data_17703 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17703 _Entry.Title ; Backbone and stereo-specific Ile(d1), Leu, Val methyl sidechain chemical shift assignments of RDE-4 (1-243) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-06-14 _Entry.Accession_date 2011-06-14 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details 'Backbone and stereo-specific Ile(d1), Leu, Val methyl sidechain chemical shift assignments of RDE-4 (1-243)' _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 'Sai Chaitanya' Chiliveri . . . 17703 2 Sonu Kumar . . . 17703 3 'Udaya Kiran' Marelli . . . 17703 4 Mandar Deshmukh . V. . 17703 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Centre for Cellular and Molecular Biology' . 17703 2 . 'Indian Institute of Chemical Technology' . 17703 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17703 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 775 17703 '15N chemical shifts' 226 17703 '1H chemical shifts' 434 17703 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 3 . . 2013-01-24 2011-06-14 update author 'update entry citation' 17703 2 . . 2012-06-05 2011-06-14 update author 'update sample and condition' 17703 1 . . 2011-10-26 2011-06-14 original author 'original release' 17703 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2LTR 'BMRB Entry Tracking System' 17703 PDB 2LTS 'BMRB Entry Tracking System' 17703 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17703 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22002349 _Citation.Full_citation . _Citation.Title 'Backbone and sidechain methyl Ile (1), Leu and Val chemical shift assignments of RDE-4 (1-243), an RNA interference initiation protein in C. elegans.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 6 _Citation.Journal_issue 2 _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 143 _Citation.Page_last 146 _Citation.Year 2012 _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 'Sai Chaitanya' Chiliveri . . . 17703 1 2 Sonu Kumar . . . 17703 1 3 'Udaya Kiran' Marelli . . . 17703 1 4 Mandar Deshmukh . V. . 17703 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID dsRBD 17703 1 RDE-4 17703 1 'RNA binding proteins' 17703 1 RNAi 17703 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17703 _Assembly.ID 1 _Assembly.Name RDE-4DC _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 RDE-4DC 1 $RDE-4DC A . yes native no no . . . 17703 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_RDE-4DC _Entity.Sf_category entity _Entity.Sf_framecode RDE-4DC _Entity.Entry_ID 17703 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name RDE-4DC _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 ; MDLTKLTFESVFGGSDVPMK PSRSEDNKTPRNRTDLEMFL KKTPLMVLEEAAKAVYQKTP TWGTVELPEGFEMTLILNEI TVKGQATSKKAARQKAAVEY LRKVVEKGKHEIFFIPGTTK EEALSNIDQISDKAEELKRS TSDAVQDNDNDDSIPTSAEF PPGISPTENWVGKLQEKSQK SKLQAPIYEDSKNERTERFL VICTMCNQKTRGIRSKKKDA KNLAAWLMWKALEDGIESLE SYDLEHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 251 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'RDE-4DC, i.e. RDE-4 (1-243)' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'The N-terminal region of RDE-4 which contains two dsRBDs and remains monomeric in solution.' _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 EMBL CAA83012 . "Uncharacterized protein CELE_T20G5.11 [Caenorhabditis elegans]" . . . . . 97.21 385 99.59 100.00 3.92e-176 . . . . 17703 1 2 no GB AAL61544 . "RNA interference promoting factor [Caenorhabditis elegans]" . . . . . 97.21 385 99.59 100.00 3.92e-176 . . . . 17703 1 3 no REF NP_499265 . "Uncharacterized protein CELE_T20G5.11 [Caenorhabditis elegans]" . . . . . 97.21 385 99.59 100.00 3.92e-176 . . . . 17703 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 17703 1 2 . ASP . 17703 1 3 . LEU . 17703 1 4 . THR . 17703 1 5 . LYS . 17703 1 6 . LEU . 17703 1 7 . THR . 17703 1 8 . PHE . 17703 1 9 . GLU . 17703 1 10 . SER . 17703 1 11 . VAL . 17703 1 12 . PHE . 17703 1 13 . GLY . 17703 1 14 . GLY . 17703 1 15 . SER . 17703 1 16 . ASP . 17703 1 17 . VAL . 17703 1 18 . PRO . 17703 1 19 . MET . 17703 1 20 . LYS . 17703 1 21 . PRO . 17703 1 22 . SER . 17703 1 23 . ARG . 17703 1 24 . SER . 17703 1 25 . GLU . 17703 1 26 . ASP . 17703 1 27 . ASN . 17703 1 28 . LYS . 17703 1 29 . THR . 17703 1 30 . PRO . 17703 1 31 . ARG . 17703 1 32 . ASN . 17703 1 33 . ARG . 17703 1 34 . THR . 17703 1 35 . ASP . 17703 1 36 . LEU . 17703 1 37 . GLU . 17703 1 38 . MET . 17703 1 39 . PHE . 17703 1 40 . LEU . 17703 1 41 . LYS . 17703 1 42 . LYS . 17703 1 43 . THR . 17703 1 44 . PRO . 17703 1 45 . LEU . 17703 1 46 . MET . 17703 1 47 . VAL . 17703 1 48 . LEU . 17703 1 49 . GLU . 17703 1 50 . GLU . 17703 1 51 . ALA . 17703 1 52 . ALA . 17703 1 53 . LYS . 17703 1 54 . ALA . 17703 1 55 . VAL . 17703 1 56 . TYR . 17703 1 57 . GLN . 17703 1 58 . LYS . 17703 1 59 . THR . 17703 1 60 . PRO . 17703 1 61 . THR . 17703 1 62 . TRP . 17703 1 63 . GLY . 17703 1 64 . THR . 17703 1 65 . VAL . 17703 1 66 . GLU . 17703 1 67 . LEU . 17703 1 68 . PRO . 17703 1 69 . GLU . 17703 1 70 . GLY . 17703 1 71 . PHE . 17703 1 72 . GLU . 17703 1 73 . MET . 17703 1 74 . THR . 17703 1 75 . LEU . 17703 1 76 . ILE . 17703 1 77 . LEU . 17703 1 78 . ASN . 17703 1 79 . GLU . 17703 1 80 . ILE . 17703 1 81 . THR . 17703 1 82 . VAL . 17703 1 83 . LYS . 17703 1 84 . GLY . 17703 1 85 . GLN . 17703 1 86 . ALA . 17703 1 87 . THR . 17703 1 88 . SER . 17703 1 89 . LYS . 17703 1 90 . LYS . 17703 1 91 . ALA . 17703 1 92 . ALA . 17703 1 93 . ARG . 17703 1 94 . GLN . 17703 1 95 . LYS . 17703 1 96 . ALA . 17703 1 97 . ALA . 17703 1 98 . VAL . 17703 1 99 . GLU . 17703 1 100 . TYR . 17703 1 101 . LEU . 17703 1 102 . ARG . 17703 1 103 . LYS . 17703 1 104 . VAL . 17703 1 105 . VAL . 17703 1 106 . GLU . 17703 1 107 . LYS . 17703 1 108 . GLY . 17703 1 109 . LYS . 17703 1 110 . HIS . 17703 1 111 . GLU . 17703 1 112 . ILE . 17703 1 113 . PHE . 17703 1 114 . PHE . 17703 1 115 . ILE . 17703 1 116 . PRO . 17703 1 117 . GLY . 17703 1 118 . THR . 17703 1 119 . THR . 17703 1 120 . LYS . 17703 1 121 . GLU . 17703 1 122 . GLU . 17703 1 123 . ALA . 17703 1 124 . LEU . 17703 1 125 . SER . 17703 1 126 . ASN . 17703 1 127 . ILE . 17703 1 128 . ASP . 17703 1 129 . GLN . 17703 1 130 . ILE . 17703 1 131 . SER . 17703 1 132 . ASP . 17703 1 133 . LYS . 17703 1 134 . ALA . 17703 1 135 . GLU . 17703 1 136 . GLU . 17703 1 137 . LEU . 17703 1 138 . LYS . 17703 1 139 . ARG . 17703 1 140 . SER . 17703 1 141 . THR . 17703 1 142 . SER . 17703 1 143 . ASP . 17703 1 144 . ALA . 17703 1 145 . VAL . 17703 1 146 . GLN . 17703 1 147 . ASP . 17703 1 148 . ASN . 17703 1 149 . ASP . 17703 1 150 . ASN . 17703 1 151 . ASP . 17703 1 152 . ASP . 17703 1 153 . SER . 17703 1 154 . ILE . 17703 1 155 . PRO . 17703 1 156 . THR . 17703 1 157 . SER . 17703 1 158 . ALA . 17703 1 159 . GLU . 17703 1 160 . PHE . 17703 1 161 . PRO . 17703 1 162 . PRO . 17703 1 163 . GLY . 17703 1 164 . ILE . 17703 1 165 . SER . 17703 1 166 . PRO . 17703 1 167 . THR . 17703 1 168 . GLU . 17703 1 169 . ASN . 17703 1 170 . TRP . 17703 1 171 . VAL . 17703 1 172 . GLY . 17703 1 173 . LYS . 17703 1 174 . LEU . 17703 1 175 . GLN . 17703 1 176 . GLU . 17703 1 177 . LYS . 17703 1 178 . SER . 17703 1 179 . GLN . 17703 1 180 . LYS . 17703 1 181 . SER . 17703 1 182 . LYS . 17703 1 183 . LEU . 17703 1 184 . GLN . 17703 1 185 . ALA . 17703 1 186 . PRO . 17703 1 187 . ILE . 17703 1 188 . TYR . 17703 1 189 . GLU . 17703 1 190 . ASP . 17703 1 191 . SER . 17703 1 192 . LYS . 17703 1 193 . ASN . 17703 1 194 . GLU . 17703 1 195 . ARG . 17703 1 196 . THR . 17703 1 197 . GLU . 17703 1 198 . ARG . 17703 1 199 . PHE . 17703 1 200 . LEU . 17703 1 201 . VAL . 17703 1 202 . ILE . 17703 1 203 . CYS . 17703 1 204 . THR . 17703 1 205 . MET . 17703 1 206 . CYS . 17703 1 207 . ASN . 17703 1 208 . GLN . 17703 1 209 . LYS . 17703 1 210 . THR . 17703 1 211 . ARG . 17703 1 212 . GLY . 17703 1 213 . ILE . 17703 1 214 . ARG . 17703 1 215 . SER . 17703 1 216 . LYS . 17703 1 217 . LYS . 17703 1 218 . LYS . 17703 1 219 . ASP . 17703 1 220 . ALA . 17703 1 221 . LYS . 17703 1 222 . ASN . 17703 1 223 . LEU . 17703 1 224 . ALA . 17703 1 225 . ALA . 17703 1 226 . TRP . 17703 1 227 . LEU . 17703 1 228 . MET . 17703 1 229 . TRP . 17703 1 230 . LYS . 17703 1 231 . ALA . 17703 1 232 . LEU . 17703 1 233 . GLU . 17703 1 234 . ASP . 17703 1 235 . GLY . 17703 1 236 . ILE . 17703 1 237 . GLU . 17703 1 238 . SER . 17703 1 239 . LEU . 17703 1 240 . GLU . 17703 1 241 . SER . 17703 1 242 . TYR . 17703 1 243 . ASP . 17703 1 244 . LEU . 17703 1 245 . GLU . 17703 1 246 . HIS . 17703 1 247 . HIS . 17703 1 248 . HIS . 17703 1 249 . HIS . 17703 1 250 . HIS . 17703 1 251 . HIS . 17703 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 17703 1 . ASP 2 2 17703 1 . LEU 3 3 17703 1 . THR 4 4 17703 1 . LYS 5 5 17703 1 . LEU 6 6 17703 1 . THR 7 7 17703 1 . PHE 8 8 17703 1 . GLU 9 9 17703 1 . SER 10 10 17703 1 . VAL 11 11 17703 1 . PHE 12 12 17703 1 . GLY 13 13 17703 1 . GLY 14 14 17703 1 . SER 15 15 17703 1 . ASP 16 16 17703 1 . VAL 17 17 17703 1 . PRO 18 18 17703 1 . MET 19 19 17703 1 . LYS 20 20 17703 1 . PRO 21 21 17703 1 . SER 22 22 17703 1 . ARG 23 23 17703 1 . SER 24 24 17703 1 . GLU 25 25 17703 1 . ASP 26 26 17703 1 . ASN 27 27 17703 1 . LYS 28 28 17703 1 . THR 29 29 17703 1 . PRO 30 30 17703 1 . ARG 31 31 17703 1 . ASN 32 32 17703 1 . ARG 33 33 17703 1 . THR 34 34 17703 1 . ASP 35 35 17703 1 . LEU 36 36 17703 1 . GLU 37 37 17703 1 . MET 38 38 17703 1 . PHE 39 39 17703 1 . LEU 40 40 17703 1 . LYS 41 41 17703 1 . LYS 42 42 17703 1 . THR 43 43 17703 1 . PRO 44 44 17703 1 . LEU 45 45 17703 1 . MET 46 46 17703 1 . VAL 47 47 17703 1 . LEU 48 48 17703 1 . GLU 49 49 17703 1 . GLU 50 50 17703 1 . ALA 51 51 17703 1 . ALA 52 52 17703 1 . LYS 53 53 17703 1 . ALA 54 54 17703 1 . VAL 55 55 17703 1 . TYR 56 56 17703 1 . GLN 57 57 17703 1 . LYS 58 58 17703 1 . THR 59 59 17703 1 . PRO 60 60 17703 1 . THR 61 61 17703 1 . TRP 62 62 17703 1 . GLY 63 63 17703 1 . THR 64 64 17703 1 . VAL 65 65 17703 1 . GLU 66 66 17703 1 . LEU 67 67 17703 1 . PRO 68 68 17703 1 . GLU 69 69 17703 1 . GLY 70 70 17703 1 . PHE 71 71 17703 1 . GLU 72 72 17703 1 . MET 73 73 17703 1 . THR 74 74 17703 1 . LEU 75 75 17703 1 . ILE 76 76 17703 1 . LEU 77 77 17703 1 . ASN 78 78 17703 1 . GLU 79 79 17703 1 . ILE 80 80 17703 1 . THR 81 81 17703 1 . VAL 82 82 17703 1 . LYS 83 83 17703 1 . GLY 84 84 17703 1 . GLN 85 85 17703 1 . ALA 86 86 17703 1 . THR 87 87 17703 1 . SER 88 88 17703 1 . LYS 89 89 17703 1 . LYS 90 90 17703 1 . ALA 91 91 17703 1 . ALA 92 92 17703 1 . ARG 93 93 17703 1 . GLN 94 94 17703 1 . LYS 95 95 17703 1 . ALA 96 96 17703 1 . ALA 97 97 17703 1 . VAL 98 98 17703 1 . GLU 99 99 17703 1 . TYR 100 100 17703 1 . LEU 101 101 17703 1 . ARG 102 102 17703 1 . LYS 103 103 17703 1 . VAL 104 104 17703 1 . VAL 105 105 17703 1 . GLU 106 106 17703 1 . LYS 107 107 17703 1 . GLY 108 108 17703 1 . LYS 109 109 17703 1 . HIS 110 110 17703 1 . GLU 111 111 17703 1 . ILE 112 112 17703 1 . PHE 113 113 17703 1 . PHE 114 114 17703 1 . ILE 115 115 17703 1 . PRO 116 116 17703 1 . GLY 117 117 17703 1 . THR 118 118 17703 1 . THR 119 119 17703 1 . LYS 120 120 17703 1 . GLU 121 121 17703 1 . GLU 122 122 17703 1 . ALA 123 123 17703 1 . LEU 124 124 17703 1 . SER 125 125 17703 1 . ASN 126 126 17703 1 . ILE 127 127 17703 1 . ASP 128 128 17703 1 . GLN 129 129 17703 1 . ILE 130 130 17703 1 . SER 131 131 17703 1 . ASP 132 132 17703 1 . LYS 133 133 17703 1 . ALA 134 134 17703 1 . GLU 135 135 17703 1 . GLU 136 136 17703 1 . LEU 137 137 17703 1 . LYS 138 138 17703 1 . ARG 139 139 17703 1 . SER 140 140 17703 1 . THR 141 141 17703 1 . SER 142 142 17703 1 . ASP 143 143 17703 1 . ALA 144 144 17703 1 . VAL 145 145 17703 1 . GLN 146 146 17703 1 . ASP 147 147 17703 1 . ASN 148 148 17703 1 . ASP 149 149 17703 1 . ASN 150 150 17703 1 . ASP 151 151 17703 1 . ASP 152 152 17703 1 . SER 153 153 17703 1 . ILE 154 154 17703 1 . PRO 155 155 17703 1 . THR 156 156 17703 1 . SER 157 157 17703 1 . ALA 158 158 17703 1 . GLU 159 159 17703 1 . PHE 160 160 17703 1 . PRO 161 161 17703 1 . PRO 162 162 17703 1 . GLY 163 163 17703 1 . ILE 164 164 17703 1 . SER 165 165 17703 1 . PRO 166 166 17703 1 . THR 167 167 17703 1 . GLU 168 168 17703 1 . ASN 169 169 17703 1 . TRP 170 170 17703 1 . VAL 171 171 17703 1 . GLY 172 172 17703 1 . LYS 173 173 17703 1 . LEU 174 174 17703 1 . GLN 175 175 17703 1 . GLU 176 176 17703 1 . LYS 177 177 17703 1 . SER 178 178 17703 1 . GLN 179 179 17703 1 . LYS 180 180 17703 1 . SER 181 181 17703 1 . LYS 182 182 17703 1 . LEU 183 183 17703 1 . GLN 184 184 17703 1 . ALA 185 185 17703 1 . PRO 186 186 17703 1 . ILE 187 187 17703 1 . TYR 188 188 17703 1 . GLU 189 189 17703 1 . ASP 190 190 17703 1 . SER 191 191 17703 1 . LYS 192 192 17703 1 . ASN 193 193 17703 1 . GLU 194 194 17703 1 . ARG 195 195 17703 1 . THR 196 196 17703 1 . GLU 197 197 17703 1 . ARG 198 198 17703 1 . PHE 199 199 17703 1 . LEU 200 200 17703 1 . VAL 201 201 17703 1 . ILE 202 202 17703 1 . CYS 203 203 17703 1 . THR 204 204 17703 1 . MET 205 205 17703 1 . CYS 206 206 17703 1 . ASN 207 207 17703 1 . GLN 208 208 17703 1 . LYS 209 209 17703 1 . THR 210 210 17703 1 . ARG 211 211 17703 1 . GLY 212 212 17703 1 . ILE 213 213 17703 1 . ARG 214 214 17703 1 . SER 215 215 17703 1 . LYS 216 216 17703 1 . LYS 217 217 17703 1 . LYS 218 218 17703 1 . ASP 219 219 17703 1 . ALA 220 220 17703 1 . LYS 221 221 17703 1 . ASN 222 222 17703 1 . LEU 223 223 17703 1 . ALA 224 224 17703 1 . ALA 225 225 17703 1 . TRP 226 226 17703 1 . LEU 227 227 17703 1 . MET 228 228 17703 1 . TRP 229 229 17703 1 . LYS 230 230 17703 1 . ALA 231 231 17703 1 . LEU 232 232 17703 1 . GLU 233 233 17703 1 . ASP 234 234 17703 1 . GLY 235 235 17703 1 . ILE 236 236 17703 1 . GLU 237 237 17703 1 . SER 238 238 17703 1 . LEU 239 239 17703 1 . GLU 240 240 17703 1 . SER 241 241 17703 1 . TYR 242 242 17703 1 . ASP 243 243 17703 1 . LEU 244 244 17703 1 . GLU 245 245 17703 1 . HIS 246 246 17703 1 . HIS 247 247 17703 1 . HIS 248 248 17703 1 . HIS 249 249 17703 1 . HIS 250 250 17703 1 . HIS 251 251 17703 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 17703 _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 $RDE-4DC . 6239 organism . 'Caenorhabditis elegans' nematode . . Eukaryota Metazoa Caenorhabditis elegans . . . . . . . . . . . . . . . . rde-4 . . . . 17703 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 17703 _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 $RDE-4DC . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET28a . . . . . . 17703 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_U-15N _Sample.Sf_category sample _Sample.Sf_framecode U-15N _Sample.Entry_ID 17703 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% 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 RDE-4DC '[U-100% 15N]' . . 1 $RDE-4DC . . 200 . . uM . . . . 17703 1 2 RDE-4DC [U-15N]-Lys . . 1 $RDE-4DC . . 200 . . uM . . . . 17703 1 3 RDE-4DC [U-15N]-(-R)Arg . . 1 $RDE-4DC . . 200 . . uM . . . . 17703 1 4 H20 'natural abundance' . . . . . . 90 . . % . . . . 17703 1 5 D20 'natural abundance' . . . . . . 10 . . % . . . . 17703 1 6 'Potassium phosphate buffer' 'natural abundance' . . . . . . 50 . . mM . . . . 17703 1 7 Na2SO4 'natural abundance' . . . . . . 100 . . mM . . . . 17703 1 stop_ save_ save_13C_15N_2H _Sample.Sf_category sample _Sample.Sf_framecode 13C_15N_2H _Sample.Entry_ID 17703 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% 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 RDE-4DC '[U-100% 13C; U-100% 15N; U-80% 2H]' . . 1 $RDE-4DC . . 500 . . uM . . . . 17703 2 2 H20 'natural abundance' . . . . . . 90 . . % . . . . 17703 2 3 D20 'natural abundance' . . . . . . 10 . . % . . . . 17703 2 4 'Potassium phosphate buffer' 'natural abundance' . . . . . . 50 . . mM . . . . 17703 2 5 Na2SO4 'natural abundance' . . . . . . 100 . . mM . . . . 17703 2 stop_ save_ save_U-13C_ILV _Sample.Sf_category sample _Sample.Sf_framecode U-13C_ILV _Sample.Entry_ID 17703 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% 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 RDE-4DC '[U-13C Ile, Leu, Val (rest 12C); U-15N; U-2H]' . . 