data_17189 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17189 _Entry.Title ; Pfu Rpp30 Free ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-09-13 _Entry.Accession_date 2010-09-13 _Entry.Last_release_date 2012-05-22 _Entry.Original_release_date 2012-05-22 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details 'Assignments for Free Rpp30 from Pfu' _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Brandon Crowe . L. . 17189 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17189 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 570 17189 '15N chemical shifts' 195 17189 '1H chemical shifts' 194 17189 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 . . 2012-05-22 2010-09-13 original author . 17189 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 17190 'RPP30/Pop5 complex' 17189 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17189 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22162665 _Citation.Full_citation . _Citation.Title 'Assembly of the complex between archaeal RNase P proteins RPP30 and Pop5.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Archaea _Citation.Journal_name_full 'Archaea (Vancouver, B.C.)' _Citation.Journal_volume 2011 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 891531 _Citation.Page_last 891531 _Citation.Year 2011 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Brandon Crowe . L. . 17189 1 2 Christopher Bohlen . J. . 17189 1 3 Ross Wilson . C. . 17189 1 4 Venkat Gopalan . . . 17189 1 5 Mark Foster . P. . 17189 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID Archaea 17189 1 'Chemical Shift Perturbations' 17189 1 ITC 17189 1 NMR 17189 1 Pop5 17189 1 'Protein protein interaction' 17189 1 'Pyrococcus furiosis' 17189 1 'RNase P' 17189 1 RPP30 17189 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17189 _Assembly.ID 1 _Assembly.Name Rpp30 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _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 Rpp30 1 $Rpp30 A . yes native no no . . . 17189 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Rpp30 _Entity.Sf_category entity _Entity.Sf_framecode Rpp30 _Entity.Entry_ID 17189 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Rpp30 _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 ; GEFMAGGRNGVKFVEMDIRS REAYELAEEWFDDVVFSYEI PPGVLDKERLKEIKKEYGNV AITLINPKPSLVKEAVQRFK QNYLIYVESSDLRVVRYSIE RGVDAVISPWANRKDQGIDH VLARMMNKRGVALGFSLRPL LHQNPYERANALKFMRKAWT LVNKYKVPRFISSSAKGKFQ VRGVKELISLGIAIGMEEVQ AKASLSFYPLGILERLK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq ; -3,G -2,E -1,F 1,M 2,A ; _Entity.Polymer_author_seq_details 'The 1st 3 residues are artifacted from a cleavage affinity tag. Residue 4 on is the sequence for Rpp30 from Pfu' _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 217 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 17190 . Rpp30 . . . . . 100.00 217 100.00 100.00 4.15e-154 . . . . 17189 1 2 no GB AAL82038 . "hypothetical protein PF1914 [Pyrococcus furiosus DSM 3638]" . . . . . 98.62 214 100.00 100.00 9.45e-152 . . . . 17189 1 3 no GB AFN04726 . "ribonuclease P protein component 3 [Pyrococcus furiosus COM1]" . . . . . 95.39 207 99.52 100.00 2.32e-145 . . . . 17189 1 4 no REF WP_011013054 . "ribonuclease P [Pyrococcus furiosus]" . . . . . 98.62 214 100.00 100.00 9.45e-152 . . . . 17189 1 5 no SP Q8TZS0 . "RecName: Full=Ribonuclease P protein component 3; Short=RNase P component 3; AltName: Full=Rpp30" . . . . . 98.62 214 100.00 100.00 9.45e-152 . . . . 17189 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 -3 GLY . 17189 1 2 -2 GLU . 17189 1 3 -1 PHE . 17189 1 4 1 MET . 17189 1 5 2 ALA . 17189 1 6 3 GLY . 17189 1 7 4 GLY . 17189 1 8 5 ARG . 17189 1 9 6 ASN . 17189 1 10 7 GLY . 17189 1 11 8 VAL . 17189 1 12 9 LYS . 17189 1 13 10 PHE . 17189 1 14 11 VAL . 17189 1 15 12 GLU . 17189 1 16 13 MET . 17189 1 17 14 ASP . 17189 1 18 15 ILE . 17189 1 19 16 ARG . 17189 1 20 17 SER . 17189 1 21 18 ARG . 17189 1 22 19 GLU . 17189 1 23 20 ALA . 17189 1 24 21 TYR . 17189 1 25 22 GLU . 17189 1 26 23 LEU . 17189 1 27 24 ALA . 17189 1 28 25 GLU . 17189 1 29 26 GLU . 17189 1 30 27 TRP . 17189 1 31 28 PHE . 17189 1 32 29 ASP . 17189 1 33 30 ASP . 17189 1 34 31 VAL . 17189 1 35 32 VAL . 17189 1 36 33 PHE . 17189 1 37 34 SER . 17189 1 38 35 TYR . 17189 1 39 36 GLU . 17189 1 40 37 ILE . 17189 1 41 38 PRO . 17189 1 42 39 PRO . 17189 1 43 40 GLY . 17189 1 44 41 VAL . 17189 1 45 42 LEU . 17189 1 46 43 ASP . 17189 1 47 44 LYS . 17189 1 48 45 GLU . 17189 1 49 46 ARG . 17189 1 50 47 LEU . 17189 1 51 48 LYS . 17189 1 52 49 GLU . 17189 1 53 50 ILE . 17189 1 54 51 LYS . 17189 1 55 52 LYS . 17189 1 56 53 GLU . 17189 1 57 54 TYR . 17189 1 58 55 GLY . 17189 1 59 56 ASN . 17189 1 60 57 VAL . 17189 1 61 58 ALA . 17189 1 62 59 ILE . 17189 1 63 60 THR . 17189 1 64 61 LEU . 17189 1 65 62 ILE . 17189 1 66 63 ASN . 17189 1 67 64 PRO . 17189 1 68 65 LYS . 17189 1 69 66 PRO . 17189 1 70 67 SER . 17189 1 71 68 LEU . 17189 1 72 69 VAL . 17189 1 73 70 LYS . 17189 1 74 71 GLU . 17189 1 75 72 ALA . 17189 1 76 73 VAL . 17189 1 77 74 GLN . 17189 1 78 75 ARG . 17189 1 79 76 PHE . 17189 1 80 77 LYS . 17189 1 81 78 GLN . 17189 1 82 79 ASN . 17189 1 83 80 TYR . 17189 1 84 81 LEU . 17189 1 85 82 ILE . 17189 1 86 83 TYR . 17189 1 87 84 VAL . 17189 1 88 85 GLU . 17189 1 89 86 SER . 17189 1 90 87 SER . 17189 1 91 88 ASP . 17189 1 92 89 LEU . 17189 1 93 90 ARG . 17189 1 94 91 VAL . 17189 1 95 92 VAL . 17189 1 96 93 ARG . 17189 1 97 94 TYR . 17189 1 98 95 SER . 17189 1 99 96 ILE . 17189 1 100 97 GLU . 17189 1 101 98 ARG . 17189 1 102 99 GLY . 17189 1 103 100 VAL . 17189 1 104 101 ASP . 17189 1 105 102 ALA . 17189 1 106 103 VAL . 17189 1 107 104 ILE . 17189 1 108 105 SER . 17189 1 109 106 PRO . 17189 1 110 107 TRP . 17189 1 111 108 ALA . 17189 1 112 109 ASN . 17189 1 113 110 ARG . 17189 1 114 111 LYS . 17189 1 115 112 ASP . 17189 1 116 113 GLN . 17189 1 117 114 GLY . 17189 1 118 115 ILE . 17189 1 119 116 ASP . 17189 1 120 117 HIS . 17189 1 121 118 VAL . 17189 1 122 119 LEU . 17189 1 123 120 ALA . 17189 1 124 121 ARG . 17189 1 125 122 MET . 17189 1 126 123 MET . 17189 1 127 124 ASN . 17189 1 128 125 LYS . 17189 1 129 126 ARG . 17189 1 130 127 GLY . 17189 1 131 128 VAL . 17189 1 132 129 ALA . 17189 1 133 130 LEU . 17189 1 134 131 GLY . 17189 1 135 132 PHE . 17189 1 136 133 SER . 17189 1 137 134 LEU . 17189 1 138 135 ARG . 17189 1 139 136 PRO . 17189 1 140 137 LEU . 17189 1 141 138 LEU . 17189 1 142 139 HIS . 17189 1 143 140 GLN . 17189 1 144 141 ASN . 17189 1 145 142 PRO . 17189 1 146 143 TYR . 17189 1 147 144 GLU . 17189 1 148 145 ARG . 17189 1 149 146 ALA . 17189 1 150 147 ASN . 17189 1 151 148 ALA . 17189 1 152 149 LEU . 17189 1 153 150 LYS . 17189 1 154 151 PHE . 17189 1 155 152 MET . 17189 1 156 153 ARG . 17189 1 157 154 LYS . 17189 1 158 155 ALA . 17189 1 159 156 TRP . 17189 1 160 157 THR . 17189 1 161 158 LEU . 17189 1 162 159 VAL . 17189 1 163 160 ASN . 17189 1 164 161 LYS . 17189 1 165 162 TYR . 17189 1 166 163 LYS . 17189 1 167 164 VAL . 17189 1 168 165 PRO . 17189 1 169 166 ARG . 17189 1 170 167 PHE . 17189 1 171 168 ILE . 17189 1 172 169 SER . 17189 1 173 170 SER . 17189 1 174 171 SER . 17189 1 175 172 ALA . 17189 1 176 173 LYS . 17189 1 177 174 GLY . 17189 1 178 175 LYS . 17189 1 179 176 PHE . 17189 1 180 177 GLN . 17189 1 181 178 VAL . 17189 1 182 179 ARG . 17189 1 183 180 GLY . 17189 1 184 181 VAL . 17189 1 185 182 LYS . 17189 1 186 183 GLU . 17189 1 187 184 LEU . 17189 1 188 185 ILE . 17189 1 189 186 SER . 17189 1 190 187 LEU . 17189 1 191 188 GLY . 17189 1 192 189 ILE . 17189 1 193 190 ALA . 17189 1 194 191 ILE . 17189 1 195 192 GLY . 17189 1 196 193 MET . 17189 1 197 194 GLU . 17189 1 198 195 GLU . 17189 1 199 196 VAL . 17189 1 200 197 GLN . 17189 1 201 198 ALA . 17189 1 202 199 LYS . 17189 1 203 200 ALA . 17189 1 204 201 SER . 17189 1 205 202 LEU . 17189 1 206 203 SER . 17189 1 207 204 PHE . 17189 1 208 205 TYR . 17189 1 209 206 PRO . 17189 1 210 207 LEU . 17189 1 211 208 GLY . 17189 1 212 209 ILE . 17189 1 213 210 LEU . 17189 1 214 211 GLU . 17189 1 215 212 ARG . 17189 1 216 213 LEU . 17189 1 217 214 LYS . 17189 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 17189 1 . GLU 2 2 17189 1 . PHE 3 3 17189 1 . MET 4 4 17189 1 . ALA 5 5 17189 1 . GLY 6 6 17189 1 . GLY 7 7 17189 1 . ARG 8 8 17189 1 . ASN 9 9 17189 1 . GLY 10 10 17189 1 . VAL 11 11 17189 1 . LYS 12 12 17189 1 . PHE 13 13 17189 1 . VAL 14 14 17189 1 . GLU 15 15 17189 1 . MET 16 16 17189 1 . ASP 17 17 17189 1 . ILE 18 18 17189 1 . ARG 19 19 17189 1 . SER 20 20 17189 1 . ARG 21 21 17189 1 . GLU 22 22 17189 1 . ALA 23 23 17189 1 . TYR 24 24 17189 1 . GLU 25 25 17189 1 . LEU 26 26 17189 1 . ALA 27 27 17189 1 . GLU 28 28 17189 1 . GLU 29 29 17189 1 . TRP 30 30 17189 1 . PHE 31 31 17189 1 . ASP 32 32 17189 1 . ASP 33 33 17189 1 . VAL 34 34 17189 1 . VAL 35 35 17189 1 . PHE 36 36 17189 1 . SER 37 37 17189 1 . TYR 38 38 17189 1 . GLU 39 39 17189 1 . ILE 40 40 17189 1 . PRO 41 41 17189 1 . PRO 42 42 17189 1 . GLY 43 43 17189 1 . VAL 44 44 17189 1 . LEU 45 45 17189 1 . ASP 46 46 17189 1 . LYS 47 47 17189 1 . GLU 48 48 17189 1 . ARG 49 49 17189 1 . LEU 50 50 17189 1 . LYS 51 51 17189 1 . GLU 52 52 17189 1 . ILE 53 53 17189 1 . LYS 54 54 17189 1 . LYS 55 55 17189 1 . GLU 56 56 17189 1 . TYR 57 57 17189 1 . GLY 58 58 17189 1 . ASN 59 59 17189 1 . VAL 60 60 17189 1 . ALA 61 61 17189 1 . ILE 62 62 17189 1 . THR 63 63 17189 1 . LEU 64 64 17189 1 . ILE 65 65 17189 1 . ASN 66 66 17189 1 . PRO 67 67 17189 1 . LYS 68 68 17189 1 . PRO 69 69 17189 1 . SER 70 70 17189 1 . LEU 71 71 17189 1 . VAL 72 72 17189 1 . LYS 73 73 17189 1 . GLU 74 74 17189 1 . ALA 75 75 17189 1 . VAL 76 76 17189 1 . GLN 77 77 17189 1 . ARG 78 78 17189 1 . PHE 79 79 17189 1 . LYS 80 80 17189 1 . GLN 81 81 17189 1 . ASN 82 82 17189 1 . TYR 83 83 17189 1 . LEU 84 84 17189 1 . ILE 85 85 17189 1 . TYR 86 86 17189 1 . VAL 87 87 17189 1 . GLU 88 88 17189 1 . SER 89 89 17189 1 . SER 90 90 17189 1 . ASP 91 91 17189 1 . LEU 92 92 17189 1 . ARG 93 93 17189 1 . VAL 94 94 17189 1 . VAL 95 95 17189 1 . ARG 96 96 17189 1 . TYR 97 97 17189 1 . SER 98 98 17189 1 . ILE 99 99 17189 1 . GLU 100 100 17189 1 . ARG 101 101 17189 1 . GLY 102 102 17189 1 . VAL 103 103 17189 1 . ASP 104 104 17189 1 . ALA 105 105 17189 1 . VAL 106 106 17189 1 . ILE 107 107 17189 1 . SER 108 108 17189 1 . PRO 109 109 17189 1 . TRP 110 110 17189 1 . ALA 111 111 17189 1 . ASN 112 112 17189 1 . ARG 113 113 17189 1 . LYS 114 114 17189 1 . ASP 115 115 17189 1 . GLN 116 116 17189 1 . GLY 117 117 17189 1 . ILE 118 118 17189 1 . ASP 119 119 17189 1 . HIS 120 120 17189 1 . VAL 121 121 17189 1 . LEU 122 122 17189 1 . ALA 123 123 17189 1 . ARG 124 124 17189 1 . MET 125 125 17189 1 . MET 126 126 17189 1 . ASN 127 127 17189 1 . LYS 128 128 17189 1 . ARG 129 129 17189 1 . GLY 130 130 17189 1 . VAL 131 131 17189 1 . ALA 132 132 17189 1 . LEU 133 133 17189 1 . GLY 134 134 17189 1 . PHE 135 135 17189 1 . SER 136 136 17189 1 . LEU 137 137 17189 1 . ARG 