data_18170 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18170 _Entry.Title ; Structure of human CXCR1 in phospholipid bilayers ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-12-31 _Entry.Accession_date 2011-12-31 _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 SOLID-STATE _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 'Sang Ho' Park . . . 18170 2 Bibhuti Das . B. . 18170 3 Fabio Casagrande . . . 18170 4 Henry Nothnagel . . . 18170 5 Mignon Chu . . . 18170 6 Hans Kiefer . . . 18170 7 Klaus Maier . . . 18170 8 Anna 'De Angelis' . . . 18170 9 Francesca Marassi . M. . 18170 10 Stanley Opella . J. . 18170 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 18170 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 7TM . 18170 chemokine . 18170 GPCR . 18170 'G protein coupled receptor' . 18170 'membrane protein' . 18170 phospholipid . 18170 signaling . 18170 transmembrane . 18170 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18170 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 816 18170 '15N chemical shifts' 298 18170 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 2 . . 2013-02-13 2011-12-31 update BMRB 'update entry citation' 18170 1 . . 2012-10-15 2011-12-31 original author 'original release' 18170 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2LNL 'BMRB Entry Tracking System' 18170 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 18170 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 23086146 _Citation.Full_citation . _Citation.Title 'Structure of the chemokine receptor CXCR1 in phospholipid bilayers.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Nature _Citation.Journal_name_full Nature _Citation.Journal_volume 491 _Citation.Journal_issue 7426 _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 779 _Citation.Page_last 783 _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 'Sang Ho' Park . . . 18170 1 2 Bibhuti Das . B. . 18170 1 3 Fabio Casagrande . . . 18170 1 4 Ye Tian . . . 18170 1 5 Henry Nothnagel . J. . 18170 1 6 Mignon Chu . . . 18170 1 7 Hans Kiefer . . . 18170 1 8 Klaus Maier . . . 18170 1 9 Anna 'De Angelis' . A. . 18170 1 10 Francesca Marassi . M. . 18170 1 11 Stanley Opella . J. . 18170 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18170 _Assembly.ID 1 _Assembly.Name 'human CXCR1 in phospholipid bilayers' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _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 'human CXCR1 in phospholipid bilayers' 1 $cxcr1 A . yes native no no . . . 18170 1 2 4-TRIFLUOROMETHYLANILINE 2 $ANI B . yes native no no . . . 18170 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 11 11 SG . 1 . 1 CYS 258 258 SG . . 30 CYS SG . . 277 CYS SG 18170 1 2 disulfide single . 1 . 1 CYS 91 91 SG . 1 . 1 CYS 168 168 SG . . 110 CYS SG . . 187 CYS SG 18170 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_cxcr1 _Entity.Sf_category entity _Entity.Sf_framecode cxcr1 _Entity.Entry_ID 18170 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MPPADEDYSPCMLETETLNK YVVIIAYALVFLLSLLGNSL VMLVILYSRVGRSVTDVYLL NLALADLLFALTLPIWAASK VNGWIFGTFLCKVVSLLKEV NFYSGILLLACISVDRYLAI VHATRTLTQKRHLVKFVCLG CWGLSMNLSLPFFLFRQAYH PNNSSPVCYEVLGNDTAKWR MVLRILPHTFGFIVPLFVML FCYGFTLRTLFKAHMGQKHR AMRVIFAVVLIFLLCWLPYN LVLLADTLMRTQVIQESCER RNNIGRALDATEILGFLHSC LNPIIYAFIGQNFRHGFLKI LAMHGLVSK ; _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 309 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'disulfide bound and not reported' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 33726.656 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2LNL . "Structure Of Human Cxcr1 In Phospholipid Bilayers" . . . . . 