 . . 54118 . . 8 GLY H . 53440 1 46 . 1 . 1 9 9 GLY C C 13 174.2863 0.0000 . 1 . . 46475 . . 8 GLY C . 53440 1 47 . 1 . 1 9 9 GLY CA C 13 44.4622 0.0000 . 1 . . 47762 . . 8 GLY CA . 53440 1 48 . 1 . 1 9 9 GLY N N 15 108.4248 0.0000 . 1 . . 54120 . . 8 GLY N . 53440 1 49 . 1 . 1 10 10 GLY H H 1 7.6950 0.0000 . 1 . . 50515 . . 9 GLY H . 53440 1 50 . 1 . 1 10 10 GLY C C 13 172.7295 0.0000 . 1 . . 46511 . . 9 GLY C . 53440 1 51 . 1 . 1 10 10 GLY CA C 13 44.9831 0.0000 . 1 . . 54200 . . 9 GLY CA . 53440 1 52 . 1 . 1 10 10 GLY N N 15 106.5301 0.0000 . 1 . . 50517 . . 9 GLY N . 53440 1 53 . 1 . 1 11 11 GLY H H 1 7.3604 0.0000 . 1 . . 50467 . . 10 GLY H . 53440 1 54 . 1 . 1 11 11 GLY C C 13 171.0949 0.0000 . 1 . . 78192 . . 10 GLY C . 53440 1 55 . 1 . 1 11 11 GLY CA C 13 44.3251 0.0000 . 1 . . 78193 . . 10 GLY CA . 53440 1 56 . 1 . 1 11 11 GLY N N 15 108.1409 0.0000 . 1 . . 50469 . . 10 GLY N . 53440 1 57 . 1 . 1 12 12 LEU H H 1 8.1215 0.0000 . 1 . . 52438 . . 11 LEU H . 53440 1 58 . 1 . 1 12 12 LEU HD11 H 1 1.0560 0.0000 . 2 . . 23150 . . 11 LEU HD11 . 53440 1 59 . 1 . 1 12 12 LEU HD12 H 1 1.0560 0.0000 . 2 . . 23150 . . 11 LEU HD11 . 53440 1 60 . 1 . 1 12 12 LEU HD13 H 1 1.0560 0.0000 . 2 . . 23150 . . 11 LEU HD11 . 53440 1 61 . 1 . 1 12 12 LEU HD21 H 1 1.0760 0.0000 . 2 . . 23150 . . 11 LEU HD21 . 53440 1 62 . 1 . 1 12 12 LEU HD22 H 1 1.0760 0.0000 . 2 . . 23150 . . 11 LEU HD21 . 53440 1 63 . 1 . 1 12 12 LEU HD23 H 1 1.0760 0.0000 . 2 . . 23150 . . 11 LEU HD21 . 53440 1 64 . 1 . 1 12 12 LEU C C 13 176.0488 0.0000 . 1 . . 59905 . . 11 LEU C . 53440 1 65 . 1 . 1 12 12 LEU CA C 13 53.6823 0.0000 . 1 . . 59964 . . 11 LEU CA . 53440 1 66 . 1 . 1 12 12 LEU CB C 13 43.3417 0.0000 . 1 . . 59903 . . 11 LEU CB . 53440 1 67 . 1 . 1 12 12 LEU CD1 C 13 26.3610 0.0000 . 2 . . . . . 11 LEU CD1 . 53440 1 68 . 1 . 1 12 12 LEU CD2 C 13 24.9920 0.0000 . 2 . . . . . 11 LEU CD2 . 53440 1 69 . 1 . 1 12 12 LEU N N 15 123.2896 0.0000 . 1 . . 52440 . . 11 LEU N . 53440 1 70 . 1 . 1 13 13 VAL H H 1 9.0034 0.0000 . 1 . . 50698 . . 12 VAL H . 53440 1 71 . 1 . 1 13 13 VAL HG11 H 1 0.9430 0.0000 . 2 . . 23192 . . 12 VAL HG11 . 53440 1 72 . 1 . 1 13 13 VAL HG12 H 1 0.9430 0.0000 . 2 . . 23192 . . 12 VAL HG11 . 53440 1 73 . 1 . 1 13 13 VAL HG13 H 1 0.9430 0.0000 . 2 . . 23192 . . 12 VAL HG11 . 53440 1 74 . 1 . 1 13 13 VAL HG21 H 1 0.8270 0.0000 . 2 . . 23192 . . 12 VAL HG21 . 53440 1 75 . 1 . 1 13 13 VAL HG22 H 1 0.8270 0.0000 . 2 . . 23192 . . 12 VAL HG21 . 53440 1 76 . 1 . 1 13 13 VAL HG23 H 1 0.8270 0.0000 . 2 . . 23192 . . 12 VAL HG21 . 53440 1 77 . 1 . 1 13 13 VAL C C 13 172.4995 0.0000 . 1 . . 45686 . . 12 VAL C . 53440 1 78 . 1 . 1 13 13 VAL CA C 13 59.4300 0.0000 . 1 . . 46739 . . 12 VAL CA . 53440 1 79 . 1 . 1 13 13 VAL CB C 13 34.4650 0.0000 . 1 . . 51860 . . 12 VAL CB . 53440 1 80 . 1 . 1 13 13 VAL CG1 C 13 21.5800 0.0000 . 2 . . . . . 12 VAL CG1 . 53440 1 81 . 1 . 1 13 13 VAL CG2 C 13 21.1910 0.0000 . 2 . . . . . 12 VAL CG2 . 53440 1 82 . 1 . 1 13 13 VAL N N 15 126.3413 0.0000 . 1 . . 50700 . . 12 VAL N . 53440 1 83 . 1 . 1 14 14 GLN H H 1 8.0365 0.0000 . 1 . . 52273 . . 13 GLN H . 53440 1 84 . 1 . 1 14 14 GLN C C 13 174.1315 0.0000 . 1 . . 45860 . . 13 GLN C . 53440 1 85 . 1 . 1 14 14 GLN CA C 13 53.7557 0.0000 . 1 . . 52349 . . 13 GLN CA . 53440 1 86 . 1 . 1 14 14 GLN CB C 13 26.8710 0.0000 . 1 . . 52388 . . 13 GLN CB . 53440 1 87 . 1 . 1 14 14 GLN N N 15 123.6524 0.0000 . 1 . . 52275 . . 13 GLN N . 53440 1 88 . 1 . 1 15 15 PRO C C 13 177.7411 0.0000 . 1 . . 73638 . . 14 PRO C . 53440 1 89 . 1 . 1 15 15 PRO CA C 13 63.1877 0.0000 . 1 . . 73641 . . 14 PRO CA . 53440 1 90 . 1 . 1 15 15 PRO CB C 13 30.1400 0.0000 . 1 . . 73641 . . 14 PRO CB . 53440 1 91 . 1 . 1 16 16 GLY H H 1 9.8162 0.0000 . 1 . . 53641 . . 15 GLY H . 53440 1 92 . 1 . 1 16 16 GLY C C 13 175.2253 0.0000 . 1 . . 73640 . . 15 GLY C . 53440 1 93 . 1 . 1 16 16 GLY CA C 13 44.4804 0.0000 . 1 . . 73642 . . 15 GLY CA . 53440 1 94 . 1 . 1 16 16 GLY N N 15 114.9296 0.0000 . 1 . . 53643 . . 15 GLY N . 53440 1 95 . 1 . 1 17 17 GLY H H 1 8.4762 0.0000 . 1 . . 54079 . . 16 GLY H . 53440 1 96 . 1 . 1 17 17 GLY C C 13 170.7699 0.0000 . 1 . . 77435 . . 16 GLY C . 53440 1 97 . 1 . 1 17 17 GLY CA C 13 44.1903 0.0000 . 1 . . 77438 . . 16 GLY CA . 53440 1 98 . 1 . 1 17 17 GLY N N 15 110.2861 0.0000 . 1 . . 54081 . . 16 GLY N . 53440 1 99 . 1 . 1 18 18 SER H H 1 7.7536 0.0000 . 1 . . 54046 . . 17 SER H . 53440 1 100 . 1 . 1 18 18 SER C C 13 173.0146 0.0000 . 1 . . 46457 . . 17 SER C . 53440 1 101 . 1 . 1 18 18 SER CA C 13 56.0935 0.0000 . 1 . . 47726 . . 17 SER CA . 53440 1 102 . 1 . 1 18 18 SER CB C 13 66.8043 0.0000 . 1 . . 54044 . . 17 SER CB . 53440 1 103 . 1 . 1 18 18 SER N N 15 110.3528 0.0000 . 1 . . 54048 . . 17 SER N . 53440 1 104 . 1 . 1 19 19 LEU H H 1 8.2930 0.0000 . 1 . . 50881 . . 18 LEU H . 53440 1 105 . 1 . 1 19 19 LEU HD11 H 1 0.7110 0.0000 . 2 . . . . . 18 LEU HD11 . 53440 1 106 . 1 . 1 19 19 LEU HD12 H 1 0.7110 0.0000 . 2 . . . . . 18 LEU HD11 . 53440 1 107 . 1 . 1 19 19 LEU HD13 H 1 0.7110 0.0000 . 2 . . . . . 18 LEU HD11 . 53440 1 108 . 1 . 1 19 19 LEU HD21 H 1 0.7640 0.0000 . 2 . . . . . 18 LEU HD21 . 53440 1 109 . 1 . 1 19 19 LEU HD22 H 1 0.7640 0.0000 . 2 . . . . . 18 LEU HD21 . 53440 1 110 . 1 . 1 19 19 LEU HD23 H 1 0.7640 0.0000 . 2 . . . . . 18 LEU HD21 . 53440 1 111 . 1 . 1 19 19 LEU C C 13 173.6033 0.0000 . 1 . . 88090 . . 18 LEU C . 53440 1 112 . 1 . 1 19 19 LEU CA C 13 54.5726 0.0000 . 1 . . 88098 . . 18 LEU CA . 53440 1 113 . 1 . 1 19 19 LEU CB C 13 46.2134 0.0000 . 1 . . 88102 . . 18 LEU CB . 53440 1 114 . 1 . 1 19 19 LEU CD1 C 13 25.8260 0.0000 . 2 . . . . . 18 LEU CD1 . 53440 1 115 . 1 . 1 19 19 LEU CD2 C 13 24.9850 0.0000 . 2 . . . . . 18 LEU CD2 . 53440 1 116 . 1 . 1 19 19 LEU N N 15 121.9538 0.0000 . 1 . . 50883 . . 18 LEU N . 53440 1 117 . 1 . 1 20 20 ARG H H 1 8.0994 0.0000 . 1 . . 50809 . . 19 ARG H . 53440 1 118 . 1 . 1 20 20 ARG C C 13 175.2240 0.0000 . 1 . . 108625 . . 19 ARG C . 53440 1 119 . 1 . 1 20 20 ARG CA C 13 54.1854 0.0000 . 1 . . 88114 . . 19 ARG CA . 53440 1 120 . 1 . 1 20 20 ARG CB C 13 31.9411 0.0000 . 1 . . 108637 . . 19 ARG CB . 53440 1 121 . 1 . 1 20 20 ARG N N 15 123.8582 0.0000 . 1 . . 50811 . . 19 ARG N . 53440 1 122 . 1 . 1 21 21 LEU H H 1 8.9313 0.0000 . 1 . . 48838 . . 20 LEU H . 53440 1 123 . 1 . 1 21 21 LEU HD11 H 1 0.3910 0.0000 . 2 . . 23429 . . 20 LEU HD11 . 53440 1 124 . 1 . 1 21 21 LEU HD12 H 1 0.3910 0.0000 . 2 . . 23429 . . 20 LEU HD11 . 53440 1 125 . 1 . 1 21 21 LEU HD13 H 1 0.3910 0.0000 . 2 . . 23429 . . 20 LEU HD11 . 53440 1 126 . 1 . 1 21 21 LEU HD21 H 1 0.4530 0.0000 . 2 . . 23348 . . 20 LEU HD21 . 53440 1 127 . 1 . 1 21 21 LEU HD22 H 1 0.4530 0.0000 . 2 . . 23348 . . 20 LEU HD21 . 53440 1 128 . 1 . 1 21 21 LEU HD23 H 1 0.4530 0.0000 . 2 . . 23348 . . 20 LEU HD21 . 53440 1 129 . 1 . 1 21 21 LEU C C 13 176.5796 0.0000 . 1 . . 55883 . . 20 LEU C . 53440 1 130 . 1 . 1 21 21 LEU CA C 13 52.6656 0.0000 . 1 . . 55885 . . 20 LEU CA . 53440 1 131 . 1 . 1 21 21 LEU CB C 13 42.7981 0.0000 . 1 . . 55878 . . 20 LEU CB . 53440 1 132 . 1 . 1 21 21 LEU CD1 C 13 26.0930 0.0000 . 2 . . . . . 20 LEU CD1 . 53440 1 133 . 1 . 1 21 21 LEU CD2 C 13 21.9920 0.0000 . 2 . . . . . 20 LEU CD2 . 53440 1 134 . 1 . 1 21 21 LEU N N 15 127.0635 0.0000 . 1 . . 48840 . . 20 LEU N . 53440 1 135 . 1 . 1 22 22 SER H H 1 8.7586 0.0000 . 1 . . 53584 . . 21 SER H . 53440 1 136 . 1 . 1 22 22 SER C C 13 173.3176 0.0000 . 1 . . 46346 . . 21 SER C . 53440 1 137 . 1 . 1 22 22 SER CA C 13 56.3348 0.0000 . 1 . . 47513 . . 21 SER CA . 53440 1 138 . 1 . 1 22 22 SER CB C 13 66.2172 0.0000 . 1 . . 53612 . . 21 SER CB . 53440 1 139 . 1 . 1 22 22 SER N N 15 115.0116 0.0000 . 1 . . 53586 . . 21 SER N . 53440 1 140 . 1 . 1 23 23 CYS H H 1 8.8543 0.0000 . 1 . . 45868 . . 22 CYS H . 53440 1 141 . 1 . 1 23 23 CYS C C 13 171.7289 0.0000 . 1 . . 68430 . . 22 CYS C . 53440 1 142 . 1 . 1 23 23 CYS CA C 13 55.6537 0.0000 . 1 . . 68424 . . 22 CYS CA . 53440 1 143 . 1 . 1 23 23 CYS CB C 13 45.5322 0.0000 . 1 . . 68478 . . 22 CYS CB . 53440 1 144 . 1 . 1 23 23 CYS N N 15 123.8615 0.0000 . 1 . . 45870 . . 22 CYS N . 53440 1 145 . 1 . 1 25 25 ALA HB1 H 1 1.5080 0.0000 . 1 . . . . . 24 ALA HB1 . 53440 1 146 . 1 . 1 25 25 ALA HB2 H 1 1.5080 0.0000 . 1 . . . . . 24 ALA HB1 . 53440 1 147 . 1 . 1 25 25 ALA HB3 H 1 1.5080 0.0000 . 1 . . . . . 24 ALA HB1 . 53440 1 148 . 1 . 1 25 25 ALA C C 13 177.0252 0.0000 . 1 . . 73762 . . 24 ALA C . 53440 1 149 . 1 . 1 25 25 ALA CA C 13 50.7356 0.0000 . 1 . . 73765 . . 24 ALA CA . 53440 1 150 . 1 . 1 25 25 ALA CB C 13 21.9400 0.0000 . 1 . . 73788 . . 24 ALA CB . 53440 1 151 . 1 . 1 26 26 SER H H 1 8.6869 0.0000 . 1 . . 53701 . . 25 SER H . 53440 1 152 . 1 . 1 26 26 SER C C 13 174.4535 0.0000 . 1 . . 73764 . . 25 SER C . 53440 1 153 . 1 . 1 26 26 SER CA C 13 57.5898 0.0000 . 1 . . 73772 . . 25 SER CA . 53440 1 154 . 1 . 1 26 26 SER CB C 13 65.0642 0.0000 . 1 . . 73767 . . 25 SER CB . 53440 1 155 . 1 . 1 26 26 SER N N 15 114.7041 0.0000 . 1 . . 53703 . . 25 SER N . 53440 1 156 . 1 . 1 27 27 GLY H H 1 8.6283 0.0000 . 1 . . 47752 . . 26 GLY H . 53440 1 157 . 1 . 1 27 27 GLY C C 13 173.0500 0.0000 . 1 . . 93013 . . 26 GLY C . 53440 1 158 . 1 . 1 27 27 GLY CA C 13 45.4456 0.0000 . 1 . . 78018 . . 26 GLY CA . 53440 1 159 . 1 . 1 27 27 GLY N N 15 108.5706 0.0000 . 1 . . 47754 . . 26 GLY N . 53440 1 160 . 1 . 1 28 28 TYR H H 1 7.3504 0.0000 . 1 . . 50122 . . 27 TYR H . 53440 1 161 . 1 . 1 28 28 TYR C C 13 173.7838 0.0000 . 1 . . 93122 . . 27 TYR C . 53440 1 162 . 1 . 1 28 28 TYR CA C 13 57.7769 0.0000 . 1 . . 93126 . . 27 TYR CA . 53440 1 163 . 1 . 1 28 28 TYR N N 15 114.6477 0.0000 . 1 . . 50124 . . 27 TYR N . 53440 1 164 . 1 . 1 29 29 THR H H 1 7.6158 0.0000 . 1 . . 84120 . . 28 THR H . 53440 1 165 . 1 . 1 29 29 THR C C 13 173.1205 0.0000 . 1 . . 101325 . . 28 THR C . 53440 1 166 . 1 . 1 29 29 THR CA C 13 58.0232 0.0000 . 1 . . 93130 . . 28 THR CA . 53440 1 167 . 1 . 1 29 29 THR CB C 13 63.0470 0.0000 . 1 . . 93131 . . 28 THR CB . 53440 1 168 . 1 . 1 29 29 THR N N 15 116.2959 0.0000 . 1 . . 84122 . . 28 THR N . 53440 1 169 . 1 . 1 36 36 ASN C C 13 173.7353 0.0000 . 1 . . 54659 . . 35 ASN C . 53440 1 170 . 1 . 1 36 36 ASN CA C 13 51.6658 0.0000 . 1 . . 108616 . . 35 ASN CA . 53440 1 171 . 1 . 1 36 36 ASN CB C 13 43.0763 0.0000 . 1 . . 108620 . . 35 ASN CB . 53440 1 172 . 1 . 1 37 37 TRP H H 1 8.1819 0.0000 . 1 . . 49798 . . 36 TRP H . 53440 1 173 . 1 . 1 37 37 TRP C C 13 174.5236 0.0000 . 1 . . 108205 . . 36 TRP C . 53440 1 174 . 1 . 1 37 37 TRP CA C 13 55.6745 0.0000 . 1 . . 108213 . . 36 TRP CA . 53440 1 175 . 1 . 1 37 37 TRP N N 15 118.3067 0.0000 . 1 . . 49800 . . 36 TRP N . 53440 1 176 . 1 . 1 38 38 VAL H H 1 9.1734 0.0000 . 1 . . 85037 . . 37 VAL H . 53440 1 177 . 1 . 1 38 38 VAL HG11 H 1 0.8860 0.0000 . 2 . . . . . 37 VAL HG11 . 53440 1 178 . 1 . 1 38 38 VAL HG12 H 1 0.8860 0.0000 . 2 . . . . . 37 VAL HG11 . 53440 1 179 . 1 . 1 38 38 VAL HG13 H 1 0.8860 0.0000 . 2 . . . . . 37 VAL HG11 . 53440 1 180 . 1 . 1 38 38 VAL HG21 H 1 0.4680 0.0000 . 2 . . . . . 37 VAL HG21 . 53440 1 181 . 1 . 1 38 38 VAL HG22 H 1 0.4680 0.0000 . 2 . . . . . 37 VAL HG21 . 53440 1 182 . 1 . 1 38 38 VAL HG23 H 1 0.4680 0.0000 . 2 . . . . . 37 VAL HG21 . 53440 1 183 . 1 . 1 38 38 VAL C C 13 173.1679 0.0000 . 1 . . 85256 . . 37 VAL C . 53440 1 184 . 1 . 1 38 38 VAL CA C 13 60.1240 0.0000 . 1 . . 85258 . . 37 VAL CA . 53440 1 185 . 1 . 1 38 38 VAL CB C 13 36.3710 0.0000 . 1 . . 85261 . . 37 VAL CB . 53440 1 186 . 1 . 1 38 38 VAL CG1 C 13 22.1570 0.0000 . 2 . . . . . 37 VAL CG1 . 53440 1 187 . 1 . 1 38 38 VAL CG2 C 13 21.2480 0.0000 . 2 . . . . . 37 VAL CG2 . 53440 1 188 . 1 . 1 38 38 VAL N N 15 124.8875 0.0000 . 1 . . 85039 . . 37 VAL N . 53440 1 189 . 1 . 1 39 39 ARG H H 1 9.7462 0.0000 . 1 . . 52018 . . 38 ARG H . 53440 1 190 . 1 . 1 39 39 ARG C C 13 173.2301 0.0000 . 1 . . 108229 . . 38 ARG C . 53440 1 191 . 1 . 1 39 39 ARG CA C 13 52.6434 0.0000 . 1 . . 108063 . . 38 ARG CA . 53440 1 192 . 1 . 1 39 39 ARG CB C 13 33.2711 0.0000 . 1 . . 108241 . . 38 ARG CB . 53440 1 193 . 1 . 1 39 39 ARG N N 15 125.2546 0.0000 . 1 . . 52020 . . 38 ARG N . 53440 1 194 . 1 . 1 40 40 GLN H H 1 8.8904 0.0000 . 1 . . 50869 . . 39 GLN H . 53440 1 195 . 1 . 1 40 40 GLN C C 13 175.2122 0.0000 . 1 . . 108657 . . 39 GLN C . 53440 1 196 . 1 . 1 40 40 GLN CA C 13 54.2086 0.0000 . 1 . . 108665 . . 39 GLN CA . 53440 1 197 . 1 . 1 40 40 GLN CB C 13 31.8124 0.0000 . 1 . . 108669 . . 39 GLN CB . 53440 1 198 . 1 . 1 40 40 GLN N N 15 122.0552 0.0000 . 1 . . 50871 . . 39 GLN N . 53440 1 199 . 1 . 1 41 41 ALA H H 1 9.4309 0.0000 . 1 . . 51337 . . 40 ALA H . 53440 1 200 . 1 . 1 41 41 ALA C C 13 174.8496 0.0000 . 1 . . 45491 . . 40 ALA C . 53440 1 201 . 1 . 1 41 41 ALA CA C 13 50.2628 0.0000 . 1 . . 51335 . . 40 ALA CA . 53440 1 202 . 1 . 1 41 41 ALA CB C 13 17.4197 0.0000 . 1 . . 51341 . . 40 ALA CB . 53440 1 203 . 1 . 1 41 41 ALA N N 15 136.5620 0.0000 . 1 . . 51339 . . 40 ALA N . 53440 1 204 . 1 . 1 42 42 PRO C C 13 178.4005 0.0000 . 1 . . 101709 . . 41 PRO C . 53440 1 205 . 1 . 1 42 42 PRO CA C 13 63.7818 0.0000 . 1 . . 101712 . . 41 PRO CA . 53440 1 206 . 1 . 1 42 42 PRO CB C 13 30.6096 0.0000 . 1 . . 101712 . . 41 PRO CB . 53440 1 207 . 1 . 1 43 43 GLY H H 1 8.7616 0.0000 . 1 . . 53893 . . 42 GLY H . 53440 1 208 . 1 . 1 43 43 GLY C C 13 174.6779 0.0000 . 1 . . 101859 . . 42 GLY C . 53440 1 209 . 1 . 1 43 43 GLY CA C 13 45.5652 0.0000 . 1 . . 101865 . . 42 GLY CA . 53440 1 210 . 1 . 1 43 43 GLY N N 15 113.4315 0.0000 . 1 . . 53895 . . 42 GLY N . 53440 1 211 . 1 . 1 44 44 LYS H H 1 8.1507 0.0000 . 1 . . 47128 . . 43 LYS H . 53440 1 212 . 1 . 1 44 44 LYS C C 13 176.5122 0.0000 . 1 . . 101772 . . 43 LYS C . 53440 1 213 . 1 . 1 44 44 LYS CA C 13 54.4865 0.0000 . 1 . . 101774 . . 43 LYS CA . 53440 1 214 . 1 . 1 44 44 LYS CB C 13 33.3338 0.0000 . 1 . . 101778 . . 43 LYS CB . 53440 1 215 . 1 . 1 44 44 LYS N N 15 121.1533 0.0000 . 1 . . 47130 . . 43 LYS N . 53440 1 216 . 1 . 1 45 45 GLY H H 1 8.1056 0.0000 . 1 . . 54178 . . 44 GLY H . 53440 1 217 . 1 . 1 45 45 GLY C C 13 173.4778 0.0000 . 1 . . 78358 . . 44 GLY C . 53440 1 218 . 1 . 1 45 45 GLY CA C 13 44.3179 0.0000 . 1 . . 78360 . . 44 GLY CA . 53440 1 219 . 1 . 1 45 45 GLY N N 15 107.1713 0.0000 . 1 . . 54180 . . 44 GLY N . 53440 1 220 . 1 . 1 46 46 LEU H H 1 7.1853 0.0000 . 1 . . 52999 . . 45 LEU H . 53440 1 221 . 1 . 1 46 46 LEU HD11 H 1 -0.5330 0.0000 . 2 . . . . . 45 LEU HD11 . 53440 1 222 . 1 . 1 46 46 LEU HD12 H 1 -0.5330 0.0000 . 2 . . . . . 45 LEU HD11 . 53440 1 223 . 1 . 1 46 46 LEU HD13 H 1 -0.5330 0.0000 . 2 . . . . . 45 LEU HD11 . 53440 1 224 . 1 . 1 46 46 LEU HD21 H 1 0.1310 0.0000 . 2 . . . . . 45 LEU HD21 . 53440 1 225 . 1 . 1 46 46 LEU HD22 H 1 0.1310 0.0000 . 2 . . . . . 45 LEU HD21 . 53440 1 226 . 1 . 1 46 46 LEU HD23 H 1 0.1310 0.0000 . 2 . . . . . 45 LEU HD21 . 53440 1 227 . 1 . 1 46 46 LEU C C 13 176.2348 0.0000 . 1 . . 63862 . . 45 LEU C . 53440 1 228 . 1 . 1 46 46 LEU CA C 13 53.7961 0.0000 . 1 . . 63866 . . 45 LEU CA . 53440 1 229 . 1 . 1 46 46 LEU CB C 13 41.6208 0.0000 . 1 . . 63868 . . 45 LEU CB . 53440 1 230 . 1 . 1 46 46 LEU CD1 C 13 24.8800 0.0000 . 2 . . . . . 45 LEU CD1 . 53440 1 231 . 1 . 1 46 46 LEU CD2 C 13 23.3030 0.0000 . 2 . . . . . 45 LEU CD2 . 53440 1 232 . 1 . 1 46 46 LEU N N 15 119.8136 0.0000 . 1 . . 53001 . . 45 LEU N . 53440 1 233 . 1 . 1 47 47 GLU H H 1 8.8489 0.0000 . 1 . . 52903 . . 46 GLU H . 53440 1 234 . 1 . 1 47 47 GLU C C 13 174.9760 0.0000 . 1 . . 46058 . . 46 GLU C . 53440 1 235 . 1 . 1 47 47 GLU CA C 13 54.8387 0.0000 . 1 . . 52889 . . 46 GLU CA . 53440 1 236 . 1 . 1 47 47 GLU CB C 13 32.9458 0.0000 . 1 . . 52910 . . 46 GLU CB . 53440 1 237 . 1 . 1 47 47 GLU N N 15 120.5213 0.0000 . 1 . . 52905 . . 46 GLU N . 53440 1 238 . 1 . 1 48 48 TRP H H 1 9.9691 0.0000 . 1 . . 51406 . . 47 TRP H . 53440 1 239 . 1 . 1 48 48 TRP C C 13 174.1649 0.0000 . 1 . . 45524 . . 47 TRP C . 53440 1 240 . 1 . 1 48 48 TRP CA C 13 59.2113 0.0000 . 1 . . 51386 . . 47 TRP CA . 53440 1 241 . 1 . 1 48 48 TRP CB C 13 29.4141 0.0000 . 1 . . 51407 . . 47 TRP CB . 53440 1 242 . 1 . 1 48 48 TRP N N 15 129.7171 0.0000 . 1 . . 51408 . . 47 TRP N . 53440 1 243 . 1 . 1 49 49 VAL H H 1 8.4948 0.0000 . 1 . . 48658 . . 48 VAL H . 53440 1 244 . 1 . 1 49 49 VAL HG11 H 1 0.5830 0.0000 . 2 . . . . . 48 VAL HG11 . 53440 1 245 . 1 . 1 49 49 VAL HG12 H 1 0.5830 0.0000 . 2 . . . . . 48 VAL HG11 . 53440 1 246 . 1 . 1 49 49 VAL HG13 H 1 0.5830 0.0000 . 2 . . . . . 48 VAL HG11 . 53440 1 247 . 1 . 1 49 49 VAL HG21 H 1 0.5140 0.0000 . 2 . . . . . 48 VAL HG21 . 53440 1 248 . 1 . 1 49 49 VAL HG22 H 1 0.5140 0.0000 . 2 . . . . . 48 VAL HG21 . 53440 1 249 . 1 . 1 49 49 VAL HG23 H 1 0.5140 0.0000 . 2 . . . . . 48 VAL HG21 . 53440 1 250 . 1 . 1 49 49 VAL C C 13 174.6603 0.0000 . 1 . . 55123 . . 48 VAL C . 53440 1 251 . 1 . 1 49 49 VAL CA C 13 62.4074 0.0000 . 1 . . 55119 . . 48 VAL CA . 53440 1 252 . 1 . 1 49 49 VAL CB C 13 31.5716 0.0000 . 1 . . 55124 . . 48 VAL CB . 53440 1 253 . 1 . 1 49 49 VAL CG1 C 13 20.4830 0.0000 . 2 . . . . . 48 VAL CG1 . 53440 1 254 . 1 . 1 49 49 VAL CG2 C 13 20.4770 0.0000 . 2 . . . . . 48 VAL CG2 . 53440 1 255 . 1 . 1 49 49 VAL N N 15 128.5942 0.0000 . 1 . . 48660 . . 48 VAL N . 53440 1 256 . 1 . 1 50 50 GLY H H 1 6.1595 0.0000 . 1 . . 50557 . . 49 GLY H . 53440 1 257 . 1 . 1 50 50 GLY C C 13 170.8152 0.0000 . 1 . . 78899 . . 49 GLY C . 53440 1 258 . 1 . 1 50 50 GLY CA C 13 43.8756 0.0000 . 1 . . 78893 . . 49 GLY CA . 53440 1 259 . 1 . 1 50 50 GLY N N 15 103.2443 0.0000 . 1 . . 50559 . . 49 GLY N . 53440 1 260 . 1 . 1 51 51 TRP H H 1 8.8255 0.0000 . 1 . . 51058 . . 50 TRP H . 53440 1 261 . 1 . 1 51 51 TRP C C 13 171.8895 0.0000 . 1 . . 100383 . . 50 TRP C . 53440 1 262 . 1 . 1 51 51 TRP CA C 13 54.6188 0.0000 . 1 . . 53351 . . 50 TRP CA . 53440 1 263 . 1 . 1 51 51 TRP CB C 13 30.7198 0.0000 . 1 . . . . . 50 TRP CB . 53440 1 264 . 1 . 1 51 51 TRP N N 15 117.5451 0.0000 . 1 . . 51060 . . 50 TRP N . 53440 1 265 . 1 . 1 52 52 ILE H H 1 8.9086 0.0000 . 1 . . 96593 . . 51 ILE H . 53440 1 266 . 1 . 1 52 52 ILE HD11 H 1 0.6600 0.0000 . 1 . . . . . 51 ILE HD11 . 53440 1 267 . 1 . 1 52 52 ILE HD12 H 1 0.6600 0.0000 . 1 . . . . . 51 ILE HD11 . 53440 1 268 . 1 . 1 52 52 ILE HD13 H 1 0.6600 0.0000 . 1 . . . . . 51 ILE HD11 . 53440 1 269 . 1 . 1 52 52 ILE C C 13 171.7485 0.0000 . 1 . . 100325 . . 51 ILE C . 53440 1 270 . 1 . 1 52 52 ILE CA C 13 58.0078 0.0000 . 1 . . 100334 . . 51 ILE CA . 53440 1 271 . 1 . 1 52 52 ILE CB C 13 41.5843 0.0000 . 1 . . 100338 . . 51 ILE CB . 53440 1 272 . 1 . 1 52 52 ILE CD1 C 13 14.2620 0.0000 . 1 . . . . . 51 ILE CD1 . 53440 1 273 . 1 . 1 52 52 ILE N N 15 117.4206 0.0000 . 1 . . 96595 . . 51 ILE N . 53440 1 274 . 1 . 1 53 53 ASN H H 1 7.1703 0.0000 . 1 . . 50674 . . 52 ASN H . 53440 1 275 . 1 . 1 53 53 ASN C C 13 176.3180 0.0000 . 1 . . 45641 . . 52 ASN C . 53440 1 276 . 1 . 1 53 53 ASN CA C 13 52.5834 0.0000 . 1 . . 51752 . . 52 ASN CA . 53440 1 277 . 1 . 1 53 53 ASN CB C 13 38.2126 0.0000 . 1 . . 51773 . . 52 ASN CB . 53440 1 278 . 1 . 1 53 53 ASN N N 15 126.8749 0.0000 . 1 . . 50676 . . 52 ASN N . 53440 1 279 . 1 . 1 54 54 THR H H 1 7.6049 0.0000 . 1 . . 53212 . . 53 THR H . 53440 1 280 . 1 . 1 54 54 THR C C 13 172.8000 0.0000 . 1 . . 54530 . . 53 THR C . 53440 1 281 . 1 . 1 54 54 THR CA C 13 62.0991 0.0000 . 1 . . 91731 . . 53 THR CA . 53440 1 282 . 1 . 1 54 54 THR CB C 13 67.4468 0.0000 . 1 . . 91734 . . 53 THR CB . 53440 1 283 . 1 . 1 54 54 THR N N 15 118.3125 0.0000 . 1 . . 53214 . . 53 THR N . 53440 1 284 . 1 . 1 55 55 TYR H H 1 8.5328 0.0000 . 1 . . 52705 . . 54 TYR H . 53440 1 285 . 1 . 1 55 55 TYR C C 13 177.5708 0.0000 . 1 . . 91650 . . 54 TYR C . 53440 1 286 . 1 . 1 55 55 TYR CA C 13 59.4212 0.0000 . 1 . . 52673 . . 54 TYR CA . 53440 1 287 . 1 . 1 55 55 TYR CB C 13 38.7482 0.0000 . 1 . . 91662 . . 54 TYR CB . 53440 1 288 . 1 . 1 55 55 TYR N N 15 121.8977 0.0000 . 1 . . 52707 . . 54 TYR N . 53440 1 289 . 1 . 1 56 56 THR H H 1 7.7701 0.0000 . 1 . . 50491 . . 55 THR H . 53440 1 290 . 1 . 1 56 56 THR HG21 H 1 1.2740 0.0000 . 1 . . 101890 . . 55 THR HG21 . 53440 1 291 . 1 . 1 56 56 THR HG22 H 1 1.2740 0.0000 . 1 . . 101890 . . 55 THR HG21 . 53440 1 292 . 1 . 1 56 56 THR HG23 H 1 1.2740 0.0000 . 1 . . 101890 . . 55 THR HG21 . 53440 1 293 . 1 . 1 56 56 THR C C 13 176.6263 0.0000 . 1 . . 91284 . . 55 THR C . 53440 1 294 . 1 . 1 56 56 THR CA C 13 61.1194 0.0000 . 1 . . 54146 . . 55 THR CA . 53440 1 295 . 1 . 1 56 56 THR CB C 13 69.9679 0.0000 . 1 . . 91296 . . 55 THR CB . 53440 1 296 . 1 . 1 56 56 THR CG2 C 13 21.2770 0.0000 . 1 . . . . . 55 THR CG2 . 53440 1 297 . 1 . 1 56 56 THR N N 15 107.7360 0.0000 . 1 . . 50493 . . 55 THR N . 53440 1 298 . 1 . 1 57 57 GLY H H 1 8.0205 0.0000 . 1 . . 53977 . . 56 GLY H . 53440 1 299 . 1 . 1 57 57 GLY C C 13 173.5970 0.0000 . 1 . . 91666 . . 56 GLY C . 53440 1 300 . 1 . 1 57 57 GLY CA C 13 44.8637 0.0000 . 1 . . 91674 . . 56 GLY CA . 53440 1 301 . 1 . 1 57 57 GLY N N 15 111.5821 0.0000 . 1 . . 53979 . . 56 GLY N . 53440 1 302 . 1 . 1 58 58 GLU H H 1 7.4841 0.0000 . 1 . . 49555 . . 57 GLU H . 53440 1 303 . 1 . 1 58 58 GLU C C 13 175.6364 0.0000 . 1 . . 46055 . . 57 GLU C . 53440 1 304 . 1 . 1 58 58 GLU CA C 13 54.1785 0.0000 . 1 . . 52895 . . 57 GLU CA . 53440 1 305 . 1 . 1 58 58 GLU CB C 13 30.2335 0.0000 . 1 . . 52916 . . 57 GLU CB . 53440 1 306 . 1 . 1 58 58 GLU N N 15 120.5690 0.0000 . 1 . . 49557 . . 57 GLU N . 53440 1 307 . 1 . 1 59 59 PRO C C 13 175.2996 0.0000 . 1 . . 54638 . . 58 PRO C . 53440 1 308 . 1 . 1 59 59 PRO CA C 13 61.1016 0.0000 . 1 . . 47303 . . 58 PRO CA . 53440 1 309 . 1 . 1 59 59 PRO CB C 13 33.0242 0.0000 . 1 . . 53192 . . 58 PRO CB . 53440 1 310 . 1 . 1 60 60 THR H H 1 8.6878 0.0000 . 1 . . 53173 . . 59 THR H . 53440 1 311 . 1 . 1 60 60 THR HG21 H 1 1.2630 0.0000 . 1 . . 23099 . . 59 THR HG21 . 53440 1 312 . 1 . 1 60 60 THR HG22 H 1 1.2630 0.0000 . 1 . . 23099 . . 59 THR HG21 . 53440 1 313 . 1 . 1 60 60 THR HG23 H 1 1.2630 0.0000 . 1 . . 23099 . . 59 THR HG21 . 53440 1 314 . 1 . 1 60 60 THR C C 13 172.1192 0.0000 . 1 . . 46166 . . 59 THR C . 53440 1 315 . 1 . 1 60 60 THR CA C 13 62.4306 0.0000 . 1 . . 47288 . . 59 THR CA . 53440 1 316 . 1 . 1 60 60 THR CB C 13 62.4350 0.0000 . 1 . . . . . 59 THR CB . 53440 1 317 . 1 . 1 60 60 THR CG2 C 13 20.9020 0.0000 . 1 . . . . . 59 THR CG2 . 53440 1 318 . 1 . 1 60 60 THR N N 15 118.5647 0.0000 . 1 . . 53175 . . 59 THR N . 53440 1 319 . 1 . 1 61 61 TYR H H 1 8.6694 0.0000 . 1 . . 49192 . . 60 TYR H . 53440 1 320 . 1 . 1 61 61 TYR C C 13 176.1991 0.0000 . 1 . . 45821 . . 60 TYR C . 53440 1 321 . 1 . 1 61 61 TYR CA C 13 56.6407 0.0000 . 1 . . 52259 . . 60 TYR CA . 53440 1 322 . 1 . 1 61 61 TYR CB C 13 41.2047 0.0000 . 1 . . 52286 . . 60 TYR CB . 53440 1 323 . 1 . 1 61 61 TYR N N 15 123.9458 0.0000 . 1 . . 49194 . . 60 TYR N . 53440 1 324 . 1 . 1 62 62 ALA H H 1 8.3763 0.0000 . 1 . . 49060 . . 61 ALA H . 53440 1 325 . 1 . 1 62 62 ALA HB1 H 1 1.8800 0.0000 . 1 . . 22991 . . 61 ALA HB1 . 53440 1 326 . 1 . 1 62 62 ALA HB2 H 1 1.8800 0.0000 . 1 . . 22991 . . 61 ALA HB1 . 53440 1 327 . 1 . 1 62 62 ALA HB3 H 1 1.8800 0.0000 . 1 . . 22991 . . 61 ALA HB1 . 53440 1 328 . 1 . 1 62 62 ALA C C 13 177.7253 0.0000 . 1 . . 45743 . . 61 ALA C . 53440 1 329 . 1 . 1 62 62 ALA CA C 13 51.7109 0.0000 . 1 . . 46829 . . 61 ALA CA . 53440 1 330 . 1 . 1 62 62 ALA CB C 13 18.9899 0.0000 . 1 . . 52088 . . 61 ALA CB . 53440 1 331 . 1 . 1 62 62 ALA N N 15 125.1302 0.0000 . 1 . . 49062 . . 61 ALA N . 53440 1 332 . 1 . 1 63 63 ALA H H 1 8.7735 0.0000 . 1 . . 50812 . . 62 ALA H . 53440 1 333 . 1 . 1 63 63 ALA HB1 H 1 1.3670 0.0000 . 1 . . 23093 . . 62 ALA HB1 . 53440 1 334 . 1 . 1 63 63 ALA HB2 H 1 1.3670 0.0000 . 1 . . 23093 . . 62 ALA HB1 . 53440 1 335 . 1 . 1 63 63 ALA HB3 H 1 1.3670 0.0000 . 1 . . 23093 . . 62 ALA HB1 . 53440 1 336 . 1 . 1 63 63 ALA C C 13 178.3145 0.0000 . 1 . . 45848 . . 62 ALA C . 53440 1 337 . 1 . 1 63 63 ALA CA C 13 54.6150 0.0000 . 1 . . 46940 . . 62 ALA CA . 53440 1 338 . 1 . 1 63 63 ALA CB C 13 17.7046 0.0000 . 1 . . 52391 . . 62 ALA CB . 53440 1 339 . 1 . 1 63 63 ALA N N 15 123.8263 0.0000 . 1 . . 50814 . . 62 ALA N . 53440 1 340 . 1 . 1 64 64 ASP H H 1 8.2643 0.0000 . 1 . . 46171 . . 63 ASP H . 53440 1 341 . 1 . 1 64 64 ASP C C 13 177.4791 0.0000 . 1 . . 71188 . . 63 ASP C . 53440 1 342 . 1 . 1 64 64 ASP CA C 13 54.2379 0.0000 . 1 . . 71191 . . 63 ASP CA . 53440 1 343 . 1 . 1 64 64 ASP CB C 13 39.9363 0.0000 . 1 . . 71194 . . 63 ASP CB . 53440 1 344 . 1 . 1 64 64 ASP N N 15 118.2805 0.0000 . 1 . . 46173 . . 63 ASP N . 53440 1 345 . 1 . 1 65 65 PHE H H 1 8.0096 0.0000 . 1 . . 53311 . . 64 PHE H . 53440 1 346 . 1 . 1 65 65 PHE C C 13 175.7735 0.0000 . 1 . . 46208 . . 64 PHE C . 53440 1 347 . 1 . 1 65 65 PHE CA C 13 58.5308 0.0000 . 1 . . 47354 . . 64 PHE CA . 53440 1 348 . 1 . 1 65 65 PHE CB C 13 38.5383 0.0000 . 1 . . 53312 . . 64 PHE CB . 53440 1 349 . 1 . 1 65 65 PHE N N 15 117.9560 0.0000 . 1 . . 53313 . . 64 PHE N . 53440 1 350 . 1 . 1 66 66 LYS H H 1 7.5921 0.0000 . 1 . . 49762 . . 65 LYS H . 53440 1 351 . 1 . 1 66 66 LYS C C 13 176.7491 0.0000 . 1 . . 46106 . . 65 LYS C . 53440 1 352 . 1 . 1 66 66 LYS CA C 13 57.7522 0.0000 . 1 . . 53030 . . 65 LYS CA . 53440 1 353 . 1 . 1 66 66 LYS CB C 13 31.8251 0.0000 . 1 . . 53063 . . 65 LYS CB . 53440 1 354 . 1 . 1 66 66 LYS N N 15 119.5004 0.0000 . 1 . . 49764 . . 65 LYS N . 53440 1 355 . 1 . 1 67 67 ARG H H 1 7.8475 0.0000 . 1 . . 51085 . . 66 ARG H . 53440 1 356 . 1 . 1 67 67 ARG C C 13 176.9705 0.0000 . 1 . . 71725 . . 66 ARG C . 53440 1 357 . 1 . 1 67 67 ARG CA C 13 57.6024 0.0000 . 1 . . 71732 . . 66 ARG CA . 53440 1 358 . 1 . 1 67 67 ARG CB C 13 29.0865 0.0000 . 1 . . 71731 . . 66 ARG CB . 53440 1 359 . 1 . 1 67 67 ARG N N 15 115.5812 0.0000 . 1 . . 51087 . . 66 ARG N . 53440 1 360 . 1 . 1 68 68 ARG H H 1 7.2299 0.0000 . 1 . . 53728 . . 67 ARG H . 53440 1 361 . 1 . 1 68 68 ARG C C 13 174.3972 0.0000 . 1 . . 73866 . . 67 ARG C . 53440 1 362 . 1 . 1 68 68 ARG CA C 13 56.6775 0.0000 . 1 . . 73895 . . 67 ARG CA . 53440 1 363 . 1 . 1 68 68 ARG CB C 13 31.2189 0.0000 . 1 . . 53723 . . 67 ARG CB . 53440 1 364 . 1 . 1 68 68 ARG N N 15 114.6914 0.0000 . 1 . . 53730 . . 67 ARG N . 53440 1 365 . 1 . 1 69 69 PHE H H 1 8.0458 0.0000 . 1 . . 52744 . . 68 PHE H . 53440 1 366 . 1 . 1 69 69 PHE C C 13 174.2167 0.0000 . 1 . . 46007 . . 68 PHE C . 53440 1 367 . 1 . 1 69 69 PHE CA C 13 52.9083 0.0000 . 1 . . 47096 . . 68 PHE CA . 53440 1 368 . 1 . 1 69 69 PHE CB C 13 38.7786 0.0000 . 1 . . 52739 . . 68 PHE CB . 53440 1 369 . 1 . 1 69 69 PHE N N 15 121.4383 0.0000 . 1 . . 52746 . . 68 PHE N . 53440 1 370 . 1 . 1 70 70 THR H H 1 8.6923 0.0000 . 1 . . 53929 . . 69 THR H . 53440 1 371 . 1 . 1 70 70 THR HG21 H 1 1.0620 0.0000 . 1 . . 23162 . . 69 THR HG21 . 53440 1 372 . 1 . 1 70 70 THR HG22 H 1 1.0620 0.0000 . 1 . . 23162 . . 69 THR HG21 . 53440 1 373 . 1 . 1 70 70 THR HG23 H 1 1.0620 0.0000 . 1 . . 23162 . . 69 THR HG21 . 53440 1 374 . 1 . 1 70 70 THR C C 13 174.9314 0.0000 . 1 . . 46433 . . 69 THR C . 53440 1 375 . 1 . 1 70 70 THR CA C 13 60.5038 0.0000 . 1 . . 47681 . . 69 THR CA . 53440 1 376 . 1 . 1 70 70 THR CB C 13 71.7854 0.0000 . 1 . . 53969 . . 69 THR CB . 53440 1 377 . 1 . 1 70 70 THR CG2 C 13 21.3730 0.0000 . 1 . . . . . 69 THR CG2 . 53440 1 378 . 1 . 1 70 70 THR N N 15 112.1659 0.0000 . 1 . . 53931 . . 69 THR N . 53440 1 379 . 1 . 1 71 71 PHE H H 1 8.6215 0.0000 . 1 . . 48688 . . 70 PHE H . 53440 1 380 . 1 . 1 71 71 PHE C C 13 174.7318 0.0000 . 1 . . 55453 . . 70 PHE C . 53440 1 381 . 1 . 1 71 71 PHE CA C 13 52.5954 0.0000 . 1 . . 55450 . . 70 PHE CA . 53440 1 382 . 1 . 1 71 71 PHE CB C 13 39.8842 0.0000 . 1 . . 55456 . . 70 PHE CB . 53440 1 383 . 1 . 1 71 71 PHE N N 15 128.3440 0.0000 . 1 . . 48690 . . 70 PHE N . 53440 1 384 . 1 . 1 72 72 SER H H 1 8.3845 0.0000 . 1 . . 51163 . . 71 SER H . 53440 1 385 . 1 . 1 72 72 SER C C 13 173.3526 0.0000 . 1 . . 46379 . . 71 SER C . 53440 1 386 . 1 . 1 72 72 SER CA C 13 57.6797 0.0000 . 1 . . 47564 . . 71 SER CA . 