1 $RDE-4DC . . 500 . . uM . . . . 17703 3 2 H20 'natural abundance' . . . . . . 90 . . % . . . . 17703 3 3 D20 'natural abundance' . . . . . . 10 . . % . . . . 17703 3 4 'Potassium phosphate buffer' 'natural abundance' . . . . . . 50 . . mM . . . . 17703 3 5 Na2SO4 'natural abundance' . . . . . . 100 . . mM . . . . 17703 3 stop_ save_ save_U-13C_Me_only_ILV _Sample.Sf_category sample _Sample.Sf_framecode U-13C_Me_only_ILV _Sample.Entry_ID 17703 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% 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 RDE-4DC '[U-13C,1H Me only Ile, Leu, Val (rest 12C,2H); 15N,1H, Phe; U-15N; U-2H]' . . 1 $RDE-4DC . . 500 . . uM . . . . 17703 4 2 RDE-4DC '[U-13C,1H Me only Ile, Leu, Val (rest 12C,2H); 15N,1H, Tyr; U-15N; U-2H]' . . 1 $RDE-4DC . . 500 . . uM . . . . 17703 4 3 H20 'natural abundance' . . . . . . 90 . . % . . . . 17703 4 4 D20 'natural abundance' . . . . . . 10 . . % . . . . 17703 4 5 'Potassium phosphate buffer' 'natural abundance' . . . . . . 50 . . mM . . . . 17703 4 6 Na2SO4 'natural abundance' . . . . . . 100 . . mM . . . . 17703 4 stop_ save_ save_10%13C _Sample.Sf_category sample _Sample.Sf_framecode 10%13C _Sample.Entry_ID 17703 _Sample.ID 5 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% 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 RDE-4DC '[U-10% 13C]' . . 1 $RDE-4DC . . 200 . . uM . . . . 17703 5 2 H20 'natural abundance' . . . . . . 90 . . % . . . . 17703 5 3 D20 'natural abundance' . . . . . . 10 . . % . . . . 17703 5 4 'Potassium phosphate buffer' 'natural abundance' . . . . . . 50 . . mM . . . . 17703 5 5 Na2SO4 'natural abundance' . . . . . . 100 . . mM . . . . 17703 5 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 17703 _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 'ionic strength' 150 . mM 17703 1 pH 7.0 . pH 17703 1 pressure 1 . atm 17703 1 temperature 298 . K 17703 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 17703 _Software.ID 1 _Software.Name TOPSPIN _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 17703 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17703 1 processing 17703 1 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 17703 _Software.ID 2 _Software.Name CARA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 17703 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17703 2 'data analysis' 17703 2 'peak picking' 17703 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 17703 _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' . . 17703 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17703 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 17703 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17703 _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 Avance . 600 . . . 17703 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 17703 _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 $U-15N isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17703 1 2 '3D HNCO' no . . . . . . . . . . 2 $13C_15N_2H isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17703 1 3 '3D HNCA' no . . . . . . . . . . 2 $13C_15N_2H isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17703 1 4 '3D HN(CA)CB' no . . . . . . . . . . 2 $13C_15N_2H isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17703 1 5 '3D HN(CO)CA' no . . . . . . . . . . 2 $13C_15N_2H isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17703 1 6 '3D HN(COCA)CB' no . . . . . . . . . . 2 $13C_15N_2H isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17703 1 7 '3D HN(CA)CO' no . . . . . . . . . . 2 $13C_15N_2H isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17703 1 8 '3D H(CCO)NH' no . . . . . . . . . . 3 $U-13C_ILV isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17703 1 9 '3D (H)C(CO)NH' no . . . . . . . . . . 3 $U-13C_ILV isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17703 1 10 '2D 1H-13C HSQC' no . . . . . . . . . . 5 $10%13C isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17703 1 11 '3D 1H-13C NOESY-HSQC' no . . . . . . . . . . 4 $U-13C_Me_only_ILV isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17703 1 12 '3D 1H-15N HMQC-NOESY-HSQC' no . . . . . . . . . . 2 $13C_15N_2H isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17703 1 13 '2D 1H-13C HSQC' no . . . . . . . . . . 4 $U-13C_Me_only_ILV isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17703 1 14 '3D 1H-15N NOESY-HSQC' no . . . . . . . . . . 1 $U-15N isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17703 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 17703 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details '1H with DSS and heteronuclei with indirect referencing.' 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 . . . . . . . . . 17703 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17703 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 17703 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 17703 _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' . . . 17703 1 2 '3D HNCO' . . . 17703 1 3 '3D HNCA' . . . 17703 1 4 '3D HN(CA)CB' . . . 17703 1 5 '3D HN(CO)CA' . . . 17703 1 6 '3D HN(COCA)CB' . . . 17703 1 7 '3D HN(CA)CO' . . . 17703 1 8 '3D H(CCO)NH' . . . 17703 1 9 '3D (H)C(CO)NH' . . . 17703 1 10 '2D 1H-13C HSQC' . . . 17703 1 11 '3D 1H-13C NOESY-HSQC' . . . 17703 1 12 '3D 1H-15N HMQC-NOESY-HSQC' . . . 17703 1 13 '2D 1H-13C HSQC' . . . 17703 1 14 '3D 1H-15N NOESY-HSQC' . . . 17703 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 2 2 ASP C C 13 175.988 0.300 . 1 . . . . 2 ASP C . 17703 1 2 . 1 1 2 2 ASP CA C 13 53.203 0.300 . 1 . . . . 2 ASP CA . 17703 1 3 . 1 1 2 2 ASP CB C 13 40.154 0.300 . 1 . . . . 2 ASP CB . 17703 1 4 . 1 1 3 3 LEU H H 1 8.559 0.020 . 1 . . . . 3 LEU H . 17703 1 5 . 1 1 3 3 LEU C C 13 177.901 0.300 . 1 . . . . 3 LEU C . 17703 1 6 . 1 1 3 3 LEU CA C 13 55.018 0.300 . 1 . . . . 3 LEU CA . 17703 1 7 . 1 1 3 3 LEU CB C 13 40.437 0.300 . 1 . . . . 3 LEU CB . 17703 1 8 . 1 1 3 3 LEU N N 15 125.503 0.300 . 1 . . . . 3 LEU N . 17703 1 9 . 1 1 4 4 THR H H 1 8.241 0.020 . 1 . . . . 4 THR H . 17703 1 10 . 1 1 4 4 THR C C 13 174.724 0.300 . 1 . . . . 4 THR C . 17703 1 11 . 1 1 4 4 THR CA C 13 62.489 0.300 . 1 . . . . 4 THR CA . 17703 1 12 . 1 1 4 4 THR CB C 13 68.703 0.300 . 1 . . . . 4 THR CB . 17703 1 13 . 1 1 4 4 THR N N 15 114.697 0.300 . 1 . . . . 4 THR N . 17703 1 14 . 1 1 5 5 LYS H H 1 7.896 0.020 . 1 . . . . 5 LYS H . 17703 1 15 . 1 1 5 5 LYS C C 13 176.227 0.300 . 1 . . . . 5 LYS C . 17703 1 16 . 1 1 5 5 LYS CA C 13 55.621 0.300 . 1 . . . . 5 LYS CA . 17703 1 17 . 1 1 5 5 LYS CB C 13 31.512 0.300 . 1 . . . . 5 LYS CB . 17703 1 18 . 1 1 5 5 LYS N N 15 123.285 0.300 . 1 . . . . 5 LYS N . 17703 1 19 . 1 1 6 6 LEU H H 1 7.952 0.020 . 1 . . . . 6 LEU H . 17703 1 20 . 1 1 6 6 LEU C C 13 177.127 0.300 . 1 . . . . 6 LEU C . 17703 1 21 . 1 1 6 6 LEU CA C 13 54.624 0.300 . 1 . . . . 6 LEU CA . 17703 1 22 . 1 1 6 6 LEU CB C 13 41.051 0.300 . 1 . . . . 6 LEU CB . 17703 1 23 . 1 1 6 6 LEU N N 15 123.293 0.300 . 1 . . . . 6 LEU N . 17703 1 24 . 1 1 7 7 THR H H 1 7.881 0.020 . 1 . . . . 7 THR H . 17703 1 25 . 1 1 7 7 THR C C 13 174.072 0.300 . 1 . . . . 7 THR C . 17703 1 26 . 1 1 7 7 THR CA C 13 60.977 0.300 . 1 . . . . 7 THR CA . 17703 1 27 . 1 1 7 7 THR CB C 13 69.199 0.300 . 1 . . . . 7 THR CB . 17703 1 28 . 1 1 7 7 THR N N 15 114.868 0.300 . 1 . . . . 7 THR N . 17703 1 29 . 1 1 8 8 PHE H H 1 8.187 0.020 . 1 . . . . 8 PHE H . 17703 1 30 . 1 1 8 8 PHE C C 13 175.547 0.300 . 1 . . . . 8 PHE C . 17703 1 31 . 1 1 8 8 PHE CA C 13 57.470 0.300 . 1 . . . . 8 PHE CA . 17703 1 32 . 1 1 8 8 PHE CB C 13 38.737 0.300 . 1 . . . . 8 PHE CB . 17703 1 33 . 1 1 8 8 PHE N N 15 122.698 0.300 . 1 . . . . 8 PHE N . 17703 1 34 . 1 1 9 9 GLU H H 1 8.322 0.020 . 1 . . . . 9 GLU H . 17703 1 35 . 1 1 9 9 GLU C C 13 176.236 0.300 . 1 . . . . 9 GLU C . 17703 1 36 . 1 1 9 9 GLU CA C 13 56.131 0.300 . 1 . . . . 9 GLU CA . 17703 1 37 . 1 1 9 9 GLU CB C 13 29.101 0.300 . 1 . . . . 9 GLU CB . 17703 1 38 . 1 1 9 9 GLU N N 15 122.332 0.300 . 1 . . . . 9 GLU N . 17703 1 39 . 1 1 10 10 SER H H 1 8.170 0.020 . 1 . . . . 10 SER H . 17703 1 40 . 1 1 10 10 SER C C 13 174.398 0.300 . 1 . . . . 10 SER C . 17703 1 41 . 1 1 10 10 SER CA C 13 57.924 0.300 . 1 . . . . 10 SER CA . 17703 1 42 . 1 1 10 10 SER CB C 13 63.319 0.300 . 1 . . . . 10 SER CB . 17703 1 43 . 1 1 10 10 SER N N 15 117.453 0.300 . 1 . . . . 10 SER N . 17703 1 44 . 1 1 11 11 VAL H H 1 7.963 0.020 . 1 . . . . 11 VAL H . 17703 1 45 . 1 1 11 11 VAL HG11 H 1 0.640 0.020 . 1 . . . . 11 VAL HG1 . 17703 1 46 . 1 1 11 11 VAL HG12 H 1 0.640 0.020 . 1 . . . . 11 VAL HG1 . 17703 1 47 . 1 1 11 11 VAL HG13 H 1 0.640 0.020 . 1 . . . . 11 VAL HG1 . 17703 1 48 . 1 1 11 11 VAL HG21 H 1 0.704 0.020 . 1 . . . . 11 VAL HG2 . 17703 1 49 . 1 1 11 11 VAL HG22 H 1 0.704 0.020 . 1 . . . . 11 VAL HG2 . 17703 1 50 . 1 1 11 11 VAL HG23 H 1 0.704 0.020 . 1 . . . . 11 VAL HG2 . 17703 1 51 . 1 1 11 11 VAL C C 13 175.859 0.300 . 1 . . . . 11 VAL C . 17703 1 52 . 1 1 11 11 VAL CA C 13 61.854 0.300 . 1 . . . . 11 VAL CA . 17703 1 53 . 1 1 11 11 VAL CB C 13 31.370 0.300 . 1 . . . . 11 VAL CB . 17703 1 54 . 1 1 11 11 VAL CG1 C 13 20.615 0.300 . 1 . . . . 11 VAL CG1 . 17703 1 55 . 1 1 11 11 VAL CG2 C 13 20.003 0.300 . 1 . . . . 11 VAL CG2 . 17703 1 56 . 1 1 11 11 VAL N N 15 122.156 0.300 . 1 . . . . 11 VAL N . 17703 1 57 . 1 1 12 12 PHE H H 1 8.235 0.020 . 1 . . . . 12 PHE H . 17703 1 58 . 1 1 12 12 PHE HD1 H 1 7.194 0.020 . 1 . . . . 12 PHE HD1 . 17703 1 59 . 1 1 12 12 PHE HE1 H 1 7.249 0.020 . 1 . . . . 12 PHE HE1 . 17703 1 60 . 1 1 12 12 PHE HZ H 1 7.161 0.020 . 1 . . . . 12 PHE HZ . 17703 1 61 . 1 1 12 12 PHE C C 13 176.162 0.300 . 1 . . . . 12 PHE C . 17703 1 62 . 1 1 12 12 PHE CA C 13 57.253 0.300 . 1 . . . . 12 PHE CA . 17703 1 63 . 1 1 12 12 PHE CB C 13 38.495 0.300 . 1 . . . . 12 PHE CB . 17703 1 64 . 1 1 12 12 PHE N N 15 123.643 0.300 . 1 . . . . 12 PHE N . 17703 1 65 . 1 1 13 13 GLY H H 1 8.196 0.020 . 1 . . . . 13 GLY H . 17703 1 66 . 1 1 13 13 GLY C C 13 174.313 0.300 . 1 . . . . 13 GLY C . 17703 1 67 . 1 1 13 13 GLY CA C 13 44.714 0.300 . 1 . . . . 13 GLY CA . 17703 1 68 . 1 1 13 13 GLY N N 15 111.925 0.300 . 1 . . . . 13 GLY N . 17703 1 69 . 1 1 14 14 GLY H H 1 7.887 0.020 . 1 . . . . 14 GLY H . 17703 1 70 . 1 1 14 14 GLY C C 13 173.930 0.300 . 1 . . . . 14 GLY C . 17703 1 71 . 1 1 14 14 GLY CA C 13 44.550 0.300 . 1 . . . . 14 GLY CA . 17703 1 72 . 1 1 14 14 GLY N N 15 109.260 0.300 . 1 . . . . 14 GLY N . 17703 1 73 . 1 1 15 15 SER H H 1 8.175 0.020 . 1 . . . . 15 SER H . 17703 1 74 . 1 1 15 15 SER C C 13 173.948 0.300 . 1 . . . . 15 SER C . 17703 1 75 . 1 1 15 15 SER CA C 13 57.726 0.300 . 1 . . . . 15 SER CA . 17703 1 76 . 1 1 15 15 SER CB C 13 63.293 0.300 . 1 . . . . 15 SER CB . 17703 1 77 . 1 1 15 15 SER N N 15 116.147 0.300 . 1 . . . . 15 SER N . 17703 1 78 . 1 1 16 16 ASP H H 1 8.383 0.020 . 1 . . . . 16 ASP H . 17703 1 79 . 1 1 16 16 ASP C C 13 175.476 0.300 . 1 . . . . 16 ASP C . 17703 1 80 . 1 1 16 16 ASP CA C 13 53.682 0.300 . 1 . . . . 16 ASP CA . 17703 1 81 . 1 1 16 16 ASP CB C 13 40.154 0.300 . 1 . . . . 16 ASP CB . 17703 1 82 . 1 1 16 16 ASP N N 15 123.055 0.300 . 1 . . . . 16 ASP N . 17703 1 83 . 1 1 17 17 VAL H H 1 7.890 0.020 . 1 . . . . 17 VAL H . 17703 1 84 . 1 1 17 17 VAL HG11 H 1 0.840 0.020 . 1 . . . . 17 VAL HG1 . 17703 1 85 . 1 1 17 17 VAL HG12 H 1 0.840 0.020 . 1 . . . . 17 VAL HG1 . 17703 1 86 . 1 1 17 17 VAL HG13 H 1 0.840 0.020 . 1 . . . . 17 VAL HG1 . 17703 1 87 . 1 1 17 17 VAL HG21 H 1 0.808 0.020 . 1 . . . . 17 VAL HG2 . 17703 1 88 . 1 1 17 17 VAL HG22 H 1 0.808 0.020 . 1 . . . . 17 VAL HG2 . 17703 1 89 . 1 1 17 17 VAL HG23 H 1 0.808 0.020 . 1 . . . . 17 VAL HG2 . 17703 1 90 . 1 1 17 17 VAL C C 13 174.157 0.300 . 1 . . . . 17 VAL C . 17703 1 91 . 1 1 17 17 VAL CA C 13 59.166 0.300 . 1 . . . . 17 VAL CA . 17703 1 92 . 1 1 17 17 VAL CB C 13 31.370 0.300 . 1 . . . . 17 VAL CB . 17703 1 93 . 1 1 17 17 VAL CG1 C 13 20.725 0.300 . 1 . . . . 17 VAL CG1 . 17703 1 94 . 1 1 17 17 VAL CG2 C 13 19.906 0.300 . 1 . . . . 17 VAL CG2 . 17703 1 95 . 1 1 17 17 VAL N N 15 121.964 0.300 . 1 . . . . 17 VAL N . 17703 1 96 . 1 1 18 18 PRO C C 13 176.578 0.300 . 1 . . . . 18 PRO C . 17703 1 97 . 1 1 18 18 PRO CA C 13 62.459 0.300 . 1 . . . . 18 PRO CA . 17703 1 98 . 1 1 18 18 PRO CB C 13 30.874 0.300 . 1 . . . . 18 PRO CB . 17703 1 99 . 1 1 19 19 MET H H 1 8.294 0.020 . 1 . . . . 19 MET H . 17703 1 100 . 1 1 19 19 MET C C 13 175.703 0.300 . 1 . . . . 19 MET C . 17703 1 101 . 1 1 19 19 MET CA C 13 54.622 0.300 . 1 . . . . 19 MET CA . 17703 1 102 . 1 1 19 19 MET CB C 13 32.007 0.300 . 1 . . . . 19 MET CB . 17703 1 103 . 1 1 19 19 MET N N 15 121.632 0.300 . 1 . . . . 19 MET N . 17703 1 104 . 1 1 20 20 LYS H H 1 8.255 0.020 . 1 . . . . 20 LYS H . 17703 1 105 . 1 1 20 20 LYS C C 13 174.200 0.300 . 1 . . . . 20 LYS C . 17703 1 106 . 1 1 20 20 LYS CA C 13 53.501 0.300 . 1 . . . . 20 LYS CA . 17703 1 107 . 1 1 20 20 LYS CB C 13 31.299 0.300 . 1 . . . . 20 LYS CB . 17703 1 108 . 1 1 20 20 LYS N N 15 124.923 0.300 . 1 . . . . 20 LYS N . 17703 1 109 . 1 1 21 21 PRO C C 13 176.750 0.300 . 1 . . . . 21 PRO C . 17703 1 110 . 1 1 21 21 PRO CA C 13 62.429 0.300 . 1 . . . . 21 PRO CA . 17703 1 111 . 1 1 21 21 PRO CB C 13 30.874 0.300 . 1 . . . . 21 PRO CB . 17703 1 112 . 1 1 22 22 SER H H 1 8.387 0.020 . 1 . . . . 22 SER H . 17703 1 113 . 1 1 22 22 SER C C 13 174.469 0.300 . 1 . . . . 22 SER C . 17703 1 114 . 1 1 22 22 SER CA C 13 57.651 0.300 . 1 . . . . 22 SER CA . 17703 1 115 . 1 1 22 22 SER CB C 13 63.319 0.300 . 1 . . . . 22 SER CB . 17703 1 116 . 1 1 22 22 SER N N 15 117.436 0.300 . 1 . . . . 22 SER N . 17703 1 117 . 1 1 23 23 ARG H H 1 8.391 0.020 . 1 . . . . 23 ARG H . 17703 1 118 . 1 1 23 23 ARG C C 13 176.327 0.300 . 1 . . . . 23 ARG C . 17703 1 119 . 1 1 23 23 ARG CA C 13 55.409 0.300 . 1 . . . . 23 ARG CA . 17703 1 120 . 1 1 23 23 ARG CB C 13 29.457 0.300 . 1 . . . . 23 ARG CB . 17703 1 121 . 1 1 23 23 ARG N N 15 123.817 0.300 . 1 . . . . 23 ARG N . 17703 1 122 . 1 1 24 24 SER H H 1 8.361 0.020 . 1 . . . . 24 SER H . 17703 1 123 . 1 1 24 24 SER C C 13 174.666 0.300 . 1 . . . . 24 SER C . 17703 1 124 . 1 1 24 24 SER CA C 13 58.140 0.300 . 1 . . . . 24 SER CA . 17703 1 125 . 1 1 24 24 SER CB C 13 63.086 0.300 . 1 . . . . 24 SER CB . 17703 1 126 . 1 1 24 24 SER N N 15 118.159 0.300 . 1 . . . . 24 SER N . 17703 1 127 . 1 1 25 25 GLU H H 1 8.476 0.020 . 1 . . . . 25 GLU H . 17703 1 128 . 1 1 25 25 GLU C C 13 176.063 0.300 . 1 . . . . 25 GLU C . 17703 1 129 . 1 1 25 25 GLU CA C 13 56.042 0.300 . 1 . . . . 25 GLU CA . 17703 1 130 . 1 1 25 25 GLU CB C 13 28.963 0.300 . 1 . . . . 25 GLU CB . 17703 1 131 . 1 1 25 25 GLU N N 15 123.248 0.300 . 1 . . . . 25 GLU N . 17703 1 132 . 1 1 26 26 ASP H H 1 8.165 0.020 . 1 . . . . 26 ASP H . 17703 1 133 . 1 1 26 26 ASP C C 13 175.800 0.300 . 1 . . . . 26 ASP C . 17703 1 134 . 1 1 26 26 ASP CA C 13 53.886 0.300 . 1 . . . . 26 ASP CA . 17703 1 135 . 1 1 26 26 ASP CB C 13 40.222 0.300 . 1 . . . . 26 ASP CB . 17703 1 136 . 1 1 26 26 ASP N N 15 121.489 0.300 . 1 . . . . 26 ASP N . 17703 1 137 . 1 1 27 27 ASN H H 1 8.227 0.020 . 1 . . . . 27 ASN H . 17703 1 138 . 1 1 27 27 ASN C C 13 174.970 0.300 . 1 . . . . 27 ASN C . 17703 1 139 . 1 1 27 27 ASN CA C 13 52.704 0.300 . 1 . . . . 27 ASN CA . 17703 1 140 . 1 1 27 27 ASN CB C 13 37.943 0.300 . 1 . . . . 27 ASN CB . 17703 1 141 . 1 1 27 27 ASN N N 15 119.643 0.300 . 1 . . . . 27 ASN N . 17703 1 142 . 1 1 28 28 LYS H H 1 8.174 0.020 . 1 . . . . 28 LYS H . 17703 1 143 . 1 1 28 28 LYS C C 13 176.464 0.300 . 1 . . . . 28 LYS C . 17703 1 144 . 1 1 28 28 LYS CA C 13 55.658 0.300 . 1 . . . . 28 LYS CA . 17703 1 145 . 1 1 28 28 LYS CB C 13 31.588 0.300 . 1 . . . . 28 LYS CB . 17703 1 146 . 1 1 28 28 LYS N N 15 121.919 0.300 . 1 . . . . 28 LYS N . 17703 1 147 . 1 1 29 29 THR H H 1 8.120 0.020 . 1 . . . . 29 THR H . 17703 1 148 . 1 1 29 29 THR C C 13 172.592 0.300 . 1 . . . . 29 THR C . 17703 1 149 . 1 1 29 29 THR CA C 13 59.500 0.300 . 1 . . . . 29 THR CA . 17703 1 150 . 