data_51256 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51256 _Entry.Title ; Inter-domain flexibility of human SRSF1 tandem RRMs allows flexibility in RNA binding ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2022-01-03 _Entry.Accession_date 2022-01-03 _Entry.Last_release_date 2022-01-03 _Entry.Original_release_date 2022-01-03 _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 1 _Entry.Generated_software_label $software_1 _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 'Naiduwadura Ivon' 'De Silva' . U. . . 51256 2 Jun Zhang . . . . 51256 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 51256 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 485 51256 '15N chemical shifts' 164 51256 '1H chemical shifts' 164 51256 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 . . 2023-02-16 . original BMRB . 51256 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51256 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 36454680 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Inter-domain Flexibility of Human Ser/Arg-Rich Splicing Factor 1 Allows Variable Spacer Length in Cognate RNA's Bipartite Motifs ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full Biochemistry _Citation.Journal_volume 61 _Citation.Journal_issue 24 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1520-4995 _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 2922 _Citation.Page_last 2932 _Citation.Year 2022 _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 'Naiduwadura Ivon Upekala' 'De Silva' . . . . 51256 1 2 Talia Fargason T. . . . 51256 1 3 Zihan Zhang Z. . . . 51256 1 4 Ting Wang T. . . . 51256 1 5 Jun Zhang J. . . . 51256 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51256 _Assembly.ID 1 _Assembly.Name 'RNA bound protein' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _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 . _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 Protein 1 $entity_1 . . yes native no no . . . 51256 1 2 RNA 2 $entity_2 . . no native no no . . . 51256 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51256 _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 ; MSGGGVIRGPAGNNDCRIYV GNLPPDIRTKDIEDVFYKYG AIRDIDLKNRRGGPPFAFVE FEDPRDAEDAVYGRDGYDYD GYRLRVEFPRSGRGTGRGGG GGGGGGAPRGRYGPPSRRSE NRVVVSGLPPSGSWQDLKDH MREAGDVCYADVYRDGTGVV EFVRKEDMTYAVRKLDNTKF RSHEGETAYIRVKVDG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 196 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 51256 1 2 . SER . 51256 1 3 . GLY . 51256 1 4 . GLY . 51256 1 5 . GLY . 51256 1 6 . VAL . 51256 1 7 . ILE . 51256 1 8 . ARG . 51256 1 9 . GLY . 51256 1 10 . PRO . 51256 1 11 . ALA . 51256 1 12 . GLY . 51256 1 13 . ASN . 51256 1 14 . ASN . 51256 1 15 . ASP . 51256 1 16 . CYS . 51256 1 17 . ARG . 51256 1 18 . ILE . 51256 1 19 . TYR . 51256 1 20 . VAL . 51256 1 21 . GLY . 51256 1 22 . ASN . 51256 1 23 . LEU . 51256 1 24 . PRO . 51256 1 25 . PRO . 51256 1 26 . ASP . 51256 1 27 . ILE . 51256 1 28 . ARG . 51256 1 29 . THR . 51256 1 30 . LYS . 51256 1 31 . ASP . 51256 1 32 . ILE . 51256 1 33 . GLU . 51256 1 34 . ASP . 51256 1 35 . VAL . 51256 1 36 . PHE . 51256 1 37 . TYR . 51256 1 38 . LYS . 51256 1 39 . TYR . 51256 1 40 . GLY . 51256 1 41 . ALA . 51256 1 42 . ILE . 51256 1 43 . ARG . 51256 1 44 . ASP . 51256 1 45 . ILE . 51256 1 46 . ASP . 51256 1 47 . LEU . 51256 1 48 . LYS . 51256 1 49 . ASN . 51256 1 50 . ARG . 51256 1 51 . ARG . 51256 1 52 . GLY . 51256 1 53 . GLY . 51256 1 54 . PRO . 51256 1 55 . PRO . 51256 1 56 . PHE . 51256 1 57 . ALA . 51256 1 58 . PHE . 51256 1 59 . VAL . 51256 1 60 . GLU . 51256 1 61 . PHE . 51256 1 62 . GLU . 51256 1 63 . ASP . 51256 1 64 . PRO . 51256 1 65 . ARG . 51256 1 66 . ASP . 51256 1 67 . ALA . 51256 1 68 . GLU . 51256 1 69 . ASP . 51256 1 70 . ALA . 51256 1 71 . VAL . 51256 1 72 . TYR . 51256 1 73 . GLY . 51256 1 74 . ARG . 51256 1 75 . ASP . 51256 1 76 . GLY . 51256 1 77 . TYR . 51256 1 78 . ASP . 51256 1 79 . TYR . 51256 1 80 . ASP . 51256 1 81 . GLY . 51256 1 82 . TYR . 51256 1 83 . ARG . 51256 1 84 . LEU . 51256 1 85 . ARG . 51256 1 86 . VAL . 51256 1 87 . GLU . 51256 1 88 . PHE . 51256 1 89 . PRO . 51256 1 90 . ARG . 51256 1 91 . SER . 51256 1 92 . GLY . 51256 1 93 . ARG . 51256 1 94 . GLY . 51256 1 95 . THR . 51256 1 96 . GLY . 51256 1 97 . ARG . 51256 1 98 . GLY . 51256 1 99 . GLY . 51256 1 100 . GLY . 51256 1 101 . GLY . 51256 1 102 . GLY . 51256 1 103 . GLY . 51256 1 104 . GLY . 51256 1 105 . GLY . 51256 1 106 . GLY . 51256 1 107 . ALA . 51256 1 108 . PRO . 51256 1 109 . ARG . 51256 1 110 . GLY . 51256 1 111 . ARG . 51256 1 112 . TYR . 51256 1 113 . GLY . 51256 1 114 . PRO . 51256 1 115 . PRO . 51256 1 116 . SER . 51256 1 117 . ARG . 51256 1 118 . ARG . 51256 1 119 . SER . 51256 1 120 . GLU . 51256 1 121 . ASN . 51256 1 122 . ARG . 51256 1 123 . VAL . 51256 1 124 . VAL . 51256 1 125 . VAL . 51256 1 126 . SER . 51256 1 127 . GLY . 51256 1 128 . LEU . 51256 1 129 . PRO . 51256 1 130 . PRO . 51256 1 131 . SER . 51256 1 132 . GLY . 51256 1 133 . SER . 51256 1 134 . TRP . 51256 1 135 . GLN . 51256 1 136 . ASP . 51256 1 137 . LEU . 51256 1 138 . LYS . 51256 1 139 . ASP . 51256 1 140 . HIS . 51256 1 141 . MET . 51256 1 142 . ARG . 51256 1 143 . GLU . 51256 1 144 . ALA . 51256 1 145 . GLY . 51256 1 146 . ASP . 51256 1 147 . VAL . 51256 1 148 . CYS . 51256 1 149 . TYR . 51256 1 150 . ALA . 51256 1 151 . ASP . 51256 1 152 . VAL . 51256 1 153 . TYR . 51256 1 154 . ARG . 51256 1 155 . ASP . 51256 1 156 . GLY . 51256 1 157 . THR . 51256 1 158 . GLY . 51256 1 159 . VAL . 51256 1 160 . VAL . 51256 1 161 . GLU . 51256 1 162 . PHE . 51256 1 163 . VAL . 51256 1 164 . ARG . 51256 1 165 . LYS . 51256 1 166 . GLU . 51256 1 167 . ASP . 51256 1 168 . MET . 51256 1 169 . THR . 51256 1 170 . TYR . 51256 1 171 . ALA . 51256 1 172 . VAL . 51256 1 173 . ARG . 51256 1 174 . LYS . 51256 1 175 . LEU . 51256 1 176 . ASP . 51256 1 177 . ASN . 51256 1 178 . THR . 51256 1 179 . LYS . 51256 1 180 . PHE . 51256 1 181 . ARG . 51256 1 182 . SER . 51256 1 183 . HIS . 51256 1 184 . GLU . 51256 1 185 . GLY . 51256 1 186 . GLU . 51256 1 187 . THR . 51256 1 188 . ALA . 51256 1 189 . TYR . 51256 1 190 . ILE . 51256 1 191 . ARG . 51256 1 192 . VAL . 51256 1 193 . LYS . 51256 1 194 . VAL . 51256 1 195 . ASP . 51256 1 196 . GLY . 51256 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 51256 1 . SER 2 2 51256 1 . GLY 3 3 51256 1 . GLY 4 4 51256 1 . GLY 5 5 51256 1 . VAL 6 6 51256 1 . ILE 7 7 51256 1 . ARG 8 8 51256 1 . GLY 9 9 51256 1 . PRO 10 10 51256 1 . ALA 11 11 51256 1 . GLY 12 12 51256 1 . ASN 13 13 51256 1 . ASN 14 14 51256 1 . ASP 15 15 51256 1 . CYS 16 16 51256 1 . ARG 17 17 51256 1 . ILE 18 18 51256 1 . TYR 19 19 51256 1 . VAL 20 20 51256 1 . GLY 21 21 51256 1 . ASN 22 22 51256 1 . LEU 23 23 51256 1 . PRO 24 24 51256 1 . PRO 25 25 51256 1 . ASP 26 26 51256 1 . ILE 27 27 51256 1 . ARG 28 28 51256 1 . THR 29 29 51256 1 . LYS 30 30 51256 1 . ASP 31 31 51256 1 . ILE 32 32 51256 1 . GLU 33 33 51256 1 . ASP 34 34 51256 1 . VAL 35 35 51256 1 . PHE 36 36 51256 1 . TYR 37 37 51256 1 . LYS 38 38 51256 1 . TYR 39 39 51256 1 . GLY 40 40 51256 1 . ALA 41 41 51256 1 . ILE 42 42 51256 1 . ARG 43 43 51256 1 . ASP 44 44 51256 1 . ILE 45 45 51256 1 . ASP 46 46 51256 1 . LEU 47 47 51256 1 . LYS 48 48 51256 1 . ASN 49 49 51256 1 . ARG 50 50 51256 1 . ARG 51 51 51256 1 . GLY 52 52 51256 1 . GLY 53 53 51256 1 . PRO 54 54 51256 1 . PRO 55 55 51256 1 . PHE 56 56 51256 1 . ALA 57 57 51256 1 . PHE 58 58 51256 1 . VAL 59 59 51256 1 . GLU 60 60 51256 1 . PHE 61 61 51256 1 . GLU 62 62 51256 1 . ASP 63 63 51256 1 . PRO 64 64 51256 1 . ARG 65 65 51256 1 . ASP 66 66 51256 1 . ALA 67 67 51256 1 . GLU 68 68 51256 1 . ASP 69 69 51256 1 . ALA 70 70 51256 1 . VAL 71 71 51256 1 . TYR 72 72 51256 1 . GLY 73 73 51256 1 . ARG 74 74 51256 1 . ASP 75 75 51256 1 . GLY 76 76 51256 1 . TYR 77 77 51256 1 . ASP 78 78 51256 1 . TYR 79 79 51256 1 . ASP 80 80 51256 1 . GLY 81 81 51256 1 . TYR 82 82 51256 1 . ARG 83 83 51256 1 . LEU 84 84 51256 1 . ARG 85 85 51256 1 . VAL 86 86 51256 1 . GLU 87 87 51256 1 . PHE 88 88 51256 1 . PRO 89 89 51256 1 . ARG 90 90 51256 1 . SER 91 91 51256 1 . GLY 92 92 51256 1 . ARG 93 93 51256 1 . GLY 94 94 51256 1 . THR 95 95 51256 1 . GLY 96 96 51256 1 . ARG 97 97 51256 1 . GLY 98 98 51256 1 . GLY 99 99 51256 1 . GLY 100 100 51256 1 . GLY 101 101 51256 1 . GLY 102 102 51256 1 . GLY 103 103 51256 1 . GLY 104 104 51256 1 . GLY 105 105 51256 1 . GLY 106 106 51256 1 . ALA 107 107 51256 1 . PRO 108 108 51256 1 . ARG 109 109 51256 1 . GLY 110 110 51256 1 . ARG 111 111 51256 1 . TYR 112 112 51256 1 . GLY 113 113 51256 1 . PRO 114 114 51256 1 . PRO 115 115 51256 1 . SER 116 116 51256 1 . ARG 117 117 51256 1 . ARG 118 118 51256 1 . SER 119 119 51256 1 . GLU 120 120 51256 1 . ASN 121 121 51256 1 . ARG 122 122 51256 1 . VAL 123 123 51256 1 . VAL 124 124 51256 1 . VAL 125 125 51256 1 . SER 126 126 51256 1 . GLY 127 127 51256 1 . LEU 128 128 51256 1 . PRO 129 129 51256 1 . PRO 130 130 51256 1 . SER 131 131 51256 1 . GLY 132 132 51256 1 . SER 133 133 51256 1 . TRP 134 134 51256 1 . GLN 135 135 51256 1 . ASP 136 136 51256 1 . LEU 137 137 51256 1 . LYS 138 138 51256 1 . ASP 139 139 51256 1 . HIS 140 140 51256 1 . MET 141 141 51256 1 . ARG 142 142 51256 1 . GLU 143 143 51256 1 . ALA 144 144 51256 1 . GLY 145 145 51256 1 . ASP 146 146 51256 1 . VAL 147 147 51256 1 . CYS 148 148 51256 1 . TYR 149 149 51256 1 . ALA 150 150 51256 1 . ASP 151 151 51256 1 . VAL 152 152 51256 1 . TYR 153 153 51256 1 . ARG 154 154 51256 1 . ASP 155 155 51256 1 . GLY 156 156 51256 1 . THR 157 157 51256 1 . GLY 158 158 51256 1 . VAL 159 159 51256 1 . VAL 160 160 51256 1 . GLU 161 161 51256 1 . PHE 162 162 51256 1 . VAL 163 163 51256 1 . ARG 164 164 51256 1 . LYS 165 165 51256 1 . GLU 166 166 51256 1 . ASP 167 167 51256 1 . MET 168 168 51256 1 . THR 169 169 51256 1 . TYR 170 170 51256 1 . ALA 171 171 51256 1 . VAL 172 172 51256 1 . ARG 173 173 51256 1 . LYS 174 174 51256 1 . LEU 175 175 51256 1 . ASP 176 176 51256 1 . ASN 177 177 51256 1 . THR 178 178 51256 1 . LYS 179 179 51256 1 . PHE 180 180 51256 1 . ARG 181 181 51256 1 . SER 182 182 51256 1 . HIS 183 183 51256 1 . GLU 184 184 51256 1 . GLY 185 185 51256 1 . GLU 186 186 51256 1 . THR 187 187 51256 1 . ALA 188 188 51256 1 . TYR 189 189 51256 1 . ILE 190 190 51256 1 . ARG 191 191 51256 1 . VAL 192 192 51256 1 . LYS 193 193 51256 1 . VAL 194 194 51256 1 . ASP 195 195 51256 1 . GLY 196 196 51256 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 51256 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; UCAGAGGA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 8 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not available' _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . U . 