53440 1 387 . 1 . 1 72 72 SER CB C 13 65.3683 0.0000 . 1 . . 53732 . . 71 SER CB . 53440 1 388 . 1 . 1 72 72 SER N N 15 114.3480 0.0000 . 1 . . 51165 . . 71 SER N . 53440 1 389 . 1 . 1 73 73 LEU H H 1 8.9176 0.0000 . 1 . . 53014 . . 72 LEU H . 53440 1 390 . 1 . 1 73 73 LEU HD11 H 1 0.9710 0.0000 . 2 . . . . . 72 LEU HD11 . 53440 1 391 . 1 . 1 73 73 LEU HD12 H 1 0.9710 0.0000 . 2 . . . . . 72 LEU HD11 . 53440 1 392 . 1 . 1 73 73 LEU HD13 H 1 0.9710 0.0000 . 2 . . . . . 72 LEU HD11 . 53440 1 393 . 1 . 1 73 73 LEU HD21 H 1 1.0470 0.0000 . 2 . . . . . 72 LEU HD21 . 53440 1 394 . 1 . 1 73 73 LEU HD22 H 1 1.0470 0.0000 . 2 . . . . . 72 LEU HD21 . 53440 1 395 . 1 . 1 73 73 LEU HD23 H 1 1.0470 0.0000 . 2 . . . . . 72 LEU HD21 . 53440 1 396 . 1 . 1 73 73 LEU C C 13 176.2617 0.0000 . 1 . . 64570 . . 72 LEU C . 53440 1 397 . 1 . 1 73 73 LEU CA C 13 54.1765 0.0000 . 1 . . 47237 . . 72 LEU CA . 53440 1 398 . 1 . 1 73 73 LEU CB C 13 45.6413 0.0000 . 1 . . 53048 . . 72 LEU CB . 53440 1 399 . 1 . 1 73 73 LEU CD1 C 13 26.5190 0.0000 . 2 . . . . . 72 LEU CD1 . 53440 1 400 . 1 . 1 73 73 LEU CD2 C 13 25.1440 0.0000 . 2 . . . . . 72 LEU CD2 . 53440 1 401 . 1 . 1 73 73 LEU N N 15 119.7298 0.0000 . 1 . . 53016 . . 72 LEU N . 53440 1 402 . 1 . 1 74 74 ASP H H 1 8.6839 0.0000 . 1 . . 53116 . . 73 ASP H . 53440 1 403 . 1 . 1 74 74 ASP C C 13 177.7160 0.0000 . 1 . . 108675 . . 73 ASP C . 53440 1 404 . 1 . 1 74 74 ASP CA C 13 53.3050 0.0000 . 1 . . 47276 . . 73 ASP CA . 53440 1 405 . 1 . 1 74 74 ASP CB C 13 41.4783 0.0000 . 1 . . 53117 . . 73 ASP CB . 53440 1 406 . 1 . 1 74 74 ASP N N 15 119.3169 0.0000 . 1 . . 53118 . . 73 ASP N . 53440 1 407 . 1 . 1 79 79 THR C C 13 170.9483 0.0000 . 1 . . 54272 . . 78 THR C . 53440 1 408 . 1 . 1 79 79 THR CA C 13 60.6212 0.0000 . 1 . . 46580 . . 78 THR CA . 53440 1 409 . 1 . 1 79 79 THR CB C 13 72.2201 0.0000 . 1 . . 51422 . . 78 THR CB . 53440 1 410 . 1 . 1 80 80 ALA H H 1 8.6852 0.0000 . 1 . . 45556 . . 79 ALA H . 53440 1 411 . 1 . 1 80 80 ALA HB1 H 1 1.5960 0.0000 . 1 . . 23363 . . 79 ALA HB1 . 53440 1 412 . 1 . 1 80 80 ALA HB2 H 1 1.5960 0.0000 . 1 . . 23363 . . 79 ALA HB1 . 53440 1 413 . 1 . 1 80 80 ALA HB3 H 1 1.5960 0.0000 . 1 . . 23363 . . 79 ALA HB1 . 53440 1 414 . 1 . 1 80 80 ALA C C 13 174.8586 0.0000 . 1 . . 45530 . . 79 ALA C . 53440 1 415 . 1 . 1 80 80 ALA CA C 13 49.1622 0.0000 . 1 . . 46589 . . 79 ALA CA . 53440 1 416 . 1 . 1 80 80 ALA CB C 13 20.6610 0.0000 . 1 . . 51452 . . 79 ALA CB . 53440 1 417 . 1 . 1 80 80 ALA N N 15 128.6355 0.0000 . 1 . . 45558 . . 79 ALA N . 53440 1 418 . 1 . 1 81 81 TYR H H 1 8.9165 0.0000 . 1 . . 53149 . . 80 TYR H . 53440 1 419 . 1 . 1 81 81 TYR C C 13 175.9989 0.0000 . 1 . . 46151 . . 80 TYR C . 53440 1 420 . 1 . 1 81 81 TYR CA C 13 56.5978 0.0000 . 1 . . 53141 . . 80 TYR CA . 53440 1 421 . 1 . 1 81 81 TYR CB C 13 40.9324 0.0000 . 1 . . 53156 . . 80 TYR CB . 53440 1 422 . 1 . 1 81 81 TYR N N 15 119.0007 0.0000 . 1 . . 53151 . . 80 TYR N . 53440 1 423 . 1 . 1 82 82 LEU H H 1 8.4976 0.0000 . 1 . . 51790 . . 81 LEU H . 53440 1 424 . 1 . 1 82 82 LEU HD11 H 1 0.0790 0.0000 . 2 . . . . . 81 LEU HD11 . 53440 1 425 . 1 . 1 82 82 LEU HD12 H 1 0.0790 0.0000 . 2 . . . . . 81 LEU HD11 . 53440 1 426 . 1 . 1 82 82 LEU HD13 H 1 0.0790 0.0000 . 2 . . . . . 81 LEU HD11 . 53440 1 427 . 1 . 1 82 82 LEU HD21 H 1 0.2580 0.0000 . 2 . . . . . 81 LEU HD21 . 53440 1 428 . 1 . 1 82 82 LEU HD22 H 1 0.2580 0.0000 . 2 . . . . . 81 LEU HD21 . 53440 1 429 . 1 . 1 82 82 LEU HD23 H 1 0.2580 0.0000 . 2 . . . . . 81 LEU HD21 . 53440 1 430 . 1 . 1 82 82 LEU C C 13 173.4726 0.0000 . 1 . . 56105 . . 81 LEU C . 53440 1 431 . 1 . 1 82 82 LEU CA C 13 53.2556 0.0000 . 1 . . 56107 . . 81 LEU CA . 53440 1 432 . 1 . 1 82 82 LEU CB C 13 40.4153 0.0000 . 1 . . 56118 . . 81 LEU CB . 53440 1 433 . 1 . 1 82 82 LEU CD1 C 13 25.1770 0.0000 . 2 . . . . . 81 LEU CD1 . 53440 1 434 . 1 . 1 82 82 LEU CD2 C 13 22.7940 0.0000 . 2 . . . . . 81 LEU CD2 . 53440 1 435 . 1 . 1 82 82 LEU N N 15 126.7572 0.0000 . 1 . . 51792 . . 81 LEU N . 53440 1 436 . 1 . 1 83 83 GLN H H 1 8.8170 0.0000 . 1 . . 46606 . . 82 GLN H . 53440 1 437 . 1 . 1 83 83 GLN CA C 13 54.0984 0.0000 . 1 . . 46604 . . 82 GLN CA . 53440 1 438 . 1 . 1 83 83 GLN CB C 13 28.6223 0.0000 . 1 . . 51488 . . 82 GLN CB . 53440 1 439 . 1 . 1 83 83 GLN N N 15 128.3397 0.0000 . 1 . . 46608 . . 82 GLN N . 53440 1 440 . 1 . 1 84 84 MET H H 1 8.7599 0.0000 . 1 . . 50686 . . 83 MET H . 53440 1 441 . 1 . 1 84 84 MET CA C 13 54.2846 0.0000 . 1 . . 56300 . . 83 MET CA . 53440 1 442 . 1 . 1 84 84 MET CB C 13 35.0499 0.0000 . 1 . . 56296 . . 83 MET CB . 53440 1 443 . 1 . 1 84 84 MET N N 15 126.4795 0.0000 . 1 . . 50688 . . 83 MET N . 53440 1 444 . 1 . 1 85 85 ASN H H 1 8.0081 0.0000 . 1 . . 50959 . . 84 ASN H . 53440 1 445 . 1 . 1 85 85 ASN C C 13 173.1600 0.0000 . 1 . . 46085 . . 84 ASN C . 53440 1 446 . 1 . 1 85 85 ASN CA C 13 51.1973 0.0000 . 1 . . 47195 . . 84 ASN CA . 53440 1 447 . 1 . 1 85 85 ASN CB C 13 41.2525 0.0000 . 1 . . 52967 . . 84 ASN CB . 53440 1 448 . 1 . 1 85 85 ASN N N 15 120.2526 0.0000 . 1 . . 50961 . . 84 ASN N . 53440 1 449 . 1 . 1 86 86 SER H H 1 8.3808 0.0000 . 1 . . 51238 . . 85 SER H . 53440 1 450 . 1 . 1 86 86 SER C C 13 175.6857 0.0000 . 1 . . 46427 . . 85 SER C . 53440 1 451 . 1 . 1 86 86 SER CA C 13 56.9529 0.0000 . 1 . . 47669 . . 85 SER CA . 53440 1 452 . 1 . 1 86 86 SER CB C 13 61.6914 0.0000 . 1 . . 53939 . . 85 SER CB . 53440 1 453 . 1 . 1 86 86 SER N N 15 112.3717 0.0000 . 1 . . 51240 . . 85 SER N . 53440 1 454 . 1 . 1 87 87 LEU H H 1 7.9249 0.0000 . 1 . . 53101 . . 86 LEU H . 53440 1 455 . 1 . 1 87 87 LEU HD11 H 1 0.5970 0.0000 . 2 . . . . . 86 LEU HD11 . 53440 1 456 . 1 . 1 87 87 LEU HD12 H 1 0.5970 0.0000 . 2 . . . . . 86 LEU HD11 . 53440 1 457 . 1 . 1 87 87 LEU HD13 H 1 0.5970 0.0000 . 2 . . . . . 86 LEU HD11 . 53440 1 458 . 1 . 1 87 87 LEU HD21 H 1 0.9090 0.0000 . 2 . . . . . 86 LEU HD21 . 53440 1 459 . 1 . 1 87 87 LEU HD22 H 1 0.9090 0.0000 . 2 . . . . . 86 LEU HD21 . 53440 1 460 . 1 . 1 87 87 LEU HD23 H 1 0.9090 0.0000 . 2 . . . . . 86 LEU HD21 . 53440 1 461 . 1 . 1 87 87 LEU C C 13 176.9380 0.0000 . 1 . . 79047 . . 86 LEU C . 53440 1 462 . 1 . 1 87 87 LEU CA C 13 56.0154 0.0000 . 1 . . 79042 . . 86 LEU CA . 53440 1 463 . 1 . 1 87 87 LEU CB C 13 42.3601 0.0000 . 1 . . 79043 . . 86 LEU CB . 53440 1 464 . 1 . 1 87 87 LEU CD1 C 13 26.7570 0.0000 . 2 . . . . . 86 LEU CD1 . 53440 1 465 . 1 . 1 87 87 LEU CD2 C 13 23.8440 0.0000 . 2 . . . . . 86 LEU CD2 . 53440 1 466 . 1 . 1 87 87 LEU N N 15 119.1075 0.0000 . 1 . . 53103 . . 86 LEU N . 53440 1 467 . 1 . 1 88 88 ARG H H 1 9.5991 0.0000 . 1 . . 50905 . . 87 ARG H . 53440 1 468 . 1 . 1 88 88 ARG C C 13 177.0523 0.0000 . 1 . . 46016 . . 87 ARG C . 53440 1 469 . 1 . 1 88 88 ARG CA C 13 53.4026 0.0000 . 1 . . 52772 . . 87 ARG CA . 53440 1 470 . 1 . 1 88 88 ARG CB C 13 33.0662 0.0000 . 1 . . 52793 . . 87 ARG CB . 53440 1 471 . 1 . 1 88 88 ARG N N 15 121.2885 0.0000 . 1 . . 50907 . . 87 ARG N . 53440 1 472 . 1 . 1 89 89 ALA H H 1 9.0535 0.0000 . 1 . . 50707 . . 88 ALA H . 53440 1 473 . 1 . 1 89 89 ALA HB1 H 1 1.5440 0.0000 . 1 . . 23045 . . 88 ALA HB1 . 53440 1 474 . 1 . 1 89 89 ALA HB2 H 1 1.5440 0.0000 . 1 . . 23045 . . 88 ALA HB1 . 53440 1 475 . 1 . 1 89 89 ALA HB3 H 1 1.5440 0.0000 . 1 . . 23045 . . 88 ALA HB1 . 53440 1 476 . 1 . 1 89 89 ALA C C 13 180.7392 0.0000 . 1 . . 45689 . . 88 ALA C . 53440 1 477 . 1 . 1 89 89 ALA CA C 13 55.6196 0.0000 . 1 . . 46757 . . 88 ALA CA . 53440 1 478 . 1 . 1 89 89 ALA CB C 13 17.9850 0.0000 . 1 . . 51941 . . 88 ALA CB . 53440 1 479 . 1 . 1 89 89 ALA N N 15 125.8646 0.0000 . 1 . . 50709 . . 88 ALA N . 53440 1 480 . 1 . 1 90 90 GLU H H 1 9.3204 0.0000 . 1 . . 53530 . . 89 GLU H . 53440 1 481 . 1 . 1 90 90 GLU C C 13 176.1106 0.0000 . 1 . . 46298 . . 89 GLU C . 53440 1 482 . 1 . 1 90 90 GLU CA C 13 58.5166 0.0000 . 1 . . 53492 . . 89 GLU CA . 53440 1 483 . 1 . 1 90 90 GLU CB C 13 27.4038 0.0000 . 1 . . 53528 . . 89 GLU CB . 53440 1 484 . 1 . 1 90 90 GLU N N 15 115.5167 0.0000 . 1 . . 53532 . . 89 GLU N . 53440 1 485 . 1 . 1 91 91 ASP H H 1 8.5049 0.0000 . 1 . . 49831 . . 90 ASP H . 53440 1 486 . 1 . 1 91 91 ASP C C 13 176.6633 0.0000 . 1 . . 46181 . . 90 ASP C . 53440 1 487 . 1 . 1 91 91 ASP CA C 13 55.2354 0.0000 . 1 . . 47324 . . 90 ASP CA . 53440 1 488 . 1 . 1 91 91 ASP CB C 13 41.6602 0.0000 . 1 . . 53246 . . 90 ASP CB . 53440 1 489 . 1 . 1 91 91 ASP N N 15 118.4039 0.0000 . 1 . . 49833 . . 90 ASP N . 53440 1 490 . 1 . 1 92 92 THR H H 1 7.8429 0.0000 . 1 . . 52747 . . 91 THR H . 53440 1 491 . 1 . 1 92 92 THR HG21 H 1 1.5770 0.0000 . 1 . . . . . 91 THR HG21 . 53440 1 492 . 1 . 1 92 92 THR HG22 H 1 1.5770 0.0000 . 1 . . . . . 91 THR HG21 . 53440 1 493 . 1 . 1 92 92 THR HG23 H 1 1.5770 0.0000 . 1 . . . . . 91 THR HG21 . 53440 1 494 . 1 . 1 92 92 THR C C 13 174.5293 0.0000 . 1 . . 62208 . . 91 THR C . 53440 1 495 . 1 . 1 92 92 THR CA C 13 64.4448 0.0000 . 1 . . 62212 . . 91 THR CA . 53440 1 496 . 1 . 1 92 92 THR CB C 13 69.6218 0.0000 . 1 . . 62207 . . 91 THR CB . 53440 1 497 . 1 . 1 92 92 THR CG2 C 13 20.3530 0.0000 . 1 . . . . . 91 THR CG2 . 53440 1 498 . 1 . 1 92 92 THR N N 15 121.1730 0.0000 . 1 . . 52749 . . 91 THR N . 53440 1 499 . 1 . 1 93 93 ALA H H 1 8.9393 0.0000 . 1 . . 51601 . . 92 ALA H . 53440 1 500 . 1 . 1 93 93 ALA HB1 H 1 1.0570 0.0000 . 1 . . 23144 . . 92 ALA HB1 . 53440 1 501 . 1 . 1 93 93 ALA HB2 H 1 1.0570 0.0000 . 1 . . 23144 . . 92 ALA HB1 . 53440 1 502 . 1 . 1 93 93 ALA HB3 H 1 1.0570 0.0000 . 1 . . 23144 . . 92 ALA HB1 . 53440 1 503 . 1 . 1 93 93 ALA C C 13 175.5067 0.0000 . 1 . . 45575 . . 92 ALA C . 53440 1 504 . 1 . 1 93 93 ALA CA C 13 52.0859 0.0000 . 1 . . 46649 . . 92 ALA CA . 53440 1 505 . 1 . 1 93 93 ALA CB C 13 20.3320 0.0000 . 1 . . 51605 . . 92 ALA CB . 53440 1 506 . 1 . 1 93 93 ALA N N 15 127.8330 0.0000 . 1 . . 51603 . . 92 ALA N . 53440 1 507 . 1 . 1 94 94 VAL H H 1 7.9719 0.0000 . 1 . . 53053 . . 93 VAL H . 53440 1 508 . 1 . 1 94 94 VAL HG11 H 1 0.9130 0.0000 . 2 . . . . . 93 VAL HG11 . 53440 1 509 . 1 . 1 94 94 VAL HG12 H 1 0.9130 0.0000 . 2 . . . . . 93 VAL HG11 . 53440 1 510 . 1 . 1 94 94 VAL HG13 H 1 0.9130 0.0000 . 2 . . . . . 93 VAL HG11 . 53440 1 511 . 1 . 1 94 94 VAL HG21 H 1 0.2300 0.0000 . 2 . . . . . 93 VAL HG21 . 53440 1 512 . 1 . 1 94 94 VAL HG22 H 1 0.2300 0.0000 . 2 . . . . . 93 VAL HG21 . 53440 1 513 . 1 . 1 94 94 VAL HG23 H 1 0.2300 0.0000 . 2 . . . . . 93 VAL HG21 . 53440 1 514 . 1 . 1 94 94 VAL C C 13 175.6831 0.0000 . 1 . . 46094 . . 93 VAL C . 53440 1 515 . 1 . 1 94 94 VAL CA C 13 62.1564 0.0000 . 1 . . 52985 . . 93 VAL CA . 53440 1 516 . 1 . 1 94 94 VAL CB C 13 31.6865 0.0000 . 1 . . 53006 . . 93 VAL CB . 53440 1 517 . 1 . 1 94 94 VAL CG1 C 13 22.8670 0.0000 . 2 . . . . . 93 VAL CG1 . 53440 1 518 . 1 . 1 94 94 VAL CG2 C 13 20.9630 0.0000 . 2 . . . . . 93 VAL CG2 . 53440 1 519 . 1 . 1 94 94 VAL N N 15 119.9340 0.0000 . 1 . . 53055 . . 93 VAL N . 53440 1 520 . 1 . 1 95 95 TYR H H 1 8.8848 0.0000 . 1 . . 85891 . . 94 TYR H . 53440 1 521 . 1 . 1 95 95 TYR C C 13 176.4684 0.0000 . 1 . . 86183 . . 94 TYR C . 53440 1 522 . 1 . 1 95 95 TYR CA C 13 57.5466 0.0000 . 1 . . 86189 . . 94 TYR CA . 53440 1 523 . 1 . 1 95 95 TYR CB C 13 40.4874 0.0000 . 1 . . 86188 . . 94 TYR CB . 53440 1 524 . 1 . 1 95 95 TYR N N 15 125.2353 0.0000 . 1 . . 85893 . . 94 TYR N . 53440 1 525 . 1 . 1 98 98 ALA H H 1 9.4309 0.0000 . 1 . . 51337 . . 97 ALA H . 53440 1 526 . 1 . 1 98 98 ALA C C 13 175.8616 0.0000 . 1 . . 68232 . . 97 ALA C . 53440 1 527 . 1 . 1 98 98 ALA CA C 13 51.0776 0.0000 . 1 . . 68235 . . 97 ALA CA . 53440 1 528 . 1 . 1 98 98 ALA CB C 13 19.7104 0.0000 . 1 . . 68242 . . 97 ALA CB . 53440 1 529 . 1 . 1 98 98 ALA N N 15 136.5620 0.0000 . 1 . . 51339 . . 97 ALA N . 53440 1 530 . 1 . 1 99 99 LYS H H 1 8.4774 0.0000 . 1 . . 52261 . . 98 LYS H . 53440 1 531 . 1 . 1 99 99 LYS C C 13 175.6600 0.0000 . 1 . . 108857 . . 98 LYS C . 53440 1 532 . 1 . 1 99 99 LYS CA C 13 53.9140 0.0000 . 1 . . 108865 . . 98 LYS CA . 53440 1 533 . 1 . 1 99 99 LYS CB C 13 34.2560 0.0000 . 1 . . 108869 . . 98 LYS CB . 53440 1 534 . 1 . 1 99 99 LYS N N 15 124.5962 0.0000 . 1 . . 52263 . . 98 LYS N . 53440 1 535 . 1 . 1 100 100 TYR H H 1 7.6322 0.0000 . 1 . . 52861 . . 99 TYR H . 53440 1 536 . 1 . 1 100 100 TYR C C 13 175.3157 0.0000 . 1 . . 108871 . . 99 TYR C . 53440 1 537 . 1 . 1 100 100 TYR CA C 13 53.9470 0.0000 . 1 . . 52841 . . 99 TYR CA . 53440 1 538 . 1 . 1 100 100 TYR CB C 13 38.1553 0.0000 . 1 . . 52862 . . 99 TYR CB . 53440 1 539 . 1 . 1 100 100 TYR N N 15 120.8773 0.0000 . 1 . . 52863 . . 99 TYR N . 53440 1 540 . 1 . 1 109 109 TRP C C 13 172.8262 0.0000 . 1 . . 84093 . . 108 TRP C . 53440 1 541 . 1 . 1 109 109 TRP CA C 13 53.9449 0.0000 . 1 . . 84096 . . 108 TRP CA . 53440 1 542 . 1 . 1 109 109 TRP CB C 13 26.1485 0.0000 . 1 . . 84100 . . 108 TRP CB . 53440 1 543 . 1 . 1 110 110 TYR H H 1 6.0677 0.0000 . 1 . . 83629 . . 109 TYR H . 53440 1 544 . 1 . 1 110 110 TYR C C 13 172.1123 0.0000 . 1 . . 84094 . . 109 TYR C . 53440 1 545 . 1 . 1 110 110 TYR CA C 13 53.4524 0.0000 . 1 . . 84098 . . 109 TYR CA . 53440 1 546 . 1 . 1 110 110 TYR CB C 13 39.3974 0.0000 . 1 . . 84099 . . 109 TYR CB . 53440 1 547 . 1 . 1 110 110 TYR N N 15 116.3009 0.0000 . 1 . . 83631 . . 109 TYR N . 53440 1 548 . 1 . 1 111 111 PHE H H 1 7.3751 0.0000 . 1 . . 51025 . . 110 PHE H . 53440 1 549 . 1 . 1 111 111 PHE C C 13 175.0246 0.0000 . 1 . . 46193 . . 110 PHE C . 53440 1 550 . 1 . 1 111 111 PHE CA C 13 54.2743 0.0000 . 1 . . 47330 . . 110 PHE CA . 53440 1 551 . 1 . 1 111 111 PHE CB C 13 37.5415 0.0000 . 1 . . 53255 . . 110 PHE CB . 53440 1 552 . 1 . 1 111 111 PHE N N 15 118.3556 0.0000 . 1 . . 51027 . . 110 PHE N . 53440 1 553 . 1 . 1 112 112 ASP H H 1 8.3648 0.0000 . 1 . . 82879 . . 111 ASP H . 53440 1 554 . 1 . 1 112 112 ASP C C 13 175.0503 0.0000 . 1 . . . . . 111 ASP C . 53440 1 555 . 1 . 1 112 112 ASP CA C 13 56.0474 0.0000 . 1 . . . . . 111 ASP CA . 53440 1 556 . 1 . 1 112 112 ASP CB C 13 42.8644 0.0000 . 1 . . . . . 111 ASP CB . 53440 1 557 . 1 . 1 112 112 ASP N N 15 125.8521 0.0000 . 1 . . 82881 . . 111 ASP N . 53440 1 558 . 1 . 1 118 118 THR C C 13 171.8100 0.0000 . 1 . . 54242 . . 117 THR C . 53440 1 559 . 1 . 1 118 118 THR CA C 13 60.0096 0.0000 . 1 . . 46535 . . 117 THR CA . 53440 1 560 . 1 . 1 118 118 THR CB C 13 70.1309 0.0000 . 1 . . 51344 . . 117 THR CB . 53440 1 561 . 1 . 1 119 119 LEU H H 1 8.3705 0.0000 . 1 . . 51343 . . 118 LEU H . 53440 1 562 . 1 . 1 119 119 LEU HD11 H 1 0.6750 0.0000 . 2 . . . . . 118 LEU HD11 . 53440 1 563 . 1 . 1 119 119 LEU HD12 H 1 0.6750 0.0000 . 2 . . . . . 118 LEU HD11 . 53440 1 564 . 1 . 1 119 119 LEU HD13 H 1 0.6750 0.0000 . 2 . . . . . 118 LEU HD11 . 53440 1 565 . 1 . 1 119 119 LEU HD21 H 1 0.7060 0.0000 . 2 . . . . . 118 LEU HD21 . 53440 1 566 . 1 . 1 119 119 LEU HD22 H 1 0.7060 0.0000 . 2 . . . . . 118 LEU HD21 . 53440 1 567 . 1 . 1 119 119 LEU HD23 H 1 0.7060 0.0000 . 2 . . . . . 118 LEU HD21 . 53440 1 568 . 1 . 1 119 119 LEU C C 13 175.9942 0.0000 . 1 . . 45494 . . 118 LEU C . 53440 1 569 . 1 . 1 119 119 LEU CA C 13 55.3187 0.0000 . 1 . . 51350 . . 118 LEU CA . 53440 1 570 . 1 . 1 119 119 LEU CB C 13 41.8363 0.0000 . 1 . . 51353 . . 118 LEU CB . 53440 1 571 . 1 . 1 119 119 LEU CD1 C 13 25.9480 0.0000 . 2 . . . . . 118 LEU CD1 . 53440 1 572 . 1 . 1 119 119 LEU CD2 C 13 21.8810 0.0000 . 2 . . . . . 118 LEU CD2 . 53440 1 573 . 1 . 1 119 119 LEU N N 15 132.4553 0.0000 . 1 . . 51345 . . 118 LEU N . 53440 1 574 . 1 . 1 120 120 VAL H H 1 8.8780 0.0000 . 1 . . 50566 . . 119 VAL H . 53440 1 575 . 1 . 1 120 120 VAL HG11 H 1 0.7520 0.0000 . 2 . . . . . 119 VAL HG11 . 53440 1 576 . 1 . 1 120 120 VAL HG12 H 1 0.7520 0.0000 . 2 . . . . . 119 VAL HG11 . 53440 1 577 . 1 . 1 120 120 VAL HG13 H 1 0.7520 0.0000 . 2 . . . . . 119 VAL HG11 . 53440 1 578 . 1 . 1 120 120 VAL HG21 H 1 0.7230 0.0000 . 2 . . . . . 119 VAL HG21 . 53440 1 579 . 1 . 1 120 120 VAL HG22 H 1 0.7230 0.0000 . 2 . . . . . 119 VAL HG21 . 53440 1 580 . 1 . 1 120 120 VAL HG23 H 1 0.7230 0.0000 . 2 . . . . . 119 VAL HG21 . 53440 1 581 . 1 . 1 120 120 VAL C C 13 173.9147 0.0000 . 1 . . 45503 . . 119 VAL C . 53440 1 582 . 1 . 1 120 120 VAL CA C 13 61.5906 0.0000 . 1 . . 51356 . . 119 VAL CA . 53440 1 583 . 1 . 1 120 120 VAL CB C 13 33.2529 0.0000 . 1 . . 51365 . . 119 VAL CB . 53440 1 584 . 1 . 1 120 120 VAL CG1 C 13 23.0370 0.0000 . 2 . . . . . 119 VAL CG1 . 53440 1 585 . 1 . 1 120 120 VAL CG2 C 13 20.0610 0.0000 . 2 . . . . . 119 VAL CG2 . 53440 1 586 . 1 . 1 120 120 VAL N N 15 131.2187 0.0000 . 1 . . 50568 . . 119 VAL N . 53440 1 587 . 1 . 1 121 121 THR H H 1 8.2217 0.0000 . 1 . . 49213 . . 120 THR H . 53440 1 588 . 1 . 1 121 121 THR HG21 H 1 0.9850 0.0000 . 1 . . 23168 . . 120 THR HG21 . 53440 1 589 . 1 . 1 121 121 THR HG22 H 1 0.9850 0.0000 . 1 . . 23168 . . 120 THR HG21 . 53440 1 590 . 1 . 1 121 121 THR HG23 H 1 0.9850 0.0000 . 1 . . 23168 . . 120 THR HG21 . 53440 1 591 . 1 . 1 121 121 THR C C 13 172.2592 0.0000 . 1 . . 45878 . . 120 THR C . 53440 1 592 . 1 . 1 121 121 THR CA C 13 61.9976 0.0000 . 1 . . 58948 . . 120 THR CA . 53440 1 593 . 1 . 1 121 121 THR CB C 13 69.6998 0.0000 . 1 . . 52313 . . 120 THR CB . 53440 1 594 . 1 . 1 121 121 THR CG2 C 13 20.9390 0.0000 . 1 . . . . . 120 THR CG2 . 53440 1 595 . 1 . 1 121 121 THR N N 15 123.6745 0.0000 . 1 . . 49215 . . 120 THR N . 53440 1 596 . 1 . 1 122 122 VAL H H 1 8.3066 0.0000 . 1 . . 51556 . . 121 VAL H . 53440 1 597 . 1 . 1 122 122 VAL HG11 H 1 0.4020 0.0000 . 2 . . . . . 121 VAL HG11 . 53440 1 598 . 1 . 1 122 122 VAL HG12 H 1 0.4020 0.0000 . 2 . . . . . 121 VAL HG11 . 53440 1 599 . 1 . 1 122 122 VAL HG13 H 1 0.4020 0.0000 . 2 . . . . . 121 VAL HG11 . 53440 1 600 . 1 . 1 122 122 VAL HG21 H 1 0.6990 0.0000 . 2 . . . . . 121 VAL HG21 . 53440 1 601 . 1 . 1 122 122 VAL HG22 H 1 0.6990 0.0000 . 2 . . . . . 121 VAL HG21 . 53440 1 602 . 1 . 1 122 122 VAL HG23 H 1 0.6990 0.0000 . 2 . . . . . 121 VAL HG21 . 53440 1 603 . 1 . 1 122 122 VAL C C 13 176.0303 0.0000 . 1 . . 45563 . . 121 VAL C . 53440 1 604 . 1 . 1 122 122 VAL CA C 13 59.4434 0.0000 . 1 . . 51503 . . 121 VAL CA . 53440 1 605 . 1 . 1 122 122 VAL CB C 13 30.5408 0.0000 . 1 . . 51482 . . 121 VAL CB . 53440 1 606 . 1 . 1 122 122 VAL CG1 C 13 19.9540 0.0000 . 2 . . . . . 121 VAL CG1 . 53440 1 607 . 1 . 1 122 122 VAL CG2 C 13 20.2480 0.0000 . 2 . . . . . 121 VAL CG2 . 53440 1 608 . 1 . 1 122 122 VAL N N 15 128.2319 0.0000 . 1 . . 51558 . . 121 VAL N . 53440 1 609 . 1 . 1 123 123 SER C C 13 173.7434 0.0000 . 1 . . 46115 . . 122 SER C . 53440 1 610 . 1 . 1 123 123 SER CA C 13 56.5069 0.0000 . 1 . . 53033 . . 122 SER CA . 53440 1 611 . 1 . 1 123 123 SER CB C 13 63.9387 0.0000 . 1 . . 53018 . . 122 SER CB . 53440 1 612 . 1 . 1 123 123 SER N N 15 119.6024 0.0000 . 1 . . 53100 . . 122 SER N . 53440 1 613 . 1 . 1 124 124 SER H H 1 8.6679 0.0000 . 1 . . 49426 . . 123 SER H . 53440 1 614 . 1 . 1 124 124 SER C C 13 173.9876 0.0000 . 1 . . 60991 . . 123 SER C . 53440 1 615 . 1 . 1 124 124 SER CA C 13 58.5056 0.0000 . 1 . . 60989 . . 123 SER CA . 53440 1 616 . 1 . 1 124 124 SER N N 15 122.4107 0.0000 . 1 . . 49428 . . 123 SER N . 53440 1 617 . 1 . 1 125 125 ALA H H 1 8.2030 0.0000 . 1 . . 50665 . . 124 ALA H . 53440 1 618 . 1 . 1 125 125 ALA HB1 H 1 0.6090 0.0000 . 1 . . 23306 . . 124 ALA HB1 . 53440 1 619 . 1 . 1 125 125 ALA HB2 H 1 0.6090 0.0000 . 1 . . 23306 . . 124 ALA HB1 . 53440 1 620 . 1 . 1 125 125 ALA HB3 H 1 0.6090 0.0000 . 1 . . 23306 . . 124 ALA HB1 . 53440 1 621 . 1 . 1 125 125 ALA C C 13 175.7384 0.0000 . 1 . . 45614 . . 124 ALA C . 53440 1 622 . 1 . 1 125 125 ALA CA C 13 51.9832 0.0000 . 1 . . 46703 . . 124 ALA CA . 53440 1 623 . 1 . 1 125 125 ALA CB C 13 18.2830 0.0000 . 1 . . 51734 . . 124 ALA CB . 53440 1 624 . 1 . 1 125 125 ALA N N 15 127.2280 0.0000 . 1 . . 50667 . . 124 ALA N . 53440 1 625 . 1 . 1 126 126 SER H H 1 7.5238 0.0000 . 1 . . 53866 . . 125 SER H . 53440 1 626 . 1 . 1 126 126 SER C C 13 174.0895 0.0000 . 1 . . 46418 . . 125 SER C . 53440 1 627 . 1 . 1 126 126 SER CA C 13 57.0631 0.0000 . 1 . . 47645 . . 125 SER CA . 53440 1 628 . 1 . 1 126 126 SER CB C 13 65.0971 0.0000 . 1 . . 53852 . . 125 SER CB . 53440 1 629 . 1 . 1 126 126 SER N N 15 113.5081 0.0000 . 1 . . 53868 . . 125 SER N . 53440 1 630 . 1 . 1 127 127 THR H H 1 8.1305 0.0000 . 1 . . 53293 . . 126 THR H . 53440 1 631 . 1 . 1 127 127 THR HG21 H 1 1.2180 0.0000 . 1 . . . . . 126 THR HG21 . 53440 1 632 . 1 . 1 127 127 THR HG22 H 1 1.2180 0.0000 . 1 . . . . . 126 THR HG21 . 53440 1 633 . 1 . 1 127 127 THR HG23 H 1 1.2180 0.0000 . 1 . . . . . 126 THR HG21 . 53440 1 634 . 1 . 1 127 127 THR C C 13 174.8330 0.0000 . 1 . . 46211 . . 126 THR C . 53440 1 635 . 1 . 1 127 127 THR CA C 13 63.8145 0.0000 . 1 . . 53282 . . 126 THR CA . 53440 1 636 . 1 . 1 127 127 THR CB C 13 68.6152 0.0000 . 1 . . 53276 . . 126 THR CB . 53440 1 637 . 1 . 1 127 127 THR CG2 C 13 21.3490 0.0000 . 1 . . . . . 126 THR CG2 . 53440 1 638 . 1 . 1 127 127 THR N N 15 117.9880 0.0000 . 1 . . 53295 . . 126 THR N . 53440 1 639 . 1 . 1 128 128 LYS H H 1 9.4790 0.0000 . 1 . . 46522 . . 127 LYS H . 53440 1 640 . 1 . 1 128 128 LYS C C 13 175.4532 0.0000 . 1 . . 45527 . . 127 LYS C . 53440 1 641 . 1 . 1 128 128 LYS CA C 13 55.7622 0.0000 . 1 . . 46571 . . 127 LYS CA . 53440 1 642 . 1 . 1 128 128 LYS CB C 13 35.3297 0.0000 . 1 . . 51419 . . 127 LYS CB . 53440 1 643 . 1 . 1 128 128 LYS N N 15 129.2642 0.0000 . 1 . . 46524 . . 127 LYS N . 53440 1 644 . 1 . 1 129 129 GLY H H 1 8.9740 0.0000 . 1 . . 53833 . . 128 GLY H . 53440 1 645 . 1 . 1 129 129 GLY C C 13 171.1676 0.0000 . 1 . . 74837 . . 128 GLY C . 53440 1 646 . 1 . 1 129 129 GLY CA C 13 44.1199 0.0000 . 1 . . 74840 . . 128 GLY CA . 53440 1 647 . 1 . 1 129 129 GLY N N 15 113.9757 0.0000 . 1 . . 53835 . . 128 GLY N . 53440 1 648 . 1 . 1 130 130 PRO C C 13 177.3568 0.0000 . 1 . . 54695 . . 129 PRO C . 53440 1 649 . 1 . 1 130 130 PRO CA C 13 61.7899 0.0000 . 1 . . 47423 . . 129 PRO CA . 53440 1 650 . 1 . 1 130 130 PRO CB C 13 32.3468 0.0000 . 1 . . 53462 . . 129 PRO CB . 53440 1 651 . 1 . 1 131 131 SER H H 1 8.4400 0.0000 . 1 . . 53425 . . 130 SER H . 53440 1 652 . 1 . 1 131 131 SER C C 13 172.0143 0.0000 . 1 . . 46277 . . 130 SER C . 53440 1 653 . 1 . 1 131 131 SER CA C 13 57.9365 0.0000 . 1 . . 47435 . . 130 SER CA . 53440 1 654 . 1 . 1 131 131 SER CB C 13 64.8013 0.0000 . 1 . . 53417 . . 130 SER CB . 53440 1 655 . 1 . 1 131 131 SER N N 15 116.2184 0.0000 . 1 . . 53427 . . 130 SER N . 53440 1 656 . 1 . 1 132 132 VAL H H 1 7.9476 0.0000 . 1 . . 46936 . . 131 VAL H . 53440 1 657 . 1 . 1 132 132 VAL HG11 H 1 0.5950 0.0000 . 2 . . . . . 131 VAL HG11 . 53440 1 658 . 1 . 1 132 132 VAL HG12 H 1 0.5950 0.0000 . 2 . . . . . 131 VAL HG11 . 53440 1 659 . 1 . 1 132 132 VAL HG13 H 1 0.5950 0.0000 . 2 . . . . . 131 VAL HG11 . 53440 1 660 . 1 . 1 132 132 VAL HG21 H 1 0.5730 0.0000 . 2 . . . . . 131 VAL HG21 . 53440 1 661 . 1 . 1 132 132 VAL HG22 H 1 0.5730 0.0000 . 2 . . . . . 131 VAL HG21 . 53440 1 662 . 1 . 1 132 132 VAL HG23 H 1 0.5730 0.0000 . 2 . . . . . 131 VAL HG21 . 53440 1 663 . 1 . 1 132 132 VAL C C 13 173.8061 0.0000 . 1 . . 45866 . . 131 VAL C . 53440 1 664 . 1 . 1 132 132 VAL CA C 13 60.2990 0.0000 . 1 . . 46922 . . 131 VAL CA . 53440 1 665 . 1 . 1 132 132 VAL CB C 13 32.5445 0.0000 . 1 . . 52379 . . 131 VAL CB . 53440 1 666 . 1 . 1 132 132 VAL CG1 C 13 21.4330 0.0000 . 2 . . . . . 131 VAL CG1 . 53440 1 667 . 1 . 1 132 132 VAL CG2 C 13 20.9460 0.0000 . 2 . . . . . 131 VAL CG2 . 53440 1 668 . 1 . 1 132 132 VAL N N 15 123.5994 0.0000 . 1 . . 46938 . . 131 VAL N . 53440 1 669 . 1 . 1 133 133 PHE H H 1 9.1738 0.0000 . 1 . . 52111 . . 132 PHE H . 53440 1 670 . 1 . 1 133 133 PHE CA C 13 52.4651 0.0000 . 1 . . 51950 . . 132 PHE CA . 53440 1 671 . 1 . 1 133 133 PHE CB C 13 40.5173 0.0000 . 1 . . 51956 . . 132 PHE CB . 53440 1 672 . 1 . 1 133 133 PHE N N 15 125.5775 0.0000 . 1 . . 52113 . . 132 PHE N . 53440 1 673 . 1 . 1 134 134 PRO C C 13 176.1991 0.0000 . 1 . . 54404 . . 133 PRO C . 53440 1 674 . 1 . 1 134 134 PRO CA C 13 62.5983 0.0000 . 1 . . 46838 . . 133 PRO CA . 53440 1 675 . 1 . 1 134 134 PRO CB C 13 32.8536 0.0000 . 1 . . 52136 . . 133 PRO CB . 53440 1 676 . 1 . 1 135 135 LEU H H 1 8.3765 0.0000 . 1 . . 50749 . . 134 LEU H . 53440 1 677 . 1 . 1 135 135 LEU HD11 H 1 0.3090 0.0000 . 2 . . . . . 134 LEU HD11 . 53440 1 678 . 1 . 1 135 135 LEU HD12 H 1 0.3090 0.0000 . 2 . . . . . 134 LEU HD11 . 53440 1 679 . 1 . 1 135 135 LEU HD13 H 1 0.3090 0.0000 . 2 . . . . . 134 LEU HD11 . 53440 1 680 . 1 . 1 135 135 LEU HD21 H 1 0.5500 0.0000 . 2 . . . . . 134 LEU HD21 . 53440 1 681 . 1 . 1 135 135 LEU HD22 H 1 0.5500 0.0000 . 2 . . . . . 134 LEU HD21 . 53440 1 682 . 1 . 1 135 135 LEU HD23 H 1 0.5500 0.0000 . 2 . . . . . 134 LEU HD21 . 53440 1 683 . 1 . 1 135 135 LEU C C 13 173.9941 0.0000 . 1 . . 45782 . . 134 LEU C . 53440 1 684 . 1 . 1 135 135 LEU CA C 13 52.6763 0.0000 . 1 . . 46847 . . 134 LEU CA . 53440 1 685 . 1 . 1 135 135 LEU CB C 13 38.0044 0.0000 . 1 . . 52127 . . 134 LEU CB . 53440 1 686 . 1 . 1 135 135 LEU CD1 C 13 24.9280 0.0000 . 2 . . . . . 134 LEU CD1 . 53440 1 687 . 1 . 1 135 135 LEU CD2 C 13 23.9660 0.0000 . 2 . . . . . 134 LEU CD2 . 53440 1 688 . 1 . 1 135 135 LEU N N 15 124.9169 0.0000 . 1 . . 50751 . . 134 LEU N . 53440 1 689 . 1 . 1 136 136 ALA H H 1 7.9888 0.0000 . 1 . . 85679 . . 135 ALA H . 53440 1 690 . 1 . 1 136 136 ALA C C 13 175.0984 0.0000 . 1 . . 101596 . . 135 ALA C . 53440 1 691 . 1 . 1 136 136 ALA CA C 13 49.5639 0.0000 . 1 . . 85870 . . 135 ALA CA . 53440 1 692 . 1 . 1 136 136 ALA CB C 13 18.8649 0.0000 . 1 . . 85889 . . 135 ALA CB . 53440 1 693 . 1 . 1 136 136 ALA N N 15 124.6798 0.0000 . 1 . . 85681 . . 135 ALA N . 53440 1 694 . 1 . 1 137 137 PRO C C 13 176.2905 0.0000 . 1 . . 54752 . . 136 PRO C . 53440 1 695 . 1 . 1 137 137 PRO CA C 13 61.6103 0.0000 . 1 . . 47531 . . 136 PRO CA . 53440 1 696 . 1 . 1 137 137 PRO CB C 13 30.9273 0.0000 . 1 . . 53720 . . 136 PRO CB . 53440 1 697 . 1 . 1 138 138 SER H H 1 8.4322 0.0000 . 1 . . 53656 . . 137 SER H . 53440 1 698 . 1 . 1 138 138 SER C C 13 176.4367 0.0000 . 1 . . 73997 . . 137 SER C . 53440 1 699 . 1 . 1 138 138 SER CA C 13 57.5427 0.0000 . 1 . . 53687 . . 137 SER CA . 53440 1 700 . 1 . 1 138 138 SER CB C 13 65.4311 0.0000 . 1 . . 53663 . . 137 SER CB . 53440 1 701 . 1 . 1 138 138 SER N N 15 114.5958 0.0000 . 1 . . 53658 . . 137 SER N . 53440 1 702 . 1 . 1 139 139 SER H H 1 9.0603 0.0000 . 1 . . 50947 . . 138 SER H . 53440 1 703 . 1 . 1 139 139 SER C C 13 175.8640 0.0000 . 1 . . 63409 . . 138 SER C . 53440 1 704 . 1 . 1 139 139 SER CA C 13 60.4327 0.0000 . 1 . . 63379 . . 138 SER CA . 53440 1 705 . 1 . 1 139 139 SER CB C 13 62.8395 0.0000 . 1 . . 63381 . . 138 SER CB . 53440 1 706 . 1 . 1 139 139 SER N N 15 120.4244 0.0000 . 1 . . 50949 . . 138 SER N . 53440 1 707 . 1 . 1 140 140 LYS H H 1 8.2591 0.0000 . 1 . . 52810 . . 139 LYS H . 53440 1 708 . 1 . 1 140 140 LYS C C 13 177.0309 0.0000 . 1 . . 46028 . . 139 LYS C . 53440 1 709 . 1 . 1 140 140 LYS CA C 13 56.3086 0.0000 . 1 . . 47147 . . 139 LYS CA . 53440 1 710 . 1 . 1 140 140 LYS CB C 13 31.4252 0.0000 . 1 . . 52874 . . 139 LYS CB . 53440 1 711 . 1 . 1 140 140 LYS N N 15 120.8855 0.0000 . 1 . . 52812 . . 139 LYS N . 53440 1 712 . 1 . 1 141 141 SER H H 1 8.0611 0.0000 . 1 . . 53470 . . 140 SER H . 53440 1 713 . 1 . 1 141 141 SER C C 13 173.7838 0.0000 . 1 . . 71690 . . 140 SER C . 53440 1 714 . 1 . 1 141 141 SER CA C 13 57.5586 0.0000 . 1 . . 71695 . . 140 SER CA . 53440 1 715 . 1 . 1 141 141 SER CB C 13 63.7176 0.0000 . 1 . . 71694 . . 140 SER CB . 53440 1 716 . 1 . 1 141 141 SER N N 15 115.9855 0.0000 . 1 . . 53472 . . 140 SER N . 53440 1 717 . 1 . 1 142 142 THR H H 1 7.5751 0.0000 . 1 . . 54979 . . 141 THR H . 53440 1 718 . 1 . 1 142 142 THR HG21 H 1 1.2310 0.0000 . 1 . . 101878 . . 141 THR HG21 . 53440 1 719 . 1 . 1 142 142 THR HG22 H 1 1.2310 0.0000 . 1 . . 101878 . . 141 THR HG21 . 53440 1 720 . 1 . 1 142 142 THR HG23 H 1 1.2310 0.0000 . 1 . . 101878 . . 141 THR HG21 . 53440 1 721 . 1 . 1 142 142 THR C C 13 174.5642 0.0000 . 1 . . 