1 1 29 29 THR CB C 13 68.774 0.300 . 1 . . . . 29 THR CB . 17703 1 151 . 1 1 29 29 THR N N 15 118.711 0.300 . 1 . . . . 29 THR N . 17703 1 152 . 1 1 30 30 PRO C C 13 176.725 0.300 . 1 . . . . 30 PRO C . 17703 1 153 . 1 1 30 30 PRO CA C 13 62.610 0.300 . 1 . . . . 30 PRO CA . 17703 1 154 . 1 1 30 30 PRO CB C 13 30.945 0.300 . 1 . . . . 30 PRO CB . 17703 1 155 . 1 1 31 31 ARG H H 1 8.372 0.020 . 1 . . . . 31 ARG H . 17703 1 156 . 1 1 31 31 ARG C C 13 176.007 0.300 . 1 . . . . 31 ARG C . 17703 1 157 . 1 1 31 31 ARG CA C 13 55.500 0.300 . 1 . . . . 31 ARG CA . 17703 1 158 . 1 1 31 31 ARG CB C 13 29.457 0.300 . 1 . . . . 31 ARG CB . 17703 1 159 . 1 1 31 31 ARG N N 15 122.183 0.300 . 1 . . . . 31 ARG N . 17703 1 160 . 1 1 32 32 ASN H H 1 8.400 0.020 . 1 . . . . 32 ASN H . 17703 1 161 . 1 1 32 32 ASN C C 13 175.230 0.300 . 1 . . . . 32 ASN C . 17703 1 162 . 1 1 32 32 ASN CA C 13 52.810 0.300 . 1 . . . . 32 ASN CA . 17703 1 163 . 1 1 32 32 ASN CB C 13 37.958 0.300 . 1 . . . . 32 ASN CB . 17703 1 164 . 1 1 32 32 ASN N N 15 120.309 0.300 . 1 . . . . 32 ASN N . 17703 1 165 . 1 1 33 33 ARG H H 1 8.311 0.020 . 1 . . . . 33 ARG H . 17703 1 166 . 1 1 33 33 ARG C C 13 176.562 0.300 . 1 . . . . 33 ARG C . 17703 1 167 . 1 1 33 33 ARG CA C 13 55.747 0.300 . 1 . . . . 33 ARG CA . 17703 1 168 . 1 1 33 33 ARG CB C 13 29.386 0.300 . 1 . . . . 33 ARG CB . 17703 1 169 . 1 1 33 33 ARG N N 15 122.389 0.300 . 1 . . . . 33 ARG N . 17703 1 170 . 1 1 34 34 THR H H 1 8.249 0.020 . 1 . . . . 34 THR H . 17703 1 171 . 1 1 34 34 THR C C 13 174.473 0.300 . 1 . . . . 34 THR C . 17703 1 172 . 1 1 34 34 THR CA C 13 61.980 0.300 . 1 . . . . 34 THR CA . 17703 1 173 . 1 1 34 34 THR CB C 13 69.026 0.300 . 1 . . . . 34 THR CB . 17703 1 174 . 1 1 34 34 THR N N 15 115.570 0.300 . 1 . . . . 34 THR N . 17703 1 175 . 1 1 35 35 ASP H H 1 8.338 0.020 . 1 . . . . 35 ASP H . 17703 1 176 . 1 1 35 35 ASP C C 13 177.955 0.300 . 1 . . . . 35 ASP C . 17703 1 177 . 1 1 35 35 ASP CA C 13 55.197 0.300 . 1 . . . . 35 ASP CA . 17703 1 178 . 1 1 35 35 ASP CB C 13 40.012 0.300 . 1 . . . . 35 ASP CB . 17703 1 179 . 1 1 35 35 ASP N N 15 123.219 0.300 . 1 . . . . 35 ASP N . 17703 1 180 . 1 1 36 36 LEU H H 1 8.356 0.020 . 1 . . . . 36 LEU H . 17703 1 181 . 1 1 36 36 LEU HD11 H 1 0.790 0.020 . 1 . . . . 36 LEU HD1 . 17703 1 182 . 1 1 36 36 LEU HD12 H 1 0.790 0.020 . 1 . . . . 36 LEU HD1 . 17703 1 183 . 1 1 36 36 LEU HD13 H 1 0.790 0.020 . 1 . . . . 36 LEU HD1 . 17703 1 184 . 1 1 36 36 LEU HD21 H 1 0.830 0.020 . 1 . . . . 36 LEU HD2 . 17703 1 185 . 1 1 36 36 LEU HD22 H 1 0.830 0.020 . 1 . . . . 36 LEU HD2 . 17703 1 186 . 1 1 36 36 LEU HD23 H 1 0.830 0.020 . 1 . . . . 36 LEU HD2 . 17703 1 187 . 1 1 36 36 LEU C C 13 177.044 0.300 . 1 . . . . 36 LEU C . 17703 1 188 . 1 1 36 36 LEU CA C 13 57.559 0.300 . 1 . . . . 36 LEU CA . 17703 1 189 . 1 1 36 36 LEU CB C 13 40.367 0.300 . 1 . . . . 36 LEU CB . 17703 1 190 . 1 1 36 36 LEU CD1 C 13 22.206 0.300 . 1 . . . . 36 LEU CD1 . 17703 1 191 . 1 1 36 36 LEU CD2 C 13 24.896 0.300 . 1 . . . . 36 LEU CD2 . 17703 1 192 . 1 1 36 36 LEU N N 15 125.589 0.300 . 1 . . . . 36 LEU N . 17703 1 193 . 1 1 37 37 GLU H H 1 8.010 0.020 . 1 . . . . 37 GLU H . 17703 1 194 . 1 1 37 37 GLU C C 13 179.333 0.300 . 1 . . . . 37 GLU C . 17703 1 195 . 1 1 37 37 GLU CA C 13 58.985 0.300 . 1 . . . . 37 GLU CA . 17703 1 196 . 1 1 37 37 GLU CB C 13 28.253 0.300 . 1 . . . . 37 GLU CB . 17703 1 197 . 1 1 37 37 GLU N N 15 118.091 0.300 . 1 . . . . 37 GLU N . 17703 1 198 . 1 1 38 38 MET H H 1 7.829 0.020 . 1 . . . . 38 MET H . 17703 1 199 . 1 1 38 38 MET C C 13 178.737 0.300 . 1 . . . . 38 MET C . 17703 1 200 . 1 1 38 38 MET CA C 13 57.046 0.300 . 1 . . . . 38 MET CA . 17703 1 201 . 1 1 38 38 MET CB C 13 31.243 0.300 . 1 . . . . 38 MET CB . 17703 1 202 . 1 1 38 38 MET N N 15 116.022 0.300 . 1 . . . . 38 MET N . 17703 1 203 . 1 1 39 39 PHE H H 1 8.026 0.020 . 1 . . . . 39 PHE H . 17703 1 204 . 1 1 39 39 PHE HD1 H 1 7.225 0.020 . 1 . . . . 39 PHE HD1 . 17703 1 205 . 1 1 39 39 PHE HE1 H 1 7.273 0.020 . 1 . . . . 39 PHE HE1 . 17703 1 206 . 1 1 39 39 PHE HZ H 1 6.897 0.020 . 1 . . . . 39 PHE HZ . 17703 1 207 . 1 1 39 39 PHE C C 13 175.855 0.300 . 1 . . . . 39 PHE C . 17703 1 208 . 1 1 39 39 PHE CA C 13 61.378 0.300 . 1 . . . . 39 PHE CA . 17703 1 209 . 1 1 39 39 PHE CB C 13 38.772 0.300 . 1 . . . . 39 PHE CB . 17703 1 210 . 1 1 39 39 PHE N N 15 123.397 0.300 . 1 . . . . 39 PHE N . 17703 1 211 . 1 1 40 40 LEU H H 1 7.995 0.020 . 1 . . . . 40 LEU H . 17703 1 212 . 1 1 40 40 LEU HD11 H 1 0.813 0.020 . 1 . . . . 40 LEU HD1 . 17703 1 213 . 1 1 40 40 LEU HD12 H 1 0.813 0.020 . 1 . . . . 40 LEU HD1 . 17703 1 214 . 1 1 40 40 LEU HD13 H 1 0.813 0.020 . 1 . . . . 40 LEU HD1 . 17703 1 215 . 1 1 40 40 LEU HD21 H 1 0.855 0.020 . 1 . . . . 40 LEU HD2 . 17703 1 216 . 1 1 40 40 LEU HD22 H 1 0.855 0.020 . 1 . . . . 40 LEU HD2 . 17703 1 217 . 1 1 40 40 LEU HD23 H 1 0.855 0.020 . 1 . . . . 40 LEU HD2 . 17703 1 218 . 1 1 40 40 LEU C C 13 177.461 0.300 . 1 . . . . 40 LEU C . 17703 1 219 . 1 1 40 40 LEU CA C 13 55.451 0.300 . 1 . . . . 40 LEU CA . 17703 1 220 . 1 1 40 40 LEU CB C 13 40.367 0.300 . 1 . . . . 40 LEU CB . 17703 1 221 . 1 1 40 40 LEU CD1 C 13 25.480 0.300 . 1 . . . . 40 LEU CD1 . 17703 1 222 . 1 1 40 40 LEU CD2 C 13 22.102 0.300 . 1 . . . . 40 LEU CD2 . 17703 1 223 . 1 1 40 40 LEU N N 15 113.942 0.300 . 1 . . . . 40 LEU N . 17703 1 224 . 1 1 41 41 LYS H H 1 6.996 0.020 . 1 . . . . 41 LYS H . 17703 1 225 . 1 1 41 41 LYS C C 13 176.539 0.300 . 1 . . . . 41 LYS C . 17703 1 226 . 1 1 41 41 LYS CA C 13 55.381 0.300 . 1 . . . . 41 LYS CA . 17703 1 227 . 1 1 41 41 LYS CB C 13 31.866 0.300 . 1 . . . . 41 LYS CB . 17703 1 228 . 1 1 41 41 LYS N N 15 117.082 0.300 . 1 . . . . 41 LYS N . 17703 1 229 . 1 1 42 42 LYS H H 1 7.691 0.020 . 1 . . . . 42 LYS H . 17703 1 230 . 1 1 42 42 LYS C C 13 174.994 0.300 . 1 . . . . 42 LYS C . 17703 1 231 . 1 1 42 42 LYS CA C 13 55.245 0.300 . 1 . . . . 42 LYS CA . 17703 1 232 . 1 1 42 42 LYS CB C 13 33.920 0.300 . 1 . . . . 42 LYS CB . 17703 1 233 . 1 1 42 42 LYS N N 15 121.665 0.300 . 1 . . . . 42 LYS N . 17703 1 234 . 1 1 43 43 THR H H 1 7.060 0.020 . 1 . . . . 43 THR H . 17703 1 235 . 1 1 43 43 THR C C 13 173.632 0.300 . 1 . . . . 43 THR C . 17703 1 236 . 1 1 43 43 THR CA C 13 58.106 0.300 . 1 . . . . 43 THR CA . 17703 1 237 . 1 1 43 43 THR CB C 13 67.640 0.300 . 1 . . . . 43 THR CB . 17703 1 238 . 1 1 43 43 THR N N 15 108.411 0.300 . 1 . . . . 43 THR N . 17703 1 239 . 1 1 44 44 PRO C C 13 177.229 0.300 . 1 . . . . 44 PRO C . 17703 1 240 . 1 1 44 44 PRO CA C 13 65.454 0.300 . 1 . . . . 44 PRO CA . 17703 1 241 . 1 1 44 44 PRO CB C 13 31.157 0.300 . 1 . . . . 44 PRO CB . 17703 1 242 . 1 1 45 45 LEU H H 1 8.502 0.020 . 1 . . . . 45 LEU H . 17703 1 243 . 1 1 45 45 LEU HD11 H 1 0.991 0.020 . 1 . . . . 45 LEU HD1 . 17703 1 244 . 1 1 45 45 LEU HD12 H 1 0.991 0.020 . 1 . . . . 45 LEU HD1 . 17703 1 245 . 1 1 45 45 LEU HD13 H 1 0.991 0.020 . 1 . . . . 45 LEU HD1 . 17703 1 246 . 1 1 45 45 LEU HD21 H 1 0.790 0.020 . 1 . . . . 45 LEU HD2 . 17703 1 247 . 1 1 45 45 LEU HD22 H 1 0.790 0.020 . 1 . . . . 45 LEU HD2 . 17703 1 248 . 1 1 45 45 LEU HD23 H 1 0.790 0.020 . 1 . . . . 45 LEU HD2 . 17703 1 249 . 1 1 45 45 LEU C C 13 177.815 0.300 . 1 . . . . 45 LEU C . 17703 1 250 . 1 1 45 45 LEU CA C 13 57.283 0.300 . 1 . . . . 45 LEU CA . 17703 1 251 . 1 1 45 45 LEU CB C 13 41.362 0.300 . 1 . . . . 45 LEU CB . 17703 1 252 . 1 1 45 45 LEU CD1 C 13 24.177 0.300 . 1 . . . . 45 LEU CD1 . 17703 1 253 . 1 1 45 45 LEU CD2 C 13 25.444 0.300 . 1 . . . . 45 LEU CD2 . 17703 1 254 . 1 1 45 45 LEU N N 15 116.774 0.300 . 1 . . . . 45 LEU N . 17703 1 255 . 1 1 46 46 MET H H 1 7.600 0.020 . 1 . . . . 46 MET H . 17703 1 256 . 1 1 46 46 MET C C 13 178.368 0.300 . 1 . . . . 46 MET C . 17703 1 257 . 1 1 46 46 MET CA C 13 58.583 0.300 . 1 . . . . 46 MET CA . 17703 1 258 . 1 1 46 46 MET CB C 13 33.070 0.300 . 1 . . . . 46 MET CB . 17703 1 259 . 1 1 46 46 MET N N 15 119.277 0.300 . 1 . . . . 46 MET N . 17703 1 260 . 1 1 47 47 VAL H H 1 7.846 0.020 . 1 . . . . 47 VAL H . 17703 1 261 . 1 1 47 47 VAL HG11 H 1 1.205 0.020 . 1 . . . . 47 VAL HG1 . 17703 1 262 . 1 1 47 47 VAL HG12 H 1 1.205 0.020 . 1 . . . . 47 VAL HG1 . 17703 1 263 . 1 1 47 47 VAL HG13 H 1 1.205 0.020 . 1 . . . . 47 VAL HG1 . 17703 1 264 . 1 1 47 47 VAL HG21 H 1 0.818 0.020 . 1 . . . . 47 VAL HG2 . 17703 1 265 . 1 1 47 47 VAL HG22 H 1 0.818 0.020 . 1 . . . . 47 VAL HG2 . 17703 1 266 . 1 1 47 47 VAL HG23 H 1 0.818 0.020 . 1 . . . . 47 VAL HG2 . 17703 1 267 . 1 1 47 47 VAL C C 13 179.120 0.300 . 1 . . . . 47 VAL C . 17703 1 268 . 1 1 47 47 VAL CA C 13 65.771 0.300 . 1 . . . . 47 VAL CA . 17703 1 269 . 1 1 47 47 VAL CB C 13 30.803 0.300 . 1 . . . . 47 VAL CB . 17703 1 270 . 1 1 47 47 VAL CG1 C 13 21.808 0.300 . 1 . . . . 47 VAL CG1 . 17703 1 271 . 1 1 47 47 VAL CG2 C 13 23.452 0.300 . 1 . . . . 47 VAL CG2 . 17703 1 272 . 1 1 47 47 VAL N N 15 118.968 0.300 . 1 . . . . 47 VAL N . 17703 1 273 . 1 1 48 48 LEU H H 1 8.171 0.020 . 1 . . . . 48 LEU H . 17703 1 274 . 1 1 48 48 LEU HD11 H 1 0.502 0.020 . 1 . . . . 48 LEU HD1 . 17703 1 275 . 1 1 48 48 LEU HD12 H 1 0.502 0.020 . 1 . . . . 48 LEU HD1 . 17703 1 276 . 1 1 48 48 LEU HD13 H 1 0.502 0.020 . 1 . . . . 48 LEU HD1 . 17703 1 277 . 1 1 48 48 LEU HD21 H 1 0.648 0.020 . 1 . . . . 48 LEU HD2 . 17703 1 278 . 1 1 48 48 LEU HD22 H 1 0.648 0.020 . 1 . . . . 48 LEU HD2 . 17703 1 279 . 1 1 48 48 LEU HD23 H 1 0.648 0.020 . 1 . . . . 48 LEU HD2 . 17703 1 280 . 1 1 48 48 LEU C C 13 177.667 0.300 . 1 . . . . 48 LEU C . 17703 1 281 . 1 1 48 48 LEU CA C 13 57.682 0.300 . 1 . . . . 48 LEU CA . 17703 1 282 . 1 1 48 48 LEU CB C 13 41.258 0.300 . 1 . . . . 48 LEU CB . 17703 1 283 . 1 1 48 48 LEU CD1 C 13 24.574 0.300 . 1 . . . . 48 LEU CD1 . 17703 1 284 . 1 1 48 48 LEU CD2 C 13 26.597 0.300 . 1 . . . . 48 LEU CD2 . 17703 1 285 . 1 1 48 48 LEU N N 15 120.631 0.300 . 1 . . . . 48 LEU N . 17703 1 286 . 1 1 49 49 GLU H H 1 8.975 0.020 . 1 . . . . 49 GLU H . 17703 1 287 . 1 1 49 49 GLU C C 13 179.957 0.300 . 1 . . . . 49 GLU C . 17703 1 288 . 1 1 49 49 GLU CA C 13 59.924 0.300 . 1 . . . . 49 GLU CA . 17703 1 289 . 1 1 49 49 GLU CB C 13 28.465 0.300 . 1 . . . . 49 GLU CB . 17703 1 290 . 1 1 49 49 GLU N N 15 119.032 0.300 . 1 . . . . 49 GLU N . 17703 1 291 . 1 1 50 50 GLU H H 1 8.681 0.020 . 1 . . . . 50 GLU H . 17703 1 292 . 1 1 50 50 GLU C C 13 179.588 0.300 . 1 . . . . 50 GLU C . 17703 1 293 . 1 1 50 50 GLU CA C 13 58.698 0.300 . 1 . . . . 50 GLU CA . 17703 1 294 . 1 1 50 50 GLU CB C 13 28.272 0.300 . 1 . . . . 50 GLU CB . 17703 1 295 . 1 1 50 50 GLU N N 15 119.768 0.300 . 1 . . . . 50 GLU N . 17703 1 296 . 1 1 51 51 ALA H H 1 7.708 0.020 . 1 . . . . 51 ALA H . 17703 1 297 . 1 1 51 51 ALA C C 13 178.774 0.300 . 1 . . . . 51 ALA C . 17703 1 298 . 1 1 51 51 ALA CA C 13 54.410 0.300 . 1 . . . . 51 ALA CA . 17703 1 299 . 1 1 51 51 ALA CB C 13 17.773 0.300 . 1 . . . . 51 ALA CB . 17703 1 300 . 1 1 51 51 ALA N N 15 122.287 0.300 . 1 . . . . 51 ALA N . 17703 1 301 . 1 1 52 52 ALA H H 1 8.732 0.020 . 1 . . . . 52 ALA H . 17703 1 302 . 1 1 52 52 ALA C C 13 179.561 0.300 . 1 . . . . 52 ALA C . 17703 1 303 . 1 1 52 52 ALA CA C 13 55.411 0.300 . 1 . . . . 52 ALA CA . 17703 1 304 . 1 1 52 52 ALA CB C 13 17.556 0.300 . 1 . . . . 52 ALA CB . 17703 1 305 . 1 1 52 52 ALA N N 15 120.682 0.300 . 1 . . . . 52 ALA N . 17703 1 306 . 1 1 53 53 LYS H H 1 7.549 0.020 . 1 . . . . 53 LYS H . 17703 1 307 . 1 1 53 53 LYS C C 13 178.227 0.300 . 1 . . . . 53 LYS C . 17703 1 308 . 1 1 53 53 LYS CA C 13 58.863 0.300 . 1 . . . . 53 LYS CA . 17703 1 309 . 1 1 53 53 LYS CB C 13 31.653 0.300 . 1 . . . . 53 LYS CB . 17703 1 310 . 1 1 53 53 LYS N N 15 116.775 0.300 . 1 . . . . 53 LYS N . 17703 1 311 . 1 1 54 54 ALA H H 1 7.924 0.020 . 1 . . . . 54 ALA H . 17703 1 312 . 1 1 54 54 ALA C C 13 179.021 0.300 . 1 . . . . 54 ALA C . 17703 1 313 . 1 1 54 54 ALA CA C 13 54.228 0.300 . 1 . . . . 54 ALA CA . 17703 1 314 . 1 1 54 54 ALA CB C 13 18.464 0.300 . 1 . . . . 54 ALA CB . 17703 1 315 . 1 1 54 54 ALA N N 15 120.539 0.300 . 1 . . . . 54 ALA N . 17703 1 316 . 1 1 55 55 VAL H H 1 8.662 0.020 . 1 . . . . 55 VAL H . 17703 1 317 . 1 1 55 55 VAL HG11 H 1 -0.110 0.020 . 1 . . . . 55 VAL HG1 . 17703 1 318 . 1 1 55 55 VAL HG12 H 1 -0.110 0.020 . 1 . . . . 55 VAL HG1 . 17703 1 319 . 1 1 55 55 VAL HG13 H 1 -0.110 0.020 . 1 . . . . 55 VAL HG1 . 17703 1 320 . 1 1 55 55 VAL HG21 H 1 0.544 0.020 . 1 . . . . 55 VAL HG2 . 17703 1 321 . 1 1 55 55 VAL HG22 H 1 0.544 0.020 . 1 . . . . 55 VAL HG2 . 17703 1 322 . 1 1 55 55 VAL HG23 H 1 0.544 0.020 . 1 . . . . 55 VAL HG2 . 17703 1 323 . 1 1 55 55 VAL C C 13 177.234 0.300 . 1 . . . . 55 VAL C . 17703 1 324 . 1 1 55 55 VAL CA C 13 63.832 0.300 . 1 . . . . 55 VAL CA . 17703 1 325 . 1 1 55 55 VAL CB C 13 31.519 0.300 . 1 . . . . 55 VAL CB . 17703 1 326 . 1 1 55 55 VAL CG1 C 13 20.106 0.300 . 1 . . . . 55 VAL CG1 . 17703 1 327 . 1 1 55 55 VAL CG2 C 13 21.919 0.300 . 1 . . . . 55 VAL CG2 . 17703 1 328 . 1 1 55 55 VAL N N 15 116.542 0.300 . 1 . . . . 55 VAL N . 17703 1 329 . 1 1 56 56 TYR H H 1 6.752 0.020 . 1 . . . . 56 TYR H . 17703 1 330 . 1 1 56 56 TYR C C 13 174.818 0.300 . 1 . . . . 56 TYR C . 17703 1 331 . 1 1 56 56 TYR CA C 13 56.456 0.300 . 1 . . . . 56 TYR CA . 17703 1 332 . 1 1 56 56 TYR CB C 13 38.495 0.300 . 1 . . . . 56 TYR CB . 17703 1 333 . 1 1 56 56 TYR N N 15 114.496 0.300 . 1 . . . . 56 TYR N . 17703 1 334 . 1 1 57 57 GLN H H 1 7.643 0.020 . 1 . . . . 57 GLN H . 17703 1 335 . 1 1 57 57 GLN C C 13 174.809 0.300 . 1 . . . . 57 GLN C . 17703 1 336 . 1 1 57 57 GLN CA C 13 56.712 0.300 . 1 . . . . 57 GLN CA . 17703 1 337 . 1 1 57 57 GLN CB C 13 24.853 0.300 . 1 . . . . 57 GLN CB . 17703 1 338 . 1 1 57 57 GLN N N 15 116.964 0.300 . 1 . . . . 57 GLN N . 17703 1 339 . 1 1 58 58 LYS H H 1 7.471 0.020 . 1 . . . . 58 LYS H . 17703 1 340 . 1 1 58 58 LYS C C 13 174.398 0.300 . 1 . . . . 58 LYS C . 17703 1 341 . 1 1 58 58 LYS CA C 13 53.925 0.300 . 1 . . . . 58 LYS CA . 17703 1 342 . 1 1 58 58 LYS CB C 13 35.620 0.300 . 1 . . . . 58 LYS CB . 17703 1 343 . 1 1 58 58 LYS N N 15 116.204 0.300 . 1 . . . . 58 LYS N . 17703 1 344 . 1 1 59 59 THR H H 1 7.893 0.020 . 1 . . . . 59 THR H . 17703 1 345 . 1 1 59 59 THR C C 13 172.661 0.300 . 1 . . . . 59 THR C . 17703 1 346 . 1 1 59 59 THR CA C 13 58.140 0.300 . 1 . . . . 59 THR CA . 17703 1 347 . 1 1 59 59 THR CB C 13 68.774 0.300 . 1 . . . . 59 THR CB . 17703 1 348 . 1 1 59 59 THR N N 15 112.295 0.300 . 1 . . . . 59 THR N . 17703 1 349 . 1 1 60 60 PRO C C 13 174.256 0.300 . 1 . . . . 60 PRO C . 17703 1 350 . 1 1 60 60 PRO CA C 13 62.089 0.300 . 1 . . . . 60 PRO CA . 17703 1 351 . 1 1 60 60 PRO CB C 13 30.759 0.300 . 1 . . . . 60 PRO CB . 17703 1 352 . 1 1 61 61 THR H H 1 8.215 0.020 . 1 . . . . 61 THR H . 17703 1 353 . 1 1 61 61 THR C C 13 172.067 0.300 . 1 . . . . 61 THR C . 17703 1 354 . 1 1 61 61 THR CA C 13 61.655 0.300 . 1 . . . . 61 THR CA . 17703 1 355 . 1 1 61 61 THR CB C 13 69.510 0.300 . 1 . . . . 61 THR CB . 17703 1 356 . 1 1 61 61 THR N N 15 119.282 0.300 . 1 . . . . 61 THR N . 17703 1 357 . 1 1 62 62 TRP H H 1 8.540 0.020 . 1 . . . . 62 TRP H . 17703 1 358 . 1 1 62 62 TRP HE1 H 1 10.464 0.020 . 1 . . . . 62 TRP HE1 . 17703 1 359 . 1 1 62 62 TRP C C 13 177.064 0.300 . 1 . . . . 62 TRP C . 17703 1 360 . 1 1 62 62 TRP CA C 13 54.836 0.300 . 1 . . . . 62 TRP CA . 17703 1 361 . 1 1 62 62 TRP CB C 13 32.149 0.300 . 1 . . . . 62 TRP CB . 17703 1 362 . 1 1 62 62 TRP N N 15 125.233 0.300 . 1 . . . . 62 TRP N . 17703 1 363 . 1 1 62 62 TRP NE1 N 15 130.804 0.300 . 1 . . . . 62 TRP NE1 . 17703 1 364 . 1 1 63 63 GLY H H 1 9.522 0.020 . 1 . . . . 63 GLY H . 17703 1 365 . 1 1 63 63 GLY C C 13 172.583 0.300 . 1 . . . . 63 GLY C . 17703 1 366 . 1 1 63 63 GLY CA C 13 44.017 0.300 . 1 . . . . 63 GLY CA . 17703 1 367 . 1 1 63 63 GLY N N 15 112.774 0.300 . 1 . . . . 63 GLY N . 17703 1 368 . 1 1 64 64 THR H H 1 8.624 0.020 . 1 . . . . 64 THR H . 17703 1 369 . 1 1 64 64 THR C C 13 173.859 0.300 . 1 . . . . 64 THR C . 17703 1 370 . 1 1 64 64 THR CA C 13 62.157 0.300 . 1 . . . . 64 THR CA . 17703 1 371 . 1 1 64 64 THR CB C 13 70.120 0.300 . 1 . . . . 64 THR CB . 