51256 2 2 . C . 51256 2 3 . A . 51256 2 4 . G . 51256 2 5 . A . 51256 2 6 . G . 51256 2 7 . G . 51256 2 8 . A . 51256 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 . U 1 1 51256 2 . C 2 2 51256 2 . A 3 3 51256 2 . G 4 4 51256 2 . A 5 5 51256 2 . G 6 6 51256 2 . G 7 7 51256 2 . A 8 8 51256 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 51256 _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 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 51256 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 51256 _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 'BL21-CodonPlus (DE3)' . . plasmid . . pSMT3 . . . 51256 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51256 _Sample.ID 1 _Sample.Name SRSF1_1-196_8mer_UCAGAGGA _Sample.Type solution _Sample.Sub_type . _Sample.Details '436uM SRSF1_1-196, 620 uM UCAGAGGA RNA, 20 mM MES, pH 6.2, 380 mM Arg/Glu Acid, 5% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 SRSF1_1-196 '[U-13C; U-15N; U-2H]' . . 1 $entity_1 . . 436 . . uM . . . . 51256 1 2 'Single stranded 8mer RNA' 'natural abundance' . . 2 $entity_2 . . 620 . . uM . . . . 51256 1 3 MES 'natural abundance' . . . . . . 20 . . mM . . . . 51256 1 4 'Arg/Glu Acid' 'natural abundance' . . . . . . 380 . . mM . . . . 51256 1 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 51256 _Sample_condition_list.ID 1 _Sample_condition_list.Name SRSF1_1-196_8mer_UCAGAGGA _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.2 . pH 51256 1 temperature 310 . K 51256 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51256 _Software.ID 1 _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' . 51256 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 51256 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name '850MHz NMR spectrometer installed with a cryo-probe' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III HD' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 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 51256 _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 '3D CBCANH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51256 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51256 1 3 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51256 1 4 '3D HN(CA)CO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51256 1 5 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51256 1 6 '3D HN(CO)CA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51256 1 7 '2D 1H-15N TROSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51256 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 51256 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name '1H, 13C, 15N,' _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 glucose 'methyl carbons' . . . . ppm 0 na direct 1 . . . . . 51256 1 H 1 TMS 'methyl protons' . . . . ppm 0 na direct 1 . . . . . 51256 1 N 15 '[15N] ammonium chloride' nitrogen . . . . ppm 0 na direct 1 . . . . . 51256 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 51256 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name SRSF1_1-196_8mer _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 '3D CBCANH' . . . 51256 1 2 '3D CBCA(CO)NH' . . . 51256 1 3 '3D HNCO' . . . 51256 1 4 '3D HN(CA)CO' . . . 51256 1 5 '3D HNCA' . . . 51256 1 6 '3D HN(CO)CA' . . . 51256 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 . . 51256 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 1 1 MET C C 13 176.1407 0.0000 . 1 . . 327593 . . 1 MET C . 51256 1 2 . 1 . 1 1 1 MET CA C 13 55.4205 0.0000 . 1 . . 342479 . . 1 MET CA . 51256 1 3 . 1 . 1 1 1 MET CB C 13 32.1954 0.0000 . 1 . . 326090 . . 1 MET CB . 51256 1 4 . 1 . 1 2 2 SER H H 1 8.2918 0.0000 . 1 . . 328755 . . 2 SER H . 51256 1 5 . 1 . 1 2 2 SER CA C 13 58.2582 0.0000 . 1 . . -1 . . 2 SER CA . 51256 1 6 . 1 . 1 2 2 SER CB C 13 63.7645 0.0000 . 1 . . -1 . . 2 SER CB . 51256 1 7 . 1 . 1 2 2 SER N N 15 117.5294 0.0000 . 1 . . 328756 . . 2 SER N . 51256 1 8 . 1 . 1 3 3 GLY H H 1 8.2800 0.0000 . 1 . . 329667 . . 3 GLY H . 51256 1 9 . 1 . 1 3 3 GLY C C 13 174.6005 0.0000 . 1 . . 327848 . . 3 GLY C . 51256 1 10 . 1 . 1 3 3 GLY CA C 13 44.6762 0.0000 . 1 . . 330104 . . 3 GLY CA . 51256 1 11 . 1 . 1 3 3 GLY N N 15 111.2760 0.0000 . 1 . . 329668 . . 3 GLY N . 51256 1 12 . 1 . 1 4 4 GLY H H 1 8.1317 0.0000 . 1 . . 327846 . . 4 GLY H . 51256 1 13 . 1 . 1 4 4 GLY C C 13 174.5718 0.0000 . 1 . . 327845 . . 4 GLY C . 51256 1 14 . 1 . 1 4 4 GLY CA C 13 44.9209 0.0000 . 1 . . 326576 . . 4 GLY CA . 51256 1 15 . 1 . 1 4 4 GLY N N 15 108.9684 0.0000 . 1 . . 327847 . . 4 GLY N . 51256 1 16 . 1 . 1 5 5 GLY H H 1 8.1024 0.0000 . 1 . . 329004 . . 5 GLY H . 51256 1 17 . 1 . 1 5 5 GLY C C 13 173.7770 0.0000 . 1 . . 327467 . . 5 GLY C . 51256 1 18 . 1 . 1 5 5 GLY CA C 13 44.9209 0.0000 . 1 . . 329009 . . 5 GLY CA . 51256 1 19 . 1 . 1 5 5 GLY N N 15 109.0334 0.0000 . 1 . . 329005 . . 5 GLY N . 51256 1 20 . 1 . 1 6 6 VAL H H 1 7.7561 0.0000 . 1 . . 324810 . . 6 VAL H . 51256 1 21 . 1 . 1 6 6 VAL C C 13 175.8840 0.0000 . 1 . . 334367 . . 6 VAL C . 51256 1 22 . 1 . 1 6 6 VAL CA C 13 61.8067 0.0000 . 1 . . 324812 . . 6 VAL CA . 51256 1 23 . 1 . 1 6 6 VAL CB C 13 31.9507 0.0000 . 1 . . 334363 . . 6 VAL CB . 51256 1 24 . 1 . 1 6 6 VAL N N 15 119.7568 0.0000 . 1 . . 324811 . . 6 VAL N . 51256 1 25 . 1 . 1 7 7 ILE H H 1 8.0505 0.0000 . 1 . . 326475 . . 7 ILE H . 51256 1 26 . 1 . 1 7 7 ILE C C 13 175.8412 0.0000 . 1 . . 327152 . . 7 ILE C . 51256 1 27 . 1 . 1 7 7 ILE CA C 13 60.2903 0.0000 . 1 . . 332006 . . 7 ILE CA . 51256 1 28 . 1 . 1 7 7 ILE CB C 13 37.4263 0.0000 . 1 . . 334403 . . 7 ILE CB . 51256 1 29 . 1 . 1 7 7 ILE N N 15 125.4226 0.0000 . 1 . . 326476 . . 7 ILE N . 51256 1 30 . 1 . 1 8 8 ARG H H 1 8.2273 0.0000 . 1 . . 329244 . . 8 ARG H . 51256 1 31 . 1 . 1 8 8 ARG C C 13 176.0338 0.0000 . 1 . . 327149 . . 8 ARG C . 51256 1 32 . 1 . 1 8 8 ARG CA C 13 55.3289 0.0000 . 1 . . 328175 . . 8 ARG CA . 51256 1 33 . 1 . 1 8 8 ARG CB C 13 29.9493 0.0000 . 1 . . 325433 . . 8 ARG CB . 51256 1 34 . 1 . 1 8 8 ARG N N 15 126.1756 0.0000 . 1 . . 329245 . . 8 ARG N . 51256 1 35 . 1 . 1 9 9 GLY H H 1 8.0178 0.0000 . 1 . . 325716 . . 9 GLY H . 51256 1 36 . 1 . 1 9 9 GLY C C 13 171.7726 0.0000 . 1 . . 326870 . . 9 GLY C . 51256 1 37 . 1 . 1 9 9 GLY CA C 13 43.6650 0.0000 . 1 . . 324965 . . 9 GLY CA . 51256 1 38 . 1 . 1 9 9 GLY N N 15 110.2934 0.0000 . 1 . . 325717 . . 9 GLY N . 51256 1 39 . 1 . 1 10 10 PRO C C 13 176.7183 0.0000 . 1 . . 327776 . . 10 PRO C . 51256 1 40 . 1 . 1 10 10 PRO CA C 13 62.8411 0.0000 . 1 . . 328940 . . 10 PRO CA . 51256 1 41 . 1 . 1 10 10 PRO CB C 13 31.7059 0.0000 . 1 . . 332367 . . 10 PRO CB . 51256 1 42 . 1 . 1 11 11 ALA H H 1 8.2142 0.0000 . 1 . . 330036 . . 11 ALA H . 51256 1 43 . 1 . 1 11 11 ALA C C 13 177.7943 0.0000 . 1 . . 327773 . . 11 ALA C . 51256 1 44 . 1 . 1 11 11 ALA CA C 13 52.2140 0.0000 . 1 . . 326444 . . 11 ALA CA . 51256 1 45 . 1 . 1 11 11 ALA CB C 13 18.4910 0.0000 . 1 . . 326447 . . 11 ALA CB . 51256 1 46 . 1 . 1 11 11 ALA N N 15 123.9288 0.0000 . 1 . . 330037 . . 11 ALA N . 51256 1 47 . 1 . 1 12 12 GLY H H 1 8.2608 0.0000 . 1 . . 329907 . . 12 GLY H . 51256 1 48 . 1 . 1 12 12 GLY C C 13 173.7621 0.0000 . 1 . . 340159 . . 12 GLY C . 51256 1 49 . 1 . 1 12 12 GLY CA C 13 44.5538 0.0000 . 1 . . 339862 . . 12 GLY CA . 51256 1 50 . 1 . 1 12 12 GLY N N 15 108.4665 0.0000 . 1 . . 329908 . . 12 GLY N . 51256 1 51 . 1 . 1 13 13 ASN H H 1 8.1547 0.0000 . 1 . . 329328 . . 13 ASN H . 51256 1 52 . 1 . 1 13 13 ASN CA C 13 53.1191 0.0000 . 1 . . 340183 . . 13 ASN CA . 51256 1 53 . 1 . 1 13 13 ASN CB C 13 38.1471 0.0000 . 1 . . 326216 . . 13 ASN CB . 51256 1 54 . 1 . 1 13 13 ASN N N 15 118.9319 0.0000 . 1 . . 329329 . . 13 ASN N . 51256 1 55 . 1 . 1 14 14 ASN H H 1 8.3827 0.0000 . 1 . . 326211 . . 14 ASN H . 51256 1 56 . 1 . 1 14 14 ASN C C 13 174.7594 0.0000 . 1 . . . . . 14 ASN C . 51256 1 57 . 1 . 1 14 14 ASN CA C 13 57.6099 0.0000 . 1 . . 326210 . . 14 ASN CA . 51256 1 58 . 1 . 1 14 14 ASN CB C 13 36.9674 0.0000 . 1 . . 326207 . . 14 ASN CB . 51256 1 59 . 1 . 1 14 14 ASN N N 15 119.9121 0.0000 . 1 . . 326212 . . 14 ASN N . 51256 1 60 . 1 . 1 15 15 ASP C C 13 178.7506 0.0000 . 1 . . . . . 15 ASP C . 51256 1 61 . 1 . 1 15 15 ASP CA C 13 56.9321 0.0000 . 1 . . . . . 15 ASP CA . 51256 1 62 . 1 . 1 15 15 ASP CB C 13 39.2923 0.0000 . 1 . . . . . 15 ASP CB . 51256 1 63 . 1 . 1 16 16 CYS H H 1 7.8350 0.0000 . 1 . . . . . 16 CYS H . 51256 1 64 . 1 . 1 16 16 CYS C C 13 174.0229 0.0000 . 1 . . 327218 . . 16 CYS C . 51256 1 65 . 1 . 1 16 16 CYS CA C 13 58.5699 0.0000 . 1 . . . . . 16 CYS CA . 51256 1 66 . 1 . 1 16 16 CYS CB C 13 37.7016 0.0000 . 1 . . 338753 . . 16 CYS CB . 51256 1 67 . 1 . 1 16 16 CYS N N 15 119.4714 0.0000 . 1 . . . . . 16 CYS N . 51256 1 68 . 1 . 1 17 17 ARG H H 1 8.0733 0.0000 . 1 . . 325518 . . 17 ARG H . 51256 1 69 . 1 . 1 17 17 ARG C C 13 176.7976 0.0000 . 1 . . -1 . . 17 ARG C . 51256 1 70 . 1 . 1 17 17 ARG CA C 13 55.9244 0.0000 . 1 . . -1 . . 17 ARG CA . 51256 1 71 . 1 . 1 17 17 ARG CB C 13 29.3811 0.0000 . 1 . . -1 . . 17 ARG CB . 51256 1 72 . 1 . 1 17 17 ARG N N 15 120.8324 0.0000 . 1 . . 325519 . . 17 ARG N . 51256 1 73 . 1 . 1 18 18 ILE H H 1 7.9961 0.0000 . 1 . . 326694 . . 18 ILE H . 51256 1 74 . 1 . 1 18 18 ILE C C 13 176.2029 0.0000 . 1 . . 343705 . . 18 ILE C . 51256 1 75 . 1 . 1 18 18 ILE CA C 13 62.1082 0.0000 . 1 . . 343701 . . 18 ILE CA . 51256 1 76 . 1 . 1 18 18 ILE N N 15 115.2606 0.0000 . 1 . . 326695 . . 18 ILE N . 51256 1 77 . 1 . 1 19 19 TYR H H 1 8.3931 0.0000 . 1 . . 325443 . . 19 TYR H . 51256 1 78 . 1 . 1 19 19 TYR C C 13 177.7451 0.0000 . 1 . . 340175 . . 19 TYR C . 51256 1 79 . 1 . 1 19 19 TYR CA C 13 52.2024 0.0000 . 1 . . 327974 . . 19 TYR CA . 51256 1 80 . 1 . 1 19 19 TYR N N 15 125.1573 0.0000 . 1 . . 325444 . . 19 TYR N . 51256 1 81 . 1 . 1 20 20 VAL H H 1 8.6545 0.0000 . 1 . . . . . 