95.79 296 100.00 100.00 0.00e+00 . . . . 18170 1 2 no DBJ BAG35550 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 350 100.00 100.00 0.00e+00 . . . . 18170 1 3 no DBJ BAG74111 . "interleukin 8 receptor, alpha [synthetic construct]" . . . . . 100.00 350 100.00 100.00 0.00e+00 . . . . 18170 1 4 no EMBL CAA46688 . "High affinity interleukin-8 receptor [Homo sapiens]" . . . . . 100.00 350 100.00 100.00 0.00e+00 . . . . 18170 1 5 no EMBL CAB37671 . "interleukin-8 receptor type A [Gorilla gorilla]" . . . . . 100.00 350 97.09 97.41 0.00e+00 . . . . 18170 1 6 no EMBL CAB37850 . "interleukin-8 receptor type A [Pan troglodytes]" . . . . . 100.00 350 98.71 98.71 0.00e+00 . . . . 18170 1 7 no EMBL CAG46791 . "IL8RA [Homo sapiens]" . . . . . 100.00 350 100.00 100.00 0.00e+00 . . . . 18170 1 8 no EMBL CAG46826 . "IL8RA [Homo sapiens]" . . . . . 100.00 350 100.00 100.00 0.00e+00 . . . . 18170 1 9 no GB AAA59159 . "IL-8 receptor [Homo sapiens]" . . . . . 100.00 350 99.68 100.00 0.00e+00 . . . . 18170 1 10 no GB AAA59160 . "interleukin 8 receptor alpha [Homo sapiens]" . . . . . 100.00 350 100.00 100.00 0.00e+00 . . . . 18170 1 11 no GB AAA64378 . "interleukin-8 receptor type A [Homo sapiens]" . . . . . 100.00 350 100.00 100.00 0.00e+00 . . . . 18170 1 12 no GB AAB25879 . "interleukin-8 receptor type 1, IL8R1 [human, neutrophils, Peptide, 350 aa]" . . . . . 100.00 350 99.68 100.00 0.00e+00 . . . . 18170 1 13 no GB AAB59436 . "interleukin 8 receptor alpha [Homo sapiens]" . . . . . 100.00 350 100.00 100.00 0.00e+00 . . . . 18170 1 14 no REF NP_000625 . "C-X-C chemokine receptor type 1 [Homo sapiens]" . . . . . 100.00 350 100.00 100.00 0.00e+00 . . . . 18170 1 15 no REF NP_001035537 . "C-X-C chemokine receptor type 1 [Pan troglodytes]" . . . . . 100.00 350 98.71 98.71 0.00e+00 . . . . 18170 1 16 no REF XP_004033238 . "PREDICTED: c-X-C chemokine receptor type 1 isoform 1 [Gorilla gorilla gorilla]" . . . . . 100.00 350 97.41 97.73 0.00e+00 . . . . 18170 1 17 no REF XP_004033239 . "PREDICTED: c-X-C chemokine receptor type 1 isoform 2 [Gorilla gorilla gorilla]" . . . . . 100.00 350 97.41 97.73 0.00e+00 . . . . 18170 1 18 no SP P25024 . "RecName: Full=C-X-C chemokine receptor type 1; Short=CXC-R1; Short=CXCR-1; AltName: Full=CDw128a; AltName: Full=High affinity i" . . . . . 100.00 350 100.00 100.00 0.00e+00 . . . . 18170 1 19 no SP P55919 . "RecName: Full=C-X-C chemokine receptor type 1; Short=CXC-R1; Short=CXCR-1; AltName: Full=High affinity interleukin-8 receptor A" . . . . . 100.00 350 97.09 97.41 0.00e+00 . . . . 18170 1 20 no SP P55920 . "RecName: Full=C-X-C chemokine receptor type 1; Short=CXC-R1; Short=CXCR-1; AltName: Full=High affinity interleukin-8 receptor A" . . . . . 100.00 350 98.71 98.71 0.00e+00 . . . . 18170 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 20 MET . 18170 1 2 21 PRO . 18170 1 3 22 PRO . 18170 1 4 23 ALA . 18170 1 5 24 ASP . 18170 1 6 25 GLU . 18170 1 7 26 ASP . 18170 1 8 27 TYR . 18170 1 9 28 SER . 18170 1 10 29 PRO . 18170 1 11 30 CYS . 18170 1 12 31 MET . 18170 1 13 32 LEU . 18170 1 14 33 GLU . 18170 1 15 34 THR . 18170 1 16 35 GLU . 18170 1 17 36 THR . 18170 1 18 37 LEU . 18170 1 19 38 ASN . 18170 1 20 39 LYS . 18170 1 21 40 TYR . 18170 1 22 41 VAL . 18170 1 23 42 VAL . 18170 1 24 43 ILE . 18170 1 25 44 ILE . 18170 1 26 45 ALA . 18170 1 27 46 TYR . 