82243 . . 141 THR C . 53440 1 722 . 1 . 1 142 142 THR CA C 13 61.3904 0.0000 . 1 . . 82244 . . 141 THR CA . 53440 1 723 . 1 . 1 142 142 THR CB C 13 69.8289 0.0000 . 1 . . 82250 . . 141 THR CB . 53440 1 724 . 1 . 1 142 142 THR CG2 C 13 20.6620 0.0000 . 1 . . . . . 141 THR CG2 . 53440 1 725 . 1 . 1 142 142 THR N N 15 115.2885 0.0000 . 1 . . 54981 . . 141 THR N . 53440 1 726 . 1 . 1 143 143 SER H H 1 8.6016 0.0000 . 1 . . 53089 . . 142 SER H . 53440 1 727 . 1 . 1 143 143 SER C C 13 175.3922 0.0000 . 1 . . 46139 . . 142 SER C . 53440 1 728 . 1 . 1 143 143 SER CA C 13 57.7423 0.0000 . 1 . . 53096 . . 142 SER CA . 53440 1 729 . 1 . 1 143 143 SER CB C 13 63.6631 0.0000 . 1 . . 53081 . . 142 SER CB . 53440 1 730 . 1 . 1 143 143 SER N N 15 119.2763 0.0000 . 1 . . 53091 . . 142 SER N . 53440 1 731 . 1 . 1 144 144 GLY H H 1 8.7226 0.0000 . 1 . . 53668 . . 143 GLY H . 53440 1 732 . 1 . 1 144 144 GLY C C 13 175.3062 0.0000 . 1 . . 74063 . . 143 GLY C . 53440 1 733 . 1 . 1 144 144 GLY CA C 13 45.9587 0.0000 . 1 . . 53705 . . 143 GLY CA . 53440 1 734 . 1 . 1 144 144 GLY N N 15 114.6878 0.0000 . 1 . . 53670 . . 143 GLY N . 53440 1 735 . 1 . 1 145 145 GLY H H 1 8.5060 0.0000 . 1 . . 54103 . . 144 GLY H . 53440 1 736 . 1 . 1 145 145 GLY C C 13 174.9625 0.0000 . 1 . . 77763 . . 144 GLY C . 53440 1 737 . 1 . 1 145 145 GLY CA C 13 45.3303 0.0000 . 1 . . 77764 . . 144 GLY CA . 53440 1 738 . 1 . 1 145 145 GLY N N 15 109.9410 0.0000 . 1 . . 54105 . . 144 GLY N . 53440 1 739 . 1 . 1 146 146 THR H H 1 8.0544 0.0000 . 1 . . 49822 . . 145 THR H . 53440 1 740 . 1 . 1 146 146 THR HG21 H 1 1.1370 0.0000 . 1 . . 23135 . . 145 THR HG21 . 53440 1 741 . 1 . 1 146 146 THR HG22 H 1 1.1370 0.0000 . 1 . . 23135 . . 145 THR HG21 . 53440 1 742 . 1 . 1 146 146 THR HG23 H 1 1.1370 0.0000 . 1 . . 23135 . . 145 THR HG21 . 53440 1 743 . 1 . 1 146 146 THR C C 13 172.1408 0.0000 . 1 . . 64785 . . 145 THR C . 53440 1 744 . 1 . 1 146 146 THR CA C 13 61.6111 0.0000 . 1 . . 64782 . . 145 THR CA . 53440 1 745 . 1 . 1 146 146 THR CB C 13 71.0743 0.0000 . 1 . . 64780 . . 145 THR CB . 53440 1 746 . 1 . 1 146 146 THR CG2 C 13 21.5730 0.0000 . 1 . . . . . 145 THR CG2 . 53440 1 747 . 1 . 1 146 146 THR N N 15 118.7021 0.0000 . 1 . . 49824 . . 145 THR N . 53440 1 748 . 1 . 1 147 147 ALA H H 1 9.2990 0.0000 . 1 . . 54301 . . 146 ALA H . 53440 1 749 . 1 . 1 147 147 ALA HB1 H 1 1.1500 0.0000 . 1 . . 23123 . . 146 ALA HB1 . 53440 1 750 . 1 . 1 147 147 ALA HB2 H 1 1.1500 0.0000 . 1 . . 23123 . . 146 ALA HB1 . 53440 1 751 . 1 . 1 147 147 ALA HB3 H 1 1.1500 0.0000 . 1 . . 23123 . . 146 ALA HB1 . 53440 1 752 . 1 . 1 147 147 ALA C C 13 174.2098 0.0000 . 1 . . 45584 . . 146 ALA C . 53440 1 753 . 1 . 1 147 147 ALA CA C 13 49.7322 0.0000 . 1 . . 51560 . . 146 ALA CA . 53440 1 754 . 1 . 1 147 147 ALA CB C 13 22.3260 0.0000 . 1 . . 51599 . . 146 ALA CB . 53440 1 755 . 1 . 1 147 147 ALA N N 15 127.8083 0.0000 . 1 . . 54303 . . 146 ALA N . 53440 1 756 . 1 . 1 148 148 ALA H H 1 7.4080 0.0000 . 1 . . 52849 . . 147 ALA H . 53440 1 757 . 1 . 1 148 148 ALA HB1 H 1 0.3520 0.0000 . 1 . . 23366 . . 147 ALA HB1 . 53440 1 758 . 1 . 1 148 148 ALA HB2 H 1 0.3520 0.0000 . 1 . . 23366 . . 147 ALA HB1 . 53440 1 759 . 1 . 1 148 148 ALA HB3 H 1 0.3520 0.0000 . 1 . . 23366 . . 147 ALA HB1 . 53440 1 760 . 1 . 1 148 148 ALA C C 13 174.7462 0.0000 . 1 . . 62652 . . 147 ALA C . 53440 1 761 . 1 . 1 148 148 ALA CA C 13 49.2570 0.0000 . 1 . . 62689 . . 147 ALA CA . 53440 1 762 . 1 . 1 148 148 ALA CB C 13 21.2010 0.0000 . 1 . . 62678 . . 147 ALA CB . 53440 1 763 . 1 . 1 148 148 ALA N N 15 120.8375 0.0000 . 1 . . 52851 . . 147 ALA N . 53440 1 764 . 1 . 1 149 149 LEU H H 1 8.3467 0.0000 . 1 . . 53341 . . 148 LEU H . 53440 1 765 . 1 . 1 149 149 LEU HD11 H 1 0.2860 0.0000 . 2 . . . . . 148 LEU HD11 . 53440 1 766 . 1 . 1 149 149 LEU HD12 H 1 0.2860 0.0000 . 2 . . . . . 148 LEU HD11 . 53440 1 767 . 1 . 1 149 149 LEU HD13 H 1 0.2860 0.0000 . 2 . . . . . 148 LEU HD11 . 53440 1 768 . 1 . 1 149 149 LEU HD21 H 1 0.2760 0.0000 . 2 . . . . . 148 LEU HD21 . 53440 1 769 . 1 . 1 149 149 LEU HD22 H 1 0.2760 0.0000 . 2 . . . . . 148 LEU HD21 . 53440 1 770 . 1 . 1 149 149 LEU HD23 H 1 0.2760 0.0000 . 2 . . . . . 148 LEU HD21 . 53440 1 771 . 1 . 1 149 149 LEU CA C 13 53.4369 0.0000 . 1 . . 79246 . . 148 LEU CA . 53440 1 772 . 1 . 1 149 149 LEU CB C 13 43.7634 0.0000 . 1 . . 79248 . . 148 LEU CB . 53440 1 773 . 1 . 1 149 149 LEU CD1 C 13 26.8080 0.0000 . 2 . . . . . 148 LEU CD1 . 53440 1 774 . 1 . 1 149 149 LEU CD2 C 13 26.8090 0.0000 . 2 . . . . . 148 LEU CD2 . 53440 1 775 . 1 . 1 149 149 LEU N N 15 117.4655 0.0000 . 1 . . 53343 . . 148 LEU N . 53440 1 776 . 1 . 1 150 150 GLY H H 1 8.8541 0.0000 . 1 . . 54220 . . 149 GLY H . 53440 1 777 . 1 . 1 150 150 GLY C C 13 171.8165 0.0000 . 1 . . 46520 . . 149 GLY C . 53440 1 778 . 1 . 1 150 150 GLY CA C 13 48.3948 0.0000 . 1 . . 54224 . . 149 GLY CA . 53440 1 779 . 1 . 1 150 150 GLY N N 15 105.4901 0.0000 . 1 . . 54222 . . 149 GLY N . 53440 1 780 . 1 . 1 151 151 CYS H H 1 9.4955 0.0000 . 1 . . 49813 . . 150 CYS H . 53440 1 781 . 1 . 1 151 151 CYS C C 13 171.2339 0.0000 . 1 . . 46223 . . 150 CYS C . 53440 1 782 . 1 . 1 151 151 CYS CA C 13 54.0718 0.0000 . 1 . . 47363 . . 150 CYS CA . 53440 1 783 . 1 . 1 151 151 CYS CB C 13 46.5486 0.0000 . 1 . . 53306 . . 150 CYS CB . 53440 1 784 . 1 . 1 151 151 CYS N N 15 118.1042 0.0000 . 1 . . 49815 . . 150 CYS N . 53440 1 785 . 1 . 1 152 152 LEU H H 1 9.4156 0.0000 . 1 . . 48790 . . 151 LEU H . 53440 1 786 . 1 . 1 152 152 LEU HD11 H 1 0.8090 0.0000 . 2 . . . . . 151 LEU HD11 . 53440 1 787 . 1 . 1 152 152 LEU HD12 H 1 0.8090 0.0000 . 2 . . . . . 151 LEU HD11 . 53440 1 788 . 1 . 1 152 152 LEU HD13 H 1 0.8090 0.0000 . 2 . . . . . 151 LEU HD11 . 53440 1 789 . 1 . 1 152 152 LEU HD21 H 1 0.7680 0.0000 . 2 . . . . . 151 LEU HD21 . 53440 1 790 . 1 . 1 152 152 LEU HD22 H 1 0.7680 0.0000 . 2 . . . . . 151 LEU HD21 . 53440 1 791 . 1 . 1 152 152 LEU HD23 H 1 0.7680 0.0000 . 2 . . . . . 151 LEU HD21 . 53440 1 792 . 1 . 1 152 152 LEU C C 13 173.7469 0.0000 . 1 . . 55706 . . 151 LEU C . 53440 1 793 . 1 . 1 152 152 LEU CA C 13 54.0105 0.0000 . 1 . . 55714 . . 151 LEU CA . 53440 1 794 . 1 . 1 152 152 LEU CB C 13 43.0015 0.0000 . 1 . . 55704 . . 151 LEU CB . 53440 1 795 . 1 . 1 152 152 LEU CD1 C 13 25.8870 0.0000 . 2 . . . . . 151 LEU CD1 . 53440 1 796 . 1 . 1 152 152 LEU CD2 C 13 23.1130 0.0000 . 2 . . . . . 151 LEU CD2 . 53440 1 797 . 1 . 1 152 152 LEU N N 15 127.6182 0.0000 . 1 . . 48792 . . 151 LEU N . 53440 1 798 . 1 . 1 153 153 VAL H H 1 9.3447 0.0000 . 1 . . 50578 . . 152 VAL H . 53440 1 799 . 1 . 1 153 153 VAL HG11 H 1 0.5750 0.0000 . 2 . . . . . 152 VAL HG11 . 53440 1 800 . 1 . 1 153 153 VAL HG12 H 1 0.5750 0.0000 . 2 . . . . . 152 VAL HG11 . 53440 1 801 . 1 . 1 153 153 VAL HG13 H 1 0.5750 0.0000 . 2 . . . . . 152 VAL HG11 . 53440 1 802 . 1 . 1 153 153 VAL HG21 H 1 0.6600 0.0000 . 2 . . . . . 152 VAL HG21 . 53440 1 803 . 1 . 1 153 153 VAL HG22 H 1 0.6600 0.0000 . 2 . . . . . 152 VAL HG21 . 53440 1 804 . 1 . 1 153 153 VAL HG23 H 1 0.6600 0.0000 . 2 . . . . . 152 VAL HG21 . 53440 1 805 . 1 . 1 153 153 VAL C C 13 173.6685 0.0000 . 1 . . 55081 . . 152 VAL C . 53440 1 806 . 1 . 1 153 153 VAL CA C 13 61.6921 0.0000 . 1 . . 55076 . . 152 VAL CA . 53440 1 807 . 1 . 1 153 153 VAL CB C 13 30.3285 0.0000 . 1 . . 55073 . . 152 VAL CB . 53440 1 808 . 1 . 1 153 153 VAL CG1 C 13 23.0440 0.0000 . 2 . . . . . 152 VAL CG1 . 53440 1 809 . 1 . 1 153 153 VAL CG2 C 13 20.6440 0.0000 . 2 . . . . . 152 VAL CG2 . 53440 1 810 . 1 . 1 153 153 VAL N N 15 129.7437 0.0000 . 1 . . 50580 . . 152 VAL N . 53440 1 811 . 1 . 1 154 154 LYS H H 1 8.8281 0.0000 . 1 . . 48865 . . 153 LYS H . 53440 1 812 . 1 . 1 154 154 LYS C C 13 174.7664 0.0000 . 1 . . 45623 . . 153 LYS C . 53440 1 813 . 1 . 1 154 154 LYS CA C 13 55.9526 0.0000 . 1 . . 46685 . . 153 LYS CA . 53440 1 814 . 1 . 1 154 154 LYS CB C 13 36.7754 0.0000 . 1 . . 51713 . . 153 LYS CB . 53440 1 815 . 1 . 1 154 154 LYS N N 15 127.0342 0.0000 . 1 . . 48867 . . 153 LYS N . 53440 1 816 . 1 . 1 155 155 ASP H H 1 8.0402 0.0000 . 1 . . 46075 . . 154 ASP H . 53440 1 817 . 1 . 1 155 155 ASP C C 13 172.1335 0.0000 . 1 . . 62842 . . 154 ASP C . 53440 1 818 . 1 . 1 155 155 ASP CA C 13 55.4197 0.0000 . 1 . . 62835 . . 154 ASP CA . 53440 1 819 . 1 . 1 155 155 ASP CB C 13 36.5706 0.0000 . 1 . . 62838 . . 154 ASP CB . 53440 1 820 . 1 . 1 155 155 ASP N N 15 120.4852 0.0000 . 1 . . 46077 . . 154 ASP N . 53440 1 821 . 1 . 1 156 156 TYR H H 1 7.7283 0.0000 . 1 . . 50179 . . 155 TYR H . 53440 1 822 . 1 . 1 156 156 TYR C C 13 174.0630 0.0000 . 1 . . 75048 . . 155 TYR C . 53440 1 823 . 1 . 1 156 156 TYR CA C 13 54.2830 0.0000 . 1 . . 75051 . . 155 TYR CA . 53440 1 824 . 1 . 1 156 156 TYR CB C 13 41.7326 0.0000 . 1 . . 75054 . . 155 TYR CB . 53440 1 825 . 1 . 1 156 156 TYR N N 15 114.0285 0.0000 . 1 . . 50181 . . 155 TYR N . 53440 1 826 . 1 . 1 157 157 PHE H H 1 9.3762 0.0000 . 1 . . 50926 . . 156 PHE H . 53440 1 827 . 1 . 1 157 157 PHE C C 13 173.6197 0.0000 . 1 . . 46049 . . 156 PHE C . 53440 1 828 . 1 . 1 157 157 PHE CA C 13 57.9933 0.0000 . 1 . . 52823 . . 156 PHE CA . 53440 1 829 . 1 . 1 157 157 PHE CB C 13 43.0670 0.0000 . 1 . . 52853 . . 156 PHE CB . 53440 1 830 . 1 . 1 157 157 PHE N N 15 120.9574 0.0000 . 1 . . 50928 . . 156 PHE N . 53440 1 831 . 1 . 1 160 160 PRO C C 13 176.3882 0.0000 . 1 . . 71572 . . 159 PRO C . 53440 1 832 . 1 . 1 160 160 PRO CA C 13 61.7243 0.0000 . 1 . . 71575 . . 159 PRO CA . 53440 1 833 . 1 . 1 160 160 PRO CB C 13 34.2868 0.0000 . 1 . . 71580 . . 159 PRO CB . 53440 1 834 . 1 . 1 161 161 VAL H H 1 7.8936 0.0000 . 1 . . 53440 . . 160 VAL H . 53440 1 835 . 1 . 1 161 161 VAL HG11 H 1 0.2870 0.0000 . 2 . . . . . 160 VAL HG11 . 53440 1 836 . 1 . 1 161 161 VAL HG12 H 1 0.2870 0.0000 . 2 . . . . . 160 VAL HG11 . 53440 1 837 . 1 . 1 161 161 VAL HG13 H 1 0.2870 0.0000 . 2 . . . . . 160 VAL HG11 . 53440 1 838 . 1 . 1 161 161 VAL HG21 H 1 0.3440 0.0000 . 2 . . . . . 160 VAL HG21 . 53440 1 839 . 1 . 1 161 161 VAL HG22 H 1 0.3440 0.0000 . 2 . . . . . 160 VAL HG21 . 53440 1 840 . 1 . 1 161 161 VAL HG23 H 1 0.3440 0.0000 . 2 . . . . . 160 VAL HG21 . 53440 1 841 . 1 . 1 161 161 VAL C C 13 175.0123 0.0000 . 1 . . 79334 . . 160 VAL C . 53440 1 842 . 1 . 1 161 161 VAL CA C 13 59.8415 0.0000 . 1 . . 79336 . . 160 VAL CA . 53440 1 843 . 1 . 1 161 161 VAL CB C 13 34.4243 0.0000 . 1 . . 79341 . . 160 VAL CB . 53440 1 844 . 1 . 1 161 161 VAL CG1 C 13 21.3280 0.0000 . 2 . . . . . 160 VAL CG1 . 53440 1 845 . 1 . 1 161 161 VAL CG2 C 13 21.5240 0.0000 . 2 . . . . . 160 VAL CG2 . 53440 1 846 . 1 . 1 161 161 VAL N N 15 116.2448 0.0000 . 1 . . 53442 . . 160 VAL N . 53440 1 847 . 1 . 1 162 162 THR H H 1 8.3495 0.0000 . 1 . . 53371 . . 161 THR H . 53440 1 848 . 1 . 1 162 162 THR HG21 H 1 1.1460 0.0000 . 1 . . 23138 . . 161 THR HG21 . 53440 1 849 . 1 . 1 162 162 THR HG22 H 1 1.1460 0.0000 . 1 . . 23138 . . 161 THR HG21 . 53440 1 850 . 1 . 1 162 162 THR HG23 H 1 1.1460 0.0000 . 1 . . 23138 . . 161 THR HG21 . 53440 1 851 . 1 . 1 162 162 THR C C 13 173.5363 0.0000 . 1 . . 79335 . . 161 THR C . 53440 1 852 . 1 . 1 162 162 THR CA C 13 60.4756 0.0000 . 1 . . 79339 . . 161 THR CA . 53440 1 853 . 1 . 1 162 162 THR CB C 13 70.3160 0.0000 . 1 . . 79338 . . 161 THR CB . 53440 1 854 . 1 . 1 162 162 THR CG2 C 13 21.1110 0.0000 . 1 . . . . . 161 THR CG2 . 53440 1 855 . 1 . 1 162 162 THR N N 15 117.3787 0.0000 . 1 . . 53373 . . 161 THR N . 53440 1 856 . 1 . 1 163 163 VAL H H 1 8.6674 0.0000 . 1 . . 52213 . . 162 VAL H . 53440 1 857 . 1 . 1 163 163 VAL HG11 H 1 0.7530 0.0000 . 2 . . . . . 162 VAL HG11 . 53440 1 858 . 1 . 1 163 163 VAL HG12 H 1 0.7530 0.0000 . 2 . . . . . 162 VAL HG11 . 53440 1 859 . 1 . 1 163 163 VAL HG13 H 1 0.7530 0.0000 . 2 . . . . . 162 VAL HG11 . 53440 1 860 . 1 . 1 163 163 VAL HG21 H 1 0.5730 0.0000 . 2 . . . . . 162 VAL HG21 . 53440 1 861 . 1 . 1 163 163 VAL HG22 H 1 0.5730 0.0000 . 2 . . . . . 162 VAL HG21 . 53440 1 862 . 1 . 1 163 163 VAL HG23 H 1 0.5730 0.0000 . 2 . . . . . 162 VAL HG21 . 53440 1 863 . 1 . 1 163 163 VAL C C 13 175.2346 0.0000 . 1 . . 45815 . . 162 VAL C . 53440 1 864 . 1 . 1 163 163 VAL CA C 13 60.5564 0.0000 . 1 . . 58350 . . 162 VAL CA . 53440 1 865 . 1 . 1 163 163 VAL CB C 13 33.6116 0.0000 . 1 . . 52217 . . 162 VAL CB . 53440 1 866 . 1 . 1 163 163 VAL CG1 C 13 21.8630 0.0000 . 2 . . . . . 162 VAL CG1 . 53440 1 867 . 1 . 1 163 163 VAL CG2 C 13 21.1860 0.0000 . 2 . . . . . 162 VAL CG2 . 53440 1 868 . 1 . 1 163 163 VAL N N 15 124.2543 0.0000 . 1 . . 52215 . . 162 VAL N . 53440 1 869 . 1 . 1 164 164 SER H H 1 8.8221 0.0000 . 1 . . 52393 . . 163 SER H . 53440 1 870 . 1 . 1 164 164 SER C C 13 170.9788 0.0000 . 1 . . 59281 . . 163 SER C . 53440 1 871 . 1 . 1 164 164 SER CA C 13 56.0021 0.0000 . 1 . . 59278 . . 163 SER CA . 53440 1 872 . 1 . 1 164 164 SER CB C 13 66.6169 0.0000 . 1 . . 59283 . . 163 SER CB . 53440 1 873 . 1 . 1 164 164 SER N N 15 123.3177 0.0000 . 1 . . 52395 . . 163 SER N . 53440 1 874 . 1 . 1 165 165 TRP H H 1 9.1786 0.0000 . 1 . . 50953 . . 164 TRP H . 53440 1 875 . 1 . 1 165 165 TRP C C 13 177.5303 0.0000 . 1 . . 63623 . . 164 TRP C . 53440 1 876 . 1 . 1 165 165 TRP CA C 13 56.2271 0.0000 . 1 . . 63628 . . 164 TRP CA . 53440 1 877 . 1 . 1 165 165 TRP CB C 13 31.1880 0.0000 . 1 . . 63626 . . 164 TRP CB . 53440 1 878 . 1 . 1 165 165 TRP N N 15 120.2420 0.0000 . 1 . . 50955 . . 164 TRP N . 53440 1 879 . 1 . 1 166 166 ASN H H 1 10.4201 0.0000 . 1 . . 51931 . . 165 ASN H . 53440 1 880 . 1 . 1 166 166 ASN C C 13 177.0435 0.0000 . 1 . . 45671 . . 165 ASN C . 53440 1 881 . 1 . 1 166 166 ASN CA C 13 53.7931 0.0000 . 1 . . 46745 . . 165 ASN CA . 53440 1 882 . 1 . 1 166 166 ASN CB C 13 35.5251 0.0000 . 1 . . 51857 . . 165 ASN CB . 53440 1 883 . 1 . 1 166 166 ASN N N 15 126.0740 0.0000 . 1 . . 51933 . . 165 ASN N . 53440 1 884 . 1 . 1 167 167 SER H H 1 9.6546 0.0000 . 1 . . 50332 . . 166 SER H . 53440 1 885 . 1 . 1 167 167 SER CA C 13 58.6683 0.0000 . 1 . . 53945 . . 166 SER CA . 53440 1 886 . 1 . 1 167 167 SER CB C 13 61.1416 0.0000 . 1 . . 53942 . . 166 SER CB . 53440 1 887 . 1 . 1 167 167 SER N N 15 112.3994 0.0000 . 1 . . 50334 . . 166 SER N . 53440 1 888 . 1 . 1 168 168 GLY H H 1 7.7848 0.0000 . 1 . . 54214 . . 167 GLY H . 53440 1 889 . 1 . 1 168 168 GLY C C 13 174.3752 0.0000 . 1 . . 78592 . . 167 GLY C . 53440 1 890 . 1 . 1 168 168 GLY CA C 13 43.9556 0.0000 . 1 . . 78594 . . 167 GLY CA . 53440 1 891 . 1 . 1 168 168 GLY N N 15 106.1111 0.0000 . 1 . . 54216 . . 167 GLY N . 53440 1 892 . 1 . 1 169 169 ALA H H 1 7.6898 0.0000 . 1 . . 49444 . . 168 ALA H . 53440 1 893 . 1 . 1 169 169 ALA HB1 H 1 1.6010 0.0000 . 1 . . 23036 . . 168 ALA HB1 . 53440 1 894 . 1 . 1 169 169 ALA HB2 H 1 1.6010 0.0000 . 1 . . 23036 . . 168 ALA HB1 . 53440 1 895 . 1 . 1 169 169 ALA HB3 H 1 1.6010 0.0000 . 1 . . 23036 . . 168 ALA HB1 . 53440 1 896 . 1 . 1 169 169 ALA C C 13 177.4037 0.0000 . 1 . . 46004 . . 168 ALA C . 53440 1 897 . 1 . 1 169 169 ALA CA C 13 53.0519 0.0000 . 1 . . 52733 . . 168 ALA CA . 53440 1 898 . 1 . 1 169 169 ALA CB C 13 19.1680 0.0000 . 1 . . 52751 . . 168 ALA CB . 53440 1 899 . 1 . 1 169 169 ALA N N 15 121.4547 0.0000 . 1 . . 49446 . . 168 ALA N . 53440 1 900 . 1 . 1 170 170 LEU H H 1 7.1446 0.0000 . 1 . . 50980 . . 169 LEU H . 53440 1 901 . 1 . 1 170 170 LEU HD11 H 1 0.8350 0.0000 . 2 . . . . . 169 LEU HD11 . 53440 1 902 . 1 . 1 170 170 LEU HD12 H 1 0.8350 0.0000 . 2 . . . . . 169 LEU HD11 . 53440 1 903 . 1 . 1 170 170 LEU HD13 H 1 0.8350 0.0000 . 2 . . . . . 169 LEU HD11 . 53440 1 904 . 1 . 1 170 170 LEU HD21 H 1 1.0140 0.0000 . 2 . . . . . 169 LEU HD21 . 53440 1 905 . 1 . 1 170 170 LEU HD22 H 1 1.0140 0.0000 . 2 . . . . . 169 LEU HD21 . 53440 1 906 . 1 . 1 170 170 LEU HD23 H 1 1.0140 0.0000 . 2 . . . . . 169 LEU HD21 . 53440 1 907 . 1 . 1 170 170 LEU C C 13 174.5460 0.0000 . 1 . . 46112 . . 169 LEU C . 53440 1 908 . 1 . 1 170 170 LEU CA C 13 53.8846 0.0000 . 1 . . 47240 . . 169 LEU CA . 53440 1 909 . 1 . 1 170 170 LEU CB C 13 41.6366 0.0000 . 1 . . 53057 . . 169 LEU CB . 53440 1 910 . 1 . 1 170 170 LEU CD1 C 13 26.1670 0.0000 . 2 . . . . . 169 LEU CD1 . 53440 1 911 . 1 . 1 170 170 LEU CD2 C 13 23.7540 0.0000 . 2 . . . . . 169 LEU CD2 . 53440 1 912 . 1 . 1 170 170 LEU N N 15 119.7172 0.0000 . 1 . . 50982 . . 169 LEU N . 53440 1 913 . 1 . 1 171 171 THR H H 1 8.5699 0.0000 . 1 . . 51151 . . 170 THR H . 53440 1 914 . 1 . 1 171 171 THR HG21 H 1 1.1570 0.0000 . 1 . . 23240 . . 170 THR HG21 . 53440 1 915 . 1 . 1 171 171 THR HG22 H 1 1.1570 0.0000 . 1 . . 23240 . . 170 THR HG21 . 53440 1 916 . 1 . 1 171 171 THR HG23 H 1 1.1570 0.0000 . 1 . . 23240 . . 170 THR HG21 . 53440 1 917 . 1 . 1 171 171 THR C C 13 175.3302 0.0000 . 1 . . 46361 . . 170 THR C . 53440 1 918 . 1 . 1 171 171 THR CA C 13 61.1322 0.0000 . 1 . . 53678 . . 170 THR CA . 53440 1 919 . 1 . 1 171 171 THR CB C 13 69.9147 0.0000 . 1 . . 53645 . . 170 THR CB . 53440 1 920 . 1 . 1 171 171 THR CG2 C 13 21.4350 0.0000 . 1 . . . . . 170 THR CG2 . 53440 1 921 . 1 . 1 171 171 THR N N 15 114.7541 0.0000 . 1 . . 51153 . . 170 THR N . 53440 1 922 . 1 . 1 172 172 SER H H 1 8.0318 0.0000 . 1 . . 52879 . . 171 SER H . 53440 1 923 . 1 . 1 172 172 SER C C 13 174.7191 0.0000 . 1 . . 46061 . . 171 SER C . 53440 1 924 . 1 . 1 172 172 SER CA C 13 58.3928 0.0000 . 1 . . 47138 . . 171 SER CA . 53440 1 925 . 1 . 1 172 172 SER CB C 13 63.1785 0.0000 . 1 . . 52808 . . 171 SER CB . 53440 1 926 . 1 . 1 172 172 SER N N 15 120.7562 0.0000 . 1 . . 52881 . . 171 SER N . 53440 1 927 . 1 . 1 173 173 GLY H H 1 8.5771 0.0000 . 1 . . 53887 . . 172 GLY H . 53440 1 928 . 1 . 1 173 173 GLY C C 13 173.4470 0.0000 . 1 . . 75985 . . 172 GLY C . 53440 1 929 . 1 . 1 173 173 GLY CA C 13 45.3277 0.0000 . 1 . . 75987 . . 172 GLY CA . 53440 1 930 . 1 . 1 173 173 GLY N N 15 113.3444 0.0000 . 1 . . 53889 . . 172 GLY N . 53440 1 931 . 1 . 1 174 174 VAL H H 1 6.9141 0.0000 . 1 . . 49708 . . 173 VAL H . 53440 1 932 . 1 . 1 174 174 VAL HG11 H 1 0.5330 0.0000 . 2 . . . . . 173 VAL HG11 . 53440 1 933 . 1 . 1 174 174 VAL HG12 H 1 0.5330 0.0000 . 2 . . . . . 173 VAL HG11 . 53440 1 934 . 1 . 1 174 174 VAL HG13 H 1 0.5330 0.0000 . 2 . . . . . 173 VAL HG11 . 53440 1 935 . 1 . 1 174 174 VAL HG21 H 1 0.8980 0.0000 . 2 . . . . . 173 VAL HG21 . 53440 1 936 . 1 . 1 174 174 VAL HG22 H 1 0.8980 0.0000 . 2 . . . . . 173 VAL HG21 . 53440 1 937 . 1 . 1 174 174 VAL HG23 H 1 0.8980 0.0000 . 2 . . . . . 173 VAL HG21 . 53440 1 938 . 1 . 1 174 174 VAL C C 13 177.0924 0.0000 . 1 . . 46103 . . 173 VAL C . 53440 1 939 . 1 . 1 174 174 VAL CA C 13 61.4937 0.0000 . 1 . . 47213 . . 173 VAL CA . 53440 1 940 . 1 . 1 174 174 VAL CB C 13 32.3327 0.0000 . 1 . . 53060 . . 173 VAL CB . 53440 1 941 . 1 . 1 174 174 VAL CG1 C 13 21.1060 0.0000 . 2 . . . . . 173 VAL CG1 . 53440 1 942 . 1 . 1 174 174 VAL CG2 C 13 21.0430 0.0000 . 2 . . . . . 173 VAL CG2 . 53440 1 943 . 1 . 1 174 174 VAL N N 15 119.7062 0.0000 . 1 . . 49710 . . 173 VAL N . 53440 1 944 . 1 . 1 175 175 HIS H H 1 9.2673 0.0000 . 1 . . 51985 . . 174 HIS H . 53440 1 945 . 1 . 1 175 175 HIS C C 13 172.5204 0.0000 . 1 . . 45773 . . 174 HIS C . 53440 1 946 . 1 . 1 175 175 HIS CA C 13 54.0382 0.0000 . 1 . . 46814 . . 174 HIS CA . 53440 1 947 . 1 . 1 175 175 HIS CB C 13 29.6988 0.0000 . 1 . . 52067 . . 174 HIS CB . 53440 1 948 . 1 . 1 175 175 HIS N N 15 125.1677 0.0000 . 1 . . 51987 . . 174 HIS N . 53440 1 949 . 1 . 1 176 176 THR H H 1 8.8131 0.0000 . 1 . . 52243 . . 175 THR H . 53440 1 950 . 1 . 1 176 176 THR HG21 H 1 1.3100 0.0000 . 1 . . 101884 . . 175 THR HG21 . 53440 1 951 . 1 . 1 176 176 THR HG22 H 1 1.3100 0.0000 . 1 . . 101884 . . 175 THR HG21 . 53440 1 952 . 1 . 1 176 176 THR HG23 H 1 1.3100 0.0000 . 1 . . 101884 . . 175 THR HG21 . 53440 1 953 . 1 . 1 176 176 THR C C 13 173.7421 0.0000 . 1 . . 45839 . . 175 THR C . 53440 1 954 . 1 . 1 176 176 THR CA C 13 61.9281 0.0000 . 1 . . 52250 . . 175 THR CA . 53440 1 955 . 1 . 1 176 176 THR CB C 13 68.1448 0.0000 . 1 . . 52241 . . 175 THR CB . 53440 1 956 . 1 . 1 176 176 THR CG2 C 13 23.4590 0.0000 . 1 . . . . . 175 THR CG2 . 53440 1 957 . 1 . 1 176 176 THR N N 15 124.1088 0.0000 . 1 . . 52245 . . 175 THR N . 53440 1 958 . 1 . 1 177 177 PHE H H 1 8.6360 0.0000 . 1 . . 50584 . . 176 PHE H . 53440 1 959 . 1 . 1 177 177 PHE C C 13 173.3197 0.0000 . 1 . . 55160 . . 176 PHE C . 53440 1 960 . 1 . 1 177 177 PHE CA C 13 58.3873 0.0000 . 1 . . 55157 . . 176 PHE CA . 53440 1 961 . 1 . 1 177 177 PHE CB C 13 38.1139 0.0000 . 1 . . 55154 . . 176 PHE CB . 53440 1 962 . 1 . 1 177 177 PHE N N 15 128.8162 0.0000 . 1 . . 50586 . . 176 PHE N . 53440 1 963 . 1 . 1 178 178 PRO C C 13 177.3681 0.0000 . 1 . . 55775 . . 177 PRO C . 53440 1 964 . 1 . 1 178 178 PRO CA C 13 62.4305 0.0000 . 1 . . 55770 . . 177 PRO CA . 53440 1 965 . 1 . 1 178 178 PRO CB C 13 31.2666 0.0000 . 1 . . 55772 . . 177 PRO CB . 53440 1 966 . 1 . 1 179 179 ALA H H 1 9.0253 0.0000 . 1 . . 51667 . . 178 ALA H . 53440 1 967 . 1 . 1 179 179 ALA HB1 H 1 1.4480 0.0000 . 1 . . 23084 . . 178 ALA HB1 . 53440 1 968 . 1 . 1 179 179 ALA HB2 H 1 1.4480 0.0000 . 1 . . 23084 . . 178 ALA HB1 . 53440 1 969 . 1 . 1 179 179 ALA HB3 H 1 1.4480 0.0000 . 1 . . 23084 . . 178 ALA HB1 . 53440 1 970 . 1 . 1 179 179 ALA C C 13 178.1614 0.0000 . 1 . . 55777 . . 178 ALA C . 53440 1 971 . 1 . 1 179 179 ALA CA C 13 52.2402 0.0000 . 1 . . 55771 . . 178 ALA CA . 53440 1 972 . 1 . 1 179 179 ALA CB C 13 20.7240 0.0000 . 1 . . 55779 . . 178 ALA CB . 53440 1 973 . 1 . 1 179 179 ALA N N 15 127.3985 0.0000 . 1 . . 51669 . . 178 ALA N . 53440 1 974 . 1 . 1 180 180 VAL H H 1 8.7549 0.0000 . 1 . . 51031 . . 179 VAL H . 53440 1 975 . 1 . 1 180 180 VAL HG11 H 1 0.9490 0.0000 . 2 . . . . . 179 VAL HG11 . 53440 1 976 . 1 . 1 180 180 VAL HG12 H 1 0.9490 0.0000 . 2 . . . . . 179 VAL HG11 . 53440 1 977 . 1 . 1 180 180 VAL HG13 H 1 0.9490 0.0000 . 2 . . . . . 179 VAL HG11 . 53440 1 978 . 1 . 1 180 180 VAL HG21 H 1 0.9680 0.0000 . 2 . . . . . 179 VAL HG21 . 53440 1 979 . 1 . 1 180 180 VAL HG22 H 1 0.9680 0.0000 . 2 . . . . . 179 VAL HG21 . 53440 1 980 . 1 . 1 180 180 VAL HG23 H 1 0.9680 0.0000 . 2 . . . . . 179 VAL HG21 . 53440 1 981 . 1 . 1 180 180 VAL C C 13 174.8173 0.0000 . 1 . . 46196 . . 179 VAL C . 53440 1 982 . 1 . 1 180 180 VAL CA C 13 59.6596 0.0000 . 1 . . 53219 . . 179 VAL CA . 53440 1 983 . 1 . 1 180 180 VAL CB C 13 33.8957 0.0000 . 1 . . 53258 . . 179 VAL CB . 53440 1 984 . 1 . 1 180 180 VAL CG1 C 13 20.6220 0.0000 . 2 . . . . . 179 VAL CG1 . 53440 1 985 . 1 . 1 180 180 VAL CG2 C 13 20.9330 0.0000 . 2 . . . . . 179 VAL CG2 . 53440 1 986 . 1 . 1 180 180 VAL N N 15 118.4210 0.0000 . 1 . . 51033 . . 179 VAL N . 53440 1 987 . 1 . 1 181 181 LEU H H 1 8.5874 0.0000 . 1 . . 48757 . . 180 LEU H . 53440 1 988 . 1 . 1 181 181 LEU HD11 H 1 0.6790 0.0000 . 2 . . . . . 180 LEU HD11 . 53440 1 989 . 1 . 1 181 181 LEU HD12 H 1 0.6790 0.0000 . 2 . . . . . 180 LEU HD11 . 53440 1 990 . 1 . 1 181 181 LEU HD13 H 1 0.6790 0.0000 . 2 . . . . . 180 LEU HD11 . 53440 1 991 . 1 . 1 181 181 LEU HD21 H 1 0.1720 0.0000 . 2 . . . . . 180 LEU HD21 . 53440 1 992 . 1 . 1 181 181 LEU HD22 H 1 0.1720 0.0000 . 2 . . . . . 180 LEU HD21 . 53440 1 993 . 1 . 1 181 181 LEU HD23 H 1 0.1720 0.0000 . 2 . . . . . 180 LEU HD21 . 53440 1 994 . 1 . 1 181 181 LEU C C 13 176.8567 0.0000 . 1 . . 45572 . . 180 LEU C . 53440 1 995 . 1 . 1 181 181 LEU CA C 13 53.9186 0.0000 . 1 . . 46646 . . 180 LEU CA . 53440 1 996 . 1 . 1 181 181 LEU CB C 13 41.1558 0.0000 . 1 . . 51581 . . 180 LEU CB . 53440 1 997 . 1 . 1 181 181 LEU CD1 C 13 25.3470 0.0000 . 2 . . . . . 180 LEU CD1 . 53440 1 998 . 1 . 1 181 181 LEU CD2 C 13 21.9360 0.0000 . 2 . . . . . 180 LEU CD2 . 53440 1 999 . 1 . 1 181 181 LEU N N 15 127.7711 0.0000 . 1 . . 48759 . . 180 LEU N . 53440 1 1000 . 1 . 1 182 182 GLN H H 1 8.1656 0.0000 . 1 . . 51922 . . 181 GLN H . 53440 1 1001 . 1 . 1 182 182 GLN C C 13 178.1716 0.0000 . 1 . . 56455 . . 181 GLN C . 53440 1 1002 . 1 . 1 182 182 GLN CA C 13 54.9014 0.0000 . 1 . . 56450 . . 181 GLN CA . 53440 1 1003 . 1 . 1 182 182 GLN CB C 13 32.0076 0.0000 . 1 . . 56452 . . 181 GLN CB . 53440 1 1004 . 1 . 1 182 182 GLN N N 15 125.9201 0.0000 . 1 . . 51924 . . 181 GLN N . 53440 1 1005 . 1 . 1 183 183 SER H H 1 9.1144 0.0000 . 1 . . 50998 . . 182 SER H . 53440 1 1006 . 1 . 1 183 183 SER CA C 13 60.9606 0.0000 . 1 . . 47258 . . 182 SER CA . 53440 1 1007 . 1 . 1 183 183 SER CB C 13 62.2606 0.0000 . 1 . . 53084 . . 182 SER CB . 53440 1 1008 . 1 . 1 183 183 SER N N 15 119.4369 0.0000 . 1 . . 51000 . . 182 SER N . 53440 1 1009 . 1 . 1 184 184 SER H H 1 7.2474 0.0000 . 1 . . 53869 . . 183 SER H . 53440 1 1010 . 1 . 1 184 184 SER C C 13 175.5078 0.0000 . 1 . . 76090 . . 183 SER C . 53440 1 1011 . 1 . 1 184 184 SER CA C 13 57.4659 0.0000 . 1 . . 76092 . . 183 SER CA . 53440 1 1012 . 1 . 1 184 184 SER CB C 13 64.1006 0.0000 . 1 . . 76094 . . 183 SER CB . 53440 1 1013 . 1 . 1 184 184 SER N N 15 113.3768 0.0000 . 1 . . 53871 . . 183 SER N . 53440 1 1014 . 1 . 1 185 185 GLY H H 1 8.0653 0.0000 . 1 . . 54049 . . 184 GLY H . 53440 1 1015 . 1 . 1 185 185 GLY C C 13 171.6172 0.0000 . 1 . . 46460 . . 184 GLY C . 53440 1 1016 . 1 . 1 185 185 GLY CA C 13 44.5140 0.0000 . 1 . . 47735 . . 184 GLY CA . 53440 1 1017 . 1 . 1 185 185 GLY N N 15 110.2397 0.0000 . 1 . . 54051 . . 184 GLY N . 53440 1 1018 . 1 . 1 186 186 LEU H H 1 6.7371 0.0000 . 1 . . 53581 . . 185 LEU H . 53440 1 1019 . 1 . 1 186 186 LEU HD11 H 1 0.6060 0.0000 . 2 . . . . . 185 LEU HD11 . 53440 1 1020 . 1 . 1 186 186 LEU HD12 H 1 0.6060 0.0000 . 2 . . . . . 185 LEU HD11 . 53440 1 1021 . 1 . 1 186 186 LEU HD13 H 1 0.6060 0.0000 . 2 . . . . . 185 LEU HD11 . 53440 1 1022 . 1 . 1 186 186 LEU HD21 H 1 0.6420 0.0000 . 2 . . . . . 185 LEU HD21 . 53440 1 1023 . 1 . 1 186 186 LEU HD22 H 1 0.6420 0.0000 . 2 . . . . . 185 LEU HD21 . 53440 1 1024 . 1 . 1 186 186 LEU HD23 H 1 0.6420 0.0000 . 2 . . . . . 185 LEU HD21 . 53440 1 1025 . 1 . 1 186 186 LEU C C 13 177.4255 0.0000 . 1 . . 46292 . . 185 LEU C . 53440 1 1026 . 1 . 1 186 186 LEU CA C 13 51.8428 0.0000 . 1 . . 47459 . . 185 LEU CA . 53440 1 1027 . 1 . 1 186 186 LEU CB C 13 42.9691 0.0000 . 1 . . 53513 . . 185 LEU CB . 53440 1 1028 . 1 . 1 186 186 LEU CD1 C 13 23.3440 0.0000 . 2 . . . . . 185 LEU CD1 . 53440 1 1029 . 1 . 1 186 186 LEU CD2 C 13 25.2250 0.0000 . 2 . . . . . 185 LEU CD2 . 53440 1 1030 . 1 . 1 186 186 LEU N N 15 115.5362 0.0000 . 1 . . 53583 . . 185 LEU N . 53440 1 1031 . 1 . 1 187 187 TYR H H 1 9.0435 0.0000 . 1 . . 52444 . . 186 TYR H . 53440 1 1032 . 1 . 1 187 187 TYR C C 13 176.6946 0.0000 . 1 . . 45890 . . 186 TYR C . 53440 1 1033 . 1 . 1 187 187 TYR CA C 13 58.6352 0.0000 . 1 . . 46958 . . 186 TYR CA . 53440 1 1034 . 1 . 1 187 187 TYR CB C 13 39.4752 0.0000 . 1 . . 52463 . . 186 TYR CB . 53440 1 1035 . 1 . 1 187 187 TYR N N 15 123.2809 0.0000 . 1 . . 52446 . . 186 TYR N . 53440 1 1036 . 1 . 1 188 188 SER H H 1 8.3036 0.0000 . 1 . . 50380 . . 187 SER H . 53440 1 1037 . 1 . 1 188 188 SER C C 13 172.6337 0.0000 . 1 . . 76661 . . 187 SER C . 53440 1 1038 . 1 . 1 188 188 SER CA C 13 57.3414 0.0000 . 1 . . 76663 . . 187 SER CA . 53440 1 1039 . 1 . 1 188 188 SER CB C 13 66.0602 0.0000 . 1 . . 76665 . . 187 SER CB . 53440 1 1040 . 1 . 1 188 188 SER N N 15 111.8244 0.0000 . 1 . . 50382 . . 187 SER N . 53440 1 1041 . 1 . 1 189 189 LEU H H 1 9.4798 0.0000 . 1 . . 51877 . . 188 LEU H . 53440 1 1042 . 1 . 1 189 189 LEU HD11 H 1 0.8840 0.0000 . 2 . . . . . 188 LEU HD11 . 53440 1 1043 . 1 . 1 189 189 LEU HD12 H 1 0.8840 0.0000 . 2 . . . . . 188 LEU HD11 . 53440 1 1044 . 1 . 1 189 189 LEU HD13 H 1 0.8840 0.0000 . 2 . . . . . 188 LEU HD11 . 53440 1 1045 . 1 . 1 189 189 LEU HD21 H 1 0.8290 0.0000 . 2 . . . . . 188 LEU HD21 . 53440 1 1046 . 1 . 1 189 189 LEU HD22 H 1 0.8290 0.0000 . 2 . . . . . 188 LEU HD21 . 53440 1 1047 . 1 . 1 189 189 LEU HD23 H 1 0.8290 0.0000 . 2 . . . . . 188 LEU HD21 . 53440 1 1048 . 1 . 1 189 189 LEU C C 13 174.5664 0.0000 . 1 . . 45704 . . 188 LEU C . 53440 1 1049 . 1 . 1 189 189 LEU CA C 13 55.1128 0.0000 . 1 . . 46760 . . 188 LEU CA . 53440 1 1050 . 1 . 1 189 189 LEU CB C 13 44.3398 0.0000 . 