138 138 17189 1 . PRO 139 139 17189 1 . LEU 140 140 17189 1 . LEU 141 141 17189 1 . HIS 142 142 17189 1 . GLN 143 143 17189 1 . ASN 144 144 17189 1 . PRO 145 145 17189 1 . TYR 146 146 17189 1 . GLU 147 147 17189 1 . ARG 148 148 17189 1 . ALA 149 149 17189 1 . ASN 150 150 17189 1 . ALA 151 151 17189 1 . LEU 152 152 17189 1 . LYS 153 153 17189 1 . PHE 154 154 17189 1 . MET 155 155 17189 1 . ARG 156 156 17189 1 . LYS 157 157 17189 1 . ALA 158 158 17189 1 . TRP 159 159 17189 1 . THR 160 160 17189 1 . LEU 161 161 17189 1 . VAL 162 162 17189 1 . ASN 163 163 17189 1 . LYS 164 164 17189 1 . TYR 165 165 17189 1 . LYS 166 166 17189 1 . VAL 167 167 17189 1 . PRO 168 168 17189 1 . ARG 169 169 17189 1 . PHE 170 170 17189 1 . ILE 171 171 17189 1 . SER 172 172 17189 1 . SER 173 173 17189 1 . SER 174 174 17189 1 . ALA 175 175 17189 1 . LYS 176 176 17189 1 . GLY 177 177 17189 1 . LYS 178 178 17189 1 . PHE 179 179 17189 1 . GLN 180 180 17189 1 . VAL 181 181 17189 1 . ARG 182 182 17189 1 . GLY 183 183 17189 1 . VAL 184 184 17189 1 . LYS 185 185 17189 1 . GLU 186 186 17189 1 . LEU 187 187 17189 1 . ILE 188 188 17189 1 . SER 189 189 17189 1 . LEU 190 190 17189 1 . GLY 191 191 17189 1 . ILE 192 192 17189 1 . ALA 193 193 17189 1 . ILE 194 194 17189 1 . GLY 195 195 17189 1 . MET 196 196 17189 1 . GLU 197 197 17189 1 . GLU 198 198 17189 1 . VAL 199 199 17189 1 . GLN 200 200 17189 1 . ALA 201 201 17189 1 . LYS 202 202 17189 1 . ALA 203 203 17189 1 . SER 204 204 17189 1 . LEU 205 205 17189 1 . SER 206 206 17189 1 . PHE 207 207 17189 1 . TYR 208 208 17189 1 . PRO 209 209 17189 1 . LEU 210 210 17189 1 . GLY 211 211 17189 1 . ILE 212 212 17189 1 . LEU 213 213 17189 1 . GLU 214 214 17189 1 . ARG 215 215 17189 1 . LEU 216 216 17189 1 . LYS 217 217 17189 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 17189 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Rpp30 . 2261 organism . 'Pyrococcus furiosus' 'Pyrococcus furiosus' . . Archaea . Pyrococcus furiosus . . . . . . . . . . . . . . . . . . . . . 17189 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 17189 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Rpp30 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 (DE3)' Rosetta . . . . . . . . . . . . . . pET33b . . . 'Protein cloned into pET33b' . . 17189 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17189 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _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 Rpp30 '[U-100% 13C; U-100% 15N]' . . 1 $Rpp30 . . 500 . . uM . . . . 17189 1 2 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17189 1 3 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17189 1 4 DSS 'natural abundance' . . . . . . 66.67 . . uM . . . . 17189 1 5 TRIS 'natural abundance' . . . . . . 10 . . mM . . . . 17189 1 6 'Sodium Azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 17189 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 17189 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 5.0 . pH 17189 1 pressure 1 . atm 17189 1 temperature 328 . K 17189 1 stop_ save_ ############################ # Computer software used # ############################ save_xwinnmr _Software.Sf_category software _Software.Sf_framecode xwinnmr _Software.Entry_ID 17189 _Software.ID 1 _Software.Name xwinnmr _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 17189 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17189 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 17189 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 17189 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 17189 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 17189 _Software.ID 3 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 17189 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17189 3 'data analysis' 17189 3 'peak picking' 17189 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17189 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17189 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DRX . 600 . . . 17189 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 17189 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17189 1 2 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17189 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17189 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17189 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17189 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 17189 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 17189 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17189 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 17189 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 17189 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 17189 1 2 '3D HNCO' . . . 17189 1 3 '3D CBCA(CO)NH' . . . 17189 1 4 '3D HNCACB' . . . 17189 1 5 '3D HNCA' . . . 17189 1 stop_ loop_ _Systematic_chem_shift_offset.Type _Systematic_chem_shift_offset.Atom_type _Systematic_chem_shift_offset.Atom_isotope_number _Systematic_chem_shift_offset.Val _Systematic_chem_shift_offset.Val_err _Systematic_chem_shift_offset.Entry_ID _Systematic_chem_shift_offset.Assigned_chem_shift_list_ID 'TROSY offset' 'amide protons' 1 0.075 0.005 17189 1 'TROSY offset' 'amide nitrogens' 15 0.75 0.05 17189 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 4 4 MET C C 13 175.3520 0.042 . 1 . . . . 1 MET C . 17189 1 2 . 1 1 4 4 MET CA C 13 55.3820 0.042 . 1 . . . . 1 MET CA . 17189 1 3 . 1 1 4 4 MET CB C 13 33.0220 0.042 . 1 . . . . 1 MET CB . 17189 1 4 . 1 1 4 4 MET N N 15 122.8030 0.045 . 1 . . . . 1 MET N . 17189 1 5 . 1 1 5 5 ALA H H 1 8.0000 0.004 . 1 . . . . 2 ALA HN . 17189 1 6 . 1 1 5 5 ALA C C 13 177.9170 0.042 . 1 . . . . 2 ALA C . 17189 1 7 . 1 1 5 5 ALA CA C 13 52.6530 0.042 . 1 . . . . 2 ALA CA . 17189 1 8 . 1 1 5 5 ALA CB C 13 19.4203 0.042 . 1 . . . . 2 ALA CB . 17189 1 9 . 1 1 5 5 ALA N N 15 125.5240 0.045 . 1 . . . . 2 ALA N . 17189 1 10 . 1 1 6 6 GLY H H 1 8.1830 0.004 . 1 . . . . 3 GLY HN . 17189 1 11 . 1 1 6 6 GLY C C 13 174.7130 0.042 . 1 . . . . 3 GLY C . 17189 1 12 . 1 1 6 6 GLY CA C 13 45.3837 0.042 . 1 . . . . 3 GLY CA . 17189 1 13 . 1 1 6 6 GLY N N 15 108.4510 0.045 . 1 . . . . 3 GLY N . 17189 1 14 . 1 1 7 7 GLY H H 1 8.0830 0.004 . 1 . . . . 4 GLY HN . 17189 1 15 . 1 1 7 7 GLY C C 13 173.8330 0.042 . 1 . . . . 4 GLY C . 17189 1 16 . 1 1 7 7 GLY CA C 13 45.3810 0.042 . 1 . . . . 4 GLY CA . 17189 1 17 . 1 1 7 7 GLY N N 15 108.7740 0.045 . 1 . . . . 4 GLY N . 17189 1 18 . 1 1 8 8 ARG H H 1 7.9970 0.004 . 1 . . . . 5 ARG HN . 17189 1 19 . 1 1 8 8 ARG C C 13 175.0870 0.042 . 1 . . . . 5 ARG C . 17189 1 20 . 1 1 8 8 ARG CA C 13 56.0170 0.042 . 1 . . . . 5 ARG CA . 17189 1 21 . 1 1 8 8 ARG CB C 13 31.0400 0.042 . 1 . . . . 5 ARG CB . 17189 1 22 . 1 1 8 8 ARG N N 15 120.7390 0.045 . 1 . . . . 5 ARG N . 17189 1 23 . 1 1 9 9 ASN H H 1 7.8790 0.004 . 1 . . . . 6 ASN HN . 17189 1 24 . 1 1 9 9 ASN C C 13 176.4640 0.042 . 1 . . . . 6 ASN C . 17189 1 25 . 1 1 9 9 ASN CA C 13 54.4480 0.042 . 1 . . . . 6 ASN CA . 17189 1 26 . 1 1 9 9 ASN CB C 13 41.3720 0.042 . 1 . . . . 6 ASN CB . 17189 1 27 . 1 1 9 9 ASN N N 15 125.6800 0.045 . 1 . . . . 6 ASN N . 17189 1 28 . 1 1 10 10 GLY H H 1 8.0210 0.004 . 1 . . . . 7 GLY HN . 17189 1 29 . 1 1 10 10 GLY C C 13 173.5350 0.042 . 1 . . . . 7 GLY C . 17189 1 30 . 1 1 10 10 GLY CA C 13 45.5640 0.042 . 1 . . . . 7 GLY CA . 17189 1 31 . 1 1 10 10 GLY N N 15 108.8140 0.045 . 1 . . . . 7 GLY N . 17189 1 32 . 1 1 11 11 VAL H H 1 7.5430 0.004 . 1 . . . . 8 VAL HN . 17189 1 33 . 1 1 11 11 VAL C C 13 174.3090 0.042 . 1 . . . . 8 VAL C . 17189 1 34 . 1 1 11 11 VAL CA C 13 61.8920 0.042 . 1 . . . . 8 VAL CA . 17189 1 35 . 1 1 11 11 VAL CB C 13 32.8270 0.042 . 1 . . . . 8 VAL CB . 17189 1 36 . 1 1 11 11 VAL N N 15 120.5120 0.045 . 1 . . . . 8 VAL N . 17189 1 37 . 1 1 12 12 LYS H H 1 7.3660 0.004 . 1 . . . . 9 LYS HN . 17189 1 38 . 1 1 12 12 LYS C C 13 174.1420 0.042 . 1 . . . . 9 LYS C . 17189 1 39 . 1 1 12 12 LYS CA C 13 54.9740 0.042 . 1 . . . . 9 LYS CA . 17189 1 40 . 1 1 12 12 LYS CB C 13 34.8800 0.042 . 1 . . . . 9 LYS CB . 17189 1 41 . 1 1 12 12 LYS N N 15 125.0060 0.045 . 1 . . . . 9 LYS N . 17189 1 42 . 1 1 13 13 PHE H H 1 9.3670 0.004 . 1 . . . . 10 PHE HN . 17189 1 43 . 1 1 13 13 PHE C C 13 176.3840 0.042 . 1 . . . . 10 PHE C . 17189 1 44 . 1 1 13 13 PHE CA C 13 57.2710 0.042 . 1 . . . . 10 PHE CA . 17189 1 45 . 1 1 13 13 PHE CB C 13 41.8860 0.042 . 1 . . . . 10 PHE CB . 17189 1 46 . 1 1 13 13 PHE N N 15 120.5490 0.045 . 1 . . . . 10 PHE N . 17189 1 47 . 1 1 14 14 VAL H H 1 9.0260 0.004 . 1 . . . . 11 VAL HN . 17189 1 48 . 1 1 14 14 VAL C C 13 173.7530 0.042 . 1 . . . . 11 VAL C . 17189 1 49 . 1 1 14 14 VAL CA C 13 60.4590 0.042 . 1 . . . . 11 VAL CA . 17189 1 50 . 1 1 14 14 VAL CB C 13 35.7940 0.042 . 1 . . . . 11 VAL CB . 17189 1 51 . 1 1 14 14 VAL N N 15 123.5410 0.045 . 1 . . . . 11 VAL N . 17189 1 52 . 1 1 15 15 GLU H H 1 7.7620 0.004 . 1 . . . . 12 GLU HN . 17189 1 53 . 1 1 15 15 GLU C C 13 177.3460 0.042 . 1 . . . . 12 GLU C . 17189 1 54 . 1 1 15 15 GLU CA C 13 56.2148 0.042 . 1 . . . . 12 GLU CA . 17189 1 55 . 1 1 15 15 GLU CB C 13 31.8625 0.042 . 1 . . . . 12 GLU CB . 17189 1 56 . 1 1 15 15 GLU N N 15 131.7460 0.045 . 1 . . . . 12 GLU N . 17189 1 57 . 1 1 16 16 MET H H 1 8.3980 0.004 . 1 . . . . 13 MET HN . 17189 1 58 . 1 1 16 16 MET C C 13 176.4170 0.042 . 1 . . . . 13 MET C . 17189 1 59 . 1 1 16 16 MET CA C 13 54.7310 0.042 . 1 . . . . 13 MET CA . 17189 1 60 . 1 1 16 16 MET CB C 13 33.0740 0.042 . 1 . . . . 13 MET CB . 17189 1 61 . 1 1 16 16 MET N N 15 120.5880 0.045 . 1 . . . . 13 MET N . 17189 1 62 . 1 1 17 17 ASP H H 1 7.5360 0.004 . 1 . . . . 14 ASP HN . 17189 1 63 . 1 1 17 17 ASP C C 13 171.6460 0.042 . 1 . . . . 14 ASP C . 17189 1 64 . 1 1 17 17 ASP CA C 13 53.7610 0.042 . 1 . . . . 14 ASP CA . 17189 1 65 . 1 1 17 17 ASP CB C 13 40.5810 0.042 . 1 . . . . 14 ASP CB . 17189 1 66 . 1 1 17 17 ASP N N 15 118.9620 0.045 . 1 . . . . 14 ASP N . 17189 1 67 . 1 1 18 18 ILE H H 1 7.0200 0.004 . 1 . . . . 15 ILE HN . 17189 1 68 . 1 1 18 18 ILE C C 13 177.0390 0.042 . 1 . . . . 15 ILE C . 17189 1 69 . 1 1 18 18 ILE CA C 13 57.7850 0.042 . 1 . . . . 15 ILE CA . 17189 1 70 . 1 1 18 18 ILE CB C 13 35.4280 0.042 . 1 . . . . 15 ILE CB . 17189 1 71 . 1 1 18 18 ILE N N 15 120.9240 0.045 . 1 . . . . 15 ILE N . 17189 1 72 . 1 1 19 19 ARG H H 1 7.9530 0.004 . 1 . . . . 16 ARG HN . 17189 1 73 . 1 1 19 19 ARG C C 13 176.0980 0.042 . 1 . . . . 16 ARG C . 17189 1 74 . 1 1 19 19 ARG CA C 13 56.3010 0.042 . 1 . . . . 16 ARG CA . 17189 1 75 . 1 1 19 19 ARG CB C 13 31.3110 0.042 . 1 . . . . 16 ARG CB . 17189 1 76 . 1 1 19 19 ARG N N 15 123.3840 0.045 . 1 . . . . 16 ARG N . 17189 1 77 . 1 1 20 20 SER H H 1 7.1200 0.004 . 1 . . . . 17 SER HN . 17189 1 78 . 1 1 20 20 SER C C 13 174.0500 0.042 . 1 . . . . 17 SER C . 17189 1 79 . 1 1 20 20 SER CA C 13 57.2850 0.042 . 1 . . . . 17 SER CA . 17189 1 80 . 1 1 20 20 SER CB C 13 67.0060 0.042 . 1 . . . . 17 SER CB . 