18170 1 28 47 ALA . 18170 1 29 48 LEU . 18170 1 30 49 VAL . 18170 1 31 50 PHE . 18170 1 32 51 LEU . 18170 1 33 52 LEU . 18170 1 34 53 SER . 18170 1 35 54 LEU . 18170 1 36 55 LEU . 18170 1 37 56 GLY . 18170 1 38 57 ASN . 18170 1 39 58 SER . 18170 1 40 59 LEU . 18170 1 41 60 VAL . 18170 1 42 61 MET . 18170 1 43 62 LEU . 18170 1 44 63 VAL . 18170 1 45 64 ILE . 18170 1 46 65 LEU . 18170 1 47 66 TYR . 18170 1 48 67 SER . 18170 1 49 68 ARG . 18170 1 50 69 VAL . 18170 1 51 70 GLY . 18170 1 52 71 ARG . 18170 1 53 72 SER . 18170 1 54 73 VAL . 18170 1 55 74 THR . 18170 1 56 75 ASP . 18170 1 57 76 VAL . 18170 1 58 77 TYR . 18170 1 59 78 LEU . 18170 1 60 79 LEU . 18170 1 61 80 ASN . 18170 1 62 81 LEU . 18170 1 63 82 ALA . 18170 1 64 83 LEU . 18170 1 65 84 ALA . 18170 1 66 85 ASP . 18170 1 67 86 LEU . 18170 1 68 87 LEU . 18170 1 69 88 PHE . 18170 1 70 89 ALA . 18170 1 71 90 LEU . 18170 1 72 91 THR . 18170 1 73 92 LEU . 18170 1 74 93 PRO . 18170 1 75 94 ILE . 18170 1 76 95 TRP . 18170 1 77 96 ALA . 18170 1 78 97 ALA . 18170 1 79 98 SER . 18170 1 80 99 LYS . 18170 1 81 100 VAL . 18170 1 82 101 ASN . 18170 1 83 102 GLY . 18170 1 84 103 TRP . 18170 1 85 104 ILE . 18170 1 86 105 PHE . 18170 1 87 106 GLY . 18170 1 88 107 THR . 18170 1 89 108 PHE . 18170 1 90 109 LEU . 18170 1 91 110 CYS . 18170 1 92 111 LYS . 18170 1 93 112 VAL . 18170 1 94 113 VAL . 18170 1 95 114 SER . 18170 1 96 115 LEU . 18170 1 97 116 LEU . 18170 1 98 117 LYS . 18170 1 99 118 GLU . 18170 1 100 119 VAL . 18170 1 101 120 ASN . 18170 1 102 121 PHE . 18170 1 103 122 TYR . 18170 1 104 123 SER . 18170 1 105 124 GLY . 18170 1 106 125 ILE . 18170 1 107 126 LEU . 18170 1 108 127 LEU . 18170 1 109 128 LEU . 18170 1 110 129 ALA . 18170 1 111 130 CYS . 18170 1 112 131 ILE . 18170 1 113 132 SER . 18170 1 114 133 VAL . 18170 1 115 134 ASP . 18170 1 116 135 ARG . 18170 1 117 136 TYR . 18170 1 118 137 LEU . 18170 1 119 138 ALA . 18170 1 120 139 ILE . 18170 1 121 140 VAL . 18170 1 122 141 HIS . 18170 1 123 142 ALA . 18170 1 124 143 THR . 18170 1 125 144 ARG . 18170 1 126 145 THR . 18170 1 127 146 LEU . 18170 1 128 147 THR . 18170 1 129 148 GLN . 18170 1 130 149 LYS . 18170 1 131 150 ARG . 18170 1 132 151 HIS . 18170 1 133 152 LEU . 18170 1 134 153 VAL . 18170 1 135 154 LYS . 18170 1 136 155 PHE . 18170 1 137 156 VAL . 18170 1 138 157 CYS . 18170 1 139 158 LEU . 18170 1 140 159 GLY . 18170 1 141 160 CYS . 18170 1 142 161 TRP . 18170 1 143 162 GLY . 18170 1 144 163 LEU . 18170 1 145 164 SER . 18170 1 146 165 MET . 18170 1 147 166 ASN . 18170 1 148 167 LEU . 18170 1 149 168 SER . 18170 1 150 169 LEU . 18170 1 151 170 PRO . 18170 1 152 171 PHE . 18170 1 153 172 PHE . 18170 1 154 173 LEU . 18170 1 155 174 PHE . 18170 1 156 175 ARG . 18170 1 157 176 GLN . 18170 1 158 177 ALA . 18170 1 159 178 TYR . 18170 1 160 179 HIS . 18170 1 161 180 PRO . 18170 1 162 181 ASN . 18170 1 163 182 ASN . 18170 1 164 183 SER . 18170 1 165 184 SER . 18170 1 166 185 PRO . 18170 1 167 186 VAL . 18170 1 168 187 CYS . 18170 1 169 188 TYR . 18170 1 170 189 GLU . 18170 1 171 190 VAL . 18170 1 172 191 LEU . 18170 1 173 192 GLY . 18170 1 174 193 ASN . 18170 1 175 194 ASP . 18170 1 176 195 THR . 18170 1 177 196 ALA . 18170 1 178 197 LYS . 18170 1 179 198 TRP . 18170 1 180 199 ARG . 18170 1 181 200 MET . 18170 1 182 201 VAL . 18170 1 183 202 LEU . 18170 1 184 203 ARG . 18170 1 185 204 ILE . 18170 1 186 205 LEU . 18170 1 187 206 PRO . 18170 1 188 207 HIS . 18170 1 189 208 THR . 18170 1 190 209 PHE . 18170 1 191 210 GLY . 