17703 1 372 . 1 1 64 64 THR N N 15 120.888 0.300 . 1 . . . . 64 THR N . 17703 1 373 . 1 1 65 65 VAL H H 1 8.734 0.020 . 1 . . . . 65 VAL H . 17703 1 374 . 1 1 65 65 VAL HG11 H 1 0.802 0.020 . 1 . . . . 65 VAL HG1 . 17703 1 375 . 1 1 65 65 VAL HG12 H 1 0.802 0.020 . 1 . . . . 65 VAL HG1 . 17703 1 376 . 1 1 65 65 VAL HG13 H 1 0.802 0.020 . 1 . . . . 65 VAL HG1 . 17703 1 377 . 1 1 65 65 VAL HG21 H 1 0.915 0.020 . 1 . . . . 65 VAL HG2 . 17703 1 378 . 1 1 65 65 VAL HG22 H 1 0.915 0.020 . 1 . . . . 65 VAL HG2 . 17703 1 379 . 1 1 65 65 VAL HG23 H 1 0.915 0.020 . 1 . . . . 65 VAL HG2 . 17703 1 380 . 1 1 65 65 VAL C C 13 174.200 0.300 . 1 . . . . 65 VAL C . 17703 1 381 . 1 1 65 65 VAL CA C 13 61.249 0.300 . 1 . . . . 65 VAL CA . 17703 1 382 . 1 1 65 65 VAL CB C 13 34.274 0.300 . 1 . . . . 65 VAL CB . 17703 1 383 . 1 1 65 65 VAL CG1 C 13 20.596 0.300 . 1 . . . . 65 VAL CG1 . 17703 1 384 . 1 1 65 65 VAL CG2 C 13 21.720 0.300 . 1 . . . . 65 VAL CG2 . 17703 1 385 . 1 1 65 65 VAL N N 15 128.659 0.300 . 1 . . . . 65 VAL N . 17703 1 386 . 1 1 66 66 GLU H H 1 8.699 0.020 . 1 . . . . 66 GLU H . 17703 1 387 . 1 1 66 66 GLU C C 13 174.582 0.300 . 1 . . . . 66 GLU C . 17703 1 388 . 1 1 66 66 GLU CA C 13 55.683 0.300 . 1 . . . . 66 GLU CA . 17703 1 389 . 1 1 66 66 GLU CB C 13 28.678 0.300 . 1 . . . . 66 GLU CB . 17703 1 390 . 1 1 66 66 GLU N N 15 128.468 0.300 . 1 . . . . 66 GLU N . 17703 1 391 . 1 1 67 67 LEU H H 1 8.055 0.020 . 1 . . . . 67 LEU H . 17703 1 392 . 1 1 67 67 LEU HD11 H 1 0.606 0.020 . 1 . . . . 67 LEU HD1 . 17703 1 393 . 1 1 67 67 LEU HD12 H 1 0.606 0.020 . 1 . . . . 67 LEU HD1 . 17703 1 394 . 1 1 67 67 LEU HD13 H 1 0.606 0.020 . 1 . . . . 67 LEU HD1 . 17703 1 395 . 1 1 67 67 LEU HD21 H 1 0.695 0.020 . 1 . . . . 67 LEU HD2 . 17703 1 396 . 1 1 67 67 LEU HD22 H 1 0.695 0.020 . 1 . . . . 67 LEU HD2 . 17703 1 397 . 1 1 67 67 LEU HD23 H 1 0.695 0.020 . 1 . . . . 67 LEU HD2 . 17703 1 398 . 1 1 67 67 LEU C C 13 175.192 0.300 . 1 . . . . 67 LEU C . 17703 1 399 . 1 1 67 67 LEU CA C 13 51.683 0.300 . 1 . . . . 67 LEU CA . 17703 1 400 . 1 1 67 67 LEU CB C 13 40.367 0.300 . 1 . . . . 67 LEU CB . 17703 1 401 . 1 1 67 67 LEU CD1 C 13 25.516 0.300 . 1 . . . . 67 LEU CD1 . 17703 1 402 . 1 1 67 67 LEU CD2 C 13 21.962 0.300 . 1 . . . . 67 LEU CD2 . 17703 1 403 . 1 1 67 67 LEU N N 15 127.645 0.300 . 1 . . . . 67 LEU N . 17703 1 404 . 1 1 68 68 PRO C C 13 177.844 0.300 . 1 . . . . 68 PRO C . 17703 1 405 . 1 1 68 68 PRO CA C 13 65.061 0.300 . 1 . . . . 68 PRO CA . 17703 1 406 . 1 1 68 68 PRO CB C 13 30.166 0.300 . 1 . . . . 68 PRO CB . 17703 1 407 . 1 1 69 69 GLU H H 1 7.877 0.020 . 1 . . . . 69 GLU H . 17703 1 408 . 1 1 69 69 GLU C C 13 175.688 0.300 . 1 . . . . 69 GLU C . 17703 1 409 . 1 1 69 69 GLU CA C 13 54.974 0.300 . 1 . . . . 69 GLU CA . 17703 1 410 . 1 1 69 69 GLU CB C 13 28.607 0.300 . 1 . . . . 69 GLU CB . 17703 1 411 . 1 1 69 69 GLU N N 15 112.386 0.300 . 1 . . . . 69 GLU N . 17703 1 412 . 1 1 70 70 GLY H H 1 7.262 0.020 . 1 . . . . 70 GLY H . 17703 1 413 . 1 1 70 70 GLY C C 13 170.995 0.300 . 1 . . . . 70 GLY C . 17703 1 414 . 1 1 70 70 GLY CA C 13 45.078 0.300 . 1 . . . . 70 GLY CA . 17703 1 415 . 1 1 70 70 GLY N N 15 108.767 0.300 . 1 . . . . 70 GLY N . 17703 1 416 . 1 1 71 71 PHE H H 1 8.757 0.020 . 1 . . . . 71 PHE H . 17703 1 417 . 1 1 71 71 PHE C C 13 173.726 0.300 . 1 . . . . 71 PHE C . 17703 1 418 . 1 1 71 71 PHE CA C 13 56.864 0.300 . 1 . . . . 71 PHE CA . 17703 1 419 . 1 1 71 71 PHE CB C 13 43.059 0.300 . 1 . . . . 71 PHE CB . 17703 1 420 . 1 1 71 71 PHE N N 15 119.710 0.300 . 1 . . . . 71 PHE N . 17703 1 421 . 1 1 72 72 GLU H H 1 9.180 0.020 . 1 . . . . 72 GLU H . 17703 1 422 . 1 1 72 72 GLU C C 13 175.717 0.300 . 1 . . . . 72 GLU C . 17703 1 423 . 1 1 72 72 GLU CA C 13 54.379 0.300 . 1 . . . . 72 GLU CA . 17703 1 424 . 1 1 72 72 GLU CB C 13 31.937 0.300 . 1 . . . . 72 GLU CB . 17703 1 425 . 1 1 72 72 GLU N N 15 122.014 0.300 . 1 . . . . 72 GLU N . 17703 1 426 . 1 1 73 73 MET H H 1 9.529 0.020 . 1 . . . . 73 MET H . 17703 1 427 . 1 1 73 73 MET C C 13 175.471 0.300 . 1 . . . . 73 MET C . 17703 1 428 . 1 1 73 73 MET CA C 13 51.552 0.300 . 1 . . . . 73 MET CA . 17703 1 429 . 1 1 73 73 MET CB C 13 31.429 0.300 . 1 . . . . 73 MET CB . 17703 1 430 . 1 1 73 73 MET N N 15 128.414 0.300 . 1 . . . . 73 MET N . 17703 1 431 . 1 1 74 74 THR H H 1 9.548 0.020 . 1 . . . . 74 THR H . 17703 1 432 . 1 1 74 74 THR C C 13 171.559 0.300 . 1 . . . . 74 THR C . 17703 1 433 . 1 1 74 74 THR CA C 13 62.105 0.300 . 1 . . . . 74 THR CA . 17703 1 434 . 1 1 74 74 THR CB C 13 69.199 0.300 . 1 . . . . 74 THR CB . 17703 1 435 . 1 1 74 74 THR N N 15 121.747 0.300 . 1 . . . . 74 THR N . 17703 1 436 . 1 1 75 75 LEU H H 1 9.030 0.020 . 1 . . . . 75 LEU H . 17703 1 437 . 1 1 75 75 LEU HD11 H 1 -0.426 0.020 . 1 . . . . 75 LEU HD1 . 17703 1 438 . 1 1 75 75 LEU HD12 H 1 -0.426 0.020 . 1 . . . . 75 LEU HD1 . 17703 1 439 . 1 1 75 75 LEU HD13 H 1 -0.426 0.020 . 1 . . . . 75 LEU HD1 . 17703 1 440 . 1 1 75 75 LEU HD21 H 1 0.225 0.020 . 1 . . . . 75 LEU HD2 . 17703 1 441 . 1 1 75 75 LEU HD22 H 1 0.225 0.020 . 1 . . . . 75 LEU HD2 . 17703 1 442 . 1 1 75 75 LEU HD23 H 1 0.225 0.020 . 1 . . . . 75 LEU HD2 . 17703 1 443 . 1 1 75 75 LEU C C 13 173.278 0.300 . 1 . . . . 75 LEU C . 17703 1 444 . 1 1 75 75 LEU CA C 13 52.471 0.300 . 1 . . . . 75 LEU CA . 17703 1 445 . 1 1 75 75 LEU CB C 13 42.846 0.300 . 1 . . . . 75 LEU CB . 17703 1 446 . 1 1 75 75 LEU CD1 C 13 22.695 0.300 . 1 . . . . 75 LEU CD1 . 17703 1 447 . 1 1 75 75 LEU CD2 C 13 25.298 0.300 . 1 . . . . 75 LEU CD2 . 17703 1 448 . 1 1 75 75 LEU N N 15 132.071 0.300 . 1 . . . . 75 LEU N . 17703 1 449 . 1 1 76 76 ILE H H 1 8.442 0.020 . 1 . . . . 76 ILE H . 17703 1 450 . 1 1 76 76 ILE HD11 H 1 0.600 0.020 . 1 . . . . 76 ILE HD1 . 17703 1 451 . 1 1 76 76 ILE HD12 H 1 0.600 0.020 . 1 . . . . 76 ILE HD1 . 17703 1 452 . 1 1 76 76 ILE HD13 H 1 0.600 0.020 . 1 . . . . 76 ILE HD1 . 17703 1 453 . 1 1 76 76 ILE C C 13 175.391 0.300 . 1 . . . . 76 ILE C . 17703 1 454 . 1 1 76 76 ILE CA C 13 59.772 0.300 . 1 . . . . 76 ILE CA . 17703 1 455 . 1 1 76 76 ILE CB C 13 40.012 0.300 . 1 . . . . 76 ILE CB . 17703 1 456 . 1 1 76 76 ILE CD1 C 13 13.972 0.300 . 1 . . . . 76 ILE CD1 . 17703 1 457 . 1 1 76 76 ILE N N 15 126.389 0.300 . 1 . . . . 76 ILE N . 17703 1 458 . 1 1 77 77 LEU H H 1 7.965 0.020 . 1 . . . . 77 LEU H . 17703 1 459 . 1 1 77 77 LEU HD11 H 1 0.472 0.020 . 1 . . . . 77 LEU HD1 . 17703 1 460 . 1 1 77 77 LEU HD12 H 1 0.472 0.020 . 1 . . . . 77 LEU HD1 . 17703 1 461 . 1 1 77 77 LEU HD13 H 1 0.472 0.020 . 1 . . . . 77 LEU HD1 . 17703 1 462 . 1 1 77 77 LEU HD21 H 1 0.561 0.020 . 1 . . . . 77 LEU HD2 . 17703 1 463 . 1 1 77 77 LEU HD22 H 1 0.561 0.020 . 1 . . . . 77 LEU HD2 . 17703 1 464 . 1 1 77 77 LEU HD23 H 1 0.561 0.020 . 1 . . . . 77 LEU HD2 . 17703 1 465 . 1 1 77 77 LEU C C 13 178.427 0.300 . 1 . . . . 77 LEU C . 17703 1 466 . 1 1 77 77 LEU CA C 13 54.801 0.300 . 1 . . . . 77 LEU CA . 17703 1 467 . 1 1 77 77 LEU CB C 13 40.498 0.300 . 1 . . . . 77 LEU CB . 17703 1 468 . 1 1 77 77 LEU CD1 C 13 22.539 0.300 . 1 . . . . 77 LEU CD1 . 17703 1 469 . 1 1 77 77 LEU CD2 C 13 21.838 0.300 . 1 . . . . 77 LEU CD2 . 17703 1 470 . 1 1 77 77 LEU N N 15 124.234 0.300 . 1 . . . . 77 LEU N . 17703 1 471 . 1 1 79 79 GLU C C 13 174.882 0.300 . 1 . . . . 79 GLU C . 17703 1 472 . 1 1 79 79 GLU CA C 13 56.621 0.300 . 1 . . . . 79 GLU CA . 17703 1 473 . 1 1 79 79 GLU CB C 13 27.332 0.300 . 1 . . . . 79 GLU CB . 17703 1 474 . 1 1 80 80 ILE H H 1 7.295 0.020 . 1 . . . . 80 ILE H . 17703 1 475 . 1 1 80 80 ILE HD11 H 1 0.239 0.020 . 1 . . . . 80 ILE HD1 . 17703 1 476 . 1 1 80 80 ILE HD12 H 1 0.239 0.020 . 1 . . . . 80 ILE HD1 . 17703 1 477 . 1 1 80 80 ILE HD13 H 1 0.239 0.020 . 1 . . . . 80 ILE HD1 . 17703 1 478 . 1 1 80 80 ILE C C 13 173.264 0.300 . 1 . . . . 80 ILE C . 17703 1 479 . 1 1 80 80 ILE CA C 13 60.651 0.300 . 1 . . . . 80 ILE CA . 17703 1 480 . 1 1 80 80 ILE CB C 13 37.746 0.300 . 1 . . . . 80 ILE CB . 17703 1 481 . 1 1 80 80 ILE CD1 C 13 12.439 0.300 . 1 . . . . 80 ILE CD1 . 17703 1 482 . 1 1 80 80 ILE N N 15 123.564 0.300 . 1 . . . . 80 ILE N . 17703 1 483 . 1 1 81 81 THR H H 1 7.907 0.020 . 1 . . . . 81 THR H . 17703 1 484 . 1 1 81 81 THR C C 13 174.473 0.300 . 1 . . . . 81 THR C . 17703 1 485 . 1 1 81 81 THR CA C 13 60.318 0.300 . 1 . . . . 81 THR CA . 17703 1 486 . 1 1 81 81 THR CB C 13 70.120 0.300 . 1 . . . . 81 THR CB . 17703 1 487 . 1 1 81 81 THR N N 15 123.968 0.300 . 1 . . . . 81 THR N . 17703 1 488 . 1 1 82 82 VAL H H 1 8.990 0.020 . 1 . . . . 82 VAL H . 17703 1 489 . 1 1 82 82 VAL HG11 H 1 0.667 0.020 . 1 . . . . 82 VAL HG1 . 17703 1 490 . 1 1 82 82 VAL HG12 H 1 0.667 0.020 . 1 . . . . 82 VAL HG1 . 17703 1 491 . 1 1 82 82 VAL HG13 H 1 0.667 0.020 . 1 . . . . 82 VAL HG1 . 17703 1 492 . 1 1 82 82 VAL HG21 H 1 0.931 0.020 . 1 . . . . 82 VAL HG2 . 17703 1 493 . 1 1 82 82 VAL HG22 H 1 0.931 0.020 . 1 . . . . 82 VAL HG2 . 17703 1 494 . 1 1 82 82 VAL HG23 H 1 0.931 0.020 . 1 . . . . 82 VAL HG2 . 17703 1 495 . 1 1 82 82 VAL C C 13 173.164 0.300 . 1 . . . . 82 VAL C . 17703 1 496 . 1 1 82 82 VAL CA C 13 58.470 0.300 . 1 . . . . 82 VAL CA . 17703 1 497 . 1 1 82 82 VAL CB C 13 35.266 0.300 . 1 . . . . 82 VAL CB . 17703 1 498 . 1 1 82 82 VAL CG1 C 13 21.760 0.300 . 1 . . . . 82 VAL CG1 . 17703 1 499 . 1 1 82 82 VAL CG2 C 13 20.506 0.300 . 1 . . . . 82 VAL CG2 . 17703 1 500 . 1 1 82 82 VAL N N 15 120.397 0.300 . 1 . . . . 82 VAL N . 17703 1 501 . 1 1 83 83 LYS H H 1 8.278 0.020 . 1 . . . . 83 LYS H . 17703 1 502 . 1 1 83 83 LYS C C 13 175.897 0.300 . 1 . . . . 83 LYS C . 17703 1 503 . 1 1 83 83 LYS CA C 13 53.974 0.300 . 1 . . . . 83 LYS CA . 17703 1 504 . 1 1 83 83 LYS CB C 13 35.940 0.300 . 1 . . . . 83 LYS CB . 17703 1 505 . 1 1 83 83 LYS N N 15 118.186 0.300 . 1 . . . . 83 LYS N . 17703 1 506 . 1 1 84 84 GLY H H 1 8.784 0.020 . 1 . . . . 84 GLY H . 17703 1 507 . 1 1 84 84 GLY C C 13 171.250 0.300 . 1 . . . . 84 GLY C . 17703 1 508 . 1 1 84 84 GLY CA C 13 43.623 0.300 . 1 . . . . 84 GLY CA . 17703 1 509 . 1 1 84 84 GLY N N 15 106.633 0.300 . 1 . . . . 84 GLY N . 17703 1 510 . 1 1 85 85 GLN H H 1 8.568 0.020 . 1 . . . . 85 GLN H . 17703 1 511 . 1 1 85 85 GLN C C 13 174.200 0.300 . 1 . . . . 85 GLN C . 17703 1 512 . 1 1 85 85 GLN CA C 13 53.590 0.300 . 1 . . . . 85 GLN CA . 17703 1 513 . 1 1 85 85 GLN CB C 13 30.591 0.300 . 1 . . . . 85 GLN CB . 17703 1 514 . 1 1 85 85 GLN N N 15 123.301 0.300 . 1 . . . . 85 GLN N . 17703 1 515 . 1 1 86 86 ALA H H 1 8.518 0.020 . 1 . . . . 86 ALA H . 17703 1 516 . 1 1 86 86 ALA C C 13 176.412 0.300 . 1 . . . . 86 ALA C . 17703 1 517 . 1 1 86 86 ALA CA C 13 51.077 0.300 . 1 . . . . 86 ALA CA . 17703 1 518 . 1 1 86 86 ALA CB C 13 21.169 0.300 . 1 . . . . 86 ALA CB . 17703 1 519 . 1 1 86 86 ALA N N 15 122.478 0.300 . 1 . . . . 86 ALA N . 17703 1 520 . 1 1 87 87 THR H H 1 8.681 0.020 . 1 . . . . 87 THR H . 17703 1 521 . 1 1 87 87 THR C C 13 173.592 0.300 . 1 . . . . 87 THR C . 17703 1 522 . 1 1 87 87 THR CA C 13 63.842 0.300 . 1 . . . . 87 THR CA . 17703 1 523 . 1 1 87 87 THR CB C 13 68.543 0.300 . 1 . . . . 87 THR CB . 17703 1 524 . 1 1 87 87 THR N N 15 110.462 0.300 . 1 . . . . 87 THR N . 17703 1 525 . 1 1 88 88 SER H H 1 7.365 0.020 . 1 . . . . 88 SER H . 17703 1 526 . 1 1 88 88 SER C C 13 173.845 0.300 . 1 . . . . 88 SER C . 17703 1 527 . 1 1 88 88 SER CA C 13 54.979 0.300 . 1 . . . . 88 SER CA . 17703 1 528 . 1 1 88 88 SER CB C 13 65.798 0.300 . 1 . . . . 88 SER CB . 17703 1 529 . 1 1 88 88 SER N N 15 112.541 0.300 . 1 . . . . 88 SER N . 17703 1 530 . 1 1 89 89 LYS H H 1 8.663 0.020 . 1 . . . . 89 LYS H . 17703 1 531 . 1 1 89 89 LYS C C 13 178.227 0.300 . 1 . . . . 89 LYS C . 17703 1 532 . 1 1 89 89 LYS CA C 13 59.984 0.300 . 1 . . . . 89 LYS CA . 17703 1 533 . 1 1 89 89 LYS CB C 13 30.307 0.300 . 1 . . . . 89 LYS CB . 17703 1 534 . 1 1 89 89 LYS N N 15 125.762 0.300 . 1 . . . . 89 LYS N . 17703 1 535 . 1 1 90 90 LYS H H 1 8.345 0.020 . 1 . . . . 90 LYS H . 17703 1 536 . 1 1 90 90 LYS C C 13 178.879 0.300 . 1 . . . . 90 LYS C . 17703 1 537 . 1 1 90 90 LYS CA C 13 59.166 0.300 . 1 . . . . 90 LYS CA . 17703 1 538 . 1 1 90 90 LYS CB C 13 30.759 0.300 . 1 . . . . 90 LYS CB . 17703 1 539 . 1 1 90 90 LYS N N 15 118.312 0.300 . 1 . . . . 90 LYS N . 17703 1 540 . 1 1 91 91 ALA H H 1 7.425 0.020 . 1 . . . . 91 ALA H . 17703 1 541 . 1 1 91 91 ALA C C 13 179.985 0.300 . 1 . . . . 91 ALA C . 17703 1 542 . 1 1 91 91 ALA CA C 13 53.743 0.300 . 1 . . . . 91 ALA CA . 17703 1 543 . 1 1 91 91 ALA CB C 13 17.627 0.300 . 1 . . . . 91 ALA CB . 17703 1 544 . 1 1 91 91 ALA N N 15 120.613 0.300 . 1 . . . . 91 ALA N . 17703 1 545 . 1 1 92 92 ALA H H 1 8.059 0.020 . 1 . . . . 92 ALA H . 17703 1 546 . 1 1 92 92 ALA C C 13 179.049 0.300 . 1 . . . . 92 ALA C . 17703 1 547 . 1 1 92 92 ALA CA C 13 54.897 0.300 . 1 . . . . 92 ALA CA . 17703 1 548 . 1 1 92 92 ALA CB C 13 17.290 0.300 . 1 . . . . 92 ALA CB . 17703 1 549 . 1 1 92 92 ALA N N 15 123.791 0.300 . 1 . . . . 92 ALA N . 17703 1 550 . 1 1 93 93 ARG H H 1 8.075 0.020 . 1 . . . . 93 ARG H . 17703 1 551 . 1 1 93 93 ARG C C 13 178.573 0.300 . 1 . . . . 93 ARG C . 17703 1 552 . 1 1 93 93 ARG CA C 13 59.318 0.300 . 1 . . . . 93 ARG CA . 17703 1 553 . 1 1 93 93 ARG CB C 13 29.457 0.300 . 1 . . . . 93 ARG CB . 17703 1 554 . 1 1 93 93 ARG N N 15 117.999 0.300 . 1 . . . . 93 ARG N . 17703 1 555 . 1 1 94 94 GLN H H 1 7.417 0.020 . 1 . . . . 94 GLN H . 17703 1 556 . 1 1 94 94 GLN C C 13 178.363 0.300 . 1 . . . . 94 GLN C . 17703 1 557 . 1 1 94 94 GLN CA C 13 58.197 0.300 . 1 . . . . 94 GLN CA . 17703 1 558 . 1 1 94 94 GLN CB C 13 26.269 0.300 . 1 . . . . 94 GLN CB . 17703 1 559 . 1 1 94 94 GLN N N 15 117.299 0.300 . 1 . . . . 94 GLN N . 17703 1 560 . 1 1 95 95 LYS H H 1 8.034 0.020 . 1 . . . . 95 LYS H . 17703 1 561 . 1 1 95 95 LYS C C 13 179.489 0.300 . 1 . . . . 95 LYS C . 17703 1 562 . 1 1 95 95 LYS CA C 13 58.533 0.300 . 1 . . . . 95 LYS CA . 17703 1 563 . 1 1 95 95 LYS CB C 13 31.173 0.300 . 1 . . . . 95 LYS CB . 17703 1 564 . 1 1 95 95 LYS N N 15 118.440 0.300 . 1 . . . . 95 LYS N . 17703 1 565 . 1 1 96 96 ALA H H 1 8.255 0.020 . 1 . . . . 96 ALA H . 17703 1 566 . 1 1 96 96 ALA C C 13 178.150 0.300 . 1 . . . . 96 ALA C . 17703 1 567 . 1 1 96 96 ALA CA C 13 54.358 0.300 . 1 . . . . 96 ALA CA . 17703 1 568 . 1 1 96 96 ALA CB C 13 16.737 0.300 . 1 . . . . 96 ALA CB . 17703 1 569 . 1 1 96 96 ALA N N 15 122.399 0.300 . 1 . . . . 96 ALA N . 17703 1 570 . 1 1 97 97 ALA H H 1 8.365 0.020 . 1 . . . . 97 ALA H . 17703 1 571 . 1 1 97 97 ALA C C 13 179.092 0.300 . 1 . . . . 97 ALA C . 17703 1 572 . 1 1 97 97 ALA CA C 13 54.864 0.300 . 1 . . . . 97 ALA CA . 17703 1 573 . 1 1 97 97 ALA CB C 13 16.253 0.300 . 1 . . . . 97 ALA CB . 17703 1 574 . 1 1 97 97 ALA N N 15 120.184 0.300 . 1 . . . . 97 ALA N . 17703 1 575 . 1 1 98 98 VAL H H 1 8.321 0.020 . 1 . . . . 98 VAL H . 17703 1 576 . 1 1 98 98 VAL HG11 H 1 0.892 0.020 . 1 . . . . 98 VAL HG1 . 17703 1 577 . 1 1 98 98 VAL HG12 H 1 0.892 0.020 . 1 . . . . 98 VAL HG1 . 17703 1 578 . 1 1 98 98 VAL HG13 H 1 0.892 0.020 . 1 . . . . 98 VAL HG1 . 17703 1 579 . 1 1 98 98 VAL HG21 H 1 1.092 0.020 . 1 . . . . 98 VAL HG2 . 17703 1 580 . 1 1 98 98 VAL HG22 H 1 1.092 0.020 . 1 . . . . 98 VAL HG2 . 17703 1 581 . 1 1 98 98 VAL HG23 H 1 1.092 0.020 . 1 . . . . 98 VAL HG2 . 17703 1 582 . 1 1 98 98 VAL C C 13 177.362 0.300 . 1 . . . . 98 VAL C . 17703 1 583 . 1 1 98 98 VAL CA C 13 67.209 0.300 . 1 . . . . 98 VAL CA . 17703 1 584 . 1 1 98 98 VAL CB C 13 30.414 0.300 . 1 . . . . 98 VAL CB . 17703 1 585 . 1 1 98 98 VAL CG1 C 13 20.682 0.300 . 1 . . . . 98 VAL CG1 . 17703 1 586 . 1 1 98 98 VAL CG2 C 13 24.456 0.300 . 1 . . . . 98 VAL CG2 . 17703 1 587 . 1 1 98 98 VAL N N 15 118.520 0.300 . 1 . . . . 98 VAL N . 17703 1 588 . 1 1 99 99 GLU H H 1 7.794 0.020 . 1 . . . . 99 GLU H . 17703 1 589 . 1 1 99 99 GLU C C 13 179.205 0.300 . 1 . . . . 99 GLU C . 17703 1 590 . 1 1 99 99 GLU CA C 13 58.136 0.300 . 1 . . . . 99 GLU CA . 17703 1 591 . 1 1 99 99 GLU CB C 13 27.474 0.300 . 1 . . . . 99 GLU CB . 17703 1 592 . 1 1 99 99 GLU N N 15 119.040 0.300 . 1 . . . . 99 GLU N . 17703 1 593 . 1 1 100 100 TYR H H 1 8.617 0.020 . 