17189 1 81 . 1 1 20 20 SER N N 15 111.5550 0.045 . 1 . . . . 17 SER N . 17189 1 82 . 1 1 21 21 ARG H H 1 9.2940 0.004 . 1 . . . . 18 ARG HN . 17189 1 83 . 1 1 21 21 ARG C C 13 177.7820 0.042 . 1 . . . . 18 ARG C . 17189 1 84 . 1 1 21 21 ARG CA C 13 59.9470 0.042 . 1 . . . . 18 ARG CA . 17189 1 85 . 1 1 21 21 ARG CB C 13 29.8030 0.042 . 1 . . . . 18 ARG CB . 17189 1 86 . 1 1 21 21 ARG N N 15 126.4520 0.045 . 1 . . . . 18 ARG N . 17189 1 87 . 1 1 22 22 GLU H H 1 8.7770 0.004 . 1 . . . . 19 GLU HN . 17189 1 88 . 1 1 22 22 GLU C C 13 178.9070 0.042 . 1 . . . . 19 GLU C . 17189 1 89 . 1 1 22 22 GLU CA C 13 59.6770 0.042 . 1 . . . . 19 GLU CA . 17189 1 90 . 1 1 22 22 GLU CB C 13 29.3940 0.042 . 1 . . . . 19 GLU CB . 17189 1 91 . 1 1 22 22 GLU N N 15 118.3690 0.045 . 1 . . . . 19 GLU N . 17189 1 92 . 1 1 23 23 ALA H H 1 7.4530 0.004 . 1 . . . . 20 ALA HN . 17189 1 93 . 1 1 23 23 ALA C C 13 177.7010 0.042 . 1 . . . . 20 ALA C . 17189 1 94 . 1 1 23 23 ALA CA C 13 54.3270 0.042 . 1 . . . . 20 ALA CA . 17189 1 95 . 1 1 23 23 ALA CB C 13 18.9560 0.042 . 1 . . . . 20 ALA CB . 17189 1 96 . 1 1 23 23 ALA N N 15 120.4380 0.045 . 1 . . . . 20 ALA N . 17189 1 97 . 1 1 24 24 TYR H H 1 8.3800 0.004 . 1 . . . . 21 TYR HN . 17189 1 98 . 1 1 24 24 TYR C C 13 176.0590 0.042 . 1 . . . . 21 TYR C . 17189 1 99 . 1 1 24 24 TYR CA C 13 63.0780 0.042 . 1 . . . . 21 TYR CA . 17189 1 100 . 1 1 24 24 TYR CB C 13 39.0570 0.042 . 1 . . . . 21 TYR CB . 17189 1 101 . 1 1 24 24 TYR N N 15 122.8560 0.045 . 1 . . . . 21 TYR N . 17189 1 102 . 1 1 25 25 GLU H H 1 8.0760 0.004 . 1 . . . . 22 GLU HN . 17189 1 103 . 1 1 25 25 GLU C C 13 178.3080 0.042 . 1 . . . . 22 GLU C . 17189 1 104 . 1 1 25 25 GLU CA C 13 59.1710 0.042 . 1 . . . . 22 GLU CA . 17189 1 105 . 1 1 25 25 GLU CB C 13 29.7070 0.042 . 1 . . . . 22 GLU CB . 17189 1 106 . 1 1 25 25 GLU N N 15 116.4890 0.045 . 1 . . . . 22 GLU N . 17189 1 107 . 1 1 26 26 LEU H H 1 6.7400 0.004 . 1 . . . . 23 LEU HN . 17189 1 108 . 1 1 26 26 LEU C C 13 177.8210 0.042 . 1 . . . . 23 LEU C . 17189 1 109 . 1 1 26 26 LEU CA C 13 56.5710 0.042 . 1 . . . . 23 LEU CA . 17189 1 110 . 1 1 26 26 LEU CB C 13 42.5600 0.042 . 1 . . . . 23 LEU CB . 17189 1 111 . 1 1 26 26 LEU N N 15 118.1550 0.045 . 1 . . . . 23 LEU N . 17189 1 112 . 1 1 27 27 ALA H H 1 8.5180 0.004 . 1 . . . . 24 ALA HN . 17189 1 113 . 1 1 27 27 ALA C C 13 179.3120 0.042 . 1 . . . . 24 ALA C . 17189 1 114 . 1 1 27 27 ALA CA C 13 55.7390 0.042 . 1 . . . . 24 ALA CA . 17189 1 115 . 1 1 27 27 ALA CB C 13 18.0610 0.042 . 1 . . . . 24 ALA CB . 17189 1 116 . 1 1 27 27 ALA N N 15 120.9410 0.045 . 1 . . . . 24 ALA N . 17189 1 117 . 1 1 28 28 GLU H H 1 8.2450 0.004 . 1 . . . . 25 GLU HN . 17189 1 118 . 1 1 28 28 GLU C C 13 176.7390 0.042 . 1 . . . . 25 GLU C . 17189 1 119 . 1 1 28 28 GLU CA C 13 58.1480 0.042 . 1 . . . . 25 GLU CA . 17189 1 120 . 1 1 28 28 GLU CB C 13 28.7906 0.042 . 1 . . . . 25 GLU CB . 17189 1 121 . 1 1 28 28 GLU N N 15 114.9320 0.045 . 1 . . . . 25 GLU N . 17189 1 122 . 1 1 29 29 GLU H H 1 7.4260 0.004 . 1 . . . . 26 GLU HN . 17189 1 123 . 1 1 29 29 GLU C C 13 176.5790 0.042 . 1 . . . . 26 GLU C . 17189 1 124 . 1 1 29 29 GLU CA C 13 57.8551 0.042 . 1 . . . . 26 GLU CA . 17189 1 125 . 1 1 29 29 GLU CB C 13 29.1540 0.042 . 1 . . . . 26 GLU CB . 17189 1 126 . 1 1 29 29 GLU N N 15 116.8150 0.045 . 1 . . . . 26 GLU N . 17189 1 127 . 1 1 30 30 TRP H H 1 7.2920 0.004 . 1 . . . . 27 TRP HN . 17189 1 128 . 1 1 30 30 TRP C C 13 175.0060 0.042 . 1 . . . . 27 TRP C . 17189 1 129 . 1 1 30 30 TRP CA C 13 55.7010 0.042 . 1 . . . . 27 TRP CA . 17189 1 130 . 1 1 30 30 TRP CB C 13 32.7300 0.042 . 1 . . . . 27 TRP CB . 17189 1 131 . 1 1 30 30 TRP N N 15 118.6160 0.045 . 1 . . . . 27 TRP N . 17189 1 132 . 1 1 31 31 PHE H H 1 8.2910 0.004 . 1 . . . . 28 PHE HN . 17189 1 133 . 1 1 31 31 PHE C C 13 174.1360 0.042 . 1 . . . . 28 PHE C . 17189 1 134 . 1 1 31 31 PHE CA C 13 57.9950 0.042 . 1 . . . . 28 PHE CA . 17189 1 135 . 1 1 31 31 PHE CB C 13 41.2640 0.042 . 1 . . . . 28 PHE CB . 17189 1 136 . 1 1 31 31 PHE N N 15 118.6460 0.045 . 1 . . . . 28 PHE N . 17189 1 137 . 1 1 32 32 ASP H H 1 8.5820 0.004 . 1 . . . . 29 ASP HN . 17189 1 138 . 1 1 32 32 ASP C C 13 175.9370 0.042 . 1 . . . . 29 ASP C . 17189 1 139 . 1 1 32 32 ASP CA C 13 57.6150 0.042 . 1 . . . . 29 ASP CA . 17189 1 140 . 1 1 32 32 ASP CB C 13 42.9130 0.042 . 1 . . . . 29 ASP CB . 17189 1 141 . 1 1 32 32 ASP N N 15 120.4470 0.045 . 1 . . . . 29 ASP N . 17189 1 142 . 1 1 33 33 ASP H H 1 7.8920 0.004 . 1 . . . . 30 ASP HN . 17189 1 143 . 1 1 33 33 ASP C C 13 173.5090 0.042 . 1 . . . . 30 ASP C . 17189 1 144 . 1 1 33 33 ASP CA C 13 52.9900 0.042 . 1 . . . . 30 ASP CA . 17189 1 145 . 1 1 33 33 ASP CB C 13 44.2360 0.042 . 1 . . . . 30 ASP CB . 17189 1 146 . 1 1 33 33 ASP N N 15 115.3470 0.045 . 1 . . . . 30 ASP N . 17189 1 147 . 1 1 34 34 VAL H H 1 8.5850 0.004 . 1 . . . . 31 VAL HN . 17189 1 148 . 1 1 34 34 VAL C C 13 174.3390 0.042 . 1 . . . . 31 VAL C . 17189 1 149 . 1 1 34 34 VAL CA C 13 60.6920 0.042 . 1 . . . . 31 VAL CA . 17189 1 150 . 1 1 34 34 VAL CB C 13 35.7260 0.042 . 1 . . . . 31 VAL CB . 17189 1 151 . 1 1 34 34 VAL N N 15 120.8020 0.045 . 1 . . . . 31 VAL N . 17189 1 152 . 1 1 35 35 VAL H H 1 8.6700 0.004 . 1 . . . . 32 VAL HN . 17189 1 153 . 1 1 35 35 VAL C C 13 174.2260 0.042 . 1 . . . . 32 VAL C . 17189 1 154 . 1 1 35 35 VAL CA C 13 61.4330 0.042 . 1 . . . . 32 VAL CA . 17189 1 155 . 1 1 35 35 VAL CB C 13 32.7260 0.042 . 1 . . . . 32 VAL CB . 17189 1 156 . 1 1 35 35 VAL N N 15 130.6140 0.045 . 1 . . . . 32 VAL N . 17189 1 157 . 1 1 36 36 PHE H H 1 8.0900 0.004 . 1 . . . . 33 PHE HN . 17189 1 158 . 1 1 36 36 PHE C C 13 172.9550 0.042 . 1 . . . . 33 PHE C . 17189 1 159 . 1 1 36 36 PHE CA C 13 57.8640 0.042 . 1 . . . . 33 PHE CA . 17189 1 160 . 1 1 36 36 PHE CB C 13 40.3740 0.042 . 1 . . . . 33 PHE CB . 17189 1 161 . 1 1 36 36 PHE N N 15 127.1500 0.045 . 1 . . . . 33 PHE N . 17189 1 162 . 1 1 37 37 SER H H 1 8.1560 0.004 . 1 . . . . 34 SER HN . 17189 1 163 . 1 1 37 37 SER C C 13 171.3940 0.042 . 1 . . . . 34 SER C . 17189 1 164 . 1 1 37 37 SER CA C 13 54.8750 0.042 . 1 . . . . 34 SER CA . 17189 1 165 . 1 1 37 37 SER CB C 13 64.6110 0.042 . 1 . . . . 34 SER CB . 17189 1 166 . 1 1 37 37 SER N N 15 126.5890 0.045 . 1 . . . . 34 SER N . 17189 1 167 . 1 1 38 38 TYR H H 1 8.9670 0.004 . 1 . . . . 35 TYR HN . 17189 1 168 . 1 1 38 38 TYR C C 13 173.7000 0.042 . 1 . . . . 35 TYR C . 17189 1 169 . 1 1 38 38 TYR CA C 13 55.7200 0.042 . 1 . . . . 35 TYR CA . 17189 1 170 . 1 1 38 38 TYR CB C 13 39.4200 0.042 . 1 . . . . 35 TYR CB . 17189 1 171 . 1 1 38 38 TYR N N 15 129.5320 0.045 . 1 . . . . 35 TYR N . 17189 1 172 . 1 1 39 39 GLU H H 1 7.5650 0.004 . 1 . . . . 36 GLU HN . 17189 1 173 . 1 1 39 39 GLU C C 13 177.1220 0.042 . 1 . . . . 36 GLU C . 17189 1 174 . 1 1 39 39 GLU CA C 13 56.8760 0.042 . 1 . . . . 36 GLU CA . 17189 1 175 . 1 1 39 39 GLU CB C 13 31.9730 0.042 . 1 . . . . 36 GLU CB . 17189 1 176 . 1 1 39 39 GLU N N 15 126.3590 0.045 . 1 . . . . 36 GLU N . 17189 1 177 . 1 1 40 40 ILE H H 1 8.6370 0.004 . 1 . . . . 37 ILE HN . 17189 1 178 . 1 1 40 40 ILE CA C 13 58.3730 0.042 . 1 . . . . 37 ILE CA . 17189 1 179 . 1 1 40 40 ILE N N 15 125.0330 0.045 . 1 . . . . 37 ILE N . 17189 1 180 . 1 1 42 42 PRO C C 13 177.3270 0.042 . 1 . . . . 39 PRO C . 17189 1 181 . 1 1 42 42 PRO CA C 13 63.2650 0.042 . 1 . . . . 39 PRO CA . 17189 1 182 . 1 1 42 42 PRO CB C 13 33.9940 0.042 . 1 . . . . 39 PRO CB . 17189 1 183 . 1 1 43 43 GLY H H 1 8.6300 0.004 . 1 . . . . 40 GLY HN . 17189 1 184 . 1 1 43 43 GLY C C 13 170.5640 0.042 . 1 . . . . 40 GLY C . 17189 1 185 . 1 1 43 43 GLY CA C 13 44.7200 0.042 . 1 . . . . 40 GLY CA . 17189 1 186 . 1 1 43 43 GLY N N 15 112.7900 0.045 . 1 . . . . 40 GLY N . 17189 1 187 . 1 1 44 44 VAL H H 1 7.6700 0.004 . 1 . . . . 41 VAL HN . 17189 1 188 . 1 1 44 44 VAL C C 13 175.2040 0.042 . 1 . . . . 41 VAL C . 17189 1 189 . 1 1 44 44 VAL CA C 13 59.5890 0.042 . 1 . . . . 41 VAL CA . 17189 1 190 . 1 1 44 44 VAL CB C 13 35.1670 0.042 . 1 . . . . 41 VAL CB . 17189 1 191 . 1 1 44 44 VAL N N 15 112.2610 0.045 . 1 . . . . 41 VAL N . 17189 1 192 . 1 1 45 45 LEU H H 1 8.5290 0.004 . 1 . . . . 42 LEU HN . 17189 1 193 . 1 1 45 45 LEU C C 13 174.2460 0.042 . 1 . . . . 42 LEU C . 17189 1 194 . 1 1 45 45 LEU CA C 13 53.4990 0.042 . 1 . . . . 42 LEU CA . 17189 1 195 . 1 1 45 45 LEU CB C 13 39.7440 0.042 . 1 . . . . 42 LEU CB . 17189 1 196 . 1 1 45 45 LEU N N 15 125.5230 0.045 . 1 . . . . 42 LEU N . 17189 1 197 . 1 1 46 46 ASP H H 1 7.0680 0.004 . 1 . . . . 43 ASP HN . 17189 1 198 . 1 1 46 46 ASP C C 13 175.6370 0.042 . 1 . . . . 43 ASP C . 17189 1 199 . 1 1 46 46 ASP CA C 13 52.7410 0.042 . 1 . . . . 43 ASP CA . 17189 1 200 . 1 1 46 46 ASP CB C 13 45.0690 0.042 . 1 . . . . 43 ASP CB . 17189 1 201 . 1 1 46 46 ASP N N 15 126.1000 0.045 . 1 . . . . 43 ASP N . 17189 1 202 . 1 1 47 47 LYS H H 1 9.0530 0.004 . 1 . . . . 44 LYS HN . 17189 1 203 . 1 1 47 47 LYS C C 13 177.8960 0.042 . 1 . . . . 44 LYS C . 17189 1 204 . 1 1 47 47 LYS CA C 13 60.1400 0.042 . 1 . . . . 44 LYS CA . 17189 1 205 . 1 1 47 47 LYS CB C 13 32.7740 0.042 . 1 . . . . 44 LYS CB . 17189 1 206 . 1 1 47 47 LYS N N 15 126.6140 0.045 . 1 . . . . 44 LYS N . 17189 1 207 . 1 1 48 48 GLU H H 1 8.2420 0.004 . 1 . . . . 45 GLU HN . 17189 1 208 . 1 1 48 48 GLU C C 13 179.1960 0.042 . 1 . . . . 45 GLU C . 17189 1 209 . 1 1 48 48 GLU CA C 13 59.0550 0.042 . 1 . . . . 45 GLU CA . 17189 1 210 . 1 1 48 48 GLU CB C 13 28.8090 0.042 . 1 . . . . 45 GLU CB . 17189 1 211 . 1 1 48 48 GLU N N 15 120.2050 0.045 . 1 . . . . 45 GLU N . 17189 1 212 . 1 1 49 49 ARG H H 1 8.0100 0.004 . 1 . . . . 46 ARG HN . 17189 1 213 . 1 1 49 49 ARG C C 13 179.4100 0.042 . 1 . . . . 46 ARG C . 17189 1 214 . 1 1 49 49 ARG CA C 13 58.1370 0.042 . 1 . . . . 46 ARG CA . 17189 1 215 . 1 1 49 49 ARG CB C 13 29.8370 0.042 . 1 . . . . 46 ARG CB . 17189 1 216 . 1 1 49 49 ARG N N 15 121.2900 0.045 . 1 . . . . 46 ARG N . 17189 1 217 . 1 1 50 50 LEU H H 1 7.9780 0.004 . 1 . . . . 47 LEU HN . 17189 1 218 . 1 1 50 50 LEU C C 13 179.1590 0.042 . 1 . . . . 47 LEU C . 17189 1 219 . 1 1 50 50 LEU CA C 13 57.8090 0.042 . 1 . . . . 47 LEU CA . 17189 1 220 . 1 1 50 50 LEU CB C 13 40.2390 0.042 . 1 . . . . 47 LEU CB . 17189 1 221 . 1 1 50 50 LEU N N 15 118.5990 0.045 . 1 . . . . 47 LEU N . 17189 1 222 . 1 1 51 51 LYS H H 1 7.6690 0.004 . 1 . . . . 48 LYS HN . 17189 1 223 . 1 1 51 51 LYS C C 13 179.1030 0.042 . 1 . . . . 48 LYS C . 17189 1 224 . 1 1 51 51 LYS CA C 13 59.8760 0.042 . 1 . . . . 48 LYS CA . 17189 1 225 . 1 1 51 51 LYS CB C 13 32.1540 0.042 . 1 . . . . 48 LYS CB . 17189 1 226 . 1 1 51 51 LYS N N 15 121.3810 0.045 . 1 . . . . 48 LYS N . 17189 1 227 . 1 1 52 52 GLU H H 1 7.3600 0.004 . 1 . . . . 49 GLU HN . 17189 1 228 . 1 1 52 52 GLU C C 13 179.1350 0.042 . 1 . . . . 49 GLU C . 17189 1 229 . 1 1 52 52 GLU CA C 13 59.4687 0.042 . 1 . . . . 49 GLU CA . 17189 1 230 . 1 1 52 52 GLU CB C 13 29.2380 0.042 . 1 . . . . 49 GLU CB . 17189 1 231 . 