20 VAL H . 51256 1 82 . 1 . 1 20 20 VAL C C 13 173.1031 0.0000 . 1 . . 327731 . . 20 VAL C . 51256 1 83 . 1 . 1 20 20 VAL CA C 13 59.0850 0.0000 . 1 . . 328901 . . 20 VAL CA . 51256 1 84 . 1 . 1 20 20 VAL CB C 13 32.4401 0.0000 . 1 . . 328901 . . 20 VAL CB . 51256 1 85 . 1 . 1 20 20 VAL N N 15 127.6987 0.0000 . 1 . . . . . 20 VAL N . 51256 1 86 . 1 . 1 21 21 GLY H H 1 9.1679 0.0000 . 1 . . 329994 . . 21 GLY H . 51256 1 87 . 1 . 1 21 21 GLY C C 13 173.5371 0.0000 . 1 . . 333075 . . 21 GLY C . 51256 1 88 . 1 . 1 21 21 GLY CA C 13 42.5987 0.0000 . 1 . . 340016 . . 21 GLY CA . 51256 1 89 . 1 . 1 21 21 GLY N N 15 113.4577 0.0000 . 1 . . 329995 . . 21 GLY N . 51256 1 90 . 1 . 1 22 22 ASN H H 1 8.9373 0.0000 . 1 . . 330795 . . 22 ASN H . 51256 1 91 . 1 . 1 22 22 ASN C C 13 172.4704 0.0000 . 1 . . 340032 . . 22 ASN C . 51256 1 92 . 1 . 1 22 22 ASN CA C 13 53.4862 0.0000 . 1 . . 328391 . . 22 ASN CA . 51256 1 93 . 1 . 1 22 22 ASN CB C 13 37.9463 0.0000 . 1 . . 340028 . . 22 ASN CB . 51256 1 94 . 1 . 1 22 22 ASN N N 15 116.3056 0.0000 . 1 . . 330796 . . 22 ASN N . 51256 1 95 . 1 . 1 23 23 LEU H H 1 6.4222 0.0000 . 1 . . 329661 . . 23 LEU H . 51256 1 96 . 1 . 1 23 23 LEU C C 13 173.4667 0.0000 . 1 . . 327347 . . 23 LEU C . 51256 1 97 . 1 . 1 23 23 LEU CA C 13 52.2612 0.0000 . 1 . . 325688 . . 23 LEU CA . 51256 1 98 . 1 . 1 23 23 LEU CB C 13 40.7606 0.0000 . 1 . . 325685 . . 23 LEU CB . 51256 1 99 . 1 . 1 23 23 LEU N N 15 111.8535 0.0000 . 1 . . 329662 . . 23 LEU N . 51256 1 100 . 1 . 1 25 25 PRO C C 13 177.1248 0.0000 . 1 . . 334290 . . 25 PRO C . 51256 1 101 . 1 . 1 25 25 PRO CA C 13 63.9365 0.0000 . 1 . . 328064 . . 25 PRO CA . 51256 1 102 . 1 . 1 25 25 PRO CB C 13 31.0941 0.0000 . 1 . . 325829 . . 25 PRO CB . 51256 1 103 . 1 . 1 26 26 ASP H H 1 7.9341 0.0000 . 1 . . 329640 . . 26 ASP H . 51256 1 104 . 1 . 1 26 26 ASP C C 13 175.8627 0.0000 . 1 . . 340104 . . 26 ASP C . 51256 1 105 . 1 . 1 26 26 ASP CA C 13 52.3849 0.0000 . 1 . . 340098 . . 26 ASP CA . 51256 1 106 . 1 . 1 26 26 ASP CB C 13 39.1699 0.0000 . 1 . . 340102 . . 26 ASP CB . 51256 1 107 . 1 . 1 26 26 ASP N N 15 115.0881 0.0000 . 1 . . 329641 . . 26 ASP N . 51256 1 108 . 1 . 1 27 27 ILE H H 1 6.9737 0.0000 . 1 . . 329808 . . 27 ILE H . 51256 1 109 . 1 . 1 27 27 ILE C C 13 172.5511 0.0000 . 1 . . 340120 . . 27 ILE C . 51256 1 110 . 1 . 1 27 27 ILE CA C 13 58.9732 0.0000 . 1 . . 340112 . . 27 ILE CA . 51256 1 111 . 1 . 1 27 27 ILE CB C 13 38.3134 0.0000 . 1 . . 340116 . . 27 ILE CB . 51256 1 112 . 1 . 1 27 27 ILE N N 15 120.6767 0.0000 . 1 . . 329809 . . 27 ILE N . 51256 1 113 . 1 . 1 28 28 ARG H H 1 8.2558 0.0000 . 1 . . 324732 . . 28 ARG H . 51256 1 114 . 1 . 1 28 28 ARG C C 13 178.3744 0.0000 . 1 . . 332423 . . 28 ARG C . 51256 1 115 . 1 . 1 28 28 ARG CA C 13 53.2414 0.0000 . 1 . . 334719 . . 28 ARG CA . 51256 1 116 . 1 . 1 28 28 ARG CB C 13 31.8283 0.0000 . 1 . . 334723 . . 28 ARG CB . 51256 1 117 . 1 . 1 28 28 ARG N N 15 123.7369 0.0000 . 1 . . 324733 . . 28 ARG N . 51256 1 118 . 1 . 1 29 29 THR H H 1 8.9649 0.0000 . 1 . . 329868 . . 29 THR H . 51256 1 119 . 1 . 1 29 29 THR CA C 13 67.4676 0.0000 . 1 . . 328766 . . 29 THR CA . 51256 1 120 . 1 . 1 29 29 THR CB C 13 66.3340 0.0000 . 1 . . 326129 . . 29 THR CB . 51256 1 121 . 1 . 1 29 29 THR N N 15 118.1908 0.0000 . 1 . . 329869 . . 29 THR N . 51256 1 122 . 1 . 1 30 30 LYS H H 1 8.0923 0.0000 . 1 . . 324822 . . 30 LYS H . 51256 1 123 . 1 . 1 30 30 LYS C C 13 177.6382 0.0000 . 1 . . 327251 . . 30 LYS C . 51256 1 124 . 1 . 1 30 30 LYS CA C 13 57.9857 0.0000 . 1 . . 324824 . . 30 LYS CA . 51256 1 125 . 1 . 1 30 30 LYS CB C 13 31.0941 0.0000 . 1 . . 325178 . . 30 LYS CB . 51256 1 126 . 1 . 1 30 30 LYS N N 15 119.2802 0.0000 . 1 . . 324823 . . 30 LYS N . 51256 1 127 . 1 . 1 31 31 ASP H H 1 6.8683 0.0000 . 1 . . 326229 . . 31 ASP H . 51256 1 128 . 1 . 1 31 31 ASP C C 13 178.2034 0.0000 . 1 . . 327653 . . 31 ASP C . 51256 1 129 . 1 . 1 31 31 ASP CA C 13 56.6573 0.0000 . 1 . . 326234 . . 31 ASP CA . 51256 1 130 . 1 . 1 31 31 ASP CB C 13 40.8830 0.0000 . 1 . . 326231 . . 31 ASP CB . 51256 1 131 . 1 . 1 31 31 ASP N N 15 117.4034 0.0000 . 1 . . 326230 . . 31 ASP N . 51256 1 132 . 1 . 1 32 32 ILE H H 1 7.0719 0.0000 . 1 . . 324831 . . 32 ILE H . 51256 1 133 . 1 . 1 32 32 ILE C C 13 177.9639 0.0000 . 1 . . 327257 . . 32 ILE C . 51256 1 134 . 1 . 1 32 32 ILE CA C 13 64.3527 0.0000 . 1 . . 328343 . . 32 ILE CA . 51256 1 135 . 1 . 1 32 32 ILE CB C 13 36.0497 0.0000 . 1 . . 325556 . . 32 ILE CB . 51256 1 136 . 1 . 1 32 32 ILE N N 15 118.4335 0.0000 . 1 . . 324832 . . 32 ILE N . 51256 1 137 . 1 . 1 33 33 GLU H H 1 7.9235 0.0000 . 1 . . 329535 . . 33 GLU H . 51256 1 138 . 1 . 1 33 33 GLU C C 13 177.9667 0.0000 . 1 . . 326909 . . 33 GLU C . 51256 1 139 . 1 . 1 33 33 GLU CA C 13 60.0469 0.0000 . 1 . . 328274 . . 33 GLU CA . 51256 1 140 . 1 . 1 33 33 GLU CB C 13 28.2798 0.0000 . 1 . . 325799 . . 33 GLU CB . 51256 1 141 . 1 . 1 33 33 GLU N N 15 120.9762 0.0000 . 1 . . 329536 . . 33 GLU N . 51256 1 142 . 1 . 1 34 34 ASP H H 1 7.7145 0.0000 . 1 . . 330792 . . 34 ASP H . 51256 1 143 . 1 . 1 34 34 ASP C C 13 178.5152 0.0000 . 1 . . 327272 . . 34 ASP C . 51256 1 144 . 1 . 1 34 34 ASP CA C 13 57.2069 0.0000 . 1 . . 324866 . . 34 ASP CA . 51256 1 145 . 1 . 1 34 34 ASP CB C 13 40.1488 0.0000 . 1 . . 325592 . . 34 ASP CB . 51256 1 146 . 1 . 1 34 34 ASP N N 15 117.4215 0.0000 . 1 . . 330793 . . 34 ASP N . 51256 1 147 . 1 . 1 35 35 VAL H H 1 7.4981 0.0000 . 1 . . 326325 . . 35 VAL H . 51256 1 148 . 1 . 1 35 35 VAL C C 13 177.5526 0.0000 . 1 . . 338766 . . 35 VAL C . 51256 1 149 . 1 . 1 35 35 VAL CA C 13 64.8657 0.0000 . 1 . . 328883 . . 35 VAL CA . 51256 1 150 . 1 . 1 35 35 VAL N N 15 118.4815 0.0000 . 1 . . 326326 . . 35 VAL N . 51256 1 151 . 1 . 1 36 36 PHE H H 1 7.5280 0.0000 . 1 . . 329628 . . 36 PHE H . 51256 1 152 . 1 . 1 36 36 PHE C C 13 176.1921 0.0000 . 1 . . 338822 . . 36 PHE C . 51256 1 153 . 1 . 1 36 36 PHE CA C 13 59.9710 0.0000 . 1 . . 338814 . . 36 PHE CA . 51256 1 154 . 1 . 1 36 36 PHE CB C 13 40.5159 0.0000 . 1 . . 338818 . . 36 PHE CB . 51256 1 155 . 1 . 1 36 36 PHE N N 15 115.9593 0.0000 . 1 . . 329629 . . 36 PHE N . 51256 1 156 . 1 . 1 37 37 TYR H H 1 8.4119 0.0000 . 1 . . 329520 . . 37 TYR H . 51256 1 157 . 1 . 1 37 37 TYR CA C 13 61.0089 0.0000 . 1 . . 336281 . . 37 TYR CA . 51256 1 158 . 1 . 1 37 37 TYR CB C 13 36.4780 0.0000 . 1 . . 336285 . . 37 TYR CB . 51256 1 159 . 1 . 1 37 37 TYR N N 15 122.0811 0.0000 . 1 . . 329521 . . 37 TYR N . 51256 1 160 . 1 . 1 38 38 LYS H H 1 7.5487 0.0000 . 1 . . 324906 . . 38 LYS H . 51256 1 161 . 1 . 1 38 38 LYS C C 13 177.0392 0.0000 . 1 . . 334479 . . 38 LYS C . 51256 1 162 . 1 . 1 38 38 LYS CA C 13 57.0237 0.0000 . 1 . . 324908 . . 38 LYS CA . 51256 1 163 . 1 . 1 38 38 LYS CB C 13 30.1152 0.0000 . 1 . . 334475 . . 38 LYS CB . 51256 1 164 . 1 . 1 38 38 LYS N N 15 116.0866 0.0000 . 1 . . 324907 . . 38 LYS N . 51256 1 165 . 1 . 1 39 39 TYR H H 1 7.5012 0.0000 . 1 . . 328821 . . 39 TYR H . 51256 1 166 . 1 . 1 39 39 TYR C C 13 174.6647 0.0000 . 1 . . 334499 . . 39 TYR C . 51256 1 167 . 1 . 1 39 39 TYR CA C 13 60.0936 0.0000 . 1 . . 334481 . . 39 TYR CA . 51256 1 168 . 1 . 1 39 39 TYR CB C 13 37.4569 0.0000 . 1 . . 334483 . . 39 TYR CB . 51256 1 169 . 1 . 1 39 39 TYR N N 15 117.8005 0.0000 . 1 . . 328822 . . 39 TYR N . 51256 1 170 . 1 . 1 40 40 GLY H H 1 7.0216 0.0000 . 1 . . 325329 . . 40 GLY H . 51256 1 171 . 1 . 1 40 40 GLY C C 13 171.6719 0.0000 . 1 . . 331493 . . 40 GLY C . 51256 1 172 . 1 . 1 40 40 GLY CA C 13 43.7857 0.0000 . 1 . . 328310 . . 40 GLY CA . 51256 1 173 . 1 . 1 40 40 GLY N N 15 103.5927 0.0000 . 1 . . 325330 . . 40 GLY N . 51256 1 174 . 1 . 1 41 41 ALA H H 1 7.9869 0.0000 . 1 . . 330909 . . 41 ALA H . 51256 1 175 . 1 . 1 41 41 ALA C C 13 177.5675 0.0000 . 1 . . 327245 . . 41 ALA C . 51256 1 176 . 1 . 1 41 41 ALA CA C 13 52.6558 0.0000 . 1 . . 328313 . . 41 ALA CA . 51256 1 177 . 1 . 1 41 41 ALA CB C 13 18.0540 0.0000 . 1 . . 325544 . . 41 ALA CB . 51256 1 178 . 1 . 1 41 41 ALA N N 15 120.0748 0.0000 . 1 . . 330910 . . 41 ALA N . 51256 1 179 . 1 . 1 42 42 ILE H H 1 8.1869 0.0000 . 1 . . 325470 . . 42 ILE H . 51256 1 180 . 1 . 1 42 42 ILE C C 13 176.2523 0.0000 . 1 . . 327179 . . 42 ILE C . 51256 1 181 . 1 . 1 42 42 ILE CA C 13 61.0725 0.0000 . 1 . . 325478 . . 42 ILE CA . 51256 1 182 . 1 . 1 42 42 ILE CB C 13 39.2923 0.0000 . 1 . . 325469 . . 42 ILE CB . 51256 1 183 . 1 . 1 42 42 ILE N N 15 123.9164 0.0000 . 1 . . 325471 . . 42 ILE N . 51256 1 184 . 1 . 1 43 43 ARG H H 1 9.0942 0.0000 . 1 . . 327525 . . 43 ARG H . 51256 1 185 . 1 . 1 43 43 ARG C C 13 175.6288 0.0000 . 1 . . 341917 . . 43 ARG C . 51256 1 186 . 1 . 1 43 43 ARG CA C 13 56.3379 0.0000 . 1 . . 344229 . . 43 ARG CA . 51256 1 187 . 1 . 1 43 43 ARG CB C 13 30.9923 0.0000 . 1 . . 325973 . . 43 ARG CB . 51256 1 188 . 1 . 1 43 43 ARG N N 15 127.9215 0.0000 . 1 . . 327526 . . 43 ARG N . 51256 1 189 . 1 . 1 44 44 ASP H H 1 7.3605 0.0000 . 1 . . 343958 . . 44 ASP H . 51256 1 190 . 1 . 1 44 44 ASP C C 13 173.3597 0.0000 . 1 . . 344297 . . 44 ASP C . 51256 1 191 . 1 . 1 44 44 ASP CA C 13 54.3211 0.0000 . 1 . . 344305 . . 44 ASP CA . 51256 1 192 . 1 . 1 44 44 ASP CB C 13 44.5538 0.0000 . 1 . . 344309 . . 44 ASP CB . 51256 1 193 . 1 . 1 44 44 ASP N N 15 115.8746 0.0000 . 1 . . 343959 . . 44 ASP N . 51256 1 194 . 1 . 1 45 45 ILE H H 1 7.6656 0.0000 . 1 . . 326289 . . 45 ILE H . 51256 1 195 . 1 . 1 45 45 ILE CA C 13 61.2837 0.0000 . 1 . . 342726 . . 45 ILE CA . 51256 1 196 . 1 . 1 45 45 ILE CB C 13 39.9041 0.0000 . 1 . . 342695 . . 45 ILE CB . 51256 1 197 . 1 . 1 45 45 ILE N N 15 122.4450 0.0000 . 1 . . 326290 . . 45 ILE N . 51256 1 198 . 1 . 1 46 46 ASP H H 1 8.7359 0.0000 . 1 . . 342687 . . 46 ASP H . 51256 1 199 . 1 . 1 46 46 ASP C C 13 174.1727 0.0000 . 1 . . 342707 . . 46 ASP C . 51256 1 200 . 1 . 1 46 46 ASP CA C 13 51.8476 0.0000 . 1 . . 342689 . . 46 ASP CA . 51256 1 201 . 1 . 1 46 46 ASP CB C 13 41.2501 0.0000 . 1 . . 342698 . . 46 ASP CB . 51256 1 202 . 1 . 1 46 46 ASP N N 15 129.0548 0.0000 . 1 . . 342688 . . 46 ASP N . 51256 1 203 . 1 . 1 47 47 LEU H H 1 8.0299 0.0000 . 1 . . 342741 . . 47 LEU H . 51256 1 204 . 1 . 1 47 47 LEU C C 13 174.6857 0.0000 . 1 . . 344277 . . 47 LEU C . 51256 1 205 . 1 . 1 47 47 LEU CA C 13 54.2753 0.0000 . 1 . . 342758 . . 47 LEU CA . 51256 1 206 . 1 . 