1 . . 51905 . . 188 LEU CB . 53440 1 1051 . 1 . 1 189 189 LEU CD1 C 13 27.4540 0.0000 . 2 . . . . . 188 LEU CD1 . 53440 1 1052 . 1 . 1 189 189 LEU CD2 C 13 25.4100 0.0000 . 2 . . . . . 188 LEU CD2 . 53440 1 1053 . 1 . 1 189 189 LEU N N 15 125.9095 0.0000 . 1 . . 51879 . . 188 LEU N . 53440 1 1054 . 1 . 1 190 190 SER H H 1 7.3143 0.0000 . 1 . . 53653 . . 189 SER H . 53440 1 1055 . 1 . 1 190 190 SER C C 13 172.5997 0.0000 . 1 . . 46373 . . 189 SER C . 53440 1 1056 . 1 . 1 190 190 SER CA C 13 57.6803 0.0000 . 1 . . 47543 . . 189 SER CA . 53440 1 1057 . 1 . 1 190 190 SER CB C 13 66.0646 0.0000 . 1 . . 53660 . . 189 SER CB . 53440 1 1058 . 1 . 1 190 190 SER N N 15 114.5897 0.0000 . 1 . . 53655 . . 189 SER N . 53440 1 1059 . 1 . 1 191 191 SER H H 1 8.6110 0.0000 . 1 . . 53446 . . 190 SER H . 53440 1 1060 . 1 . 1 191 191 SER C C 13 174.2148 0.0000 . 1 . . 87279 . . 190 SER C . 53440 1 1061 . 1 . 1 191 191 SER CA C 13 56.8386 0.0000 . 1 . . 87285 . . 190 SER CA . 53440 1 1062 . 1 . 1 191 191 SER CB C 13 64.2480 0.0000 . 1 . . 87283 . . 190 SER CB . 53440 1 1063 . 1 . 1 191 191 SER N N 15 116.3887 0.0000 . 1 . . 53448 . . 190 SER N . 53440 1 1064 . 1 . 1 192 192 VAL H H 1 9.1368 0.0000 . 1 . . 50827 . . 191 VAL H . 53440 1 1065 . 1 . 1 192 192 VAL HG11 H 1 0.8740 0.0000 . 2 . . . . . 191 VAL HG11 . 53440 1 1066 . 1 . 1 192 192 VAL HG12 H 1 0.8740 0.0000 . 2 . . . . . 191 VAL HG11 . 53440 1 1067 . 1 . 1 192 192 VAL HG13 H 1 0.8740 0.0000 . 2 . . . . . 191 VAL HG11 . 53440 1 1068 . 1 . 1 192 192 VAL HG21 H 1 1.0770 0.0000 . 2 . . . . . 191 VAL HG21 . 53440 1 1069 . 1 . 1 192 192 VAL HG22 H 1 1.0770 0.0000 . 2 . . . . . 191 VAL HG21 . 53440 1 1070 . 1 . 1 192 192 VAL HG23 H 1 1.0770 0.0000 . 2 . . . . . 191 VAL HG21 . 53440 1 1071 . 1 . 1 192 192 VAL C C 13 172.9026 0.0000 . 1 . . 45908 . . 191 VAL C . 53440 1 1072 . 1 . 1 192 192 VAL CA C 13 58.5895 0.0000 . 1 . . 52403 . . 191 VAL CA . 53440 1 1073 . 1 . 1 192 192 VAL CB C 13 35.3672 0.0000 . 1 . . 52469 . . 191 VAL CB . 53440 1 1074 . 1 . 1 192 192 VAL CG1 C 13 20.7930 0.0000 . 2 . . . . . 191 VAL CG1 . 53440 1 1075 . 1 . 1 192 192 VAL CG2 C 13 19.4770 0.0000 . 2 . . . . . 191 VAL CG2 . 53440 1 1076 . 1 . 1 192 192 VAL N N 15 123.2897 0.0000 . 1 . . 50829 . . 191 VAL N . 53440 1 1077 . 1 . 1 193 193 VAL H H 1 8.9064 0.0000 . 1 . . 52765 . . 192 VAL H . 53440 1 1078 . 1 . 1 193 193 VAL HG11 H 1 -0.2050 0.0000 . 2 . . . . . 192 VAL HG11 . 53440 1 1079 . 1 . 1 193 193 VAL HG12 H 1 -0.2050 0.0000 . 2 . . . . . 192 VAL HG11 . 53440 1 1080 . 1 . 1 193 193 VAL HG13 H 1 -0.2050 0.0000 . 2 . . . . . 192 VAL HG11 . 53440 1 1081 . 1 . 1 193 193 VAL HG21 H 1 -0.3360 0.0000 . 2 . . . . . 192 VAL HG21 . 53440 1 1082 . 1 . 1 193 193 VAL HG22 H 1 -0.3360 0.0000 . 2 . . . . . 192 VAL HG21 . 53440 1 1083 . 1 . 1 193 193 VAL HG23 H 1 -0.3360 0.0000 . 2 . . . . . 192 VAL HG21 . 53440 1 1084 . 1 . 1 193 193 VAL C C 13 174.0946 0.0000 . 1 . . 61992 . . 192 VAL C . 53440 1 1085 . 1 . 1 193 193 VAL CA C 13 58.7306 0.0000 . 1 . . 61996 . . 192 VAL CA . 53440 1 1086 . 1 . 1 193 193 VAL CB C 13 33.6506 0.0000 . 1 . . 61995 . . 192 VAL CB . 53440 1 1087 . 1 . 1 193 193 VAL CG1 C 13 20.1420 0.0000 . 2 . . . . . 192 VAL CG1 . 53440 1 1088 . 1 . 1 193 193 VAL CG2 C 13 18.9180 0.0000 . 2 . . . . . 192 VAL CG2 . 53440 1 1089 . 1 . 1 193 193 VAL N N 15 121.5099 0.0000 . 1 . . 52767 . . 192 VAL N . 53440 1 1090 . 1 . 1 194 194 THR H H 1 7.2211 0.0000 . 1 . . 53638 . . 193 THR H . 53440 1 1091 . 1 . 1 194 194 THR HG21 H 1 1.0490 0.0000 . 1 . . 101887 . . 193 THR HG21 . 53440 1 1092 . 1 . 1 194 194 THR HG22 H 1 1.0490 0.0000 . 1 . . 101887 . . 193 THR HG21 . 53440 1 1093 . 1 . 1 194 194 THR HG23 H 1 1.0490 0.0000 . 1 . . 101887 . . 193 THR HG21 . 53440 1 1094 . 1 . 1 194 194 THR C C 13 174.3407 0.0000 . 1 . . 73719 . . 193 THR C . 53440 1 1095 . 1 . 1 194 194 THR CA C 13 58.4127 0.0000 . 1 . . 73729 . . 193 THR CA . 53440 1 1096 . 1 . 1 194 194 THR CB C 13 69.3981 0.0000 . 1 . . 73723 . . 193 THR CB . 53440 1 1097 . 1 . 1 194 194 THR CG2 C 13 20.5960 0.0000 . 1 . . . . . 193 THR CG2 . 53440 1 1098 . 1 . 1 194 194 THR N N 15 114.9561 0.0000 . 1 . . 53640 . . 193 THR N . 53440 1 1099 . 1 . 1 195 195 VAL H H 1 8.6286 0.0000 . 1 . . 47371 . . 194 VAL H . 53440 1 1100 . 1 . 1 195 195 VAL HG11 H 1 0.3500 0.0000 . 2 . . . . . 194 VAL HG11 . 53440 1 1101 . 1 . 1 195 195 VAL HG12 H 1 0.3500 0.0000 . 2 . . . . . 194 VAL HG11 . 53440 1 1102 . 1 . 1 195 195 VAL HG13 H 1 0.3500 0.0000 . 2 . . . . . 194 VAL HG11 . 53440 1 1103 . 1 . 1 195 195 VAL HG21 H 1 0.2350 0.0000 . 2 . . . . . 194 VAL HG21 . 53440 1 1104 . 1 . 1 195 195 VAL HG22 H 1 0.2350 0.0000 . 2 . . . . . 194 VAL HG21 . 53440 1 1105 . 1 . 1 195 195 VAL HG23 H 1 0.2350 0.0000 . 2 . . . . . 194 VAL HG21 . 53440 1 1106 . 1 . 1 195 195 VAL C C 13 172.6013 0.0000 . 1 . . 71323 . . 194 VAL C . 53440 1 1107 . 1 . 1 195 195 VAL CA C 13 56.9070 0.0000 . 1 . . 71328 . . 194 VAL CA . 53440 1 1108 . 1 . 1 195 195 VAL CB C 13 32.9006 0.0000 . 1 . . 71329 . . 194 VAL CB . 53440 1 1109 . 1 . 1 195 195 VAL CG1 C 13 21.6750 0.0000 . 2 . . . . . 194 VAL CG1 . 53440 1 1110 . 1 . 1 195 195 VAL CG2 C 13 17.3330 0.0000 . 2 . . . . . 194 VAL CG2 . 53440 1 1111 . 1 . 1 195 195 VAL N N 15 117.6966 0.0000 . 1 . . 47373 . . 194 VAL N . 53440 1 1112 . 1 . 1 196 196 PRO C C 13 180.3867 0.0000 . 1 . . 101451 . . 195 PRO C . 53440 1 1113 . 1 . 1 196 196 PRO CA C 13 62.2853 0.0000 . 1 . . 101454 . . 195 PRO CA . 53440 1 1114 . 1 . 1 196 196 PRO CB C 13 30.7935 0.0000 . 1 . . 101458 . . 195 PRO CB . 53440 1 1115 . 1 . 1 197 197 SER H H 1 9.0193 0.0000 . 1 . . 52060 . . 196 SER H . 53440 1 1116 . 1 . 1 197 197 SER C C 13 176.8775 0.0000 . 1 . . 101506 . . 196 SER C . 53440 1 1117 . 1 . 1 197 197 SER CA C 13 61.7142 0.0000 . 1 . . 101455 . . 196 SER CA . 53440 1 1118 . 1 . 1 197 197 SER N N 15 125.2346 0.0000 . 1 . . 52062 . . 196 SER N . 53440 1 1119 . 1 . 1 198 198 SER H H 1 8.4701 0.0000 . 1 . . 53431 . . 197 SER H . 53440 1 1120 . 1 . 1 198 198 SER C C 13 175.6475 0.0000 . 1 . . 71381 . . 197 SER C . 53440 1 1121 . 1 . 1 198 198 SER CA C 13 59.6219 0.0000 . 1 . . 98618 . . 197 SER CA . 53440 1 1122 . 1 . 1 198 198 SER CB C 13 62.3798 0.0000 . 1 . . 71389 . . 197 SER CB . 53440 1 1123 . 1 . 1 198 198 SER N N 15 116.2673 0.0000 . 1 . . 53433 . . 197 SER N . 53440 1 1124 . 1 . 1 199 199 SER H H 1 7.8317 0.0000 . 1 . . 51067 . . 198 SER H . 53440 1 1125 . 1 . 1 199 199 SER C C 13 175.3121 0.0000 . 1 . . 71382 . . 198 SER C . 53440 1 1126 . 1 . 1 199 199 SER CA C 13 59.0355 0.0000 . 1 . . 71384 . . 198 SER CA . 53440 1 1127 . 1 . 1 199 199 SER CB C 13 64.4593 0.0000 . 1 . . 71387 . . 198 SER CB . 53440 1 1128 . 1 . 1 199 199 SER N N 15 116.8874 0.0000 . 1 . . 51069 . . 198 SER N . 53440 1 1129 . 1 . 1 200 200 LEU H H 1 7.3714 0.0000 . 1 . . 52528 . . 199 LEU H . 53440 1 1130 . 1 . 1 200 200 LEU HD11 H 1 0.7680 0.0000 . 2 . . . . . 199 LEU HD11 . 53440 1 1131 . 1 . 1 200 200 LEU HD12 H 1 0.7680 0.0000 . 2 . . . . . 199 LEU HD11 . 53440 1 1132 . 1 . 1 200 200 LEU HD13 H 1 0.7680 0.0000 . 2 . . . . . 199 LEU HD11 . 53440 1 1133 . 1 . 1 200 200 LEU HD21 H 1 0.8480 0.0000 . 2 . . . . . 199 LEU HD21 . 53440 1 1134 . 1 . 1 200 200 LEU HD22 H 1 0.8480 0.0000 . 2 . . . . . 199 LEU HD21 . 53440 1 1135 . 1 . 1 200 200 LEU HD23 H 1 0.8480 0.0000 . 2 . . . . . 199 LEU HD21 . 53440 1 1136 . 1 . 1 200 200 LEU C C 13 178.3640 0.0000 . 1 . . 45926 . . 199 LEU C . 53440 1 1137 . 1 . 1 200 200 LEU CA C 13 56.7243 0.0000 . 1 . . 47012 . . 199 LEU CA . 53440 1 1138 . 1 . 1 200 200 LEU CB C 13 40.4162 0.0000 . 1 . . 52568 . . 199 LEU CB . 53440 1 1139 . 1 . 1 200 200 LEU CD1 C 13 23.1430 0.0000 . 2 . . . . . 199 LEU CD1 . 53440 1 1140 . 1 . 1 200 200 LEU CD2 C 13 25.3660 0.0000 . 2 . . . . . 199 LEU CD2 . 53440 1 1141 . 1 . 1 200 200 LEU N N 15 122.6511 0.0000 . 1 . . 52530 . . 199 LEU N . 53440 1 1142 . 1 . 1 201 201 GLY H H 1 8.6593 0.0000 . 1 . . 51310 . . 200 GLY H . 53440 1 1143 . 1 . 1 201 201 GLY C C 13 174.8884 0.0000 . 1 . . 46493 . . 200 GLY C . 53440 1 1144 . 1 . 1 201 201 GLY CA C 13 44.9779 0.0000 . 1 . . 54158 . . 200 GLY CA . 53440 1 1145 . 1 . 1 201 201 GLY N N 15 107.4405 0.0000 . 1 . . 51312 . . 200 GLY N . 53440 1 1146 . 1 . 1 202 202 THR H H 1 7.4629 0.0000 . 1 . . 54025 . . 201 THR H . 53440 1 1147 . 1 . 1 202 202 THR HG21 H 1 1.2310 0.0000 . 1 . . . . . 201 THR HG21 . 53440 1 1148 . 1 . 1 202 202 THR HG22 H 1 1.2310 0.0000 . 1 . . . . . 201 THR HG21 . 53440 1 1149 . 1 . 1 202 202 THR HG23 H 1 1.2310 0.0000 . 1 . . . . . 201 THR HG21 . 53440 1 1150 . 1 . 1 202 202 THR C C 13 174.1082 0.0000 . 1 . . 46454 . . 201 THR C . 53440 1 1151 . 1 . 1 202 202 THR CA C 13 61.7372 0.0000 . 1 . . 47720 . . 201 THR CA . 53440 1 1152 . 1 . 1 202 202 THR CB C 13 69.7377 0.0000 . 1 . . 54041 . . 201 THR CB . 53440 1 1153 . 1 . 1 202 202 THR CG2 C 13 21.5550 0.0000 . 1 . . . . . 201 THR CG2 . 53440 1 1154 . 1 . 1 202 202 THR N N 15 110.2534 0.0000 . 1 . . 54027 . . 201 THR N . 53440 1 1155 . 1 . 1 203 203 GLN H H 1 7.8129 0.0000 . 1 . . 52657 . . 202 GLN H . 53440 1 1156 . 1 . 1 203 203 GLN CA C 13 53.8133 0.0000 . 1 . . 47048 . . 202 GLN CA . 53440 1 1157 . 1 . 1 203 203 GLN CB C 13 30.0337 0.0000 . 1 . . 52661 . . 202 GLN CB . 53440 1 1158 . 1 . 1 203 203 GLN N N 15 122.1397 0.0000 . 1 . . 52659 . . 202 GLN N . 53440 1 1159 . 1 . 1 204 204 THR H H 1 7.9265 0.0000 . 1 . . 51022 . . 203 THR H . 53440 1 1160 . 1 . 1 204 204 THR HG21 H 1 1.1660 0.0000 . 1 . . 22997 . . 203 THR HG21 . 53440 1 1161 . 1 . 1 204 204 THR HG22 H 1 1.1660 0.0000 . 1 . . 22997 . . 203 THR HG21 . 53440 1 1162 . 1 . 1 204 204 THR HG23 H 1 1.1660 0.0000 . 1 . . 22997 . . 203 THR HG21 . 53440 1 1163 . 1 . 1 204 204 THR C C 13 173.2833 0.0000 . 1 . . 46205 . . 203 THR C . 53440 1 1164 . 1 . 1 204 204 THR CA C 13 61.6462 0.0000 . 1 . . 53216 . . 203 THR CA . 53440 1 1165 . 1 . 1 204 204 THR CB C 13 69.7702 0.0000 . 1 . . 53210 . . 203 THR CB . 53440 1 1166 . 1 . 1 204 204 THR CG2 C 13 21.8320 0.0000 . 1 . . . . . 203 THR CG2 . 53440 1 1167 . 1 . 1 204 204 THR N N 15 118.5279 0.0000 . 1 . . 51024 . . 203 THR N . 53440 1 1168 . 1 . 1 205 205 TYR H H 1 9.2280 0.0000 . 1 . . 50650 . . 204 TYR H . 53440 1 1169 . 1 . 1 205 205 TYR C C 13 173.7626 0.0000 . 1 . . 45632 . . 204 TYR C . 53440 1 1170 . 1 . 1 205 205 TYR CA C 13 58.5063 0.0000 . 1 . . 46682 . . 204 TYR CA . 53440 1 1171 . 1 . 1 205 205 TYR CB C 13 40.3224 0.0000 . 1 . . 51704 . . 204 TYR CB . 53440 1 1172 . 1 . 1 205 205 TYR N N 15 127.1393 0.0000 . 1 . . 50652 . . 204 TYR N . 53440 1 1173 . 1 . 1 206 206 ILE H H 1 8.9009 0.0000 . 1 . . 49165 . . 205 ILE H . 53440 1 1174 . 1 . 1 206 206 ILE HD11 H 1 0.7360 0.0000 . 1 . . . . . 205 ILE HD11 . 53440 1 1175 . 1 . 1 206 206 ILE HD12 H 1 0.7360 0.0000 . 1 . . . . . 205 ILE HD11 . 53440 1 1176 . 1 . 1 206 206 ILE HD13 H 1 0.7360 0.0000 . 1 . . . . . 205 ILE HD11 . 53440 1 1177 . 1 . 1 206 206 ILE C C 13 174.6516 0.0000 . 1 . . 68287 . . 205 ILE C . 53440 1 1178 . 1 . 1 206 206 ILE CB C 13 41.4018 0.0000 . 1 . . 68293 . . 205 ILE CB . 53440 1 1179 . 1 . 1 206 206 ILE CD1 C 13 13.1370 0.0000 . 1 . . . . . 205 ILE CD1 . 53440 1 1180 . 1 . 1 206 206 ILE N N 15 124.0277 0.0000 . 1 . . 49167 . . 205 ILE N . 53440 1 1181 . 1 . 1 207 207 CYS H H 1 8.6183 0.0000 . 1 . . 49258 . . 206 CYS H . 53440 1 1182 . 1 . 1 207 207 CYS C C 13 172.1564 0.0000 . 1 . . 45881 . . 206 CYS C . 53440 1 1183 . 1 . 1 207 207 CYS CA C 13 52.1613 0.0000 . 1 . . 46946 . . 206 CYS CA . 53440 1 1184 . 1 . 1 207 207 CYS CB C 13 42.9982 0.0000 . 1 . . 52367 . . 206 CYS CB . 53440 1 1185 . 1 . 1 207 207 CYS N N 15 123.6804 0.0000 . 1 . . 49260 . . 206 CYS N . 53440 1 1186 . 1 . 1 208 208 ASN H H 1 8.9166 0.0000 . 1 . . 49270 . . 207 ASN H . 53440 1 1187 . 1 . 1 208 208 ASN C C 13 174.2250 0.0000 . 1 . . 60040 . . 207 ASN C . 53440 1 1188 . 1 . 1 208 208 ASN CA C 13 51.5914 0.0000 . 1 . . 60037 . . 207 ASN CA . 53440 1 1189 . 1 . 1 208 208 ASN CB C 13 38.8659 0.0000 . 1 . . 60038 . . 207 ASN CB . 53440 1 1190 . 1 . 1 208 208 ASN N N 15 123.1217 0.0000 . 1 . . 49272 . . 207 ASN N . 53440 1 1191 . 1 . 1 209 209 VAL H H 1 9.2659 0.0000 . 1 . . 51808 . . 208 VAL H . 53440 1 1192 . 1 . 1 209 209 VAL HG11 H 1 0.5300 0.0000 . 2 . . . . . 208 VAL HG11 . 53440 1 1193 . 1 . 1 209 209 VAL HG12 H 1 0.5300 0.0000 . 2 . . . . . 208 VAL HG11 . 53440 1 1194 . 1 . 1 209 209 VAL HG13 H 1 0.5300 0.0000 . 2 . . . . . 208 VAL HG11 . 53440 1 1195 . 1 . 1 209 209 VAL HG21 H 1 0.6760 0.0000 . 2 . . . . . 208 VAL HG21 . 53440 1 1196 . 1 . 1 209 209 VAL HG22 H 1 0.6760 0.0000 . 2 . . . . . 208 VAL HG21 . 53440 1 1197 . 1 . 1 209 209 VAL HG23 H 1 0.6760 0.0000 . 2 . . . . . 208 VAL HG21 . 53440 1 1198 . 1 . 1 209 209 VAL C C 13 174.5492 0.0000 . 1 . . 45644 . . 208 VAL C . 53440 1 1199 . 1 . 1 209 209 VAL CA C 13 61.2523 0.0000 . 1 . . 46709 . . 208 VAL CA . 53440 1 1200 . 1 . 1 209 209 VAL CB C 13 32.8997 0.0000 . 1 . . 51776 . . 208 VAL CB . 53440 1 1201 . 1 . 1 209 209 VAL CG1 C 13 21.1070 0.0000 . 2 . . . . . 208 VAL CG1 . 53440 1 1202 . 1 . 1 209 209 VAL CG2 C 13 21.8540 0.0000 . 2 . . . . . 208 VAL CG2 . 53440 1 1203 . 1 . 1 209 209 VAL N N 15 126.7129 0.0000 . 1 . . 51810 . . 208 VAL N . 53440 1 1204 . 1 . 1 210 210 ASN H H 1 8.6267 0.0000 . 1 . . 51901 . . 209 ASN H . 53440 1 1205 . 1 . 1 210 210 ASN C C 13 173.6685 0.0000 . 1 . . 45683 . . 209 ASN C . 53440 1 1206 . 1 . 1 210 210 ASN CA C 13 51.8567 0.0000 . 1 . . 46748 . . 209 ASN CA . 53440 1 1207 . 1 . 1 210 210 ASN CB C 13 41.0234 0.0000 . 1 . . 51854 . . 209 ASN CB . 53440 1 1208 . 1 . 1 210 210 ASN N N 15 126.1313 0.0000 . 1 . . 51903 . . 209 ASN N . 53440 1 1209 . 1 . 1 211 211 HIS H H 1 8.8479 0.0000 . 1 . . 48910 . . 210 HIS H . 53440 1 1210 . 1 . 1 211 211 HIS C C 13 173.3717 0.0000 . 1 . . 80794 . . 210 HIS C . 53440 1 1211 . 1 . 1 211 211 HIS CA C 13 54.3149 0.0000 . 1 . . 80795 . . 210 HIS CA . 53440 1 1212 . 1 . 1 211 211 HIS CB C 13 32.5210 0.0000 . 1 . . 80800 . . 210 HIS CB . 53440 1 1213 . 1 . 1 211 211 HIS N N 15 126.5564 0.0000 . 1 . . 48912 . . 210 HIS N . 53440 1 1214 . 1 . 1 212 212 LYS H H 1 9.0014 0.0000 . 1 . . 46618 . . 211 LYS H . 53440 1 1215 . 1 . 1 212 212 LYS C C 13 176.8817 0.0000 . 1 . . 45560 . . 211 LYS C . 53440 1 1216 . 1 . 1 212 212 LYS CA C 13 60.0306 0.0000 . 1 . . 51500 . . 211 LYS CA . 53440 1 1217 . 1 . 1 212 212 LYS CB C 13 28.7909 0.0000 . 1 . . 51515 . . 211 LYS CB . 53440 1 1218 . 1 . 1 212 212 LYS N N 15 128.0995 0.0000 . 1 . . 46620 . . 211 LYS N . 53440 1 1219 . 1 . 1 213 213 PRO C C 13 175.8943 0.0000 . 1 . . 54902 . . 212 PRO C . 53440 1 1220 . 1 . 1 213 213 PRO CA C 13 65.7121 0.0000 . 1 . . 47798 . . 212 PRO CA . 53440 1 1221 . 1 . 1 213 213 PRO CB C 13 31.2251 0.0000 . 1 . . 54203 . . 212 PRO CB . 53440 1 1222 . 1 . 1 214 214 SER H H 1 6.4102 0.0000 . 1 . . 46507 . . 213 SER H . 53440 1 1223 . 1 . 1 214 214 SER C C 13 174.1245 0.0000 . 1 . . 46508 . . 213 SER C . 53440 1 1224 . 1 . 1 214 214 SER CA C 13 57.0346 0.0000 . 1 . . 47801 . . 213 SER CA . 53440 1 1225 . 1 . 1 214 214 SER CB C 13 64.0406 0.0000 . 1 . . 54191 . . 213 SER CB . 53440 1 1226 . 1 . 1 214 214 SER N N 15 106.5054 0.0000 . 1 . . 46509 . . 213 SER N . 53440 1 1227 . 1 . 1 215 215 ASN H H 1 8.1939 0.0000 . 1 . . 52897 . . 214 ASN H . 53440 1 1228 . 1 . 1 215 215 ASN C C 13 174.4585 0.0000 . 1 . . 46040 . . 214 ASN C . 53440 1 1229 . 1 . 1 215 215 ASN CA C 13 54.2439 0.0000 . 1 . . 47153 . . 214 ASN CA . 53440 1 1230 . 1 . 1 215 215 ASN CB C 13 37.1024 0.0000 . 1 . . 52865 . . 214 ASN CB . 53440 1 1231 . 1 . 1 215 215 ASN N N 15 121.0174 0.0000 . 1 . . 52899 . . 214 ASN N . 53440 1 1232 . 1 . 1 216 216 THR H H 1 7.7534 0.0000 . 1 . . 53794 . . 215 THR H . 53440 1 1233 . 1 . 1 216 216 THR HG21 H 1 1.0940 0.0000 . 1 . . . . . 215 THR HG21 . 53440 1 1234 . 1 . 1 216 216 THR HG22 H 1 1.0940 0.0000 . 1 . . . . . 215 THR HG21 . 53440 1 1235 . 1 . 1 216 216 THR HG23 H 1 1.0940 0.0000 . 1 . . . . . 215 THR HG21 . 53440 1 1236 . 1 . 1 216 216 THR C C 13 173.5356 0.0000 . 1 . . 74975 . . 215 THR C . 53440 1 1237 . 1 . 1 216 216 THR CA C 13 63.0230 0.0000 . 1 . . 74978 . . 215 THR CA . 53440 1 1238 . 1 . 1 216 216 THR CB C 13 69.3349 0.0000 . 1 . . 74983 . . 215 THR CB . 53440 1 1239 . 1 . 1 216 216 THR CG2 C 13 20.9730 0.0000 . 1 . . . . . 215 THR CG2 . 53440 1 1240 . 1 . 1 216 216 THR N N 15 113.9440 0.0000 . 1 . . 53796 . . 215 THR N . 53440 1 1241 . 1 . 1 217 217 LYS H H 1 8.5110 0.0000 . 1 . . 48586 . . 216 LYS H . 53440 1 1242 . 1 . 1 217 217 LYS C C 13 175.0105 0.0000 . 1 . . 108775 . . 216 LYS C . 53440 1 1243 . 1 . 1 217 217 LYS CB C 13 33.5279 0.0000 . 1 . . 108787 . . 216 LYS CB . 53440 1 1244 . 1 . 1 217 217 LYS N N 15 130.0637 0.0000 . 1 . . 48588 . . 216 LYS N . 53440 1 1245 . 1 . 1 218 218 VAL H H 1 8.6336 0.0000 . 1 . . 82506 . . 217 VAL H . 53440 1 1246 . 1 . 1 218 218 VAL HG11 H 1 0.7760 0.0000 . 2 . . . . . 217 VAL HG11 . 53440 1 1247 . 1 . 1 218 218 VAL HG12 H 1 0.7760 0.0000 . 2 . . . . . 217 VAL HG11 . 53440 1 1248 . 1 . 1 218 218 VAL HG13 H 1 0.7760 0.0000 . 2 . . . . . 217 VAL HG11 . 53440 1 1249 . 1 . 1 218 218 VAL HG21 H 1 0.7820 0.0000 . 2 . . . . . 217 VAL HG21 . 53440 1 1250 . 1 . 1 218 218 VAL HG22 H 1 0.7820 0.0000 . 2 . . . . . 217 VAL HG21 . 53440 1 1251 . 1 . 1 218 218 VAL HG23 H 1 0.7820 0.0000 . 2 . . . . . 217 VAL HG21 . 53440 1 1252 . 1 . 1 218 218 VAL C C 13 172.8784 0.0000 . 1 . . 82786 . . 217 VAL C . 53440 1 1253 . 1 . 1 218 218 VAL CA C 13 60.3805 0.0000 . 1 . . 82788 . . 217 VAL CA . 53440 1 1254 . 1 . 1 218 218 VAL CB C 13 35.8162 0.0000 . 1 . . 82793 . . 217 VAL CB . 53440 1 1255 . 1 . 1 218 218 VAL CG1 C 13 20.9530 0.0000 . 2 . . . . . 217 VAL CG1 . 53440 1 1256 . 1 . 1 218 218 VAL CG2 C 13 20.5880 0.0000 . 2 . . . . . 217 VAL CG2 . 53440 1 1257 . 1 . 1 218 218 VAL N N 15 124.7703 0.0000 . 1 . . 82508 . . 217 VAL N . 53440 1 1258 . 1 . 1 219 219 ASP H H 1 8.2718 0.0000 . 1 . . 48808 . . 218 ASP H . 53440 1 1259 . 1 . 1 219 219 ASP C C 13 175.1254 0.0000 . 1 . . 108821 . . 218 ASP C . 53440 1 1260 . 1 . 1 219 219 ASP CA C 13 52.3341 0.0000 . 1 . . 51677 . . 218 ASP CA . 53440 1 1261 . 1 . 1 219 219 ASP CB C 13 42.4127 0.0000 . 1 . . 108823 . . 218 ASP CB . 53440 1 1262 . 1 . 1 219 219 ASP N N 15 127.1204 0.0000 . 1 . . 48810 . . 218 ASP N . 53440 1 1263 . 1 . 1 220 220 LYS C C 13 173.3345 0.0000 . 1 . . 108840 . . 219 LYS C . 53440 1 1264 . 1 . 1 220 220 LYS CA C 13 52.9910 0.0000 . 1 . . 108844 . . 219 LYS CA . 53440 1 1265 . 1 . 1 220 220 LYS CB C 13 33.3219 0.0000 . 1 . . 108854 . . 219 LYS CB . 53440 1 1266 . 1 . 1 221 221 LYS H H 1 8.4972 0.0000 . 1 . . 51454 . . 220 LYS H . 53440 1 1267 . 1 . 1 221 221 LYS C C 13 176.1225 0.0000 . 1 . . 108731 . . 220 LYS C . 53440 1 1268 . 1 . 1 221 221 LYS CA C 13 56.2188 0.0000 . 1 . . 108739 . . 220 LYS CA . 53440 1 1269 . 1 . 1 221 221 LYS CB C 13 32.1419 0.0000 . 1 . . 108741 . . 220 LYS CB . 53440 1 1270 . 1 . 1 221 221 LYS N N 15 128.3395 0.0000 . 1 . . 51456 . . 220 LYS N . 53440 1 1271 . 1 . 1 222 222 VAL H H 1 8.9714 0.0000 . 1 . . 50572 . . 221 VAL H . 53440 1 1272 . 1 . 1 222 222 VAL C C 13 174.8660 0.0000 . 1 . . 108827 . . 221 VAL C . 53440 1 1273 . 1 . 1 222 222 VAL CA C 13 62.4948 0.0000 . 1 . . 108835 . . 221 VAL CA . 53440 1 1274 . 1 . 1 222 222 VAL CB C 13 31.3994 0.0000 . 1 . . 108837 . . 221 VAL CB . 53440 1 1275 . 1 . 1 222 222 VAL N N 15 129.6439 0.0000 . 1 . . 50574 . . 221 VAL N . 53440 1 1276 . 1 . 1 223 223 GLU H H 1 8.4861 0.0000 . 1 . . 51682 . . 222 GLU H . 53440 1 1277 . 1 . 1 223 223 GLU C C 13 173.8525 0.0000 . 1 . . 55985 . . 222 GLU C . 53440 1 1278 . 1 . 1 223 223 GLU CA C 13 52.9357 0.0000 . 1 . . 55981 . . 222 GLU CA . 53440 1 1279 . 1 . 1 223 223 GLU CB C 13 30.5858 0.0000 . 1 . . 100499 . . 222 GLU CB . 53440 1 1280 . 1 . 1 223 223 GLU N N 15 127.1623 0.0000 . 1 . . 51684 . . 222 GLU N . 53440 1 1281 . 1 . 1 224 224 PRO C C 13 176.2223 0.0000 . 1 . . 91722 . . 223 PRO C . 53440 1 1282 . 1 . 1 224 224 PRO CA C 13 62.3299 0.0000 . 1 . . 91726 . . 223 PRO CA . 53440 1 1283 . 1 . 1 224 224 PRO CB C 13 31.5595 0.0000 . 1 . . 68851 . . 223 PRO CB . 53440 1 1284 . 1 . 1 225 225 LYS H H 1 8.4735 0.0000 . 1 . . 52435 . . 224 LYS H . 53440 1 1285 . 1 . 1 225 225 LYS C C 13 176.4862 0.0000 . 1 . . 45893 . . 224 LYS C . 53440 1 1286 . 1 . 1 225 225 LYS CA C 13 55.4678 0.0000 . 1 . . 52421 . . 224 LYS CA . 53440 1 1287 . 1 . 1 225 225 LYS CB C 13 33.0878 0.0000 . 1 . . 52481 . . 224 LYS CB . 53440 1 1288 . 1 . 1 225 225 LYS N N 15 123.4084 0.0000 . 1 . . 52437 . . 224 LYS N . 53440 1 1289 . 1 . 1 226 226 SER H H 1 8.5719 0.0000 . 1 . . 50956 . . 225 SER H . 53440 1 1290 . 1 . 1 226 226 SER C C 13 174.6713 0.0000 . 1 . . 54497 . . 225 SER C . 53440 1 1291 . 1 . 1 226 226 SER CA C 13 57.5365 0.0000 . 1 . . 47009 . . 225 SER CA . 53440 1 1292 . 1 . 1 226 226 SER CB C 13 63.7535 0.0000 . 1 . . 52532 . . 225 SER CB . 53440 1 1293 . 1 . 1 226 226 SER N N 15 120.3000 0.0000 . 1 . . 50958 . . 225 SER N . 53440 1 1294 . 1 . 1 227 227 CYS H H 1 8.6178 0.0000 . 1 . . 47002 . . 226 CYS H . 53440 1 1295 . 1 . 1 227 227 CYS C C 13 174.3349 0.0000 . 1 . . 45932 . . 226 CYS C . 53440 1 1296 . 1 . 1 227 227 CYS CA C 13 55.2421 0.0000 . 1 . . 47015 . . 226 CYS CA . 53440 1 1297 . 1 . 1 227 227 CYS CB C 13 41.3546 0.0000 . 1 . . 52565 . . 226 CYS CB . 53440 1 1298 . 1 . 1 227 227 CYS N N 15 122.7469 0.0000 . 1 . . 47004 . . 226 CYS N . 53440 1 1299 . 1 . 1 228 228 ASP H H 1 8.3874 0.0000 . 1 . . 49414 . . 227 ASP H . 53440 1 1300 . 1 . 1 228 228 ASP C C 13 175.9697 0.0000 . 1 . . 60605 . . 227 ASP C . 53440 1 1301 . 1 . 1 228 228 ASP CA C 13 53.9574 0.0000 . 1 . . 60608 . . 227 ASP CA . 53440 1 1302 . 1 . 1 228 228 ASP CB C 13 40.7146 0.0000 . 1 . . 60604 . . 227 ASP CB . 53440 1 1303 . 1 . 1 228 228 ASP N N 15 122.5753 0.0000 . 1 . . 49416 . . 227 ASP N . 53440 1 1304 . 1 . 1 229 229 LYS H H 1 8.2189 0.0000 . 1 . . 50884 . . 228 LYS H . 53440 1 1305 . 1 . 1 229 229 LYS C C 13 176.8262 0.0000 . 1 . . 79854 . . 228 LYS C . 53440 1 1306 . 1 . 1 229 229 LYS CA C 13 55.7532 0.0000 . 1 . . 79863 . . 228 LYS CA . 53440 1 1307 . 1 . 1 229 229 LYS CB C 13 32.0986 0.0000 . 1 . . 79861 . . 228 LYS CB . 53440 1 1308 . 1 . 1 229 229 LYS N N 15 121.8551 0.0000 . 1 . . 50886 . . 228 LYS N . 53440 1 1309 . 1 . 1 230 230 THR H H 1 8.1206 0.0000 . 1 . . 50050 . . 229 THR H . 53440 1 1310 . 1 . 1 230 230 THR HG21 H 1 1.1920 0.0000 . 1 . . 23081 . . 229 THR HG21 . 53440 1 1311 . 1 . 1 230 230 THR HG22 H 1 1.1920 0.0000 . 1 . . 23081 . . 229 THR HG21 . 53440 1 1312 . 1 . 1 230 230 THR HG23 H 1 1.1920 0.0000 . 1 . . 23081 . . 229 THR HG21 . 53440 1 1313 . 1 . 1 230 230 THR C C 13 173.8777 0.0000 . 1 . . 72817 . . 229 THR C . 53440 1 1314 . 1 . 1 230 230 THR CA C 13 61.7931 0.0000 . 1 . . 72818 . . 229 THR CA . 53440 1 1315 . 1 . 1 230 230 THR CB C 13 69.4642 0.0000 . 1 . . 72820 . . 229 THR CB . 53440 1 1316 . 1 . 1 230 230 THR CG2 C 13 21.1480 0.0000 . 1 . . . . . 229 THR CG2 . 53440 1 1317 . 1 . 1 230 230 THR N N 15 115.2165 0.0000 . 1 . . 50052 . . 229 THR N . 53440 1 1318 . 1 . 1 231 231 HIS C C 13 178.5997 0.0000 . 1 . . 45737 . . 230 HIS C . 53440 1 1319 . 1 . 1 231 231 HIS CA C 13 56.6737 0.0000 . 1 . . 52001 . . 230 HIS CA . 53440 1 1320 . 1 . 1 231 231 HIS CB C 13 29.3403 0.0000 . 1 . . 52073 . . 230 HIS CB . 53440 1 1321 . 1 . 1 231 231 HIS N N 15 125.3002 0.0000 . 1 . . 48990 . . 230 HIS N . 53440 1 stop_ save_ save_assigned_chemical_shifts_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID 53440 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Name 'assigned chem shift list 2' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 53440 2 2 '2D 1H-15N TROSY' . . . 53440 2 3 '2D 1H-13C HSQC' . . . 53440 2 4 '3D HNCO' . . . 53440 2 5 '3D HNCACO' . . . 53440 2 6 '3D HNCA' . . . 53440 2 7 '3D HN(CO)CA' . . . 53440 2 8 '3D HNCACB' . . . 53440 2 9 '3D HN(CO)CACB' . . . 53440 2 14 '3D CCH-TOCSY' . . . 53440 2 16 '3D HCCH-TOCSY' . . . 53440 2 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 53440 2 2 $software_2 . . 53440 2 3 $software_3 . . 53440 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 2 . 2 1 1 MET C C 13 171.7896 0.0000 . 1 . . 35899 . . 0 MET C . 53440 2 2 . 2 . 2 1 1 MET CA C 13 54.9078 0.0000 . 1 . . 35900 . . 0 MET CA . 53440 2 3 . 2 . 2 1 1 MET CB C 13 54.9078 0.0000 . 1 . . 35910 . . 0 MET CB . 53440 2 4 . 2 . 2 2 2 ASP C C 13 175.8001 0.0000 . 1 . . 37512 . . 1 ASP C . 53440 2 5 . 2 . 2 2 2 ASP CA C 13 53.8572 0.0000 . 1 . . 37513 . . 1 ASP CA . 53440 2 6 . 2 . 2 2 2 ASP CB C 13 40.1224 0.0000 . 1 . . 37520 . . 1 ASP CB . 53440 2 7 . 2 . 2 2 2 ASP N N 15 125.8030 0.0000 . 1 . . 23941 . . 1 ASP N . 53440 2 8 . 2 . 2 3 3 ILE H H 1 8.6925 0.0000 . 1 . . 22688 . . 2 ILE H . 53440 2 9 . 2 . 2 3 3 ILE HG21 H 1 1.1130 0.0000 . 1 . . . . . 2 ILE HG21 . 53440 2 10 . 2 . 2 3 3 ILE HG22 H 1 1.1130 0.0000 . 1 . . . . . 2 ILE HG21 . 53440 2 11 . 2 . 2 3 3 ILE HG23 H 1 1.1130 0.0000 . 1 . . . . . 2 ILE HG21 . 53440 2 12 . 2 . 2 3 3 ILE HD11 H 1 0.8630 0.0000 . 1 . . . . . 2 ILE HD11 . 53440 2 13 . 2 . 2 3 3 ILE HD12 H 1 0.8630 0.0000 . 1 . . . . . 2 ILE HD11 . 53440 2 14 . 2 . 2 3 3 ILE HD13 H 1 0.8630 0.0000 . 1 . . . . . 2 ILE HD11 . 53440 2 15 . 2 . 2 3 3 ILE C C 13 176.0140 0.0000 . 1 . . 37516 . . 2 ILE C . 53440 2 16 . 2 . 2 3 3 ILE CA C 13 62.0791 0.0000 . 1 . . 37518 . . 2 ILE CA . 53440 2 17 . 2 . 2 3 3 ILE CB C 13 36.7430 0.0000 . 1 . . 37519 . . 2 ILE CB . 53440 2 18 . 2 . 2 3 3 ILE CG2 C 13 18.1100 0.0000 . 1 . . . . . 2 ILE CG2 . 53440 2 19 . 2 . 2 3 3 ILE CD1 C 13 12.6740 0.0000 . 1 . . . . . 2 ILE CD1 . 53440 2 20 . 2 . 2 3 3 ILE N N 15 123.7788 0.0000 . 1 . . 22690 . . 2 ILE N . 53440 2 21 . 2 . 2 4 4 GLN H H 1 8.5649 0.0000 . 1 . . 19118 . . 3 GLN H . 53440 2 22 . 2 . 2 4 4 GLN C C 13 175.4766 0.0000 . 1 . . 48673 . . 3 GLN C . 53440 2 23 . 2 . 2 4 4 GLN CA C 13 54.6975 0.0000 . 1 . . 48676 . . 3 GLN CA . 53440 2 24 . 2 . 2 4 4 GLN CB C 13 29.6332 0.0000 . 1 . . 48696 . . 3 GLN CB . 53440 2 25 . 2 . 2 4 4 GLN N N 15 130.2325 0.0000 . 1 . . 19120 . . 3 GLN N . 53440 2 26 . 2 . 2 5 5 MET H H 1 9.0973 0.0000 . 1 . . 22559 . . 4 MET H . 53440 2 27 . 2 . 2 5 5 MET C C 13 176.2653 0.0000 . 1 . . 48689 . . 4 MET C . 53440 2 28 . 2 . 2 5 5 MET CA C 13 51.7820 0.0000 . 1 . . 48683 . . 4 MET CA . 53440 2 29 . 2 . 2 5 5 MET CB C 13 30.5220 0.0000 . 1 . . 48695 . . 4 MET CB . 53440 2 30 . 2 . 2 5 5 MET N N 15 126.2318 0.0000 . 1 . . 22561 . . 4 MET N . 53440 2 31 . 2 . 2 6 6 THR H H 1 9.4205 0.0000 . 1 . . 23390 . . 5 THR H . 53440 2 32 . 2 . 2 6 6 THR HG21 H 1 1.2480 0.0000 . 1 . . 54554 . . 5 THR HG21 . 53440 2 33 . 2 . 2 6 6 THR HG22 H 1 1.2480 0.0000 . 1 . . 54554 . . 5 THR HG21 . 53440 2 34 . 2 . 2 6 6 THR HG23 H 1 1.2480 0.0000 . 1 . . 54554 . . 5 THR HG21 . 53440 2 35 . 2 . 2 6 6 THR C C 13 174.3150 0.0000 . 1 . . 41657 . . 5 THR C . 53440 2 36 . 2 . 2 6 6 THR CA C 13 61.4743 0.0000 . 1 . . 41658 . . 5 THR CA . 53440 2 37 . 2 . 2 6 6 THR CB C 13 70.4150 0.0000 . 1 . . 41660 . . 5 THR CB . 53440 2 38 . 2 . 2 6 6 THR CG2 C 13 20.9710 0.0000 . 1 . . 51077 . . 5 THR CG2 . 53440 2 39 . 2 . 2 6 6 THR N N 15 119.5745 0.0000 . 1 . . 23392 . . 5 THR N . 53440 2 40 . 2 . 2 7 7 GLN H H 1 9.7547 0.0000 . 1 . . 22439 . . 6 GLN H . 53440 2 41 . 2 . 2 7 7 GLN C C 13 175.4812 0.0000 . 1 . . 34271 . . 6 GLN C . 53440 2 42 . 2 . 2 7 7 GLN CA C 13 54.5785 0.0000 . 1 . . 34270 . . 6 GLN CA . 53440 2 43 . 2 . 2 7 7 GLN CB C 13 30.5329 0.0000 . 1 . . 34273 . . 6 GLN CB . 53440 2 44 . 2 . 2 7 7 GLN N N 15 128.3672 0.0000 . 1 . . 22441 . . 6 GLN N . 53440 2 45 . 2 . 2 8 8 SER H H 1 8.7727 0.0000 . 1 . . 26261 . . 7 SER H . 53440 2 46 . 2 . 2 8 8 SER C C 13 172.1184 0.0000 . 1 . . 42081 . . 7 SER C . 53440 2 47 . 2 . 2 8 8 SER CA C 13 55.3757 0.0000 . 1 . . 42082 . . 7 SER CA . 53440 2 48 . 2 . 2 8 8 SER CB C 13 65.0997 0.0000 . 1 . . 42083 . . 7 SER CB . 53440 2 49 . 2 . 2 8 8 SER N N 15 118.2808 0.0000 . 1 . . 26263 . . 7 SER N . 53440 2 50 . 2 . 2 9 9 PRO C C 13 175.9384 0.0000 . 1 . . 44017 . . 8 PRO C . 53440 2 51 . 