1 . . . . 100 TYR H . 17703 1 594 . 1 1 100 100 TYR C C 13 177.252 0.300 . 1 . . . . 100 TYR C . 17703 1 595 . 1 1 100 100 TYR CA C 13 61.626 0.300 . 1 . . . . 100 TYR CA . 17703 1 596 . 1 1 100 100 TYR CB C 13 37.943 0.300 . 1 . . . . 100 TYR CB . 17703 1 597 . 1 1 100 100 TYR N N 15 122.069 0.300 . 1 . . . . 100 TYR N . 17703 1 598 . 1 1 101 101 LEU H H 1 8.525 0.020 . 1 . . . . 101 LEU H . 17703 1 599 . 1 1 101 101 LEU HD11 H 1 0.997 0.020 . 1 . . . . 101 LEU HD1 . 17703 1 600 . 1 1 101 101 LEU HD12 H 1 0.997 0.020 . 1 . . . . 101 LEU HD1 . 17703 1 601 . 1 1 101 101 LEU HD13 H 1 0.997 0.020 . 1 . . . . 101 LEU HD1 . 17703 1 602 . 1 1 101 101 LEU HD21 H 1 0.891 0.020 . 1 . . . . 101 LEU HD2 . 17703 1 603 . 1 1 101 101 LEU HD22 H 1 0.891 0.020 . 1 . . . . 101 LEU HD2 . 17703 1 604 . 1 1 101 101 LEU HD23 H 1 0.891 0.020 . 1 . . . . 101 LEU HD2 . 17703 1 605 . 1 1 101 101 LEU C C 13 178.510 0.300 . 1 . . . . 101 LEU C . 17703 1 606 . 1 1 101 101 LEU CA C 13 56.958 0.300 . 1 . . . . 101 LEU CA . 17703 1 607 . 1 1 101 101 LEU CB C 13 39.877 0.300 . 1 . . . . 101 LEU CB . 17703 1 608 . 1 1 101 101 LEU CD1 C 13 25.383 0.300 . 1 . . . . 101 LEU CD1 . 17703 1 609 . 1 1 101 101 LEU CD2 C 13 21.639 0.300 . 1 . . . . 101 LEU CD2 . 17703 1 610 . 1 1 101 101 LEU N N 15 117.726 0.300 . 1 . . . . 101 LEU N . 17703 1 611 . 1 1 102 102 ARG H H 1 8.450 0.020 . 1 . . . . 102 ARG H . 17703 1 612 . 1 1 102 102 ARG C C 13 178.986 0.300 . 1 . . . . 102 ARG C . 17703 1 613 . 1 1 102 102 ARG CA C 13 60.106 0.300 . 1 . . . . 102 ARG CA . 17703 1 614 . 1 1 102 102 ARG CB C 13 28.410 0.300 . 1 . . . . 102 ARG CB . 17703 1 615 . 1 1 102 102 ARG N N 15 118.083 0.300 . 1 . . . . 102 ARG N . 17703 1 616 . 1 1 103 103 LYS H H 1 7.649 0.020 . 1 . . . . 103 LYS H . 17703 1 617 . 1 1 103 103 LYS C C 13 178.842 0.300 . 1 . . . . 103 LYS C . 17703 1 618 . 1 1 103 103 LYS CA C 13 57.500 0.300 . 1 . . . . 103 LYS CA . 17703 1 619 . 1 1 103 103 LYS CB C 13 29.811 0.300 . 1 . . . . 103 LYS CB . 17703 1 620 . 1 1 103 103 LYS N N 15 120.989 0.300 . 1 . . . . 103 LYS N . 17703 1 621 . 1 1 104 104 VAL H H 1 7.934 0.020 . 1 . . . . 104 VAL H . 17703 1 622 . 1 1 104 104 VAL HG11 H 1 0.171 0.020 . 1 . . . . 104 VAL HG1 . 17703 1 623 . 1 1 104 104 VAL HG12 H 1 0.171 0.020 . 1 . . . . 104 VAL HG1 . 17703 1 624 . 1 1 104 104 VAL HG13 H 1 0.171 0.020 . 1 . . . . 104 VAL HG1 . 17703 1 625 . 1 1 104 104 VAL HG21 H 1 0.172 0.020 . 1 . . . . 104 VAL HG2 . 17703 1 626 . 1 1 104 104 VAL HG22 H 1 0.172 0.020 . 1 . . . . 104 VAL HG2 . 17703 1 627 . 1 1 104 104 VAL HG23 H 1 0.172 0.020 . 1 . . . . 104 VAL HG2 . 17703 1 628 . 1 1 104 104 VAL C C 13 178.206 0.300 . 1 . . . . 104 VAL C . 17703 1 629 . 1 1 104 104 VAL CA C 13 65.850 0.300 . 1 . . . . 104 VAL CA . 17703 1 630 . 1 1 104 104 VAL CB C 13 29.654 0.300 . 1 . . . . 104 VAL CB . 17703 1 631 . 1 1 104 104 VAL CG1 C 13 21.331 0.300 . 1 . . . . 104 VAL CG1 . 17703 1 632 . 1 1 104 104 VAL CG2 C 13 22.576 0.300 . 1 . . . . 104 VAL CG2 . 17703 1 633 . 1 1 104 104 VAL N N 15 119.813 0.300 . 1 . . . . 104 VAL N . 17703 1 634 . 1 1 105 105 VAL H H 1 7.720 0.020 . 1 . . . . 105 VAL H . 17703 1 635 . 1 1 105 105 VAL HG21 H 1 0.850 0.020 . 1 . . . . 105 VAL HG2 . 17703 1 636 . 1 1 105 105 VAL HG22 H 1 0.850 0.020 . 1 . . . . 105 VAL HG2 . 17703 1 637 . 1 1 105 105 VAL HG23 H 1 0.850 0.020 . 1 . . . . 105 VAL HG2 . 17703 1 638 . 1 1 105 105 VAL C C 13 180.160 0.300 . 1 . . . . 105 VAL C . 17703 1 639 . 1 1 105 105 VAL CA C 13 65.468 0.300 . 1 . . . . 105 VAL CA . 17703 1 640 . 1 1 105 105 VAL CB C 13 29.930 0.300 . 1 . . . . 105 VAL CB . 17703 1 641 . 1 1 105 105 VAL CG2 C 13 22.873 0.300 . 1 . . . . 105 VAL CG2 . 17703 1 642 . 1 1 105 105 VAL N N 15 119.945 0.300 . 1 . . . . 105 VAL N . 17703 1 643 . 1 1 106 106 GLU H H 1 7.996 0.020 . 1 . . . . 106 GLU H . 17703 1 644 . 1 1 106 106 GLU C C 13 178.180 0.300 . 1 . . . . 106 GLU C . 17703 1 645 . 1 1 106 106 GLU CA C 13 58.701 0.300 . 1 . . . . 106 GLU CA . 17703 1 646 . 1 1 106 106 GLU CB C 13 28.272 0.300 . 1 . . . . 106 GLU CB . 17703 1 647 . 1 1 106 106 GLU N N 15 122.151 0.300 . 1 . . . . 106 GLU N . 17703 1 648 . 1 1 107 107 LYS H H 1 7.761 0.020 . 1 . . . . 107 LYS H . 17703 1 649 . 1 1 107 107 LYS C C 13 176.574 0.300 . 1 . . . . 107 LYS C . 17703 1 650 . 1 1 107 107 LYS CA C 13 55.451 0.300 . 1 . . . . 107 LYS CA . 17703 1 651 . 1 1 107 107 LYS CB C 13 31.243 0.300 . 1 . . . . 107 LYS CB . 17703 1 652 . 1 1 107 107 LYS N N 15 116.035 0.300 . 1 . . . . 107 LYS N . 17703 1 653 . 1 1 108 108 GLY H H 1 7.919 0.020 . 1 . . . . 108 GLY H . 17703 1 654 . 1 1 108 108 GLY C C 13 176.015 0.300 . 1 . . . . 108 GLY C . 17703 1 655 . 1 1 108 108 GLY CA C 13 45.643 0.300 . 1 . . . . 108 GLY CA . 17703 1 656 . 1 1 108 108 GLY N N 15 108.029 0.300 . 1 . . . . 108 GLY N . 17703 1 657 . 1 1 109 109 LYS H H 1 7.824 0.020 . 1 . . . . 109 LYS H . 17703 1 658 . 1 1 109 109 LYS C C 13 176.850 0.300 . 1 . . . . 109 LYS C . 17703 1 659 . 1 1 109 109 LYS CA C 13 54.417 0.300 . 1 . . . . 109 LYS CA . 17703 1 660 . 1 1 109 109 LYS CB C 13 32.140 0.300 . 1 . . . . 109 LYS CB . 17703 1 661 . 1 1 109 109 LYS N N 15 118.024 0.300 . 1 . . . . 109 LYS N . 17703 1 662 . 1 1 110 110 HIS H H 1 8.559 0.020 . 1 . . . . 110 HIS H . 17703 1 663 . 1 1 110 110 HIS C C 13 176.057 0.300 . 1 . . . . 110 HIS C . 17703 1 664 . 1 1 110 110 HIS CA C 13 60.469 0.300 . 1 . . . . 110 HIS CA . 17703 1 665 . 1 1 110 110 HIS N N 15 119.735 0.300 . 1 . . . . 110 HIS N . 17703 1 666 . 1 1 111 111 GLU C C 13 178.547 0.300 . 1 . . . . 111 GLU C . 17703 1 667 . 1 1 111 111 GLU CA C 13 58.580 0.300 . 1 . . . . 111 GLU CA . 17703 1 668 . 1 1 112 112 ILE H H 1 7.147 0.020 . 1 . . . . 112 ILE H . 17703 1 669 . 1 1 112 112 ILE HD11 H 1 0.759 0.020 . 1 . . . . 112 ILE HD1 . 17703 1 670 . 1 1 112 112 ILE HD12 H 1 0.759 0.020 . 1 . . . . 112 ILE HD1 . 17703 1 671 . 1 1 112 112 ILE HD13 H 1 0.759 0.020 . 1 . . . . 112 ILE HD1 . 17703 1 672 . 1 1 112 112 ILE C C 13 174.307 0.300 . 1 . . . . 112 ILE C . 17703 1 673 . 1 1 112 112 ILE CA C 13 61.980 0.300 . 1 . . . . 112 ILE CA . 17703 1 674 . 1 1 112 112 ILE CB C 13 36.009 0.300 . 1 . . . . 112 ILE CB . 17703 1 675 . 1 1 112 112 ILE CD1 C 13 12.714 0.300 . 1 . . . . 112 ILE CD1 . 17703 1 676 . 1 1 112 112 ILE N N 15 119.910 0.300 . 1 . . . . 112 ILE N . 17703 1 677 . 1 1 113 113 PHE H H 1 6.860 0.020 . 1 . . . . 113 PHE H . 17703 1 678 . 1 1 113 113 PHE HD1 H 1 7.176 0.020 . 1 . . . . 113 PHE HD1 . 17703 1 679 . 1 1 113 113 PHE HE1 H 1 7.237 0.020 . 1 . . . . 113 PHE HE1 . 17703 1 680 . 1 1 113 113 PHE HZ H 1 7.379 0.020 . 1 . . . . 113 PHE HZ . 17703 1 681 . 1 1 113 113 PHE C C 13 173.629 0.300 . 1 . . . . 113 PHE C . 17703 1 682 . 1 1 113 113 PHE CA C 13 57.076 0.300 . 1 . . . . 113 PHE CA . 17703 1 683 . 1 1 113 113 PHE CB C 13 38.841 0.300 . 1 . . . . 113 PHE CB . 17703 1 684 . 1 1 113 113 PHE N N 15 116.897 0.300 . 1 . . . . 113 PHE N . 17703 1 685 . 1 1 114 114 PHE H H 1 7.256 0.020 . 1 . . . . 114 PHE H . 17703 1 686 . 1 1 114 114 PHE C C 13 174.984 0.300 . 1 . . . . 114 PHE C . 17703 1 687 . 1 1 114 114 PHE CA C 13 57.431 0.300 . 1 . . . . 114 PHE CA . 17703 1 688 . 1 1 114 114 PHE CB C 13 34.487 0.300 . 1 . . . . 114 PHE CB . 17703 1 689 . 1 1 114 114 PHE N N 15 112.904 0.300 . 1 . . . . 114 PHE N . 17703 1 690 . 1 1 115 115 ILE H H 1 7.628 0.020 . 1 . . . . 115 ILE H . 17703 1 691 . 1 1 115 115 ILE HD11 H 1 0.876 0.020 . 1 . . . . 115 ILE HD1 . 17703 1 692 . 1 1 115 115 ILE HD12 H 1 0.876 0.020 . 1 . . . . 115 ILE HD1 . 17703 1 693 . 1 1 115 115 ILE HD13 H 1 0.876 0.020 . 1 . . . . 115 ILE HD1 . 17703 1 694 . 1 1 115 115 ILE C C 13 173.788 0.300 . 1 . . . . 115 ILE C . 17703 1 695 . 1 1 115 115 ILE CA C 13 57.253 0.300 . 1 . . . . 115 ILE CA . 17703 1 696 . 1 1 115 115 ILE CB C 13 37.666 0.300 . 1 . . . . 115 ILE CB . 17703 1 697 . 1 1 115 115 ILE CD1 C 13 14.153 0.300 . 1 . . . . 115 ILE CD1 . 17703 1 698 . 1 1 115 115 ILE N N 15 121.347 0.300 . 1 . . . . 115 ILE N . 17703 1 699 . 1 1 116 116 PRO C C 13 175.337 0.300 . 1 . . . . 116 PRO C . 17703 1 700 . 1 1 116 116 PRO CA C 13 61.915 0.300 . 1 . . . . 116 PRO CA . 17703 1 701 . 1 1 116 116 PRO CB C 13 30.449 0.300 . 1 . . . . 116 PRO CB . 17703 1 702 . 1 1 117 117 GLY H H 1 8.069 0.020 . 1 . . . . 117 GLY H . 17703 1 703 . 1 1 117 117 GLY C C 13 174.696 0.300 . 1 . . . . 117 GLY C . 17703 1 704 . 1 1 117 117 GLY CA C 13 43.290 0.300 . 1 . . . . 117 GLY CA . 17703 1 705 . 1 1 117 117 GLY N N 15 108.662 0.300 . 1 . . . . 117 GLY N . 17703 1 706 . 1 1 118 118 THR H H 1 9.063 0.020 . 1 . . . . 118 THR H . 17703 1 707 . 1 1 118 118 THR C C 13 174.452 0.300 . 1 . . . . 118 THR C . 17703 1 708 . 1 1 118 118 THR CA C 13 63.529 0.300 . 1 . . . . 118 THR CA . 17703 1 709 . 1 1 118 118 THR CB C 13 68.128 0.300 . 1 . . . . 118 THR CB . 17703 1 710 . 1 1 118 118 THR N N 15 121.394 0.300 . 1 . . . . 118 THR N . 17703 1 711 . 1 1 119 119 THR H H 1 7.305 0.020 . 1 . . . . 119 THR H . 17703 1 712 . 1 1 119 119 THR C C 13 174.556 0.300 . 1 . . . . 119 THR C . 17703 1 713 . 1 1 119 119 THR CA C 13 58.136 0.300 . 1 . . . . 119 THR CA . 17703 1 714 . 1 1 119 119 THR CB C 13 71.961 0.300 . 1 . . . . 119 THR CB . 17703 1 715 . 1 1 119 119 THR N N 15 110.277 0.300 . 1 . . . . 119 THR N . 17703 1 716 . 1 1 120 120 LYS H H 1 8.951 0.020 . 1 . . . . 120 LYS H . 17703 1 717 . 1 1 120 120 LYS C C 13 177.540 0.300 . 1 . . . . 120 LYS C . 17703 1 718 . 1 1 120 120 LYS CA C 13 59.530 0.300 . 1 . . . . 120 LYS CA . 17703 1 719 . 1 1 120 120 LYS CB C 13 31.243 0.300 . 1 . . . . 120 LYS CB . 17703 1 720 . 1 1 120 120 LYS N N 15 121.923 0.300 . 1 . . . . 120 LYS N . 17703 1 721 . 1 1 121 121 GLU H H 1 8.560 0.020 . 1 . . . . 121 GLU H . 17703 1 722 . 1 1 121 121 GLU C C 13 179.475 0.300 . 1 . . . . 121 GLU C . 17703 1 723 . 1 1 121 121 GLU CA C 13 59.853 0.300 . 1 . . . . 121 GLU CA . 17703 1 724 . 1 1 121 121 GLU CB C 13 27.305 0.300 . 1 . . . . 121 GLU CB . 17703 1 725 . 1 1 121 121 GLU N N 15 117.565 0.300 . 1 . . . . 121 GLU N . 17703 1 726 . 1 1 122 122 GLU H H 1 7.787 0.020 . 1 . . . . 122 GLU H . 17703 1 727 . 1 1 122 122 GLU C C 13 178.170 0.300 . 1 . . . . 122 GLU C . 17703 1 728 . 1 1 122 122 GLU CA C 13 58.257 0.300 . 1 . . . . 122 GLU CA . 17703 1 729 . 1 1 122 122 GLU CB C 13 29.528 0.300 . 1 . . . . 122 GLU CB . 17703 1 730 . 1 1 122 122 GLU N N 15 121.874 0.300 . 1 . . . . 122 GLU N . 17703 1 731 . 1 1 123 123 ALA H H 1 7.714 0.020 . 1 . . . . 123 ALA H . 17703 1 732 . 1 1 123 123 ALA C C 13 179.960 0.300 . 1 . . . . 123 ALA C . 17703 1 733 . 1 1 123 123 ALA CA C 13 54.440 0.300 . 1 . . . . 123 ALA CA . 17703 1 734 . 1 1 123 123 ALA CB C 13 16.493 0.300 . 1 . . . . 123 ALA CB . 17703 1 735 . 1 1 123 123 ALA N N 15 122.474 0.300 . 1 . . . . 123 ALA N . 17703 1 736 . 1 1 124 124 LEU H H 1 8.382 0.020 . 1 . . . . 124 LEU H . 17703 1 737 . 1 1 124 124 LEU HD11 H 1 0.851 0.020 . 1 . . . . 124 LEU HD1 . 17703 1 738 . 1 1 124 124 LEU HD12 H 1 0.851 0.020 . 1 . . . . 124 LEU HD1 . 17703 1 739 . 1 1 124 124 LEU HD13 H 1 0.851 0.020 . 1 . . . . 124 LEU HD1 . 17703 1 740 . 1 1 124 124 LEU HD21 H 1 0.757 0.020 . 1 . . . . 124 LEU HD2 . 17703 1 741 . 1 1 124 124 LEU HD22 H 1 0.757 0.020 . 1 . . . . 124 LEU HD2 . 17703 1 742 . 1 1 124 124 LEU HD23 H 1 0.757 0.020 . 1 . . . . 124 LEU HD2 . 17703 1 743 . 1 1 124 124 LEU C C 13 179.243 0.300 . 1 . . . . 124 LEU C . 17703 1 744 . 1 1 124 124 LEU CA C 13 57.460 0.300 . 1 . . . . 124 LEU CA . 17703 1 745 . 1 1 124 124 LEU CB C 13 39.739 0.300 . 1 . . . . 124 LEU CB . 17703 1 746 . 1 1 124 124 LEU CD1 C 13 22.624 0.300 . 1 . . . . 124 LEU CD1 . 17703 1 747 . 1 1 124 124 LEU CD2 C 13 24.675 0.300 . 1 . . . . 124 LEU CD2 . 17703 1 748 . 1 1 124 124 LEU N N 15 117.418 0.300 . 1 . . . . 124 LEU N . 17703 1 749 . 1 1 125 125 SER H H 1 7.769 0.020 . 1 . . . . 125 SER H . 17703 1 750 . 1 1 125 125 SER C C 13 177.444 0.300 . 1 . . . . 125 SER C . 17703 1 751 . 1 1 125 125 SER CA C 13 60.590 0.300 . 1 . . . . 125 SER CA . 17703 1 752 . 1 1 125 125 SER CB C 13 62.326 0.300 . 1 . . . . 125 SER CB . 17703 1 753 . 1 1 125 125 SER N N 15 116.137 0.300 . 1 . . . . 125 SER N . 17703 1 754 . 1 1 126 126 ASN H H 1 8.092 0.020 . 1 . . . . 126 ASN H . 17703 1 755 . 1 1 126 126 ASN C C 13 177.667 0.300 . 1 . . . . 126 ASN C . 17703 1 756 . 1 1 126 126 ASN CA C 13 55.776 0.300 . 1 . . . . 126 ASN CA . 17703 1 757 . 1 1 126 126 ASN CB C 13 35.904 0.300 . 1 . . . . 126 ASN CB . 17703 1 758 . 1 1 126 126 ASN N N 15 122.568 0.300 . 1 . . . . 126 ASN N . 17703 1 759 . 1 1 127 127 ILE H H 1 8.213 0.020 . 1 . . . . 127 ILE H . 17703 1 760 . 1 1 127 127 ILE HD11 H 1 0.748 0.020 . 1 . . . . 127 ILE HD1 . 17703 1 761 . 1 1 127 127 ILE HD12 H 1 0.748 0.020 . 1 . . . . 127 ILE HD1 . 17703 1 762 . 1 1 127 127 ILE HD13 H 1 0.748 0.020 . 1 . . . . 127 ILE HD1 . 17703 1 763 . 1 1 127 127 ILE C C 13 178.220 0.300 . 1 . . . . 127 ILE C . 17703 1 764 . 1 1 127 127 ILE CA C 13 64.491 0.300 . 1 . . . . 127 ILE CA . 17703 1 765 . 1 1 127 127 ILE CB C 13 36.285 0.300 . 1 . . . . 127 ILE CB . 17703 1 766 . 1 1 127 127 ILE CD1 C 13 15.053 0.300 . 1 . . . . 127 ILE CD1 . 17703 1 767 . 1 1 127 127 ILE N N 15 122.107 0.300 . 1 . . . . 127 ILE N . 17703 1 768 . 1 1 128 128 ASP H H 1 8.332 0.020 . 1 . . . . 128 ASP H . 17703 1 769 . 1 1 128 128 ASP C C 13 178.978 0.300 . 1 . . . . 128 ASP C . 17703 1 770 . 1 1 128 128 ASP CA C 13 57.194 0.300 . 1 . . . . 128 ASP CA . 17703 1 771 . 1 1 128 128 ASP CB C 13 39.186 0.300 . 1 . . . . 128 ASP CB . 17703 1 772 . 1 1 128 128 ASP N N 15 121.490 0.300 . 1 . . . . 128 ASP N . 17703 1 773 . 1 1 129 129 GLN H H 1 7.730 0.020 . 1 . . . . 129 GLN H . 17703 1 774 . 1 1 129 129 GLN C C 13 178.510 0.300 . 1 . . . . 129 GLN C . 17703 1 775 . 1 1 129 129 GLN CA C 13 58.530 0.300 . 1 . . . . 129 GLN CA . 17703 1 776 . 1 1 129 129 GLN N N 15 117.694 0.300 . 1 . . . . 129 GLN N . 17703 1 777 . 1 1 130 130 ILE H H 1 7.404 0.020 . 1 . . . . 130 ILE H . 17703 1 778 . 1 1 130 130 ILE HD11 H 1 0.140 0.020 . 1 . . . . 130 ILE HD1 . 17703 1 779 . 1 1 130 130 ILE HD12 H 1 0.140 0.020 . 1 . . . . 130 ILE HD1 . 17703 1 780 . 1 1 130 130 ILE HD13 H 1 0.140 0.020 . 1 . . . . 130 ILE HD1 . 17703 1 781 . 1 1 130 130 ILE C C 13 177.183 0.300 . 1 . . . . 130 ILE C . 17703 1 782 . 1 1 130 130 ILE CA C 13 62.560 0.300 . 1 . . . . 130 ILE CA . 17703 1 783 . 1 1 130 130 ILE CB C 13 37.391 0.300 . 1 . . . . 130 ILE CB . 17703 1 784 . 1 1 130 130 ILE CD1 C 13 14.254 0.300 . 1 . . . . 130 ILE CD1 . 17703 1 785 . 1 1 130 130 ILE N N 15 111.546 0.300 . 1 . . . . 130 ILE N . 17703 1 786 . 1 1 131 131 SER H H 1 7.877 0.020 . 1 . . . . 131 SER H . 17703 1 787 . 1 1 131 131 SER C C 13 175.050 0.300 . 1 . . . . 131 SER C . 17703 1 788 . 1 1 131 131 SER CA C 13 59.824 0.300 . 1 . . . . 131 SER CA . 17703 1 789 . 1 1 131 131 SER CB C 13 62.879 0.300 . 1 . . . . 131 SER CB . 17703 1 790 . 1 1 131 131 SER N N 15 118.628 0.300 . 1 . . . . 131 SER N . 17703 1 791 . 1 1 132 132 ASP H H 1 8.275 0.020 . 1 . . . . 132 ASP H . 17703 1 792 . 1 1 132 132 ASP C C 13 177.044 0.300 . 1 . . . . 132 ASP C . 17703 1 793 . 1 1 132 132 ASP CA C 13 54.661 0.300 . 1 . . . . 132 ASP CA . 17703 1 794 . 1 1 132 132 ASP CB C 13 40.093 0.300 . 1 . . . . 132 ASP CB . 17703 1 795 . 1 1 132 132 ASP N N 15 121.719 0.300 . 1 . . . . 132 ASP N . 17703 1 796 . 1 1 133 133 LYS H H 1 7.782 0.020 . 1 . . . . 133 LYS H . 17703 1 797 . 1 1 133 133 LYS C C 13 176.823 0.300 . 1 . . . . 133 LYS C . 17703 1 798 . 1 1 133 133 LYS CA C 13 56.258 0.300 . 1 . . . . 133 LYS CA . 17703 1 799 . 1 1 133 133 LYS CB C 13 31.299 0.300 . 1 . . . . 133 LYS CB . 17703 1 800 . 1 1 133 133 LYS N N 15 120.682 0.300 . 1 . . . . 133 LYS N . 17703 1 801 . 1 1 134 134 ALA H H 1 7.955 0.020 . 1 . . . . 134 ALA H . 17703 1 802 . 1 1 134 134 ALA C C 13 178.040 0.300 . 1 . . . . 134 ALA C . 17703 1 803 . 1 1 134 134 ALA CA C 13 52.349 0.300 . 1 . . . . 134 ALA CA . 17703 1 804 . 1 1 134 134 ALA CB C 13 17.704 0.300 . 1 . . . . 134 ALA CB . 17703 1 805 . 1 1 134 134 ALA N N 15 123.659 0.300 . 1 . . . . 134 ALA N . 17703 1 806 . 1 1 135 135 GLU H H 1 8.074 0.020 . 1 . . . . 