1 47 47 LEU CB C 13 42.5787 0.0000 . 1 . . 342752 . . 47 LEU CB . 51256 1 207 . 1 . 1 47 47 LEU N N 15 126.0444 0.0000 . 1 . . 342742 . . 47 LEU N . 51256 1 208 . 1 . 1 48 48 LYS H H 1 8.8412 0.0000 . 1 . . 327768 . . 48 LYS H . 51256 1 209 . 1 . 1 48 48 LYS C C 13 174.0715 0.0000 . 1 . . 345434 . . 48 LYS C . 51256 1 210 . 1 . 1 48 48 LYS CA C 13 53.4862 0.0000 . 1 . . 345426 . . 48 LYS CA . 51256 1 211 . 1 . 1 48 48 LYS CB C 13 30.6047 0.0000 . 1 . . 345430 . . 48 LYS CB . 51256 1 212 . 1 . 1 48 48 LYS N N 15 129.3290 0.0000 . 1 . . 327769 . . 48 LYS N . 51256 1 213 . 1 . 1 49 49 ASN H H 1 7.8236 0.0000 . 1 . . 326490 . . 49 ASN H . 51256 1 214 . 1 . 1 49 49 ASN C C 13 174.9428 0.0000 . 1 . . 332371 . . 49 ASN C . 51256 1 215 . 1 . 1 49 49 ASN CA C 13 51.7187 0.0000 . 1 . . 326492 . . 49 ASN CA . 51256 1 216 . 1 . 1 49 49 ASN CB C 13 38.5582 0.0000 . 1 . . 345440 . . 49 ASN CB . 51256 1 217 . 1 . 1 49 49 ASN N N 15 119.6387 0.0000 . 1 . . 326491 . . 49 ASN N . 51256 1 218 . 1 . 1 50 50 ARG C C 13 174.9428 0.0000 . 1 . . 327242 . . 50 ARG C . 51256 1 219 . 1 . 1 50 50 ARG CA C 13 55.2373 0.0000 . 1 . . 328586 . . 50 ARG CA . 51256 1 220 . 1 . 1 50 50 ARG CB C 13 31.8273 0.0000 . 1 . . 325349 . . 50 ARG CB . 51256 1 221 . 1 . 1 51 51 ARG H H 1 8.3379 0.0000 . 1 . . 330123 . . 51 ARG H . 51256 1 222 . 1 . 1 51 51 ARG C C 13 176.1877 0.0000 . 1 . . -1 . . 51 ARG C . 51256 1 223 . 1 . 1 51 51 ARG CA C 13 55.7411 0.0000 . 1 . . 342505 . . 51 ARG CA . 51256 1 224 . 1 . 1 51 51 ARG N N 15 120.7354 0.0000 . 1 . . 330124 . . 51 ARG N . 51256 1 225 . 1 . 1 52 52 GLY H H 1 8.3102 0.0000 . 1 . . 324957 . . 52 GLY H . 51256 1 226 . 1 . 1 52 52 GLY CA C 13 44.8850 0.0000 . 1 . . 332179 . . 52 GLY CA . 51256 1 227 . 1 . 1 52 52 GLY N N 15 110.2132 0.0000 . 1 . . 324958 . . 52 GLY N . 51256 1 228 . 1 . 1 55 55 PRO C C 13 173.6379 0.0000 . 1 . . 344905 . . 55 PRO C . 51256 1 229 . 1 . 1 55 55 PRO CA C 13 62.7953 0.0000 . 1 . . 328451 . . 55 PRO CA . 51256 1 230 . 1 . 1 55 55 PRO CB C 13 31.9507 0.0000 . 1 . . 332800 . . 55 PRO CB . 51256 1 231 . 1 . 1 56 56 PHE H H 1 7.3963 0.0000 . 1 . . 329652 . . 56 PHE H . 51256 1 232 . 1 . 1 56 56 PHE CA C 13 54.3669 0.0000 . 1 . . 344900 . . 56 PHE CA . 51256 1 233 . 1 . 1 56 56 PHE N N 15 114.2600 0.0000 . 1 . . 329653 . . 56 PHE N . 51256 1 234 . 1 . 1 57 57 ALA H H 1 9.1004 0.0000 . 1 . . 327750 . . 57 ALA H . 51256 1 235 . 1 . 1 57 57 ALA C C 13 172.1068 0.0000 . 1 . . 327749 . . 57 ALA C . 51256 1 236 . 1 . 1 57 57 ALA CA C 13 49.0812 0.0000 . 1 . . 326399 . . 57 ALA CA . 51256 1 237 . 1 . 1 57 57 ALA CB C 13 22.7736 0.0000 . 1 . . -1 . . 57 ALA CB . 51256 1 238 . 1 . 1 57 57 ALA N N 15 120.2946 0.0000 . 1 . . 327751 . . 57 ALA N . 51256 1 239 . 1 . 1 59 59 VAL C C 13 173.0817 0.0000 . 1 . . 326897 . . 59 VAL C . 51256 1 240 . 1 . 1 59 59 VAL CA C 13 60.4592 0.0000 . 1 . . 328163 . . 59 VAL CA . 51256 1 241 . 1 . 1 59 59 VAL CB C 13 32.4401 0.0000 . 1 . . 343943 . . 59 VAL CB . 51256 1 242 . 1 . 1 60 60 GLU H H 1 8.6545 0.0000 . 1 . . 325395 . . 60 GLU H . 51256 1 243 . 1 . 1 60 60 GLU C C 13 175.3706 0.0000 . 1 . . 346326 . . 60 GLU C . 51256 1 244 . 1 . 1 60 60 GLU CA C 13 54.4650 0.0000 . 1 . . 346322 . . 60 GLU CA . 51256 1 245 . 1 . 1 60 60 GLU CB C 13 31.8283 0.0000 . 1 . . 346320 . . 60 GLU CB . 51256 1 246 . 1 . 1 60 60 GLU N N 15 127.6987 0.0000 . 1 . . 325396 . . 60 GLU N . 51256 1 247 . 1 . 1 61 61 PHE H H 1 8.6784 0.0000 . 1 . . 327144 . . 61 PHE H . 51256 1 248 . 1 . 1 61 61 PHE C C 13 174.6219 0.0000 . 1 . . 331969 . . 61 PHE C . 51256 1 249 . 1 . 1 61 61 PHE CA C 13 60.4592 0.0000 . 1 . . . . . 61 PHE CA . 51256 1 250 . 1 . 1 61 61 PHE CB C 13 40.1488 0.0000 . 1 . . 331989 . . 61 PHE CB . 51256 1 251 . 1 . 1 61 61 PHE N N 15 127.2346 0.0000 . 1 . . 327145 . . 61 PHE N . 51256 1 252 . 1 . 1 62 62 GLU H H 1 8.6545 0.0000 . 1 . . . . . 62 GLU H . 51256 1 253 . 1 . 1 62 62 GLU C C 13 175.3772 0.0000 . 1 . . . . . 62 GLU C . 51256 1 254 . 1 . 1 62 62 GLU CA C 13 54.4650 0.0000 . 1 . . . . . 62 GLU CA . 51256 1 255 . 1 . 1 62 62 GLU CB C 13 31.8283 0.0000 . 1 . . . . . 62 GLU CB . 51256 1 256 . 1 . 1 62 62 GLU N N 15 127.6987 0.0000 . 1 . . . . . 62 GLU N . 51256 1 257 . 1 . 1 63 63 ASP H H 1 8.6784 0.0000 . 1 . . . . . 63 ASP H . 51256 1 258 . 1 . 1 63 63 ASP C C 13 174.6219 0.0000 . 1 . . . . . 63 ASP C . 51256 1 259 . 1 . 1 63 63 ASP CB C 13 40.1488 0.0000 . 1 . . . . . 63 ASP CB . 51256 1 260 . 1 . 1 63 63 ASP N N 15 127.2346 0.0000 . 1 . . . . . 63 ASP N . 51256 1 261 . 1 . 1 64 64 PRO C C 13 179.0500 0.0000 . 1 . . 327491 . . 64 PRO C . 51256 1 262 . 1 . 1 64 64 PRO CA C 13 64.7650 0.0000 . 1 . . 328655 . . 64 PRO CA . 51256 1 263 . 1 . 1 64 64 PRO CB C 13 31.5836 0.0000 . 1 . . 332976 . . 64 PRO CB . 51256 1 264 . 1 . 1 65 65 ARG H H 1 8.7839 0.0000 . 1 . . 329760 . . 65 ARG H . 51256 1 265 . 1 . 1 65 65 ARG C C 13 178.4954 0.0000 . 1 . . 340060 . . 65 ARG C . 51256 1 266 . 1 . 1 65 65 ARG CA C 13 58.1689 0.0000 . 1 . . 340054 . . 65 ARG CA . 51256 1 267 . 1 . 1 65 65 ARG CB C 13 28.6469 0.0000 . 1 . . 340058 . . 65 ARG CB . 51256 1 268 . 1 . 1 65 65 ARG N N 15 120.6056 0.0000 . 1 . . 329761 . . 65 ARG N . 51256 1 269 . 1 . 1 66 66 ASP H H 1 7.0206 0.0000 . 1 . . 326970 . . 66 ASP H . 51256 1 270 . 1 . 1 66 66 ASP C C 13 176.7825 0.0000 . 1 . . 340048 . . 66 ASP C . 51256 1 271 . 1 . 1 66 66 ASP CA C 13 56.3824 0.0000 . 1 . . 324764 . . 66 ASP CA . 51256 1 272 . 1 . 1 66 66 ASP CB C 13 39.2923 0.0000 . 1 . . 340044 . . 66 ASP CB . 51256 1 273 . 1 . 1 66 66 ASP N N 15 121.2962 0.0000 . 1 . . 326971 . . 66 ASP N . 51256 1 274 . 1 . 1 67 67 ALA H H 1 6.4937 0.0000 . 1 . . 326373 . . 67 ALA H . 51256 1 275 . 1 . 1 67 67 ALA C C 13 178.0930 0.0000 . 1 . . 334876 . . 67 ALA C . 51256 1 276 . 1 . 1 67 67 ALA CA C 13 53.8801 0.0000 . 1 . . 342211 . . 67 ALA CA . 51256 1 277 . 1 . 1 67 67 ALA CB C 13 17.0344 0.0000 . 1 . . 342213 . . 67 ALA CB . 51256 1 278 . 1 . 1 67 67 ALA N N 15 119.3703 0.0000 . 1 . . 326374 . . 67 ALA N . 51256 1 279 . 1 . 1 68 68 GLU H H 1 7.3611 0.0000 . 1 . . 327453 . . 68 GLU H . 51256 1 280 . 1 . 1 68 68 GLU C C 13 177.9805 0.0000 . 1 . . 333082 . . 68 GLU C . 51256 1 281 . 1 . 1 68 68 GLU CA C 13 59.2682 0.0000 . 1 . . 329138 . . 68 GLU CA . 51256 1 282 . 1 . 1 68 68 GLU CB C 13 28.6469 0.0000 . 1 . . 326774 . . 68 GLU CB . 51256 1 283 . 1 . 1 68 68 GLU N N 15 115.9196 0.0000 . 1 . . 327454 . . 68 GLU N . 51256 1 284 . 1 . 1 69 69 ASP H H 1 7.7299 0.0000 . 1 . . 329139 . . 69 ASP H . 51256 1 285 . 1 . 1 69 69 ASP C C 13 178.5366 0.0000 . 1 . . 339700 . . 69 ASP C . 51256 1 286 . 1 . 1 69 69 ASP CA C 13 56.6573 0.0000 . 1 . . 339692 . . 69 ASP CA . 51256 1 287 . 1 . 1 69 69 ASP CB C 13 39.2923 0.0000 . 1 . . 339696 . . 69 ASP CB . 51256 1 288 . 1 . 1 69 69 ASP N N 15 118.7122 0.0000 . 1 . . 329140 . . 69 ASP N . 51256 1 289 . 1 . 1 70 70 ALA H H 1 7.5337 0.0000 . 1 . . 325083 . . 70 ALA H . 51256 1 290 . 1 . 1 70 70 ALA CA C 13 53.8532 0.0000 . 1 . . 325466 . . 70 ALA CA . 51256 1 291 . 1 . 1 70 70 ALA CB C 13 18.8581 0.0000 . 1 . . 332725 . . 70 ALA CB . 51256 1 292 . 1 . 1 70 70 ALA N N 15 123.9647 0.0000 . 1 . . 325084 . . 70 ALA N . 51256 1 293 . 1 . 1 71 71 VAL H H 1 7.2761 0.0000 . 1 . . 329985 . . 71 VAL H . 51256 1 294 . 1 . 1 71 71 VAL C C 13 177.9997 0.0000 . 1 . . 332739 . . 71 VAL C . 51256 1 295 . 1 . 1 71 71 VAL CA C 13 65.8446 0.0000 . 1 . . 332753 . . 71 VAL CA . 51256 1 296 . 1 . 1 71 71 VAL CB C 13 30.3600 0.0000 . 1 . . 332737 . . 71 VAL CB . 51256 1 297 . 1 . 1 71 71 VAL N N 15 119.2366 0.0000 . 1 . . 329986 . . 71 VAL N . 51256 1 298 . 1 . 1 72 72 TYR H H 1 7.3835 0.0000 . 1 . . 324918 . . 72 TYR H . 51256 1 299 . 1 . 1 72 72 TYR C C 13 179.0667 0.0000 . 1 . . 332771 . . 72 TYR C . 51256 1 300 . 1 . 1 72 72 TYR CA C 13 59.6347 0.0000 . 1 . . 332781 . . 72 TYR CA . 51256 1 301 . 1 . 1 72 72 TYR CB C 13 37.0898 0.0000 . 1 . . 332767 . . 72 TYR CB . 51256 1 302 . 1 . 1 72 72 TYR N N 15 115.9886 0.0000 . 1 . . 324919 . . 72 TYR N . 51256 1 303 . 1 . 1 73 73 GLY H H 1 8.2789 0.0000 . 1 . . 331080 . . 73 GLY H . 51256 1 304 . 1 . 1 73 73 GLY C C 13 176.0912 0.0000 . 1 . . 327083 . . 73 GLY C . 51256 1 305 . 1 . 1 73 73 GLY CA C 13 45.6637 0.0000 . 1 . . 328109 . . 73 GLY CA . 51256 1 306 . 1 . 1 73 73 GLY N N 15 105.2398 0.0000 . 1 . . 331081 . . 73 GLY N . 51256 1 307 . 1 . 1 74 74 ARG H H 1 7.7894 0.0000 . 1 . . 327294 . . 74 ARG H . 51256 1 308 . 1 . 1 74 74 ARG C C 13 175.9268 0.0000 . 1 . . 327296 . . 74 ARG C . 51256 1 309 . 1 . 1 74 74 ARG CA C 13 53.2414 0.0000 . 1 . . 324911 . . 74 ARG CA . 51256 1 310 . 1 . 1 74 74 ARG CB C 13 31.6677 0.0000 . 1 . . 339710 . . 74 ARG CB . 51256 1 311 . 1 . 1 74 74 ARG N N 15 116.2243 0.0000 . 1 . . 327295 . . 74 ARG N . 51256 1 312 . 1 . 1 75 75 ASP H H 1 7.5776 0.0000 . 1 . . 329559 . . 75 ASP H . 51256 1 313 . 1 . 1 75 75 ASP C C 13 178.0265 0.0000 . 1 . . 327236 . . 75 ASP C . 51256 1 314 . 1 . 1 75 75 ASP CA C 13 58.0135 0.0000 . 1 . . 331986 . . 75 ASP CA . 51256 1 315 . 1 . 1 75 75 ASP CB C 13 40.2712 0.0000 . 1 . . 325163 . . 75 ASP CB . 51256 1 316 . 1 . 1 75 75 ASP N N 15 120.2931 0.0000 . 1 . . 329560 . . 75 ASP N . 51256 1 317 . 1 . 1 76 76 GLY H H 1 8.8000 0.0000 . 1 . . 327675 . . 76 GLY H . 51256 1 318 . 1 . 1 76 76 GLY C C 13 173.2528 0.0000 . 1 . . 327197 . . 76 GLY C . 51256 1 319 . 1 . 1 76 76 GLY CA C 13 45.4103 0.0000 . 1 . . 328235 . . 76 GLY CA . 51256 1 320 . 1 . 1 76 76 GLY N N 15 117.5267 0.0000 . 1 . . 327676 . . 76 GLY N . 51256 1 321 . 1 . 1 77 77 TYR H H 1 7.9116 0.0000 . 1 . . 326805 . . 77 TYR H . 51256 1 322 . 1 . 1 77 77 TYR C C 13 173.9374 0.0000 . 1 . . 326807 . . 77 TYR C . 51256 1 323 . 1 . 1 77 77 TYR CA C 13 57.8911 0.0000 . 1 . . 324746 . . 77 TYR CA . 51256 1 324 . 1 . 1 77 77 TYR CB C 13 39.6594 0.0000 . 1 . . 325019 . . 77 TYR CB . 51256 1 325 . 1 . 1 77 77 TYR N N 15 123.0731 0.0000 . 1 . . 326806 . . 77 TYR N . 51256 1 326 . 1 . 1 78 78 ASP H H 1 7.5896 0.0000 . 1 . . 329481 . . 78 ASP H . 51256 1 327 . 1 . 1 78 78 ASP C C 13 173.3598 0.0000 . 1 . . 326948 . . 78 ASP C . 51256 1 328 . 1 . 1 78 78 ASP CA C 13 53.2218 0.0000 . 1 . . 328124 . . 78 ASP CA . 51256 1 329 . 1 . 1 78 78 ASP CB C 13 40.1488 0.0000 . 1 . . 326360 . . 78 ASP CB . 51256 1 330 . 1 . 1 78 78 ASP N N 15 126.7890 0.0000 . 1 . . 329482 . . 78 ASP N . 