2 . 2 9 9 PRO CA C 13 63.0180 0.0000 . 1 . . 44018 . . 8 PRO CA . 53440 2 52 . 2 . 2 9 9 PRO CB C 13 34.2375 0.0000 . 1 . . 44024 . . 8 PRO CB . 53440 2 53 . 2 . 2 10 10 SER H H 1 9.0551 0.0000 . 1 . . 19979 . . 9 SER H . 53440 2 54 . 2 . 2 10 10 SER C C 13 175.5256 0.0000 . 1 . . 44022 . . 9 SER C . 53440 2 55 . 2 . 2 10 10 SER CA C 13 60.9424 0.0000 . 1 . . 44020 . . 9 SER CA . 53440 2 56 . 2 . 2 10 10 SER CB C 13 63.0179 0.0000 . 1 . . 44025 . . 9 SER CB . 53440 2 57 . 2 . 2 10 10 SER N N 15 115.8631 0.0000 . 1 . . 19981 . . 9 SER N . 53440 2 58 . 2 . 2 11 11 SER H H 1 7.7055 0.0000 . 1 . . 26855 . . 10 SER H . 53440 2 59 . 2 . 2 11 11 SER C C 13 171.9893 0.0000 . 1 . . 44097 . . 10 SER C . 53440 2 60 . 2 . 2 11 11 SER CA C 13 56.8948 0.0000 . 1 . . 44096 . . 10 SER CA . 53440 2 61 . 2 . 2 11 11 SER CB C 13 64.8589 0.0000 . 1 . . 44101 . . 10 SER CB . 53440 2 62 . 2 . 2 11 11 SER N N 15 115.7614 0.0000 . 1 . . 26857 . . 10 SER N . 53440 2 63 . 2 . 2 12 12 LEU H H 1 8.9434 0.0000 . 1 . . 25028 . . 11 LEU H . 53440 2 64 . 2 . 2 12 12 LEU HD11 H 1 0.8470 0.0000 . 2 . . . . . 11 LEU HD11 . 53440 2 65 . 2 . 2 12 12 LEU HD12 H 1 0.8470 0.0000 . 2 . . . . . 11 LEU HD11 . 53440 2 66 . 2 . 2 12 12 LEU HD13 H 1 0.8470 0.0000 . 2 . . . . . 11 LEU HD11 . 53440 2 67 . 2 . 2 12 12 LEU HD21 H 1 0.8460 0.0000 . 2 . . . . . 11 LEU HD21 . 53440 2 68 . 2 . 2 12 12 LEU HD22 H 1 0.8460 0.0000 . 2 . . . . . 11 LEU HD21 . 53440 2 69 . 2 . 2 12 12 LEU HD23 H 1 0.8460 0.0000 . 2 . . . . . 11 LEU HD21 . 53440 2 70 . 2 . 2 12 12 LEU C C 13 174.2549 0.0000 . 1 . . 37896 . . 11 LEU C . 53440 2 71 . 2 . 2 12 12 LEU CA C 13 54.7896 0.0000 . 1 . . 37898 . . 11 LEU CA . 53440 2 72 . 2 . 2 12 12 LEU CB C 13 44.3964 0.0000 . 1 . . 37903 . . 11 LEU CB . 53440 2 73 . 2 . 2 12 12 LEU CD1 C 13 26.5510 0.0000 . 2 . . . . . 11 LEU CD1 . 53440 2 74 . 2 . 2 12 12 LEU CD2 C 13 26.0890 0.0000 . 2 . . . . . 11 LEU CD2 . 53440 2 75 . 2 . 2 12 12 LEU N N 15 123.3104 0.0000 . 1 . . 25030 . . 11 LEU N . 53440 2 76 . 2 . 2 13 13 SER H H 1 8.4733 0.0000 . 1 . . 22982 . . 12 SER H . 53440 2 77 . 2 . 2 13 13 SER C C 13 173.3234 0.0000 . 1 . . 42189 . . 12 SER C . 53440 2 78 . 2 . 2 13 13 SER CA C 13 56.1950 0.0000 . 1 . . 42191 . . 12 SER CA . 53440 2 79 . 2 . 2 13 13 SER CB C 13 64.4559 0.0000 . 1 . . 42194 . . 12 SER CB . 53440 2 80 . 2 . 2 13 13 SER N N 15 118.2020 0.0000 . 1 . . 22984 . . 12 SER N . 53440 2 81 . 2 . 2 14 14 ALA HB1 H 1 1.3320 0.0000 . 1 . . 54539 . . 13 ALA HB1 . 53440 2 82 . 2 . 2 14 14 ALA HB2 H 1 1.3320 0.0000 . 1 . . 54539 . . 13 ALA HB1 . 53440 2 83 . 2 . 2 14 14 ALA HB3 H 1 1.3320 0.0000 . 1 . . 54539 . . 13 ALA HB1 . 53440 2 84 . 2 . 2 14 14 ALA C C 13 175.1800 0.0000 . 1 . . 42125 . . 13 ALA C . 53440 2 85 . 2 . 2 14 14 ALA CA C 13 50.8008 0.0000 . 1 . . 42126 . . 13 ALA CA . 53440 2 86 . 2 . 2 14 14 ALA CB C 13 22.6840 0.0000 . 1 . . 42148 . . 13 ALA CB . 53440 2 87 . 2 . 2 15 15 SER H H 1 8.5844 0.0000 . 1 . . 24320 . . 14 SER H . 53440 2 88 . 2 . 2 15 15 SER C C 13 173.8969 0.0000 . 1 . . 42130 . . 14 SER C . 53440 2 89 . 2 . 2 15 15 SER CA C 13 57.6565 0.0000 . 1 . . 42131 . . 14 SER CA . 53440 2 90 . 2 . 2 15 15 SER CB C 13 63.5753 0.0000 . 1 . . 42133 . . 14 SER CB . 53440 2 91 . 2 . 2 15 15 SER N N 15 118.2997 0.0000 . 1 . . 24322 . . 14 SER N . 53440 2 92 . 2 . 2 16 16 VAL H H 1 8.3626 0.0000 . 1 . . 22724 . . 15 VAL H . 53440 2 93 . 2 . 2 16 16 VAL HG11 H 1 0.9580 0.0000 . 2 . . . . . 15 VAL HG11 . 53440 2 94 . 2 . 2 16 16 VAL HG12 H 1 0.9580 0.0000 . 2 . . . . . 15 VAL HG11 . 53440 2 95 . 2 . 2 16 16 VAL HG13 H 1 0.9580 0.0000 . 2 . . . . . 15 VAL HG11 . 53440 2 96 . 2 . 2 16 16 VAL HG21 H 1 1.0150 0.0000 . 2 . . . . . 15 VAL HG21 . 53440 2 97 . 2 . 2 16 16 VAL HG22 H 1 1.0150 0.0000 . 2 . . . . . 15 VAL HG21 . 53440 2 98 . 2 . 2 16 16 VAL HG23 H 1 1.0150 0.0000 . 2 . . . . . 15 VAL HG21 . 53440 2 99 . 2 . 2 16 16 VAL C C 13 178.2534 0.0000 . 1 . . 38091 . . 15 VAL C . 53440 2 100 . 2 . 2 16 16 VAL CA C 13 64.4621 0.0000 . 1 . . 38093 . . 15 VAL CA . 53440 2 101 . 2 . 2 16 16 VAL CB C 13 30.4989 0.0000 . 1 . . 38095 . . 15 VAL CB . 53440 2 102 . 2 . 2 16 16 VAL CG1 C 13 23.1140 0.0000 . 2 . . . . . 15 VAL CG1 . 53440 2 103 . 2 . 2 16 16 VAL CG2 C 13 20.6360 0.0000 . 2 . . . . . 15 VAL CG2 . 53440 2 104 . 2 . 2 16 16 VAL N N 15 122.9881 0.0000 . 1 . . 22726 . . 15 VAL N . 53440 2 105 . 2 . 2 17 17 GLY H H 1 10.0291 0.0000 . 1 . . 24293 . . 16 GLY H . 53440 2 106 . 2 . 2 17 17 GLY C C 13 174.7083 0.0000 . 1 . . 42031 . . 16 GLY C . 53440 2 107 . 2 . 2 17 17 GLY CA C 13 44.5280 0.0000 . 1 . . 42029 . . 16 GLY CA . 53440 2 108 . 2 . 2 17 17 GLY N N 15 118.5031 0.0000 . 1 . . 24295 . . 16 GLY N . 53440 2 109 . 2 . 2 18 18 ASP H H 1 8.0083 0.0000 . 1 . . 24137 . . 17 ASP H . 53440 2 110 . 2 . 2 18 18 ASP C C 13 175.5312 0.0000 . 1 . . 38533 . . 17 ASP C . 53440 2 111 . 2 . 2 18 18 ASP CA C 13 54.4885 0.0000 . 1 . . 38530 . . 17 ASP CA . 53440 2 112 . 2 . 2 18 18 ASP CB C 13 41.0094 0.0000 . 1 . . 38535 . . 17 ASP CB . 53440 2 113 . 2 . 2 18 18 ASP N N 15 122.8799 0.0000 . 1 . . 24139 . . 17 ASP N . 53440 2 114 . 2 . 2 19 19 ARG H H 1 8.0672 0.0000 . 1 . . 24224 . . 18 ARG H . 53440 2 115 . 2 . 2 19 19 ARG C C 13 176.6130 0.0000 . 1 . . 40889 . . 18 ARG C . 53440 2 116 . 2 . 2 19 19 ARG CA C 13 54.3709 0.0000 . 1 . . 40888 . . 18 ARG CA . 53440 2 117 . 2 . 2 19 19 ARG CB C 13 30.4622 0.0000 . 1 . . 40892 . . 18 ARG CB . 53440 2 118 . 2 . 2 19 19 ARG N N 15 120.5642 0.0000 . 1 . . 24226 . . 18 ARG N . 53440 2 119 . 2 . 2 20 20 VAL H H 1 8.5156 0.0000 . 1 . . 22619 . . 19 VAL H . 53440 2 120 . 2 . 2 20 20 VAL HG11 H 1 0.7290 0.0000 . 2 . . . . . 19 VAL HG11 . 53440 2 121 . 2 . 2 20 20 VAL HG12 H 1 0.7290 0.0000 . 2 . . . . . 19 VAL HG11 . 53440 2 122 . 2 . 2 20 20 VAL HG13 H 1 0.7290 0.0000 . 2 . . . . . 19 VAL HG11 . 53440 2 123 . 2 . 2 20 20 VAL HG21 H 1 0.7200 0.0000 . 2 . . . . . 19 VAL HG21 . 53440 2 124 . 2 . 2 20 20 VAL HG22 H 1 0.7200 0.0000 . 2 . . . . . 19 VAL HG21 . 53440 2 125 . 2 . 2 20 20 VAL HG23 H 1 0.7200 0.0000 . 2 . . . . . 19 VAL HG21 . 53440 2 126 . 2 . 2 20 20 VAL C C 13 173.8250 0.0000 . 1 . . 36057 . . 19 VAL C . 53440 2 127 . 2 . 2 20 20 VAL CA C 13 59.9483 0.0000 . 1 . . 36054 . . 19 VAL CA . 53440 2 128 . 2 . 2 20 20 VAL CB C 13 34.9420 0.0000 . 1 . . 36073 . . 19 VAL CB . 53440 2 129 . 2 . 2 20 20 VAL CG1 C 13 21.8670 0.0000 . 2 . . . . . 19 VAL CG1 . 53440 2 130 . 2 . 2 20 20 VAL CG2 C 13 21.2210 0.0000 . 2 . . . . . 19 VAL CG2 . 53440 2 131 . 2 . 2 20 20 VAL N N 15 125.1213 0.0000 . 1 . . 22621 . . 19 VAL N . 53440 2 132 . 2 . 2 21 21 THR H H 1 8.0326 0.0000 . 1 . . 19805 . . 20 THR H . 53440 2 133 . 2 . 2 21 21 THR HG21 H 1 0.9730 0.0000 . 1 . . 54737 . . 20 THR HG21 . 53440 2 134 . 2 . 2 21 21 THR HG22 H 1 0.9730 0.0000 . 1 . . 54737 . . 20 THR HG21 . 53440 2 135 . 2 . 2 21 21 THR HG23 H 1 0.9730 0.0000 . 1 . . 54737 . . 20 THR HG21 . 53440 2 136 . 2 . 2 21 21 THR C C 13 173.0981 0.0000 . 1 . . 41981 . . 20 THR C . 53440 2 137 . 2 . 2 21 21 THR CA C 13 60.5887 0.0000 . 1 . . 41982 . . 20 THR CA . 53440 2 138 . 2 . 2 21 21 THR CB C 13 71.0828 0.0000 . 1 . . 41983 . . 20 THR CB . 53440 2 139 . 2 . 2 21 21 THR CG2 C 13 21.4450 0.0000 . 1 . . 51011 . . 20 THR CG2 . 53440 2 140 . 2 . 2 21 21 THR N N 15 118.6343 0.0000 . 1 . . 19807 . . 20 THR N . 53440 2 141 . 2 . 2 22 22 ILE H H 1 8.9970 0.0000 . 1 . . 25742 . . 21 ILE H . 53440 2 142 . 2 . 2 22 22 ILE HG21 H 1 1.1130 0.0000 . 1 . . . . . 21 ILE HG21 . 53440 2 143 . 2 . 2 22 22 ILE HG22 H 1 1.1130 0.0000 . 1 . . . . . 21 ILE HG21 . 53440 2 144 . 2 . 2 22 22 ILE HG23 H 1 1.1130 0.0000 . 1 . . . . . 21 ILE HG21 . 53440 2 145 . 2 . 2 22 22 ILE HD11 H 1 0.3870 0.0000 . 1 . . . . . 21 ILE HD11 . 53440 2 146 . 2 . 2 22 22 ILE HD12 H 1 0.3870 0.0000 . 1 . . . . . 21 ILE HD11 . 53440 2 147 . 2 . 2 22 22 ILE HD13 H 1 0.3870 0.0000 . 1 . . . . . 21 ILE HD11 . 53440 2 148 . 2 . 2 22 22 ILE C C 13 174.6875 0.0000 . 1 . . 35678 . . 21 ILE C . 53440 2 149 . 2 . 2 22 22 ILE CA C 13 60.4897 0.0000 . 1 . . 35670 . . 21 ILE CA . 53440 2 150 . 2 . 2 22 22 ILE CB C 13 40.3570 0.0000 . 1 . . 35677 . . 21 ILE CB . 53440 2 151 . 2 . 2 22 22 ILE CG2 C 13 18.1100 0.0000 . 1 . . . . . 21 ILE CG2 . 53440 2 152 . 2 . 2 22 22 ILE CD1 C 13 13.4750 0.0000 . 1 . . . . . 21 ILE CD1 . 53440 2 153 . 2 . 2 22 22 ILE N N 15 126.1290 0.0000 . 1 . . 25744 . . 21 ILE N . 53440 2 154 . 2 . 2 23 23 THR H H 1 8.8557 0.0000 . 1 . . 22934 . . 22 THR H . 53440 2 155 . 2 . 2 23 23 THR HG21 H 1 1.2400 0.0000 . 1 . . 54575 . . 22 THR HG21 . 53440 2 156 . 2 . 2 23 23 THR HG22 H 1 1.2400 0.0000 . 1 . . 54575 . . 22 THR HG21 . 53440 2 157 . 2 . 2 23 23 THR HG23 H 1 1.2400 0.0000 . 1 . . 54575 . . 22 THR HG21 . 53440 2 158 . 2 . 2 23 23 THR C C 13 174.4224 0.0000 . 1 . . 41806 . . 22 THR C . 53440 2 159 . 2 . 2 23 23 THR CA C 13 61.5568 0.0000 . 1 . . 41808 . . 22 THR CA . 53440 2 160 . 2 . 2 23 23 THR CB C 13 70.9800 0.0000 . 1 . . 41809 . . 22 THR CB . 53440 2 161 . 2 . 2 23 23 THR CG2 C 13 20.8020 0.0000 . 1 . . 51095 . . 22 THR CG2 . 53440 2 162 . 2 . 2 23 23 THR N N 15 119.1953 0.0000 . 1 . . 22936 . . 22 THR N . 53440 2 163 . 2 . 2 24 24 CYS H H 1 9.4804 0.0000 . 1 . . 23315 . . 23 CYS H . 53440 2 164 . 2 . 2 24 24 CYS C C 13 172.1639 0.0000 . 1 . . 36801 . . 23 CYS C . 53440 2 165 . 2 . 2 24 24 CYS CA C 13 55.5154 0.0000 . 1 . . 36803 . . 23 CYS CA . 53440 2 166 . 2 . 2 24 24 CYS CB C 13 48.0981 0.0000 . 1 . . 36804 . . 23 CYS CB . 53440 2 167 . 2 . 2 24 24 CYS N N 15 124.6685 0.0000 . 1 . . 23317 . . 23 CYS N . 53440 2 168 . 2 . 2 25 25 SER H H 1 9.2973 0.0000 . 1 . . 25991 . . 24 SER H . 53440 2 169 . 2 . 2 25 25 SER C C 13 173.0071 0.0000 . 1 . . 38178 . . 24 SER C . 53440 2 170 . 2 . 2 25 25 SER CA C 13 56.3972 0.0000 . 1 . . 38180 . . 24 SER CA . 53440 2 171 . 2 . 2 25 25 SER CB C 13 65.0858 0.0000 . 1 . . 38179 . . 24 SER CB . 53440 2 172 . 2 . 2 25 25 SER N N 15 123.0722 0.0000 . 1 . . 25993 . . 24 SER N . 53440 2 173 . 2 . 2 26 26 ALA H H 1 9.0460 0.0000 . 1 . . 22442 . . 25 ALA H . 53440 2 174 . 2 . 2 26 26 ALA HB1 H 1 1.5380 0.0000 . 1 . . 54416 . . 25 ALA HB1 . 53440 2 175 . 2 . 2 26 26 ALA HB2 H 1 1.5380 0.0000 . 1 . . 54416 . . 25 ALA HB1 . 53440 2 176 . 2 . 2 26 26 ALA HB3 H 1 1.5380 0.0000 . 1 . . 54416 . . 25 ALA HB1 . 53440 2 177 . 2 . 2 26 26 ALA C C 13 178.5255 0.0000 . 1 . . 34395 . . 25 ALA C . 53440 2 178 . 2 . 2 26 26 ALA CA C 13 49.8028 0.0000 . 1 . . 34398 . . 25 ALA CA . 53440 2 179 . 2 . 2 26 26 ALA CB C 13 23.8030 0.0000 . 1 . . 34410 . . 25 ALA CB . 53440 2 180 . 2 . 2 26 26 ALA N N 15 128.3798 0.0000 . 1 . . 22444 . . 25 ALA N . 53440 2 181 . 2 . 2 27 27 SER H H 1 8.1727 0.0000 . 1 . . 25436 . . 26 SER H . 53440 2 182 . 2 . 2 27 27 SER C C 13 173.6666 0.0000 . 1 . . 45133 . . 26 SER C . 53440 2 183 . 2 . 2 27 27 SER CA C 13 60.0684 0.0000 . 1 . . 45134 . . 26 SER CA . 53440 2 184 . 2 . 2 27 27 SER CB C 13 62.7718 0.0000 . 1 . . 45136 . . 26 SER CB . 53440 2 185 . 2 . 2 27 27 SER N N 15 114.3254 0.0000 . 1 . . 25438 . . 26 SER N . 53440 2 186 . 2 . 2 28 28 GLN H H 1 7.3265 0.0000 . 1 . . 26864 . . 27 GLN H . 53440 2 187 . 2 . 2 28 28 GLN C C 13 172.4728 0.0000 . 1 . . 48730 . . 27 GLN C . 53440 2 188 . 2 . 2 28 28 GLN CA C 13 53.4573 0.0000 . 1 . . 43459 . . 27 GLN CA . 53440 2 189 . 2 . 2 28 28 GLN CB C 13 31.9725 0.0000 . 1 . . 48734 . . 27 GLN CB . 53440 2 190 . 2 . 2 28 28 GLN N N 15 117.2832 0.0000 . 1 . . 26866 . . 27 GLN N . 53440 2 191 . 2 . 2 29 29 ASP H H 1 8.0191 0.0000 . 1 . . 25268 . . 28 ASP H . 53440 2 192 . 2 . 2 29 29 ASP C C 13 177.5005 0.0000 . 1 . . 49330 . . 28 ASP C . 53440 2 193 . 2 . 2 29 29 ASP CA C 13 55.3320 0.0000 . 1 . . 49333 . . 28 ASP CA . 53440 2 194 . 2 . 2 29 29 ASP CB C 13 40.6814 0.0000 . 1 . . 49339 . . 28 ASP CB . 53440 2 195 . 2 . 2 29 29 ASP N N 15 118.0300 0.0000 . 1 . . 25270 . . 28 ASP N . 53440 2 196 . 2 . 2 30 30 ILE H H 1 8.5283 0.0000 . 1 . . 23342 . . 29 ILE H . 53440 2 197 . 2 . 2 30 30 ILE HG21 H 1 0.9780 0.0000 . 1 . . . . . 29 ILE HG21 . 53440 2 198 . 2 . 2 30 30 ILE HG22 H 1 0.9780 0.0000 . 1 . . . . . 29 ILE HG21 . 53440 2 199 . 2 . 2 30 30 ILE HG23 H 1 0.9780 0.0000 . 1 . . . . . 29 ILE HG21 . 53440 2 200 . 2 . 2 30 30 ILE HD11 H 1 0.3980 0.0000 . 1 . . . . . 29 ILE HD11 . 53440 2 201 . 2 . 2 30 30 ILE HD12 H 1 0.3980 0.0000 . 1 . . . . . 29 ILE HD11 . 53440 2 202 . 2 . 2 30 30 ILE HD13 H 1 0.3980 0.0000 . 1 . . . . . 29 ILE HD11 . 53440 2 203 . 2 . 2 30 30 ILE CA C 13 60.3968 0.0000 . 1 . . 49361 . . 29 ILE CA . 53440 2 204 . 2 . 2 30 30 ILE CB C 13 38.1338 0.0000 . 1 . . 49332 . . 29 ILE CB . 53440 2 205 . 2 . 2 30 30 ILE CG2 C 13 17.9500 0.0000 . 1 . . . . . 29 ILE CG2 . 53440 2 206 . 2 . 2 30 30 ILE CD1 C 13 16.2020 0.0000 . 1 . . . . . 29 ILE CD1 . 53440 2 207 . 2 . 2 30 30 ILE N N 15 122.7363 0.0000 . 1 . . 23344 . . 29 ILE N . 53440 2 208 . 2 . 2 31 31 SER H H 1 9.0442 0.0000 . 1 . . 23003 . . 30 SER H . 53440 2 209 . 2 . 2 31 31 SER C C 13 175.2166 0.0000 . 1 . . 42903 . . 30 SER C . 53440 2 210 . 2 . 2 31 31 SER CA C 13 58.7489 0.0000 . 1 . . 42904 . . 30 SER CA . 53440 2 211 . 2 . 2 31 31 SER CB C 13 61.2863 0.0000 . 1 . . 42906 . . 30 SER CB . 53440 2 212 . 2 . 2 31 31 SER N N 15 117.7299 0.0000 . 1 . . 23005 . . 30 SER N . 53440 2 213 . 2 . 2 32 32 ASN C C 13 176.5915 0.0000 . 1 . . 36332 . . 31 ASN C . 53440 2 214 . 2 . 2 32 32 ASN CA C 13 53.1588 0.0000 . 1 . . 36333 . . 31 ASN CA . 53440 2 215 . 2 . 2 32 32 ASN CB C 13 38.8785 0.0000 . 1 . . 36339 . . 31 ASN CB . 53440 2 216 . 2 . 2 33 33 TYR H H 1 8.0561 0.0000 . 1 . . 24905 . . 32 TYR H . 53440 2 217 . 2 . 2 33 33 TYR C C 13 172.7006 0.0000 . 1 . . 36336 . . 32 TYR C . 53440 2 218 . 2 . 2 33 33 TYR CA C 13 56.1645 0.0000 . 1 . . 36334 . . 32 TYR CA . 53440 2 219 . 2 . 2 33 33 TYR CB C 13 33.4685 0.0000 . 1 . . 36360 . . 32 TYR CB . 53440 2 220 . 2 . 2 33 33 TYR N N 15 124.9943 0.0000 . 1 . . 24907 . . 32 TYR N . 53440 2 221 . 2 . 2 34 34 LEU H H 1 7.4393 0.0000 . 1 . . 22475 . . 33 LEU H . 53440 2 222 . 2 . 2 34 34 LEU HD11 H 1 0.0640 0.0000 . 2 . . . . . 33 LEU HD11 . 53440 2 223 . 2 . 2 34 34 LEU HD12 H 1 0.0640 0.0000 . 2 . . . . . 33 LEU HD11 . 53440 2 224 . 2 . 2 34 34 LEU HD13 H 1 0.0640 0.0000 . 2 . . . . . 33 LEU HD11 . 53440 2 225 . 2 . 2 34 34 LEU HD21 H 1 -0.0420 0.0000 . 2 . . . . . 33 LEU HD21 . 53440 2 226 . 2 . 2 34 34 LEU HD22 H 1 -0.0420 0.0000 . 2 . . . . . 33 LEU HD21 . 53440 2 227 . 2 . 2 34 34 LEU HD23 H 1 -0.0420 0.0000 . 2 . . . . . 33 LEU HD21 . 53440 2 228 . 2 . 2 34 34 LEU C C 13 175.0879 0.0000 . 1 . . 34607 . . 33 LEU C . 53440 2 229 . 2 . 2 34 34 LEU CA C 13 52.5455 0.0000 . 1 . . 34610 . . 33 LEU CA . 53440 2 230 . 2 . 2 34 34 LEU CB C 13 44.3844 0.0000 . 1 . . 34612 . . 33 LEU CB . 53440 2 231 . 2 . 2 34 34 LEU CD1 C 13 23.8140 0.0000 . 2 . . . . . 33 LEU CD1 . 53440 2 232 . 2 . 2 34 34 LEU CD2 C 13 24.1090 0.0000 . 2 . . . . . 33 LEU CD2 . 53440 2 233 . 2 . 2 34 34 LEU N N 15 127.6897 0.0000 . 1 . . 22477 . . 33 LEU N . 53440 2 234 . 2 . 2 35 35 ASN H H 1 8.8403 0.0000 . 1 . . 26051 . . 34 ASN H . 53440 2 235 . 2 . 2 35 35 ASN C C 13 174.1619 0.0000 . 1 . . 39202 . . 34 ASN C . 53440 2 236 . 2 . 2 35 35 ASN CA C 13 50.9115 0.0000 . 1 . . 39199 . . 34 ASN CA . 53440 2 237 . 2 . 2 35 35 ASN CB C 13 42.3929 0.0000 . 1 . . 39216 . . 34 ASN CB . 53440 2 238 . 2 . 2 35 35 ASN N N 15 122.2915 0.0000 . 1 . . 26053 . . 34 ASN N . 53440 2 239 . 2 . 2 36 36 TRP H H 1 9.0066 0.0000 . 1 . . 26327 . . 35 TRP H . 53440 2 240 . 2 . 2 36 36 TRP C C 13 175.8465 0.0000 . 1 . . 42983 . . 35 TRP C . 53440 2 241 . 2 . 2 36 36 TRP CA C 13 56.1236 0.0000 . 1 . . 42981 . . 35 TRP CA . 53440 2 242 . 2 . 2 36 36 TRP CB C 13 33.7823 0.0000 . 1 . . 42986 . . 35 TRP CB . 53440 2 243 . 2 . 2 36 36 TRP N N 15 117.6562 0.0000 . 1 . . 26329 . . 35 TRP N . 53440 2 244 . 2 . 2 37 37 TYR H H 1 9.7986 0.0000 . 1 . . 19835 . . 36 TYR H . 53440 2 245 . 2 . 2 37 37 TYR N N 15 118.0478 0.0000 . 1 . . 19837 . . 36 TYR N . 53440 2 246 . 2 . 2 38 38 GLN C C 13 174.1417 0.0000 . 1 . . 48553 . . 37 GLN C . 53440 2 247 . 2 . 2 38 38 GLN CA C 13 53.6475 0.0000 . 1 . . 33980 . . 37 GLN CA . 53440 2 248 . 2 . 2 38 38 GLN CB C 13 33.8173 0.0000 . 1 . . 33987 . . 37 GLN CB . 53440 2 249 . 2 . 2 39 39 GLN H H 1 9.6206 0.0000 . 1 . . 23783 . . 38 GLN H . 53440 2 250 . 2 . 2 39 39 GLN C C 13 174.7463 0.0000 . 1 . . 33983 . . 38 GLN C . 53440 2 251 . 2 . 2 39 39 GLN CA C 13 55.0383 0.0000 . 1 . . 33981 . . 38 GLN CA . 53440 2 252 . 2 . 2 39 39 GLN CB C 13 31.5034 0.0000 . 1 . . 33986 . . 38 GLN CB . 53440 2 253 . 2 . 2 39 39 GLN N N 15 129.2017 0.0000 . 1 . . 23785 . . 38 GLN N . 53440 2 254 . 2 . 2 40 40 LYS H H 1 8.8659 0.0000 . 1 . . 23729 . . 39 LYS H . 53440 2 255 . 2 . 2 40 40 LYS C C 13 173.2596 0.0000 . 1 . . 48536 . . 39 LYS C . 53440 2 256 . 2 . 2 40 40 LYS CA C 13 53.4575 0.0000 . 1 . . 33452 . . 39 LYS CA . 53440 2 257 . 2 . 2 40 40 LYS CB C 13 30.6870 0.0000 . 1 . . 48540 . . 39 LYS CB . 53440 2 258 . 2 . 2 40 40 LYS N N 15 132.7983 0.0000 . 1 . . 23731 . . 39 LYS N . 53440 2 259 . 2 . 2 41 41 PRO C C 13 178.2775 0.0000 . 1 . . 46196 . . 40 PRO C . 53440 2 260 . 2 . 2 41 41 PRO CA C 13 64.0155 0.0000 . 1 . . 46197 . . 40 PRO CA . 53440 2 261 . 2 . 2 41 41 PRO CB C 13 30.7984 0.0000 . 1 . . 46197 . . 40 PRO CB . 53440 2 262 . 2 . 2 42 42 GLY H H 1 8.5905 0.0000 . 1 . . 24533 . . 41 GLY H . 53440 2 263 . 2 . 2 42 42 GLY C C 13 173.9523 0.0000 . 1 . . 46200 . . 41 GLY C . 53440 2 264 . 2 . 2 42 42 GLY CA C 13 45.3846 0.0000 . 1 . . 46206 . . 41 GLY CA . 53440 2 265 . 2 . 2 42 42 GLY N N 15 112.9210 0.0000 . 1 . . 24535 . . 41 GLY N . 53440 2 266 . 2 . 2 43 43 LYS H H 1 7.8393 0.0000 . 1 . . 22895 . . 42 LYS H . 53440 2 267 . 2 . 2 43 43 LYS C C 13 175.5055 0.0000 . 1 . . 41139 . . 42 LYS C . 53440 2 268 . 2 . 2 43 43 LYS CA C 13 53.3466 0.0000 . 1 . . 41137 . . 42 LYS CA . 53440 2 269 . 2 . 2 43 43 LYS CB C 13 34.6411 0.0000 . 1 . . 41142 . . 42 LYS CB . 53440 2 270 . 2 . 2 43 43 LYS N N 15 120.3746 0.0000 . 1 . . 22897 . . 42 LYS N . 53440 2 271 . 2 . 2 44 44 ALA H H 1 8.0870 0.0000 . 1 . . 26129 . . 43 ALA H . 53440 2 272 . 2 . 2 44 44 ALA HB1 H 1 1.0320 0.0000 . 1 . . . . . 43 ALA HB1 . 53440 2 273 . 2 . 2 44 44 ALA HB2 H 1 1.0320 0.0000 . 1 . . . . . 43 ALA HB1 . 53440 2 274 . 2 . 2 44 44 ALA HB3 H 1 1.0320 0.0000 . 1 . . . . . 43 ALA HB1 . 53440 2 275 . 2 . 2 44 44 ALA C C 13 175.4357 0.0000 . 1 . . 40386 . . 43 ALA C . 53440 2 276 . 2 . 2 44 44 ALA CA C 13 49.9778 0.0000 . 1 . . 40387 . . 43 ALA CA . 53440 2 277 . 2 . 2 44 44 ALA CB C 13 17.0450 0.0000 . 1 . . 40388 . . 43 ALA CB . 53440 2 278 . 2 . 2 44 44 ALA N N 15 121.5110 0.0000 . 1 . . 26131 . . 43 ALA N . 53440 2 279 . 2 . 2 45 45 PRO C C 13 172.6683 0.0000 . 1 . . 43034 . . 44 PRO C . 53440 2 280 . 2 . 2 45 45 PRO CA C 13 61.4275 0.0000 . 1 . . 43035 . . 44 PRO CA . 53440 2 281 . 2 . 2 45 45 PRO CB C 13 30.8040 0.0000 . 1 . . 43042 . . 44 PRO CB . 53440 2 282 . 2 . 2 46 46 LYS H H 1 8.4361 0.0000 . 1 . . 23681 . . 45 LYS H . 53440 2 283 . 2 . 2 46 46 LYS C C 13 176.4057 0.0000 . 1 . . 43038 . . 45 LYS C . 53440 2 284 . 2 . 2 46 46 LYS CA C 13 53.7348 0.0000 . 1 . . 43037 . . 45 LYS CA . 53440 2 285 . 2 . 2 46 46 LYS CB C 13 35.4656 0.0000 . 1 . . 43055 . . 45 LYS CB . 53440 2 286 . 2 . 2 46 46 LYS N N 15 117.8087 0.0000 . 1 . . 23683 . . 45 LYS N . 53440 2 287 . 2 . 2 47 47 VAL H H 1 9.2979 0.0000 . 1 . . 24752 . . 46 VAL H . 53440 2 288 . 2 . 2 47 47 VAL HG11 H 1 0.5600 0.0000 . 2 . . . . . 46 VAL HG11 . 53440 2 289 . 2 . 2 47 47 VAL HG12 H 1 0.5600 0.0000 . 2 . . . . . 46 VAL HG11 . 53440 2 290 . 2 . 2 47 47 VAL HG13 H 1 0.5600 0.0000 . 2 . . . . . 46 VAL HG11 . 53440 2 291 . 2 . 2 47 47 VAL HG21 H 1 0.2710 0.0000 . 2 . . . . . 46 VAL HG21 . 53440 2 292 . 2 . 2 47 47 VAL HG22 H 1 0.2710 0.0000 . 2 . . . . . 46 VAL HG21 . 53440 2 293 . 2 . 2 47 47 VAL HG23 H 1 0.2710 0.0000 . 2 . . . . . 46 VAL HG21 . 53440 2 294 . 2 . 2 47 47 VAL C C 13 172.2660 0.0000 . 1 . . 34496 . . 46 VAL C . 53440 2 295 . 2 . 2 47 47 VAL CA C 13 61.6923 0.0000 . 1 . . 34497 . . 46 VAL CA . 53440 2 296 . 2 . 2 47 47 VAL CB C 13 31.1177 0.0000 . 1 . . 34499 . . 46 VAL CB . 53440 2 297 . 2 . 2 47 47 VAL CG1 C 13 19.5290 0.0000 . 2 . . . . . 46 VAL CG1 . 53440 2 298 . 2 . 2 47 47 VAL CG2 C 13 21.3810 0.0000 . 2 . . . . . 46 VAL CG2 . 53440 2 299 . 2 . 2 47 47 VAL N N 15 127.6607 0.0000 . 1 . . 24754 . . 46 VAL N . 53440 2 300 . 2 . 2 48 48 LEU H H 1 8.5705 0.0000 . 1 . . 26906 . . 47 LEU H . 53440 2 301 . 2 . 2 48 48 LEU HD11 H 1 0.4960 0.0000 . 2 . . . . . 47 LEU HD11 . 53440 2 302 . 2 . 2 48 48 LEU HD12 H 1 0.4960 0.0000 . 2 . . . . . 47 LEU HD11 . 53440 2 303 . 2 . 2 48 48 LEU HD13 H 1 0.4960 0.0000 . 2 . . . . . 47 LEU HD11 . 53440 2 304 . 2 . 2 48 48 LEU HD21 H 1 0.2900 0.0000 . 2 . . . . . 47 LEU HD21 . 53440 2 305 . 2 . 2 48 48 LEU HD22 H 1 0.2900 0.0000 . 2 . . . . . 47 LEU HD21 . 53440 2 306 . 2 . 2 48 48 LEU HD23 H 1 0.2900 0.0000 . 2 . . . . . 47 LEU HD21 . 53440 2 307 . 2 . 2 48 48 LEU C C 13 175.4052 0.0000 . 1 . . 48524 . . 47 LEU C . 53440 2 308 . 2 . 2 48 48 LEU CA C 13 54.0962 0.0000 . 1 . . 37208 . . 47 LEU CA . 53440 2 309 . 2 . 2 48 48 LEU CB C 13 44.9622 0.0000 . 1 . . 37212 . . 47 LEU CB . 53440 2 310 . 2 . 2 48 48 LEU CD1 C 13 26.7200 0.0000 . 2 . . . . . 47 LEU CD1 . 53440 2 311 . 2 . 2 48 48 LEU CD2 C 13 22.1400 0.0000 . 2 . . . . . 47 LEU CD2 . 53440 2 312 . 2 . 2 48 48 LEU N N 15 124.4065 0.0000 . 1 . . 26908 . . 47 LEU N . 53440 2 313 . 2 . 2 49 49 ILE H H 1 6.8541 0.0000 . 1 . . 23423 . . 48 ILE H . 53440 2 314 . 2 . 2 49 49 ILE HG21 H 1 0.6510 0.0000 . 1 . . . . . 48 ILE HG21 . 53440 2 315 . 2 . 2 49 49 ILE HG22 H 1 0.6510 0.0000 . 1 . . . . . 48 ILE HG21 . 53440 2 316 . 2 . 2 49 49 ILE HG23 H 1 0.6510 0.0000 . 1 . . . . . 48 ILE HG21 . 53440 2 317 . 2 . 2 49 49 ILE HD11 H 1 0.4420 0.0000 . 1 . . . . . 48 ILE HD11 . 53440 2 318 . 2 . 2 49 49 ILE HD12 H 1 0.4420 0.0000 . 1 . . . . . 48 ILE HD11 . 53440 2 319 . 2 . 2 49 49 ILE HD13 H 1 0.4420 0.0000 . 1 . . . . . 48 ILE HD11 . 53440 2 320 . 2 . 2 49 49 ILE C C 13 173.3510 0.0000 . 1 . . 42736 . . 48 ILE C . 53440 2 321 . 2 . 2 49 49 ILE CA C 13 57.4132 0.0000 . 1 . . 42737 . . 48 ILE CA . 53440 2 322 . 2 . 2 49 49 ILE CB C 13 43.0883 0.0000 . 1 . . 42738 . . 48 ILE CB . 53440 2 323 . 2 . 2 49 49 ILE CG2 C 13 17.7030 0.0000 . 1 . . . . . 48 ILE CG2 . 53440 2 324 . 2 . 2 49 49 ILE CD1 C 13 13.0400 0.0000 . 1 . . . . . 48 ILE CD1 . 53440 2 325 . 2 . 2 49 49 ILE N N 15 118.0922 0.0000 . 1 . . 23425 . . 48 ILE N . 53440 2 326 . 2 . 2 50 50 TYR H H 1 8.9431 0.0000 . 1 . . 22670 . . 49 TYR H . 53440 2 327 . 2 . 2 50 50 TYR C C 13 173.9644 0.0000 . 1 . . 48832 . . 49 TYR C . 53440 2 328 . 2 . 2 50 50 TYR CA C 13 53.6311 0.0000 . 1 . . 48834 . . 49 TYR CA . 53440 2 329 . 2 . 2 50 50 TYR CB C 13 42.5479 0.0000 . 1 . . 48844 . . 49 TYR CB . 53440 2 330 . 2 . 2 50 50 TYR N N 15 124.0312 0.0000 . 1 . . 22672 . . 49 TYR N . 53440 2 331 . 2 . 2 51 51 PHE H H 1 7.9507 0.0000 . 1 . . 24206 . . 50 PHE H . 53440 2 332 . 2 . 2 51 51 PHE C C 13 178.7174 0.0000 . 1 . . 48842 . . 50 PHE C . 53440 2 333 . 2 . 2 51 51 PHE CA C 13 56.7019 0.0000 . 1 . . 48841 . . 50 PHE CA . 53440 2 334 . 2 . 2 51 51 PHE CB C 13 37.9715 0.0000 . 1 . . 48847 . . 50 PHE CB . 53440 2 335 . 2 . 2 51 51 PHE N N 15 120.9025 0.0000 . 1 . . 24208 . . 50 PHE N . 53440 2 336 . 2 . 2 52 52 THR H H 1 9.5089 0.0000 . 1 . . 23558 . . 51 THR H . 53440 2 337 . 2 . 2 52 52 THR C C 13 175.6057 0.0000 . 1 . . 48828 . . 51 THR C . 53440 2 338 . 2 . 2 52 52 THR CA C 13 70.7375 0.0000 . 1 . . 48822 . . 51 THR CA . 53440 2 339 . 2 . 2 52 52 THR CB C 13 65.5093 0.0000 . 1 . . 48825 . . 51 THR CB . 53440 2 340 . 2 . 2 52 52 THR N N 15 109.9357 0.0000 . 1 . . 23560 . . 51 THR N . 53440 2 341 . 2 . 2 53 53 SER C C 13 175.4325 0.0000 . 1 . . 39092 . . 52 SER C . 53440 2 342 . 2 . 2 53 53 SER CA C 13 57.4215 0.0000 . 1 . . 39093 . . 52 SER CA . 53440 2 343 . 2 . 2 53 53 SER CB C 13 66.8397 0.0000 . 1 . . 39102 . . 52 SER CB . 53440 2 344 . 2 . 2 54 54 SER H H 1 8.5376 0.0000 . 1 . . 20762 . . 53 SER H . 53440 2 345 . 2 . 2 54 54 SER C C 13 171.7360 0.0000 . 1 . . 39096 . . 53 SER C . 53440 2 346 . 2 . 2 54 54 SER CA C 13 59.2363 0.0000 . 1 . . 39097 . . 53 SER CA . 53440 2 347 . 2 . 2 54 54 SER CB C 13 62.0747 0.0000 . 1 . . 39098 . . 53 SER CB . 53440 2 348 . 2 . 2 54 54 SER N N 15 122.4136 0.0000 . 1 . . 20764 . . 53 SER N . 53440 2 349 . 2 . 2 55 55 LEU H H 1 8.3852 0.0000 . 1 . . 23870 . . 54 LEU H . 53440 2 350 . 2 . 2 55 55 LEU HD11 H 1 0.9700 0.0000 . 2 . . . . . 54 LEU HD11 . 53440 2 351 . 2 . 2 55 55 LEU HD12 H 1 0.9700 0.0000 . 2 . . . . . 54 LEU HD11 . 53440 2 352 . 2 . 2 55 55 LEU HD13 H 1 0.9700 0.0000 . 2 . . . . . 54 LEU HD11 . 53440 2 353 . 2 . 2 55 55 LEU HD21 H 1 0.8910 0.0000 . 2 . . . . . 54 LEU HD21 . 53440 2 354 . 2 . 2 55 55 LEU HD22 H 1 0.8910 0.0000 . 2 . . . . . 54 LEU HD21 . 53440 2 355 . 2 . 2 55 55 LEU HD23 H 1 0.8910 0.0000 . 2 . . . . . 54 LEU HD21 . 53440 2 356 . 2 . 2 55 55 LEU C C 13 178.1506 0.0000 . 1 . . 35179 . . 54 LEU C . 53440 2 357 . 2 . 2 55 55 LEU CA C 13 55.1680 0.0000 . 1 . . 35182 . . 54 LEU CA . 53440 2 358 . 2 . 2 55 55 LEU CB C 13 42.3082 0.0000 . 1 . . 35183 . . 54 LEU CB . 53440 2 359 . 2 . 2 55 55 LEU CD1 C 13 24.2170 0.0000 . 2 . . . . . 54 LEU CD1 . 53440 2 360 . 2 . 2 55 55 LEU CD2 C 13 24.7830 0.0000 . 2 . . . . . 54 LEU CD2 . 53440 2 361 . 2 . 2 55 55 LEU N N 15 127.1017 0.0000 . 1 . . 23872 . . 54 LEU N . 53440 2 362 . 2 . 2 56 56 HIS H H 1 8.1514 0.0000 . 1 . . 25892 . . 55 HIS H . 53440 2 363 . 2 . 2 56 56 HIS C C 13 174.0248 0.0000 . 1 . . 37275 . . 55 HIS C . 53440 2 364 . 2 . 2 56 56 HIS CA C 13 56.4204 0.0000 . 1 . . 37276 . . 55 HIS CA . 53440 2 365 . 2 . 2 56 56 HIS CB C 13 29.0512 0.0000 . 1 . . 37292 . . 55 HIS CB . 53440 2 366 . 2 . 2 56 56 HIS N N 15 124.0800 0.0000 . 1 . . 25894 . . 55 HIS N . 53440 2 367 . 2 . 2 57 57 SER C C 13 175.0962 0.0000 . 1 . . 59135 . . 56 SER C . 53440 2 368 . 2 . 2 57 57 SER CA C 13 58.1773 0.0000 . 1 . . 59136 . . 56 SER CA . 53440 2 369 . 2 . 2 57 57 SER CB C 13 63.5507 0.0000 . 1 . . 59136 . . 56 SER CB . 53440 2 370 . 2 . 2 58 58 GLY H H 1 8.3619 0.0000 . 1 . . 58811 . . 57 GLY H . 53440 2 371 . 2 . 2 58 58 GLY CA C 13 44.9773 0.0000 . 1 . . 59138 . . 57 GLY CA . 53440 2 372 . 2 . 2 58 58 GLY N N 15 111.4069 0.0000 . 1 . . 58813 . . 57 GLY N . 53440 2 373 . 2 . 2 59 59 VAL H H 1 8.1907 0.0000 . 1 . . 24401 . . 58 VAL H . 53440 2 374 . 2 . 2 59 59 VAL CA C 13 58.0978 0.0000 . 1 . . 59201 . . 58 VAL CA . 53440 2 375 . 2 . 2 59 59 VAL N N 15 116.1611 0.0000 . 1 . . 24403 . . 58 VAL N . 53440 2 376 . 2 . 2 60 60 PRO C C 13 176.9169 0.0000 . 1 . . 45684 . . 59 PRO C . 53440 2 377 . 2 . 2 60 60 PRO CA C 13 62.7955 0.0000 . 1 . . 45685 . . 59 PRO CA . 53440 2 378 . 2 . 2 60 60 PRO CB C 13 33.0391 0.0000 . 1 . . 45691 . . 59 PRO CB . 53440 2 379 . 2 . 2 61 61 SER H H 1 8.3364 0.0000 . 1 . . 26576 . . 60 SER H . 53440 2 380 . 2 . 2 61 61 SER C C 13 174.3141 0.0000 . 1 . . 45688 . . 60 SER C . 53440 2 381 . 2 . 2 61 61 SER CA C 13 60.1112 0.0000 . 1 . . 45686 . . 60 SER CA . 53440 2 382 . 2 . 2 61 61 SER CB C 13 62.6774 0.0000 . 1 . . 45692 . . 60 SER CB . 53440 2 383 . 2 . 2 61 61 SER N N 15 114.1351 0.0000 . 1 . . 26578 . . 60 SER N . 53440 2 384 . 2 . 2 62 62 ARG H H 1 6.9158 0.0000 . 1 . . 23441 . . 61 ARG H . 53440 2 385 . 2 . 2 62 62 ARG C C 13 175.5710 0.0000 . 1 . . 43874 . . 61 ARG C . 53440 2 386 . 2 . 2 62 62 ARG CA C 13 56.4741 0.0000 . 1 . . 43875 . . 61 ARG CA . 53440 2 387 . 2 . 2 62 62 ARG CB C 13 28.6356 0.0000 . 1 . . 43878 . . 61 ARG CB . 53440 2 388 . 2 . 2 62 62 ARG N N 15 116.5666 0.0000 . 1 . . 23443 . . 61 ARG N . 53440 2 389 . 2 . 2 63 63 PHE H H 1 7.5681 0.0000 . 1 . . 19679 . . 62 PHE H . 53440 2 390 . 2 . 2 63 63 PHE C C 13 173.9985 0.0000 . 1 . . 40492 . . 62 PHE C . 53440 2 391 . 2 . 2 63 63 PHE CA C 13 57.9553 0.0000 . 1 . . 40489 . . 62 PHE CA . 53440 2 392 . 2 . 2 63 63 PHE CB C 13 39.5587 0.0000 . 1 . . 40494 . . 62 PHE CB . 53440 2 393 . 2 . 