135 GLU H . 17703 1 807 . 1 1 135 135 GLU C C 13 176.795 0.300 . 1 . . . . 135 GLU C . 17703 1 808 . 1 1 135 135 GLU CA C 13 56.440 0.300 . 1 . . . . 135 GLU CA . 17703 1 809 . 1 1 135 135 GLU CB C 13 28.890 0.300 . 1 . . . . 135 GLU CB . 17703 1 810 . 1 1 135 135 GLU N N 15 120.244 0.300 . 1 . . . . 135 GLU N . 17703 1 811 . 1 1 136 136 GLU H H 1 8.294 0.020 . 1 . . . . 136 GLU H . 17703 1 812 . 1 1 136 136 GLU C C 13 176.588 0.300 . 1 . . . . 136 GLU C . 17703 1 813 . 1 1 136 136 GLU CA C 13 56.366 0.300 . 1 . . . . 136 GLU CA . 17703 1 814 . 1 1 136 136 GLU CB C 13 28.894 0.300 . 1 . . . . 136 GLU CB . 17703 1 815 . 1 1 136 136 GLU N N 15 121.881 0.300 . 1 . . . . 136 GLU N . 17703 1 816 . 1 1 137 137 LEU H H 1 8.079 0.020 . 1 . . . . 137 LEU H . 17703 1 817 . 1 1 137 137 LEU HD11 H 1 0.770 0.020 . 1 . . . . 137 LEU HD1 . 17703 1 818 . 1 1 137 137 LEU HD12 H 1 0.770 0.020 . 1 . . . . 137 LEU HD1 . 17703 1 819 . 1 1 137 137 LEU HD13 H 1 0.770 0.020 . 1 . . . . 137 LEU HD1 . 17703 1 820 . 1 1 137 137 LEU HD21 H 1 0.828 0.020 . 1 . . . . 137 LEU HD2 . 17703 1 821 . 1 1 137 137 LEU HD22 H 1 0.828 0.020 . 1 . . . . 137 LEU HD2 . 17703 1 822 . 1 1 137 137 LEU HD23 H 1 0.828 0.020 . 1 . . . . 137 LEU HD2 . 17703 1 823 . 1 1 137 137 LEU C C 13 177.305 0.300 . 1 . . . . 137 LEU C . 17703 1 824 . 1 1 137 137 LEU CA C 13 54.713 0.300 . 1 . . . . 137 LEU CA . 17703 1 825 . 1 1 137 137 LEU CB C 13 40.775 0.300 . 1 . . . . 137 LEU CB . 17703 1 826 . 1 1 137 137 LEU CD1 C 13 23.198 0.300 . 1 . . . . 137 LEU CD1 . 17703 1 827 . 1 1 137 137 LEU CD2 C 13 24.537 0.300 . 1 . . . . 137 LEU CD2 . 17703 1 828 . 1 1 137 137 LEU N N 15 123.233 0.300 . 1 . . . . 137 LEU N . 17703 1 829 . 1 1 138 138 LYS H H 1 8.086 0.020 . 1 . . . . 138 LYS H . 17703 1 830 . 1 1 138 138 LYS C C 13 176.463 0.300 . 1 . . . . 138 LYS C . 17703 1 831 . 1 1 138 138 LYS CA C 13 55.773 0.300 . 1 . . . . 138 LYS CA . 17703 1 832 . 1 1 138 138 LYS CB C 13 31.519 0.300 . 1 . . . . 138 LYS CB . 17703 1 833 . 1 1 138 138 LYS N N 15 122.904 0.300 . 1 . . . . 138 LYS N . 17703 1 834 . 1 1 139 139 ARG H H 1 8.237 0.020 . 1 . . . . 139 ARG H . 17703 1 835 . 1 1 139 139 ARG C C 13 176.301 0.300 . 1 . . . . 139 ARG C . 17703 1 836 . 1 1 139 139 ARG CA C 13 55.532 0.300 . 1 . . . . 139 ARG CA . 17703 1 837 . 1 1 139 139 ARG CB C 13 29.599 0.300 . 1 . . . . 139 ARG CB . 17703 1 838 . 1 1 139 139 ARG N N 15 122.925 0.300 . 1 . . . . 139 ARG N . 17703 1 839 . 1 1 140 140 SER H H 1 8.404 0.020 . 1 . . . . 140 SER H . 17703 1 840 . 1 1 140 140 SER C C 13 174.791 0.300 . 1 . . . . 140 SER C . 17703 1 841 . 1 1 140 140 SER CA C 13 57.785 0.300 . 1 . . . . 140 SER CA . 17703 1 842 . 1 1 140 140 SER CB C 13 63.285 0.300 . 1 . . . . 140 SER CB . 17703 1 843 . 1 1 140 140 SER N N 15 118.057 0.300 . 1 . . . . 140 SER N . 17703 1 844 . 1 1 141 141 THR H H 1 8.165 0.020 . 1 . . . . 141 THR H . 17703 1 845 . 1 1 141 141 THR C C 13 174.638 0.300 . 1 . . . . 141 THR C . 17703 1 846 . 1 1 141 141 THR CA C 13 61.330 0.300 . 1 . . . . 141 THR CA . 17703 1 847 . 1 1 141 141 THR CB C 13 69.026 0.300 . 1 . . . . 141 THR CB . 17703 1 848 . 1 1 141 141 THR N N 15 116.424 0.300 . 1 . . . . 141 THR N . 17703 1 849 . 1 1 142 142 SER H H 1 8.229 0.020 . 1 . . . . 142 SER H . 17703 1 850 . 1 1 142 142 SER C C 13 174.155 0.300 . 1 . . . . 142 SER C . 17703 1 851 . 1 1 142 142 SER CA C 13 57.963 0.300 . 1 . . . . 142 SER CA . 17703 1 852 . 1 1 142 142 SER CB C 13 63.155 0.300 . 1 . . . . 142 SER CB . 17703 1 853 . 1 1 142 142 SER N N 15 118.258 0.300 . 1 . . . . 142 SER N . 17703 1 854 . 1 1 143 143 ASP H H 1 8.213 0.020 . 1 . . . . 143 ASP H . 17703 1 855 . 1 1 143 143 ASP C C 13 175.683 0.300 . 1 . . . . 143 ASP C . 17703 1 856 . 1 1 143 143 ASP CA C 13 53.864 0.300 . 1 . . . . 143 ASP CA . 17703 1 857 . 1 1 143 143 ASP CB C 13 40.367 0.300 . 1 . . . . 143 ASP CB . 17703 1 858 . 1 1 143 143 ASP N N 15 123.199 0.300 . 1 . . . . 143 ASP N . 17703 1 859 . 1 1 144 144 ALA H H 1 8.025 0.020 . 1 . . . . 144 ALA H . 17703 1 860 . 1 1 144 144 ALA C C 13 177.532 0.300 . 1 . . . . 144 ALA C . 17703 1 861 . 1 1 144 144 ALA CA C 13 51.865 0.300 . 1 . . . . 144 ALA CA . 17703 1 862 . 1 1 144 144 ALA CB C 13 17.910 0.300 . 1 . . . . 144 ALA CB . 17703 1 863 . 1 1 144 144 ALA N N 15 124.487 0.300 . 1 . . . . 144 ALA N . 17703 1 864 . 1 1 145 145 VAL H H 1 7.986 0.020 . 1 . . . . 145 VAL H . 17703 1 865 . 1 1 145 145 VAL HG21 H 1 0.812 0.020 . 1 . . . . 145 VAL HG2 . 17703 1 866 . 1 1 145 145 VAL HG22 H 1 0.812 0.020 . 1 . . . . 145 VAL HG2 . 17703 1 867 . 1 1 145 145 VAL HG23 H 1 0.812 0.020 . 1 . . . . 145 VAL HG2 . 17703 1 868 . 1 1 145 145 VAL C C 13 176.043 0.300 . 1 . . . . 145 VAL C . 17703 1 869 . 1 1 145 145 VAL CA C 13 61.733 0.300 . 1 . . . . 145 VAL CA . 17703 1 870 . 1 1 145 145 VAL CB C 13 31.370 0.300 . 1 . . . . 145 VAL CB . 17703 1 871 . 1 1 145 145 VAL CG2 C 13 20.858 0.300 . 1 . . . . 145 VAL CG2 . 17703 1 872 . 1 1 145 145 VAL N N 15 120.303 0.300 . 1 . . . . 145 VAL N . 17703 1 873 . 1 1 146 146 GLN H H 1 8.337 0.020 . 1 . . . . 146 GLN H . 17703 1 874 . 1 1 146 146 GLN C C 13 175.320 0.300 . 1 . . . . 146 GLN C . 17703 1 875 . 1 1 146 146 GLN CA C 13 54.894 0.300 . 1 . . . . 146 GLN CA . 17703 1 876 . 1 1 146 146 GLN CB C 13 28.395 0.300 . 1 . . . . 146 GLN CB . 17703 1 877 . 1 1 146 146 GLN N N 15 124.575 0.300 . 1 . . . . 146 GLN N . 17703 1 878 . 1 1 147 147 ASP H H 1 8.288 0.020 . 1 . . . . 147 ASP H . 17703 1 879 . 1 1 147 147 ASP C C 13 175.660 0.300 . 1 . . . . 147 ASP C . 17703 1 880 . 1 1 147 147 ASP CA C 13 53.747 0.300 . 1 . . . . 147 ASP CA . 17703 1 881 . 1 1 147 147 ASP CB C 13 40.367 0.300 . 1 . . . . 147 ASP CB . 17703 1 882 . 1 1 147 147 ASP N N 15 122.685 0.300 . 1 . . . . 147 ASP N . 17703 1 883 . 1 1 148 148 ASN H H 1 8.291 0.020 . 1 . . . . 148 ASN H . 17703 1 884 . 1 1 148 148 ASN C C 13 174.767 0.300 . 1 . . . . 148 ASN C . 17703 1 885 . 1 1 148 148 ASN CA C 13 52.683 0.300 . 1 . . . . 148 ASN CA . 17703 1 886 . 1 1 148 148 ASN CB C 13 38.241 0.300 . 1 . . . . 148 ASN CB . 17703 1 887 . 1 1 148 148 ASN N N 15 119.712 0.300 . 1 . . . . 148 ASN N . 17703 1 888 . 1 1 149 149 ASP H H 1 8.209 0.020 . 1 . . . . 149 ASP H . 17703 1 889 . 1 1 149 149 ASP C C 13 175.828 0.300 . 1 . . . . 149 ASP C . 17703 1 890 . 1 1 149 149 ASP CA C 13 53.959 0.300 . 1 . . . . 149 ASP CA . 17703 1 891 . 1 1 149 149 ASP CB C 13 40.154 0.300 . 1 . . . . 149 ASP CB . 17703 1 892 . 1 1 149 149 ASP N N 15 121.997 0.300 . 1 . . . . 149 ASP N . 17703 1 893 . 1 1 150 150 ASN H H 1 8.176 0.020 . 1 . . . . 150 ASN H . 17703 1 894 . 1 1 150 150 ASN C C 13 174.809 0.300 . 1 . . . . 150 ASN C . 17703 1 895 . 1 1 150 150 ASN CA C 13 52.719 0.300 . 1 . . . . 150 ASN CA . 17703 1 896 . 1 1 150 150 ASN CB C 13 38.312 0.300 . 1 . . . . 150 ASN CB . 17703 1 897 . 1 1 150 150 ASN N N 15 119.279 0.300 . 1 . . . . 150 ASN N . 17703 1 898 . 1 1 151 151 ASP H H 1 8.284 0.020 . 1 . . . . 151 ASP H . 17703 1 899 . 1 1 151 151 ASP C C 13 175.717 0.300 . 1 . . . . 151 ASP C . 17703 1 900 . 1 1 151 151 ASP CA C 13 53.915 0.300 . 1 . . . . 151 ASP CA . 17703 1 901 . 1 1 151 151 ASP CB C 13 40.222 0.300 . 1 . . . . 151 ASP CB . 17703 1 902 . 1 1 151 151 ASP N N 15 121.526 0.300 . 1 . . . . 151 ASP N . 17703 1 903 . 1 1 152 152 ASP H H 1 8.180 0.020 . 1 . . . . 152 ASP H . 17703 1 904 . 1 1 152 152 ASP C C 13 176.256 0.300 . 1 . . . . 152 ASP C . 17703 1 905 . 1 1 152 152 ASP CA C 13 53.856 0.300 . 1 . . . . 152 ASP CA . 17703 1 906 . 1 1 152 152 ASP CB C 13 40.084 0.300 . 1 . . . . 152 ASP CB . 17703 1 907 . 1 1 152 152 ASP N N 15 121.423 0.300 . 1 . . . . 152 ASP N . 17703 1 908 . 1 1 153 153 SER H H 1 8.221 0.020 . 1 . . . . 153 SER H . 17703 1 909 . 1 1 153 153 SER C C 13 174.100 0.300 . 1 . . . . 153 SER C . 17703 1 910 . 1 1 153 153 SER CA C 13 57.937 0.300 . 1 . . . . 153 SER CA . 17703 1 911 . 1 1 153 153 SER CB C 13 62.894 0.300 . 1 . . . . 153 SER CB . 17703 1 912 . 1 1 153 153 SER N N 15 115.689 0.300 . 1 . . . . 153 SER N . 17703 1 913 . 1 1 154 154 ILE H H 1 7.640 0.020 . 1 . . . . 154 ILE H . 17703 1 914 . 1 1 154 154 ILE HD11 H 1 0.599 0.020 . 1 . . . . 154 ILE HD1 . 17703 1 915 . 1 1 154 154 ILE HD12 H 1 0.599 0.020 . 1 . . . . 154 ILE HD1 . 17703 1 916 . 1 1 154 154 ILE HD13 H 1 0.599 0.020 . 1 . . . . 154 ILE HD1 . 17703 1 917 . 1 1 154 154 ILE C C 13 174.145 0.300 . 1 . . . . 154 ILE C . 17703 1 918 . 1 1 154 154 ILE CA C 13 58.612 0.300 . 1 . . . . 154 ILE CA . 17703 1 919 . 1 1 154 154 ILE CB C 13 38.357 0.300 . 1 . . . . 154 ILE CB . 17703 1 920 . 1 1 154 154 ILE CD1 C 13 13.708 0.300 . 1 . . . . 154 ILE CD1 . 17703 1 921 . 1 1 154 154 ILE N N 15 124.619 0.300 . 1 . . . . 154 ILE N . 17703 1 922 . 1 1 155 155 PRO C C 13 174.895 0.300 . 1 . . . . 155 PRO C . 17703 1 923 . 1 1 155 155 PRO CA C 13 63.609 0.300 . 1 . . . . 155 PRO CA . 17703 1 924 . 1 1 155 155 PRO CB C 13 30.874 0.300 . 1 . . . . 155 PRO CB . 17703 1 925 . 1 1 156 156 THR H H 1 8.486 0.020 . 1 . . . . 156 THR H . 17703 1 926 . 1 1 156 156 THR C C 13 172.992 0.300 . 1 . . . . 156 THR C . 17703 1 927 . 1 1 156 156 THR CA C 13 60.799 0.300 . 1 . . . . 156 THR CA . 17703 1 928 . 1 1 156 156 THR CB C 13 72.457 0.300 . 1 . . . . 156 THR CB . 17703 1 929 . 1 1 156 156 THR N N 15 123.089 0.300 . 1 . . . . 156 THR N . 17703 1 930 . 1 1 157 157 SER H H 1 8.291 0.020 . 1 . . . . 157 SER H . 17703 1 931 . 1 1 157 157 SER C C 13 171.431 0.300 . 1 . . . . 157 SER C . 17703 1 932 . 1 1 157 157 SER CA C 13 56.249 0.300 . 1 . . . . 157 SER CA . 17703 1 933 . 1 1 157 157 SER CB C 13 65.434 0.300 . 1 . . . . 157 SER CB . 17703 1 934 . 1 1 157 157 SER N N 15 118.301 0.300 . 1 . . . . 157 SER N . 17703 1 935 . 1 1 158 158 ALA H H 1 8.841 0.020 . 1 . . . . 158 ALA H . 17703 1 936 . 1 1 158 158 ALA C C 13 176.412 0.300 . 1 . . . . 158 ALA C . 17703 1 937 . 1 1 158 158 ALA CA C 13 49.966 0.300 . 1 . . . . 158 ALA CA . 17703 1 938 . 1 1 158 158 ALA CB C 13 19.540 0.300 . 1 . . . . 158 ALA CB . 17703 1 939 . 1 1 158 158 ALA N N 15 127.456 0.300 . 1 . . . . 158 ALA N . 17703 1 940 . 1 1 159 159 GLU H H 1 7.847 0.020 . 1 . . . . 159 GLU H . 17703 1 941 . 1 1 159 159 GLU C C 13 175.306 0.300 . 1 . . . . 159 GLU C . 17703 1 942 . 1 1 159 159 GLU CA C 13 54.319 0.300 . 1 . . . . 159 GLU CA . 17703 1 943 . 1 1 159 159 GLU CB C 13 31.724 0.300 . 1 . . . . 159 GLU CB . 17703 1 944 . 1 1 159 159 GLU N N 15 117.099 0.300 . 1 . . . . 159 GLU N . 17703 1 945 . 1 1 160 160 PHE H H 1 9.230 0.020 . 1 . . . . 160 PHE H . 17703 1 946 . 1 1 160 160 PHE C C 13 173.561 0.300 . 1 . . . . 160 PHE C . 17703 1 947 . 1 1 160 160 PHE CA C 13 56.652 0.300 . 1 . . . . 160 PHE CA . 17703 1 948 . 1 1 160 160 PHE CB C 13 37.533 0.300 . 1 . . . . 160 PHE CB . 17703 1 949 . 1 1 160 160 PHE N N 15 124.986 0.300 . 1 . . . . 160 PHE N . 17703 1 950 . 1 1 162 162 PRO C C 13 177.549 0.300 . 1 . . . . 162 PRO C . 17703 1 951 . 1 1 162 162 PRO CA C 13 63.276 0.300 . 1 . . . . 162 PRO CA . 17703 1 952 . 1 1 162 162 PRO CB C 13 30.378 0.300 . 1 . . . . 162 PRO CB . 17703 1 953 . 1 1 163 163 GLY H H 1 8.575 0.020 . 1 . . . . 163 GLY H . 17703 1 954 . 1 1 163 163 GLY C C 13 173.264 0.300 . 1 . . . . 163 GLY C . 17703 1 955 . 1 1 163 163 GLY CA C 13 44.351 0.300 . 1 . . . . 163 GLY CA . 17703 1 956 . 1 1 163 163 GLY N N 15 111.972 0.300 . 1 . . . . 163 GLY N . 17703 1 957 . 1 1 164 164 ILE H H 1 7.575 0.020 . 1 . . . . 164 ILE H . 17703 1 958 . 1 1 164 164 ILE HD11 H 1 0.523 0.020 . 1 . . . . 164 ILE HD1 . 17703 1 959 . 1 1 164 164 ILE HD12 H 1 0.523 0.020 . 1 . . . . 164 ILE HD1 . 17703 1 960 . 1 1 164 164 ILE HD13 H 1 0.523 0.020 . 1 . . . . 164 ILE HD1 . 17703 1 961 . 1 1 164 164 ILE C C 13 175.362 0.300 . 1 . . . . 164 ILE C . 17703 1 962 . 1 1 164 164 ILE CA C 13 56.682 0.300 . 1 . . . . 164 ILE CA . 17703 1 963 . 1 1 164 164 ILE CB C 13 33.849 0.300 . 1 . . . . 164 ILE CB . 17703 1 964 . 1 1 164 164 ILE CD1 C 13 8.709 0.300 . 1 . . . . 164 ILE CD1 . 17703 1 965 . 1 1 164 164 ILE N N 15 122.817 0.300 . 1 . . . . 164 ILE N . 17703 1 966 . 1 1 165 165 SER H H 1 8.644 0.020 . 1 . . . . 165 SER H . 17703 1 967 . 1 1 165 165 SER C C 13 174.292 0.300 . 1 . . . . 165 SER C . 17703 1 968 . 1 1 165 165 SER CA C 13 54.743 0.300 . 1 . . . . 165 SER CA . 17703 1 969 . 1 1 165 165 SER CB C 13 63.248 0.300 . 1 . . . . 165 SER CB . 17703 1 970 . 1 1 165 165 SER N N 15 122.181 0.300 . 1 . . . . 165 SER N . 17703 1 971 . 1 1 166 166 PRO C C 13 176.725 0.300 . 1 . . . . 166 PRO C . 17703 1 972 . 1 1 166 166 PRO CA C 13 61.703 0.300 . 1 . . . . 166 PRO CA . 17703 1 973 . 1 1 166 166 PRO CB C 13 31.653 0.300 . 1 . . . . 166 PRO CB . 17703 1 974 . 1 1 167 167 THR H H 1 7.427 0.020 . 1 . . . . 167 THR H . 17703 1 975 . 1 1 167 167 THR C C 13 175.419 0.300 . 1 . . . . 167 THR C . 17703 1 976 . 1 1 167 167 THR CA C 13 60.439 0.300 . 1 . . . . 167 THR CA . 17703 1 977 . 1 1 167 167 THR CB C 13 67.711 0.300 . 1 . . . . 167 THR CB . 17703 1 978 . 1 1 167 167 THR N N 15 106.805 0.300 . 1 . . . . 167 THR N . 17703 1 979 . 1 1 168 168 GLU H H 1 6.402 0.020 . 1 . . . . 168 GLU H . 17703 1 980 . 1 1 168 168 GLU C C 13 173.958 0.300 . 1 . . . . 168 GLU C . 17703 1 981 . 1 1 168 168 GLU CA C 13 54.652 0.300 . 1 . . . . 168 GLU CA . 17703 1 982 . 1 1 168 168 GLU CB C 13 28.465 0.300 . 1 . . . . 168 GLU CB . 17703 1 983 . 1 1 168 168 GLU N N 15 124.439 0.300 . 1 . . . . 168 GLU N . 17703 1 984 . 1 1 169 169 ASN H H 1 8.723 0.020 . 1 . . . . 169 ASN H . 17703 1 985 . 1 1 169 169 ASN C C 13 175.674 0.300 . 1 . . . . 169 ASN C . 17703 1 986 . 1 1 169 169 ASN CA C 13 49.835 0.300 . 1 . . . . 169 ASN CA . 17703 1 987 . 1 1 169 169 ASN CB C 13 34.983 0.300 . 1 . . . . 169 ASN CB . 17703 1 988 . 1 1 169 169 ASN N N 15 123.071 0.300 . 1 . . . . 169 ASN N . 17703 1 989 . 1 1 170 170 TRP H H 1 8.769 0.020 . 1 . . . . 170 TRP H . 17703 1 990 . 1 1 170 170 TRP HE1 H 1 10.382 0.020 . 1 . . . . 170 TRP HE1 . 17703 1 991 . 1 1 170 170 TRP C C 13 177.998 0.300 . 1 . . . . 170 TRP C . 17703 1 992 . 1 1 170 170 TRP CA C 13 59.500 0.300 . 1 . . . . 170 TRP CA . 17703 1 993 . 1 1 170 170 TRP CB C 13 28.111 0.300 . 1 . . . . 170 TRP CB . 17703 1 994 . 1 1 170 170 TRP N N 15 128.988 0.300 . 1 . . . . 170 TRP N . 17703 1 995 . 1 1 170 170 TRP NE1 N 15 130.592 0.300 . 1 . . . . 170 TRP NE1 . 17703 1 996 . 1 1 171 171 VAL H H 1 7.436 0.020 . 1 . . . . 171 VAL H . 17703 1 997 . 1 1 171 171 VAL HG11 H 1 0.828 0.020 . 1 . . . . 171 VAL HG1 . 17703 1 998 . 1 1 171 171 VAL HG12 H 1 0.828 0.020 . 1 . . . . 171 VAL HG1 . 17703 1 999 . 1 1 171 171 VAL HG13 H 1 0.828 0.020 . 1 . . . . 171 VAL HG1 . 17703 1 1000 . 1 1 171 171 VAL HG21 H 1 0.949 0.020 . 1 . . . . 171 VAL HG2 . 17703 1 1001 . 1 1 171 171 VAL HG22 H 1 0.949 0.020 . 1 . . . . 171 VAL HG2 . 17703 1 1002 . 1 1 171 171 VAL HG23 H 1 0.949 0.020 . 1 . . . . 171 VAL HG2 . 17703 1 1003 . 1 1 171 171 VAL C C 13 179.985 0.300 . 1 . . . . 171 VAL C . 17703 1 1004 . 1 1 171 171 VAL CA C 13 65.165 0.300 . 1 . . . . 171 VAL CA . 17703 1 1005 . 1 1 171 171 VAL CB C 13 31.157 0.300 . 1 . . . . 171 VAL CB . 17703 1 1006 . 1 1 171 171 VAL CG1 C 13 20.315 0.300 . 1 . . . . 171 VAL CG1 . 17703 1 1007 . 1 1 171 171 VAL CG2 C 13 22.235 0.300 . 1 . . . . 171 VAL CG2 . 17703 1 1008 . 1 1 171 171 VAL N N 15 119.871 0.300 . 1 . . . . 171 VAL N . 17703 1 1009 . 1 1 172 172 GLY H H 1 7.801 0.020 . 1 . . . . 172 GLY H . 17703 1 1010 . 1 1 172 172 GLY C C 13 176.440 0.300 . 1 . . . . 172 GLY C . 17703 1 1011 . 1 1 172 172 GLY CA C 13 46.744 0.300 . 1 . . . . 172 GLY CA . 17703 1 1012 . 1 1 172 172 GLY N N 15 110.098 0.300 . 1 . . . . 172 GLY N . 17703 1 1013 . 1 1 173 173 LYS H H 1 7.980 0.020 . 1 . . . . 173 LYS H . 17703 1 1014 . 1 1 173 173 LYS C C 13 179.865 0.300 . 1 . . . . 173 LYS C . 17703 1 1015 . 1 1 173 173 LYS CA C 13 58.761 0.300 . 1 . . . . 173 LYS CA . 17703 1 1016 . 1 1 173 173 LYS CB C 13 30.266 0.300 . 1 . . . . 173 LYS CB . 17703 1 1017 . 1 1 173 173 LYS N N 15 123.784 0.300 . 1 . . . . 173 LYS N . 17703 1 1018 . 1 1 174 174 LEU H H 1 8.631 0.020 . 1 . . . . 174 LEU H . 17703 1 1019 . 1 1 174 174 LEU HD11 H 1 0.959 0.020 . 1 . . . . 174 LEU HD1 . 17703 1 1020 . 