1 1 52 52 GLU N N 15 120.0430 0.045 . 1 . . . . 49 GLU N . 17189 1 232 . 1 1 53 53 ILE H H 1 7.6190 0.004 . 1 . . . . 50 ILE HN . 17189 1 233 . 1 1 53 53 ILE C C 13 178.0060 0.042 . 1 . . . . 50 ILE C . 17189 1 234 . 1 1 53 53 ILE CA C 13 64.1160 0.042 . 1 . . . . 50 ILE CA . 17189 1 235 . 1 1 53 53 ILE CB C 13 37.4020 0.042 . 1 . . . . 50 ILE CB . 17189 1 236 . 1 1 53 53 ILE N N 15 120.9600 0.045 . 1 . . . . 50 ILE N . 17189 1 237 . 1 1 54 54 LYS H H 1 8.3510 0.004 . 1 . . . . 51 LYS HN . 17189 1 238 . 1 1 54 54 LYS C C 13 178.7290 0.042 . 1 . . . . 51 LYS C . 17189 1 239 . 1 1 54 54 LYS CA C 13 59.2480 0.042 . 1 . . . . 51 LYS CA . 17189 1 240 . 1 1 54 54 LYS CB C 13 32.3480 0.042 . 1 . . . . 51 LYS CB . 17189 1 241 . 1 1 54 54 LYS N N 15 122.0420 0.045 . 1 . . . . 51 LYS N . 17189 1 242 . 1 1 55 55 LYS H H 1 7.7220 0.004 . 1 . . . . 52 LYS HN . 17189 1 243 . 1 1 55 55 LYS C C 13 177.5340 0.042 . 1 . . . . 52 LYS C . 17189 1 244 . 1 1 55 55 LYS CA C 13 59.1380 0.042 . 1 . . . . 52 LYS CA . 17189 1 245 . 1 1 55 55 LYS CB C 13 32.1600 0.042 . 1 . . . . 52 LYS CB . 17189 1 246 . 1 1 55 55 LYS N N 15 119.8520 0.045 . 1 . . . . 52 LYS N . 17189 1 247 . 1 1 56 56 GLU H H 1 7.1230 0.004 . 1 . . . . 53 GLU HN . 17189 1 248 . 1 1 56 56 GLU C C 13 177.1370 0.042 . 1 . . . . 53 GLU C . 17189 1 249 . 1 1 56 56 GLU CA C 13 58.2360 0.042 . 1 . . . . 53 GLU CA . 17189 1 250 . 1 1 56 56 GLU CB C 13 29.9970 0.042 . 1 . . . . 53 GLU CB . 17189 1 251 . 1 1 56 56 GLU N N 15 117.4090 0.045 . 1 . . . . 53 GLU N . 17189 1 252 . 1 1 57 57 TYR H H 1 7.5750 0.004 . 1 . . . . 54 TYR HN . 17189 1 253 . 1 1 57 57 TYR C C 13 177.2650 0.042 . 1 . . . . 54 TYR C . 17189 1 254 . 1 1 57 57 TYR CA C 13 58.7960 0.042 . 1 . . . . 54 TYR CA . 17189 1 255 . 1 1 57 57 TYR CB C 13 41.3100 0.042 . 1 . . . . 54 TYR CB . 17189 1 256 . 1 1 57 57 TYR N N 15 114.5920 0.045 . 1 . . . . 54 TYR N . 17189 1 257 . 1 1 58 58 GLY H H 1 8.4870 0.004 . 1 . . . . 55 GLY HN . 17189 1 258 . 1 1 58 58 GLY C C 13 173.7800 0.042 . 1 . . . . 55 GLY C . 17189 1 259 . 1 1 58 58 GLY CA C 13 47.5440 0.042 . 1 . . . . 55 GLY CA . 17189 1 260 . 1 1 58 58 GLY N N 15 111.0480 0.045 . 1 . . . . 55 GLY N . 17189 1 261 . 1 1 59 59 ASN H H 1 8.2020 0.004 . 1 . . . . 56 ASN HN . 17189 1 262 . 1 1 59 59 ASN C C 13 173.0920 0.042 . 1 . . . . 56 ASN C . 17189 1 263 . 1 1 59 59 ASN CA C 13 52.6500 0.042 . 1 . . . . 56 ASN CA . 17189 1 264 . 1 1 59 59 ASN CB C 13 40.8370 0.042 . 1 . . . . 56 ASN CB . 17189 1 265 . 1 1 59 59 ASN N N 15 122.8510 0.045 . 1 . . . . 56 ASN N . 17189 1 266 . 1 1 60 60 VAL H H 1 8.1450 0.004 . 1 . . . . 57 VAL HN . 17189 1 267 . 1 1 60 60 VAL C C 13 173.7850 0.042 . 1 . . . . 57 VAL C . 17189 1 268 . 1 1 60 60 VAL CA C 13 60.3620 0.042 . 1 . . . . 57 VAL CA . 17189 1 269 . 1 1 60 60 VAL CB C 13 36.5530 0.042 . 1 . . . . 57 VAL CB . 17189 1 270 . 1 1 60 60 VAL N N 15 123.7830 0.045 . 1 . . . . 57 VAL N . 17189 1 271 . 1 1 61 61 ALA H H 1 9.1160 0.004 . 1 . . . . 58 ALA HN . 17189 1 272 . 1 1 61 61 ALA C C 13 175.6590 0.042 . 1 . . . . 58 ALA C . 17189 1 273 . 1 1 61 61 ALA CA C 13 48.9550 0.042 . 1 . . . . 58 ALA CA . 17189 1 274 . 1 1 61 61 ALA CB C 13 20.6140 0.042 . 1 . . . . 58 ALA CB . 17189 1 275 . 1 1 61 61 ALA N N 15 130.1150 0.045 . 1 . . . . 58 ALA N . 17189 1 276 . 1 1 62 62 ILE H H 1 8.9170 0.004 . 1 . . . . 59 ILE HN . 17189 1 277 . 1 1 62 62 ILE C C 13 173.8500 0.042 . 1 . . . . 59 ILE C . 17189 1 278 . 1 1 62 62 ILE CA C 13 61.6790 0.042 . 1 . . . . 59 ILE CA . 17189 1 279 . 1 1 62 62 ILE CB C 13 38.7010 0.042 . 1 . . . . 59 ILE CB . 17189 1 280 . 1 1 62 62 ILE N N 15 124.2400 0.045 . 1 . . . . 59 ILE N . 17189 1 281 . 1 1 63 63 THR H H 1 8.3490 0.004 . 1 . . . . 60 THR HN . 17189 1 282 . 1 1 63 63 THR C C 13 173.2150 0.042 . 1 . . . . 60 THR C . 17189 1 283 . 1 1 63 63 THR CA C 13 61.6280 0.042 . 1 . . . . 60 THR CA . 17189 1 284 . 1 1 63 63 THR CB C 13 68.2760 0.042 . 1 . . . . 60 THR CB . 17189 1 285 . 1 1 63 63 THR N N 15 128.0170 0.045 . 1 . . . . 60 THR N . 17189 1 286 . 1 1 64 64 LEU H H 1 8.6460 0.004 . 1 . . . . 61 LEU HN . 17189 1 287 . 1 1 64 64 LEU C C 13 175.3310 0.042 . 1 . . . . 61 LEU C . 17189 1 288 . 1 1 64 64 LEU CA C 13 53.5540 0.042 . 1 . . . . 61 LEU CA . 17189 1 289 . 1 1 64 64 LEU CB C 13 41.3530 0.042 . 1 . . . . 61 LEU CB . 17189 1 290 . 1 1 64 64 LEU N N 15 126.9960 0.045 . 1 . . . . 61 LEU N . 17189 1 291 . 1 1 65 65 ILE H H 1 8.3190 0.004 . 1 . . . . 62 ILE HN . 17189 1 292 . 1 1 65 65 ILE C C 13 176.6210 0.042 . 1 . . . . 62 ILE C . 17189 1 293 . 1 1 65 65 ILE CA C 13 59.6470 0.042 . 1 . . . . 62 ILE CA . 17189 1 294 . 1 1 65 65 ILE CB C 13 36.4210 0.042 . 1 . . . . 62 ILE CB . 17189 1 295 . 1 1 65 65 ILE N N 15 126.9470 0.045 . 1 . . . . 62 ILE N . 17189 1 296 . 1 1 66 66 ASN H H 1 9.3730 0.004 . 1 . . . . 63 ASN HN . 17189 1 297 . 1 1 66 66 ASN CA C 13 54.7290 0.042 . 1 . . . . 63 ASN CA . 17189 1 298 . 1 1 66 66 ASN N N 15 125.8770 0.045 . 1 . . . . 63 ASN N . 17189 1 299 . 1 1 70 70 SER C C 13 174.1630 0.042 . 1 . . . . 67 SER C . 17189 1 300 . 1 1 70 70 SER CA C 13 61.8580 0.042 . 1 . . . . 67 SER CA . 17189 1 301 . 1 1 71 71 LEU H H 1 7.2550 0.004 . 1 . . . . 68 LEU HN . 17189 1 302 . 1 1 71 71 LEU C C 13 178.2590 0.042 . 1 . . . . 68 LEU C . 17189 1 303 . 1 1 71 71 LEU CA C 13 57.1947 0.042 . 1 . . . . 68 LEU CA . 17189 1 304 . 1 1 71 71 LEU CB C 13 42.5670 0.042 . 1 . . . . 68 LEU CB . 17189 1 305 . 1 1 71 71 LEU N N 15 125.4020 0.045 . 1 . . . . 68 LEU N . 17189 1 306 . 1 1 72 72 VAL H H 1 7.1700 0.004 . 1 . . . . 69 VAL HN . 17189 1 307 . 1 1 72 72 VAL C C 13 177.3630 0.042 . 1 . . . . 69 VAL C . 17189 1 308 . 1 1 72 72 VAL CA C 13 67.0280 0.042 . 1 . . . . 69 VAL CA . 17189 1 309 . 1 1 72 72 VAL CB C 13 31.5969 0.042 . 1 . . . . 69 VAL CB . 17189 1 310 . 1 1 72 72 VAL N N 15 118.5770 0.045 . 1 . . . . 69 VAL N . 17189 1 311 . 1 1 73 73 LYS H H 1 8.1300 0.004 . 1 . . . . 70 LYS HN . 17189 1 312 . 1 1 73 73 LYS C C 13 178.1690 0.042 . 1 . . . . 70 LYS C . 17189 1 313 . 1 1 73 73 LYS CA C 13 60.2190 0.042 . 1 . . . . 70 LYS CA . 17189 1 314 . 1 1 73 73 LYS CB C 13 31.9220 0.042 . 1 . . . . 70 LYS CB . 17189 1 315 . 1 1 73 73 LYS N N 15 118.0000 0.045 . 1 . . . . 70 LYS N . 17189 1 316 . 1 1 74 74 GLU H H 1 7.7140 0.004 . 1 . . . . 71 GLU HN . 17189 1 317 . 1 1 74 74 GLU C C 13 178.2780 0.042 . 1 . . . . 71 GLU C . 17189 1 318 . 1 1 74 74 GLU CA C 13 59.5910 0.042 . 1 . . . . 71 GLU CA . 17189 1 319 . 1 1 74 74 GLU CB C 13 29.9800 0.042 . 1 . . . . 71 GLU CB . 17189 1 320 . 1 1 74 74 GLU N N 15 119.0100 0.045 . 1 . . . . 71 GLU N . 17189 1 321 . 1 1 75 75 ALA H H 1 8.5130 0.004 . 1 . . . . 72 ALA HN . 17189 1 322 . 1 1 75 75 ALA C C 13 179.6930 0.042 . 1 . . . . 72 ALA C . 17189 1 323 . 1 1 75 75 ALA CA C 13 55.8510 0.042 . 1 . . . . 72 ALA CA . 17189 1 324 . 1 1 75 75 ALA CB C 13 18.6590 0.042 . 1 . . . . 72 ALA CB . 17189 1 325 . 1 1 75 75 ALA N N 15 120.6060 0.045 . 1 . . . . 72 ALA N . 17189 1 326 . 1 1 76 76 VAL H H 1 8.3010 0.004 . 1 . . . . 73 VAL HN . 17189 1 327 . 1 1 76 76 VAL C C 13 178.1940 0.042 . 1 . . . . 73 VAL C . 17189 1 328 . 1 1 76 76 VAL CA C 13 66.5370 0.042 . 1 . . . . 73 VAL CA . 17189 1 329 . 1 1 76 76 VAL CB C 13 31.9660 0.042 . 1 . . . . 73 VAL CB . 17189 1 330 . 1 1 76 76 VAL N N 15 115.9390 0.045 . 1 . . . . 73 VAL N . 17189 1 331 . 1 1 77 77 GLN H H 1 8.3410 0.004 . 1 . . . . 74 GLN HN . 17189 1 332 . 1 1 77 77 GLN C C 13 178.3750 0.042 . 1 . . . . 74 GLN C . 17189 1 333 . 1 1 77 77 GLN CA C 13 59.3300 0.042 . 1 . . . . 74 GLN CA . 17189 1 334 . 1 1 77 77 GLN CB C 13 29.0620 0.042 . 1 . . . . 74 GLN CB . 17189 1 335 . 1 1 77 77 GLN N N 15 118.2900 0.045 . 1 . . . . 74 GLN N . 17189 1 336 . 1 1 78 78 ARG H H 1 8.0890 0.004 . 1 . . . . 75 ARG HN . 17189 1 337 . 1 1 78 78 ARG C C 13 178.2790 0.042 . 1 . . . . 75 ARG C . 17189 1 338 . 1 1 78 78 ARG CA C 13 57.7420 0.042 . 1 . . . . 75 ARG CA . 17189 1 339 . 1 1 78 78 ARG N N 15 113.3400 0.045 . 1 . . . . 75 ARG N . 17189 1 340 . 1 1 79 79 PHE H H 1 8.0130 0.004 . 1 . . . . 76 PHE HN . 17189 1 341 . 1 1 79 79 PHE C C 13 176.0480 0.042 . 1 . . . . 76 PHE C . 17189 1 342 . 1 1 79 79 PHE CA C 13 59.1120 0.042 . 1 . . . . 76 PHE CA . 17189 1 343 . 1 1 79 79 PHE CB C 13 41.3240 0.042 . 1 . . . . 76 PHE CB . 17189 1 344 . 1 1 79 79 PHE N N 15 114.3250 0.045 . 1 . . . . 76 PHE N . 17189 1 345 . 1 1 80 80 LYS H H 1 7.5770 0.004 . 1 . . . . 77 LYS HN . 17189 1 346 . 1 1 80 80 LYS C C 13 176.5280 0.042 . 1 . . . . 77 LYS C . 17189 1 347 . 1 1 80 80 LYS CA C 13 59.5410 0.042 . 1 . . . . 77 LYS CA . 17189 1 348 . 1 1 80 80 LYS CB C 13 33.6240 0.042 . 1 . . . . 77 LYS CB . 17189 1 349 . 1 1 80 80 LYS N N 15 121.4410 0.045 . 1 . . . . 77 LYS N . 17189 1 350 . 1 1 81 81 GLN H H 1 8.3660 0.004 . 1 . . . . 78 GLN HN . 17189 1 351 . 1 1 81 81 GLN C C 13 176.0000 0.042 . 1 . . . . 78 GLN C . 17189 1 352 . 1 1 81 81 GLN CA C 13 59.0130 0.042 . 1 . . . . 78 GLN CA . 17189 1 353 . 1 1 81 81 GLN CB C 13 28.4760 0.042 . 1 . . . . 78 GLN CB . 17189 1 354 . 1 1 81 81 GLN N N 15 113.7080 0.045 . 1 . . . . 78 GLN N . 17189 1 355 . 1 1 82 82 ASN H H 1 7.4000 0.004 . 1 . . . . 79 ASN HN . 17189 1 356 . 1 1 82 82 ASN C C 13 172.3430 0.042 . 1 . . . . 79 ASN C . 17189 1 357 . 1 1 82 82 ASN CA C 13 53.2750 0.042 . 1 . . . . 79 ASN CA . 17189 1 358 . 1 1 82 82 ASN CB C 13 42.9000 0.042 . 1 . . . . 79 ASN CB . 17189 1 359 . 1 1 82 82 ASN N N 15 111.6530 0.045 . 1 . . . . 79 ASN N . 17189 1 360 . 1 1 83 83 TYR H H 1 7.9450 0.004 . 1 . . . . 80 TYR HN . 17189 1 361 . 1 1 83 83 TYR C C 13 174.6190 0.042 . 1 . . . . 80 TYR C . 17189 1 362 . 1 1 83 83 TYR CA C 13 57.3870 0.042 . 1 . . . . 80 TYR CA . 17189 1 363 . 1 1 83 83 TYR CB C 13 41.4480 0.042 . 1 . . . . 80 TYR CB . 17189 1 364 . 1 1 83 83 TYR N N 15 118.8600 0.045 . 1 . . . . 80 TYR N . 17189 1 365 . 1 1 84 84 LEU H H 1 7.5250 0.004 . 1 . . . . 81 LEU HN . 17189 1 366 . 1 1 84 84 LEU C C 13 176.8020 0.042 . 1 . . . . 81 LEU C . 17189 1 367 . 1 1 84 84 LEU CA C 13 54.3230 0.042 . 1 . . . . 81 LEU CA . 17189 1 368 . 1 1 84 84 LEU CB C 13 42.8520 0.042 . 1 . . . . 81 LEU CB . 17189 1 369 . 1 1 84 84 LEU N N 15 118.5510 0.045 . 1 . . . . 81 LEU N . 17189 1 370 . 1 1 85 85 ILE H H 1 9.9640 0.004 . 1 . . . . 82 ILE HN . 17189 1 371 . 1 1 85 85 ILE C C 13 175.5950 0.042 . 1 . . . . 82 ILE C . 17189 1 372 . 1 1 85 85 ILE CA C 13 59.6260 0.042 . 1 . . . . 82 ILE CA . 17189 1 373 . 1 1 85 85 ILE CB C 13 39.2510 0.042 . 1 . . . . 82 ILE CB . 17189 1 374 . 1 1 85 85 ILE N N 15 121.2010 0.045 . 1 . . . . 82 ILE N . 17189 1 375 . 1 1 86 86 TYR H H 1 9.5730 0.004 . 1 . . . . 83 TYR HN . 17189 1 376 . 1 1 86 86 TYR C C 13 176.1720 0.042 . 1 . . . . 83 TYR C . 17189 1 377 . 1 1 86 86 TYR CA C 13 51.5360 0.042 . 1 . . . . 83 TYR CA . 17189 1 378 . 1 1 86 86 TYR CB C 13 39.8750 0.042 . 1 . . . . 83 TYR CB . 17189 1 379 . 1 1 86 86 TYR N N 15 128.9600 0.045 . 1 . . . . 83 TYR N . 17189 1 380 . 1 1 87 87 VAL H H 1 8.2870 0.004 . 1 . . . . 84 VAL HN . 17189 1 381 . 