2 63 63 PHE N N 15 121.1710 0.0000 . 1 . . 19681 . . 62 PHE N . 53440 2 394 . 2 . 2 64 64 SER H H 1 8.6614 0.0000 . 1 . . 20075 . . 63 SER H . 53440 2 395 . 2 . 2 64 64 SER C C 13 172.5580 0.0000 . 1 . . 46236 . . 63 SER C . 53440 2 396 . 2 . 2 64 64 SER CA C 13 56.9823 0.0000 . 1 . . 46234 . . 63 SER CA . 53440 2 397 . 2 . 2 64 64 SER CB C 13 65.5305 0.0000 . 1 . . 46238 . . 63 SER CB . 53440 2 398 . 2 . 2 64 64 SER N N 15 113.1662 0.0000 . 1 . . 20077 . . 63 SER N . 53440 2 399 . 2 . 2 65 65 GLY H H 1 8.7910 0.0000 . 1 . . 26678 . . 64 GLY H . 53440 2 400 . 2 . 2 65 65 GLY C C 13 172.8400 0.0000 . 1 . . 47723 . . 64 GLY C . 53440 2 401 . 2 . 2 65 65 GLY CA C 13 43.7323 0.0000 . 1 . . 47726 . . 64 GLY CA . 53440 2 402 . 2 . 2 65 65 GLY N N 15 110.4914 0.0000 . 1 . . 26680 . . 64 GLY N . 53440 2 403 . 2 . 2 66 66 SER H H 1 8.7996 0.0000 . 1 . . 23453 . . 65 SER H . 53440 2 404 . 2 . 2 66 66 SER C C 13 173.8332 0.0000 . 1 . . 44499 . . 65 SER C . 53440 2 405 . 2 . 2 66 66 SER CA C 13 56.8489 0.0000 . 1 . . 44502 . . 65 SER CA . 53440 2 406 . 2 . 2 66 66 SER CB C 13 65.7571 0.0000 . 1 . . 44505 . . 65 SER CB . 53440 2 407 . 2 . 2 66 66 SER N N 15 115.9295 0.0000 . 1 . . 23455 . . 65 SER N . 53440 2 408 . 2 . 2 67 67 GLY H H 1 8.1595 0.0000 . 1 . . 26672 . . 66 GLY H . 53440 2 409 . 2 . 2 67 67 GLY C C 13 172.1190 0.0000 . 1 . . 47651 . . 66 GLY C . 53440 2 410 . 2 . 2 67 67 GLY CA C 13 44.8542 0.0000 . 1 . . 47654 . . 66 GLY CA . 53440 2 411 . 2 . 2 67 67 GLY N N 15 110.7579 0.0000 . 1 . . 26674 . . 66 GLY N . 53440 2 412 . 2 . 2 68 68 SER H H 1 6.9797 0.0000 . 1 . . 25526 . . 67 SER H . 53440 2 413 . 2 . 2 68 68 SER C C 13 174.8138 0.0000 . 1 . . 47940 . . 67 SER C . 53440 2 414 . 2 . 2 68 68 SER CA C 13 58.5361 0.0000 . 1 . . 47942 . . 67 SER CA . 53440 2 415 . 2 . 2 68 68 SER CB C 13 63.9807 0.0000 . 1 . . 47944 . . 67 SER CB . 53440 2 416 . 2 . 2 68 68 SER N N 15 109.4896 0.0000 . 1 . . 25528 . . 67 SER N . 53440 2 417 . 2 . 2 69 69 GLY H H 1 8.4422 0.0000 . 1 . . 25475 . . 68 GLY H . 53440 2 418 . 2 . 2 69 69 GLY C C 13 172.8403 0.0000 . 1 . . 46636 . . 68 GLY C . 53440 2 419 . 2 . 2 69 69 GLY CA C 13 47.3362 0.0000 . 1 . . 46634 . . 68 GLY CA . 53440 2 420 . 2 . 2 69 69 GLY N N 15 112.6882 0.0000 . 1 . . 25477 . . 68 GLY N . 53440 2 421 . 2 . 2 70 70 THR H H 1 8.0304 0.0000 . 1 . . 26540 . . 69 THR H . 53440 2 422 . 2 . 2 70 70 THR HG21 H 1 0.9610 0.0000 . 1 . . 54794 . . 69 THR HG21 . 53440 2 423 . 2 . 2 70 70 THR HG22 H 1 0.9610 0.0000 . 1 . . 54794 . . 69 THR HG21 . 53440 2 424 . 2 . 2 70 70 THR HG23 H 1 0.9610 0.0000 . 1 . . 54794 . . 69 THR HG21 . 53440 2 425 . 2 . 2 70 70 THR C C 13 173.8077 0.0000 . 1 . . 45019 . . 69 THR C . 53440 2 426 . 2 . 2 70 70 THR CA C 13 61.3855 0.0000 . 1 . . 45017 . . 69 THR CA . 53440 2 427 . 2 . 2 70 70 THR CB C 13 70.3473 0.0000 . 1 . . 45023 . . 69 THR CB . 53440 2 428 . 2 . 2 70 70 THR CG2 C 13 20.1570 0.0000 . 1 . . 51203 . . 69 THR CG2 . 53440 2 429 . 2 . 2 70 70 THR N N 15 114.6147 0.0000 . 1 . . 26542 . . 69 THR N . 53440 2 430 . 2 . 2 71 71 ASP H H 1 7.0220 0.0000 . 1 . . 22820 . . 70 ASP H . 53440 2 431 . 2 . 2 71 71 ASP C C 13 173.2086 0.0000 . 1 . . 39998 . . 70 ASP C . 53440 2 432 . 2 . 2 71 71 ASP CA C 13 54.4363 0.0000 . 1 . . 39999 . . 70 ASP CA . 53440 2 433 . 2 . 2 71 71 ASP CB C 13 43.7348 0.0000 . 1 . . 40000 . . 70 ASP CB . 53440 2 434 . 2 . 2 71 71 ASP N N 15 121.8795 0.0000 . 1 . . 22822 . . 70 ASP N . 53440 2 435 . 2 . 2 72 72 PHE H H 1 8.8085 0.0000 . 1 . . 22790 . . 71 PHE H . 53440 2 436 . 2 . 2 72 72 PHE C C 13 175.6883 0.0000 . 1 . . 39473 . . 71 PHE C . 53440 2 437 . 2 . 2 72 72 PHE CA C 13 56.9826 0.0000 . 1 . . 39471 . . 71 PHE CA . 53440 2 438 . 2 . 2 72 72 PHE CB C 13 42.9739 0.0000 . 1 . . 39476 . . 71 PHE CB . 53440 2 439 . 2 . 2 72 72 PHE N N 15 122.3173 0.0000 . 1 . . 22792 . . 71 PHE N . 53440 2 440 . 2 . 2 73 73 THR H H 1 8.7790 0.0000 . 1 . . 25406 . . 72 THR H . 53440 2 441 . 2 . 2 73 73 THR HG21 H 1 0.9880 0.0000 . 1 . . 54746 . . 72 THR HG21 . 53440 2 442 . 2 . 2 73 73 THR HG22 H 1 0.9880 0.0000 . 1 . . 54746 . . 72 THR HG21 . 53440 2 443 . 2 . 2 73 73 THR HG23 H 1 0.9880 0.0000 . 1 . . 54746 . . 72 THR HG21 . 53440 2 444 . 2 . 2 73 73 THR C C 13 172.6950 0.0000 . 1 . . 44637 . . 72 THR C . 53440 2 445 . 2 . 2 73 73 THR CA C 13 60.5343 0.0000 . 1 . . 44639 . . 72 THR CA . 53440 2 446 . 2 . 2 73 73 THR CB C 13 72.2502 0.0000 . 1 . . 44641 . . 72 THR CB . 53440 2 447 . 2 . 2 73 73 THR CG2 C 13 21.6220 0.0000 . 1 . . 50981 . . 72 THR CG2 . 53440 2 448 . 2 . 2 73 73 THR N N 15 114.8697 0.0000 . 1 . . 25408 . . 72 THR N . 53440 2 449 . 2 . 2 74 74 LEU H H 1 8.7234 0.0000 . 1 . . 25610 . . 73 LEU H . 53440 2 450 . 2 . 2 74 74 LEU HD11 H 1 0.0760 0.0000 . 2 . . . . . 73 LEU HD11 . 53440 2 451 . 2 . 2 74 74 LEU HD12 H 1 0.0760 0.0000 . 2 . . . . . 73 LEU HD11 . 53440 2 452 . 2 . 2 74 74 LEU HD13 H 1 0.0760 0.0000 . 2 . . . . . 73 LEU HD11 . 53440 2 453 . 2 . 2 74 74 LEU HD21 H 1 0.2160 0.0000 . 2 . . . . . 73 LEU HD21 . 53440 2 454 . 2 . 2 74 74 LEU HD22 H 1 0.2160 0.0000 . 2 . . . . . 73 LEU HD21 . 53440 2 455 . 2 . 2 74 74 LEU HD23 H 1 0.2160 0.0000 . 2 . . . . . 73 LEU HD21 . 53440 2 456 . 2 . 2 74 74 LEU C C 13 174.5423 0.0000 . 1 . . 33756 . . 73 LEU C . 53440 2 457 . 2 . 2 74 74 LEU CA C 13 53.0590 0.0000 . 1 . . 33754 . . 73 LEU CA . 53440 2 458 . 2 . 2 74 74 LEU CB C 13 40.4493 0.0000 . 1 . . 33760 . . 73 LEU CB . 53440 2 459 . 2 . 2 74 74 LEU CD1 C 13 25.9980 0.0000 . 2 . . . . . 73 LEU CD1 . 53440 2 460 . 2 . 2 74 74 LEU CD2 C 13 23.8150 0.0000 . 2 . . . . . 73 LEU CD2 . 53440 2 461 . 2 . 2 74 74 LEU N N 15 128.8349 0.0000 . 1 . . 25612 . . 73 LEU N . 53440 2 462 . 2 . 2 75 75 THR H H 1 8.9053 0.0000 . 1 . . 23327 . . 74 THR H . 53440 2 463 . 2 . 2 75 75 THR HG21 H 1 0.8120 0.0000 . 1 . . . . . 74 THR HG21 . 53440 2 464 . 2 . 2 75 75 THR HG22 H 1 0.8120 0.0000 . 1 . . . . . 74 THR HG21 . 53440 2 465 . 2 . 2 75 75 THR HG23 H 1 0.8120 0.0000 . 1 . . . . . 74 THR HG21 . 53440 2 466 . 2 . 2 75 75 THR C C 13 173.3319 0.0000 . 1 . . 37842 . . 74 THR C . 53440 2 467 . 2 . 2 75 75 THR CA C 13 60.7337 0.0000 . 1 . . 37837 . . 74 THR CA . 53440 2 468 . 2 . 2 75 75 THR CB C 13 69.9999 0.0000 . 1 . . 37845 . . 74 THR CB . 53440 2 469 . 2 . 2 75 75 THR CG2 C 13 20.1230 0.0000 . 1 . . 51233 . . 74 THR CG2 . 53440 2 470 . 2 . 2 75 75 THR N N 15 123.4749 0.0000 . 1 . . 23329 . . 74 THR N . 53440 2 471 . 2 . 2 76 76 ILE H H 1 8.7186 0.0000 . 1 . . 23882 . . 75 ILE H . 53440 2 472 . 2 . 2 76 76 ILE HG21 H 1 0.1010 0.0000 . 1 . . . . . 75 ILE HG21 . 53440 2 473 . 2 . 2 76 76 ILE HG22 H 1 0.1010 0.0000 . 1 . . . . . 75 ILE HG21 . 53440 2 474 . 2 . 2 76 76 ILE HG23 H 1 0.1010 0.0000 . 1 . . . . . 75 ILE HG21 . 53440 2 475 . 2 . 2 76 76 ILE HD11 H 1 0.2550 0.0000 . 1 . . . . . 75 ILE HD11 . 53440 2 476 . 2 . 2 76 76 ILE HD12 H 1 0.2550 0.0000 . 1 . . . . . 75 ILE HD11 . 53440 2 477 . 2 . 2 76 76 ILE HD13 H 1 0.2550 0.0000 . 1 . . . . . 75 ILE HD11 . 53440 2 478 . 2 . 2 76 76 ILE C C 13 176.3288 0.0000 . 1 . . 35243 . . 75 ILE C . 53440 2 479 . 2 . 2 76 76 ILE CA C 13 59.7448 0.0000 . 1 . . 35244 . . 75 ILE CA . 53440 2 480 . 2 . 2 76 76 ILE CB C 13 37.5622 0.0000 . 1 . . 35245 . . 75 ILE CB . 53440 2 481 . 2 . 2 76 76 ILE CG2 C 13 16.9530 0.0000 . 1 . . . . . 75 ILE CG2 . 53440 2 482 . 2 . 2 76 76 ILE CD1 C 13 12.4280 0.0000 . 1 . . . . . 75 ILE CD1 . 53440 2 483 . 2 . 2 76 76 ILE N N 15 126.6788 0.0000 . 1 . . 23884 . . 75 ILE N . 53440 2 484 . 2 . 2 77 77 SER H H 1 8.8231 0.0000 . 1 . . 26120 . . 76 SER H . 53440 2 485 . 2 . 2 77 77 SER C C 13 173.5700 0.0000 . 1 . . 40172 . . 76 SER C . 53440 2 486 . 2 . 2 77 77 SER CA C 13 60.2624 0.0000 . 1 . . 40170 . . 76 SER CA . 53440 2 487 . 2 . 2 77 77 SER CB C 13 62.6321 0.0000 . 1 . . 40175 . . 76 SER CB . 53440 2 488 . 2 . 2 77 77 SER N N 15 121.6304 0.0000 . 1 . . 26122 . . 76 SER N . 53440 2 489 . 2 . 2 78 78 SER H H 1 6.3293 0.0000 . 1 . . 20216 . . 77 SER H . 53440 2 490 . 2 . 2 78 78 SER C C 13 173.6546 0.0000 . 1 . . 48549 . . 77 SER C . 53440 2 491 . 2 . 2 78 78 SER CA C 13 56.4206 0.0000 . 1 . . 48547 . . 77 SER CA . 53440 2 492 . 2 . 2 78 78 SER N N 15 113.7381 0.0000 . 1 . . 20218 . . 77 SER N . 53440 2 493 . 2 . 2 79 79 LEU H H 1 8.6644 0.0000 . 1 . . 22499 . . 78 LEU H . 53440 2 494 . 2 . 2 79 79 LEU HD11 H 1 0.4110 0.0000 . 2 . . . . . 78 LEU HD11 . 53440 2 495 . 2 . 2 79 79 LEU HD12 H 1 0.4110 0.0000 . 2 . . . . . 78 LEU HD11 . 53440 2 496 . 2 . 2 79 79 LEU HD13 H 1 0.4110 0.0000 . 2 . . . . . 78 LEU HD11 . 53440 2 497 . 2 . 2 79 79 LEU HD21 H 1 0.6840 0.0000 . 2 . . . . . 78 LEU HD21 . 53440 2 498 . 2 . 2 79 79 LEU HD22 H 1 0.6840 0.0000 . 2 . . . . . 78 LEU HD21 . 53440 2 499 . 2 . 2 79 79 LEU HD23 H 1 0.6840 0.0000 . 2 . . . . . 78 LEU HD21 . 53440 2 500 . 2 . 2 79 79 LEU C C 13 176.4214 0.0000 . 1 . . 48864 . . 78 LEU C . 53440 2 501 . 2 . 2 79 79 LEU CA C 13 56.5691 0.0000 . 1 . . 35123 . . 78 LEU CA . 53440 2 502 . 2 . 2 79 79 LEU CB C 13 41.9136 0.0000 . 1 . . 48868 . . 78 LEU CB . 53440 2 503 . 2 . 2 79 79 LEU CD1 C 13 27.0440 0.0000 . 2 . . . . . 78 LEU CD1 . 53440 2 504 . 2 . 2 79 79 LEU CD2 C 13 26.2760 0.0000 . 2 . . . . . 78 LEU CD2 . 53440 2 505 . 2 . 2 79 79 LEU N N 15 127.1802 0.0000 . 1 . . 22501 . . 78 LEU N . 53440 2 506 . 2 . 2 80 80 GLN H H 1 9.0021 0.0000 . 1 . . 25739 . . 79 GLN H . 53440 2 507 . 2 . 2 80 80 GLN C C 13 174.7790 0.0000 . 1 . . 35939 . . 79 GLN C . 53440 2 508 . 2 . 2 80 80 GLN CA C 13 52.3316 0.0000 . 1 . . 35941 . . 79 GLN CA . 53440 2 509 . 2 . 2 80 80 GLN CB C 13 29.0576 0.0000 . 1 . . 35942 . . 79 GLN CB . 53440 2 510 . 2 . 2 80 80 GLN N N 15 125.7019 0.0000 . 1 . . 25741 . . 79 GLN N . 53440 2 511 . 2 . 2 81 81 PRO C C 13 178.3231 0.0000 . 1 . . 45971 . . 80 PRO C . 53440 2 512 . 2 . 2 81 81 PRO CA C 13 65.8386 0.0000 . 1 . . 45972 . . 80 PRO CA . 53440 2 513 . 2 . 2 81 81 PRO CB C 13 31.3197 0.0000 . 1 . . 45979 . . 80 PRO CB . 53440 2 514 . 2 . 2 82 82 GLU H H 1 9.0000 0.0000 . 1 . . 25460 . . 81 GLU H . 53440 2 515 . 2 . 2 82 82 GLU C C 13 176.8031 0.0000 . 1 . . 45976 . . 81 GLU C . 53440 2 516 . 2 . 2 82 82 GLU CA C 13 57.2222 0.0000 . 1 . . 45974 . . 81 GLU CA . 53440 2 517 . 2 . 2 82 82 GLU CB C 13 27.5941 0.0000 . 1 . . 45980 . . 81 GLU CB . 53440 2 518 . 2 . 2 82 82 GLU N N 15 113.3750 0.0000 . 1 . . 25462 . . 81 GLU N . 53440 2 519 . 2 . 2 83 83 ASP H H 1 8.3749 0.0000 . 1 . . 23369 . . 82 ASP H . 53440 2 520 . 2 . 2 83 83 ASP C C 13 177.5145 0.0000 . 1 . . 39947 . . 82 ASP C . 53440 2 521 . 2 . 2 83 83 ASP CA C 13 54.5543 0.0000 . 1 . . 39949 . . 82 ASP CA . 53440 2 522 . 2 . 2 83 83 ASP CB C 13 40.6390 0.0000 . 1 . . 39950 . . 82 ASP CB . 53440 2 523 . 2 . 2 83 83 ASP N N 15 121.7721 0.0000 . 1 . . 23371 . . 82 ASP N . 53440 2 524 . 2 . 2 84 84 PHE H H 1 7.0783 0.0000 . 1 . . 21530 . . 83 PHE H . 53440 2 525 . 2 . 2 84 84 PHE C C 13 174.0714 0.0000 . 1 . . 39904 . . 83 PHE C . 53440 2 526 . 2 . 2 84 84 PHE CA C 13 59.8183 0.0000 . 1 . . 39902 . . 83 PHE CA . 53440 2 527 . 2 . 2 84 84 PHE CB C 13 37.4574 0.0000 . 1 . . 39906 . . 83 PHE CB . 53440 2 528 . 2 . 2 84 84 PHE N N 15 121.8263 0.0000 . 1 . . 21532 . . 83 PHE N . 53440 2 529 . 2 . 2 85 85 ALA H H 1 7.7294 0.0000 . 1 . . 23894 . . 84 ALA H . 53440 2 530 . 2 . 2 85 85 ALA HB1 H 1 0.9330 0.0000 . 1 . . 54767 . . 84 ALA HB1 . 53440 2 531 . 2 . 2 85 85 ALA HB2 H 1 0.9330 0.0000 . 1 . . 54767 . . 84 ALA HB1 . 53440 2 532 . 2 . 2 85 85 ALA HB3 H 1 0.9330 0.0000 . 1 . . 54767 . . 84 ALA HB1 . 53440 2 533 . 2 . 2 85 85 ALA C C 13 175.0068 0.0000 . 1 . . 35207 . . 84 ALA C . 53440 2 534 . 2 . 2 85 85 ALA CA C 13 51.2283 0.0000 . 1 . . 35206 . . 84 ALA CA . 53440 2 535 . 2 . 2 85 85 ALA CB C 13 19.9900 0.0000 . 1 . . 35210 . . 84 ALA CB . 53440 2 536 . 2 . 2 85 85 ALA N N 15 126.9131 0.0000 . 1 . . 23896 . . 84 ALA N . 53440 2 537 . 2 . 2 86 86 THR H H 1 7.8895 0.0000 . 1 . . 23144 . . 85 THR H . 53440 2 538 . 2 . 2 86 86 THR HG21 H 1 0.6760 0.0000 . 1 . . 54749 . . 85 THR HG21 . 53440 2 539 . 2 . 2 86 86 THR HG22 H 1 0.6760 0.0000 . 1 . . 54749 . . 85 THR HG21 . 53440 2 540 . 2 . 2 86 86 THR HG23 H 1 0.6760 0.0000 . 1 . . 54749 . . 85 THR HG21 . 53440 2 541 . 2 . 2 86 86 THR C C 13 173.0534 0.0000 . 1 . . 44979 . . 85 THR C . 53440 2 542 . 2 . 2 86 86 THR CA C 13 61.9600 0.0000 . 1 . . 44980 . . 85 THR CA . 53440 2 543 . 2 . 2 86 86 THR CB C 13 68.6961 0.0000 . 1 . . 44982 . . 85 THR CB . 53440 2 544 . 2 . 2 86 86 THR CG2 C 13 20.6720 0.0000 . 1 . . 51161 . . 85 THR CG2 . 53440 2 545 . 2 . 2 86 86 THR N N 15 114.7197 0.0000 . 1 . . 23146 . . 85 THR N . 53440 2 546 . 2 . 2 87 87 TYR H H 1 8.8082 0.0000 . 1 . . 23300 . . 86 TYR H . 53440 2 547 . 2 . 2 87 87 TYR C C 13 176.8288 0.0000 . 1 . . 36255 . . 86 TYR C . 53440 2 548 . 2 . 2 87 87 TYR CA C 13 56.5603 0.0000 . 1 . . 36256 . . 86 TYR CA . 53440 2 549 . 2 . 2 87 87 TYR CB C 13 41.1651 0.0000 . 1 . . 36257 . . 86 TYR CB . 53440 2 550 . 2 . 2 87 87 TYR N N 15 125.3199 0.0000 . 1 . . 23302 . . 86 TYR N . 53440 2 551 . 2 . 2 88 88 TYR H H 1 9.4673 0.0000 . 1 . . 20888 . . 87 TYR H . 53440 2 552 . 2 . 2 88 88 TYR C C 13 175.5037 0.0000 . 1 . . 40638 . . 87 TYR C . 53440 2 553 . 2 . 2 88 88 TYR CA C 13 57.5332 0.0000 . 1 . . 40640 . . 87 TYR CA . 53440 2 554 . 2 . 2 88 88 TYR CB C 13 43.9092 0.0000 . 1 . . 40641 . . 87 TYR CB . 53440 2 555 . 2 . 2 88 88 TYR N N 15 120.9682 0.0000 . 1 . . 20890 . . 87 TYR N . 53440 2 556 . 2 . 2 89 89 CYS H H 1 7.6910 0.0000 . 1 . . 23066 . . 88 CYS H . 53440 2 557 . 2 . 2 89 89 CYS C C 13 173.4590 0.0000 . 1 . . 43608 . . 88 CYS C . 53440 2 558 . 2 . 2 89 89 CYS CA C 13 52.6754 0.0000 . 1 . . 43610 . . 88 CYS CA . 53440 2 559 . 2 . 2 89 89 CYS CB C 13 44.0736 0.0000 . 1 . . 43611 . . 88 CYS CB . 53440 2 560 . 2 . 2 89 89 CYS N N 15 116.8321 0.0000 . 1 . . 23068 . . 88 CYS N . 53440 2 561 . 2 . 2 90 90 GLN H H 1 8.5504 0.0000 . 1 . . 19622 . . 89 GLN H . 53440 2 562 . 2 . 2 90 90 GLN C C 13 173.9652 0.0000 . 1 . . 39666 . . 89 GLN C . 53440 2 563 . 2 . 2 90 90 GLN CA C 13 54.3319 0.0000 . 1 . . 39664 . . 89 GLN CA . 53440 2 564 . 2 . 2 90 90 GLN CB C 13 31.9376 0.0000 . 1 . . 39671 . . 89 GLN CB . 53440 2 565 . 2 . 2 90 90 GLN N N 15 122.0552 0.0000 . 1 . . 19624 . . 89 GLN N . 53440 2 566 . 2 . 2 91 91 GLN H H 1 8.3126 0.0000 . 1 . . 22577 . . 90 GLN H . 53440 2 567 . 2 . 2 91 91 GLN C C 13 176.1842 0.0000 . 1 . . 35875 . . 90 GLN C . 53440 2 568 . 2 . 2 91 91 GLN CA C 13 52.6530 0.0000 . 1 . . 35877 . . 90 GLN CA . 53440 2 569 . 2 . 2 91 91 GLN CB C 13 28.8391 0.0000 . 1 . . 35878 . . 90 GLN CB . 53440 2 570 . 2 . 2 91 91 GLN N N 15 125.9597 0.0000 . 1 . . 22579 . . 90 GLN N . 53440 2 571 . 2 . 2 92 92 TYR H H 1 7.7491 0.0000 . 1 . . 24278 . . 91 TYR H . 53440 2 572 . 2 . 2 92 92 TYR C C 13 173.2203 0.0000 . 1 . . 60991 . . 91 TYR C . 53440 2 573 . 2 . 2 92 92 TYR CA C 13 55.4893 0.0000 . 1 . . 41764 . . 91 TYR CA . 53440 2 574 . 2 . 2 92 92 TYR CB C 13 34.8948 0.0000 . 1 . . 41767 . . 91 TYR CB . 53440 2 575 . 2 . 2 92 92 TYR N N 15 119.3657 0.0000 . 1 . . 24280 . . 91 TYR N . 53440 2 576 . 2 . 2 93 93 SER C C 13 176.3443 0.0000 . 1 . . 46566 . . 92 SER C . 53440 2 577 . 2 . 2 93 93 SER CA C 13 59.7211 0.0000 . 1 . . 46567 . . 92 SER CA . 53440 2 578 . 2 . 2 93 93 SER CB C 13 63.7021 0.0000 . 1 . . 46573 . . 92 SER CB . 53440 2 579 . 2 . 2 94 94 THR H H 1 8.2576 0.0000 . 1 . . 25472 . . 93 THR H . 53440 2 580 . 2 . 2 94 94 THR C C 13 171.9843 0.0000 . 1 . . 60999 . . 93 THR C . 53440 2 581 . 2 . 2 94 94 THR CA C 13 60.6301 0.0000 . 1 . . 46568 . . 93 THR CA . 53440 2 582 . 2 . 2 94 94 THR CB C 13 71.4309 0.0000 . 1 . . 61003 . . 93 THR CB . 53440 2 583 . 2 . 2 94 94 THR N N 15 112.7555 0.0000 . 1 . . 25474 . . 93 THR N . 53440 2 584 . 2 . 2 95 95 VAL H H 1 7.8840 0.0000 . 1 . . 23330 . . 94 VAL H . 53440 2 585 . 2 . 2 95 95 VAL HG11 H 1 1.2620 0.0000 . 2 . . . . . 94 VAL HG11 . 53440 2 586 . 2 . 2 95 95 VAL HG12 H 1 1.2620 0.0000 . 2 . . . . . 94 VAL HG11 . 53440 2 587 . 2 . 2 95 95 VAL HG13 H 1 1.2620 0.0000 . 2 . . . . . 94 VAL HG11 . 53440 2 588 . 2 . 2 95 95 VAL HG21 H 1 1.2690 0.0000 . 2 . . . . . 94 VAL HG21 . 53440 2 589 . 2 . 2 95 95 VAL HG22 H 1 1.2690 0.0000 . 2 . . . . . 94 VAL HG21 . 53440 2 590 . 2 . 2 95 95 VAL HG23 H 1 1.2690 0.0000 . 2 . . . . . 94 VAL HG21 . 53440 2 591 . 2 . 2 95 95 VAL C C 13 174.9729 0.0000 . 1 . . 37999 . . 94 VAL C . 53440 2 592 . 2 . 2 95 95 VAL CB C 13 31.2061 0.0000 . 1 . . 38001 . . 94 VAL CB . 53440 2 593 . 2 . 2 95 95 VAL CG1 C 13 20.5160 0.0000 . 2 . . . . . 94 VAL CG1 . 53440 2 594 . 2 . 2 95 95 VAL CG2 C 13 20.5040 0.0000 . 2 . . . . . 94 VAL CG2 . 53440 2 595 . 2 . 2 95 95 VAL N N 15 123.4965 0.0000 . 1 . . 23332 . . 94 VAL N . 53440 2 596 . 2 . 2 97 97 TRP C C 13 175.8777 0.0000 . 1 . . 47605 . . 96 TRP C . 53440 2 597 . 2 . 2 97 97 TRP CA C 13 55.5360 0.0000 . 1 . . 47606 . . 96 TRP CA . 53440 2 598 . 2 . 2 97 97 TRP CB C 13 29.9046 0.0000 . 1 . . 47616 . . 96 TRP CB . 53440 2 599 . 2 . 2 98 98 THR H H 1 7.0143 0.0000 . 1 . . 23546 . . 97 THR H . 53440 2 600 . 2 . 2 98 98 THR HG21 H 1 1.5220 0.0000 . 1 . . 54437 . . 97 THR HG21 . 53440 2 601 . 2 . 2 98 98 THR HG22 H 1 1.5220 0.0000 . 1 . . 54437 . . 97 THR HG21 . 53440 2 602 . 2 . 2 98 98 THR HG23 H 1 1.5220 0.0000 . 1 . . 54437 . . 97 THR HG21 . 53440 2 603 . 2 . 2 98 98 THR C C 13 173.0206 0.0000 . 1 . . 47610 . . 97 THR C . 53440 2 604 . 2 . 2 98 98 THR CA C 13 59.1436 0.0000 . 1 . . 47612 . . 97 THR CA . 53440 2 605 . 2 . 2 98 98 THR CB C 13 72.7547 0.0000 . 1 . . 47613 . . 97 THR CB . 53440 2 606 . 2 . 2 98 98 THR CG2 C 13 23.1780 0.0000 . 1 . . 50909 . . 97 THR CG2 . 53440 2 607 . 2 . 2 98 98 THR N N 15 110.7554 0.0000 . 1 . . 23548 . . 97 THR N . 53440 2 608 . 2 . 2 99 99 PHE H H 1 9.0221 0.0000 . 1 . . 23408 . . 98 PHE H . 53440 2 609 . 2 . 2 99 99 PHE C C 13 178.3597 0.0000 . 1 . . 41853 . . 98 PHE C . 53440 2 610 . 2 . 2 99 99 PHE CA C 13 56.0536 0.0000 . 1 . . 41856 . . 98 PHE CA . 53440 2 611 . 2 . 2 99 99 PHE CB C 13 43.2812 0.0000 . 1 . . 41857 . . 98 PHE CB . 53440 2 612 . 2 . 2 99 99 PHE N N 15 118.9958 0.0000 . 1 . . 23410 . . 98 PHE N . 53440 2 613 . 2 . 2 100 100 GLY H H 1 8.8191 0.0000 . 1 . . 25547 . . 99 GLY H . 53440 2 614 . 2 . 2 100 100 GLY C C 13 173.7101 0.0000 . 1 . . 48276 . . 99 GLY C . 53440 2 615 . 2 . 2 100 100 GLY CA C 13 44.6122 0.0000 . 1 . . 48275 . . 99 GLY CA . 53440 2 616 . 2 . 2 100 100 GLY N N 15 107.9037 0.0000 . 1 . . 25549 . . 99 GLY N . 53440 2 617 . 2 . 2 101 101 GLN H H 1 8.7615 0.0000 . 1 . . 26372 . . 100 GLN H . 53440 2 618 . 2 . 2 101 101 GLN C C 13 176.3964 0.0000 . 1 . . 43165 . . 100 GLN C . 53440 2 619 . 2 . 2 101 101 GLN CA C 13 57.3292 0.0000 . 1 . . 43169 . . 100 GLN CA . 53440 2 620 . 2 . 2 101 101 GLN CB C 13 27.1607 0.0000 . 1 . . 43168 . . 100 GLN CB . 53440 2 621 . 2 . 2 101 101 GLN N N 15 117.4069 0.0000 . 1 . . 26374 . . 100 GLN N . 53440 2 622 . 2 . 2 102 102 GLY H H 1 6.9381 0.0000 . 1 . . 26753 . . 101 GLY H . 53440 2 623 . 2 . 2 102 102 GLY C C 13 172.3632 0.0000 . 1 . . 48327 . . 101 GLY C . 53440 2 624 . 2 . 2 102 102 GLY CA C 13 44.6216 0.0000 . 1 . . 48326 . . 101 GLY CA . 53440 2 625 . 2 . 2 102 102 GLY N N 15 107.6881 0.0000 . 1 . . 26755 . . 101 GLY N . 53440 2 626 . 2 . 2 103 103 THR H H 1 7.9510 0.0000 . 1 . . 19820 . . 102 THR H . 53440 2 627 . 2 . 2 103 103 THR HG21 H 1 1.0390 0.0000 . 1 . . 54689 . . 102 THR HG21 . 53440 2 628 . 2 . 2 103 103 THR HG22 H 1 1.0390 0.0000 . 1 . . 54689 . . 102 THR HG21 . 53440 2 629 . 2 . 2 103 103 THR HG23 H 1 1.0390 0.0000 . 1 . . 54689 . . 102 THR HG21 . 53440 2 630 . 2 . 2 103 103 THR C C 13 173.9074 0.0000 . 1 . . 42456 . . 102 THR C . 53440 2 631 . 2 . 2 103 103 THR CA C 13 61.8098 0.0000 . 1 . . 42458 . . 102 THR CA . 53440 2 632 . 2 . 2 103 103 THR CB C 13 72.4718 0.0000 . 1 . . 42460 . . 102 THR CB . 53440 2 633 . 2 . 2 103 103 THR CG2 C 13 20.8870 0.0000 . 1 . . 51062 . . 102 THR CG2 . 53440 2 634 . 2 . 2 103 103 THR N N 15 118.5198 0.0000 . 1 . . 19822 . . 102 THR N . 53440 2 635 . 2 . 2 104 104 LYS H H 1 8.3320 0.0000 . 1 . . 22394 . . 103 LYS H . 53440 2 636 . 2 . 2 104 104 LYS C C 13 174.5647 0.0000 . 1 . . 33612 . . 103 LYS C . 53440 2 637 . 2 . 2 104 104 LYS CA C 13 56.2305 0.0000 . 1 . . 33615 . . 103 LYS CA . 53440 2 638 . 2 . 2 104 104 LYS CB C 13 33.1999 0.0000 . 1 . . 33617 . . 103 LYS CB . 53440 2 639 . 2 . 2 104 104 LYS N N 15 130.9946 0.0000 . 1 . . 22396 . . 103 LYS N . 53440 2 640 . 2 . 2 105 105 VAL H H 1 8.6384 0.0000 . 1 . . 24698 . . 104 VAL H . 53440 2 641 . 2 . 2 105 105 VAL HG11 H 1 0.9270 0.0000 . 2 . . . . . 104 VAL HG11 . 53440 2 642 . 2 . 2 105 105 VAL HG12 H 1 0.9270 0.0000 . 2 . . . . . 104 VAL HG11 . 53440 2 643 . 2 . 2 105 105 VAL HG13 H 1 0.9270 0.0000 . 2 . . . . . 104 VAL HG11 . 53440 2 644 . 2 . 2 105 105 VAL HG21 H 1 0.8830 0.0000 . 2 . . . . . 104 VAL HG21 . 53440 2 645 . 2 . 2 105 105 VAL HG22 H 1 0.8830 0.0000 . 2 . . . . . 104 VAL HG21 . 53440 2 646 . 2 . 2 105 105 VAL HG23 H 1 0.8830 0.0000 . 2 . . . . . 104 VAL HG21 . 53440 2 647 . 2 . 2 105 105 VAL CA C 13 61.9411 0.0000 . 1 . . 34019 . . 104 VAL CA . 53440 2 648 . 2 . 2 105 105 VAL CG1 C 13 20.7930 0.0000 . 2 . . . . . 104 VAL CG1 . 53440 2 649 . 2 . 2 105 105 VAL CG2 C 13 21.3310 0.0000 . 2 . . . . . 104 VAL CG2 . 53440 2 650 . 2 . 2 105 105 VAL N N 15 128.6810 0.0000 . 1 . . 24700 . . 104 VAL N . 53440 2 651 . 2 . 2 106 106 GLU H H 1 8.9754 0.0000 . 1 . . 20387 . . 105 GLU H . 53440 2 652 . 2 . 2 106 106 GLU C C 13 174.1965 0.0000 . 1 . . 59530 . . 105 GLU C . 53440 2 653 . 2 . 2 106 106 GLU CA C 13 54.3867 0.0000 . 1 . . 34537 . . 105 GLU CA . 53440 2 654 . 2 . 2 106 106 GLU CB C 13 32.3579 0.0000 . 1 . . 34545 . . 105 GLU CB . 53440 2 655 . 2 . 2 106 106 GLU N N 15 127.6213 0.0000 . 1 . . 20389 . . 105 GLU N . 53440 2 656 . 2 . 2 107 107 ILE HD11 H 1 0.5530 0.0000 . 1 . . . . . 106 ILE HD11 . 53440 2 657 . 2 . 2 107 107 ILE HD12 H 1 0.5530 0.0000 . 1 . . . . . 106 ILE HD11 . 53440 2 658 . 2 . 2 107 107 ILE HD13 H 1 0.5530 0.0000 . 1 . . . . . 106 ILE HD11 . 53440 2 659 . 2 . 2 107 107 ILE C C 13 176.6446 0.0000 . 1 . . 33675 . . 106 ILE C . 53440 2 660 . 2 . 2 107 107 ILE CA C 13 59.6342 0.0000 . 1 . . 56730 . . 106 ILE CA . 53440 2 661 . 2 . 2 107 107 ILE CB C 13 37.3077 0.0000 . 1 . . 33684 . . 106 ILE CB . 53440 2 662 . 2 . 2 107 107 ILE CD1 C 13 11.6960 0.0000 . 1 . . . . . 106 ILE CD1 . 53440 2 663 . 2 . 2 108 108 LYS H H 1 8.2346 0.0000 . 1 . . 23270 . . 107 LYS H . 53440 2 664 . 2 . 2 108 108 LYS C C 13 174.6314 0.0000 . 1 . . 33680 . . 107 LYS C . 53440 2 665 . 2 . 2 108 108 LYS CA C 13 54.9336 0.0000 . 1 . . 33678 . . 107 LYS CA . 53440 2 666 . 2 . 2 108 108 LYS CB C 13 32.4135 0.0000 . 1 . . 33682 . . 107 LYS CB . 53440 2 667 . 2 . 2 108 108 LYS N N 15 128.6500 0.0000 . 1 . . 23272 . . 107 LYS N . 53440 2 668 . 2 . 2 109 109 ARG H H 1 5.9919 0.0000 . 1 . . 25175 . . 108 ARG H . 53440 2 669 . 2 . 2 109 109 ARG C C 13 174.0979 0.0000 . 1 . . 41558 . . 108 ARG C . 53440 2 670 . 2 . 2 109 109 ARG CA C 13 54.2226 0.0000 . 1 . . 41556 . . 108 ARG CA . 53440 2 671 . 2 . 2 109 109 ARG CB C 13 29.3235 0.0000 . 1 . . 41560 . . 108 ARG CB . 53440 2 672 . 2 . 2 109 109 ARG N N 15 119.9462 0.0000 . 1 . . 25177 . . 108 ARG N . 53440 2 673 . 2 . 2 110 110 THR H H 1 7.5815 0.0000 . 1 . . 26714 . . 109 THR H . 53440 2 674 . 2 . 2 110 110 THR HG21 H 1 1.2830 0.0000 . 1 . . . . . 109 THR HG21 . 53440 2 675 . 2 . 2 110 110 THR HG22 H 1 1.2830 0.0000 . 1 . . . . . 109 THR HG21 . 53440 2 676 . 2 . 2 110 110 THR HG23 H 1 1.2830 0.0000 . 1 . . . . . 109 THR HG21 . 53440 2 677 . 2 . 2 110 110 THR C C 13 175.5840 0.0000 . 1 . . 47984 . . 109 THR C . 53440 2 678 . 2 . 2 110 110 THR CA C 13 61.7814 0.0000 . 1 . . 47986 . . 109 THR CA . 53440 2 679 . 2 . 2 110 110 THR CB C 13 69.8835 0.0000 . 1 . . 47988 . . 109 THR CB . 53440 2 680 . 2 . 2 110 110 THR CG2 C 13 21.7670 0.0000 . 1 . . 50966 . . 109 THR CG2 . 53440 2 681 . 2 . 2 110 110 THR N N 15 109.2745 0.0000 . 1 . . 26716 . . 109 THR N . 53440 2 682 . 2 . 2 111 111 VAL H H 1 8.2939 0.0000 . 1 . . 26006 . . 110 VAL H . 53440 2 683 . 2 . 2 111 111 VAL HG11 H 1 1.2230 0.0000 . 2 . . . . . 110 VAL HG11 . 53440 2 684 . 2 . 2 111 111 VAL HG12 H 1 1.2230 0.0000 . 2 . . . . . 110 VAL HG11 . 53440 2 685 . 2 . 2 111 111 VAL HG13 H 1 1.2230 0.0000 . 2 . . . . . 110 VAL HG11 . 53440 2 686 . 2 . 2 111 111 VAL HG21 H 1 1.1090 0.0000 . 2 . . . . . 110 VAL HG21 . 53440 2 687 . 2 . 2 111 111 VAL HG22 H 1 1.1090 0.0000 . 2 . . . . . 110 VAL HG21 . 53440 2 688 . 2 . 2 111 111 VAL HG23 H 1 1.1090 0.0000 . 2 . . . . . 110 VAL HG21 . 53440 2 689 . 2 . 2 111 111 VAL C C 13 175.3460 0.0000 . 1 . . 38254 . . 110 VAL C . 53440 2 690 . 2 . 2 111 111 VAL CA C 13 63.6757 0.0000 . 1 . . 38256 . . 110 VAL CA . 53440 2 691 . 2 . 2 111 111 VAL CB C 13 31.3674 0.0000 . 1 . . 38257 . . 110 VAL CB . 53440 2 692 . 2 . 2 111 111 VAL CG1 C 13 22.5330 0.0000 . 2 . . . . . 110 VAL CG1 . 53440 2 693 . 2 . 2 111 111 VAL CG2 C 13 20.9430 0.0000 . 2 . . . . . 110 VAL CG2 . 53440 2 694 . 2 . 2 111 111 VAL N N 15 122.7231 0.0000 . 1 . . 26008 . . 110 VAL N . 53440 2 695 . 2 . 2 112 112 ALA H H 1 9.5385 0.0000 . 1 . . 25568 . . 111 ALA H . 53440 2 696 . 2 . 2 112 112 ALA HB1 H 1 1.0730 0.0000 . 1 . . 54479 . . 111 ALA HB1 . 53440 2 697 . 2 . 2 112 112 ALA HB2 H 1 1.0730 0.0000 . 1 . . 54479 . . 111 ALA HB1 . 53440 2 698 . 2 . 2 112 112 ALA HB3 H 1 1.0730 0.0000 . 1 . . 54479 . . 111 ALA HB1 . 53440 2 699 . 2 . 2 112 112 ALA C C 13 175.7968 0.0000 . 1 . . 33916 . . 111 ALA C . 53440 2 700 . 2 . 2 112 112 ALA CA C 13 51.0854 0.0000 . 1 . . 33915 . . 111 ALA CA . 53440 2 701 . 2 . 2 112 112 ALA CB C 13 20.1392 0.0000 . 1 . . 33920 . . 111 ALA CB . 53440 2 702 . 2 . 2 112 112 ALA N N 15 131.5121 0.0000 . 1 . . 25570 . . 111 ALA N . 53440 2 703 . 2 . 2 113 113 ALA H H 1 8.7111 0.0000 . 1 . . 25757 . . 112 ALA H . 53440 2 704 . 2 . 2 113 113 ALA C C 13 174.7586 0.0000 . 1 . . 35751 . . 112 ALA C . 53440 2 705 . 2 . 2 113 113 ALA CA C 13 49.5352 0.0000 . 1 . . 35752 . . 112 ALA CA . 53440 2 706 . 2 . 2 113 113 ALA CB C 13 16.9987 0.0000 . 1 . . 35767 . . 112 ALA CB . 53440 2 707 . 2 . 2 113 113 ALA N N 15 125.8535 0.0000 . 1 . . 25759 . . 112 ALA N . 53440 2 708 . 2 . 2 114 114 PRO C C 13 177.0848 0.0000 . 1 . . 43315 . . 113 PRO C . 53440 2 709 . 2 . 2 114 114 PRO CA C 13 61.9033 0.0000 . 1 . . 43316 . . 113 PRO CA . 53440 2 710 . 2 . 2 114 114 PRO CB C 13 30.3848 0.0000 . 1 . . 43326 . . 113 PRO CB . 53440 2 711 . 2 . 2 115 115 SER H H 1 7.8448 0.0000 . 1 . . 23036 . . 114 SER H . 53440 2 712 . 2 . 2 115 115 SER C C 13 173.5559 0.0000 . 1 . . 43320 . . 114 SER C . 53440 2 713 . 2 . 2 115 115 SER CA C 13 57.9524 0.0000 . 1 . . 43322 . . 114 SER CA . 53440 2 714 . 2 . 2 115 115 SER CB C 13 63.7893 0.0000 . 1 . . 43323 . . 114 SER CB . 53440 2 715 . 2 . 2 115 115 SER N N 15 117.1666 0.0000 . 1 . . 23038 . . 114 SER N . 53440 2 716 . 2 . 2 116 116 VAL H H 1 8.0467 0.0000 . 1 . . 22604 . . 115 VAL H . 53440 2 717 . 2 . 2 116 116 VAL HG11 H 1 0.6020 0.0000 . 2 . . . . . 115 VAL HG11 . 53440 2 718 . 2 . 2 116 116 VAL HG12 H 1 0.6020 0.0000 . 2 . . . . . 115 VAL HG11 . 53440 2 719 . 2 . 2 116 116 VAL HG13 H 1 0.6020 0.0000 . 2 . . . . . 115 VAL HG11 . 53440 2 720 . 2 . 2 116 116 VAL HG21 H 1 0.5490 0.0000 . 2 . . . . . 115 VAL HG21 . 53440 2 721 . 2 . 2 116 116 VAL HG22 H 1 0.5490 0.0000 . 2 . . . . . 115 VAL HG21 . 53440 2 722 . 2 . 2 116 116 VAL HG23 H 1 0.5490 0.0000 . 2 . . . . . 115 VAL HG21 . 53440 2 723 . 2 . 2 116 116 VAL C C 13 174.1757 0.0000 . 1 . . 36177 . . 115 VAL C . 53440 2 724 . 2 . 2 116 116 VAL CA C 13 60.9107 0.0000 . 1 . . 36179 . . 115 VAL CA . 53440 2 725 . 2 . 2 116 116 VAL CB C 13 32.8562 0.0000 . 1 . . 36181 . . 115 VAL CB . 53440 2 726 . 2 . 2 116 116 VAL CG1 C 13 21.1690 0.0000 . 2 . . . . . 115 VAL CG1 . 53440 2 727 . 2 . 2 116 116 VAL CG2 C 13 20.9710 0.0000 . 2 . . . . . 115 VAL CG2 . 53440 2 728 . 2 . 2 116 116 VAL N N 15 125.3477 0.0000 . 1 . . 22606 . . 115 VAL N . 53440 2 729 . 2 . 2 117 117 PHE H H 1 9.0362 0.0000 . 1 . . 19400 . . 116 PHE H . 53440 2 730 . 2 . 