18170 1 192 211 PHE . 18170 1 193 212 ILE . 18170 1 194 213 VAL . 18170 1 195 214 PRO . 18170 1 196 215 LEU . 18170 1 197 216 PHE . 18170 1 198 217 VAL . 18170 1 199 218 MET . 18170 1 200 219 LEU . 18170 1 201 220 PHE . 18170 1 202 221 CYS . 18170 1 203 222 TYR . 18170 1 204 223 GLY . 18170 1 205 224 PHE . 18170 1 206 225 THR . 18170 1 207 226 LEU . 18170 1 208 227 ARG . 18170 1 209 228 THR . 18170 1 210 229 LEU . 18170 1 211 230 PHE . 18170 1 212 231 LYS . 18170 1 213 232 ALA . 18170 1 214 233 HIS . 18170 1 215 234 MET . 18170 1 216 235 GLY . 18170 1 217 236 GLN . 18170 1 218 237 LYS . 18170 1 219 238 HIS . 18170 1 220 239 ARG . 18170 1 221 240 ALA . 18170 1 222 241 MET . 18170 1 223 242 ARG . 18170 1 224 243 VAL . 18170 1 225 244 ILE . 18170 1 226 245 PHE . 18170 1 227 246 ALA . 18170 1 228 247 VAL . 18170 1 229 248 VAL . 18170 1 230 249 LEU . 18170 1 231 250 ILE . 18170 1 232 251 PHE . 18170 1 233 252 LEU . 18170 1 234 253 LEU . 18170 1 235 254 CYS . 18170 1 236 255 TRP . 18170 1 237 256 LEU . 18170 1 238 257 PRO . 18170 1 239 258 TYR . 18170 1 240 259 ASN . 18170 1 241 260 LEU . 18170 1 242 261 VAL . 18170 1 243 262 LEU . 18170 1 244 263 LEU . 18170 1 245 264 ALA . 18170 1 246 265 ASP . 18170 1 247 266 THR . 18170 1 248 267 LEU . 18170 1 249 268 MET . 18170 1 250 269 ARG . 18170 1 251 270 THR . 18170 1 252 271 GLN . 18170 1 253 272 VAL . 18170 1 254 273 ILE . 18170 1 255 274 GLN . 18170 1 256 275 GLU . 18170 1 257 276 SER . 18170 1 258 277 CYS . 18170 1 259 278 GLU . 18170 1 260 279 ARG . 18170 1 261 280 ARG . 18170 1 262 281 ASN . 18170 1 263 282 ASN . 18170 1 264 283 ILE . 18170 1 265 284 GLY . 18170 1 266 285 ARG . 18170 1 267 286 ALA . 18170 1 268 287 LEU . 18170 1 269 288 ASP . 18170 1 270 289 ALA . 18170 1 271 290 THR . 18170 1 272 291 GLU . 18170 1 273 292 ILE . 18170 1 274 293 LEU . 18170 1 275 294 GLY . 18170 1 276 295 PHE . 18170 1 277 296 LEU . 18170 1 278 297 HIS . 18170 1 279 298 SER . 18170 1 280 299 CYS . 18170 1 281 300 LEU . 18170 1 282 301 ASN . 18170 1 283 302 PRO . 18170 1 284 303 ILE . 18170 1 285 304 ILE . 18170 1 286 305 TYR . 18170 1 287 306 ALA . 18170 1 288 307 PHE . 18170 1 289 308 ILE . 18170 1 290 309 GLY . 18170 1 291 310 GLN . 18170 1 292 311 ASN . 18170 1 293 312 PHE . 18170 1 294 313 ARG . 18170 1 295 314 HIS . 18170 1 296 315 GLY . 18170 1 297 316 PHE . 18170 1 298 317 LEU . 18170 1 299 318 LYS . 18170 1 300 319 ILE . 18170 1 301 320 LEU . 18170 1 302 321 ALA . 18170 1 303 322 MET . 18170 1 304 323 HIS . 18170 1 305 324 GLY . 18170 1 306 325 LEU . 18170 1 307 326 VAL . 18170 1 308 327 SER . 18170 1 309 328 LYS . 18170 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 18170 1 . PRO 2 2 18170 1 . PRO 3 3 18170 1 . ALA 4 4 18170 1 . ASP 5 5 18170 1 . GLU 6 6 18170 1 . ASP 7 7 18170 1 . TYR 8 8 18170 1 . SER 9 9 18170 1 . PRO 10 10 18170 1 . CYS 11 11 18170 1 . MET 12 12 18170 1 . LEU 13 13 18170 1 . GLU 14 14 18170 1 . THR 15 15 18170 1 . GLU 16 16 18170 1 . THR 17 17 18170 1 . LEU 18 18 18170 1 . ASN 19 19 18170 1 . LYS 20 20 18170 1 . TYR 21 21 18170 1 . VAL 22 22 18170 1 . VAL 23 23 18170 1 . ILE 24 24 18170 1 . ILE 25 25 18170 1 . ALA 26 26 18170 1 . TYR 27 27 18170 1 . ALA 28 28 18170 1 . LEU 29 29 18170 1 . VAL 30 30 18170 1 . PHE 31 31 18170 1 . LEU 32 32 18170 1 . LEU 33 33 18170 1 . SER 34 34 18170 1 . LEU 35 35 18170 1 . LEU 36 36 18170 1 . GLY 37 37 18170 1 . ASN 38 38 18170 1 . SER 39 39 18170 1 . LEU 40 40 18170 1 . VAL 41 41 18170 1 . MET 42 42 18170 1 . LEU 43 43 18170 1 . VAL 44 44 18170 1 . ILE 45 45 18170 1 . LEU 46 46 18170 1 . TYR 47 47 18170 1 . SER 48 48 18170 1 . ARG 49 49 18170 1 . VAL 50 50 18170 1 . GLY 51 51 18170 1 . ARG 52 52 18170 1 . SER 53 53 18170 1 . VAL 54 54 18170 1 . THR 55 55 18170 1 . ASP 56 56 18170 1 . VAL 57 57 18170 1 . TYR 58 58 18170 1 . LEU 59 59 18170 1 . LEU 60 60 18170 1 . ASN 61 61 18170 1 . LEU 62 62 18170 1 . ALA 63 63 18170 1 . LEU 64 64 18170 1 . ALA 65 65 18170 1 . ASP 66 66 18170 1 . LEU 67 67 18170 1 . LEU 68 68 18170 1 . PHE 69 69 18170 1 . ALA 70 70 18170 1 . LEU 71 71 18170 1 . THR 72 72 18170 1 . LEU 73 73 18170 1 . PRO 74 74 18170 1 . ILE 75 75 18170 1 . TRP 76 76 18170 1 . ALA 77 77 18170 1 . ALA 78 78 18170 1 . SER 79 79 18170 1 . LYS 80 80 18170 1 . VAL 81 81 18170 1 . ASN 82 82 18170 1 . GLY 83 83 18170 1 . TRP 84 84 18170 1 . ILE 85 85 18170 1 . PHE 86 86 18170 1 . GLY 87 87 18170 1 . THR 88 88 18170 1 . PHE 89 89 18170 1 . LEU 90 90 18170 1 . CYS 91 91 18170 1 . LYS 92 92 18170 1 . VAL 93 93 18170 1 . VAL 94 94 18170 1 . SER 95 95 18170 1 . LEU 96 96 18170 1 . LEU 97 97 18170 1 . LYS 98 98 18170 1 . GLU 99 99 18170 1 . VAL 100 100 18170 1 . ASN 101 101 18170 1 . PHE 102 102 18170 1 . TYR 103 103 18170 1 . SER 104 104 18170 1 . GLY 105 105 18170 1 . ILE 106 106 18170 1 . LEU 107 107 18170 1 . LEU 108 108 18170 1 . LEU 109 109 18170 1 . ALA 110 110 18170 1 . CYS 111 111 18170 1 . ILE 112 112 18170 1 . SER 113 113 18170 1 . VAL 114 114 18170 1 . ASP 115 115 18170 1 . ARG 116 116 18170 1 . TYR 117 117 18170 1 . LEU 118 118 18170 1 . ALA 119 119 18170 1 . ILE 120 120 18170 1 . VAL 121 121 18170 1 . HIS 122 122 18170 1 . ALA 123 123 18170 1 . THR 124 124 18170 1 . ARG 125 125 18170 1 . THR 126 126 18170 1 . LEU 127 127 18170 1 . THR 128 128 18170 1 . GLN 129 129 18170 1 . LYS 130 130 18170 1 . ARG 131 131 18170 1 . HIS 132 132 18170 1 . LEU 133 133 18170 1 . VAL 134 134 18170 1 . LYS 135 135 18170 1 . PHE 136 136 18170 1 . VAL 137 137 18170 1 . CYS 138 138 18170 1 . LEU 139 139 18170 1 . GLY 140 140 18170 1 . CYS 141 141 18170 1 . TRP 142 142 18170 1 . GLY 143 143 18170 1 . LEU 144 144 18170 1 . SER 145 145 18170 1 . MET 146 146 18170 1 . ASN 147 147 18170 1 . LEU 148 148 18170 1 . SER 149 149 18170 1 . LEU 150 150 18170 1 . PRO 151 151 18170 1 . PHE 152 152 18170 1 . PHE 153 153 18170 1 . LEU 154 154 18170 1 . PHE 155 155 18170 1 . ARG 156 156 18170 1 . GLN 157 157 18170 1 . ALA 158 158 18170 1 . TYR 159 159 18170 1 . HIS 160 160 18170 1 . PRO 161 161 18170 1 . ASN 162 162 18170 1 . ASN 163 163 18170 1 . SER 164 164 18170 1 . SER 165 165 18170 1 . PRO 166 166 18170 1 . VAL 167 167 18170 1 . CYS 168 168 18170 1 . TYR 169 169 18170 1 . GLU 170 170 18170 1 . VAL 171 171 18170 1 . LEU 172 172 18170 1 . GLY 173 173 18170 1 . ASN 174 174 18170 1 . ASP 175 175 18170 1 . THR 176 176 18170 1 . ALA 177 177 18170 1 . LYS 178 178 18170 1 . TRP 179 179 18170 1 . ARG 180 180 18170 1 . MET 181 181 18170 1 . VAL 182 182 18170 1 . LEU 183 183 18170 1 . ARG 184 184 18170 1 . ILE 185 185 18170 1 . LEU 186 186 18170 1 . PRO 187 187 18170 1 . HIS 188 188 18170 1 . THR 189 189 18170 1 . PHE 190 190 18170 1 . GLY 191 191 18170 1 . PHE 192 192 18170 1 . ILE 193 193 18170 1 . VAL 194 194 18170 1 . PRO 195 195 18170 1 . LEU 196 196 18170 1 . PHE 197 197 18170 1 . VAL 198 198 18170 1 . MET 199 199 18170 1 . LEU 200 200 18170 1 . PHE 201 201 18170 1 . CYS 202 202 18170 1 . TYR 203 203 18170 1 . GLY 204 204 18170 1 . PHE 205 205 18170 1 . THR 206 206 18170 1 . LEU 207 207 18170 1 . ARG 208 208 18170 1 . THR 209 209 18170 1 . LEU 210 210 18170 1 . PHE 211 211 18170 1 . LYS 212 212 18170 1 . ALA 213 213 18170 1 . HIS 214 214 18170 1 . MET 215 215 18170 1 . GLY 216 216 18170 1 . GLN 217 217 18170 1 . LYS 218 218 18170 1 . HIS 219 219 18170 1 . ARG 220 220 18170 1 . ALA 221 221 18170 1 . MET 222 222 18170 1 . ARG 223 223 18170 1 . VAL 224 224 18170 1 . ILE 225 225 18170 1 . PHE 226 226 18170 1 . ALA 227 227 18170 1 . VAL 228 228 18170 1 . VAL 229 229 18170 1 . LEU 230 230 18170 1 . ILE 231 231 18170 1 . PHE 232 232 18170 1 . LEU 233 233 18170 1 . LEU 234 234 18170 1 . CYS 235 235 18170 1 . TRP 236 236 18170 1 . LEU 237 237 18170 1 . PRO 238 238 18170 1 . TYR 239 239 18170 1 . ASN 240 240 18170 1 . LEU 241 241 18170 1 . VAL 242 242 18170 1 . LEU 243 243 18170 1 . LEU 244 244 18170 1 . ALA 245 245 18170 1 . ASP 246 246 18170 1 . THR 247 247 18170 1 . LEU 248 248 18170 1 . MET 249 249 18170 1 . ARG 250 250 18170 1 . THR 251 251 18170 1 . GLN 252 252 18170 1 . VAL 253 253 18170 1 . ILE 254 254 18170 1 . GLN 255 255 18170 1 . GLU 256 256 18170 1 . SER 257 257 18170 1 . CYS 258 258 18170 1 . GLU 259 259 18170 1 . ARG 260 260 18170 1 . ARG 261 261 18170 1 . ASN 262 262 18170 1 . ASN 263 263 18170 1 . ILE 264 264 18170 1 . GLY 265 265 18170 1 . ARG 266 266 18170 1 . ALA 267 267 18170 1 . LEU 268 268 18170 1 . ASP 269 269 18170 1 . ALA 270 270 18170 1 . THR 271 271 18170 1 . GLU 272 272 18170 1 . ILE 273 273 18170 1 . LEU 274 274 18170 1 . GLY 275 275 18170 1 . PHE 276 276 18170 1 . LEU 277 277 18170 1 . HIS 278 278 18170 1 . SER 279 279 18170 1 . CYS 280 280 18170 1 . LEU 281 281 18170 1 . ASN 282 282 18170 1 . PRO 283 283 18170 1 . ILE 284 284 18170 1 . ILE 285 285 18170 1 . TYR 286 286 18170 1 . ALA 287 287 18170 1 . PHE 288 288 18170 1 . ILE 289 289 18170 1 . GLY 290 290 18170 1 . GLN 291 291 18170 1 . ASN 292 292 18170 1 . PHE 293 293 18170 1 . ARG 294 294 18170 1 . HIS 295 295 18170 1 . GLY 296 296 18170 1 . PHE 297 297 18170 1 . LEU 298 298 18170 1 . LYS 299 299 18170 1 . ILE 300 300 18170 1 . LEU 301 301 18170 1 . ALA 302 302 18170 1 . MET 303 303 18170 1 . HIS 304 304 18170 1 . GLY 305 305 18170 1 . LEU 306 306 18170 1 . VAL 307 307 18170 1 . SER 308 308 18170 1 . LYS 309 309 18170 1 stop_ save_ save_ANI _Entity.Sf_category entity _Entity.Sf_framecode ANI _Entity.Entry_ID 18170 _Entity.ID 2 _Entity.BMRB_code ANI _Entity.Name 4-(trifluoromethyl)aniline _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID ANI _Entity.Nonpolymer_comp_label $chem_comp_ANI _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 161.124 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 4-(trifluoromethyl)aniline BMRB 18170 2 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 4-(trifluoromethyl)aniline BMRB 18170 2 ANI 'Three letter code' 18170 2 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 1 ANI $chem_comp_ANI 18170 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . ANI 1 1 18170 2 stop_ loop_ _Entity_atom_list.ID _Entity_atom_list.Comp_index_ID _Entity_atom_list.Comp_ID _Entity_atom_list.Atom_ID _Entity_atom_list.Entry_ID _Entity_atom_list.Entity_ID 1 1 ANI C1 18170 2 2 1 ANI C2 18170 2 3 1 ANI C3 18170 2 4 1 ANI C4 18170 2 5 1 ANI C5 18170 2 6 1 ANI C6 18170 2 7 1 ANI C7 18170 2 8 1 ANI F1 18170 2 9 1 ANI F2 18170 2 10 1 ANI F3 18170 2 11 1 ANI H2 18170 2 12 1 ANI H3 18170 2 13 1 ANI H5 18170 2 14 1 ANI H6 18170 2 15 1 ANI HN1 18170 2 16 1 ANI HN2 18170 2 17 1 ANI N 18170 2 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 18170 _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 $cxcr1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 18170 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 18170 _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 $cxcr1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET . . . . . . 18170 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ANI _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ANI _Chem_comp.Entry_ID 18170 _Chem_comp.ID ANI _Chem_comp.Provenance PDB _Chem_comp.Name 4-(trifluoromethyl)aniline _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code ANI _Chem_comp.PDB_code ANI _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 1999-07-08 _Chem_comp.Modified_date 2011-12-14 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code ANI _Chem_comp.Number_atoms_all 17 _Chem_comp.Number_atoms_nh 11 _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/C7H6F3N/c8-7(9,10)5-1-3-6(11)4-2-5/h1-4H,11H2 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic yes _Chem_comp.Formula 'C7 H6 F3 N' _Chem_comp.Formula_weight 161.124 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details Corina _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code 1ELE _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID c1cc(ccc1C(F)(F)F)N SMILES 'OpenEye OEToolkits' 1.7.0 18170 ANI c1cc(ccc1C(F)(F)F)N SMILES_CANONICAL 'OpenEye OEToolkits' 1.7.0 18170 ANI FC(F)(F)c1ccc(N)cc1 SMILES ACDLabs 12.01 18170 ANI InChI=1S/C7H6F3N/c8-7(9,10)5-1-3-6(11)4-2-5/h1-4H,11H2 InChI InChI 1.03 18170 ANI Nc1ccc(cc1)C(F)(F)F SMILES CACTVS 3.370 18170 ANI Nc1ccc(cc1)C(F)(F)F SMILES_CANONICAL CACTVS 3.370 18170 ANI ODGIMMLDVSWADK-UHFFFAOYSA-N InChIKey InChI 1.03 18170 ANI stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID 4-(trifluoromethyl)aniline 'SYSTEMATIC NAME' ACDLabs 12.01 18170 ANI 4-(trifluoromethyl)aniline 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.7.0 18170 ANI stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID N N N N . N . . N 0 . . . 1 no no . . . . 36.339 . 19.208 . 37.808 . 3.902 0.000 0.001 1 . 18170 ANI C1 C1 C1 C1 . C . . N 0 . . . 1 yes no . . . . 36.000 . 18.237 . 38.690 . 2.505 -0.000 0.001 2 . 18170 ANI C2 C2 C2 C2 . C . . N 0 . . . 1 yes no . . . . 35.385 . 18.637 . 39.861 . 1.809 1.202 -0.001 3 . 18170 ANI C3 C3 C3 C3 . C . . N 0 . . . 1 yes no . . . . 35.057 . 17.724 . 40.823 . 0.428 1.199 -0.001 4 . 18170 ANI C4 C4 C4 C4 . C . . N 0 . . . 1 yes no . . . . 35.342 . 16.372 . 40.636 . -0.262 0.000 0.000 5 . 18170 ANI C5 C5 C5 C5 . C . . N 0 . . . 1 yes no . . . . 35.950 . 15.968 . 39.450 . 0.428 -1.199 0.002 6 . 18170 ANI C6 C6 C6 C6 . C . . N 0 . . . 1 yes no . . . . 36.275 . 16.888 . 38.489 . 1.809 -1.202 -0.003 7 . 18170 ANI C7 C7 C7 C7 . C . . N 0 . . . 1 no no . . . . 35.037 . 15.326 . 41.780 . -1.769 -0.000 0.000 8 . 18170 ANI F1 F1 F1 F1 . F . . N 0 . . . 1 no no . . . . 35.418 . 14.014 . 41.614 . -2.235 -0.001 -1.319 9 . 18170 ANI F2 F2 F2 F2 . F . . N 0 . . . 1 no no . . . . 35.650 . 15.727 . 42.894 . -2.235 -1.142 0.661 10 . 18170 ANI F3 F3 F3 F3 . F . . N 0 . . . 1 no no . . . . 33.733 . 15.316 . 42.082 . -2.235 1.143 0.659 11 . 18170 ANI HN1 HN1 HN1 HN1 . H . . N 0 . . . 1 no no . . . . 36.773 . 18.795 . 37.007 . 4.387 0.840 -0.000 12 . 18170 ANI HN2 HN2 HN2 HN2 . H . . N 0 . . . 1 no yes . . . . 35.517 . 19.702 . 37.524 . 4.387 -0.840 0.006 13 . 18170 ANI H2 H2 H2 H2 . H . . N 0 . . . 1 no no . . . . 35.161 . 19.682 . 40.017 . 2.347 2.138 -0.001 14 . 