1 1 87 87 VAL C C 13 173.3710 0.042 . 1 . . . . 84 VAL C . 17189 1 382 . 1 1 87 87 VAL CA C 13 61.2810 0.042 . 1 . . . . 84 VAL CA . 17189 1 383 . 1 1 87 87 VAL CB C 13 36.1250 0.042 . 1 . . . . 84 VAL CB . 17189 1 384 . 1 1 87 87 VAL N N 15 119.0020 0.045 . 1 . . . . 84 VAL N . 17189 1 385 . 1 1 88 88 GLU H H 1 8.8010 0.004 . 1 . . . . 85 GLU HN . 17189 1 386 . 1 1 88 88 GLU C C 13 173.7960 0.042 . 1 . . . . 85 GLU C . 17189 1 387 . 1 1 88 88 GLU CA C 13 54.7860 0.042 . 1 . . . . 85 GLU CA . 17189 1 388 . 1 1 88 88 GLU CB C 13 31.9871 0.042 . 1 . . . . 85 GLU CB . 17189 1 389 . 1 1 88 88 GLU N N 15 131.0450 0.045 . 1 . . . . 85 GLU N . 17189 1 390 . 1 1 89 89 SER H H 1 7.7240 0.004 . 1 . . . . 86 SER HN . 17189 1 391 . 1 1 89 89 SER C C 13 173.0090 0.042 . 1 . . . . 86 SER C . 17189 1 392 . 1 1 89 89 SER CA C 13 56.9970 0.042 . 1 . . . . 86 SER CA . 17189 1 393 . 1 1 89 89 SER CB C 13 65.1610 0.042 . 1 . . . . 86 SER CB . 17189 1 394 . 1 1 89 89 SER N N 15 118.3890 0.045 . 1 . . . . 86 SER N . 17189 1 395 . 1 1 90 90 SER H H 1 8.2020 0.004 . 1 . . . . 87 SER HN . 17189 1 396 . 1 1 90 90 SER C C 13 172.8260 0.042 . 1 . . . . 87 SER C . 17189 1 397 . 1 1 90 90 SER CA C 13 60.8020 0.042 . 1 . . . . 87 SER CA . 17189 1 398 . 1 1 90 90 SER N N 15 119.8490 0.045 . 1 . . . . 87 SER N . 17189 1 399 . 1 1 91 91 ASP H H 1 8.3670 0.004 . 1 . . . . 88 ASP HN . 17189 1 400 . 1 1 91 91 ASP C C 13 177.0370 0.042 . 1 . . . . 88 ASP C . 17189 1 401 . 1 1 91 91 ASP CA C 13 52.6700 0.042 . 1 . . . . 88 ASP CA . 17189 1 402 . 1 1 91 91 ASP CB C 13 41.6850 0.042 . 1 . . . . 88 ASP CB . 17189 1 403 . 1 1 91 91 ASP N N 15 124.1040 0.045 . 1 . . . . 88 ASP N . 17189 1 404 . 1 1 92 92 LEU H H 1 8.5930 0.004 . 1 . . . . 89 LEU HN . 17189 1 405 . 1 1 92 92 LEU C C 13 179.6150 0.042 . 1 . . . . 89 LEU C . 17189 1 406 . 1 1 92 92 LEU CA C 13 58.0753 0.042 . 1 . . . . 89 LEU CA . 17189 1 407 . 1 1 92 92 LEU CB C 13 41.0150 0.042 . 1 . . . . 89 LEU CB . 17189 1 408 . 1 1 92 92 LEU N N 15 127.0300 0.045 . 1 . . . . 89 LEU N . 17189 1 409 . 1 1 93 93 ARG H H 1 8.3520 0.004 . 1 . . . . 90 ARG HN . 17189 1 410 . 1 1 93 93 ARG C C 13 179.8940 0.042 . 1 . . . . 90 ARG C . 17189 1 411 . 1 1 93 93 ARG CA C 13 59.6920 0.042 . 1 . . . . 90 ARG CA . 17189 1 412 . 1 1 93 93 ARG CB C 13 29.4150 0.042 . 1 . . . . 90 ARG CB . 17189 1 413 . 1 1 93 93 ARG N N 15 120.3630 0.045 . 1 . . . . 90 ARG N . 17189 1 414 . 1 1 94 94 VAL H H 1 7.4050 0.004 . 1 . . . . 91 VAL HN . 17189 1 415 . 1 1 94 94 VAL C C 13 179.6660 0.042 . 1 . . . . 91 VAL C . 17189 1 416 . 1 1 94 94 VAL CA C 13 66.5500 0.042 . 1 . . . . 91 VAL CA . 17189 1 417 . 1 1 94 94 VAL CB C 13 31.6640 0.042 . 1 . . . . 91 VAL CB . 17189 1 418 . 1 1 94 94 VAL N N 15 122.7250 0.045 . 1 . . . . 91 VAL N . 17189 1 419 . 1 1 95 95 VAL H H 1 8.7290 0.004 . 1 . . . . 92 VAL HN . 17189 1 420 . 1 1 95 95 VAL C C 13 177.1050 0.042 . 1 . . . . 92 VAL C . 17189 1 421 . 1 1 95 95 VAL CA C 13 64.5435 0.042 . 1 . . . . 92 VAL CA . 17189 1 422 . 1 1 95 95 VAL CB C 13 31.5776 0.042 . 1 . . . . 92 VAL CB . 17189 1 423 . 1 1 95 95 VAL N N 15 125.4010 0.045 . 1 . . . . 92 VAL N . 17189 1 424 . 1 1 96 96 ARG H H 1 8.1570 0.004 . 1 . . . . 93 ARG HN . 17189 1 425 . 1 1 96 96 ARG C C 13 177.2480 0.042 . 1 . . . . 93 ARG C . 17189 1 426 . 1 1 96 96 ARG CA C 13 60.7790 0.042 . 1 . . . . 93 ARG CA . 17189 1 427 . 1 1 96 96 ARG CB C 13 29.9910 0.042 . 1 . . . . 93 ARG CB . 17189 1 428 . 1 1 96 96 ARG N N 15 119.2050 0.045 . 1 . . . . 93 ARG N . 17189 1 429 . 1 1 97 97 TYR H H 1 7.8260 0.004 . 1 . . . . 94 TYR HN . 17189 1 430 . 1 1 97 97 TYR C C 13 177.2800 0.042 . 1 . . . . 94 TYR C . 17189 1 431 . 1 1 97 97 TYR CA C 13 61.7560 0.042 . 1 . . . . 94 TYR CA . 17189 1 432 . 1 1 97 97 TYR CB C 13 39.3090 0.042 . 1 . . . . 94 TYR CB . 17189 1 433 . 1 1 97 97 TYR N N 15 119.2280 0.045 . 1 . . . . 94 TYR N . 17189 1 434 . 1 1 98 98 SER H H 1 8.4550 0.004 . 1 . . . . 95 SER HN . 17189 1 435 . 1 1 98 98 SER C C 13 175.6900 0.042 . 1 . . . . 95 SER C . 17189 1 436 . 1 1 98 98 SER CA C 13 62.1500 0.042 . 1 . . . . 95 SER CA . 17189 1 437 . 1 1 98 98 SER CB C 13 63.3380 0.042 . 1 . . . . 95 SER CB . 17189 1 438 . 1 1 98 98 SER N N 15 115.1810 0.045 . 1 . . . . 95 SER N . 17189 1 439 . 1 1 99 99 ILE H H 1 7.9230 0.004 . 1 . . . . 96 ILE HN . 17189 1 440 . 1 1 99 99 ILE C C 13 177.9180 0.042 . 1 . . . . 96 ILE C . 17189 1 441 . 1 1 99 99 ILE CA C 13 65.3060 0.042 . 1 . . . . 96 ILE CA . 17189 1 442 . 1 1 99 99 ILE CB C 13 38.3800 0.042 . 1 . . . . 96 ILE CB . 17189 1 443 . 1 1 99 99 ILE N N 15 124.1030 0.045 . 1 . . . . 96 ILE N . 17189 1 444 . 1 1 100 100 GLU H H 1 7.8920 0.004 . 1 . . . . 97 GLU HN . 17189 1 445 . 1 1 100 100 GLU C C 13 178.9030 0.042 . 1 . . . . 97 GLU C . 17189 1 446 . 1 1 100 100 GLU CA C 13 59.6180 0.042 . 1 . . . . 97 GLU CA . 17189 1 447 . 1 1 100 100 GLU CB C 13 29.2970 0.042 . 1 . . . . 97 GLU CB . 17189 1 448 . 1 1 100 100 GLU N N 15 118.8200 0.045 . 1 . . . . 97 GLU N . 17189 1 449 . 1 1 101 101 ARG H H 1 7.8370 0.004 . 1 . . . . 98 ARG HN . 17189 1 450 . 1 1 101 101 ARG C C 13 176.6790 0.042 . 1 . . . . 98 ARG C . 17189 1 451 . 1 1 101 101 ARG CA C 13 55.2260 0.042 . 1 . . . . 98 ARG CA . 17189 1 452 . 1 1 101 101 ARG CB C 13 30.9730 0.042 . 1 . . . . 98 ARG CB . 17189 1 453 . 1 1 101 101 ARG N N 15 115.7250 0.045 . 1 . . . . 98 ARG N . 17189 1 454 . 1 1 102 102 GLY H H 1 7.6800 0.004 . 1 . . . . 99 GLY HN . 17189 1 455 . 1 1 102 102 GLY C C 13 175.3710 0.042 . 1 . . . . 99 GLY C . 17189 1 456 . 1 1 102 102 GLY CA C 13 47.3400 0.042 . 1 . . . . 99 GLY CA . 17189 1 457 . 1 1 102 102 GLY N N 15 107.1130 0.045 . 1 . . . . 99 GLY N . 17189 1 458 . 1 1 103 103 VAL H H 1 6.8270 0.004 . 1 . . . . 100 VAL HN . 17189 1 459 . 1 1 103 103 VAL C C 13 173.6590 0.042 . 1 . . . . 100 VAL C . 17189 1 460 . 1 1 103 103 VAL CA C 13 62.6560 0.042 . 1 . . . . 100 VAL CA . 17189 1 461 . 1 1 103 103 VAL CB C 13 30.6117 0.042 . 1 . . . . 100 VAL CB . 17189 1 462 . 1 1 103 103 VAL N N 15 110.1140 0.045 . 1 . . . . 100 VAL N . 17189 1 463 . 1 1 104 104 ASP H H 1 8.8370 0.004 . 1 . . . . 101 ASP HN . 17189 1 464 . 1 1 104 104 ASP C C 13 177.6350 0.042 . 1 . . . . 101 ASP C . 17189 1 465 . 1 1 104 104 ASP CA C 13 58.3190 0.042 . 1 . . . . 101 ASP CA . 17189 1 466 . 1 1 104 104 ASP CB C 13 43.1130 0.042 . 1 . . . . 101 ASP CB . 17189 1 467 . 1 1 104 104 ASP N N 15 118.0320 0.045 . 1 . . . . 101 ASP N . 17189 1 468 . 1 1 105 105 ALA H H 1 7.8600 0.004 . 1 . . . . 102 ALA HN . 17189 1 469 . 1 1 105 105 ALA C C 13 175.1570 0.042 . 1 . . . . 102 ALA C . 17189 1 470 . 1 1 105 105 ALA CA C 13 51.2510 0.042 . 1 . . . . 102 ALA CA . 17189 1 471 . 1 1 105 105 ALA CB C 13 23.0750 0.042 . 1 . . . . 102 ALA CB . 17189 1 472 . 1 1 105 105 ALA N N 15 116.2200 0.045 . 1 . . . . 102 ALA N . 17189 1 473 . 1 1 106 106 VAL H H 1 8.3410 0.004 . 1 . . . . 103 VAL HN . 17189 1 474 . 1 1 106 106 VAL C C 13 174.3570 0.042 . 1 . . . . 103 VAL C . 17189 1 475 . 1 1 106 106 VAL CA C 13 59.7860 0.042 . 1 . . . . 103 VAL CA . 17189 1 476 . 1 1 106 106 VAL CB C 13 33.3130 0.042 . 1 . . . . 103 VAL CB . 17189 1 477 . 1 1 106 106 VAL N N 15 118.9620 0.045 . 1 . . . . 103 VAL N . 17189 1 478 . 1 1 107 107 ILE H H 1 8.7680 0.004 . 1 . . . . 104 ILE HN . 17189 1 479 . 1 1 107 107 ILE C C 13 175.2610 0.042 . 1 . . . . 104 ILE C . 17189 1 480 . 1 1 107 107 ILE CA C 13 59.0670 0.042 . 1 . . . . 104 ILE CA . 17189 1 481 . 1 1 107 107 ILE CB C 13 38.6573 0.042 . 1 . . . . 104 ILE CB . 17189 1 482 . 1 1 107 107 ILE N N 15 126.5730 0.045 . 1 . . . . 104 ILE N . 17189 1 483 . 1 1 108 108 SER H H 1 7.7310 0.004 . 1 . . . . 105 SER HN . 17189 1 484 . 1 1 108 108 SER CA C 13 56.9920 0.042 . 1 . . . . 105 SER CA . 17189 1 485 . 1 1 108 108 SER N N 15 115.3210 0.045 . 1 . . . . 105 SER N . 17189 1 486 . 1 1 109 109 PRO C C 13 174.3150 0.042 . 1 . . . . 106 PRO C . 17189 1 487 . 1 1 109 109 PRO CA C 13 63.7390 0.042 . 1 . . . . 106 PRO CA . 17189 1 488 . 1 1 109 109 PRO CB C 13 30.8950 0.042 . 1 . . . . 106 PRO CB . 17189 1 489 . 1 1 110 110 TRP H H 1 5.9730 0.004 . 1 . . . . 107 TRP HN . 17189 1 490 . 1 1 110 110 TRP C C 13 176.7530 0.042 . 1 . . . . 107 TRP C . 17189 1 491 . 1 1 110 110 TRP CA C 13 57.0340 0.042 . 1 . . . . 107 TRP CA . 17189 1 492 . 1 1 110 110 TRP CB C 13 28.6820 0.042 . 1 . . . . 107 TRP CB . 17189 1 493 . 1 1 110 110 TRP N N 15 113.2310 0.045 . 1 . . . . 107 TRP N . 17189 1 494 . 1 1 111 111 ALA H H 1 7.1460 0.004 . 1 . . . . 108 ALA HN . 17189 1 495 . 1 1 111 111 ALA C C 13 177.8720 0.042 . 1 . . . . 108 ALA C . 17189 1 496 . 1 1 111 111 ALA CA C 13 54.4670 0.042 . 1 . . . . 108 ALA CA . 17189 1 497 . 1 1 111 111 ALA CB C 13 18.5770 0.042 . 1 . . . . 108 ALA CB . 17189 1 498 . 1 1 111 111 ALA N N 15 126.2250 0.045 . 1 . . . . 108 ALA N . 17189 1 499 . 1 1 112 112 ASN H H 1 8.1950 0.004 . 1 . . . . 109 ASN HN . 17189 1 500 . 1 1 112 112 ASN C C 13 174.2540 0.042 . 1 . . . . 109 ASN C . 17189 1 501 . 1 1 112 112 ASN CA C 13 53.4610 0.042 . 1 . . . . 109 ASN CA . 17189 1 502 . 1 1 112 112 ASN CB C 13 38.6150 0.042 . 1 . . . . 109 ASN CB . 17189 1 503 . 1 1 112 112 ASN N N 15 114.9630 0.045 . 1 . . . . 109 ASN N . 17189 1 504 . 1 1 113 113 ARG H H 1 7.6350 0.004 . 1 . . . . 110 ARG HN . 17189 1 505 . 1 1 113 113 ARG C C 13 175.2590 0.042 . 1 . . . . 110 ARG C . 17189 1 506 . 1 1 113 113 ARG CA C 13 55.6960 0.042 . 1 . . . . 110 ARG CA . 17189 1 507 . 1 1 113 113 ARG CB C 13 30.6810 0.042 . 1 . . . . 110 ARG CB . 17189 1 508 . 1 1 113 113 ARG N N 15 117.4810 0.045 . 1 . . . . 110 ARG N . 17189 1 509 . 1 1 114 114 LYS H H 1 8.2610 0.004 . 1 . . . . 111 LYS HN . 17189 1 510 . 1 1 114 114 LYS C C 13 175.3060 0.042 . 1 . . . . 111 LYS C . 17189 1 511 . 1 1 114 114 LYS CA C 13 55.3930 0.042 . 1 . . . . 111 LYS CA . 17189 1 512 . 1 1 114 114 LYS CB C 13 31.8930 0.042 . 1 . . . . 111 LYS CB . 17189 1 513 . 1 1 114 114 LYS N N 15 119.0110 0.045 . 1 . . . . 111 LYS N . 17189 1 514 . 1 1 115 115 ASP H H 1 7.1300 0.004 . 1 . . . . 112 ASP HN . 17189 1 515 . 1 1 115 115 ASP C C 13 173.2990 0.042 . 1 . . . . 112 ASP C . 17189 1 516 . 1 1 115 115 ASP CA C 13 53.2230 0.042 . 1 . . . . 112 ASP CA . 17189 1 517 . 1 1 115 115 ASP CB C 13 42.5360 0.042 . 1 . . . . 112 ASP CB . 17189 1 518 . 1 1 115 115 ASP N N 15 116.7400 0.045 . 1 . . . . 112 ASP N . 17189 1 519 . 1 1 116 116 GLN H H 1 7.8450 0.004 . 1 . . . . 113 GLN HN . 17189 1 520 . 1 1 116 116 GLN C C 13 176.0880 0.042 . 1 . . . . 113 GLN C . 17189 1 521 . 1 1 116 116 GLN CA C 13 56.9990 0.042 . 1 . . . . 113 GLN CA . 17189 1 522 . 1 1 116 116 GLN CB C 13 29.0670 0.042 . 1 . . . . 113 GLN CB . 17189 1 523 . 1 1 116 116 GLN N N 15 112.7810 0.045 . 1 . . . . 113 GLN N . 17189 1 524 . 1 1 117 117 GLY H H 1 8.8150 0.004 . 1 . . . . 114 GLY HN . 17189 1 525 . 1 1 117 117 GLY C C 13 172.6810 0.042 . 1 . . . . 114 GLY C . 17189 1 526 . 1 1 117 117 GLY CA C 13 46.6230 0.042 . 1 . . . . 114 GLY CA . 17189 1 527 . 1 1 117 117 GLY N N 15 110.9190 0.045 . 1 . . . . 114 GLY N . 