2 117 117 PHE C C 13 172.7530 0.0000 . 1 . . 36117 . . 116 PHE C . 53440 2 731 . 2 . 2 117 117 PHE CA C 13 55.3784 0.0000 . 1 . . 36120 . . 116 PHE CA . 53440 2 732 . 2 . 2 117 117 PHE CB C 13 42.4193 0.0000 . 1 . . 36118 . . 116 PHE CB . 53440 2 733 . 2 . 2 117 117 PHE N N 15 125.2462 0.0000 . 1 . . 19402 . . 116 PHE N . 53440 2 734 . 2 . 2 118 118 ILE H H 1 8.0814 0.0000 . 1 . . 19721 . . 117 ILE H . 53440 2 735 . 2 . 2 118 118 ILE HG21 H 1 0.9090 0.0000 . 1 . . . . . 117 ILE HG21 . 53440 2 736 . 2 . 2 118 118 ILE HG22 H 1 0.9090 0.0000 . 1 . . . . . 117 ILE HG21 . 53440 2 737 . 2 . 2 118 118 ILE HG23 H 1 0.9090 0.0000 . 1 . . . . . 117 ILE HG21 . 53440 2 738 . 2 . 2 118 118 ILE HD11 H 1 1.0930 0.0000 . 1 . . . . . 117 ILE HD11 . 53440 2 739 . 2 . 2 118 118 ILE HD12 H 1 1.0930 0.0000 . 1 . . . . . 117 ILE HD11 . 53440 2 740 . 2 . 2 118 118 ILE HD13 H 1 1.0930 0.0000 . 1 . . . . . 117 ILE HD11 . 53440 2 741 . 2 . 2 118 118 ILE C C 13 172.3528 0.0000 . 1 . . 41412 . . 117 ILE C . 53440 2 742 . 2 . 2 118 118 ILE CA C 13 58.5341 0.0000 . 1 . . 41418 . . 117 ILE CA . 53440 2 743 . 2 . 2 118 118 ILE CB C 13 42.0577 0.0000 . 1 . . 41419 . . 117 ILE CB . 53440 2 744 . 2 . 2 118 118 ILE CG2 C 13 15.9080 0.0000 . 1 . . . . . 117 ILE CG2 . 53440 2 745 . 2 . 2 118 118 ILE CD1 C 13 14.9700 0.0000 . 1 . . . . . 117 ILE CD1 . 53440 2 746 . 2 . 2 118 118 ILE N N 15 120.1902 0.0000 . 1 . . 19723 . . 117 ILE N . 53440 2 747 . 2 . 2 119 119 PHE H H 1 9.1213 0.0000 . 1 . . 22655 . . 118 PHE H . 53440 2 748 . 2 . 2 119 119 PHE C C 13 173.0760 0.0000 . 1 . . 37148 . . 118 PHE C . 53440 2 749 . 2 . 2 119 119 PHE CA C 13 53.9172 0.0000 . 1 . . 37151 . . 118 PHE CA . 53440 2 750 . 2 . 2 119 119 PHE CB C 13 41.3986 0.0000 . 1 . . 37152 . . 118 PHE CB . 53440 2 751 . 2 . 2 119 119 PHE N N 15 124.3667 0.0000 . 1 . . 22657 . . 118 PHE N . 53440 2 752 . 2 . 2 121 121 PRO C C 13 176.6552 0.0000 . 1 . . 41739 . . 120 PRO C . 53440 2 753 . 2 . 2 121 121 PRO CA C 13 61.9563 0.0000 . 1 . . 41740 . . 120 PRO CA . 53440 2 754 . 2 . 2 121 121 PRO CB C 13 30.5796 0.0000 . 1 . . 41749 . . 120 PRO CB . 53440 2 755 . 2 . 2 122 122 SER H H 1 9.3747 0.0000 . 1 . . 23393 . . 121 SER H . 53440 2 756 . 2 . 2 122 122 SER C C 13 175.1689 0.0000 . 1 . . 41743 . . 121 SER C . 53440 2 757 . 2 . 2 122 122 SER CA C 13 57.3477 0.0000 . 1 . . 41750 . . 121 SER CA . 53440 2 758 . 2 . 2 122 122 SER CB C 13 65.5210 0.0000 . 1 . . 41744 . . 121 SER CB . 53440 2 759 . 2 . 2 122 122 SER N N 15 119.2641 0.0000 . 1 . . 23395 . . 121 SER N . 53440 2 760 . 2 . 2 123 123 ASP H H 1 8.8431 0.0000 . 1 . . 22661 . . 122 ASP H . 53440 2 761 . 2 . 2 123 123 ASP C C 13 179.2521 0.0000 . 1 . . 37419 . . 122 ASP C . 53440 2 762 . 2 . 2 123 123 ASP CA C 13 57.3238 0.0000 . 1 . . 41843 . . 122 ASP CA . 53440 2 763 . 2 . 2 123 123 ASP CB C 13 39.9368 0.0000 . 1 . . 37422 . . 122 ASP CB . 53440 2 764 . 2 . 2 123 123 ASP N N 15 124.0537 0.0000 . 1 . . 22663 . . 122 ASP N . 53440 2 765 . 2 . 2 124 124 GLU H H 1 8.8955 0.0000 . 1 . . 19772 . . 123 GLU H . 53440 2 766 . 2 . 2 124 124 GLU C C 13 178.7905 0.0000 . 1 . . 41837 . . 123 GLU C . 53440 2 767 . 2 . 2 124 124 GLU CA C 13 59.2937 0.0000 . 1 . . 41834 . . 123 GLU CA . 53440 2 768 . 2 . 2 124 124 GLU CB C 13 28.9789 0.0000 . 1 . . 41839 . . 123 GLU CB . 53440 2 769 . 2 . 2 124 124 GLU N N 15 118.9246 0.0000 . 1 . . 19774 . . 123 GLU N . 53440 2 770 . 2 . 2 125 125 GLN H H 1 7.6506 0.0000 . 1 . . 22850 . . 124 GLN H . 53440 2 771 . 2 . 2 125 125 GLN C C 13 179.6980 0.0000 . 1 . . 40441 . . 124 GLN C . 53440 2 772 . 2 . 2 125 125 GLN CA C 13 58.5732 0.0000 . 1 . . 40439 . . 124 GLN CA . 53440 2 773 . 2 . 2 125 125 GLN CB C 13 25.5376 0.0000 . 1 . . 40444 . . 124 GLN CB . 53440 2 774 . 2 . 2 125 125 GLN N N 15 121.2984 0.0000 . 1 . . 22852 . . 124 GLN N . 53440 2 775 . 2 . 2 126 126 LEU H H 1 7.7985 0.0000 . 1 . . 20846 . . 125 LEU H . 53440 2 776 . 2 . 2 126 126 LEU HD11 H 1 0.6320 0.0000 . 2 . . . . . 125 LEU HD11 . 53440 2 777 . 2 . 2 126 126 LEU HD12 H 1 0.6320 0.0000 . 2 . . . . . 125 LEU HD11 . 53440 2 778 . 2 . 2 126 126 LEU HD13 H 1 0.6320 0.0000 . 2 . . . . . 125 LEU HD11 . 53440 2 779 . 2 . 2 126 126 LEU HD21 H 1 0.8950 0.0000 . 2 . . . . . 125 LEU HD21 . 53440 2 780 . 2 . 2 126 126 LEU HD22 H 1 0.8950 0.0000 . 2 . . . . . 125 LEU HD21 . 53440 2 781 . 2 . 2 126 126 LEU HD23 H 1 0.8950 0.0000 . 2 . . . . . 125 LEU HD21 . 53440 2 782 . 2 . 2 126 126 LEU C C 13 180.2320 0.0000 . 1 . . 39785 . . 125 LEU C . 53440 2 783 . 2 . 2 126 126 LEU CA C 13 57.8406 0.0000 . 1 . . 39784 . . 125 LEU CA . 53440 2 784 . 2 . 2 126 126 LEU CB C 13 40.5916 0.0000 . 1 . . 39788 . . 125 LEU CB . 53440 2 785 . 2 . 2 126 126 LEU CD1 C 13 23.4640 0.0000 . 2 . . . . . 125 LEU CD1 . 53440 2 786 . 2 . 2 126 126 LEU CD2 C 13 25.3300 0.0000 . 2 . . . . . 125 LEU CD2 . 53440 2 787 . 2 . 2 126 126 LEU N N 15 121.7464 0.0000 . 1 . . 20848 . . 125 LEU N . 53440 2 788 . 2 . 2 127 127 LYS H H 1 7.6184 0.0000 . 1 . . 22976 . . 126 LYS H . 53440 2 789 . 2 . 2 127 127 LYS C C 13 177.8990 0.0000 . 1 . . 42506 . . 126 LYS C . 53440 2 790 . 2 . 2 127 127 LYS CA C 13 58.6953 0.0000 . 1 . . 42503 . . 126 LYS CA . 53440 2 791 . 2 . 2 127 127 LYS CB C 13 31.6210 0.0000 . 1 . . 42508 . . 126 LYS CB . 53440 2 792 . 2 . 2 127 127 LYS N N 15 118.1731 0.0000 . 1 . . 22978 . . 126 LYS N . 53440 2 793 . 2 . 2 128 128 SER H H 1 7.9226 0.0000 . 1 . . 20021 . . 127 SER H . 53440 2 794 . 2 . 2 128 128 SER C C 13 175.4488 0.0000 . 1 . . 44885 . . 127 SER C . 53440 2 795 . 2 . 2 128 128 SER CA C 13 59.1272 0.0000 . 1 . . 44886 . . 127 SER CA . 53440 2 796 . 2 . 2 128 128 SER CB C 13 64.5874 0.0000 . 1 . . 44887 . . 127 SER CB . 53440 2 797 . 2 . 2 128 128 SER N N 15 114.5813 0.0000 . 1 . . 20023 . . 127 SER N . 53440 2 798 . 2 . 2 129 129 GLY H H 1 7.8990 0.0000 . 1 . . 24617 . . 128 GLY H . 53440 2 799 . 2 . 2 129 129 GLY C C 13 174.5333 0.0000 . 1 . . 48231 . . 128 GLY C . 53440 2 800 . 2 . 2 129 129 GLY CA C 13 45.6385 0.0000 . 1 . . 48233 . . 128 GLY CA . 53440 2 801 . 2 . 2 129 129 GLY N N 15 108.3253 0.0000 . 1 . . 24619 . . 128 GLY N . 53440 2 802 . 2 . 2 130 130 THR H H 1 7.4591 0.0000 . 1 . . 20207 . . 129 THR H . 53440 2 803 . 2 . 2 130 130 THR HG21 H 1 0.9960 0.0000 . 1 . . 54743 . . 129 THR HG21 . 53440 2 804 . 2 . 2 130 130 THR HG22 H 1 0.9960 0.0000 . 1 . . 54743 . . 129 THR HG21 . 53440 2 805 . 2 . 2 130 130 THR HG23 H 1 0.9960 0.0000 . 1 . . 54743 . . 129 THR HG21 . 53440 2 806 . 2 . 2 130 130 THR C C 13 169.7740 0.0000 . 1 . . 43840 . . 129 THR C . 53440 2 807 . 2 . 2 130 130 THR CA C 13 60.9752 0.0000 . 1 . . 43838 . . 129 THR CA . 53440 2 808 . 2 . 2 130 130 THR CB C 13 72.1286 0.0000 . 1 . . 43844 . . 129 THR CB . 53440 2 809 . 2 . 2 130 130 THR CG2 C 13 21.7120 0.0000 . 1 . . 50972 . . 129 THR CG2 . 53440 2 810 . 2 . 2 130 130 THR N N 15 116.5978 0.0000 . 1 . . 20209 . . 129 THR N . 53440 2 811 . 2 . 2 131 131 ALA H H 1 8.5879 0.0000 . 1 . . 22811 . . 130 ALA H . 53440 2 812 . 2 . 2 131 131 ALA HB1 H 1 1.0000 0.0000 . 1 . . 55124 . . 130 ALA HB1 . 53440 2 813 . 2 . 2 131 131 ALA HB2 H 1 1.0000 0.0000 . 1 . . 55124 . . 130 ALA HB1 . 53440 2 814 . 2 . 2 131 131 ALA HB3 H 1 1.0000 0.0000 . 1 . . 55124 . . 130 ALA HB1 . 53440 2 815 . 2 . 2 131 131 ALA CA C 13 50.5233 0.0000 . 1 . . 40097 . . 130 ALA CA . 53440 2 816 . 2 . 2 131 131 ALA CB C 13 21.8100 0.0000 . 1 . . 49015 . . 130 ALA CB . 53440 2 817 . 2 . 2 131 131 ALA N N 15 121.8738 0.0000 . 1 . . 22813 . . 130 ALA N . 53440 2 818 . 2 . 2 132 132 SER H H 1 7.4723 0.0000 . 1 . . 48870 . . 131 SER H . 53440 2 819 . 2 . 2 132 132 SER CA C 13 57.3550 0.0000 . 1 . . 35159 . . 131 SER CA . 53440 2 820 . 2 . 2 132 132 SER CB C 13 62.3549 0.0000 . 1 . . 35167 . . 131 SER CB . 53440 2 821 . 2 . 2 132 132 SER N N 15 117.2975 0.0000 . 1 . . 48872 . . 131 SER N . 53440 2 822 . 2 . 2 133 133 VAL H H 1 9.0969 0.0000 . 1 . . 19250 . . 132 VAL H . 53440 2 823 . 2 . 2 133 133 VAL HG11 H 1 1.3800 0.0000 . 2 . . . . . 132 VAL HG11 . 53440 2 824 . 2 . 2 133 133 VAL HG12 H 1 1.3800 0.0000 . 2 . . . . . 132 VAL HG11 . 53440 2 825 . 2 . 2 133 133 VAL HG13 H 1 1.3800 0.0000 . 2 . . . . . 132 VAL HG11 . 53440 2 826 . 2 . 2 133 133 VAL HG21 H 1 1.3770 0.0000 . 2 . . . . . 132 VAL HG21 . 53440 2 827 . 2 . 2 133 133 VAL HG22 H 1 1.3770 0.0000 . 2 . . . . . 132 VAL HG21 . 53440 2 828 . 2 . 2 133 133 VAL HG23 H 1 1.3770 0.0000 . 2 . . . . . 132 VAL HG21 . 53440 2 829 . 2 . 2 133 133 VAL C C 13 174.8530 0.0000 . 1 . . 35162 . . 132 VAL C . 53440 2 830 . 2 . 2 133 133 VAL CA C 13 60.5094 0.0000 . 1 . . 35164 . . 132 VAL CA . 53440 2 831 . 2 . 2 133 133 VAL CB C 13 31.6686 0.0000 . 1 . . 35166 . . 132 VAL CB . 53440 2 832 . 2 . 2 133 133 VAL CG1 C 13 24.8680 0.0000 . 2 . . . . . 132 VAL CG1 . 53440 2 833 . 2 . 2 133 133 VAL CG2 C 13 24.8450 0.0000 . 2 . . . . . 132 VAL CG2 . 53440 2 834 . 2 . 2 133 133 VAL N N 15 127.1348 0.0000 . 1 . . 19252 . . 132 VAL N . 53440 2 835 . 2 . 2 134 134 VAL H H 1 7.9493 0.0000 . 1 . . 23930 . . 133 VAL H . 53440 2 836 . 2 . 2 134 134 VAL HG11 H 1 0.8790 0.0000 . 2 . . . . . 133 VAL HG11 . 53440 2 837 . 2 . 2 134 134 VAL HG12 H 1 0.8790 0.0000 . 2 . . . . . 133 VAL HG11 . 53440 2 838 . 2 . 2 134 134 VAL HG13 H 1 0.8790 0.0000 . 2 . . . . . 133 VAL HG11 . 53440 2 839 . 2 . 2 134 134 VAL HG21 H 1 0.7880 0.0000 . 2 . . . . . 133 VAL HG21 . 53440 2 840 . 2 . 2 134 134 VAL HG22 H 1 0.7880 0.0000 . 2 . . . . . 133 VAL HG21 . 53440 2 841 . 2 . 2 134 134 VAL HG23 H 1 0.7880 0.0000 . 2 . . . . . 133 VAL HG21 . 53440 2 842 . 2 . 2 134 134 VAL C C 13 174.3150 0.0000 . 1 . . 35976 . . 133 VAL C . 53440 2 843 . 2 . 2 134 134 VAL CA C 13 61.5292 0.0000 . 1 . . 35973 . . 133 VAL CA . 53440 2 844 . 2 . 2 134 134 VAL CB C 13 34.8066 0.0000 . 1 . . 35978 . . 133 VAL CB . 53440 2 845 . 2 . 2 134 134 VAL CG1 C 13 21.3420 0.0000 . 2 . . . . . 133 VAL CG1 . 53440 2 846 . 2 . 2 134 134 VAL CG2 C 13 20.1920 0.0000 . 2 . . . . . 133 VAL CG2 . 53440 2 847 . 2 . 2 134 134 VAL N N 15 125.6424 0.0000 . 1 . . 23932 . . 133 VAL N . 53440 2 848 . 2 . 2 135 135 CYS H H 1 9.7289 0.0000 . 1 . . 22457 . . 134 CYS H . 53440 2 849 . 2 . 2 135 135 CYS C C 13 171.9135 0.0000 . 1 . . 34467 . . 134 CYS C . 53440 2 850 . 2 . 2 135 135 CYS CA C 13 54.0914 0.0000 . 1 . . 34474 . . 134 CYS CA . 53440 2 851 . 2 . 2 135 135 CYS CB C 13 44.2738 0.0000 . 1 . . 34469 . . 134 CYS CB . 53440 2 852 . 2 . 2 135 135 CYS N N 15 128.0911 0.0000 . 1 . . 22459 . . 134 CYS N . 53440 2 853 . 2 . 2 136 136 LEU H H 1 9.4033 0.0000 . 1 . . 25613 . . 135 LEU H . 53440 2 854 . 2 . 2 136 136 LEU HD11 H 1 1.1220 0.0000 . 2 . . . . . 135 LEU HD11 . 53440 2 855 . 2 . 2 136 136 LEU HD12 H 1 1.1220 0.0000 . 2 . . . . . 135 LEU HD11 . 53440 2 856 . 2 . 2 136 136 LEU HD13 H 1 1.1220 0.0000 . 2 . . . . . 135 LEU HD11 . 53440 2 857 . 2 . 2 136 136 LEU HD21 H 1 0.8430 0.0000 . 2 . . . . . 135 LEU HD21 . 53440 2 858 . 2 . 2 136 136 LEU HD22 H 1 0.8430 0.0000 . 2 . . . . . 135 LEU HD21 . 53440 2 859 . 2 . 2 136 136 LEU HD23 H 1 0.8430 0.0000 . 2 . . . . . 135 LEU HD21 . 53440 2 860 . 2 . 2 136 136 LEU C C 13 173.0675 0.0000 . 1 . . 33821 . . 135 LEU C . 53440 2 861 . 2 . 2 136 136 LEU CA C 13 52.9132 0.0000 . 1 . . 33820 . . 135 LEU CA . 53440 2 862 . 2 . 2 136 136 LEU CB C 13 45.8922 0.0000 . 1 . . 33825 . . 135 LEU CB . 53440 2 863 . 2 . 2 136 136 LEU CD1 C 13 24.0940 0.0000 . 2 . . . . . 135 LEU CD1 . 53440 2 864 . 2 . 2 136 136 LEU CD2 C 13 26.1050 0.0000 . 2 . . . . . 135 LEU CD2 . 53440 2 865 . 2 . 2 136 136 LEU N N 15 128.6095 0.0000 . 1 . . 25615 . . 135 LEU N . 53440 2 866 . 2 . 2 137 137 LEU H H 1 9.5530 0.0000 . 1 . . 22451 . . 136 LEU H . 53440 2 867 . 2 . 2 137 137 LEU HD11 H 1 0.2160 0.0000 . 2 . . . . . 136 LEU HD11 . 53440 2 868 . 2 . 2 137 137 LEU HD12 H 1 0.2160 0.0000 . 2 . . . . . 136 LEU HD11 . 53440 2 869 . 2 . 2 137 137 LEU HD13 H 1 0.2160 0.0000 . 2 . . . . . 136 LEU HD11 . 53440 2 870 . 2 . 2 137 137 LEU HD21 H 1 0.6410 0.0000 . 2 . . . . . 136 LEU HD21 . 53440 2 871 . 2 . 2 137 137 LEU HD22 H 1 0.6410 0.0000 . 2 . . . . . 136 LEU HD21 . 53440 2 872 . 2 . 2 137 137 LEU HD23 H 1 0.6410 0.0000 . 2 . . . . . 136 LEU HD21 . 53440 2 873 . 2 . 2 137 137 LEU C C 13 175.2042 0.0000 . 1 . . 34314 . . 136 LEU C . 53440 2 874 . 2 . 2 137 137 LEU CA C 13 53.8514 0.0000 . 1 . . 34312 . . 136 LEU CA . 53440 2 875 . 2 . 2 137 137 LEU CB C 13 42.7102 0.0000 . 1 . . 34318 . . 136 LEU CB . 53440 2 876 . 2 . 2 137 137 LEU CD1 C 13 26.8620 0.0000 . 2 . . . . . 136 LEU CD1 . 53440 2 877 . 2 . 2 137 137 LEU CD2 C 13 22.7470 0.0000 . 2 . . . . . 136 LEU CD2 . 53440 2 878 . 2 . 2 137 137 LEU N N 15 128.3637 0.0000 . 1 . . 22453 . . 136 LEU N . 53440 2 879 . 2 . 2 138 138 ASN H H 1 9.4180 0.0000 . 1 . . 19568 . . 137 ASN H . 53440 2 880 . 2 . 2 138 138 ASN C C 13 175.0105 0.0000 . 1 . . 38275 . . 137 ASN C . 53440 2 881 . 2 . 2 138 138 ASN CA C 13 51.8899 0.0000 . 1 . . 38276 . . 137 ASN CA . 53440 2 882 . 2 . 2 138 138 ASN CB C 13 41.9708 0.0000 . 1 . . 38279 . . 137 ASN CB . 53440 2 883 . 2 . 2 138 138 ASN N N 15 122.8335 0.0000 . 1 . . 19570 . . 137 ASN N . 53440 2 884 . 2 . 2 139 139 ASN H H 1 8.2031 0.0000 . 1 . . 19535 . . 138 ASN H . 53440 2 885 . 2 . 2 139 139 ASN C C 13 171.9992 0.0000 . 1 . . 38045 . . 138 ASN C . 53440 2 886 . 2 . 2 139 139 ASN CA C 13 54.4361 0.0000 . 1 . . 38046 . . 138 ASN CA . 53440 2 887 . 2 . 2 139 139 ASN CB C 13 36.6212 0.0000 . 1 . . 38049 . . 138 ASN CB . 53440 2 888 . 2 . 2 139 139 ASN N N 15 123.0410 0.0000 . 1 . . 19537 . . 138 ASN N . 53440 2 889 . 2 . 2 140 140 PHE H H 1 9.1735 0.0000 . 1 . . 26405 . . 139 PHE H . 53440 2 890 . 2 . 2 140 140 PHE C C 13 174.0733 0.0000 . 1 . . 43519 . . 139 PHE C . 53440 2 891 . 2 . 2 140 140 PHE CA C 13 54.4663 0.0000 . 1 . . 43518 . . 139 PHE CA . 53440 2 892 . 2 . 2 140 140 PHE CB C 13 42.7893 0.0000 . 1 . . 43522 . . 139 PHE CB . 53440 2 893 . 2 . 2 140 140 PHE N N 15 117.0752 0.0000 . 1 . . 26407 . . 139 PHE N . 53440 2 894 . 2 . 2 141 141 TYR H H 1 9.3478 0.0000 . 1 . . 26171 . . 140 TYR H . 53440 2 895 . 2 . 2 141 141 TYR C C 13 174.6575 0.0000 . 1 . . 41028 . . 140 TYR C . 53440 2 896 . 2 . 2 141 141 TYR CA C 13 58.8541 0.0000 . 1 . . 41030 . . 140 TYR CA . 53440 2 897 . 2 . 2 141 141 TYR CB C 13 42.0170 0.0000 . 1 . . 41032 . . 140 TYR CB . 53440 2 898 . 2 . 2 141 141 TYR N N 15 120.4844 0.0000 . 1 . . 26173 . . 140 TYR N . 53440 2 899 . 2 . 2 142 142 PRO C C 13 175.3605 0.0000 . 1 . . 42862 . . 141 PRO C . 53440 2 900 . 2 . 2 142 142 PRO CA C 13 61.7103 0.0000 . 1 . . 42863 . . 141 PRO CA . 53440 2 901 . 2 . 2 142 142 PRO CB C 13 34.7501 0.0000 . 1 . . 42873 . . 141 PRO CB . 53440 2 902 . 2 . 2 143 143 ARG H H 1 8.2345 0.0000 . 1 . . 22991 . . 142 ARG H . 53440 2 903 . 2 . 2 143 143 ARG C C 13 175.7659 0.0000 . 1 . . 42866 . . 142 ARG C . 53440 2 904 . 2 . 2 143 143 ARG CA C 13 57.9280 0.0000 . 1 . . 42865 . . 142 ARG CA . 53440 2 905 . 2 . 2 143 143 ARG CB C 13 29.1110 0.0000 . 1 . . 50780 . . 142 ARG CB . 53440 2 906 . 2 . 2 143 143 ARG N N 15 117.8570 0.0000 . 1 . . 22993 . . 142 ARG N . 53440 2 907 . 2 . 2 144 144 GLU H H 1 7.3975 0.0000 . 1 . . 26870 . . 143 GLU H . 53440 2 908 . 2 . 2 144 144 GLU C C 13 174.8517 0.0000 . 1 . . 43417 . . 143 GLU C . 53440 2 909 . 2 . 2 144 144 GLU CA C 13 57.9130 0.0000 . 1 . . 43423 . . 143 GLU CA . 53440 2 910 . 2 . 2 144 144 GLU CB C 13 27.7775 0.0000 . 1 . . 43419 . . 143 GLU CB . 53440 2 911 . 2 . 2 144 144 GLU N N 15 117.1856 0.0000 . 1 . . 26872 . . 143 GLU N . 53440 2 912 . 2 . 2 145 145 ALA H H 1 7.6208 0.0000 . 1 . . 23711 . . 144 ALA H . 53440 2 913 . 2 . 2 145 145 ALA HB1 H 1 0.8590 0.0000 . 1 . . 54902 . . 144 ALA HB1 . 53440 2 914 . 2 . 2 145 145 ALA HB2 H 1 0.8590 0.0000 . 1 . . 54902 . . 144 ALA HB1 . 53440 2 915 . 2 . 2 145 145 ALA HB3 H 1 0.8590 0.0000 . 1 . . 54902 . . 144 ALA HB1 . 53440 2 916 . 2 . 2 145 145 ALA C C 13 175.4509 0.0000 . 1 . . 35824 . . 144 ALA C . 53440 2 917 . 2 . 2 145 145 ALA CA C 13 50.9461 0.0000 . 1 . . 35827 . . 144 ALA CA . 53440 2 918 . 2 . 2 145 145 ALA CB C 13 21.0570 0.0000 . 1 . . 35841 . . 144 ALA CB . 53440 2 919 . 2 . 2 145 145 ALA N N 15 125.7634 0.0000 . 1 . . 23713 . . 144 ALA N . 53440 2 920 . 2 . 2 146 146 LYS H H 1 8.2081 0.0000 . 1 . . 26084 . . 145 LYS H . 53440 2 921 . 2 . 2 146 146 LYS C C 13 174.3655 0.0000 . 1 . . 39627 . . 145 LYS C . 53440 2 922 . 2 . 2 146 146 LYS CA C 13 55.0390 0.0000 . 1 . . 39624 . . 145 LYS CA . 53440 2 923 . 2 . 2 146 146 LYS CB C 13 33.7731 0.0000 . 1 . . 39630 . . 145 LYS CB . 53440 2 924 . 2 . 2 146 146 LYS N N 15 122.0581 0.0000 . 1 . . 26086 . . 145 LYS N . 53440 2 925 . 2 . 2 147 147 VAL H H 1 8.6479 0.0000 . 1 . . 22547 . . 146 VAL H . 53440 2 926 . 2 . 2 147 147 VAL HG11 H 1 0.6820 0.0000 . 2 . . . . . 146 VAL HG11 . 53440 2 927 . 2 . 2 147 147 VAL HG12 H 1 0.6820 0.0000 . 2 . . . . . 146 VAL HG11 . 53440 2 928 . 2 . 2 147 147 VAL HG13 H 1 0.6820 0.0000 . 2 . . . . . 146 VAL HG11 . 53440 2 929 . 2 . 2 147 147 VAL HG21 H 1 0.4550 0.0000 . 2 . . . . . 146 VAL HG21 . 53440 2 930 . 2 . 2 147 147 VAL HG22 H 1 0.4550 0.0000 . 2 . . . . . 146 VAL HG21 . 53440 2 931 . 2 . 2 147 147 VAL HG23 H 1 0.4550 0.0000 . 2 . . . . . 146 VAL HG21 . 53440 2 932 . 2 . 2 147 147 VAL C C 13 175.4308 0.0000 . 1 . . 35577 . . 146 VAL C . 53440 2 933 . 2 . 2 147 147 VAL CA C 13 60.5840 0.0000 . 1 . . 35575 . . 146 VAL CA . 53440 2 934 . 2 . 2 147 147 VAL CB C 13 32.6064 0.0000 . 1 . . 35581 . . 146 VAL CB . 53440 2 935 . 2 . 2 147 147 VAL CG1 C 13 22.5400 0.0000 . 2 . . . . . 146 VAL CG1 . 53440 2 936 . 2 . 2 147 147 VAL CG2 C 13 21.1200 0.0000 . 2 . . . . . 146 VAL CG2 . 53440 2 937 . 2 . 2 147 147 VAL N N 15 126.2221 0.0000 . 1 . . 22549 . . 146 VAL N . 53440 2 938 . 2 . 2 148 148 GLN H H 1 8.9052 0.0000 . 1 . . 22535 . . 147 GLN H . 53440 2 939 . 2 . 2 148 148 GLN C C 13 173.9079 0.0000 . 1 . . 35403 . . 147 GLN C . 53440 2 940 . 2 . 2 148 148 GLN CA C 13 53.9048 0.0000 . 1 . . 35401 . . 147 GLN CA . 53440 2 941 . 2 . 2 148 148 GLN CB C 13 31.8009 0.0000 . 1 . . 35409 . . 147 GLN CB . 53440 2 942 . 2 . 2 148 148 GLN N N 15 126.2855 0.0000 . 1 . . 22537 . . 147 GLN N . 53440 2 943 . 2 . 2 149 149 TRP H H 1 9.0523 0.0000 . 1 . . 24032 . . 148 TRP H . 53440 2 944 . 2 . 2 149 149 TRP C C 13 176.2978 0.0000 . 1 . . 37093 . . 148 TRP C . 53440 2 945 . 2 . 2 149 149 TRP CA C 13 56.4748 0.0000 . 1 . . 37095 . . 148 TRP CA . 53440 2 946 . 2 . 2 149 149 TRP CB C 13 31.2905 0.0000 . 1 . . 37096 . . 148 TRP CB . 53440 2 947 . 2 . 2 149 149 TRP N N 15 124.2861 0.0000 . 1 . . 24034 . . 148 TRP N . 53440 2 948 . 2 . 2 150 150 LYS H H 1 9.3276 0.0000 . 1 . . 25079 . . 149 LYS H . 53440 2 949 . 2 . 2 150 150 LYS C C 13 175.2745 0.0000 . 1 . . 39575 . . 149 LYS C . 53440 2 950 . 2 . 2 150 150 LYS CA C 13 54.5122 0.0000 . 1 . . 39576 . . 149 LYS CA . 53440 2 951 . 2 . 2 150 150 LYS CB C 13 35.7807 0.0000 . 1 . . 39579 . . 149 LYS CB . 53440 2 952 . 2 . 2 150 150 LYS N N 15 122.0930 0.0000 . 1 . . 25081 . . 149 LYS N . 53440 2 953 . 2 . 2 151 151 VAL H H 1 8.1538 0.0000 . 1 . . 23324 . . 150 VAL H . 53440 2 954 . 2 . 2 151 151 VAL HG11 H 1 -0.0830 0.0000 . 2 . . . . . 150 VAL HG11 . 53440 2 955 . 2 . 2 151 151 VAL HG12 H 1 -0.0830 0.0000 . 2 . . . . . 150 VAL HG11 . 53440 2 956 . 2 . 2 151 151 VAL HG13 H 1 -0.0830 0.0000 . 2 . . . . . 150 VAL HG11 . 53440 2 957 . 2 . 2 151 151 VAL HG21 H 1 0.6800 0.0000 . 2 . . . . . 150 VAL HG21 . 53440 2 958 . 2 . 2 151 151 VAL HG22 H 1 0.6800 0.0000 . 2 . . . . . 150 VAL HG21 . 53440 2 959 . 2 . 2 151 151 VAL HG23 H 1 0.6800 0.0000 . 2 . . . . . 150 VAL HG21 . 53440 2 960 . 2 . 2 151 151 VAL C C 13 176.6503 0.0000 . 1 . . 37634 . . 150 VAL C . 53440 2 961 . 2 . 2 151 151 VAL CA C 13 59.9744 0.0000 . 1 . . 37632 . . 150 VAL CA . 53440 2 962 . 2 . 2 151 151 VAL CB C 13 33.2438 0.0000 . 1 . . 37638 . . 150 VAL CB . 53440 2 963 . 2 . 2 151 151 VAL CG1 C 13 20.7130 0.0000 . 2 . . . . . 150 VAL CG1 . 53440 2 964 . 2 . 2 151 151 VAL CG2 C 13 20.5240 0.0000 . 2 . . . . . 150 VAL CG2 . 53440 2 965 . 2 . 2 151 151 VAL N N 15 123.2951 0.0000 . 1 . . 23326 . . 150 VAL N . 53440 2 966 . 2 . 2 152 152 ASP H H 1 9.8357 0.0000 . 1 . . 25562 . . 151 ASP H . 53440 2 967 . 2 . 2 152 152 ASP C C 13 175.4257 0.0000 . 1 . . 33463 . . 151 ASP C . 53440 2 968 . 2 . 2 152 152 ASP CA C 13 56.3890 0.0000 . 1 . . 33461 . . 151 ASP CA . 53440 2 969 . 2 . 2 152 152 ASP CB C 13 39.2030 0.0000 . 1 . . 33466 . . 151 ASP CB . 53440 2 970 . 2 . 2 152 152 ASP N N 15 131.4670 0.0000 . 1 . . 25564 . . 151 ASP N . 53440 2 971 . 2 . 2 153 153 ASN H H 1 9.0023 0.0000 . 1 . . 26702 . . 152 ASN H . 53440 2 972 . 2 . 2 153 153 ASN C C 13 173.2733 0.0000 . 1 . . 47862 . . 152 ASN C . 53440 2 973 . 2 . 2 153 153 ASN CA C 13 54.7380 0.0000 . 1 . . 47860 . . 152 ASN CA . 53440 2 974 . 2 . 2 153 153 ASN CB C 13 38.0742 0.0000 . 1 . . 47865 . . 152 ASN CB . 53440 2 975 . 2 . 2 153 153 ASN N N 15 109.5508 0.0000 . 1 . . 26704 . . 152 ASN N . 53440 2 976 . 2 . 2 154 154 ALA H H 1 7.8651 0.0000 . 1 . . 24971 . . 153 ALA H . 53440 2 977 . 2 . 2 154 154 ALA HB1 H 1 1.2970 0.0000 . 1 . . 54551 . . 153 ALA HB1 . 53440 2 978 . 2 . 2 154 154 ALA HB2 H 1 1.2970 0.0000 . 1 . . 54551 . . 153 ALA HB1 . 53440 2 979 . 2 . 2 154 154 ALA HB3 H 1 1.2970 0.0000 . 1 . . 54551 . . 153 ALA HB1 . 53440 2 980 . 2 . 2 154 154 ALA C C 13 178.0603 0.0000 . 1 . . 37594 . . 153 ALA C . 53440 2 981 . 2 . 2 154 154 ALA CA C 13 50.6908 0.0000 . 1 . . 37597 . . 153 ALA CA . 53440 2 982 . 2 . 2 154 154 ALA CB C 13 19.0540 0.0000 . 1 . . 37612 . . 153 ALA CB . 53440 2 983 . 2 . 2 154 154 ALA N N 15 123.7644 0.0000 . 1 . . 24973 . . 153 ALA N . 53440 2 984 . 2 . 2 155 155 LEU H H 1 8.7349 0.0000 . 1 . . 22448 . . 154 LEU H . 53440 2 985 . 2 . 2 155 155 LEU HD11 H 1 0.8560 0.0000 . 2 . . . . . 154 LEU HD11 . 53440 2 986 . 2 . 2 155 155 LEU HD12 H 1 0.8560 0.0000 . 2 . . . . . 154 LEU HD11 . 53440 2 987 . 2 . 2 155 155 LEU HD13 H 1 0.8560 0.0000 . 2 . . . . . 154 LEU HD11 . 53440 2 988 . 2 . 2 155 155 LEU HD21 H 1 0.9350 0.0000 . 2 . . . . . 154 LEU HD21 . 53440 2 989 . 2 . 2 155 155 LEU HD22 H 1 0.9350 0.0000 . 2 . . . . . 154 LEU HD21 . 53440 2 990 . 2 . 2 155 155 LEU HD23 H 1 0.9350 0.0000 . 2 . . . . . 154 LEU HD21 . 53440 2 991 . 2 . 2 155 155 LEU C C 13 177.0850 0.0000 . 1 . . 34152 . . 154 LEU C . 53440 2 992 . 2 . 2 155 155 LEU CA C 13 55.8084 0.0000 . 1 . . 34153 . . 154 LEU CA . 53440 2 993 . 2 . 2 155 155 LEU CB C 13 41.3250 0.0000 . 1 . . 34156 . . 154 LEU CB . 53440 2 994 . 2 . 2 155 155 LEU CD1 C 13 24.8110 0.0000 . 2 . . . . . 154 LEU CD1 . 53440 2 995 . 2 . 2 155 155 LEU CD2 C 13 24.2610 0.0000 . 2 . . . . . 154 LEU CD2 . 53440 2 996 . 2 . 2 155 155 LEU N N 15 128.4916 0.0000 . 1 . . 22450 . . 154 LEU N . 53440 2 997 . 2 . 2 156 156 GLN H H 1 8.4667 0.0000 . 1 . . 24014 . . 155 GLN H . 53440 2 998 . 2 . 2 156 156 GLN C C 13 175.7206 0.0000 . 1 . . 36276 . . 155 GLN C . 53440 2 999 . 2 . 2 156 156 GLN CA C 13 53.6188 0.0000 . 1 . . 36274 . . 155 GLN CA . 53440 2 1000 . 2 . 2 156 156 GLN CB C 13 30.0880 0.0000 . 1 . . 36280 . . 155 GLN CB . 53440 2 1001 . 2 . 2 156 156 GLN N N 15 124.8448 0.0000 . 1 . . 24016 . . 155 GLN N . 53440 2 1002 . 2 . 2 157 157 SER H H 1 8.4665 0.0000 . 1 . . 24338 . . 156 SER H . 53440 2 1003 . 2 . 2 157 157 SER C C 13 174.7347 0.0000 . 1 . . 42670 . . 156 SER C . 53440 2 1004 . 2 . 2 157 157 SER CA C 13 57.7610 0.0000 . 1 . . 42671 . . 156 SER CA . 53440 2 1005 . 2 . 2 157 157 SER CB C 13 64.4708 0.0000 . 1 . . 42673 . . 156 SER CB . 53440 2 1006 . 2 . 2 157 157 SER N N 15 117.9616 0.0000 . 1 . . 24340 . . 156 SER N . 53440 2 1007 . 2 . 2 158 158 GLY H H 1 8.6075 0.0000 . 1 . . 23216 . . 157 GLY H . 53440 2 1008 . 2 . 2 158 158 GLY C C 13 174.3962 0.0000 . 1 . . 46776 . . 157 GLY C . 53440 2 1009 . 2 . 2 158 158 GLY CA C 13 45.7781 0.0000 . 1 . . 46774 . . 157 GLY CA . 53440 2 1010 . 2 . 2 158 158 GLY N N 15 112.6034 0.0000 . 1 . . 23218 . . 157 GLY N . 53440 2 1011 . 2 . 2 159 159 ASN H H 1 8.1183 0.0000 . 1 . . 23450 . . 158 ASN H . 53440 2 1012 . 2 . 2 159 159 ASN C C 13 173.3507 0.0000 . 1 . . 44156 . . 158 ASN C . 53440 2 1013 . 2 . 2 159 159 ASN CA C 13 52.3606 0.0000 . 1 . . 44157 . . 158 ASN CA . 53440 2 1014 . 2 . 2 159 159 ASN CB C 13 36.9105 0.0000 . 1 . . 44159 . . 158 ASN CB . 53440 2 1015 . 2 . 2 159 159 ASN N N 15 115.7496 0.0000 . 1 . . 23452 . . 158 ASN N . 53440 2 1016 . 2 . 2 160 160 SER H H 1 7.6991 0.0000 . 1 . . 23219 . . 159 SER H . 53440 2 1017 . 2 . 2 160 160 SER C C 13 174.1419 0.0000 . 1 . . 47393 . . 159 SER C . 53440 2 1018 . 2 . 2 160 160 SER CA C 13 56.2309 0.0000 . 1 . . 47391 . . 159 SER CA . 53440 2 1019 . 2 . 2 160 160 SER CB C 13 66.8223 0.0000 . 1 . . 47397 . . 159 SER CB . 53440 2 1020 . 2 . 2 160 160 SER N N 15 111.2392 0.0000 . 1 . . 23221 . . 159 SER N . 53440 2 1021 . 2 . 2 161 161 GLN H H 1 8.0368 0.0000 . 1 . . 26360 . . 160 GLN H . 53440 2 1022 . 2 . 2 161 161 GLN C C 13 175.2061 0.0000 . 1 . . 43112 . . 160 GLN C . 53440 2 1023 . 2 . 2 161 161 GLN CA C 13 55.0270 0.0000 . 1 . . 43111 . . 160 GLN CA . 53440 2 1024 . 2 . 2 161 161 GLN CB C 13 33.1419 0.0000 . 1 . . 43115 . . 160 GLN CB . 53440 2 1025 . 2 . 2 161 161 GLN N N 15 117.5732 0.0000 . 1 . . 26362 . . 160 GLN N . 53440 2 1026 . 2 . 2 162 162 GLU H H 1 8.8915 0.0000 . 1 . . 24929 . . 161 GLU H . 53440 2 1027 . 2 . 2 162 162 GLU C C 13 175.0255 0.0000 . 1 . . 36782 . . 161 GLU C . 53440 2 1028 . 2 . 2 162 162 GLU CA C 13 54.9820 0.0000 . 1 . . 36781 . . 161 GLU CA . 53440 2 1029 . 2 . 2 162 162 GLU CB C 13 32.6305 0.0000 . 1 . . 36786 . . 161 GLU CB . 53440 2 1030 . 2 . 2 162 162 GLU N N 15 124.6180 0.0000 . 1 . . 24931 . . 161 GLU N . 53440 2 1031 . 2 . 2 163 163 SER H H 1 8.6101 0.0000 . 1 . . 25388 . . 162 SER H . 53440 2 1032 . 2 . 2 163 163 SER C C 13 172.4867 0.0000 . 1 . . 44737 . . 162 SER C . 53440 2 1033 . 2 . 2 163 163 SER CA C 13 56.7448 0.0000 . 1 . . 44742 . . 162 SER CA . 53440 2 1034 . 2 . 2 163 163 SER CB C 13 65.0719 0.0000 . 1 . . 44740 . . 162 SER CB . 53440 2 1035 . 2 . 2 163 163 SER N N 15 115.0438 0.0000 . 1 . . 25390 . . 162 SER N . 53440 2 1036 . 2 . 2 164 164 VAL H H 1 8.3553 0.0000 . 1 . . 24017 . . 163 VAL H . 53440 2 1037 . 2 . 2 164 164 VAL HG11 H 1 1.2690 0.0000 . 2 . . . . . 163 VAL HG11 . 53440 2 1038 . 2 . 2 164 164 VAL HG12 H 1 1.2690 0.0000 . 2 . . . . . 163 VAL HG11 . 53440 2 1039 . 2 . 2 164 164 VAL HG13 H 1 1.2690 0.0000 . 2 . . . . . 163 VAL HG11 . 53440 2 1040 . 2 . 2 164 164 VAL HG21 H 1 1.2220 0.0000 . 2 . . . . . 163 VAL HG21 . 53440 2 1041 . 2 . 2 164 164 VAL HG22 H 1 1.2220 0.0000 . 2 . . . . . 163 VAL HG21 . 53440 2 1042 . 2 . 2 164 164 VAL HG23 H 1 1.2220 0.0000 . 2 . . . . . 163 VAL HG21 . 53440 2 1043 . 2 . 2 164 164 VAL C C 13 175.8439 0.0000 . 1 . . 35992 . . 163 VAL C . 53440 2 1044 . 2 . 2 164 164 VAL CA C 13 60.1726 0.0000 . 1 . . 35990 . . 163 VAL CA . 53440 2 1045 . 2 . 2 164 164 VAL CB C 13 35.0565 0.0000 . 1 . . 35996 . . 163 VAL CB . 53440 2 1046 . 2 . 2 164 164 VAL CG1 C 13 20.5040 0.0000 . 2 . . . . . 163 VAL CG1 . 53440 2 1047 . 2 . 2 164 164 VAL CG2 C 13 21.5260 0.0000 . 2 . . . . . 163 VAL CG2 . 53440 2 1048 . 2 . 2 164 164 VAL N N 15 125.5693 0.0000 . 1 . . 24019 . . 163 VAL N . 53440 2 1049 . 2 . 2 165 165 THR H H 1 8.5781 0.0000 . 1 . . 24410 . . 164 THR H . 53440 2 1050 . 2 . 2 165 165 THR HG21 H 1 0.7020 0.0000 . 1 . . 55007 . . 164 THR HG21 . 53440 2 1051 . 2 . 2 165 165 THR HG22 H 1 0.7020 0.0000 . 1 . . 55007 . . 164 THR HG21 . 53440 2 1052 . 2 . 2 165 165 THR HG23 H 1 0.7020 0.0000 . 1 . . 55007 . . 164 THR HG21 . 53440 2 1053 . 2 . 2 165 165 THR C C 13 176.0654 0.0000 . 1 . . 44066 . . 164 THR C . 53440 2 1054 . 2 . 2 165 165 THR CA C 13 61.8336 0.0000 . 1 . . 44064 . . 164 THR CA . 53440 2 1055 . 2 . 2 165 165 THR CB C 13 70.2270 0.0000 . 1 . . 44070 . . 164 THR CB . 53440 2 1056 . 2 . 2 165 165 THR CG2 C 13 22.5120 0.0000 . 1 . . 50945 . . 164 THR CG2 . 53440 2 1057 . 2 . 2 165 165 THR N N 15 115.8854 0.0000 . 1 . . 24412 . . 164 THR N . 53440 2 1058 . 2 . 2 166 166 GLU H H 1 8.1216 0.0000 . 1 . . 20204 . . 165 GLU H . 