1 1 174 174 LEU HD12 H 1 0.959 0.020 . 1 . . . . 174 LEU HD1 . 17703 1 1021 . 1 1 174 174 LEU HD13 H 1 0.959 0.020 . 1 . . . . 174 LEU HD1 . 17703 1 1022 . 1 1 174 174 LEU HD21 H 1 1.046 0.020 . 1 . . . . 174 LEU HD2 . 17703 1 1023 . 1 1 174 174 LEU HD22 H 1 1.046 0.020 . 1 . . . . 174 LEU HD2 . 17703 1 1024 . 1 1 174 174 LEU HD23 H 1 1.046 0.020 . 1 . . . . 174 LEU HD2 . 17703 1 1025 . 1 1 174 174 LEU C C 13 178.468 0.300 . 1 . . . . 174 LEU C . 17703 1 1026 . 1 1 174 174 LEU CA C 13 57.253 0.300 . 1 . . . . 174 LEU CA . 17703 1 1027 . 1 1 174 174 LEU CB C 13 40.792 0.300 . 1 . . . . 174 LEU CB . 17703 1 1028 . 1 1 174 174 LEU CD1 C 13 23.052 0.300 . 1 . . . . 174 LEU CD1 . 17703 1 1029 . 1 1 174 174 LEU CD2 C 13 25.496 0.300 . 1 . . . . 174 LEU CD2 . 17703 1 1030 . 1 1 174 174 LEU N N 15 122.400 0.300 . 1 . . . . 174 LEU N . 17703 1 1031 . 1 1 175 175 GLN H H 1 8.059 0.020 . 1 . . . . 175 GLN H . 17703 1 1032 . 1 1 175 175 GLN C C 13 179.106 0.300 . 1 . . . . 175 GLN C . 17703 1 1033 . 1 1 175 175 GLN CA C 13 58.500 0.300 . 1 . . . . 175 GLN CA . 17703 1 1034 . 1 1 175 175 GLN CB C 13 26.624 0.300 . 1 . . . . 175 GLN CB . 17703 1 1035 . 1 1 175 175 GLN N N 15 121.515 0.300 . 1 . . . . 175 GLN N . 17703 1 1036 . 1 1 176 176 GLU H H 1 8.336 0.020 . 1 . . . . 176 GLU H . 17703 1 1037 . 1 1 176 176 GLU C C 13 178.351 0.300 . 1 . . . . 176 GLU C . 17703 1 1038 . 1 1 176 176 GLU CA C 13 58.863 0.300 . 1 . . . . 176 GLU CA . 17703 1 1039 . 1 1 176 176 GLU CB C 13 28.341 0.300 . 1 . . . . 176 GLU CB . 17703 1 1040 . 1 1 176 176 GLU N N 15 121.629 0.300 . 1 . . . . 176 GLU N . 17703 1 1041 . 1 1 177 177 LYS H H 1 8.207 0.020 . 1 . . . . 177 LYS H . 17703 1 1042 . 1 1 177 177 LYS C C 13 178.883 0.300 . 1 . . . . 177 LYS C . 17703 1 1043 . 1 1 177 177 LYS CA C 13 58.612 0.300 . 1 . . . . 177 LYS CA . 17703 1 1044 . 1 1 177 177 LYS CB C 13 30.966 0.300 . 1 . . . . 177 LYS CB . 17703 1 1045 . 1 1 177 177 LYS N N 15 121.385 0.300 . 1 . . . . 177 LYS N . 17703 1 1046 . 1 1 178 178 SER H H 1 8.428 0.020 . 1 . . . . 178 SER H . 17703 1 1047 . 1 1 178 178 SER C C 13 175.123 0.300 . 1 . . . . 178 SER C . 17703 1 1048 . 1 1 178 178 SER CA C 13 61.530 0.300 . 1 . . . . 178 SER CA . 17703 1 1049 . 1 1 178 178 SER CB C 13 62.256 0.300 . 1 . . . . 178 SER CB . 17703 1 1050 . 1 1 178 178 SER N N 15 115.948 0.300 . 1 . . . . 178 SER N . 17703 1 1051 . 1 1 179 179 GLN H H 1 7.737 0.020 . 1 . . . . 179 GLN H . 17703 1 1052 . 1 1 179 179 GLN C C 13 179.574 0.300 . 1 . . . . 179 GLN C . 17703 1 1053 . 1 1 179 179 GLN CA C 13 57.861 0.300 . 1 . . . . 179 GLN CA . 17703 1 1054 . 1 1 179 179 GLN CB C 13 27.474 0.300 . 1 . . . . 179 GLN CB . 17703 1 1055 . 1 1 179 179 GLN N N 15 121.448 0.300 . 1 . . . . 179 GLN N . 17703 1 1056 . 1 1 180 180 LYS H H 1 8.463 0.020 . 1 . . . . 180 LYS H . 17703 1 1057 . 1 1 180 180 LYS C C 13 178.454 0.300 . 1 . . . . 180 LYS C . 17703 1 1058 . 1 1 180 180 LYS CA C 13 58.376 0.300 . 1 . . . . 180 LYS CA . 17703 1 1059 . 1 1 180 180 LYS CB C 13 31.370 0.300 . 1 . . . . 180 LYS CB . 17703 1 1060 . 1 1 180 180 LYS N N 15 121.226 0.300 . 1 . . . . 180 LYS N . 17703 1 1061 . 1 1 181 181 SER H H 1 7.973 0.020 . 1 . . . . 181 SER H . 17703 1 1062 . 1 1 181 181 SER C C 13 171.945 0.300 . 1 . . . . 181 SER C . 17703 1 1063 . 1 1 181 181 SER CA C 13 58.287 0.300 . 1 . . . . 181 SER CA . 17703 1 1064 . 1 1 181 181 SER CB C 13 63.319 0.300 . 1 . . . . 181 SER CB . 17703 1 1065 . 1 1 181 181 SER N N 15 112.898 0.300 . 1 . . . . 181 SER N . 17703 1 1066 . 1 1 182 182 LYS H H 1 7.555 0.020 . 1 . . . . 182 LYS H . 17703 1 1067 . 1 1 182 182 LYS C C 13 175.291 0.300 . 1 . . . . 182 LYS C . 17703 1 1068 . 1 1 182 182 LYS CA C 13 56.470 0.300 . 1 . . . . 182 LYS CA . 17703 1 1069 . 1 1 182 182 LYS CB C 13 27.332 0.300 . 1 . . . . 182 LYS CB . 17703 1 1070 . 1 1 182 182 LYS N N 15 118.016 0.300 . 1 . . . . 182 LYS N . 17703 1 1071 . 1 1 183 183 LEU H H 1 8.274 0.020 . 1 . . . . 183 LEU H . 17703 1 1072 . 1 1 183 183 LEU HD11 H 1 0.648 0.020 . 1 . . . . 183 LEU HD1 . 17703 1 1073 . 1 1 183 183 LEU HD12 H 1 0.648 0.020 . 1 . . . . 183 LEU HD1 . 17703 1 1074 . 1 1 183 183 LEU HD13 H 1 0.648 0.020 . 1 . . . . 183 LEU HD1 . 17703 1 1075 . 1 1 183 183 LEU HD21 H 1 0.707 0.020 . 1 . . . . 183 LEU HD2 . 17703 1 1076 . 1 1 183 183 LEU HD22 H 1 0.707 0.020 . 1 . . . . 183 LEU HD2 . 17703 1 1077 . 1 1 183 183 LEU HD23 H 1 0.707 0.020 . 1 . . . . 183 LEU HD2 . 17703 1 1078 . 1 1 183 183 LEU C C 13 176.752 0.300 . 1 . . . . 183 LEU C . 17703 1 1079 . 1 1 183 183 LEU CA C 13 51.986 0.300 . 1 . . . . 183 LEU CA . 17703 1 1080 . 1 1 183 183 LEU CB C 13 43.200 0.300 . 1 . . . . 183 LEU CB . 17703 1 1081 . 1 1 183 183 LEU CD1 C 13 25.430 0.300 . 1 . . . . 183 LEU CD1 . 17703 1 1082 . 1 1 183 183 LEU CD2 C 13 21.933 0.300 . 1 . . . . 183 LEU CD2 . 17703 1 1083 . 1 1 183 183 LEU N N 15 119.293 0.300 . 1 . . . . 183 LEU N . 17703 1 1084 . 1 1 184 184 GLN H H 1 8.014 0.020 . 1 . . . . 184 GLN H . 17703 1 1085 . 1 1 184 184 GLN C C 13 174.864 0.300 . 1 . . . . 184 GLN C . 17703 1 1086 . 1 1 184 184 GLN CA C 13 55.591 0.300 . 1 . . . . 184 GLN CA . 17703 1 1087 . 1 1 184 184 GLN CB C 13 27.757 0.300 . 1 . . . . 184 GLN CB . 17703 1 1088 . 1 1 184 184 GLN N N 15 121.634 0.300 . 1 . . . . 184 GLN N . 17703 1 1089 . 1 1 185 185 ALA H H 1 8.030 0.020 . 1 . . . . 185 ALA H . 17703 1 1090 . 1 1 185 185 ALA C C 13 175.771 0.300 . 1 . . . . 185 ALA C . 17703 1 1091 . 1 1 185 185 ALA CA C 13 50.136 0.300 . 1 . . . . 185 ALA CA . 17703 1 1092 . 1 1 185 185 ALA CB C 13 16.362 0.300 . 1 . . . . 185 ALA CB . 17703 1 1093 . 1 1 185 185 ALA N N 15 126.077 0.300 . 1 . . . . 185 ALA N . 17703 1 1094 . 1 1 186 186 PRO C C 13 175.411 0.300 . 1 . . . . 186 PRO C . 17703 1 1095 . 1 1 186 186 PRO CA C 13 61.885 0.300 . 1 . . . . 186 PRO CA . 17703 1 1096 . 1 1 186 186 PRO CB C 13 31.866 0.300 . 1 . . . . 186 PRO CB . 17703 1 1097 . 1 1 187 187 ILE H H 1 8.044 0.020 . 1 . . . . 187 ILE H . 17703 1 1098 . 1 1 187 187 ILE HD11 H 1 0.746 0.020 . 1 . . . . 187 ILE HD1 . 17703 1 1099 . 1 1 187 187 ILE HD12 H 1 0.746 0.020 . 1 . . . . 187 ILE HD1 . 17703 1 1100 . 1 1 187 187 ILE HD13 H 1 0.746 0.020 . 1 . . . . 187 ILE HD1 . 17703 1 1101 . 1 1 187 187 ILE C C 13 174.426 0.300 . 1 . . . . 187 ILE C . 17703 1 1102 . 1 1 187 187 ILE CA C 13 59.106 0.300 . 1 . . . . 187 ILE CA . 17703 1 1103 . 1 1 187 187 ILE CB C 13 39.946 0.300 . 1 . . . . 187 ILE CB . 17703 1 1104 . 1 1 187 187 ILE CD1 C 13 12.988 0.300 . 1 . . . . 187 ILE CD1 . 17703 1 1105 . 1 1 187 187 ILE N N 15 121.091 0.300 . 1 . . . . 187 ILE N . 17703 1 1106 . 1 1 188 188 TYR H H 1 8.664 0.020 . 1 . . . . 188 TYR H . 17703 1 1107 . 1 1 188 188 TYR C C 13 175.759 0.300 . 1 . . . . 188 TYR C . 17703 1 1108 . 1 1 188 188 TYR CA C 13 56.046 0.300 . 1 . . . . 188 TYR CA . 17703 1 1109 . 1 1 188 188 TYR CB C 13 40.083 0.300 . 1 . . . . 188 TYR CB . 17703 1 1110 . 1 1 188 188 TYR N N 15 123.672 0.300 . 1 . . . . 188 TYR N . 17703 1 1111 . 1 1 189 189 GLU H H 1 8.914 0.020 . 1 . . . . 189 GLU H . 17703 1 1112 . 1 1 189 189 GLU C C 13 174.100 0.300 . 1 . . . . 189 GLU C . 17703 1 1113 . 1 1 189 189 GLU CA C 13 54.531 0.300 . 1 . . . . 189 GLU CA . 17703 1 1114 . 1 1 189 189 GLU CB C 13 32.716 0.300 . 1 . . . . 189 GLU CB . 17703 1 1115 . 1 1 189 189 GLU N N 15 123.030 0.300 . 1 . . . . 189 GLU N . 17703 1 1116 . 1 1 190 190 ASP H H 1 8.714 0.020 . 1 . . . . 190 ASP H . 17703 1 1117 . 1 1 190 190 ASP C C 13 174.327 0.300 . 1 . . . . 190 ASP C . 17703 1 1118 . 1 1 190 190 ASP CA C 13 52.168 0.300 . 1 . . . . 190 ASP CA . 17703 1 1119 . 1 1 190 190 ASP CB C 13 44.688 0.300 . 1 . . . . 190 ASP CB . 17703 1 1120 . 1 1 190 190 ASP N N 15 121.583 0.300 . 1 . . . . 190 ASP N . 17703 1 1121 . 1 1 191 191 SER H H 1 8.810 0.020 . 1 . . . . 191 SER H . 17703 1 1122 . 1 1 191 191 SER C C 13 171.874 0.300 . 1 . . . . 191 SER C . 17703 1 1123 . 1 1 191 191 SER CA C 13 57.227 0.300 . 1 . . . . 191 SER CA . 17703 1 1124 . 1 1 191 191 SER CB C 13 64.807 0.300 . 1 . . . . 191 SER CB . 17703 1 1125 . 1 1 191 191 SER N N 15 114.934 0.300 . 1 . . . . 191 SER N . 17703 1 1126 . 1 1 192 192 LYS H H 1 8.468 0.020 . 1 . . . . 192 LYS H . 17703 1 1127 . 1 1 192 192 LYS C C 13 175.263 0.300 . 1 . . . . 192 LYS C . 17703 1 1128 . 1 1 192 192 LYS CA C 13 54.231 0.300 . 1 . . . . 192 LYS CA . 17703 1 1129 . 1 1 192 192 LYS CB C 13 33.708 0.300 . 1 . . . . 192 LYS CB . 17703 1 1130 . 1 1 192 192 LYS N N 15 122.639 0.300 . 1 . . . . 192 LYS N . 17703 1 1131 . 1 1 193 193 ASN H H 1 8.516 0.020 . 1 . . . . 193 ASN H . 17703 1 1132 . 1 1 193 193 ASN C C 13 175.547 0.300 . 1 . . . . 193 ASN C . 17703 1 1133 . 1 1 193 193 ASN CA C 13 51.902 0.300 . 1 . . . . 193 ASN CA . 17703 1 1134 . 1 1 193 193 ASN CB C 13 38.383 0.300 . 1 . . . . 193 ASN CB . 17703 1 1135 . 1 1 193 193 ASN N N 15 125.717 0.300 . 1 . . . . 193 ASN N . 17703 1 1136 . 1 1 194 194 GLU H H 1 8.959 0.020 . 1 . . . . 194 GLU H . 17703 1 1137 . 1 1 194 194 GLU C C 13 177.183 0.300 . 1 . . . . 194 GLU C . 17703 1 1138 . 1 1 194 194 GLU CA C 13 57.712 0.300 . 1 . . . . 194 GLU CA . 17703 1 1139 . 1 1 194 194 GLU CB C 13 28.395 0.300 . 1 . . . . 194 GLU CB . 17703 1 1140 . 1 1 194 194 GLU N N 15 125.865 0.300 . 1 . . . . 194 GLU N . 17703 1 1141 . 1 1 195 195 ARG H H 1 8.214 0.020 . 1 . . . . 195 ARG H . 17703 1 1142 . 1 1 195 195 ARG C C 13 177.773 0.300 . 1 . . . . 195 ARG C . 17703 1 1143 . 1 1 195 195 ARG CA C 13 57.519 0.300 . 1 . . . . 195 ARG CA . 17703 1 1144 . 1 1 195 195 ARG CB C 13 28.890 0.300 . 1 . . . . 195 ARG CB . 17703 1 1145 . 1 1 195 195 ARG N N 15 119.005 0.300 . 1 . . . . 195 ARG N . 17703 1 1146 . 1 1 196 196 THR H H 1 7.559 0.020 . 1 . . . . 196 THR H . 17703 1 1147 . 1 1 196 196 THR C C 13 174.680 0.300 . 1 . . . . 196 THR C . 17703 1 1148 . 1 1 196 196 THR CA C 13 60.499 0.300 . 1 . . . . 196 THR CA . 17703 1 1149 . 1 1 196 196 THR CB C 13 68.986 0.300 . 1 . . . . 196 THR CB . 17703 1 1150 . 1 1 196 196 THR N N 15 108.424 0.300 . 1 . . . . 196 THR N . 17703 1 1151 . 1 1 197 197 GLU H H 1 7.857 0.020 . 1 . . . . 197 GLU H . 17703 1 1152 . 1 1 197 197 GLU C C 13 175.050 0.300 . 1 . . . . 197 GLU C . 17703 1 1153 . 1 1 197 197 GLU CA C 13 56.500 0.300 . 1 . . . . 197 GLU CA . 17703 1 1154 . 1 1 197 197 GLU CB C 13 25.915 0.300 . 1 . . . . 197 GLU CB . 17703 1 1155 . 1 1 197 197 GLU N N 15 118.543 0.300 . 1 . . . . 197 GLU N . 17703 1 1156 . 1 1 198 198 ARG H H 1 7.277 0.020 . 1 . . . . 198 ARG H . 17703 1 1157 . 1 1 198 198 ARG C C 13 174.299 0.300 . 1 . . . . 198 ARG C . 17703 1 1158 . 1 1 198 198 ARG CA C 13 53.804 0.300 . 1 . . . . 198 ARG CA . 17703 1 1159 . 1 1 198 198 ARG CB C 13 31.795 0.300 . 1 . . . . 198 ARG CB . 17703 1 1160 . 1 1 198 198 ARG N N 15 117.332 0.300 . 1 . . . . 198 ARG N . 17703 1 1161 . 1 1 199 199 PHE H H 1 8.697 0.020 . 1 . . . . 199 PHE H . 17703 1 1162 . 1 1 199 199 PHE HD1 H 1 7.119 0.020 . 1 . . . . 199 PHE HD1 . 17703 1 1163 . 1 1 199 199 PHE C C 13 173.311 0.300 . 1 . . . . 199 PHE C . 17703 1 1164 . 1 1 199 199 PHE CA C 13 57.803 0.300 . 1 . . . . 199 PHE CA . 17703 1 1165 . 1 1 199 199 PHE CB C 13 40.775 0.300 . 1 . . . . 199 PHE CB . 17703 1 1166 . 1 1 199 199 PHE N N 15 119.812 0.300 . 1 . . . . 199 PHE N . 17703 1 1167 . 1 1 200 200 LEU H H 1 8.694 0.020 . 1 . . . . 200 LEU H . 17703 1 1168 . 1 1 200 200 LEU HD11 H 1 0.687 0.020 . 1 . . . . 200 LEU HD1 . 17703 1 1169 . 1 1 200 200 LEU HD12 H 1 0.687 0.020 . 1 . . . . 200 LEU HD1 . 17703 1 1170 . 1 1 200 200 LEU HD13 H 1 0.687 0.020 . 1 . . . . 200 LEU HD1 . 17703 1 1171 . 1 1 200 200 LEU HD21 H 1 0.685 0.020 . 1 . . . . 200 LEU HD2 . 17703 1 1172 . 1 1 200 200 LEU HD22 H 1 0.685 0.020 . 1 . . . . 200 LEU HD2 . 17703 1 1173 . 1 1 200 200 LEU HD23 H 1 0.685 0.020 . 1 . . . . 200 LEU HD2 . 17703 1 1174 . 1 1 200 200 LEU C C 13 176.412 0.300 . 1 . . . . 200 LEU C . 17703 1 1175 . 1 1 200 200 LEU CA C 13 54.016 0.300 . 1 . . . . 200 LEU CA . 17703 1 1176 . 1 1 200 200 LEU CB C 13 41.854 0.300 . 1 . . . . 200 LEU CB . 17703 1 1177 . 1 1 200 200 LEU CD1 C 13 24.878 0.300 . 1 . . . . 200 LEU CD1 . 17703 1 1178 . 1 1 200 200 LEU CD2 C 13 26.662 0.300 . 1 . . . . 200 LEU CD2 . 17703 1 1179 . 1 1 200 200 LEU N N 15 122.665 0.300 . 1 . . . . 200 LEU N . 17703 1 1180 . 1 1 201 201 VAL H H 1 9.071 0.020 . 1 . . . . 201 VAL H . 17703 1 1181 . 1 1 201 201 VAL HG11 H 1 0.944 0.020 . 1 . . . . 201 VAL HG1 . 17703 1 1182 . 1 1 201 201 VAL HG12 H 1 0.944 0.020 . 1 . . . . 201 VAL HG1 . 17703 1 1183 . 1 1 201 201 VAL HG13 H 1 0.944 0.020 . 1 . . . . 201 VAL HG1 . 17703 1 1184 . 1 1 201 201 VAL HG21 H 1 0.868 0.020 . 1 . . . . 201 VAL HG2 . 17703 1 1185 . 1 1 201 201 VAL HG22 H 1 0.868 0.020 . 1 . . . . 201 VAL HG2 . 17703 1 1186 . 1 1 201 201 VAL HG23 H 1 0.868 0.020 . 1 . . . . 201 VAL HG2 . 17703 1 1187 . 1 1 201 201 VAL C C 13 173.961 0.300 . 1 . . . . 201 VAL C . 17703 1 1188 . 1 1 201 201 VAL CA C 13 60.015 0.300 . 1 . . . . 201 VAL CA . 17703 1 1189 . 1 1 201 201 VAL CB C 13 32.624 0.300 . 1 . . . . 201 VAL CB . 17703 1 1190 . 1 1 201 201 VAL CG1 C 13 21.816 0.300 . 1 . . . . 201 VAL CG1 . 17703 1 1191 . 1 1 201 201 VAL CG2 C 13 21.816 0.300 . 1 . . . . 201 VAL CG2 . 17703 1 1192 . 1 1 201 201 VAL N N 15 124.642 0.300 . 1 . . . . 201 VAL N . 17703 1 1193 . 1 1 202 202 ILE H H 1 8.900 0.020 . 1 . . . . 202 ILE H . 17703 1 1194 . 1 1 202 202 ILE HD11 H 1 0.704 0.020 . 1 . . . . 202 ILE HD1 . 17703 1 1195 . 1 1 202 202 ILE HD12 H 1 0.704 0.020 . 1 . . . . 202 ILE HD1 . 17703 1 1196 . 1 1 202 202 ILE HD13 H 1 0.704 0.020 . 1 . . . . 202 ILE HD1 . 17703 1 1197 . 1 1 202 202 ILE C C 13 175.646 0.300 . 1 . . . . 202 ILE C . 17703 1 1198 . 1 1 202 202 ILE CA C 13 58.406 0.300 . 1 . . . . 202 ILE CA . 17703 1 1199 . 1 1 202 202 ILE CB C 13 39.304 0.300 . 1 . . . . 202 ILE CB . 17703 1 1200 . 1 1 202 202 ILE CD1 C 13 13.373 0.300 . 1 . . . . 202 ILE CD1 . 17703 1 1201 . 1 1 202 202 ILE N N 15 127.312 0.300 . 1 . . . . 202 ILE N . 17703 1 1202 . 1 1 203 203 CYS H H 1 9.206 0.020 . 1 . . . . 203 CYS H . 17703 1 1203 . 1 1 203 203 CYS C C 13 173.008 0.300 . 1 . . . . 203 CYS C . 17703 1 1204 . 1 1 203 203 CYS CA C 13 56.318 0.300 . 1 . . . . 203 CYS CA . 17703 1 1205 . 1 1 203 203 CYS CB C 13 27.899 0.300 . 1 . . . . 203 CYS CB . 17703 1 1206 . 1 1 203 203 CYS N N 15 131.048 0.300 . 1 . . . . 203 CYS N . 17703 1 1207 . 1 1 204 204 THR H H 1 8.779 0.020 . 1 . . . . 204 THR H . 17703 1 1208 . 1 1 204 204 THR C C 13 174.370 0.300 . 1 . . . . 204 THR C . 17703 1 1209 . 1 1 204 204 THR CA C 13 60.772 0.300 . 1 . . . . 204 THR CA . 17703 1 1210 . 1 1 204 204 THR CB C 13 69.199 0.300 . 1 . . . . 204 THR CB . 17703 1 1211 . 1 1 204 204 THR N N 15 124.615 0.300 . 1 . . . . 204 THR N . 17703 1 1212 . 1 1 205 205 MET H H 1 8.644 0.020 . 1 . . . . 205 MET H . 17703 1 1213 . 1 1 205 205 MET C C 13 174.086 0.300 . 1 . . . . 205 MET C . 17703 1 1214 . 1 1 205 205 MET CA C 13 55.531 0.300 . 1 . . . . 205 MET CA . 17703 1 1215 . 1 1 205 205 MET CB C 13 33.495 0.300 . 1 . . . . 205 MET CB . 17703 1 1216 . 1 1 205 205 MET N N 15 127.382 0.300 . 1 . . . . 205 MET N . 17703 1 1217 . 1 1 206 206 CYS H H 1 9.237 0.020 . 1 . . . . 206 CYS H . 17703 1 1218 . 1 1 206 206 CYS C C 13 173.823 0.300 . 1 . . . . 206 CYS C . 17703 1 1219 . 1 1 206 206 CYS CA C 13 59.863 0.300 . 1 . . . . 206 CYS CA . 17703 1 1220 . 1 1 206 206 CYS CB C 13 24.994 0.300 . 1 . . . . 206 CYS CB . 17703 1 1221 . 1 1 206 206 CYS N N 15 122.519 0.300 . 1 . . . . 206 CYS N . 17703 1 1222 . 1 1 207 207 ASN H H 1 8.749 0.020 . 1 . . . . 207 ASN H . 17703 1 1223 . 1 1 207 207 ASN C C 13 173.249 0.300 . 1 . . . . 207 ASN C . 17703 1 1224 . 1 1 207 207 ASN CA C 13 53.804 0.300 . 1 . . . . 207 ASN CA . 17703 1 1225 . 1 1 207 207 ASN CB C 13 37.108 0.300 . 1 . . . . 207 ASN CB . 17703 1 1226 . 1 1 207 207 ASN N N 15 113.021 0.300 . 1 . . . . 207 ASN N . 17703 1 1227 . 1 1 208 208 GLN H H 1 7.992 0.020 . 1 . . . . 208 GLN H . 17703 1 1228 . 1 1 208 208 GLN HE21 H 1 7.065 0.020 . 1 . . . . 208 GLN HE21 . 17703 1 1229 . 1 1 208 208 GLN HE22 H 1 7.065 0.020 . 1 . . . . 208 GLN HE22 . 17703 1 1230 . 1 1 208 208 GLN C C 13 173.285 0.300 . 