17189 1 528 . 1 1 118 118 ILE H H 1 7.6910 0.004 . 1 . . . . 115 ILE HN . 17189 1 529 . 1 1 118 118 ILE C C 13 172.3350 0.042 . 1 . . . . 115 ILE C . 17189 1 530 . 1 1 118 118 ILE CA C 13 61.3330 0.042 . 1 . . . . 115 ILE CA . 17189 1 531 . 1 1 118 118 ILE CB C 13 39.4010 0.042 . 1 . . . . 115 ILE CB . 17189 1 532 . 1 1 118 118 ILE N N 15 117.4060 0.045 . 1 . . . . 115 ILE N . 17189 1 533 . 1 1 119 119 ASP H H 1 6.8640 0.004 . 1 . . . . 116 ASP HN . 17189 1 534 . 1 1 119 119 ASP CA C 13 52.1220 0.042 . 1 . . . . 116 ASP CA . 17189 1 535 . 1 1 119 119 ASP N N 15 123.3470 0.045 . 1 . . . . 116 ASP N . 17189 1 536 . 1 1 120 120 HIS C C 13 176.2960 0.042 . 1 . . . . 117 HIS C . 17189 1 537 . 1 1 120 120 HIS CA C 13 60.1900 0.042 . 1 . . . . 117 HIS CA . 17189 1 538 . 1 1 120 120 HIS CB C 13 30.4980 0.042 . 1 . . . . 117 HIS CB . 17189 1 539 . 1 1 121 121 VAL H H 1 6.8470 0.004 . 1 . . . . 118 VAL HN . 17189 1 540 . 1 1 121 121 VAL C C 13 179.0770 0.042 . 1 . . . . 118 VAL C . 17189 1 541 . 1 1 121 121 VAL CA C 13 66.2020 0.042 . 1 . . . . 118 VAL CA . 17189 1 542 . 1 1 121 121 VAL CB C 13 31.3000 0.042 . 1 . . . . 118 VAL CB . 17189 1 543 . 1 1 121 121 VAL N N 15 121.1010 0.045 . 1 . . . . 118 VAL N . 17189 1 544 . 1 1 122 122 LEU H H 1 8.5620 0.004 . 1 . . . . 119 LEU HN . 17189 1 545 . 1 1 122 122 LEU C C 13 178.9700 0.042 . 1 . . . . 119 LEU C . 17189 1 546 . 1 1 122 122 LEU CA C 13 57.8868 0.042 . 1 . . . . 119 LEU CA . 17189 1 547 . 1 1 122 122 LEU CB C 13 42.7220 0.042 . 1 . . . . 119 LEU CB . 17189 1 548 . 1 1 122 122 LEU N N 15 120.5780 0.045 . 1 . . . . 119 LEU N . 17189 1 549 . 1 1 123 123 ALA H H 1 8.3740 0.004 . 1 . . . . 120 ALA HN . 17189 1 550 . 1 1 123 123 ALA C C 13 178.6150 0.042 . 1 . . . . 120 ALA C . 17189 1 551 . 1 1 123 123 ALA CA C 13 55.4770 0.042 . 1 . . . . 120 ALA CA . 17189 1 552 . 1 1 123 123 ALA CB C 13 18.2460 0.042 . 1 . . . . 120 ALA CB . 17189 1 553 . 1 1 123 123 ALA N N 15 120.7100 0.045 . 1 . . . . 120 ALA N . 17189 1 554 . 1 1 124 124 ARG H H 1 7.3410 0.004 . 1 . . . . 121 ARG HN . 17189 1 555 . 1 1 124 124 ARG C C 13 179.5140 0.042 . 1 . . . . 121 ARG C . 17189 1 556 . 1 1 124 124 ARG CA C 13 60.2473 0.042 . 1 . . . . 121 ARG CA . 17189 1 557 . 1 1 124 124 ARG CB C 13 29.9720 0.042 . 1 . . . . 121 ARG CB . 17189 1 558 . 1 1 124 124 ARG N N 15 116.9350 0.045 . 1 . . . . 121 ARG N . 17189 1 559 . 1 1 125 125 MET H H 1 7.7650 0.004 . 1 . . . . 122 MET HN . 17189 1 560 . 1 1 125 125 MET C C 13 178.3570 0.042 . 1 . . . . 122 MET C . 17189 1 561 . 1 1 125 125 MET CA C 13 59.3900 0.042 . 1 . . . . 122 MET CA . 17189 1 562 . 1 1 125 125 MET CB C 13 33.8050 0.042 . 1 . . . . 122 MET CB . 17189 1 563 . 1 1 125 125 MET N N 15 119.4390 0.045 . 1 . . . . 122 MET N . 17189 1 564 . 1 1 126 126 MET H H 1 8.5200 0.004 . 1 . . . . 123 MET HN . 17189 1 565 . 1 1 126 126 MET C C 13 178.6500 0.042 . 1 . . . . 123 MET C . 17189 1 566 . 1 1 126 126 MET CA C 13 61.0160 0.042 . 1 . . . . 123 MET CA . 17189 1 567 . 1 1 126 126 MET CB C 13 34.0815 0.042 . 1 . . . . 123 MET CB . 17189 1 568 . 1 1 126 126 MET N N 15 119.6020 0.045 . 1 . . . . 123 MET N . 17189 1 569 . 1 1 127 127 ASN H H 1 7.8650 0.004 . 1 . . . . 124 ASN HN . 17189 1 570 . 1 1 127 127 ASN C C 13 177.4040 0.042 . 1 . . . . 124 ASN C . 17189 1 571 . 1 1 127 127 ASN CA C 13 58.0940 0.042 . 1 . . . . 124 ASN CA . 17189 1 572 . 1 1 127 127 ASN CB C 13 40.4470 0.042 . 1 . . . . 124 ASN CB . 17189 1 573 . 1 1 127 127 ASN N N 15 117.0690 0.045 . 1 . . . . 124 ASN N . 17189 1 574 . 1 1 128 128 LYS H H 1 7.9680 0.004 . 1 . . . . 125 LYS HN . 17189 1 575 . 1 1 128 128 LYS C C 13 178.5350 0.042 . 1 . . . . 125 LYS C . 17189 1 576 . 1 1 128 128 LYS CA C 13 59.0620 0.042 . 1 . . . . 125 LYS CA . 17189 1 577 . 1 1 128 128 LYS CB C 13 32.4280 0.042 . 1 . . . . 125 LYS CB . 17189 1 578 . 1 1 128 128 LYS N N 15 119.8160 0.045 . 1 . . . . 125 LYS N . 17189 1 579 . 1 1 129 129 ARG H H 1 8.0090 0.004 . 1 . . . . 126 ARG HN . 17189 1 580 . 1 1 129 129 ARG C C 13 176.1090 0.042 . 1 . . . . 126 ARG C . 17189 1 581 . 1 1 129 129 ARG CA C 13 54.7440 0.042 . 1 . . . . 126 ARG CA . 17189 1 582 . 1 1 129 129 ARG CB C 13 30.8770 0.042 . 1 . . . . 126 ARG CB . 17189 1 583 . 1 1 129 129 ARG N N 15 114.8850 0.045 . 1 . . . . 126 ARG N . 17189 1 584 . 1 1 130 130 GLY H H 1 7.7740 0.004 . 1 . . . . 127 GLY HN . 17189 1 585 . 1 1 130 130 GLY C C 13 174.1760 0.042 . 1 . . . . 127 GLY C . 17189 1 586 . 1 1 130 130 GLY CA C 13 47.1620 0.042 . 1 . . . . 127 GLY CA . 17189 1 587 . 1 1 130 130 GLY N N 15 111.0290 0.045 . 1 . . . . 127 GLY N . 17189 1 588 . 1 1 131 131 VAL H H 1 8.1320 0.004 . 1 . . . . 128 VAL HN . 17189 1 589 . 1 1 131 131 VAL C C 13 173.0730 0.042 . 1 . . . . 128 VAL C . 17189 1 590 . 1 1 131 131 VAL CA C 13 62.2710 0.042 . 1 . . . . 128 VAL CA . 17189 1 591 . 1 1 131 131 VAL CB C 13 33.8190 0.042 . 1 . . . . 128 VAL CB . 17189 1 592 . 1 1 131 131 VAL N N 15 123.5360 0.045 . 1 . . . . 128 VAL N . 17189 1 593 . 1 1 132 132 ALA H H 1 7.6380 0.004 . 1 . . . . 129 ALA HN . 17189 1 594 . 1 1 132 132 ALA C C 13 175.7800 0.042 . 1 . . . . 129 ALA C . 17189 1 595 . 1 1 132 132 ALA CA C 13 50.2300 0.042 . 1 . . . . 129 ALA CA . 17189 1 596 . 1 1 132 132 ALA CB C 13 20.5640 0.042 . 1 . . . . 129 ALA CB . 17189 1 597 . 1 1 132 132 ALA N N 15 125.0190 0.045 . 1 . . . . 129 ALA N . 17189 1 598 . 1 1 133 133 LEU H H 1 8.1600 0.004 . 1 . . . . 130 LEU HN . 17189 1 599 . 1 1 133 133 LEU C C 13 175.1590 0.042 . 1 . . . . 130 LEU C . 17189 1 600 . 1 1 133 133 LEU CA C 13 52.4030 0.042 . 1 . . . . 130 LEU CA . 17189 1 601 . 1 1 133 133 LEU CB C 13 44.3360 0.042 . 1 . . . . 130 LEU CB . 17189 1 602 . 1 1 133 133 LEU N N 15 121.0730 0.045 . 1 . . . . 130 LEU N . 17189 1 603 . 1 1 134 134 GLY H H 1 8.5990 0.004 . 1 . . . . 131 GLY HN . 17189 1 604 . 1 1 134 134 GLY C C 13 172.0310 0.042 . 1 . . . . 131 GLY C . 17189 1 605 . 1 1 134 134 GLY CA C 13 44.2540 0.042 . 1 . . . . 131 GLY CA . 17189 1 606 . 1 1 134 134 GLY N N 15 112.2470 0.045 . 1 . . . . 131 GLY N . 17189 1 607 . 1 1 135 135 PHE H H 1 8.6830 0.004 . 1 . . . . 132 PHE HN . 17189 1 608 . 1 1 135 135 PHE C C 13 174.3300 0.042 . 1 . . . . 132 PHE C . 17189 1 609 . 1 1 135 135 PHE CA C 13 57.9800 0.042 . 1 . . . . 132 PHE CA . 17189 1 610 . 1 1 135 135 PHE CB C 13 39.3460 0.042 . 1 . . . . 132 PHE CB . 17189 1 611 . 1 1 135 135 PHE N N 15 125.6260 0.045 . 1 . . . . 132 PHE N . 17189 1 612 . 1 1 136 136 SER H H 1 7.1950 0.004 . 1 . . . . 133 SER HN . 17189 1 613 . 1 1 136 136 SER C C 13 175.8140 0.042 . 1 . . . . 133 SER C . 17189 1 614 . 1 1 136 136 SER CA C 13 57.0690 0.042 . 1 . . . . 133 SER CA . 17189 1 615 . 1 1 136 136 SER CB C 13 64.2750 0.042 . 1 . . . . 133 SER CB . 17189 1 616 . 1 1 136 136 SER N N 15 116.8190 0.045 . 1 . . . . 133 SER N . 17189 1 617 . 1 1 137 137 LEU H H 1 8.8070 0.004 . 1 . . . . 134 LEU HN . 17189 1 618 . 1 1 137 137 LEU C C 13 177.1360 0.042 . 1 . . . . 134 LEU C . 17189 1 619 . 1 1 137 137 LEU CA C 13 55.8400 0.042 . 1 . . . . 134 LEU CA . 17189 1 620 . 1 1 137 137 LEU CB C 13 42.2930 0.042 . 1 . . . . 134 LEU CB . 17189 1 621 . 1 1 137 137 LEU N N 15 125.1320 0.045 . 1 . . . . 134 LEU N . 17189 1 622 . 1 1 138 138 ARG H H 1 7.0510 0.004 . 1 . . . . 135 ARG HN . 17189 1 623 . 1 1 138 138 ARG CA C 13 61.4790 0.042 . 1 . . . . 135 ARG CA . 17189 1 624 . 1 1 138 138 ARG N N 15 119.1330 0.045 . 1 . . . . 135 ARG N . 17189 1 625 . 1 1 145 145 PRO C C 13 178.9500 0.042 . 1 . . . . 142 PRO C . 17189 1 626 . 1 1 145 145 PRO CA C 13 65.6540 0.042 . 1 . . . . 142 PRO CA . 17189 1 627 . 1 1 145 145 PRO CB C 13 32.2080 0.042 . 1 . . . . 142 PRO CB . 17189 1 628 . 1 1 146 146 TYR H H 1 7.8410 0.004 . 1 . . . . 143 TYR HN . 17189 1 629 . 1 1 146 146 TYR C C 13 178.1990 0.042 . 1 . . . . 143 TYR C . 17189 1 630 . 1 1 146 146 TYR CA C 13 60.3360 0.042 . 1 . . . . 143 TYR CA . 17189 1 631 . 1 1 146 146 TYR CB C 13 37.6220 0.042 . 1 . . . . 143 TYR CB . 17189 1 632 . 1 1 146 146 TYR N N 15 119.3560 0.045 . 1 . . . . 143 TYR N . 17189 1 633 . 1 1 147 147 GLU H H 1 7.7450 0.004 . 1 . . . . 144 GLU HN . 17189 1 634 . 1 1 147 147 GLU C C 13 179.7480 0.042 . 1 . . . . 144 GLU C . 17189 1 635 . 1 1 147 147 GLU CA C 13 58.6300 0.042 . 1 . . . . 144 GLU CA . 17189 1 636 . 1 1 147 147 GLU CB C 13 29.5610 0.042 . 1 . . . . 144 GLU CB . 17189 1 637 . 1 1 147 147 GLU N N 15 120.7520 0.045 . 1 . . . . 144 GLU N . 17189 1 638 . 1 1 148 148 ARG H H 1 8.0760 0.004 . 1 . . . . 145 ARG HN . 17189 1 639 . 1 1 148 148 ARG C C 13 177.5970 0.042 . 1 . . . . 145 ARG C . 17189 1 640 . 1 1 148 148 ARG CA C 13 59.6623 0.042 . 1 . . . . 145 ARG CA . 17189 1 641 . 1 1 148 148 ARG CB C 13 30.8123 0.042 . 1 . . . . 145 ARG CB . 17189 1 642 . 1 1 148 148 ARG N N 15 120.0110 0.045 . 1 . . . . 145 ARG N . 17189 1 643 . 1 1 149 149 ALA H H 1 7.6024 0.004 . 1 . . . . 146 ALA HN . 17189 1 644 . 1 1 149 149 ALA C C 13 180.7100 0.042 . 1 . . . . 146 ALA C . 17189 1 645 . 1 1 149 149 ALA CA C 13 55.0060 0.042 . 1 . . . . 146 ALA CA . 17189 1 646 . 1 1 149 149 ALA CB C 13 17.9810 0.042 . 1 . . . . 146 ALA CB . 17189 1 647 . 1 1 149 149 ALA N N 15 120.3420 0.045 . 1 . . . . 146 ALA N . 17189 1 648 . 1 1 150 150 ASN H H 1 7.6440 0.004 . 1 . . . . 147 ASN HN . 17189 1 649 . 1 1 150 150 ASN C C 13 175.9130 0.042 . 1 . . . . 147 ASN C . 17189 1 650 . 1 1 150 150 ASN CA C 13 55.7200 0.042 . 1 . . . . 147 ASN CA . 17189 1 651 . 1 1 150 150 ASN CB C 13 38.0290 0.042 . 1 . . . . 147 ASN CB . 17189 1 652 . 1 1 150 150 ASN N N 15 117.9350 0.045 . 1 . . . . 147 ASN N . 17189 1 653 . 1 1 151 151 ALA H H 1 7.8210 0.004 . 1 . . . . 148 ALA HN . 17189 1 654 . 1 1 151 151 ALA C C 13 179.8440 0.042 . 1 . . . . 148 ALA C . 17189 1 655 . 1 1 151 151 ALA CA C 13 55.5140 0.042 . 1 . . . . 148 ALA CA . 17189 1 656 . 1 1 151 151 ALA CB C 13 18.2580 0.042 . 1 . . . . 148 ALA CB . 17189 1 657 . 1 1 151 151 ALA N N 15 122.1360 0.045 . 1 . . . . 148 ALA N . 17189 1 658 . 1 1 152 152 LEU H H 1 8.0080 0.004 . 1 . . . . 149 LEU HN . 17189 1 659 . 1 1 152 152 LEU C C 13 178.8460 0.042 . 1 . . . . 149 LEU C . 17189 1 660 . 1 1 152 152 LEU CA C 13 58.1520 0.042 . 1 . . . . 149 LEU CA . 17189 1 661 . 1 1 152 152 LEU CB C 13 41.8360 0.042 . 1 . . . . 149 LEU CB . 17189 1 662 . 1 1 152 152 LEU N N 15 118.0530 0.045 . 1 . . . . 149 LEU N . 17189 1 663 . 1 1 153 153 LYS H H 1 7.4500 0.004 . 1 . . . . 150 LYS HN . 17189 1 664 . 1 1 153 153 LYS C C 13 179.6060 0.042 . 1 . . . . 150 LYS C . 17189 1 665 . 1 1 153 153 LYS CA C 13 60.0210 0.042 . 1 . . . . 150 LYS CA . 17189 1 666 . 1 1 153 153 LYS N N 15 119.5800 0.045 . 1 . . . . 150 LYS N . 17189 1 667 . 1 1 154 154 PHE H H 1 7.6880 0.004 . 1 . . . . 151 PHE HN . 17189 1 668 . 1 1 154 154 PHE C C 13 178.2990 0.042 . 1 . . . . 151 PHE C . 17189 1 669 . 1 1 154 154 PHE N N 15 119.0580 0.045 . 1 . . . . 151 PHE N . 17189 1 670 . 1 1 155 155 MET H H 1 8.2670 0.004 . 1 . . . . 152 MET HN . 17189 1 671 . 1 1 155 155 MET C C 13 177.9780 0.042 . 1 . . . . 152 MET C . 17189 1 672 . 