51256 1 331 . 1 . 1 79 79 TYR H H 1 8.9209 0.0000 . 1 . . 329469 . . 79 TYR H . 51256 1 332 . 1 . 1 79 79 TYR C C 13 174.1750 0.0000 . 1 . . 331965 . . 79 TYR C . 51256 1 333 . 1 . 1 79 79 TYR CA C 13 55.6495 0.0000 . 1 . . 331961 . . 79 TYR CA . 51256 1 334 . 1 . 1 79 79 TYR CB C 13 38.3625 0.0000 . 1 . . 331953 . . 79 TYR CB . 51256 1 335 . 1 . 1 79 79 TYR N N 15 129.9109 0.0000 . 1 . . 329470 . . 79 TYR N . 51256 1 336 . 1 . 1 80 80 ASP H H 1 8.2153 0.0000 . 1 . . 325449 . . 80 ASP H . 51256 1 337 . 1 . 1 80 80 ASP C C 13 174.9314 0.0000 . 1 . . 327164 . . 80 ASP C . 51256 1 338 . 1 . 1 80 80 ASP CA C 13 54.4586 0.0000 . 1 . . 325448 . . 80 ASP CA . 51256 1 339 . 1 . 1 80 80 ASP CB C 13 39.1699 0.0000 . 1 . . 325055 . . 80 ASP CB . 51256 1 340 . 1 . 1 80 80 ASP N N 15 124.9653 0.0000 . 1 . . 325450 . . 80 ASP N . 51256 1 341 . 1 . 1 81 81 GLY H H 1 8.0661 0.0000 . 1 . . 329721 . . 81 GLY H . 51256 1 342 . 1 . 1 81 81 GLY C C 13 174.3578 0.0000 . 1 . . 334653 . . 81 GLY C . 51256 1 343 . 1 . 1 81 81 GLY CA C 13 44.8392 0.0000 . 1 . . 325784 . . 81 GLY CA . 51256 1 344 . 1 . 1 81 81 GLY N N 15 104.2055 0.0000 . 1 . . 329722 . . 81 GLY N . 51256 1 345 . 1 . 1 82 82 TYR H H 1 7.8353 0.0000 . 1 . . 326247 . . 82 TYR H . 51256 1 346 . 1 . 1 82 82 TYR C C 13 174.1142 0.0000 . 1 . . 334669 . . 82 TYR C . 51256 1 347 . 1 . 1 82 82 TYR CA C 13 57.3444 0.0000 . 1 . . 328886 . . 82 TYR CA . 51256 1 348 . 1 . 1 82 82 TYR CB C 13 37.2122 0.0000 . 1 . . 334665 . . 82 TYR CB . 51256 1 349 . 1 . 1 82 82 TYR N N 15 123.5559 0.0000 . 1 . . 326248 . . 82 TYR N . 51256 1 350 . 1 . 1 83 83 ARG H H 1 8.0769 0.0000 . 1 . . 328887 . . 83 ARG H . 51256 1 351 . 1 . 1 83 83 ARG C C 13 176.4968 0.0000 . 1 . . 327713 . . 83 ARG C . 51256 1 352 . 1 . 1 83 83 ARG CA C 13 54.9545 0.0000 . 1 . . 328889 . . 83 ARG CA . 51256 1 353 . 1 . 1 83 83 ARG CB C 13 28.0351 0.0000 . 1 . . 326342 . . 83 ARG CB . 51256 1 354 . 1 . 1 83 83 ARG N N 15 122.9501 0.0000 . 1 . . 328888 . . 83 ARG N . 51256 1 355 . 1 . 1 84 84 LEU H H 1 9.2354 0.0000 . 1 . . 328674 . . 84 LEU H . 51256 1 356 . 1 . 1 84 84 LEU C C 13 177.3185 0.0000 . 1 . . 346124 . . 84 LEU C . 51256 1 357 . 1 . 1 84 84 LEU N N 15 129.4768 0.0000 . 1 . . 328675 . . 84 LEU N . 51256 1 358 . 1 . 1 85 85 ARG H H 1 8.5441 0.0000 . 1 . . 328926 . . 85 ARG H . 51256 1 359 . 1 . 1 85 85 ARG CB C 13 32.0730 0.0000 . 1 . . 333079 . . 85 ARG CB . 51256 1 360 . 1 . 1 85 85 ARG N N 15 122.6632 0.0000 . 1 . . 328927 . . 85 ARG N . 51256 1 361 . 1 . 1 86 86 VAL H H 1 9.3114 0.0000 . 1 . . 328698 . . 86 VAL H . 51256 1 362 . 1 . 1 86 86 VAL C C 13 174.4508 0.0000 . 1 . . 345104 . . 86 VAL C . 51256 1 363 . 1 . 1 86 86 VAL CA C 13 60.8650 0.0000 . 1 . . 342223 . . 86 VAL CA . 51256 1 364 . 1 . 1 86 86 VAL CB C 13 31.5836 0.0000 . 1 . . 332977 . . 86 VAL CB . 51256 1 365 . 1 . 1 86 86 VAL N N 15 127.1099 0.0000 . 1 . . 328699 . . 86 VAL N . 51256 1 366 . 1 . 1 87 87 GLU CA C 13 54.8078 0.0000 . 1 . . . . . 87 GLU CA . 51256 1 367 . 1 . 1 87 87 GLU CB C 13 30.2376 0.0000 . 1 . . . . . 87 GLU CB . 51256 1 368 . 1 . 1 89 89 PRO CB C 13 30.9718 0.0000 . 1 . . . . . 89 PRO CB . 51256 1 369 . 1 . 1 90 90 ARG C C 13 176.6541 0.0000 . 1 . . 334210 . . 90 ARG C . 51256 1 370 . 1 . 1 90 90 ARG CA C 13 56.6040 0.0000 . 1 . . 333635 . . 90 ARG CA . 51256 1 371 . 1 . 1 90 90 ARG CB C 13 29.7219 0.0000 . 1 . . 334203 . . 90 ARG CB . 51256 1 372 . 1 . 1 91 91 SER H H 1 8.2894 0.0000 . 1 . . 329130 . . 91 SER H . 51256 1 373 . 1 . 1 91 91 SER CA C 13 57.9398 0.0000 . 1 . . 336432 . . 91 SER CA . 51256 1 374 . 1 . 1 91 91 SER CB C 13 63.9278 0.0000 . 1 . . 334072 . . 91 SER CB . 51256 1 375 . 1 . 1 91 91 SER N N 15 116.5153 0.0000 . 1 . . 329131 . . 91 SER N . 51256 1 376 . 1 . 1 92 92 GLY H H 1 8.2204 0.0000 . 1 . . 327363 . . 92 GLY H . 51256 1 377 . 1 . 1 92 92 GLY C C 13 174.0015 0.0000 . 1 . . 336429 . . 92 GLY C . 51256 1 378 . 1 . 1 92 92 GLY CA C 13 44.7934 0.0000 . 1 . . 336425 . . 92 GLY CA . 51256 1 379 . 1 . 1 92 92 GLY N N 15 110.6959 0.0000 . 1 . . 327364 . . 92 GLY N . 51256 1 380 . 1 . 1 93 93 ARG H H 1 8.0580 0.0000 . 1 . . 326547 . . 93 ARG H . 51256 1 381 . 1 . 1 93 93 ARG C C 13 176.7750 0.0000 . 1 . . 343183 . . 93 ARG C . 51256 1 382 . 1 . 1 93 93 ARG CA C 13 56.0557 0.0000 . 1 . . 343179 . . 93 ARG CA . 51256 1 383 . 1 . 1 93 93 ARG CB C 13 29.7482 0.0000 . 1 . . 343181 . . 93 ARG CB . 51256 1 384 . 1 . 1 93 93 ARG N N 15 120.5330 0.0000 . 1 . . 326548 . . 93 ARG N . 51256 1 385 . 1 . 1 94 94 GLY H H 1 8.2819 0.0000 . 1 . . 331038 . . 94 GLY H . 51256 1 386 . 1 . 1 94 94 GLY C C 13 174.3301 0.0000 . 1 . . 336483 . . 94 GLY C . 51256 1 387 . 1 . 1 94 94 GLY CA C 13 44.8330 0.0000 . 1 . . 336479 . . 94 GLY CA . 51256 1 388 . 1 . 1 94 94 GLY N N 15 109.9766 0.0000 . 1 . . 331039 . . 94 GLY N . 51256 1 389 . 1 . 1 95 95 THR H H 1 7.8831 0.0000 . 1 . . 324942 . . 95 THR H . 51256 1 390 . 1 . 1 95 95 THR C C 13 175.2915 0.0000 . 1 . . 342266 . . 95 THR C . 51256 1 391 . 1 . 1 95 95 THR CA C 13 61.5321 0.0000 . 1 . . 328466 . . 95 THR CA . 51256 1 392 . 1 . 1 95 95 THR CB C 13 69.2707 0.0000 . 1 . . 342262 . . 95 THR CB . 51256 1 393 . 1 . 1 95 95 THR N N 15 113.0178 0.0000 . 1 . . 324943 . . 95 THR N . 51256 1 394 . 1 . 1 96 96 GLY H H 1 8.2918 0.0000 . 1 . . 328488 . . 96 GLY H . 51256 1 395 . 1 . 1 96 96 GLY C C 13 174.1513 0.0000 . 1 . . 336373 . . 96 GLY C . 51256 1 396 . 1 . 1 96 96 GLY CA C 13 44.8032 0.0000 . 1 . . 336371 . . 96 GLY CA . 51256 1 397 . 1 . 1 96 96 GLY N N 15 111.1920 0.0000 . 1 . . 328489 . . 96 GLY N . 51256 1 398 . 1 . 1 97 97 ARG H H 1 8.0042 0.0000 . 1 . . 331905 . . 97 ARG H . 51256 1 399 . 1 . 1 97 97 ARG C C 13 176.9027 0.0000 . 1 . . . . . 97 ARG C . 51256 1 400 . 1 . 1 97 97 ARG CA C 13 56.0557 0.0000 . 1 . . 342805 . . 97 ARG CA . 51256 1 401 . 1 . 1 97 97 ARG CB C 13 29.7482 0.0000 . 1 . . 342809 . . 97 ARG CB . 51256 1 402 . 1 . 1 97 97 ARG N N 15 120.7604 0.0000 . 1 . . 331906 . . 97 ARG N . 51256 1 403 . 1 . 1 98 98 GLY H H 1 8.3102 0.0000 . 1 . . 324957 . . 98 GLY H . 51256 1 404 . 1 . 1 98 98 GLY C C 13 174.5577 0.0000 . 1 . . 336453 . . 98 GLY C . 51256 1 405 . 1 . 1 98 98 GLY CA C 13 44.9209 0.0000 . 1 . . 332179 . . 98 GLY CA . 51256 1 406 . 1 . 1 98 98 GLY N N 15 110.2021 0.0000 . 1 . . 324958 . . 98 GLY N . 51256 1 407 . 1 . 1 99 99 GLY H H 1 8.1043 0.0000 . 1 . . 325833 . . 99 GLY H . 51256 1 408 . 1 . 1 99 99 GLY CA C 13 44.9209 0.0000 . 1 . . 336411 . . 99 GLY CA . 51256 1 409 . 1 . 1 99 99 GLY N N 15 111.0163 0.0000 . 1 . . 325834 . . 99 GLY N . 51256 1 410 . 1 . 1 100 100 GLY H H 1 8.3493 0.0000 . 1 . . 329232 . . 100 GLY H . 51256 1 411 . 1 . 1 100 100 GLY C C 13 173.1896 0.0000 . 1 . . 342801 . . 100 GLY C . 51256 1 412 . 1 . 1 100 100 GLY N N 15 110.5468 0.0000 . 1 . . 329233 . . 100 GLY N . 51256 1 413 . 1 . 1 103 103 GLY C C 13 174.9428 0.0000 . 1 . . 343779 . . 103 GLY C . 51256 1 414 . 1 . 1 103 103 GLY CA C 13 44.8850 0.0000 . 1 . . 343933 . . 103 GLY CA . 51256 1 415 . 1 . 1 104 104 GLY H H 1 8.1682 0.0000 . 1 . . 343762 . . 104 GLY H . 51256 1 416 . 1 . 1 104 104 GLY C C 13 174.7552 0.0000 . 1 . . 342778 . . 104 GLY C . 51256 1 417 . 1 . 1 104 104 GLY CA C 13 44.7985 0.0000 . 1 . . 336269 . . 104 GLY CA . 51256 1 418 . 1 . 1 104 104 GLY N N 15 109.2524 0.0000 . 1 . . 343763 . . 104 GLY N . 51256 1 419 . 1 . 1 105 105 GLY H H 1 8.1802 0.0000 . 1 . . 336264 . . 105 GLY H . 51256 1 420 . 1 . 1 105 105 GLY CA C 13 45.1656 0.0000 . 1 . . 336266 . . 105 GLY CA . 51256 1 421 . 1 . 1 105 105 GLY N N 15 109.1341 0.0000 . 1 . . 336265 . . 105 GLY N . 51256 1 422 . 1 . 1 106 106 GLY H H 1 8.0811 0.0000 . 1 . . 330099 . . 106 GLY H . 51256 1 423 . 1 . 1 106 106 GLY C C 13 174.4508 0.0000 . 1 . . . . . 106 GLY C . 51256 1 424 . 1 . 1 106 106 GLY CA C 13 44.4306 0.0000 . 1 . . 343733 . . 106 GLY CA . 51256 1 425 . 1 . 1 106 106 GLY N N 15 109.0435 0.0000 . 1 . . 330100 . . 106 GLY N . 51256 1 426 . 1 . 1 107 107 ALA H H 1 7.7992 0.0000 . 1 . . 325014 . . 107 ALA H . 51256 1 427 . 1 . 1 107 107 ALA C C 13 175.6701 0.0000 . 1 . . . . . 107 ALA C . 51256 1 428 . 1 . 1 107 107 ALA CA C 13 49.9948 0.0000 . 1 . . 324740 . . 107 ALA CA . 51256 1 429 . 1 . 1 107 107 ALA CB C 13 18.3686 0.0000 . 1 . . 325016 . . 107 ALA CB . 51256 1 430 . 1 . 1 107 107 ALA N N 15 123.5837 0.0000 . 1 . . 325015 . . 107 ALA N . 51256 1 431 . 1 . 1 108 108 PRO C C 13 176.8382 0.0000 . 1 . . 331460 . . 108 PRO C . 51256 1 432 . 1 . 1 108 108 PRO CA C 13 62.7034 0.0000 . 1 . . 327995 . . 108 PRO CA . 51256 1 433 . 1 . 1 108 108 PRO CB C 13 31.0023 0.0000 . 1 . . 345415 . . 108 PRO CB . 51256 1 434 . 1 . 1 109 109 ARG H H 1 8.2000 0.0000 . 1 . . 325029 . . 109 ARG H . 51256 1 435 . 1 . 1 109 109 ARG C C 13 176.7065 0.0000 . 1 . . 341958 . . 109 ARG C . 51256 1 436 . 1 . 1 109 109 ARG CA C 13 55.6279 0.0000 . 1 . . 341948 . . 109 ARG CA . 51256 1 437 . 1 . 1 109 109 ARG CB C 13 29.8705 0.0000 . 1 . . 341954 . . 109 ARG CB . 51256 1 438 . 1 . 1 109 109 ARG N N 15 121.1634 0.0000 . 1 . . 325030 . . 109 ARG N . 51256 1 439 . 1 . 1 110 110 GLY H H 1 8.1389 0.0000 . 1 . . 329691 . . 110 GLY H . 51256 1 440 . 1 . 1 110 110 GLY C C 13 173.7591 0.0000 . 1 . . 339962 . . 110 GLY C . 51256 1 441 . 1 . 1 110 110 GLY CA C 13 44.7018 0.0000 . 1 . . 339958 . . 110 GLY CA . 51256 1 442 . 1 . 1 110 110 GLY N N 15 109.8250 0.0000 . 1 . . 329692 . . 110 GLY N . 51256 1 443 . 1 . 1 111 111 ARG H H 1 7.9120 0.0000 . 1 . . 327222 . . 111 ARG H . 51256 1 444 . 1 . 1 111 111 ARG C C 13 175.7923 0.0000 . 1 . . 343670 . . 111 ARG C . 51256 1 445 . 1 . 1 111 111 ARG CA C 13 56.0476 0.0000 . 1 . . 325526 . . 111 ARG CA . 51256 1 446 . 1 . 1 111 111 ARG CB C 13 29.6782 0.0000 . 1 . . 336443 . . 111 ARG CB . 51256 1 447 . 1 . 1 111 111 ARG N N 15 120.8557 0.0000 . 1 . . 327223 . . 111 ARG N . 51256 1 448 . 1 . 1 112 112 TYR H H 1 8.0444 0.0000 . 1 . . 342004 . . 112 TYR H . 51256 1 449 . 1 . 1 112 112 TYR C C 13 176.7020 0.0000 . 1 . . 343425 . . 112 TYR C . 51256 1 450 . 1 . 1 112 112 TYR CA C 13 57.4017 0.0000 . 1 . . 345137 . . 112 TYR CA . 51256 1 451 . 1 . 1 112 112 TYR CB C 13 37.9463 0.0000 . 1 . . . . . 112 TYR CB . 51256 1 452 . 1 . 1 112 112 TYR N N 15 120.8065 0.0000 . 1 . . 342005 . . 112 TYR N . 51256 1 453 . 1 . 1 113 113 GLY H H 1 7.8849 0.0000 . 1 . . 327669 . . 113 GLY H . 51256 1 454 . 