1 . . . . 208 GLN C . 17703 1 1231 . 1 1 208 208 GLN CA C 13 53.561 0.300 . 1 . . . . 208 GLN CA . 17703 1 1232 . 1 1 208 208 GLN CB C 13 30.166 0.300 . 1 . . . . 208 GLN CB . 17703 1 1233 . 1 1 208 208 GLN N N 15 119.926 0.300 . 1 . . . . 208 GLN N . 17703 1 1234 . 1 1 209 209 LYS H H 1 7.771 0.020 . 1 . . . . 209 LYS H . 17703 1 1235 . 1 1 209 209 LYS C C 13 175.660 0.300 . 1 . . . . 209 LYS C . 17703 1 1236 . 1 1 209 209 LYS CA C 13 54.379 0.300 . 1 . . . . 209 LYS CA . 17703 1 1237 . 1 1 209 209 LYS CB C 13 36.683 0.300 . 1 . . . . 209 LYS CB . 17703 1 1238 . 1 1 209 209 LYS N N 15 119.942 0.300 . 1 . . . . 209 LYS N . 17703 1 1239 . 1 1 210 210 THR H H 1 8.779 0.020 . 1 . . . . 210 THR H . 17703 1 1240 . 1 1 210 210 THR C C 13 173.203 0.300 . 1 . . . . 210 THR C . 17703 1 1241 . 1 1 210 210 THR CA C 13 59.681 0.300 . 1 . . . . 210 THR CA . 17703 1 1242 . 1 1 210 210 THR CB C 13 71.466 0.300 . 1 . . . . 210 THR CB . 17703 1 1243 . 1 1 210 210 THR N N 15 111.409 0.300 . 1 . . . . 210 THR N . 17703 1 1244 . 1 1 211 211 ARG H H 1 8.511 0.020 . 1 . . . . 211 ARG H . 17703 1 1245 . 1 1 211 211 ARG C C 13 173.311 0.300 . 1 . . . . 211 ARG C . 17703 1 1246 . 1 1 211 211 ARG CA C 13 54.142 0.300 . 1 . . . . 211 ARG CA . 17703 1 1247 . 1 1 211 211 ARG CB C 13 32.787 0.300 . 1 . . . . 211 ARG CB . 17703 1 1248 . 1 1 211 211 ARG N N 15 120.129 0.300 . 1 . . . . 211 ARG N . 17703 1 1249 . 1 1 212 212 GLY H H 1 8.958 0.020 . 1 . . . . 212 GLY H . 17703 1 1250 . 1 1 212 212 GLY C C 13 172.399 0.300 . 1 . . . . 212 GLY C . 17703 1 1251 . 1 1 212 212 GLY CA C 13 42.381 0.300 . 1 . . . . 212 GLY CA . 17703 1 1252 . 1 1 212 212 GLY N N 15 112.548 0.300 . 1 . . . . 212 GLY N . 17703 1 1253 . 1 1 213 213 ILE H H 1 8.100 0.020 . 1 . . . . 213 ILE H . 17703 1 1254 . 1 1 213 213 ILE HD11 H 1 0.574 0.020 . 1 . . . . 213 ILE HD1 . 17703 1 1255 . 1 1 213 213 ILE HD12 H 1 0.574 0.020 . 1 . . . . 213 ILE HD1 . 17703 1 1256 . 1 1 213 213 ILE HD13 H 1 0.574 0.020 . 1 . . . . 213 ILE HD1 . 17703 1 1257 . 1 1 213 213 ILE C C 13 176.547 0.300 . 1 . . . . 213 ILE C . 17703 1 1258 . 1 1 213 213 ILE CA C 13 59.621 0.300 . 1 . . . . 213 ILE CA . 17703 1 1259 . 1 1 213 213 ILE CB C 13 39.393 0.300 . 1 . . . . 213 ILE CB . 17703 1 1260 . 1 1 213 213 ILE CD1 C 13 13.942 0.300 . 1 . . . . 213 ILE CD1 . 17703 1 1261 . 1 1 213 213 ILE N N 15 123.768 0.300 . 1 . . . . 213 ILE N . 17703 1 1262 . 1 1 214 214 ARG H H 1 8.512 0.020 . 1 . . . . 214 ARG H . 17703 1 1263 . 1 1 214 214 ARG C C 13 176.100 0.300 . 1 . . . . 214 ARG C . 17703 1 1264 . 1 1 214 214 ARG CA C 13 51.683 0.300 . 1 . . . . 214 ARG CA . 17703 1 1265 . 1 1 214 214 ARG CB C 13 34.345 0.300 . 1 . . . . 214 ARG CB . 17703 1 1266 . 1 1 214 214 ARG N N 15 121.124 0.300 . 1 . . . . 214 ARG N . 17703 1 1267 . 1 1 215 215 SER C C 13 173.395 0.300 . 1 . . . . 215 SER C . 17703 1 1268 . 1 1 215 215 SER CA C 13 61.098 0.300 . 1 . . . . 215 SER CA . 17703 1 1269 . 1 1 215 215 SER CB C 13 62.740 0.300 . 1 . . . . 215 SER CB . 17703 1 1270 . 1 1 216 216 LYS H H 1 7.622 0.020 . 1 . . . . 216 LYS H . 17703 1 1271 . 1 1 216 216 LYS C C 13 176.547 0.300 . 1 . . . . 216 LYS C . 17703 1 1272 . 1 1 216 216 LYS CA C 13 53.838 0.300 . 1 . . . . 216 LYS CA . 17703 1 1273 . 1 1 216 216 LYS CB C 13 32.831 0.300 . 1 . . . . 216 LYS CB . 17703 1 1274 . 1 1 216 216 LYS N N 15 118.280 0.300 . 1 . . . . 216 LYS N . 17703 1 1275 . 1 1 217 217 LYS H H 1 8.350 0.020 . 1 . . . . 217 LYS H . 17703 1 1276 . 1 1 217 217 LYS C C 13 177.730 0.300 . 1 . . . . 217 LYS C . 17703 1 1277 . 1 1 217 217 LYS CA C 13 60.136 0.300 . 1 . . . . 217 LYS CA . 17703 1 1278 . 1 1 217 217 LYS CB C 13 29.811 0.300 . 1 . . . . 217 LYS CB . 17703 1 1279 . 1 1 217 217 LYS N N 15 129.559 0.300 . 1 . . . . 217 LYS N . 17703 1 1280 . 1 1 218 218 LYS H H 1 8.713 0.020 . 1 . . . . 218 LYS H . 17703 1 1281 . 1 1 218 218 LYS C C 13 178.546 0.300 . 1 . . . . 218 LYS C . 17703 1 1282 . 1 1 218 218 LYS CA C 13 58.712 0.300 . 1 . . . . 218 LYS CA . 17703 1 1283 . 1 1 218 218 LYS CB C 13 30.690 0.300 . 1 . . . . 218 LYS CB . 17703 1 1284 . 1 1 218 218 LYS N N 15 117.320 0.300 . 1 . . . . 218 LYS N . 17703 1 1285 . 1 1 219 219 ASP H H 1 6.517 0.020 . 1 . . . . 219 ASP H . 17703 1 1286 . 1 1 219 219 ASP C C 13 176.965 0.300 . 1 . . . . 219 ASP C . 17703 1 1287 . 1 1 219 219 ASP CA C 13 55.743 0.300 . 1 . . . . 219 ASP CA . 17703 1 1288 . 1 1 219 219 ASP CB C 13 39.871 0.300 . 1 . . . . 219 ASP CB . 17703 1 1289 . 1 1 219 219 ASP N N 15 119.568 0.300 . 1 . . . . 219 ASP N . 17703 1 1290 . 1 1 220 220 ALA H H 1 7.959 0.020 . 1 . . . . 220 ALA H . 17703 1 1291 . 1 1 220 220 ALA C C 13 178.413 0.300 . 1 . . . . 220 ALA C . 17703 1 1292 . 1 1 220 220 ALA CA C 13 54.949 0.300 . 1 . . . . 220 ALA CA . 17703 1 1293 . 1 1 220 220 ALA CB C 13 17.566 0.300 . 1 . . . . 220 ALA CB . 17703 1 1294 . 1 1 220 220 ALA N N 15 123.866 0.300 . 1 . . . . 220 ALA N . 17703 1 1295 . 1 1 221 221 LYS H H 1 8.234 0.020 . 1 . . . . 221 LYS H . 17703 1 1296 . 1 1 221 221 LYS C C 13 176.712 0.300 . 1 . . . . 221 LYS C . 17703 1 1297 . 1 1 221 221 LYS CA C 13 58.760 0.300 . 1 . . . . 221 LYS CA . 17703 1 1298 . 1 1 221 221 LYS CB C 13 31.795 0.300 . 1 . . . . 221 LYS CB . 17703 1 1299 . 1 1 221 221 LYS N N 15 118.925 0.300 . 1 . . . . 221 LYS N . 17703 1 1300 . 1 1 222 222 ASN H H 1 7.734 0.020 . 1 . . . . 222 ASN H . 17703 1 1301 . 1 1 222 222 ASN C C 13 176.989 0.300 . 1 . . . . 222 ASN C . 17703 1 1302 . 1 1 222 222 ASN CA C 13 55.451 0.300 . 1 . . . . 222 ASN CA . 17703 1 1303 . 1 1 222 222 ASN CB C 13 38.703 0.300 . 1 . . . . 222 ASN CB . 17703 1 1304 . 1 1 222 222 ASN N N 15 118.189 0.300 . 1 . . . . 222 ASN N . 17703 1 1305 . 1 1 223 223 LEU H H 1 8.267 0.020 . 1 . . . . 223 LEU H . 17703 1 1306 . 1 1 223 223 LEU HD11 H 1 -0.053 0.020 . 1 . . . . 223 LEU HD1 . 17703 1 1307 . 1 1 223 223 LEU HD12 H 1 -0.053 0.020 . 1 . . . . 223 LEU HD1 . 17703 1 1308 . 1 1 223 223 LEU HD13 H 1 -0.053 0.020 . 1 . . . . 223 LEU HD1 . 17703 1 1309 . 1 1 223 223 LEU HD21 H 1 0.245 0.020 . 1 . . . . 223 LEU HD2 . 17703 1 1310 . 1 1 223 223 LEU HD22 H 1 0.245 0.020 . 1 . . . . 223 LEU HD2 . 17703 1 1311 . 1 1 223 223 LEU HD23 H 1 0.245 0.020 . 1 . . . . 223 LEU HD2 . 17703 1 1312 . 1 1 223 223 LEU C C 13 177.501 0.300 . 1 . . . . 223 LEU C . 17703 1 1313 . 1 1 223 223 LEU CA C 13 56.591 0.300 . 1 . . . . 223 LEU CA . 17703 1 1314 . 1 1 223 223 LEU CB C 13 39.877 0.300 . 1 . . . . 223 LEU CB . 17703 1 1315 . 1 1 223 223 LEU CD1 C 13 20.100 0.300 . 1 . . . . 223 LEU CD1 . 17703 1 1316 . 1 1 223 223 LEU CD2 C 13 26.721 0.300 . 1 . . . . 223 LEU CD2 . 17703 1 1317 . 1 1 223 223 LEU N N 15 120.287 0.300 . 1 . . . . 223 LEU N . 17703 1 1318 . 1 1 224 224 ALA H H 1 8.250 0.020 . 1 . . . . 224 ALA H . 17703 1 1319 . 1 1 224 224 ALA C C 13 180.501 0.300 . 1 . . . . 224 ALA C . 17703 1 1320 . 1 1 224 224 ALA CA C 13 55.215 0.300 . 1 . . . . 224 ALA CA . 17703 1 1321 . 1 1 224 224 ALA CB C 13 16.806 0.300 . 1 . . . . 224 ALA CB . 17703 1 1322 . 1 1 224 224 ALA N N 15 122.439 0.300 . 1 . . . . 224 ALA N . 17703 1 1323 . 1 1 225 225 ALA H H 1 8.512 0.020 . 1 . . . . 225 ALA H . 17703 1 1324 . 1 1 225 225 ALA C C 13 178.925 0.300 . 1 . . . . 225 ALA C . 17703 1 1325 . 1 1 225 225 ALA CA C 13 54.319 0.300 . 1 . . . . 225 ALA CA . 17703 1 1326 . 1 1 225 225 ALA CB C 13 17.704 0.300 . 1 . . . . 225 ALA CB . 17703 1 1327 . 1 1 225 225 ALA N N 15 120.368 0.300 . 1 . . . . 225 ALA N . 17703 1 1328 . 1 1 226 226 TRP H H 1 8.419 0.020 . 1 . . . . 226 TRP H . 17703 1 1329 . 1 1 226 226 TRP HE1 H 1 9.743 0.020 . 1 . . . . 226 TRP HE1 . 17703 1 1330 . 1 1 226 226 TRP CA C 13 54.319 0.300 . 1 . . . . 226 TRP CA . 17703 1 1331 . 1 1 226 226 TRP N N 15 121.963 0.300 . 1 . . . . 226 TRP N . 17703 1 1332 . 1 1 226 226 TRP NE1 N 15 129.111 0.300 . 1 . . . . 226 TRP NE1 . 17703 1 1333 . 1 1 227 227 LEU HD11 H 1 0.662 0.020 . 1 . . . . 227 LEU HD1 . 17703 1 1334 . 1 1 227 227 LEU HD12 H 1 0.662 0.020 . 1 . . . . 227 LEU HD1 . 17703 1 1335 . 1 1 227 227 LEU HD13 H 1 0.662 0.020 . 1 . . . . 227 LEU HD1 . 17703 1 1336 . 1 1 227 227 LEU HD21 H 1 0.666 0.020 . 1 . . . . 227 LEU HD2 . 17703 1 1337 . 1 1 227 227 LEU HD22 H 1 0.666 0.020 . 1 . . . . 227 LEU HD2 . 17703 1 1338 . 1 1 227 227 LEU HD23 H 1 0.666 0.020 . 1 . . . . 227 LEU HD2 . 17703 1 1339 . 1 1 227 227 LEU CD1 C 13 27.151 0.300 . 1 . . . . 227 LEU CD1 . 17703 1 1340 . 1 1 227 227 LEU CD2 C 13 24.146 0.300 . 1 . . . . 227 LEU CD2 . 17703 1 1341 . 1 1 228 228 MET C C 13 176.553 0.300 . 1 . . . . 228 MET C . 17703 1 1342 . 1 1 228 228 MET CA C 13 55.532 0.300 . 1 . . . . 228 MET CA . 17703 1 1343 . 1 1 228 228 MET CB C 13 28.111 0.300 . 1 . . . . 228 MET CB . 17703 1 1344 . 1 1 229 229 TRP H H 1 8.974 0.020 . 1 . . . . 229 TRP H . 17703 1 1345 . 1 1 229 229 TRP HE1 H 1 9.680 0.020 . 1 . . . . 229 TRP HE1 . 17703 1 1346 . 1 1 229 229 TRP C C 13 177.791 0.300 . 1 . . . . 229 TRP C . 17703 1 1347 . 1 1 229 229 TRP CA C 13 60.946 0.300 . 1 . . . . 229 TRP CA . 17703 1 1348 . 1 1 229 229 TRP CB C 13 27.789 0.300 . 1 . . . . 229 TRP CB . 17703 1 1349 . 1 1 229 229 TRP N N 15 123.396 0.300 . 1 . . . . 229 TRP N . 17703 1 1350 . 1 1 229 229 TRP NE1 N 15 130.471 0.300 . 1 . . . . 229 TRP NE1 . 17703 1 1351 . 1 1 230 230 LYS H H 1 8.507 0.020 . 1 . . . . 230 LYS H . 17703 1 1352 . 1 1 230 230 LYS C C 13 177.957 0.300 . 1 . . . . 230 LYS C . 17703 1 1353 . 1 1 230 230 LYS CA C 13 56.751 0.300 . 1 . . . . 230 LYS CA . 17703 1 1354 . 1 1 230 230 LYS CB C 13 29.239 0.300 . 1 . . . . 230 LYS CB . 17703 1 1355 . 1 1 230 230 LYS N N 15 120.069 0.300 . 1 . . . . 230 LYS N . 17703 1 1356 . 1 1 231 231 ALA H H 1 7.858 0.020 . 1 . . . . 231 ALA H . 17703 1 1357 . 1 1 231 231 ALA C C 13 180.791 0.300 . 1 . . . . 231 ALA C . 17703 1 1358 . 1 1 231 231 ALA CA C 13 53.687 0.300 . 1 . . . . 231 ALA CA . 17703 1 1359 . 1 1 231 231 ALA CB C 13 16.599 0.300 . 1 . . . . 231 ALA CB . 17703 1 1360 . 1 1 231 231 ALA N N 15 122.280 0.300 . 1 . . . . 231 ALA N . 17703 1 1361 . 1 1 232 232 LEU H H 1 8.135 0.020 . 1 . . . . 232 LEU H . 17703 1 1362 . 1 1 232 232 LEU HD11 H 1 0.590 0.020 . 1 . . . . 232 LEU HD1 . 17703 1 1363 . 1 1 232 232 LEU HD12 H 1 0.590 0.020 . 1 . . . . 232 LEU HD1 . 17703 1 1364 . 1 1 232 232 LEU HD13 H 1 0.590 0.020 . 1 . . . . 232 LEU HD1 . 17703 1 1365 . 1 1 232 232 LEU C C 13 178.870 0.300 . 1 . . . . 232 LEU C . 17703 1 1366 . 1 1 232 232 LEU CA C 13 56.076 0.300 . 1 . . . . 232 LEU CA . 17703 1 1367 . 1 1 232 232 LEU CB C 13 40.222 0.300 . 1 . . . . 232 LEU CB . 17703 1 1368 . 1 1 232 232 LEU CD1 C 13 25.456 0.300 . 1 . . . . 232 LEU CD1 . 17703 1 1369 . 1 1 232 232 LEU N N 15 118.143 0.300 . 1 . . . . 232 LEU N . 17703 1 1370 . 1 1 233 233 GLU H H 1 7.778 0.020 . 1 . . . . 233 GLU H . 17703 1 1371 . 1 1 233 233 GLU C C 13 177.459 0.300 . 1 . . . . 233 GLU C . 17703 1 1372 . 1 1 233 233 GLU CA C 13 57.924 0.300 . 1 . . . . 233 GLU CA . 17703 1 1373 . 1 1 233 233 GLU CB C 13 28.894 0.300 . 1 . . . . 233 GLU CB . 17703 1 1374 . 1 1 233 233 GLU N N 15 120.978 0.300 . 1 . . . . 233 GLU N . 17703 1 1375 . 1 1 234 234 ASP H H 1 8.212 0.020 . 1 . . . . 234 ASP H . 17703 1 1376 . 1 1 234 234 ASP C C 13 176.630 0.300 . 1 . . . . 234 ASP C . 17703 1 1377 . 1 1 234 234 ASP CA C 13 54.107 0.300 . 1 . . . . 234 ASP CA . 17703 1 1378 . 1 1 234 234 ASP CB C 13 41.535 0.300 . 1 . . . . 234 ASP CB . 17703 1 1379 . 1 1 234 234 ASP N N 15 116.859 0.300 . 1 . . . . 234 ASP N . 17703 1 1380 . 1 1 235 235 GLY H H 1 7.408 0.020 . 1 . . . . 235 GLY H . 17703 1 1381 . 1 1 235 235 GLY C C 13 175.589 0.300 . 1 . . . . 235 GLY C . 17703 1 1382 . 1 1 235 235 GLY CA C 13 44.284 0.300 . 1 . . . . 235 GLY CA . 17703 1 1383 . 1 1 235 235 GLY N N 15 110.973 0.300 . 1 . . . . 235 GLY N . 17703 1 1384 . 1 1 236 236 ILE HD11 H 1 0.729 0.020 . 1 . . . . 236 ILE HD1 . 17703 1 1385 . 1 1 236 236 ILE HD12 H 1 0.729 0.020 . 1 . . . . 236 ILE HD1 . 17703 1 1386 . 1 1 236 236 ILE HD13 H 1 0.729 0.020 . 1 . . . . 236 ILE HD1 . 17703 1 1387 . 1 1 236 236 ILE C C 13 177.143 0.300 . 1 . . . . 236 ILE C . 17703 1 1388 . 1 1 236 236 ILE CA C 13 62.140 0.300 . 1 . . . . 236 ILE CA . 17703 1 1389 . 1 1 236 236 ILE CB C 13 37.183 0.300 . 1 . . . . 236 ILE CB . 17703 1 1390 . 1 1 236 236 ILE CD1 C 13 13.348 0.300 . 1 . . . . 236 ILE CD1 . 17703 1 1391 . 1 1 237 237 GLU H H 1 9.125 0.020 . 1 . . . . 237 GLU H . 17703 1 1392 . 1 1 237 237 GLU C C 13 178.081 0.300 . 1 . . . . 237 GLU C . 17703 1 1393 . 1 1 237 237 GLU CA C 13 57.815 0.300 . 1 . . . . 237 GLU CA . 17703 1 1394 . 1 1 237 237 GLU CB C 13 27.374 0.300 . 1 . . . . 237 GLU CB . 17703 1 1395 . 1 1 237 237 GLU N N 15 123.401 0.300 . 1 . . . . 237 GLU N . 17703 1 1396 . 1 1 238 238 SER H H 1 7.890 0.020 . 1 . . . . 238 SER H . 17703 1 1397 . 1 1 238 238 SER C C 13 175.620 0.300 . 1 . . . . 238 SER C . 17703 1 1398 . 1 1 238 238 SER CA C 13 59.712 0.300 . 1 . . . . 238 SER CA . 17703 1 1399 . 1 1 238 238 SER CB C 13 62.809 0.300 . 1 . . . . 238 SER CB . 17703 1 1400 . 1 1 238 238 SER N N 15 117.282 0.300 . 1 . . . . 238 SER N . 17703 1 1401 . 1 1 239 239 LEU H H 1 7.556 0.020 . 1 . . . . 239 LEU H . 17703 1 1402 . 1 1 239 239 LEU C C 13 177.915 0.300 . 1 . . . . 239 LEU C . 17703 1 1403 . 1 1 239 239 LEU CA C 13 55.215 0.300 . 1 . . . . 239 LEU CA . 17703 1 1404 . 1 1 239 239 LEU CB C 13 40.291 0.300 . 1 . . . . 239 LEU CB . 17703 1 1405 . 1 1 239 239 LEU N N 15 122.311 0.300 . 1 . . . . 239 LEU N . 17703 1 1406 . 1 1 240 240 GLU H H 1 7.723 0.020 . 1 . . . . 240 GLU H . 17703 1 1407 . 1 1 240 240 GLU C C 13 177.203 0.300 . 1 . . . . 240 GLU C . 17703 1 1408 . 1 1 240 240 GLU CA C 13 57.313 0.300 . 1 . . . . 240 GLU CA . 17703 1 1409 . 1 1 240 240 GLU CB C 13 28.480 0.300 . 1 . . . . 240 GLU CB . 17703 1 1410 . 1 1 240 240 GLU N N 15 119.679 0.300 . 1 . . . . 240 GLU N . 17703 1 1411 . 1 1 241 241 SER H H 1 7.726 0.020 . 1 . . . . 241 SER H . 17703 1 1412 . 1 1 241 241 SER C C 13 174.006 0.300 . 1 . . . . 241 SER C . 17703 1 1413 . 1 1 241 241 SER CA C 13 58.760 0.300 . 1 . . . . 241 SER CA . 17703 1 1414 . 1 1 241 241 SER CB C 13 62.740 0.300 . 1 . . . . 241 SER CB . 17703 1 1415 . 1 1 241 241 SER N N 15 114.102 0.300 . 1 . . . . 241 SER N . 17703 1 1416 . 1 1 242 242 TYR H H 1 7.707 0.020 . 1 . . . . 242 TYR H . 17703 1 1417 . 1 1 242 242 TYR C C 13 174.998 0.300 . 1 . . . . 242 TYR C . 17703 1 1418 . 1 1 242 242 TYR CA C 13 57.313 0.300 . 1 . . . . 242 TYR CA . 17703 1 1419 . 1 1 242 242 TYR CB C 13 37.736 0.300 . 1 . . . . 242 TYR CB . 17703 1 1420 . 1 1 242 242 TYR N N 15 121.562 0.300 . 1 . . . . 242 TYR N . 17703 1 1421 . 1 1 243 243 ASP H H 1 8.123 0.020 . 1 . . . . 243 ASP H . 17703 1 1422 . 1 1 243 243 ASP C C 13 175.993 0.300 . 1 . . . . 243 ASP C . 17703 1 1423 . 1 1 243 243 ASP CA C 13 53.531 0.300 . 1 . . . . 243 ASP CA . 17703 1 1424 . 1 1 243 243 ASP CB C 13 39.808 0.300 . 1 . . . . 243 ASP CB . 17703 1 1425 . 1 1 243 243 ASP N N 15 121.714 0.300 . 1 . . . . 243 ASP N . 17703 1 1426 . 1 1 244 244 LEU H H 1 8.194 0.020 . 1 . . . . 244 LEU H . 17703 1 1427 . 1 1 244 244 LEU C C 13 177.708 0.300 . 1 . . . . 244 LEU C . 17703 1 1428 . 1 1 244 244 LEU CA C 13 54.920 0.300 . 1 . . . . 244 LEU CA . 17703 1 1429 . 1 1 244 244 LEU CB C 13 40.637 0.300 . 1 . . . . 244 LEU CB . 17703 1 1430 . 1 1 244 244 LEU N N 15 123.311 0.300 . 1 . . . . 244 LEU N . 17703 1 1431 . 1 1 245 245 GLU H H 1 8.243 0.020 . 1 . . . . 245 GLU H . 17703 1 1432 . 1 1 245 245 GLU C C 13 176.339 0.300 . 1 . . . . 245 GLU C . 17703 1 1433 . 1 1 245 245 GLU CA C 13 56.077 0.300 . 1 . . . . 245 GLU CA . 17703 1 1434 . 1 1 245 245 GLU CB C 13 28.820 0.300 . 1 . . . . 245 GLU CB . 17703 1 1435 . 1 1 245 245 GLU N N 15 119.820 0.300 . 1 . . . . 245 GLU N . 17703 1 1436 . 1 1 246 246 HIS H H 1 8.091 0.020 . 1 . . . . 246 HIS H . 17703 1 1437 . 1 1 246 246 HIS C C 13 174.445 0.300 . 1 . . . . 246 HIS C . 17703 1 1438 . 1 1 246 246 HIS CA C 13 55.411 0.300 . 1 . . . . 246 HIS CA . 17703 1 1439 . 1 1 246 246 HIS CB C 13 28.618 0.300 . 1 . . . . 246 HIS CB . 17703 1 1440 . 1 1 246 246 HIS N N 15 119.252 0.300 . 1 . . . . 246 HIS N . 17703 1 stop_ save_