1 1 155 155 MET CA C 13 60.4203 0.042 . 1 . . . . 152 MET CA . 17189 1 673 . 1 1 155 155 MET CB C 13 34.0307 0.042 . 1 . . . . 152 MET CB . 17189 1 674 . 1 1 155 155 MET N N 15 119.9640 0.045 . 1 . . . . 152 MET N . 17189 1 675 . 1 1 156 156 ARG H H 1 8.3230 0.004 . 1 . . . . 153 ARG HN . 17189 1 676 . 1 1 156 156 ARG C C 13 179.7740 0.042 . 1 . . . . 153 ARG C . 17189 1 677 . 1 1 156 156 ARG CA C 13 59.7400 0.042 . 1 . . . . 153 ARG CA . 17189 1 678 . 1 1 156 156 ARG CB C 13 30.4340 0.042 . 1 . . . . 153 ARG CB . 17189 1 679 . 1 1 156 156 ARG N N 15 120.0260 0.045 . 1 . . . . 153 ARG N . 17189 1 680 . 1 1 157 157 LYS H H 1 7.5620 0.004 . 1 . . . . 154 LYS HN . 17189 1 681 . 1 1 157 157 LYS C C 13 179.5700 0.042 . 1 . . . . 154 LYS C . 17189 1 682 . 1 1 157 157 LYS CA C 13 59.4220 0.042 . 1 . . . . 154 LYS CA . 17189 1 683 . 1 1 157 157 LYS CB C 13 32.2500 0.042 . 1 . . . . 154 LYS CB . 17189 1 684 . 1 1 157 157 LYS N N 15 120.0410 0.045 . 1 . . . . 154 LYS N . 17189 1 685 . 1 1 158 158 ALA H H 1 8.2970 0.004 . 1 . . . . 155 ALA HN . 17189 1 686 . 1 1 158 158 ALA C C 13 179.6370 0.042 . 1 . . . . 155 ALA C . 17189 1 687 . 1 1 158 158 ALA CA C 13 55.6700 0.042 . 1 . . . . 155 ALA CA . 17189 1 688 . 1 1 158 158 ALA CB C 13 18.8280 0.042 . 1 . . . . 155 ALA CB . 17189 1 689 . 1 1 158 158 ALA N N 15 121.8010 0.045 . 1 . . . . 155 ALA N . 17189 1 690 . 1 1 159 159 TRP H H 1 8.9440 0.004 . 1 . . . . 156 TRP HN . 17189 1 691 . 1 1 159 159 TRP C C 13 176.1170 0.042 . 1 . . . . 156 TRP C . 17189 1 692 . 1 1 159 159 TRP CA C 13 59.8567 0.042 . 1 . . . . 156 TRP CA . 17189 1 693 . 1 1 159 159 TRP CB C 13 29.1990 0.042 . 1 . . . . 156 TRP CB . 17189 1 694 . 1 1 159 159 TRP N N 15 119.5240 0.045 . 1 . . . . 156 TRP N . 17189 1 695 . 1 1 160 160 THR H H 1 7.8010 0.004 . 1 . . . . 157 THR HN . 17189 1 696 . 1 1 160 160 THR C C 13 177.0300 0.042 . 1 . . . . 157 THR C . 17189 1 697 . 1 1 160 160 THR CA C 13 66.6130 0.042 . 1 . . . . 157 THR CA . 17189 1 698 . 1 1 160 160 THR CB C 13 68.7690 0.042 . 1 . . . . 157 THR CB . 17189 1 699 . 1 1 160 160 THR N N 15 112.8440 0.045 . 1 . . . . 157 THR N . 17189 1 700 . 1 1 161 161 LEU H H 1 6.9260 0.004 . 1 . . . . 158 LEU HN . 17189 1 701 . 1 1 161 161 LEU C C 13 178.1050 0.042 . 1 . . . . 158 LEU C . 17189 1 702 . 1 1 161 161 LEU CA C 13 57.8490 0.042 . 1 . . . . 158 LEU CA . 17189 1 703 . 1 1 161 161 LEU N N 15 120.7780 0.045 . 1 . . . . 158 LEU N . 17189 1 704 . 1 1 162 162 VAL H H 1 8.4050 0.004 . 1 . . . . 159 VAL HN . 17189 1 705 . 1 1 162 162 VAL C C 13 177.4880 0.042 . 1 . . . . 159 VAL C . 17189 1 706 . 1 1 162 162 VAL CA C 13 65.8050 0.042 . 1 . . . . 159 VAL CA . 17189 1 707 . 1 1 162 162 VAL CB C 13 31.6520 0.042 . 1 . . . . 159 VAL CB . 17189 1 708 . 1 1 162 162 VAL N N 15 120.8290 0.045 . 1 . . . . 159 VAL N . 17189 1 709 . 1 1 163 163 ASN H H 1 8.1660 0.004 . 1 . . . . 160 ASN HN . 17189 1 710 . 1 1 163 163 ASN C C 13 177.8380 0.042 . 1 . . . . 160 ASN C . 17189 1 711 . 1 1 163 163 ASN CA C 13 54.8150 0.042 . 1 . . . . 160 ASN CA . 17189 1 712 . 1 1 163 163 ASN CB C 13 38.1710 0.042 . 1 . . . . 160 ASN CB . 17189 1 713 . 1 1 163 163 ASN N N 15 116.8950 0.045 . 1 . . . . 160 ASN N . 17189 1 714 . 1 1 164 164 LYS H H 1 7.3040 0.004 . 1 . . . . 161 LYS HN . 17189 1 715 . 1 1 164 164 LYS C C 13 177.6980 0.042 . 1 . . . . 161 LYS C . 17189 1 716 . 1 1 164 164 LYS CA C 13 59.4590 0.042 . 1 . . . . 161 LYS CA . 17189 1 717 . 1 1 164 164 LYS CB C 13 32.6380 0.042 . 1 . . . . 161 LYS CB . 17189 1 718 . 1 1 164 164 LYS N N 15 119.6270 0.045 . 1 . . . . 161 LYS N . 17189 1 719 . 1 1 165 165 TYR H H 1 7.7420 0.004 . 1 . . . . 162 TYR HN . 17189 1 720 . 1 1 165 165 TYR C C 13 173.5810 0.042 . 1 . . . . 162 TYR C . 17189 1 721 . 1 1 165 165 TYR CA C 13 58.6570 0.042 . 1 . . . . 162 TYR CA . 17189 1 722 . 1 1 165 165 TYR CB C 13 37.4750 0.042 . 1 . . . . 162 TYR CB . 17189 1 723 . 1 1 165 165 TYR N N 15 112.7280 0.045 . 1 . . . . 162 TYR N . 17189 1 724 . 1 1 166 166 LYS H H 1 7.4460 0.004 . 1 . . . . 163 LYS HN . 17189 1 725 . 1 1 166 166 LYS C C 13 176.2600 0.042 . 1 . . . . 163 LYS C . 17189 1 726 . 1 1 166 166 LYS CA C 13 56.8250 0.042 . 1 . . . . 163 LYS CA . 17189 1 727 . 1 1 166 166 LYS CB C 13 28.6560 0.042 . 1 . . . . 163 LYS CB . 17189 1 728 . 1 1 166 166 LYS N N 15 117.4370 0.045 . 1 . . . . 163 LYS N . 17189 1 729 . 1 1 167 167 VAL H H 1 8.5620 0.004 . 1 . . . . 164 VAL HN . 17189 1 730 . 1 1 167 167 VAL CA C 13 61.0140 0.042 . 1 . . . . 164 VAL CA . 17189 1 731 . 1 1 167 167 VAL N N 15 123.7880 0.045 . 1 . . . . 164 VAL N . 17189 1 732 . 1 1 168 168 PRO CA C 13 63.7750 0.042 . 1 . . . . 165 PRO CA . 17189 1 733 . 1 1 168 168 PRO CB C 13 31.5820 0.042 . 1 . . . . 165 PRO CB . 17189 1 734 . 1 1 169 169 ARG H H 1 5.9020 0.004 . 1 . . . . 166 ARG HN . 17189 1 735 . 1 1 169 169 ARG C C 13 172.5070 0.042 . 1 . . . . 166 ARG C . 17189 1 736 . 1 1 169 169 ARG CA C 13 54.9530 0.042 . 1 . . . . 166 ARG CA . 17189 1 737 . 1 1 169 169 ARG CB C 13 30.5740 0.042 . 1 . . . . 166 ARG CB . 17189 1 738 . 1 1 169 169 ARG N N 15 117.4580 0.045 . 1 . . . . 166 ARG N . 17189 1 739 . 1 1 170 170 PHE H H 1 7.9320 0.004 . 1 . . . . 167 PHE HN . 17189 1 740 . 1 1 170 170 PHE C C 13 173.5380 0.042 . 1 . . . . 167 PHE C . 17189 1 741 . 1 1 170 170 PHE CA C 13 55.5590 0.042 . 1 . . . . 167 PHE CA . 17189 1 742 . 1 1 170 170 PHE CB C 13 42.8570 0.042 . 1 . . . . 167 PHE CB . 17189 1 743 . 1 1 170 170 PHE N N 15 111.9000 0.045 . 1 . . . . 167 PHE N . 17189 1 744 . 1 1 171 171 ILE H H 1 7.1450 0.004 . 1 . . . . 168 ILE HN . 17189 1 745 . 1 1 171 171 ILE C C 13 173.5950 0.042 . 1 . . . . 168 ILE C . 17189 1 746 . 1 1 171 171 ILE CA C 13 59.6120 0.042 . 1 . . . . 168 ILE CA . 17189 1 747 . 1 1 171 171 ILE CB C 13 40.9090 0.042 . 1 . . . . 168 ILE CB . 17189 1 748 . 1 1 171 171 ILE N N 15 117.9220 0.045 . 1 . . . . 168 ILE N . 17189 1 749 . 1 1 172 172 SER H H 1 8.2740 0.004 . 1 . . . . 169 SER HN . 17189 1 750 . 1 1 172 172 SER C C 13 173.6810 0.042 . 1 . . . . 169 SER C . 17189 1 751 . 1 1 172 172 SER CA C 13 56.4460 0.042 . 1 . . . . 169 SER CA . 17189 1 752 . 1 1 172 172 SER CB C 13 64.5990 0.042 . 1 . . . . 169 SER CB . 17189 1 753 . 1 1 172 172 SER N N 15 117.4130 0.045 . 1 . . . . 169 SER N . 17189 1 754 . 1 1 173 173 SER H H 1 10.5010 0.004 . 1 . . . . 170 SER HN . 17189 1 755 . 1 1 173 173 SER C C 13 176.1300 0.042 . 1 . . . . 170 SER C . 17189 1 756 . 1 1 173 173 SER CA C 13 61.9430 0.042 . 1 . . . . 170 SER CA . 17189 1 757 . 1 1 173 173 SER CB C 13 63.5820 0.042 . 1 . . . . 170 SER CB . 17189 1 758 . 1 1 173 173 SER N N 15 126.6740 0.045 . 1 . . . . 170 SER N . 17189 1 759 . 1 1 174 174 SER H H 1 9.4710 0.004 . 1 . . . . 171 SER HN . 17189 1 760 . 1 1 174 174 SER C C 13 177.7935 0.042 . 1 . . . . 171 SER C . 17189 1 761 . 1 1 174 174 SER CA C 13 57.8551 0.042 . 1 . . . . 171 SER CA . 17189 1 762 . 1 1 174 174 SER CB C 13 62.5620 0.042 . 1 . . . . 171 SER CB . 17189 1 763 . 1 1 174 174 SER N N 15 119.6550 0.045 . 1 . . . . 171 SER N . 17189 1 764 . 1 1 175 175 ALA H H 1 7.2860 0.004 . 1 . . . . 172 ALA HN . 17189 1 765 . 1 1 175 175 ALA C C 13 176.8690 0.042 . 1 . . . . 172 ALA C . 17189 1 766 . 1 1 175 175 ALA CA C 13 54.2150 0.042 . 1 . . . . 172 ALA CA . 17189 1 767 . 1 1 175 175 ALA CB C 13 21.6380 0.042 . 1 . . . . 172 ALA CB . 17189 1 768 . 1 1 175 175 ALA N N 15 118.4825 0.045 . 1 . . . . 172 ALA N . 17189 1 769 . 1 1 176 176 LYS H H 1 8.1660 0.004 . 1 . . . . 173 LYS HN . 17189 1 770 . 1 1 176 176 LYS C C 13 176.6420 0.042 . 1 . . . . 173 LYS C . 17189 1 771 . 1 1 176 176 LYS CA C 13 56.1090 0.042 . 1 . . . . 173 LYS CA . 17189 1 772 . 1 1 176 176 LYS CB C 13 33.1890 0.042 . 1 . . . . 173 LYS CB . 17189 1 773 . 1 1 176 176 LYS N N 15 117.8210 0.045 . 1 . . . . 173 LYS N . 17189 1 774 . 1 1 177 177 GLY H H 1 7.5000 0.004 . 1 . . . . 174 GLY HN . 17189 1 775 . 1 1 177 177 GLY CA C 13 43.7770 0.042 . 1 . . . . 174 GLY CA . 17189 1 776 . 1 1 177 177 GLY N N 15 106.7580 0.045 . 1 . . . . 174 GLY N . 17189 1 777 . 1 1 178 178 LYS C C 13 177.1560 0.042 . 1 . . . . 175 LYS C . 17189 1 778 . 1 1 178 178 LYS CA C 13 60.4730 0.042 . 1 . . . . 175 LYS CA . 17189 1 779 . 1 1 178 178 LYS CB C 13 31.6396 0.042 . 1 . . . . 175 LYS CB . 17189 1 780 . 1 1 179 179 PHE H H 1 7.8380 0.004 . 1 . . . . 176 PHE HN . 17189 1 781 . 1 1 179 179 PHE C C 13 175.9510 0.042 . 1 . . . . 176 PHE C . 17189 1 782 . 1 1 179 179 PHE CA C 13 58.4253 0.042 . 1 . . . . 176 PHE CA . 17189 1 783 . 1 1 179 179 PHE CB C 13 37.5500 0.042 . 1 . . . . 176 PHE CB . 17189 1 784 . 1 1 179 179 PHE N N 15 113.9080 0.045 . 1 . . . . 176 PHE N . 17189 1 785 . 1 1 180 180 GLN H H 1 7.3500 0.004 . 1 . . . . 177 GLN HN . 17189 1 786 . 1 1 180 180 GLN C C 13 174.4800 0.042 . 1 . . . . 177 GLN C . 17189 1 787 . 1 1 180 180 GLN CA C 13 55.6960 0.042 . 1 . . . . 177 GLN CA . 17189 1 788 . 1 1 180 180 GLN CB C 13 29.3860 0.042 . 1 . . . . 177 GLN CB . 17189 1 789 . 1 1 180 180 GLN N N 15 118.1440 0.045 . 1 . . . . 177 GLN N . 17189 1 790 . 1 1 181 181 VAL H H 1 6.9180 0.004 . 1 . . . . 178 VAL HN . 17189 1 791 . 1 1 181 181 VAL C C 13 176.2400 0.042 . 1 . . . . 178 VAL C . 17189 1 792 . 1 1 181 181 VAL CA C 13 63.8400 0.042 . 1 . . . . 178 VAL CA . 17189 1 793 . 1 1 181 181 VAL CB C 13 31.9730 0.042 . 1 . . . . 178 VAL CB . 17189 1 794 . 1 1 181 181 VAL N N 15 119.6470 0.045 . 1 . . . . 178 VAL N . 17189 1 795 . 1 1 182 182 ARG H H 1 8.5860 0.004 . 1 . . . . 179 ARG HN . 17189 1 796 . 1 1 182 182 ARG C C 13 175.5180 0.042 . 1 . . . . 179 ARG C . 17189 1 797 . 1 1 182 182 ARG CA C 13 52.4250 0.042 . 1 . . . . 179 ARG CA . 17189 1 798 . 1 1 182 182 ARG CB C 13 33.9750 0.042 . 1 . . . . 179 ARG CB . 17189 1 799 . 1 1 182 182 ARG N N 15 126.9770 0.045 . 1 . . . . 179 ARG N . 17189 1 800 . 1 1 183 183 GLY H H 1 8.1230 0.004 . 1 . . . . 180 GLY HN . 17189 1 801 . 1 1 183 183 GLY C C 13 173.5570 0.042 . 1 . . . . 180 GLY C . 17189 1 802 . 1 1 183 183 GLY CA C 13 44.1120 0.042 . 1 . . . . 180 GLY CA . 17189 1 803 . 1 1 183 183 GLY N N 15 106.2930 0.045 . 1 . . . . 180 GLY N . 17189 1 804 . 1 1 184 184 VAL H H 1 7.6640 0.004 . 1 . . . . 181 VAL HN . 17189 1 805 . 1 1 184 184 VAL C C 13 177.8320 0.042 . 1 . . . . 181 VAL C . 17189 1 806 . 1 1 184 184 VAL CA C 13 67.1960 0.042 . 1 . . . . 181 VAL CA . 17189 1 807 . 1 1 184 184 VAL CB C 13 31.8360 0.042 . 1 . . . . 181 VAL CB . 17189 1 808 . 1 1 184 184 VAL N N 15 119.0480 0.045 . 1 . . . . 181 VAL N . 17189 1 809 . 1 1 185 185 LYS H H 1 8.0790 0.004 . 1 . . . . 182 LYS HN . 17189 1 810 . 1 1 185 185 LYS C C 13 179.1980 0.042 . 1 . . . . 182 LYS C . 17189 1 811 . 1 1 185 185 LYS CA C 13 59.6407 0.042 . 1 . . . . 182 LYS CA . 17189 1 812 . 1 1 185 185 LYS CB C 13 31.6040 0.042 . 1 . . . . 182 LYS CB . 17189 1 813 . 1 1 185 185 LYS N N 15 116.5670 0.045 . 1 . . . . 182 LYS N . 17189 1 814 . 1 1 186 186 GLU H H 1 7.5180 0.004 . 1 . . . . 183 GLU HN . 17189 1 815 . 1 1 186 186 GLU C C 13 179.4040 0.042 . 1 . . . . 183 GLU C . 17189 1 816 . 