1 . 1 113 113 GLY C C 13 171.4987 0.0000 . 1 . . 327668 . . 113 GLY C . 51256 1 455 . 1 . 1 113 113 GLY CA C 13 43.7857 0.0000 . 1 . . 328847 . . 113 GLY CA . 51256 1 456 . 1 . 1 113 113 GLY N N 15 110.1253 0.0000 . 1 . . 327670 . . 113 GLY N . 51256 1 457 . 1 . 1 117 117 ARG C C 13 176.7976 0.0000 . 1 . . . . . 117 ARG C . 51256 1 458 . 1 . 1 117 117 ARG CB C 13 29.3811 0.0000 . 1 . . . . . 117 ARG CB . 51256 1 459 . 1 . 1 118 118 ARG CB C 13 28.7999 0.0000 . 1 . . . . . 118 ARG CB . 51256 1 460 . 1 . 1 119 119 SER C C 13 174.0318 0.0000 . 1 . . 333474 . . 119 SER C . 51256 1 461 . 1 . 1 119 119 SER CA C 13 58.6253 0.0000 . 1 . . . . . 119 SER CA . 51256 1 462 . 1 . 1 119 119 SER CB C 13 63.5197 0.0000 . 1 . . 342491 . . 119 SER CB . 51256 1 463 . 1 . 1 120 120 GLU H H 1 8.0167 0.0000 . 1 . . 327594 . . 120 GLU H . 51256 1 464 . 1 . 1 120 120 GLU C C 13 176.8266 0.0000 . 1 . . -1 . . 120 GLU C . 51256 1 465 . 1 . 1 120 120 GLU CA C 13 55.0768 0.0000 . 1 . . 333282 . . 120 GLU CA . 51256 1 466 . 1 . 1 120 120 GLU N N 15 121.8995 0.0000 . 1 . . 327595 . . 120 GLU N . 51256 1 467 . 1 . 1 121 121 ASN H H 1 8.1421 0.0000 . 1 . . 329550 . . 121 ASN H . 51256 1 468 . 1 . 1 121 121 ASN C C 13 173.7956 0.0000 . 1 . . 340008 . . 121 ASN C . 51256 1 469 . 1 . 1 121 121 ASN CA C 13 52.3057 0.0000 . 1 . . 340000 . . 121 ASN CA . 51256 1 470 . 1 . 1 121 121 ASN CB C 13 36.3556 0.0000 . 1 . . 340004 . . 121 ASN CB . 51256 1 471 . 1 . 1 121 121 ASN N N 15 120.5673 0.0000 . 1 . . 329551 . . 121 ASN N . 51256 1 472 . 1 . 1 122 122 ARG H H 1 7.6787 0.0000 . 1 . . 324726 . . 122 ARG H . 51256 1 473 . 1 . 1 122 122 ARG C C 13 175.7985 0.0000 . 1 . . 339992 . . 122 ARG C . 51256 1 474 . 1 . 1 122 122 ARG CA C 13 55.0082 0.0000 . 1 . . 339984 . . 122 ARG CA . 51256 1 475 . 1 . 1 122 122 ARG CB C 13 32.9295 0.0000 . 1 . . 339988 . . 122 ARG CB . 51256 1 476 . 1 . 1 122 122 ARG N N 15 124.0075 0.0000 . 1 . . 324727 . . 122 ARG N . 51256 1 477 . 1 . 1 123 123 VAL H H 1 9.0943 0.0000 . 1 . . 325557 . . 123 VAL H . 51256 1 478 . 1 . 1 123 123 VAL C C 13 174.0737 0.0000 . 1 . . 333962 . . 123 VAL C . 51256 1 479 . 1 . 1 123 123 VAL CA C 13 58.5029 0.0000 . 1 . . 333471 . . 123 VAL CA . 51256 1 480 . 1 . 1 123 123 VAL CB C 13 33.1666 0.0000 . 1 . . 325565 . . 123 VAL CB . 51256 1 481 . 1 . 1 123 123 VAL N N 15 118.1991 0.0000 . 1 . . 325558 . . 123 VAL N . 51256 1 482 . 1 . 1 124 124 VAL H H 1 9.0747 0.0000 . 1 . . 329307 . . 124 VAL H . 51256 1 483 . 1 . 1 124 124 VAL C C 13 175.3278 0.0000 . 1 . . 326825 . . 124 VAL C . 51256 1 484 . 1 . 1 124 124 VAL CA C 13 60.3384 0.0000 . 1 . . 328295 . . 124 VAL CA . 51256 1 485 . 1 . 1 124 124 VAL CB C 13 33.0519 0.0000 . 1 . . 326543 . . 124 VAL CB . 51256 1 486 . 1 . 1 124 124 VAL N N 15 120.5505 0.0000 . 1 . . 329308 . . 124 VAL N . 51256 1 487 . 1 . 1 125 125 VAL H H 1 8.6158 0.0000 . 1 . . 329763 . . 125 VAL H . 51256 1 488 . 1 . 1 125 125 VAL C C 13 174.5170 0.0000 . 1 . . 340090 . . 125 VAL C . 51256 1 489 . 1 . 1 125 125 VAL CA C 13 58.8560 0.0000 . 1 . . 325904 . . 125 VAL CA . 51256 1 490 . 1 . 1 125 125 VAL CB C 13 33.7861 0.0000 . 1 . . 340086 . . 125 VAL CB . 51256 1 491 . 1 . 1 125 125 VAL N N 15 125.7925 0.0000 . 1 . . 329764 . . 125 VAL N . 51256 1 492 . 1 . 1 126 126 SER H H 1 8.8168 0.0000 . 1 . . 328593 . . 126 SER H . 51256 1 493 . 1 . 1 126 126 SER C C 13 173.2940 0.0000 . 1 . . 340074 . . 126 SER C . 51256 1 494 . 1 . 1 126 126 SER CA C 13 56.5452 0.0000 . 1 . . 340068 . . 126 SER CA . 51256 1 495 . 1 . 1 126 126 SER CB C 13 65.7222 0.0000 . 1 . . 340070 . . 126 SER CB . 51256 1 496 . 1 . 1 126 126 SER N N 15 118.1922 0.0000 . 1 . . 328594 . . 126 SER N . 51256 1 497 . 1 . 1 127 127 GLY H H 1 7.9871 0.0000 . 1 . . 328617 . . 127 GLY H . 51256 1 498 . 1 . 1 127 127 GLY C C 13 175.0575 0.0000 . 1 . . 336332 . . 127 GLY C . 51256 1 499 . 1 . 1 127 127 GLY CA C 13 44.5186 0.0000 . 1 . . 336328 . . 127 GLY CA . 51256 1 500 . 1 . 1 127 127 GLY N N 15 108.4499 0.0000 . 1 . . 328618 . . 127 GLY N . 51256 1 501 . 1 . 1 128 128 LEU H H 1 8.2971 0.0000 . 1 . . 328323 . . 128 LEU H . 51256 1 502 . 1 . 1 128 128 LEU C C 13 174.9655 0.0000 . 1 . . 326840 . . 128 LEU C . 51256 1 503 . 1 . 1 128 128 LEU CA C 13 53.1538 0.0000 . 1 . . 324818 . . 128 LEU CA . 51256 1 504 . 1 . 1 128 128 LEU CB C 13 39.5370 0.0000 . 1 . . 325175 . . 128 LEU CB . 51256 1 505 . 1 . 1 128 128 LEU N N 15 119.4971 0.0000 . 1 . . 328324 . . 128 LEU N . 51256 1 506 . 1 . 1 130 130 PRO C C 13 177.1676 0.0000 . 1 . . 327434 . . 130 PRO C . 51256 1 507 . 1 . 1 130 130 PRO CA C 13 65.1315 0.0000 . 1 . . 328556 . . 130 PRO CA . 51256 1 508 . 1 . 1 130 130 PRO CB C 13 30.8494 0.0000 . 1 . . 325313 . . 130 PRO CB . 51256 1 509 . 1 . 1 131 131 SER H H 1 7.2141 0.0000 . 1 . . 325776 . . 131 SER H . 51256 1 510 . 1 . 1 131 131 SER C C 13 174.6647 0.0000 . 1 . . 331970 . . 131 SER C . 51256 1 511 . 1 . 1 131 131 SER CA C 13 58.0112 0.0000 . 1 . . 331978 . . 131 SER CA . 51256 1 512 . 1 . 1 131 131 SER CB C 13 63.6421 0.0000 . 1 . . 325310 . . 131 SER CB . 51256 1 513 . 1 . 1 131 131 SER N N 15 106.5778 0.0000 . 1 . . 325777 . . 131 SER N . 51256 1 514 . 1 . 1 132 132 GLY H H 1 8.0233 0.0000 . 1 . . 329709 . . 132 GLY H . 51256 1 515 . 1 . 1 132 132 GLY C C 13 171.4935 0.0000 . 1 . . 326888 . . 132 GLY C . 51256 1 516 . 1 . 1 132 132 GLY CA C 13 46.3966 0.0000 . 1 . . 324983 . . 132 GLY CA . 51256 1 517 . 1 . 1 132 132 GLY N N 15 108.0046 0.0000 . 1 . . 329710 . . 132 GLY N . 51256 1 518 . 1 . 1 133 133 SER H H 1 8.5023 0.0000 . 1 . . 329871 . . 133 SER H . 51256 1 519 . 1 . 1 133 133 SER C C 13 175.5944 0.0000 . 1 . . 327608 . . 133 SER C . 51256 1 520 . 1 . 1 133 133 SER CA C 13 55.2373 0.0000 . 1 . . 326138 . . 133 SER CA . 51256 1 521 . 1 . 1 133 133 SER CB C 13 67.0682 0.0000 . 1 . . 326141 . . 133 SER CB . 51256 1 522 . 1 . 1 133 133 SER N N 15 123.1190 0.0000 . 1 . . 329872 . . 133 SER N . 51256 1 523 . 1 . 1 134 134 TRP H H 1 8.6848 0.0000 . 1 . . 326148 . . 134 TRP H . 51256 1 524 . 1 . 1 134 134 TRP C C 13 177.8048 0.0000 . 1 . . 327611 . . 134 TRP C . 51256 1 525 . 1 . 1 134 134 TRP CA C 13 59.7452 0.0000 . 1 . . 326144 . . 134 TRP CA . 51256 1 526 . 1 . 1 134 134 TRP N N 15 119.8498 0.0000 . 1 . . 326149 . . 134 TRP N . 51256 1 527 . 1 . 1 135 135 GLN H H 1 7.3618 0.0000 . 1 . . 343797 . . 135 GLN H . 51256 1 528 . 1 . 1 135 135 GLN C C 13 176.6755 0.0000 . 1 . . 344352 . . 135 GLN C . 51256 1 529 . 1 . 1 135 135 GLN CA C 13 60.5966 0.0000 . 1 . . 343799 . . 135 GLN CA . 51256 1 530 . 1 . 1 135 135 GLN N N 15 124.4998 0.0000 . 1 . . 343798 . . 135 GLN N . 51256 1 531 . 1 . 1 136 136 ASP H H 1 7.2716 0.0000 . 1 . . 327726 . . 136 ASP H . 51256 1 532 . 1 . 1 136 136 ASP C C 13 173.3597 0.0000 . 1 . . . . . 136 ASP C . 51256 1 533 . 1 . 1 136 136 ASP CA C 13 56.0160 0.0000 . 1 . . 334695 . . 136 ASP CA . 51256 1 534 . 1 . 1 136 136 ASP CB C 13 41.3724 0.0000 . 1 . . 326177 . . 136 ASP CB . 51256 1 535 . 1 . 1 136 136 ASP N N 15 118.5142 0.0000 . 1 . . 327727 . . 136 ASP N . 51256 1 536 . 1 . 1 137 137 LEU H H 1 8.3175 0.0000 . 1 . . 339748 . . 137 LEU H . 51256 1 537 . 1 . 1 137 137 LEU C C 13 174.7075 0.0000 . 1 . . -1 . . 137 LEU C . 51256 1 538 . 1 . 1 137 137 LEU N N 15 122.4076 0.0000 . 1 . . 339749 . . 137 LEU N . 51256 1 539 . 1 . 1 138 138 LYS C C 13 174.0657 0.0000 . 1 . . -1 . . 138 LYS C . 51256 1 540 . 1 . 1 138 138 LYS CA C 13 53.5882 0.0000 . 1 . . -1 . . 138 LYS CA . 51256 1 541 . 1 . 1 138 138 LYS CB C 13 30.3600 0.0000 . 1 . . -1 . . 138 LYS CB . 51256 1 542 . 1 . 1 139 139 ASP C C 13 178.7506 0.0000 . 1 . . . . . 139 ASP C . 51256 1 543 . 1 . 1 139 139 ASP CB C 13 38.5233 0.0000 . 1 . . -1 . . 139 ASP CB . 51256 1 544 . 1 . 1 140 140 HIS H H 1 7.8357 0.0000 . 1 . . 327810 . . 140 HIS H . 51256 1 545 . 1 . 1 140 140 HIS C C 13 177.6168 0.0000 . 1 . . 336359 . . 140 HIS C . 51256 1 546 . 1 . 1 140 140 HIS CA C 13 59.6042 0.0000 . 1 . . 328973 . . 140 HIS CA . 51256 1 547 . 1 . 1 140 140 HIS CB C 13 32.0730 0.0000 . 1 . . 336355 . . 140 HIS CB . 51256 1 548 . 1 . 1 140 140 HIS N N 15 119.4714 0.0000 . 1 . . 327811 . . 140 HIS N . 51256 1 549 . 1 . 1 141 141 MET H H 1 7.9834 0.0000 . 1 . . 324948 . . 141 MET H . 51256 1 550 . 1 . 1 141 141 MET C C 13 177.5954 0.0000 . 1 . . 338906 . . 141 MET C . 51256 1 551 . 1 . 1 141 141 MET CA C 13 54.8479 0.0000 . 1 . . 334299 . . 141 MET CA . 51256 1 552 . 1 . 1 141 141 MET CB C 13 30.3600 0.0000 . 1 . . 338902 . . 141 MET CB . 51256 1 553 . 1 . 1 141 141 MET N N 15 112.7376 0.0000 . 1 . . 324949 . . 141 MET N . 51256 1 554 . 1 . 1 142 142 ARG H H 1 7.8428 0.0000 . 1 . . 339712 . . 142 ARG H . 51256 1 555 . 1 . 1 142 142 ARG C C 13 177.5883 0.0000 . 1 . . 339735 . . 142 ARG C . 51256 1 556 . 1 . 1 142 142 ARG CA C 13 57.7688 0.0000 . 1 . . 339729 . . 142 ARG CA . 51256 1 557 . 1 . 1 142 142 ARG CB C 13 28.7693 0.0000 . 1 . . 339720 . . 142 ARG CB . 51256 1 558 . 1 . 1 142 142 ARG N N 15 119.9337 0.0000 . 1 . . 339713 . . 142 ARG N . 51256 1 559 . 1 . 1 143 143 GLU H H 1 7.1217 0.0000 . 1 . . 325551 . . 143 GLU H . 51256 1 560 . 1 . 1 143 143 GLU C C 13 177.1851 0.0000 . 1 . . 327125 . . 143 GLU C . 51256 1 561 . 1 . 1 143 143 GLU CA C 13 58.0135 0.0000 . 1 . . 324827 . . 143 GLU CA . 51256 1 562 . 1 . 1 143 143 GLU CB C 13 28.9146 0.0000 . 1 . . 325553 . . 143 GLU CB . 51256 1 563 . 1 . 1 143 143 GLU N N 15 118.6240 0.0000 . 1 . . 325552 . . 143 GLU N . 51256 1 564 . 1 . 1 144 144 ALA H H 1 7.9403 0.0000 . 1 . . 329574 . . 144 ALA H . 51256 1 565 . 1 . 1 144 144 ALA C C 13 175.2535 0.0000 . 1 . . 327002 . . 144 ALA C . 51256 1 566 . 1 . 1 144 144 ALA CA C 13 52.0640 0.0000 . 1 . . 328349 . . 144 ALA CA . 51256 1 567 . 1 . 1 144 144 ALA CB C 13 19.7146 0.0000 . 1 . . 325199 . . 144 ALA CB . 51256 1 568 . 1 . 1 144 144 ALA N N 15 118.0589 0.0000 . 1 . . 329575 . . 144 ALA N . 51256 1 569 . 1 . 1 145 145 GLY H H 1 7.1786 0.0000 . 1 . . 325335 . . 145 GLY H . 51256 1 570 . 1 . 1 145 145 GLY C C 13 171.6524 0.0000 . 1 . . 326894 . . 145 GLY C . 51256 1 571 . 1 . 1 145 145 GLY CA C 13 43.6024 0.0000 . 1 . . 325001 . . 145 GLY CA . 51256 1 572 . 1 . 1 145 145 GLY N N 15 103.1346 0.0000 . 1 . . 325336 . . 145 GLY N . 51256 1 573 . 1 . 1 146 146 ASP H H 1 7.7254 0.0000 . 1 . . 328398 . . 146 ASP H . 51256 1 574 . 1 . 1 146 146 ASP C C 13 176.7183 0.0000 . 