53440 2 1059 . 2 . 2 166 166 GLU C C 13 176.4786 0.0000 . 1 . . 58713 . . 165 GLU C . 53440 2 1060 . 2 . 2 166 166 GLU CA C 13 55.4064 0.0000 . 1 . . 43800 . . 165 GLU CA . 53440 2 1061 . 2 . 2 166 166 GLU CB C 13 29.3458 0.0000 . 1 . . 58717 . . 165 GLU CB . 53440 2 1062 . 2 . 2 166 166 GLU N N 15 116.4875 0.0000 . 1 . . 20206 . . 165 GLU N . 53440 2 1063 . 2 . 2 167 167 GLN H H 1 8.0013 0.0000 . 1 . . 56165 . . 166 GLN H . 53440 2 1064 . 2 . 2 167 167 GLN C C 13 175.5580 0.0000 . 1 . . 58721 . . 166 GLN C . 53440 2 1065 . 2 . 2 167 167 GLN CA C 13 56.9898 0.0000 . 1 . . 35775 . . 166 GLN CA . 53440 2 1066 . 2 . 2 167 167 GLN CB C 13 27.8335 0.0000 . 1 . . 58733 . . 166 GLN CB . 53440 2 1067 . 2 . 2 167 167 GLN N N 15 123.0410 0.0000 . 1 . . 56167 . . 166 GLN N . 53440 2 1068 . 2 . 2 168 168 ASP H H 1 8.7602 0.0000 . 1 . . 19289 . . 167 ASP H . 53440 2 1069 . 2 . 2 168 168 ASP C C 13 178.7027 0.0000 . 1 . . 35779 . . 167 ASP C . 53440 2 1070 . 2 . 2 168 168 ASP CA C 13 55.1496 0.0000 . 1 . . 35777 . . 167 ASP CA . 53440 2 1071 . 2 . 2 168 168 ASP CB C 13 43.5205 0.0000 . 1 . . 35781 . . 167 ASP CB . 53440 2 1072 . 2 . 2 168 168 ASP N N 15 125.9971 0.0000 . 1 . . 19291 . . 167 ASP N . 53440 2 1073 . 2 . 2 169 169 SER H H 1 8.5829 0.0000 . 1 . . 26093 . . 168 SER H . 53440 2 1074 . 2 . 2 169 169 SER C C 13 173.3354 0.0000 . 1 . . 39009 . . 168 SER C . 53440 2 1075 . 2 . 2 169 169 SER CA C 13 61.0523 0.0000 . 1 . . 39007 . . 168 SER CA . 53440 2 1076 . 2 . 2 169 169 SER CB C 13 63.3570 0.0000 . 1 . . 39012 . . 168 SER CB . 53440 2 1077 . 2 . 2 169 169 SER N N 15 122.3490 0.0000 . 1 . . 26095 . . 168 SER N . 53440 2 1078 . 2 . 2 170 170 LYS H H 1 8.6223 0.0000 . 1 . . 24197 . . 169 LYS H . 53440 2 1079 . 2 . 2 170 170 LYS C C 13 177.9229 0.0000 . 1 . . 40554 . . 169 LYS C . 53440 2 1080 . 2 . 2 170 170 LYS CA C 13 57.1502 0.0000 . 1 . . 40555 . . 169 LYS CA . 53440 2 1081 . 2 . 2 170 170 LYS CB C 13 32.9328 0.0000 . 1 . . 40556 . . 169 LYS CB . 53440 2 1082 . 2 . 2 170 170 LYS N N 15 121.0398 0.0000 . 1 . . 24199 . . 169 LYS N . 53440 2 1083 . 2 . 2 171 171 ASP H H 1 8.5147 0.0000 . 1 . . 26381 . . 170 ASP H . 53440 2 1084 . 2 . 2 171 171 ASP C C 13 176.1837 0.0000 . 1 . . 43292 . . 170 ASP C . 53440 2 1085 . 2 . 2 171 171 ASP CA C 13 52.5830 0.0000 . 1 . . 43290 . . 170 ASP CA . 53440 2 1086 . 2 . 2 171 171 ASP CB C 13 41.6901 0.0000 . 1 . . 43294 . . 170 ASP CB . 53440 2 1087 . 2 . 2 171 171 ASP N N 15 117.0765 0.0000 . 1 . . 26383 . . 170 ASP N . 53440 2 1088 . 2 . 2 172 172 SER H H 1 7.5557 0.0000 . 1 . . 23258 . . 171 SER H . 53440 2 1089 . 2 . 2 172 172 SER CA C 13 59.0300 0.0000 . 1 . . 48147 . . 171 SER CA . 53440 2 1090 . 2 . 2 172 172 SER CB C 13 60.0062 0.0000 . 1 . . 48150 . . 171 SER CB . 53440 2 1091 . 2 . 2 172 172 SER N N 15 108.5490 0.0000 . 1 . . 23260 . . 171 SER N . 53440 2 1092 . 2 . 2 173 173 THR H H 1 7.5862 0.0000 . 1 . . 26762 . . 172 THR H . 53440 2 1093 . 2 . 2 173 173 THR HG21 H 1 0.6950 0.0000 . 1 . . 55013 . . 172 THR HG21 . 53440 2 1094 . 2 . 2 173 173 THR HG22 H 1 0.6950 0.0000 . 1 . . 55013 . . 172 THR HG21 . 53440 2 1095 . 2 . 2 173 173 THR HG23 H 1 0.6950 0.0000 . 1 . . 55013 . . 172 THR HG21 . 53440 2 1096 . 2 . 2 173 173 THR C C 13 173.0966 0.0000 . 1 . . 48367 . . 172 THR C . 53440 2 1097 . 2 . 2 173 173 THR CA C 13 60.3112 0.0000 . 1 . . 48368 . . 172 THR CA . 53440 2 1098 . 2 . 2 173 173 THR CB C 13 71.2518 0.0000 . 1 . . 48369 . . 172 THR CB . 53440 2 1099 . 2 . 2 173 173 THR CG2 C 13 20.7590 0.0000 . 1 . . 51125 . . 172 THR CG2 . 53440 2 1100 . 2 . 2 173 173 THR N N 15 107.4927 0.0000 . 1 . . 26764 . . 172 THR N . 53440 2 1101 . 2 . 2 174 174 TYR H H 1 8.7843 0.0000 . 1 . . 26414 . . 173 TYR H . 53440 2 1102 . 2 . 2 174 174 TYR C C 13 174.4436 0.0000 . 1 . . 43744 . . 173 TYR C . 53440 2 1103 . 2 . 2 174 174 TYR CA C 13 57.1850 0.0000 . 1 . . 43743 . . 173 TYR CA . 53440 2 1104 . 2 . 2 174 174 TYR CB C 13 41.0686 0.0000 . 1 . . 43747 . . 173 TYR CB . 53440 2 1105 . 2 . 2 174 174 TYR N N 15 116.7829 0.0000 . 1 . . 26416 . . 173 TYR N . 53440 2 1106 . 2 . 2 175 175 SER H H 1 7.5946 0.0000 . 1 . . 24569 . . 174 SER H . 53440 2 1107 . 2 . 2 175 175 SER C C 13 171.1848 0.0000 . 1 . . 47277 . . 174 SER C . 53440 2 1108 . 2 . 2 175 175 SER CA C 13 58.5544 0.0000 . 1 . . 47274 . . 174 SER CA . 53440 2 1109 . 2 . 2 175 175 SER CB C 13 66.2719 0.0000 . 1 . . 47279 . . 174 SER CB . 53440 2 1110 . 2 . 2 175 175 SER N N 15 111.8871 0.0000 . 1 . . 24571 . . 174 SER N . 53440 2 1111 . 2 . 2 176 176 LEU H H 1 9.8392 0.0000 . 1 . . 19319 . . 175 LEU H . 53440 2 1112 . 2 . 2 176 176 LEU HD11 H 1 1.0070 0.0000 . 2 . . . . . 175 LEU HD11 . 53440 2 1113 . 2 . 2 176 176 LEU HD12 H 1 1.0070 0.0000 . 2 . . . . . 175 LEU HD11 . 53440 2 1114 . 2 . 2 176 176 LEU HD13 H 1 1.0070 0.0000 . 2 . . . . . 175 LEU HD11 . 53440 2 1115 . 2 . 2 176 176 LEU HD21 H 1 0.7340 0.0000 . 2 . . . . . 175 LEU HD21 . 53440 2 1116 . 2 . 2 176 176 LEU HD22 H 1 0.7340 0.0000 . 2 . . . . . 175 LEU HD21 . 53440 2 1117 . 2 . 2 176 176 LEU HD23 H 1 0.7340 0.0000 . 2 . . . . . 175 LEU HD21 . 53440 2 1118 . 2 . 2 176 176 LEU C C 13 173.6756 0.0000 . 1 . . 35705 . . 175 LEU C . 53440 2 1119 . 2 . 2 176 176 LEU CA C 13 55.2768 0.0000 . 1 . . 35704 . . 175 LEU CA . 53440 2 1120 . 2 . 2 176 176 LEU CB C 13 46.8804 0.0000 . 1 . . 35709 . . 175 LEU CB . 53440 2 1121 . 2 . 2 176 176 LEU CD1 C 13 27.4420 0.0000 . 2 . . . . . 175 LEU CD1 . 53440 2 1122 . 2 . 2 176 176 LEU CD2 C 13 25.6300 0.0000 . 2 . . . . . 175 LEU CD2 . 53440 2 1123 . 2 . 2 176 176 LEU N N 15 126.1502 0.0000 . 1 . . 19321 . . 175 LEU N . 53440 2 1124 . 2 . 2 177 177 SER H H 1 9.1715 0.0000 . 1 . . 25154 . . 176 SER H . 53440 2 1125 . 2 . 2 177 177 SER C C 13 173.3397 0.0000 . 1 . . 41065 . . 176 SER C . 53440 2 1126 . 2 . 2 177 177 SER CA C 13 55.6426 0.0000 . 1 . . 41326 . . 176 SER CA . 53440 2 1127 . 2 . 2 177 177 SER CB C 13 65.0847 0.0000 . 1 . . 41068 . . 176 SER CB . 53440 2 1128 . 2 . 2 177 177 SER N N 15 120.5908 0.0000 . 1 . . 25156 . . 176 SER N . 53440 2 1129 . 2 . 2 178 178 SER H H 1 9.1988 0.0000 . 1 . . 26186 . . 177 SER H . 53440 2 1130 . 2 . 2 178 178 SER C C 13 174.4610 0.0000 . 1 . . 41322 . . 177 SER C . 53440 2 1131 . 2 . 2 178 178 SER CA C 13 56.3047 0.0000 . 1 . . 41324 . . 177 SER CA . 53440 2 1132 . 2 . 2 178 178 SER CB C 13 63.8088 0.0000 . 1 . . 41327 . . 177 SER CB . 53440 2 1133 . 2 . 2 178 178 SER N N 15 120.3577 0.0000 . 1 . . 26188 . . 177 SER N . 53440 2 1134 . 2 . 2 179 179 THR H H 1 8.8777 0.0000 . 1 . . 19406 . . 178 THR H . 53440 2 1135 . 2 . 2 179 179 THR HG21 H 1 0.8900 0.0000 . 1 . . . . . 178 THR HG21 . 53440 2 1136 . 2 . 2 179 179 THR HG22 H 1 0.8900 0.0000 . 1 . . . . . 178 THR HG21 . 53440 2 1137 . 2 . 2 179 179 THR HG23 H 1 0.8900 0.0000 . 1 . . . . . 178 THR HG21 . 53440 2 1138 . 2 . 2 179 179 THR C C 13 173.5214 0.0000 . 1 . . 36412 . . 178 THR C . 53440 2 1139 . 2 . 2 179 179 THR CA C 13 61.2490 0.0000 . 1 . . 36409 . . 178 THR CA . 53440 2 1140 . 2 . 2 179 179 THR CB C 13 69.8846 0.0000 . 1 . . 36414 . . 178 THR CB . 53440 2 1141 . 2 . 2 179 179 THR CG2 C 13 20.4100 0.0000 . 1 . . 51140 . . 178 THR CG2 . 53440 2 1142 . 2 . 2 179 179 THR N N 15 124.9142 0.0000 . 1 . . 19408 . . 178 THR N . 53440 2 1143 . 2 . 2 180 180 LEU H H 1 9.1993 0.0000 . 1 . . 22370 . . 179 LEU H . 53440 2 1144 . 2 . 2 180 180 LEU HD11 H 1 0.3000 0.0000 . 2 . . . . . 179 LEU HD11 . 53440 2 1145 . 2 . 2 180 180 LEU HD12 H 1 0.3000 0.0000 . 2 . . . . . 179 LEU HD11 . 53440 2 1146 . 2 . 2 180 180 LEU HD13 H 1 0.3000 0.0000 . 2 . . . . . 179 LEU HD11 . 53440 2 1147 . 2 . 2 180 180 LEU HD21 H 1 0.2920 0.0000 . 2 . . . . . 179 LEU HD21 . 53440 2 1148 . 2 . 2 180 180 LEU HD22 H 1 0.2920 0.0000 . 2 . . . . . 179 LEU HD21 . 53440 2 1149 . 2 . 2 180 180 LEU HD23 H 1 0.2920 0.0000 . 2 . . . . . 179 LEU HD21 . 53440 2 1150 . 2 . 2 180 180 LEU C C 13 175.0036 0.0000 . 1 . . 33433 . . 179 LEU C . 53440 2 1151 . 2 . 2 180 180 LEU CA C 13 53.3074 0.0000 . 1 . . 33432 . . 179 LEU CA . 53440 2 1152 . 2 . 2 180 180 LEU CB C 13 41.2178 0.0000 . 1 . . 33437 . . 179 LEU CB . 53440 2 1153 . 2 . 2 180 180 LEU CD1 C 13 25.4660 0.0000 . 2 . . . . . 179 LEU CD1 . 53440 2 1154 . 2 . 2 180 180 LEU CD2 C 13 23.4400 0.0000 . 2 . . . . . 179 LEU CD2 . 53440 2 1155 . 2 . 2 180 180 LEU N N 15 134.9435 0.0000 . 1 . . 22372 . . 179 LEU N . 53440 2 1156 . 2 . 2 181 181 THR H H 1 8.0747 0.0000 . 1 . . 19508 . . 180 THR H . 53440 2 1157 . 2 . 2 181 181 THR HG21 H 1 0.9650 0.0000 . 1 . . 55157 . . 180 THR HG21 . 53440 2 1158 . 2 . 2 181 181 THR HG22 H 1 0.9650 0.0000 . 1 . . 55157 . . 180 THR HG21 . 53440 2 1159 . 2 . 2 181 181 THR HG23 H 1 0.9650 0.0000 . 1 . . 55157 . . 180 THR HG21 . 53440 2 1160 . 2 . 2 181 181 THR C C 13 173.2429 0.0000 . 1 . . 38062 . . 180 THR C . 53440 2 1161 . 2 . 2 181 181 THR CA C 13 61.8071 0.0000 . 1 . . 38059 . . 180 THR CA . 53440 2 1162 . 2 . 2 181 181 THR CB C 13 69.4718 0.0000 . 1 . . 38066 . . 180 THR CB . 53440 2 1163 . 2 . 2 181 181 THR CG2 C 13 20.9670 0.0000 . 1 . . 51089 . . 180 THR CG2 . 53440 2 1164 . 2 . 2 181 181 THR N N 15 123.1168 0.0000 . 1 . . 19510 . . 180 THR N . 53440 2 1165 . 2 . 2 182 182 LEU H H 1 8.7922 0.0000 . 1 . . 24737 . . 181 LEU H . 53440 2 1166 . 2 . 2 182 182 LEU HD11 H 1 0.9790 0.0000 . 2 . . . . . 181 LEU HD11 . 53440 2 1167 . 2 . 2 182 182 LEU HD12 H 1 0.9790 0.0000 . 2 . . . . . 181 LEU HD11 . 53440 2 1168 . 2 . 2 182 182 LEU HD13 H 1 0.9790 0.0000 . 2 . . . . . 181 LEU HD11 . 53440 2 1169 . 2 . 2 182 182 LEU HD21 H 1 0.9400 0.0000 . 2 . . . . . 181 LEU HD21 . 53440 2 1170 . 2 . 2 182 182 LEU HD22 H 1 0.9400 0.0000 . 2 . . . . . 181 LEU HD21 . 53440 2 1171 . 2 . 2 182 182 LEU HD23 H 1 0.9400 0.0000 . 2 . . . . . 181 LEU HD21 . 53440 2 1172 . 2 . 2 182 182 LEU C C 13 176.0584 0.0000 . 1 . . 34583 . . 181 LEU C . 53440 2 1173 . 2 . 2 182 182 LEU CA C 13 52.7145 0.0000 . 1 . . 34582 . . 181 LEU CA . 53440 2 1174 . 2 . 2 182 182 LEU CB C 13 46.0982 0.0000 . 1 . . 34587 . . 181 LEU CB . 53440 2 1175 . 2 . 2 182 182 LEU CD1 C 13 27.0990 0.0000 . 2 . . . . . 181 LEU CD1 . 53440 2 1176 . 2 . 2 182 182 LEU CD2 C 13 24.1080 0.0000 . 2 . . . . . 181 LEU CD2 . 53440 2 1177 . 2 . 2 182 182 LEU N N 15 127.6413 0.0000 . 1 . . 24739 . . 181 LEU N . 53440 2 1178 . 2 . 2 183 183 SER H H 1 8.9939 0.0000 . 1 . . 26858 . . 182 SER H . 53440 2 1179 . 2 . 2 183 183 SER C C 13 174.8057 0.0000 . 1 . . 43781 . . 182 SER C . 53440 2 1180 . 2 . 2 183 183 SER CA C 13 57.9575 0.0000 . 1 . . 43778 . . 182 SER CA . 53440 2 1181 . 2 . 2 183 183 SER CB C 13 64.0118 0.0000 . 1 . . 43783 . . 182 SER CB . 53440 2 1182 . 2 . 2 183 183 SER N N 15 116.5700 0.0000 . 1 . . 26860 . . 182 SER N . 53440 2 1183 . 2 . 2 184 184 LYS H H 1 7.9180 0.0000 . 1 . . 25925 . . 183 LYS H . 53440 2 1184 . 2 . 2 184 184 LYS C C 13 177.0252 0.0000 . 1 . . 37545 . . 183 LYS C . 53440 2 1185 . 2 . 2 184 184 LYS CA C 13 60.1607 0.0000 . 1 . . 37547 . . 183 LYS CA . 53440 2 1186 . 2 . 2 184 184 LYS CB C 13 31.8449 0.0000 . 1 . . 37550 . . 183 LYS CB . 53440 2 1187 . 2 . 2 184 184 LYS N N 15 123.5526 0.0000 . 1 . . 25927 . . 183 LYS N . 53440 2 1188 . 2 . 2 185 185 ALA H H 1 8.2471 0.0000 . 1 . . 25244 . . 184 ALA H . 53440 2 1189 . 2 . 2 185 185 ALA HB1 H 1 1.3340 0.0000 . 1 . . 54536 . . 184 ALA HB1 . 53440 2 1190 . 2 . 2 185 185 ALA HB2 H 1 1.3340 0.0000 . 1 . . 54536 . . 184 ALA HB1 . 53440 2 1191 . 2 . 2 185 185 ALA HB3 H 1 1.3340 0.0000 . 1 . . 54536 . . 184 ALA HB1 . 53440 2 1192 . 2 . 2 185 185 ALA C C 13 180.3459 0.0000 . 1 . . 42063 . . 184 ALA C . 53440 2 1193 . 2 . 2 185 185 ALA CA C 13 54.4246 0.0000 . 1 . . 42066 . . 184 ALA CA . 53440 2 1194 . 2 . 2 185 185 ALA CB C 13 17.5037 0.0000 . 1 . . 42067 . . 184 ALA CB . 53440 2 1195 . 2 . 2 185 185 ALA N N 15 118.4429 0.0000 . 1 . . 25246 . . 184 ALA N . 53440 2 1196 . 2 . 2 186 186 ASP H H 1 7.6663 0.0000 . 1 . . 26309 . . 185 ASP H . 53440 2 1197 . 2 . 2 186 186 ASP C C 13 178.5762 0.0000 . 1 . . 42839 . . 185 ASP C . 53440 2 1198 . 2 . 2 186 186 ASP CA C 13 56.8387 0.0000 . 1 . . 42840 . . 185 ASP CA . 53440 2 1199 . 2 . 2 186 186 ASP CB C 13 40.1164 0.0000 . 1 . . 42842 . . 185 ASP CB . 53440 2 1200 . 2 . 2 186 186 ASP N N 15 117.7890 0.0000 . 1 . . 26311 . . 185 ASP N . 53440 2 1201 . 2 . 2 187 187 TYR H H 1 8.6440 0.0000 . 1 . . 26075 . . 186 TYR H . 53440 2 1202 . 2 . 2 187 187 TYR C C 13 179.5367 0.0000 . 1 . . 39527 . . 186 TYR C . 53440 2 1203 . 2 . 2 187 187 TYR CA C 13 58.7438 0.0000 . 1 . . 39525 . . 186 TYR CA . 53440 2 1204 . 2 . 2 187 187 TYR CB C 13 38.6103 0.0000 . 1 . . 39530 . . 186 TYR CB . 53440 2 1205 . 2 . 2 187 187 TYR N N 15 122.0953 0.0000 . 1 . . 26077 . . 186 TYR N . 53440 2 1206 . 2 . 2 188 188 GLU H H 1 7.9912 0.0000 . 1 . . 21245 . . 187 GLU H . 53440 2 1207 . 2 . 2 188 188 GLU C C 13 176.0022 0.0000 . 1 . . 44770 . . 187 GLU C . 53440 2 1208 . 2 . 2 188 188 GLU CA C 13 57.2210 0.0000 . 1 . . 44768 . . 187 GLU CA . 53440 2 1209 . 2 . 2 188 188 GLU CB C 13 28.3647 0.0000 . 1 . . 44772 . . 187 GLU CB . 53440 2 1210 . 2 . 2 188 188 GLU N N 15 114.6463 0.0000 . 1 . . 21247 . . 187 GLU N . 53440 2 1211 . 2 . 2 189 189 LYS H H 1 7.1959 0.0000 . 1 . . 23018 . . 188 LYS H . 53440 2 1212 . 2 . 2 189 189 LYS C C 13 175.8400 0.0000 . 1 . . 43076 . . 188 LYS C . 53440 2 1213 . 2 . 2 189 189 LYS CA C 13 56.4736 0.0000 . 1 . . 43074 . . 188 LYS CA . 53440 2 1214 . 2 . 2 189 189 LYS CB C 13 32.4914 0.0000 . 1 . . 43079 . . 188 LYS CB . 53440 2 1215 . 2 . 2 189 189 LYS N N 15 117.4275 0.0000 . 1 . . 23020 . . 188 LYS N . 53440 2 1216 . 2 . 2 190 190 HIS H H 1 6.9686 0.0000 . 1 . . 26498 . . 189 HIS H . 53440 2 1217 . 2 . 2 190 190 HIS C C 13 173.0765 0.0000 . 1 . . 44553 . . 189 HIS C . 53440 2 1218 . 2 . 2 190 190 HIS CA C 13 53.5908 0.0000 . 1 . . 44554 . . 189 HIS CA . 53440 2 1219 . 2 . 2 190 190 HIS CB C 13 30.6111 0.0000 . 1 . . 44556 . . 189 HIS CB . 53440 2 1220 . 2 . 2 190 190 HIS N N 15 115.2538 0.0000 . 1 . . 26500 . . 189 HIS N . 53440 2 1221 . 2 . 2 191 191 LYS H H 1 9.3596 0.0000 . 1 . . 25034 . . 190 LYS H . 53440 2 1222 . 2 . 2 191 191 LYS C C 13 174.8806 0.0000 . 1 . . 38970 . . 190 LYS C . 53440 2 1223 . 2 . 2 191 191 LYS CA C 13 58.1182 0.0000 . 1 . . 38977 . . 190 LYS CA . 53440 2 1224 . 2 . 2 191 191 LYS CB C 13 34.8027 0.0000 . 1 . . 38976 . . 190 LYS CB . 53440 2 1225 . 2 . 2 191 191 LYS N N 15 122.7669 0.0000 . 1 . . 25036 . . 190 LYS N . 53440 2 1226 . 2 . 2 192 192 VAL H H 1 8.4671 0.0000 . 1 . . 22904 . . 191 VAL H . 53440 2 1227 . 2 . 2 192 192 VAL HG11 H 1 0.9120 0.0000 . 2 . . . . . 191 VAL HG11 . 53440 2 1228 . 2 . 2 192 192 VAL HG12 H 1 0.9120 0.0000 . 2 . . . . . 191 VAL HG11 . 53440 2 1229 . 2 . 2 192 192 VAL HG13 H 1 0.9120 0.0000 . 2 . . . . . 191 VAL HG11 . 53440 2 1230 . 2 . 2 192 192 VAL HG21 H 1 0.7700 0.0000 . 2 . . . . . 191 VAL HG21 . 53440 2 1231 . 2 . 2 192 192 VAL HG22 H 1 0.7700 0.0000 . 2 . . . . . 191 VAL HG21 . 53440 2 1232 . 2 . 2 192 192 VAL HG23 H 1 0.7700 0.0000 . 2 . . . . . 191 VAL HG21 . 53440 2 1233 . 2 . 2 192 192 VAL C C 13 174.5203 0.0000 . 1 . . 41491 . . 191 VAL C . 53440 2 1234 . 2 . 2 192 192 VAL CA C 13 61.6860 0.0000 . 1 . . 41489 . . 191 VAL CA . 53440 2 1235 . 2 . 2 192 192 VAL CB C 13 32.6690 0.0000 . 1 . . 41497 . . 191 VAL CB . 53440 2 1236 . 2 . 2 192 192 VAL CG1 C 13 21.0570 0.0000 . 2 . . . . . 191 VAL CG1 . 53440 2 1237 . 2 . 2 192 192 VAL CG2 C 13 21.1470 0.0000 . 2 . . . . . 191 VAL CG2 . 53440 2 1238 . 2 . 2 192 192 VAL N N 15 120.0613 0.0000 . 1 . . 22906 . . 191 VAL N . 53440 2 1239 . 2 . 2 193 193 TYR H H 1 8.1426 0.0000 . 1 . . 23864 . . 192 TYR H . 53440 2 1240 . 2 . 2 193 193 TYR C C 13 173.6643 0.0000 . 1 . . 34567 . . 192 TYR C . 53440 2 1241 . 2 . 2 193 193 TYR CA C 13 57.6077 0.0000 . 1 . . 34569 . . 192 TYR CA . 53440 2 1242 . 2 . 2 193 193 TYR CB C 13 41.5338 0.0000 . 1 . . 34570 . . 192 TYR CB . 53440 2 1243 . 2 . 2 193 193 TYR N N 15 127.7373 0.0000 . 1 . . 23866 . . 192 TYR N . 53440 2 1244 . 2 . 2 194 194 ALA H H 1 8.7083 0.0000 . 1 . . 24116 . . 193 ALA H . 53440 2 1245 . 2 . 2 194 194 ALA HB1 H 1 1.0680 0.0000 . 1 . . 54635 . . 193 ALA HB1 . 53440 2 1246 . 2 . 2 194 194 ALA HB2 H 1 1.0680 0.0000 . 1 . . 54635 . . 193 ALA HB1 . 53440 2 1247 . 2 . 2 194 194 ALA HB3 H 1 1.0680 0.0000 . 1 . . 54635 . . 193 ALA HB1 . 53440 2 1248 . 2 . 2 194 194 ALA C C 13 174.1093 0.0000 . 1 . . 38837 . . 193 ALA C . 53440 2 1249 . 2 . 2 194 194 ALA CA C 13 50.1432 0.0000 . 1 . . 38840 . . 193 ALA CA . 53440 2 1250 . 2 . 2 194 194 ALA CB C 13 22.4739 0.0000 . 1 . . 38853 . . 193 ALA CB . 53440 2 1251 . 2 . 2 194 194 ALA N N 15 122.8669 0.0000 . 1 . . 24118 . . 193 ALA N . 53440 2 1252 . 2 . 2 195 195 CYS H H 1 8.6130 0.0000 . 1 . . 25181 . . 194 CYS H . 53440 2 1253 . 2 . 2 195 195 CYS C C 13 171.3123 0.0000 . 1 . . 41607 . . 194 CYS C . 53440 2 1254 . 2 . 2 195 195 CYS CA C 13 52.3793 0.0000 . 1 . . 41604 . . 194 CYS CA . 53440 2 1255 . 2 . 2 195 195 CYS CB C 13 44.3454 0.0000 . 1 . . 41610 . . 194 CYS CB . 53440 2 1256 . 2 . 2 195 195 CYS N N 15 119.8918 0.0000 . 1 . . 25183 . . 194 CYS N . 53440 2 1257 . 2 . 2 196 196 GLU H H 1 8.8428 0.0000 . 1 . . 20444 . . 195 GLU H . 53440 2 1258 . 2 . 2 196 196 GLU C C 13 175.7310 0.0000 . 1 . . 35286 . . 195 GLU C . 53440 2 1259 . 2 . 2 196 196 GLU CA C 13 54.1139 0.0000 . 1 . . 35284 . . 195 GLU CA . 53440 2 1260 . 2 . 2 196 196 GLU CB C 13 31.8769 0.0000 . 1 . . 35289 . . 195 GLU CB . 53440 2 1261 . 2 . 2 196 196 GLU N N 15 126.3775 0.0000 . 1 . . 20446 . . 195 GLU N . 53440 2 1262 . 2 . 2 197 197 VAL H H 1 9.3311 0.0000 . 1 . . 22406 . . 196 VAL H . 53440 2 1263 . 2 . 2 197 197 VAL HG11 H 1 0.5470 0.0000 . 2 . . . . . 196 VAL HG11 . 53440 2 1264 . 2 . 2 197 197 VAL HG12 H 1 0.5470 0.0000 . 2 . . . . . 196 VAL HG11 . 53440 2 1265 . 2 . 2 197 197 VAL HG13 H 1 0.5470 0.0000 . 2 . . . . . 196 VAL HG11 . 53440 2 1266 . 2 . 2 197 197 VAL HG21 H 1 0.7270 0.0000 . 2 . . . . . 196 VAL HG21 . 53440 2 1267 . 2 . 2 197 197 VAL HG22 H 1 0.7270 0.0000 . 2 . . . . . 196 VAL HG21 . 53440 2 1268 . 2 . 2 197 197 VAL HG23 H 1 0.7270 0.0000 . 2 . . . . . 196 VAL HG21 . 53440 2 1269 . 2 . 2 197 197 VAL C C 13 174.2757 0.0000 . 1 . . 33637 . . 196 VAL C . 53440 2 1270 . 2 . 2 197 197 VAL CA C 13 61.3368 0.0000 . 1 . . 33634 . . 196 VAL CA . 53440 2 1271 . 2 . 2 197 197 VAL CB C 13 33.8728 0.0000 . 1 . . 33640 . . 196 VAL CB . 53440 2 1272 . 2 . 2 197 197 VAL CG1 C 13 20.9820 0.0000 . 2 . . . . . 196 VAL CG1 . 53440 2 1273 . 2 . 2 197 197 VAL CG2 C 13 22.4720 0.0000 . 2 . . . . . 196 VAL CG2 . 53440 2 1274 . 2 . 2 197 197 VAL N N 15 129.6441 0.0000 . 1 . . 22408 . . 196 VAL N . 53440 2 1275 . 2 . 2 198 198 THR H H 1 8.5749 0.0000 . 1 . . 26165 . . 197 THR H . 53440 2 1276 . 2 . 2 198 198 THR HG21 H 1 1.0660 0.0000 . 1 . . 54989 . . 197 THR HG21 . 53440 2 1277 . 2 . 2 198 198 THR HG22 H 1 1.0660 0.0000 . 1 . . 54989 . . 197 THR HG21 . 53440 2 1278 . 2 . 2 198 198 THR HG23 H 1 1.0660 0.0000 . 1 . . 54989 . . 197 THR HG21 . 53440 2 1279 . 2 . 2 198 198 THR C C 13 173.3778 0.0000 . 1 . . 50157 . . 197 THR C . 53440 2 1280 . 2 . 2 198 198 THR CA C 13 60.7799 0.0000 . 1 . . 50149 . . 197 THR CA . 53440 2 1281 . 2 . 2 198 198 THR CB C 13 69.9628 0.0000 . 1 . . 50161 . . 197 THR CB . 53440 2 1282 . 2 . 2 198 198 THR CG2 C 13 20.6510 0.0000 . 1 . . 51164 . . 197 THR CG2 . 53440 2 1283 . 2 . 2 198 198 THR N N 15 120.6566 0.0000 . 1 . . 26167 . . 197 THR N . 53440 2 1284 . 2 . 2 199 199 HIS H H 1 8.0285 0.0000 . 1 . . 49694 . . 198 HIS H . 53440 2 1285 . 2 . 2 199 199 HIS C C 13 174.9680 0.0000 . 1 . . 48563 . . 198 HIS C . 53440 2 1286 . 2 . 2 199 199 HIS CA C 13 58.1515 0.0000 . 1 . . 35482 . . 198 HIS CA . 53440 2 1287 . 2 . 2 199 199 HIS CB C 13 34.5316 0.0000 . 1 . . 48559 . . 198 HIS CB . 53440 2 1288 . 2 . 2 199 199 HIS N N 15 123.5293 0.0000 . 1 . . 49696 . . 198 HIS N . 53440 2 1289 . 2 . 2 200 200 GLN H H 1 8.1121 0.0000 . 1 . . 23909 . . 199 GLN H . 53440 2 1290 . 2 . 2 200 200 GLN C C 13 176.4995 0.0000 . 1 . . 35485 . . 199 GLN C . 53440 2 1291 . 2 . 2 200 200 GLN CA C 13 58.2132 0.0000 . 1 . . 35484 . . 199 GLN CA . 53440 2 1292 . 2 . 2 200 200 GLN CB C 13 28.7023 0.0000 . 1 . . 35488 . . 199 GLN CB . 53440 2 1293 . 2 . 2 200 200 GLN N N 15 126.3102 0.0000 . 1 . . 23911 . . 199 GLN N . 53440 2 1294 . 2 . 2 201 201 GLY H H 1 10.3573 0.0000 . 1 . . 26690 . . 200 GLY H . 53440 2 1295 . 2 . 2 201 201 GLY C C 13 172.9719 0.0000 . 1 . . 47805 . . 200 GLY C . 53440 2 1296 . 2 . 2 201 201 GLY CA C 13 45.0547 0.0000 . 1 . . 47803 . . 200 GLY CA . 53440 2 1297 . 2 . 2 201 201 GLY N N 15 110.1599 0.0000 . 1 . . 26692 . . 200 GLY N . 53440 2 1298 . 2 . 2 202 202 LEU H H 1 8.0218 0.0000 . 1 . . 26096 . . 201 LEU H . 53440 2 1299 . 2 . 2 202 202 LEU HD11 H 1 0.9280 0.0000 . 2 . . . . . 201 LEU HD11 . 53440 2 1300 . 2 . 2 202 202 LEU HD12 H 1 0.9280 0.0000 . 2 . . . . . 201 LEU HD11 . 53440 2 1301 . 2 . 2 202 202 LEU HD13 H 1 0.9280 0.0000 . 2 . . . . . 201 LEU HD11 . 53440 2 1302 . 2 . 2 202 202 LEU HD21 H 1 0.9900 0.0000 . 2 . . . . . 201 LEU HD21 . 53440 2 1303 . 2 . 2 202 202 LEU HD22 H 1 0.9900 0.0000 . 2 . . . . . 201 LEU HD21 . 53440 2 1304 . 2 . 2 202 202 LEU HD23 H 1 0.9900 0.0000 . 2 . . . . . 201 LEU HD21 . 53440 2 1305 . 2 . 2 202 202 LEU C C 13 176.7398 0.0000 . 1 . . 39707 . . 201 LEU C . 53440 2 1306 . 2 . 2 202 202 LEU CA C 13 52.7183 0.0000 . 1 . . 39709 . . 201 LEU CA . 53440 2 1307 . 2 . 2 202 202 LEU CB C 13 41.9939 0.0000 . 1 . . 39711 . . 201 LEU CB . 53440 2 1308 . 2 . 2 202 202 LEU CD1 C 13 26.2110 0.0000 . 2 . . . . . 201 LEU CD1 . 53440 2 1309 . 2 . 2 202 202 LEU CD2 C 13 23.3450 0.0000 . 2 . . . . . 201 LEU CD2 . 53440 2 1310 . 2 . 2 202 202 LEU N N 15 122.0679 0.0000 . 1 . . 26098 . . 201 LEU N . 53440 2 1311 . 2 . 2 203 203 SER H H 1 8.8052 0.0000 . 1 . . 22919 . . 202 SER H . 53440 2 1312 . 2 . 2 203 203 SER C C 13 174.3379 0.0000 . 1 . . 41674 . . 202 SER C . 53440 2 1313 . 2 . 2 203 203 SER CA C 13 60.2028 0.0000 . 1 . . 41671 . . 202 SER CA . 53440 2 1314 . 2 . 2 203 203 SER CB C 13 62.7396 0.0000 . 1 . . 41678 . . 202 SER CB . 53440 2 1315 . 2 . 2 203 203 SER N N 15 119.3684 0.0000 . 1 . . 22921 . . 202 SER N . 53440 2 1316 . 2 . 2 204 204 SER H H 1 7.5301 0.0000 . 1 . . 25361 . . 203 SER H . 53440 2 1317 . 2 . 2 204 204 SER C C 13 170.7846 0.0000 . 1 . . 44581 . . 203 SER C . 53440 2 1318 . 2 . 2 204 204 SER CA C 13 55.9903 0.0000 . 1 . . 44584 . . 203 SER CA . 53440 2 1319 . 2 . 2 204 204 SER CB C 13 63.6468 0.0000 . 1 . . 44585 . . 203 SER CB . 53440 2 1320 . 2 . 2 204 204 SER N N 15 115.2291 0.0000 . 1 . . 25363 . . 203 SER N . 53440 2 1321 . 2 . 2 205 205 PRO C C 13 177.4765 0.0000 . 1 . . 37375 . . 204 PRO C . 53440 2 1322 . 2 . 2 205 205 PRO CA C 13 63.2797 0.0000 . 1 . . 37376 . . 204 PRO CA . 53440 2 1323 . 2 . 2 205 205 PRO CB C 13 31.0641 0.0000 . 1 . . 37383 . . 204 PRO CB . 53440 2 1324 . 2 . 2 206 206 VAL H H 1 8.4558 0.0000 . 1 . . 22697 . . 205 VAL H . 53440 2 1325 . 2 . 2 206 206 VAL HG11 H 1 1.0430 0.0000 . 2 . . . . . 205 VAL HG11 . 53440 2 1326 . 2 . 2 206 206 VAL HG12 H 1 1.0430 0.0000 . 2 . . . . . 205 VAL HG11 . 53440 2 1327 . 2 . 2 206 206 VAL HG13 H 1 1.0430 0.0000 . 2 . . . . . 205 VAL HG11 . 53440 2 1328 . 2 . 2 206 206 VAL HG21 H 1 0.8350 0.0000 . 2 . . . . . 205 VAL HG21 . 53440 2 1329 . 2 . 2 206 206 VAL HG22 H 1 0.8350 0.0000 . 2 . . . . . 205 VAL HG21 . 53440 2 1330 . 2 . 2 206 206 VAL HG23 H 1 0.8350 0.0000 . 2 . . . . . 205 VAL HG21 . 53440 2 1331 . 2 . 2 206 206 VAL C C 13 174.4418 0.0000 . 1 . . 37380 . . 205 VAL C . 53440 2 1332 . 2 . 2 206 206 VAL CA C 13 60.4617 0.0000 . 1 . . 37378 . . 205 VAL CA . 53440 2 1333 . 2 . 2 206 206 VAL CB C 13 34.1427 0.0000 . 1 . . 37386 . . 205 VAL CB . 53440 2 1334 . 2 . 2 206 206 VAL CG1 C 13 22.5700 0.0000 . 2 . . . . . 205 VAL CG1 . 53440 2 1335 . 2 . 2 206 206 VAL CG2 C 13 20.7680 0.0000 . 2 . . . . . 205 VAL CG2 . 53440 2 1336 . 2 . 2 206 206 VAL N N 15 123.8675 0.0000 . 1 . . 22699 . . 205 VAL N . 53440 2 1337 . 2 . 2 207 207 THR H H 1 8.3852 0.0000 . 1 . . 25067 . . 206 THR H . 53440 2 1338 . 2 . 2 207 207 THR HG21 H 1 0.9870 0.0000 . 1 . . 54725 . . 206 THR HG21 . 53440 2 1339 . 2 . 2 207 207 THR HG22 H 1 0.9870 0.0000 . 1 . . 54725 . . 206 THR HG21 . 53440 2 1340 . 2 . 2 207 207 THR HG23 H 1 0.9870 0.0000 . 1 . . 54725 . . 206 THR HG21 . 53440 2 1341 . 2 . 2 207 207 THR CA C 13 60.9351 0.0000 . 1 . . 39315 . . 206 THR CA . 53440 2 1342 . 2 . 2 207 207 THR CB C 13 69.5898 0.0000 . 1 . . 39316 . . 206 THR CB . 53440 2 1343 . 2 . 2 207 207 THR CG2 C 13 21.4370 0.0000 . 1 . . 51005 . . 206 THR CG2 . 53440 2 1344 . 2 . 2 207 207 THR N N 15 122.5241 0.0000 . 1 . . 25069 . . 206 THR N . 53440 2 1345 . 2 . 2 208 208 LYS H H 1 8.5929 0.0000 . 1 . . 24761 . . 207 LYS H . 53440 2 1346 . 2 . 2 208 208 LYS C C 13 174.3322 0.0000 . 1 . . 34736 . . 207 LYS C . 53440 2 1347 . 2 . 2 208 208 LYS CA C 13 52.7440 0.0000 . 1 . . 34735 . . 207 LYS CA . 53440 2 1348 . 2 . 2 208 208 LYS CB C 13 32.9328 0.0000 . 1 . . 34740 . . 207 LYS CB . 53440 2 1349 . 2 . 2 208 208 LYS N N 15 127.4328 0.0000 . 1 . . 24763 . . 207 LYS N . 53440 2 1350 . 2 . 2 209 209 SER H H 1 8.5154 0.0000 . 1 . . 25331 . . 208 SER H . 53440 2 1351 . 2 . 2 209 209 SER C C 13 173.2161 0.0000 . 1 . . 43698 . . 208 SER C . 53440 2 1352 . 2 . 2 209 209 SER CA C 13 56.7588 0.0000 . 1 . . 43696 . . 208 SER CA . 53440 2 1353 . 2 . 2 209 209 SER CB C 13 67.7988 0.0000 . 1 . . 43701 . . 208 SER CB . 53440 2 1354 . 2 . 2 209 209 SER N N 15 116.9275 0.0000 . 1 . . 25333 . . 208 SER N . 53440 2 1355 . 2 . 2 210 210 PHE H H 1 8.7053 0.0000 . 1 . . 19967 . . 209 PHE H . 53440 2 1356 . 2 . 2 210 210 PHE C C 13 171.5560 0.0000 . 1 . . 43943 . . 209 PHE C . 53440 2 1357 . 2 . 2 210 210 PHE CA C 13 56.7433 0.0000 . 1 . . 43950 . . 209 PHE CA . 53440 2 1358 . 2 . 2 210 210 PHE CB C 13 41.3811 0.0000 . 1 . . 43945 . . 209 PHE CB . 53440 2 1359 . 2 . 2 210 210 PHE N N 15 116.4797 0.0000 . 1 . . 19969 . . 209 PHE N . 53440 2 1360 . 2 . 2 211 211 ASN H H 1 8.6999 0.0000 . 1 . . 25214 . . 210 ASN H . 53440 2 1361 . 2 . 2 211 211 ASN C C 13 176.0711 0.0000 . 1 . . 41937 . . 210 ASN C . 53440 2 1362 . 2 . 2 211 211 ASN CA C 13 50.3263 0.0000 . 1 . . 41936 . . 210 ASN CA . 53440 2 1363 . 2 . 2 211 211 ASN CB C 13 39.0642 0.0000 . 1 . . 41953 . . 210 ASN CB . 53440 2 1364 . 2 . 2 211 211 ASN N N 15 119.0184 0.0000 . 1 . . 25216 . . 210 ASN N . 53440 2 1365 . 2 . 2 212 212 ARG H H 1 9.6389 0.0000 . 1 . . 22511 . . 211 ARG H . 53440 2 1366 . 2 . 2 212 212 ARG C C 13 177.0840 0.0000 . 1 . . 34659 . . 211 ARG C . 53440 2 1367 . 2 . 2 212 212 ARG CA C 13 58.3862 0.0000 . 1 . . 34661 . . 211 ARG CA . 53440 2 1368 . 2 . 2 212 212 ARG CB C 13 29.4225 0.0000 . 1 . . 34663 . . 211 ARG CB . 53440 2 1369 . 2 . 2 212 212 ARG N N 15 127.2926 0.0000 . 1 . . 22513 . . 211 ARG N . 53440 2 1370 . 2 . 2 213 213 GLY H H 1 8.9896 0.0000 . 1 . . 23645 . . 212 GLY H . 53440 2 1371 . 2 . 2 213 213 GLY C C 13 174.4319 0.0000 . 1 . . 45406 . . 212 GLY C . 53440 2 1372 . 2 . 2 213 213 GLY CA C 13 44.9723 0.0000 . 1 . . 45405 . . 212 GLY CA . 53440 2 1373 . 2 . 2 213 213 GLY N N 15 114.2174 0.0000 . 1 . . 23647 . . 212 GLY N . 53440 2 1374 . 2 . 2 214 214 GLU H H 1 7.9038 0.0000 . 1 . . 19691 . . 213 GLU H . 53440 2 1375 . 2 . 2 214 214 GLU C C 13 175.5515 0.0000 . 1 . . 40679 . . 213 GLU C . 53440 2 1376 . 2 . 2 214 214 GLU CA C 13 55.8724 0.0000 . 1 . . 40677 . . 213 GLU CA . 53440 2 1377 . 2 . 2 214 214 GLU CB C 13 30.5218 0.0000 . 1 . . 40683 . . 213 GLU CB . 53440 2 1378 . 2 . 2 214 214 GLU N N 15 120.7767 0.0000 . 1 . . 19693 . . 213 GLU N . 53440 2 1379 . 2 . 2 215 215 CYS H H 1 8.1397 0.0000 . 1 . . 23975 . . 214 CYS H . 53440 2 1380 . 2 . 2 215 215 CYS C C 13 178.9018 0.0000 . 1 . . 36383 . . 214 CYS C . 53440 2 1381 . 2 . 2 215 215 CYS CA C 13 57.7219 0.0000 . 1 . . 36385 . . 214 CYS CA . 53440 2 1382 . 2 . 2 215 215 CYS CB C 13 43.4145 0.0000 . 1 . . 36388 . . 214 CYS CB . 53440 2 1383 . 2 . 2 215 215 CYS N N 15 125.0209 0.0000 . 1 . . 23977 . . 214 CYS N . 53440 2 stop_ save_