1 1 186 186 GLU CA C 13 59.7840 0.042 . 1 . . . . 183 GLU CA . 17189 1 817 . 1 1 186 186 GLU N N 15 119.7970 0.045 . 1 . . . . 183 GLU N . 17189 1 818 . 1 1 187 187 LEU H H 1 7.9970 0.004 . 1 . . . . 184 LEU HN . 17189 1 819 . 1 1 187 187 LEU CA C 13 56.0400 0.042 . 1 . . . . 184 LEU CA . 17189 1 820 . 1 1 187 187 LEU CB C 13 41.3700 0.042 . 1 . . . . 184 LEU CB . 17189 1 821 . 1 1 187 187 LEU N N 15 120.6340 0.045 . 1 . . . . 184 LEU N . 17189 1 822 . 1 1 188 188 ILE C C 13 177.8380 0.042 . 1 . . . . 185 ILE C . 17189 1 823 . 1 1 188 188 ILE CA C 13 65.8790 0.042 . 1 . . . . 185 ILE CA . 17189 1 824 . 1 1 188 188 ILE CB C 13 37.2100 0.042 . 1 . . . . 185 ILE CB . 17189 1 825 . 1 1 189 189 SER H H 1 7.7570 0.004 . 1 . . . . 186 SER HN . 17189 1 826 . 1 1 189 189 SER C C 13 177.0170 0.042 . 1 . . . . 186 SER C . 17189 1 827 . 1 1 189 189 SER CA C 13 62.6690 0.042 . 1 . . . . 186 SER CA . 17189 1 828 . 1 1 189 189 SER N N 15 114.8010 0.045 . 1 . . . . 186 SER N . 17189 1 829 . 1 1 190 190 LEU H H 1 7.5670 0.004 . 1 . . . . 187 LEU HN . 17189 1 830 . 1 1 190 190 LEU C C 13 177.7460 0.042 . 1 . . . . 187 LEU C . 17189 1 831 . 1 1 190 190 LEU CA C 13 57.8070 0.042 . 1 . . . . 187 LEU CA . 17189 1 832 . 1 1 190 190 LEU CB C 13 41.0520 0.042 . 1 . . . . 187 LEU CB . 17189 1 833 . 1 1 190 190 LEU N N 15 124.8890 0.045 . 1 . . . . 187 LEU N . 17189 1 834 . 1 1 191 191 GLY H H 1 7.8740 0.004 . 1 . . . . 188 GLY HN . 17189 1 835 . 1 1 191 191 GLY C C 13 175.5870 0.042 . 1 . . . . 188 GLY C . 17189 1 836 . 1 1 191 191 GLY CA C 13 48.0020 0.042 . 1 . . . . 188 GLY CA . 17189 1 837 . 1 1 191 191 GLY N N 15 107.2610 0.045 . 1 . . . . 188 GLY N . 17189 1 838 . 1 1 192 192 ILE H H 1 8.1090 0.004 . 1 . . . . 189 ILE HN . 17189 1 839 . 1 1 192 192 ILE C C 13 180.4130 0.042 . 1 . . . . 189 ILE C . 17189 1 840 . 1 1 192 192 ILE CA C 13 63.5730 0.042 . 1 . . . . 189 ILE CA . 17189 1 841 . 1 1 192 192 ILE CB C 13 37.7370 0.042 . 1 . . . . 189 ILE CB . 17189 1 842 . 1 1 192 192 ILE N N 15 123.8070 0.045 . 1 . . . . 189 ILE N . 17189 1 843 . 1 1 193 193 ALA H H 1 7.7990 0.004 . 1 . . . . 190 ALA HN . 17189 1 844 . 1 1 193 193 ALA C C 13 179.6900 0.042 . 1 . . . . 190 ALA C . 17189 1 845 . 1 1 193 193 ALA CA C 13 54.9250 0.042 . 1 . . . . 190 ALA CA . 17189 1 846 . 1 1 193 193 ALA CB C 13 17.5630 0.042 . 1 . . . . 190 ALA CB . 17189 1 847 . 1 1 193 193 ALA N N 15 125.2140 0.045 . 1 . . . . 190 ALA N . 17189 1 848 . 1 1 194 194 ILE H H 1 7.4170 0.004 . 1 . . . . 191 ILE HN . 17189 1 849 . 1 1 194 194 ILE C C 13 173.3640 0.042 . 1 . . . . 191 ILE C . 17189 1 850 . 1 1 194 194 ILE CA C 13 62.5620 0.042 . 1 . . . . 191 ILE CA . 17189 1 851 . 1 1 194 194 ILE CB C 13 37.9510 0.042 . 1 . . . . 191 ILE CB . 17189 1 852 . 1 1 194 194 ILE N N 15 114.5370 0.045 . 1 . . . . 191 ILE N . 17189 1 853 . 1 1 195 195 GLY H H 1 7.3170 0.004 . 1 . . . . 192 GLY HN . 17189 1 854 . 1 1 195 195 GLY C C 13 175.0520 0.042 . 1 . . . . 192 GLY C . 17189 1 855 . 1 1 195 195 GLY CA C 13 44.1900 0.042 . 1 . . . . 192 GLY CA . 17189 1 856 . 1 1 195 195 GLY N N 15 104.6350 0.045 . 1 . . . . 192 GLY N . 17189 1 857 . 1 1 196 196 MET H H 1 7.3380 0.004 . 1 . . . . 193 MET HN . 17189 1 858 . 1 1 196 196 MET C C 13 176.6560 0.042 . 1 . . . . 193 MET C . 17189 1 859 . 1 1 196 196 MET CA C 13 56.4710 0.042 . 1 . . . . 193 MET CA . 17189 1 860 . 1 1 196 196 MET CB C 13 32.5423 0.042 . 1 . . . . 193 MET CB . 17189 1 861 . 1 1 196 196 MET N N 15 120.0730 0.045 . 1 . . . . 193 MET N . 17189 1 862 . 1 1 197 197 GLU H H 1 8.4510 0.004 . 1 . . . . 194 GLU HN . 17189 1 863 . 1 1 197 197 GLU C C 13 178.7400 0.042 . 1 . . . . 194 GLU C . 17189 1 864 . 1 1 197 197 GLU CA C 13 56.0890 0.042 . 1 . . . . 194 GLU CA . 17189 1 865 . 1 1 197 197 GLU CB C 13 30.7660 0.042 . 1 . . . . 194 GLU CB . 17189 1 866 . 1 1 197 197 GLU N N 15 119.5260 0.045 . 1 . . . . 194 GLU N . 17189 1 867 . 1 1 198 198 GLU H H 1 9.1730 0.004 . 1 . . . . 195 GLU HN . 17189 1 868 . 1 1 198 198 GLU C C 13 178.7400 0.042 . 1 . . . . 195 GLU C . 17189 1 869 . 1 1 198 198 GLU CA C 13 61.9227 0.042 . 1 . . . . 195 GLU CA . 17189 1 870 . 1 1 198 198 GLU CB C 13 29.0230 0.042 . 1 . . . . 195 GLU CB . 17189 1 871 . 1 1 198 198 GLU N N 15 126.3790 0.045 . 1 . . . . 195 GLU N . 17189 1 872 . 1 1 199 199 VAL H H 1 8.5060 0.004 . 1 . . . . 196 VAL HN . 17189 1 873 . 1 1 199 199 VAL C C 13 178.5230 0.042 . 1 . . . . 196 VAL C . 17189 1 874 . 1 1 199 199 VAL CA C 13 65.9640 0.042 . 1 . . . . 196 VAL CA . 17189 1 875 . 1 1 199 199 VAL CB C 13 31.3120 0.042 . 1 . . . . 196 VAL CB . 17189 1 876 . 1 1 199 199 VAL N N 15 115.2400 0.045 . 1 . . . . 196 VAL N . 17189 1 877 . 1 1 200 200 GLN H H 1 6.9780 0.004 . 1 . . . . 197 GLN HN . 17189 1 878 . 1 1 200 200 GLN C C 13 179.5430 0.042 . 1 . . . . 197 GLN C . 17189 1 879 . 1 1 200 200 GLN CA C 13 57.8310 0.042 . 1 . . . . 197 GLN CA . 17189 1 880 . 1 1 200 200 GLN CB C 13 28.4870 0.042 . 1 . . . . 197 GLN CB . 17189 1 881 . 1 1 200 200 GLN N N 15 120.6410 0.045 . 1 . . . . 197 GLN N . 17189 1 882 . 1 1 201 201 ALA H H 1 8.5120 0.004 . 1 . . . . 198 ALA HN . 17189 1 883 . 1 1 201 201 ALA C C 13 179.6740 0.042 . 1 . . . . 198 ALA C . 17189 1 884 . 1 1 201 201 ALA CA C 13 55.2770 0.042 . 1 . . . . 198 ALA CA . 17189 1 885 . 1 1 201 201 ALA CB C 13 18.7350 0.042 . 1 . . . . 198 ALA CB . 17189 1 886 . 1 1 201 201 ALA N N 15 127.7580 0.045 . 1 . . . . 198 ALA N . 17189 1 887 . 1 1 202 202 LYS H H 1 8.5330 0.004 . 1 . . . . 199 LYS HN . 17189 1 888 . 1 1 202 202 LYS C C 13 181.1330 0.042 . 1 . . . . 199 LYS C . 17189 1 889 . 1 1 202 202 LYS CA C 13 61.2380 0.042 . 1 . . . . 199 LYS CA . 17189 1 890 . 1 1 202 202 LYS CB C 13 32.5600 0.042 . 1 . . . . 199 LYS CB . 17189 1 891 . 1 1 202 202 LYS N N 15 117.5950 0.045 . 1 . . . . 199 LYS N . 17189 1 892 . 1 1 203 203 ALA H H 1 8.1990 0.004 . 1 . . . . 200 ALA HN . 17189 1 893 . 1 1 203 203 ALA C C 13 180.3070 0.042 . 1 . . . . 200 ALA C . 17189 1 894 . 1 1 203 203 ALA CA C 13 55.9390 0.042 . 1 . . . . 200 ALA CA . 17189 1 895 . 1 1 203 203 ALA CB C 13 18.4660 0.042 . 1 . . . . 200 ALA CB . 17189 1 896 . 1 1 203 203 ALA N N 15 123.8920 0.045 . 1 . . . . 200 ALA N . 17189 1 897 . 1 1 204 204 SER H H 1 7.9730 0.004 . 1 . . . . 201 SER HN . 17189 1 898 . 1 1 204 204 SER C C 13 172.0200 0.042 . 1 . . . . 201 SER C . 17189 1 899 . 1 1 204 204 SER CA C 13 61.9210 0.042 . 1 . . . . 201 SER CA . 17189 1 900 . 1 1 204 204 SER CB C 13 63.6380 0.042 . 1 . . . . 201 SER CB . 17189 1 901 . 1 1 204 204 SER N N 15 116.0740 0.045 . 1 . . . . 201 SER N . 17189 1 902 . 1 1 205 205 LEU H H 1 7.4340 0.004 . 1 . . . . 202 LEU HN . 17189 1 903 . 1 1 205 205 LEU C C 13 175.3730 0.042 . 1 . . . . 202 LEU C . 17189 1 904 . 1 1 205 205 LEU CA C 13 54.3140 0.042 . 1 . . . . 202 LEU CA . 17189 1 905 . 1 1 205 205 LEU CB C 13 46.9900 0.042 . 1 . . . . 202 LEU CB . 17189 1 906 . 1 1 205 205 LEU N N 15 118.8410 0.045 . 1 . . . . 202 LEU N . 17189 1 907 . 1 1 206 206 SER H H 1 7.6780 0.004 . 1 . . . . 203 SER HN . 17189 1 908 . 1 1 206 206 SER C C 13 173.3530 0.042 . 1 . . . . 203 SER C . 17189 1 909 . 1 1 206 206 SER CA C 13 58.0099 0.042 . 1 . . . . 203 SER CA . 17189 1 910 . 1 1 206 206 SER CB C 13 65.5000 0.042 . 1 . . . . 203 SER CB . 17189 1 911 . 1 1 206 206 SER N N 15 113.8530 0.045 . 1 . . . . 203 SER N . 17189 1 912 . 1 1 207 207 PHE H H 1 8.0900 0.004 . 1 . . . . 204 PHE HN . 17189 1 913 . 1 1 207 207 PHE C C 13 177.5200 0.042 . 1 . . . . 204 PHE C . 17189 1 914 . 1 1 207 207 PHE CA C 13 62.0430 0.042 . 1 . . . . 204 PHE CA . 17189 1 915 . 1 1 207 207 PHE CB C 13 40.4940 0.042 . 1 . . . . 204 PHE CB . 17189 1 916 . 1 1 207 207 PHE N N 15 123.9930 0.045 . 1 . . . . 204 PHE N . 17189 1 917 . 1 1 208 208 TYR H H 1 8.6240 0.004 . 1 . . . . 205 TYR HN . 17189 1 918 . 1 1 208 208 TYR CA C 13 64.5100 0.042 . 1 . . . . 205 TYR CA . 17189 1 919 . 1 1 208 208 TYR N N 15 115.2110 0.045 . 1 . . . . 205 TYR N . 17189 1 920 . 1 1 209 209 PRO C C 13 177.3310 0.042 . 1 . . . . 206 PRO C . 17189 1 921 . 1 1 209 209 PRO CA C 13 67.4680 0.042 . 1 . . . . 206 PRO CA . 17189 1 922 . 1 1 209 209 PRO CB C 13 32.3560 0.042 . 1 . . . . 206 PRO CB . 17189 1 923 . 1 1 210 210 LEU H H 1 8.3260 0.004 . 1 . . . . 207 LEU HN . 17189 1 924 . 1 1 210 210 LEU C C 13 179.6290 0.042 . 1 . . . . 207 LEU C . 17189 1 925 . 1 1 210 210 LEU CA C 13 58.3500 0.042 . 1 . . . . 207 LEU CA . 17189 1 926 . 1 1 210 210 LEU CB C 13 41.1720 0.042 . 1 . . . . 207 LEU CB . 17189 1 927 . 1 1 210 210 LEU N N 15 116.4370 0.045 . 1 . . . . 207 LEU N . 17189 1 928 . 1 1 211 211 GLY H H 1 7.7470 0.004 . 1 . . . . 208 GLY HN . 17189 1 929 . 1 1 211 211 GLY C C 13 175.9780 0.042 . 1 . . . . 208 GLY C . 17189 1 930 . 1 1 211 211 GLY CA C 13 46.8520 0.042 . 1 . . . . 208 GLY CA . 17189 1 931 . 1 1 211 211 GLY N N 15 107.2130 0.045 . 1 . . . . 208 GLY N . 17189 1 932 . 1 1 212 212 ILE H H 1 7.6180 0.004 . 1 . . . . 209 ILE HN . 17189 1 933 . 1 1 212 212 ILE C C 13 177.4610 0.042 . 1 . . . . 209 ILE C . 17189 1 934 . 1 1 212 212 ILE CA C 13 64.6560 0.042 . 1 . . . . 209 ILE CA . 17189 1 935 . 1 1 212 212 ILE CB C 13 38.0817 0.042 . 1 . . . . 209 ILE CB . 17189 1 936 . 1 1 212 212 ILE N N 15 123.3310 0.045 . 1 . . . . 209 ILE N . 17189 1 937 . 1 1 213 213 LEU H H 1 7.9680 0.004 . 1 . . . . 210 LEU HN . 17189 1 938 . 1 1 213 213 LEU C C 13 179.1460 0.042 . 1 . . . . 210 LEU C . 17189 1 939 . 1 1 213 213 LEU CA C 13 57.4060 0.042 . 1 . . . . 210 LEU CA . 17189 1 940 . 1 1 213 213 LEU CB C 13 42.5380 0.042 . 1 . . . . 210 LEU CB . 17189 1 941 . 1 1 213 213 LEU N N 15 117.5110 0.045 . 1 . . . . 210 LEU N . 17189 1 942 . 1 1 214 214 GLU H H 1 7.6120 0.004 . 1 . . . . 211 GLU HN . 17189 1 943 . 1 1 214 214 GLU C C 13 177.5250 0.042 . 1 . . . . 211 GLU C . 17189 1 944 . 1 1 214 214 GLU CA C 13 58.7580 0.042 . 1 . . . . 211 GLU CA . 17189 1 945 . 1 1 214 214 GLU CB C 13 29.1750 0.042 . 1 . . . . 211 GLU CB . 17189 1 946 . 1 1 214 214 GLU N N 15 118.2460 0.045 . 1 . . . . 211 GLU N . 17189 1 947 . 1 1 215 215 ARG H H 1 7.3860 0.004 . 1 . . . . 212 ARG HN . 17189 1 948 . 1 1 215 215 ARG C C 13 177.0140 0.042 . 1 . . . . 212 ARG C . 17189 1 949 . 1 1 215 215 ARG CA C 13 58.0850 0.042 . 1 . . . . 212 ARG CA . 17189 1 950 . 1 1 215 215 ARG CB C 13 28.9710 0.042 . 1 . . . . 212 ARG CB . 17189 1 951 . 1 1 215 215 ARG N N 15 116.2130 0.045 . 1 . . . . 212 ARG N . 17189 1 952 . 1 1 216 216 LEU H H 1 7.5190 0.004 . 1 . . . . 213 LEU HN . 17189 1 953 . 1 1 216 216 LEU C C 13 176.2060 0.042 . 1 . . . . 213 LEU C . 17189 1 954 . 1 1 216 216 LEU CA C 13 54.7480 0.042 . 1 . . . . 213 LEU CA . 17189 1 955 . 1 1 216 216 LEU CB C 13 42.3500 0.042 . 1 . . . . 213 LEU CB . 17189 1 956 . 1 1 216 216 LEU N N 15 121.1070 0.045 . 1 . . . . 213 LEU N . 17189 1 957 . 1 1 217 217 LYS H H 1 7.3270 0.004 . 1 . . . . 214 LYS HN . 17189 1 958 . 1 1 217 217 LYS CA C 13 57.9380 0.042 . 1 . . . . 214 LYS CA . 17189 1 959 . 1 1 217 217 LYS N N 15 126.6470 0.045 . 1 . . . . 214 LYS N . 17189 1 stop_ save_