1 . . 332105 . . 146 ASP C . 51256 1 575 . 1 . 1 146 146 ASP CA C 13 55.8110 0.0000 . 1 . . 328400 . . 146 ASP CA . 51256 1 576 . 1 . 1 146 146 ASP CB C 13 40.1488 0.0000 . 1 . . 332101 . . 146 ASP CB . 51256 1 577 . 1 . 1 146 146 ASP N N 15 116.3521 0.0000 . 1 . . 328399 . . 146 ASP N . 51256 1 578 . 1 . 1 147 147 VAL H H 1 8.1666 0.0000 . 1 . . 326460 . . 147 VAL H . 51256 1 579 . 1 . 1 147 147 VAL C C 13 175.3918 0.0000 . 1 . . 327779 . . 147 VAL C . 51256 1 580 . 1 . 1 147 147 VAL CA C 13 60.7340 0.0000 . 1 . . 328946 . . 147 VAL CA . 51256 1 581 . 1 . 1 147 147 VAL CB C 13 33.0519 0.0000 . 1 . . 326453 . . 147 VAL CB . 51256 1 582 . 1 . 1 147 147 VAL N N 15 127.4007 0.0000 . 1 . . 326461 . . 147 VAL N . 51256 1 583 . 1 . 1 148 148 CYS H H 1 8.7053 0.0000 . 1 . . 330015 . . 148 CYS H . 51256 1 584 . 1 . 1 148 148 CYS C C 13 174.0268 0.0000 . 1 . . 327758 . . 148 CYS C . 51256 1 585 . 1 . 1 148 148 CYS CA C 13 57.1611 0.0000 . 1 . . 328925 . . 148 CYS CA . 51256 1 586 . 1 . 1 148 148 CYS CB C 13 29.0140 0.0000 . 1 . . 326408 . . 148 CYS CB . 51256 1 587 . 1 . 1 148 148 CYS N N 15 122.3452 0.0000 . 1 . . 330016 . . 148 CYS N . 51256 1 588 . 1 . 1 149 149 TYR H H 1 7.2444 0.0000 . 1 . . 328785 . . 149 TYR H . 51256 1 589 . 1 . 1 149 149 TYR C C 13 172.3757 0.0000 . 1 . . 327623 . . 149 TYR C . 51256 1 590 . 1 . 1 149 149 TYR CA C 13 58.2136 0.0000 . 1 . . 326171 . . 149 TYR CA . 51256 1 591 . 1 . 1 149 149 TYR CB C 13 42.3513 0.0000 . 1 . . 326168 . . 149 TYR CB . 51256 1 592 . 1 . 1 149 149 TYR N N 15 121.1599 0.0000 . 1 . . 328786 . . 149 TYR N . 51256 1 593 . 1 . 1 151 151 ASP C C 13 173.8946 0.0000 . 1 . . 340160 . . 151 ASP C . 51256 1 594 . 1 . 1 151 151 ASP CA C 13 53.1302 0.0000 . 1 . . 339645 . . 151 ASP CA . 51256 1 595 . 1 . 1 151 151 ASP CB C 13 44.1867 0.0000 . 1 . . 339651 . . 151 ASP CB . 51256 1 596 . 1 . 1 152 152 VAL H H 1 7.8633 0.0000 . 1 . . 325611 . . 152 VAL H . 51256 1 597 . 1 . 1 152 152 VAL C C 13 174.3344 0.0000 . 1 . . 327302 . . 152 VAL C . 51256 1 598 . 1 . 1 152 152 VAL CA C 13 60.3218 0.0000 . 1 . . 332005 . . 152 VAL CA . 51256 1 599 . 1 . 1 152 152 VAL CB C 13 34.2755 0.0000 . 1 . . 325607 . . 152 VAL CB . 51256 1 600 . 1 . 1 152 152 VAL N N 15 116.0595 0.0000 . 1 . . 325612 . . 152 VAL N . 51256 1 601 . 1 . 1 153 153 TYR H H 1 8.5287 0.0000 . 1 . . 329493 . . 153 TYR H . 51256 1 602 . 1 . 1 153 153 TYR C C 13 176.8433 0.0000 . 1 . . 326936 . . 153 TYR C . 51256 1 603 . 1 . 1 153 153 TYR CA C 13 55.6887 0.0000 . 1 . . 325454 . . 153 TYR CA . 51256 1 604 . 1 . 1 153 153 TYR CB C 13 38.3134 0.0000 . 1 . . 325064 . . 153 TYR CB . 51256 1 605 . 1 . 1 153 153 TYR N N 15 124.4847 0.0000 . 1 . . 329494 . . 153 TYR N . 51256 1 606 . 1 . 1 154 154 ARG H H 1 8.4429 0.0000 . 1 . . 329880 . . 154 ARG H . 51256 1 607 . 1 . 1 154 154 ARG C C 13 175.3934 0.0000 . 1 . . 327617 . . 154 ARG C . 51256 1 608 . 1 . 1 154 154 ARG CA C 13 57.4360 0.0000 . 1 . . 326159 . . 154 ARG CA . 51256 1 609 . 1 . 1 154 154 ARG CB C 13 28.4022 0.0000 . 1 . . 326165 . . 154 ARG CB . 51256 1 610 . 1 . 1 154 154 ARG N N 15 118.0316 0.0000 . 1 . . 329881 . . 154 ARG N . 51256 1 611 . 1 . 1 155 155 ASP H H 1 7.8960 0.0000 . 1 . . 325215 . . 155 ASP H . 51256 1 612 . 1 . 1 155 155 ASP C C 13 176.9322 0.0000 . 1 . . 326846 . . 155 ASP C . 51256 1 613 . 1 . 1 155 155 ASP CA C 13 52.6263 0.0000 . 1 . . 328046 . . 155 ASP CA . 51256 1 614 . 1 . 1 155 155 ASP CB C 13 39.7817 0.0000 . 1 . . 325217 . . 155 ASP CB . 51256 1 615 . 1 . 1 155 155 ASP N N 15 117.8243 0.0000 . 1 . . 325216 . . 155 ASP N . 51256 1 616 . 1 . 1 156 156 GLY H H 1 7.9844 0.0000 . 1 . . 329694 . . 156 GLY H . 51256 1 617 . 1 . 1 156 156 GLY CA C 13 45.7774 0.0000 . 1 . . 324974 . . 156 GLY CA . 51256 1 618 . 1 . 1 156 156 GLY N N 15 108.6737 0.0000 . 1 . . 329695 . . 156 GLY N . 51256 1 619 . 1 . 1 157 157 THR H H 1 7.5420 0.0000 . 1 . . 326706 . . 157 THR H . 51256 1 620 . 1 . 1 157 157 THR C C 13 174.0252 0.0000 . 1 . . 339588 . . 157 THR C . 51256 1 621 . 1 . 1 157 157 THR CA C 13 59.5431 0.0000 . 1 . . 339582 . . 157 THR CA . 51256 1 622 . 1 . 1 157 157 THR CB C 13 71.8403 0.0000 . 1 . . 339584 . . 157 THR CB . 51256 1 623 . 1 . 1 157 157 THR N N 15 110.5866 0.0000 . 1 . . 326707 . . 157 THR N . 51256 1 624 . 1 . 1 158 158 GLY H H 1 8.6882 0.0000 . 1 . . 325314 . . 158 GLY H . 51256 1 625 . 1 . 1 158 158 GLY C C 13 171.6131 0.0000 . 1 . . 332205 . . 158 GLY C . 51256 1 626 . 1 . 1 158 158 GLY CA C 13 45.2564 0.0000 . 1 . . 334243 . . 158 GLY CA . 51256 1 627 . 1 . 1 158 158 GLY N N 15 105.9814 0.0000 . 1 . . 325315 . . 158 GLY N . 51256 1 628 . 1 . 1 159 159 VAL H H 1 8.6068 0.0000 . 1 . . 328380 . . 159 VAL H . 51256 1 629 . 1 . 1 159 159 VAL C C 13 174.1085 0.0000 . 1 . . 326852 . . 159 VAL C . 51256 1 630 . 1 . 1 159 159 VAL CA C 13 59.0850 0.0000 . 1 . . 332037 . . 159 VAL CA . 51256 1 631 . 1 . 1 159 159 VAL CB C 13 35.1320 0.0000 . 1 . . 325235 . . 159 VAL CB . 51256 1 632 . 1 . 1 159 159 VAL N N 15 117.0915 0.0000 . 1 . . 328381 . . 159 VAL N . 51256 1 633 . 1 . 1 160 160 VAL H H 1 8.4881 0.0000 . 1 . . 329529 . . 160 VAL H . 51256 1 634 . 1 . 1 160 160 VAL C C 13 173.5619 0.0000 . 1 . . 332085 . . 160 VAL C . 51256 1 635 . 1 . 1 160 160 VAL CA C 13 60.4607 0.0000 . 1 . . 328262 . . 160 VAL CA . 51256 1 636 . 1 . 1 160 160 VAL CB C 13 33.7861 0.0000 . 1 . . 332081 . . 160 VAL CB . 51256 1 637 . 1 . 1 160 160 VAL N N 15 121.7295 0.0000 . 1 . . 329530 . . 160 VAL N . 51256 1 638 . 1 . 1 161 161 GLU H H 1 8.8305 0.0000 . 1 . . 329898 . . 161 GLU H . 51256 1 639 . 1 . 1 161 161 GLU C C 13 175.7022 0.0000 . 1 . . 327629 . . 161 GLU C . 51256 1 640 . 1 . 1 161 161 GLU CA C 13 53.6799 0.0000 . 1 . . 328805 . . 161 GLU CA . 51256 1 641 . 1 . 1 161 161 GLU CB C 13 30.1764 0.0000 . 1 . . 326189 . . 161 GLU CB . 51256 1 642 . 1 . 1 161 161 GLU N N 15 125.1350 0.0000 . 1 . . 329899 . . 161 GLU N . 51256 1 643 . 1 . 1 162 162 PHE H H 1 8.5776 0.0000 . 1 . . 325134 . . 162 PHE H . 51256 1 644 . 1 . 1 162 162 PHE C C 13 177.2745 0.0000 . 1 . . 326918 . . 162 PHE C . 51256 1 645 . 1 . 1 162 162 PHE CA C 13 57.6192 0.0000 . 1 . . 327998 . . 162 PHE CA . 51256 1 646 . 1 . 1 162 162 PHE CB C 13 41.0054 0.0000 . 1 . . 325034 . . 162 PHE CB . 51256 1 647 . 1 . 1 162 162 PHE N N 15 121.0845 0.0000 . 1 . . 325135 . . 162 PHE N . 51256 1 648 . 1 . 1 163 163 VAL H H 1 7.9549 0.0000 . 1 . . 327663 . . 163 VAL H . 51256 1 649 . 1 . 1 163 163 VAL C C 13 176.4478 0.0000 . 1 . . 327665 . . 163 VAL C . 51256 1 650 . 1 . 1 163 163 VAL CA C 13 66.5515 0.0000 . 1 . . 326252 . . 163 VAL CA . 51256 1 651 . 1 . 1 163 163 VAL CB C 13 31.2165 0.0000 . 1 . . 326261 . . 163 VAL CB . 51256 1 652 . 1 . 1 163 163 VAL N N 15 125.2343 0.0000 . 1 . . 327664 . . 163 VAL N . 51256 1 653 . 1 . 1 164 164 ARG H H 1 9.5171 0.0000 . 1 . . 325572 . . 164 ARG H . 51256 1 654 . 1 . 1 164 164 ARG C C 13 177.4117 0.0000 . 1 . . 327014 . . 164 ARG C . 51256 1 655 . 1 . 1 164 164 ARG CA C 13 54.2203 0.0000 . 1 . . 328043 . . 164 ARG CA . 51256 1 656 . 1 . 1 164 164 ARG CB C 13 31.0941 0.0000 . 1 . . 325577 . . 164 ARG CB . 51256 1 657 . 1 . 1 164 164 ARG N N 15 117.7595 0.0000 . 1 . . 325573 . . 164 ARG N . 51256 1 658 . 1 . 1 165 165 LYS H H 1 8.8732 0.0000 . 1 . . 329475 . . 165 LYS H . 51256 1 659 . 1 . 1 165 165 LYS C C 13 178.6650 0.0000 . 1 . . 327113 . . 165 LYS C . 51256 1 660 . 1 . 1 165 165 LYS CA C 13 59.7484 0.0000 . 1 . . 328166 . . 165 LYS CA . 51256 1 661 . 1 . 1 165 165 LYS CB C 13 31.2165 0.0000 . 1 . . 325376 . . 165 LYS CB . 51256 1 662 . 1 . 1 165 165 LYS N N 15 127.4048 0.0000 . 1 . . 329476 . . 165 LYS N . 51256 1 663 . 1 . 1 166 166 GLU H H 1 9.5972 0.0000 . 1 . . 328365 . . 166 GLU H . 51256 1 664 . 1 . 1 166 166 GLU C C 13 178.2780 0.0000 . 1 . . 327269 . . 166 GLU C . 51256 1 665 . 1 . 1 166 166 GLU CA C 13 59.2371 0.0000 . 1 . . 325589 . . 166 GLU CA . 51256 1 666 . 1 . 1 166 166 GLU CB C 13 27.9128 0.0000 . 1 . . 325583 . . 166 GLU CB . 51256 1 667 . 1 . 1 166 166 GLU N N 15 117.6509 0.0000 . 1 . . 328366 . . 166 GLU N . 51256 1 668 . 1 . 1 167 167 ASP H H 1 6.7015 0.0000 . 1 . . 328728 . . 167 ASP H . 51256 1 669 . 1 . 1 167 167 ASP C C 13 176.2603 0.0000 . 1 . . 327560 . . 167 ASP C . 51256 1 670 . 1 . 1 167 167 ASP CA C 13 55.9334 0.0000 . 1 . . 326036 . . 167 ASP CA . 51256 1 671 . 1 . 1 167 167 ASP CB C 13 39.2923 0.0000 . 1 . . 326039 . . 167 ASP CB . 51256 1 672 . 1 . 1 167 167 ASP N N 15 120.7554 0.0000 . 1 . . 328729 . . 167 ASP N . 51256 1 673 . 1 . 1 168 168 MET H H 1 6.8302 0.0000 . 1 . . 326019 . . 168 MET H . 51256 1 674 . 1 . 1 168 168 MET C C 13 176.7978 0.0000 . 1 . . 332840 . . 168 MET C . 51256 1 675 . 1 . 1 168 168 MET CA C 13 58.4437 0.0000 . 1 . . 332828 . . 168 MET CA . 51256 1 676 . 1 . 1 168 168 MET CB C 13 32.1954 0.0000 . 1 . . 332837 . . 168 MET CB . 51256 1 677 . 1 . 1 168 168 MET N N 15 120.4613 0.0000 . 1 . . 326020 . . 168 MET N . 51256 1 678 . 1 . 1 169 169 THR H H 1 7.7137 0.0000 . 1 . . 327051 . . 169 THR H . 51256 1 679 . 1 . 1 169 169 THR C C 13 176.5851 0.0000 . 1 . . 332089 . . 169 THR C . 51256 1 680 . 1 . 1 169 169 THR CA C 13 65.7728 0.0000 . 1 . . 324941 . . 169 THR CA . 51256 1 681 . 1 . 1 169 169 THR CB C 13 67.8024 0.0000 . 1 . . 325268 . . 169 THR CB . 51256 1 682 . 1 . 1 169 169 THR N N 15 113.0935 0.0000 . 1 . . 327052 . . 169 THR N . 51256 1 683 . 1 . 1 170 170 TYR H H 1 7.3213 0.0000 . 1 . . 326049 . . 170 TYR H . 51256 1 684 . 1 . 1 170 170 TYR C C 13 176.6114 0.0000 . 1 . . . . . 170 TYR C . 51256 1 685 . 1 . 1 170 170 TYR CA C 13 60.7417 0.0000 . 1 . . 334567 . . 170 TYR CA . 51256 1 686 . 1 . 1 170 170 TYR CB C 13 37.6409 0.0000 . 1 . . 338754 . . 170 TYR CB . 51256 1 687 . 1 . 1 170 170 TYR N N 15 122.8915 0.0000 . 1 . . 326050 . . 170 TYR N . 51256 1 688 . 1 . 1 171 171 ALA H H 1 8.0790 0.0000 . 1 . . 338708 . . 171 ALA H . 51256 1 689 . 1 . 1 171 171 ALA CA C 13 54.9545 0.0000 . 1 . . 328433 . . 171 ALA CA . 51256 1 690 . 1 . 1 171 171 ALA CB C 13 18.4910 0.0000 . 1 . . 325643 . . 171 ALA CB . 51256 1 691 . 1 . 1 171 171 ALA N N 15 120.8252 0.0000 . 1 . . 338709 . . 171 ALA N . 51256 1 692 . 1 . 1 172 172 VAL H H 1 7.3522 0.0000 . 1 . . 329637 . . 172 VAL H . 51256 1 693 . 1 . 1 172 172 VAL C C 13 177.1462 0.0000 . 1 . . 327929 . . 172 VAL C . 51256 1 694 . 1 . 1 172 172 VAL CA C 13 65.7269 0.0000 . 1 . . 325634 . . 172 VAL CA . 51256 1 695 . 1 . 1 172 172 VAL CB C 13 30.8494 0.0000 . 1 . . 325637 . . 172 VAL CB . 51256 1 696 . 1 . 1 172 172 VAL N N 15 115.6765 0.0000 . 1 . . 329638 . . 172 VAL N . 51256 1 697 . 1 . 1 173 173 ARG H H 1 7.2822 0.0000 . 1 . . 329355 . . 173 ARG H . 51256 1 698 . 1 . 1 173 173 ARG C C 13 178.4511 0.0000 . 1 . . 327281 . . 173 ARG C . 51256 1 699 . 1 . 1 173 173 ARG CA C 13 58.0773 0.0000 . 1 . . 324884 . . 173 ARG CA . 51256 1 700 . 1 . 1 173 173 ARG CB C 13 29.8705 0.0000 . 1 . . 325238 . . 173 ARG CB . 51256 1 701 . 1 . 1 173 173 ARG N N 15 116.7050 0.0000 . 1 . . 329356 . . 173 ARG N . 51256 1 702 . 1 . 1 174 174 LYS H H 1 8.4540 0.0000 . 1 . . 329622 . . 174 LYS H . 51256 1 703 . 1 . 1 174 174 LYS C C 13 177.6509 0.0000 . 1 . . 327308 . . 174 LYS C . 51256 1 704 . 1 . 1 174 174 LYS CA C 13 55.8786 0.0000 . 1 . . 324923 . . 174 LYS CA . 51256 1 705 . 1 . 1 174 174 LYS CB C 13 32.5625 0.0000 . 1 . . 325616 . . 174 LYS CB . 51256 1 706 . 1 . 1 174 174 LYS N N 15 115.8379 0.0000 . 1 . . 329623 . . 174 LYS N . 51256 1 707 . 1 . 1 175 175 LEU H H 1 8.0807 0.0000 . 1 . . 329646 . . 175 LEU H . 51256 1 708 . 1 . 1 175 175 LEU C C 13 178.3315 0.0000 . 1 . . 327041 . . 175 LEU C . 51256 1 709 . 1 . 1 175 175 LEU CA C 13 53.6799 0.0000 . 1 . . 324932 . . 175 LEU CA . 51256 1 710 . 1 . 1 175 175 LEU CB C 13 41.0054 0.0000 . 1 . . 325253 . . 175 LEU CB . 51256 1 711 . 1 . 1 175 175 LEU N N 15 114.8515 0.0000 . 1 . . 329647 . . 175 LEU N . 51256 1 712 . 1 . 1 176 176 ASP H H 1 6.8411 0.0000 . 1 . . 326010 . . 176 ASP H . 51256 1 713 . 1 . 1 176 176 ASP C C 13 176.4081 0.0000 . 1 . . 327557 . . 176 ASP C . 51256 1 714 . 1 . 1 176 176 ASP CA C 13 56.5595 0.0000 . 1 . . 328718 . . 176 ASP CA . 51256 1 715 . 1 . 1 176 176 ASP CB C 13 41.3724 0.0000 . 1 . . 326012 . . 176 ASP CB . 51256 1 716 . 1 . 1 176 176 ASP N N 15 120.1289 0.0000 . 1 . . 326011 . . 176 ASP N . 51256 1 717 . 1 . 1 177 177 ASN H H 1 9.0169 0.0000 . 1 . . 329496 . . 177 ASN H . 51256 1 718 . 1 . 1 177 177 ASN C C 13 174.9428 0.0000 . 1 . . 327167 . . 177 ASN C . 51256 1 719 . 1 . 1 177 177 ASN CA C 13 53.9756 0.0000 . 1 . . 324725 . . 177 ASN CA . 51256 1 720 . 1 . 1 177 177 ASN CB C 13 37.0898 0.0000 . 1 . . 325070 . . 177 ASN CB . 51256 1 721 . 1 . 1 177 177 ASN N N 15 124.2189 0.0000 . 1 . . 329497 . . 177 ASN N . 51256 1 722 . 1 . 1 178 178 THR H H 1 7.0977 0.0000 . 1 . . 328746 . . 178 THR H . 51256 1 723 . 1 . 1 178 178 THR C C 13 173.5127 0.0000 . 1 . . 327578 . . 178 THR C . 51256 1 724 . 1 . 1 178 178 THR CA C 13 59.9713 0.0000 . 1 . . 326072 . . 178 THR CA . 51256 1 725 . 1 . 1 178 178 THR CB C 13 72.5744 0.0000 . 1 . . 326075 . . 178 THR CB . 51256 1 726 . 1 . 1 178 178 THR N N 15 105.5281 0.0000 . 1 . . 328747 . . 178 THR N . 51256 1 727 . 1 . 1 179 179 LYS H H 1 8.2527 0.0000 . 1 . . 324795 . . 179 LYS H . 51256 1 728 . 1 . 1 179 179 LYS C C 13 174.4272 0.0000 . 1 . . 326828 . . 179 LYS C . 51256 1 729 . 1 . 1 179 179 LYS CA C 13 56.1781 0.0000 . 1 . . 328025 . . 179 LYS CA . 51256 1 730 . 1 . 1 179 179 LYS CB C 13 31.3389 0.0000 . 1 . . 325160 . . 179 LYS CB . 51256 1 731 . 1 . 1 179 179 LYS N N 15 120.5380 0.0000 . 1 . . 324796 . . 179 LYS N . 51256 1 732 . 1 . 1 180 180 PHE H H 1 9.1022 0.0000 . 1 . . 325944 . . 180 PHE H . 51256 1 733 . 1 . 1 180 180 PHE C C 13 172.4827 0.0000 . 1 . . 327515 . . 180 PHE C . 51256 1 734 . 1 . 1 180 180 PHE CA C 13 55.6037 0.0000 . 1 . . 328667 . . 180 PHE CA . 51256 1 735 . 1 . 1 180 180 PHE CB C 13 42.3513 0.0000 . 1 . . 325940 . . 180 PHE CB . 51256 1 736 . 1 . 1 180 180 PHE N N 15 132.4067 0.0000 . 1 . . 325945 . . 180 PHE N . 51256 1 737 . 1 . 1 181 181 ARG H H 1 8.0708 0.0000 . 1 . . 329772 . . 181 ARG H . 51256 1 738 . 1 . 1 181 181 ARG C C 13 174.7333 0.0000 . 1 . . 327500 . . 181 ARG C . 51256 1 739 . 1 . 1 181 181 ARG CA C 13 53.2676 0.0000 . 1 . . 325919 . . 181 ARG CA . 51256 1 740 . 1 . 1 181 181 ARG CB C 13 31.7059 0.0000 . 1 . . 325925 . . 181 ARG CB . 51256 1 741 . 1 . 1 181 181 ARG N N 15 128.4796 0.0000 . 1 . . 329773 . . 181 ARG N . 51256 1 742 . 1 . 1 182 182 SER H H 1 9.0100 0.0000 . 1 . . 328644 . . 182 SER H . 51256 1 743 . 1 . 1 182 182 SER C C 13 176.3569 0.0000 . 1 . . 327476 . . 182 SER C . 51256 1 744 . 1 . 1 182 182 SER CA C 13 55.7411 0.0000 . 1 . . 325868 . . 182 SER CA . 51256 1 745 . 1 . 1 182 182 SER N N 15 121.2162 0.0000 . 1 . . 328645 . . 182 SER N . 51256 1 746 . 1 . 1 183 183 HIS H H 1 9.7551 0.0000 . 1 . . 328908 . . 183 HIS H . 51256 1 747 . 1 . 1 183 183 HIS C C 13 174.7930 0.0000 . 1 . . 327101 . . 183 HIS C . 51256 1 748 . 1 . 1 183 183 HIS CA C 13 57.6650 0.0000 . 1 . . 328913 . . 183 HIS CA . 51256 1 749 . 1 . 1 183 183 HIS CB C 13 26.0773 0.0000 . 1 . . 326390 . . 183 HIS CB . 51256 1 750 . 1 . 1 183 183 HIS N N 15 118.0868 0.0000 . 1 . . 328909 . . 183 HIS N . 51256 1 751 . 1 . 1 184 184 GLU H H 1 6.8918 0.0000 . 1 . . 329607 . . 184 GLU H . 51256 1 752 . 1 . 1 184 184 GLU C C 13 175.9985 0.0000 . 1 . . 327104 . . 184 GLU C . 51256 1 753 . 1 . 1 184 184 GLU CA C 13 54.8321 0.0000 . 1 . . 324875 . . 184 GLU CA . 51256 1 754 . 1 . 1 184 184 GLU CB C 13 28.8916 0.0000 . 1 . . 325595 . . 184 GLU CB . 51256 1 755 . 1 . 1 184 184 GLU N N 15 117.0743 0.0000 . 1 . . 329608 . . 184 GLU N . 51256 1 756 . 1 . 1 185 185 GLY H H 1 7.6512 0.0000 . 1 . . 327069 . . 185 GLY H . 51256 1 757 . 1 . 1 185 185 GLY C C 13 174.2155 0.0000 . 1 . . 339528 . . 185 GLY C . 51256 1 758 . 1 . 1 185 185 GLY CA C 13 44.9209 0.0000 . 1 . . 339524 . . 185 GLY CA . 51256 1 759 . 1 . 1 185 185 GLY N N 15 108.3404 0.0000 . 1 . . 327070 . . 185 GLY N . 51256 1 760 . 1 . 1 186 186 GLU H H 1 6.9657 0.0000 . 1 . . 329805 . . 186 GLU H . 51256 1 761 . 1 . 1 186 186 GLU C C 13 176.0803 0.0000 . 1 . . 339544 . . 186 GLU C . 51256 1 762 . 1 . 1 186 186 GLU CA C 13 55.9795 0.0000 . 1 . . 339536 . . 186 GLU CA . 51256 1 763 . 1 . 1 186 186 GLU CB C 13 31.0941 0.0000 . 1 . . 339540 . . 186 GLU CB . 51256 1 764 . 1 . 1 186 186 GLU N N 15 118.6432 0.0000 . 1 . . 329806 . . 186 GLU N . 51256 1 765 . 1 . 1 187 187 THR H H 1 8.3682 0.0000 . 1 . . 329649 . . 187 THR H . 51256 1 766 . 1 . 1 187 187 THR C C 13 174.2423 0.0000 . 1 . . 327332 . . 187 THR C . 51256 1 767 . 1 . 1 187 187 THR CA C 13 59.0392 0.0000 . 1 . . 328445 . . 187 THR CA . 51256 1 768 . 1 . 1 187 187 THR CB C 13 71.4732 0.0000 . 1 . . 325658 . . 187 THR CB . 51256 1 769 . 1 . 1 187 187 THR N N 15 114.5763 0.0000 . 1 . . 329650 . . 187 THR N . 51256 1 770 . 1 . 1 188 188 ALA H H 1 8.5752 0.0000 . 1 . . 328230 . . 188 ALA H . 51256 1 771 . 1 . 1 188 188 ALA C C 13 175.2579 0.0000 . 1 . . 327191 . . 188 ALA C . 51256 1 772 . 1 . 1 188 188 ALA CA C 13 51.2748 0.0000 . 1 . . 325862 . . 188 ALA CA . 51256 1 773 . 1 . 1 188 188 ALA CB C 13 23.2018 0.0000 . 1 . . 325499 . . 188 ALA CB . 51256 1 774 . 1 . 1 188 188 ALA N N 15 123.1942 0.0000 . 1 . . 328231 . . 188 ALA N . 51256 1 775 . 1 . 1 189 189 TYR H H 1 8.5366 0.0000 . 1 . . 329544 . . 189 TYR H . 51256 1 776 . 1 . 1 189 189 TYR C C 13 176.5140 0.0000 . 1 . . 326816 . . 189 TYR C . 51256 1 777 . 1 . 1 189 189 TYR CA C 13 58.0586 0.0000 . 1 . . 324782 . . 189 TYR CA . 51256 1 778 . 1 . 1 189 189 TYR CB C 13 37.8240 0.0000 . 1 . . 325043 . . 189 TYR CB . 51256 1 779 . 1 . 1 189 189 TYR N N 15 120.8176 0.0000 . 1 . . 329545 . . 189 TYR N . 51256 1 780 . 1 . 1 190 190 ILE H H 1 8.0356 0.0000 . 1 . . 329616 . . 190 ILE H . 51256 1 781 . 1 . 1 190 190 ILE C C 13 175.5918 0.0000 . 1 . . 326858 . . 190 ILE C . 51256 1 782 . 1 . 1 190 190 ILE CA C 13 59.3140 0.0000 . 1 . . 324902 . . 190 ILE CA . 51256 1 783 . 1 . 1 190 190 ILE CB C 13 39.8410 0.0000 . 1 . . 332049 . . 190 ILE CB . 51256 1 784 . 1 . 1 190 190 ILE N N 15 116.2079 0.0000 . 1 . . 329617 . . 190 ILE N . 51256 1 785 . 1 . 1 191 191 ARG H H 1 8.1552 0.0000 . 1 . . 327003 . . 191 ARG H . 51256 1 786 . 1 . 1 191 191 ARG C C 13 176.1026 0.0000 . 1 . . 327482 . . 191 ARG C . 51256 1 787 . 1 . 1 191 191 ARG CA C 13 51.6644 0.0000 . 1 . . 328652 . . 191 ARG CA . 51256 1 788 . 1 . 1 191 191 ARG CB C 13 29.1364 0.0000 . 1 . . 325889 . . 191 ARG CB . 51256 1 789 . 1 . 1 191 191 ARG N N 15 118.0037 0.0000 . 1 . . 327004 . . 191 ARG N . 51256 1 790 . 1 . 1 192 192 VAL H H 1 8.9056 0.0000 . 1 . . 329754 . . 192 VAL H . 51256 1 791 . 1 . 1 192 192 VAL C C 13 173.7482 0.0000 . 1 . . 327485 . . 192 VAL C . 51256 1 792 . 1 . 1 192 192 VAL CA C 13 60.9444 0.0000 . 1 . . 325880 . . 192 VAL CA . 51256 1 793 . 1 . 1 192 192 VAL CB C 13 34.3979 0.0000 . 1 . . 325883 . . 192 VAL CB . 51256 1 794 . 1 . 1 192 192 VAL N N 15 121.8912 0.0000 . 1 . . 329755 . . 192 VAL N . 51256 1 795 . 1 . 1 193 193 LYS H H 1 8.5696 0.0000 . 1 . . 329076 . . 193 LYS H . 51256 1 796 . 1 . 1 193 193 LYS C C 13 174.9588 0.0000 . 1 . . 326801 . . 193 LYS C . 51256 1 797 . 1 . 1 193 193 LYS CA C 13 54.0980 0.0000 . 1 . . 329078 . . 193 LYS CA . 51256 1 798 . 1 . 1 193 193 LYS CB C 13 35.4991 0.0000 . 1 . . 325010 . . 193 LYS CB . 51256 1 799 . 1 . 1 193 193 LYS N N 15 123.5275 0.0000 . 1 . . 329077 . . 193 LYS N . 51256 1 800 . 1 . 1 194 194 VAL H H 1 8.4812 0.0000 . 1 . . 329547 . . 194 VAL H . 51256 1 801 . 1 . 1 194 194 VAL C C 13 175.9301 0.0000 . 1 . . 327215 . . 194 VAL C . 51256 1 802 . 1 . 1 194 194 VAL CA C 13 63.8868 0.0000 . 1 . . 324767 . . 194 VAL CA . 51256 1 803 . 1 . 1 194 194 VAL CB C 13 31.5836 0.0000 . 1 . . 325049 . . 194 VAL CB . 51256 1 804 . 1 . 1 194 194 VAL N N 15 120.9425 0.0000 . 1 . . 329548 . . 194 VAL N . 51256 1 805 . 1 . 1 195 195 ASP H H 1 8.0788 0.0000 . 1 . . 330153 . . 195 ASP H . 51256 1 806 . 1 . 1 195 195 ASP C C 13 174.8427 0.0000 . 1 . . 327788 . . 195 ASP C . 51256 1 807 . 1 . 1 195 195 ASP CA C 13 53.6085 0.0000 . 1 . . 329084 . . 195 ASP CA . 51256 1 808 . 1 . 1 195 195 ASP CB C 13 41.3896 0.0000 . 1 . . 326687 . . 195 ASP CB . 51256 1 809 . 1 . 1 195 195 ASP N N 15 126.0600 0.0000 . 1 . . 330154 . . 195 ASP N . 51256 1 810 . 1 . 1 196 196 GLY H H 1 7.5451 0.0000 . 1 . . 330786 . . 196 GLY H . 51256 1 811 . 1 . 1 196 196 GLY C C 13 178.4861 0.0000 . 1 . . 326843 . . 196 GLY C . 51256 1 812 . 1 . 1 196 196 GLY CA C 13 45.8732 0.0000 . 1 . . 324854 . . 196 GLY CA . 51256 1 813 . 1 . 1 196 196 GLY N N 15 117.9950 0.0000 . 1 . . 330787 . . 196 GLY N . 51256 1 stop_ save_