18170 ANI H3 H3 H3 H3 . H . . N 0 . . . 1 no no . . . . 34.575 . 18.051 . 41.732 . -0.114 2.133 -0.002 15 . 18170 ANI H5 H5 H5 H5 . H . . N 0 . . . 1 no no . . . . 36.167 . 14.923 . 39.287 . -0.114 -2.133 0.002 16 . 18170 ANI H6 H6 H6 H6 . H . . N 0 . . . 1 no no . . . . 36.746 . 16.565 . 37.572 . 2.347 -2.138 -0.007 17 . 18170 ANI stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING N C1 no N 1 . 18170 ANI 2 . SING N HN1 no N 2 . 18170 ANI 3 . SING N HN2 no N 3 . 18170 ANI 4 . DOUB C1 C2 yes N 4 . 18170 ANI 5 . SING C1 C6 yes N 5 . 18170 ANI 6 . SING C2 C3 yes N 6 . 18170 ANI 7 . SING C2 H2 no N 7 . 18170 ANI 8 . DOUB C3 C4 yes N 8 . 18170 ANI 9 . SING C3 H3 no N 9 . 18170 ANI 10 . SING C4 C5 yes N 10 . 18170 ANI 11 . SING C4 C7 no N 11 . 18170 ANI 12 . DOUB C5 C6 yes N 12 . 18170 ANI 13 . SING C5 H5 no N 13 . 18170 ANI 14 . SING C6 H6 no N 14 . 18170 ANI 15 . SING C7 F1 no N 15 . 18170 ANI 16 . SING C7 F2 no N 16 . 18170 ANI 17 . SING C7 F3 no N 17 . 18170 ANI stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18170 _Sample.ID 1 _Sample.Type membrane _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% H2O' _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 CXCR1 '[U-100% 13C; U-100% 15N]' . . 1 $cxcr1 . . . 2 4 mg . . . . 18170 1 2 H2O 'natural abundance' . . . . . . 100 . . % . . . . 18170 1 3 HEPES 'natural abundance' . . . . . . 20 . . mM . . . . 18170 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 18170 _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' 20 . mM 18170 1 pH 7 . pH 18170 1 pressure 1 . atm 18170 1 temperature 273 . K 18170 1 stop_ save_ ############################ # Computer software used # ############################ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 18170 _Software.ID 1 _Software.Name 'X-PLOR NIH' _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 18170 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 18170 1 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 18170 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 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 18170 _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 . 750 . . . 18170 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 18170 _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 NCACX no . . . . . . . . . . 1 $sample_1 solid . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18170 1 2 SLF no . . . . . . . . . . 1 $sample_1 solid . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18170 1 3 PDSD no . . . . . . . . . . 1 $sample_1 solid . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18170 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 18170 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'solid CH' . . . . ppm 0.00 external direct 1 . . . . . . . . . 18170 1 N 15 'liquid anhydrous ammonia' nitrogen . . . . ppm 0.00 external direct 1 . . . . . . . . . 18170 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 18170 _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 NCACX . . . 18170 1 2 SLF . . . 18170 1 3 PDSD . . . 18170 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 1 1 MET C C 13 176.7 0.3 . 1 . . . . 20 MET C . 18170 1 2 . 1 1 1 1 MET CA C 13 58.2 0.4 . 1 . . . . 20 MET CA . 18170 1 3 . 1 1 1 1 MET CB C 13 31.8 0.4 . 1 . . . . 20 MET CB . 18170 1 4 . 1 1 1 1 MET N N 15 119.9 0.5 . 1 . . . . 20 MET N . 18170 1 5 . 1 1 2 2 PRO N N 15 145 0.5 . 1 . . . . 21 PRO N . 18170 1 6 . 1 1 4 4 ALA C C 13 178.6 0.3 . 1 . . . . 23 ALA C . 18170 1 7 . 1 1 4 4 ALA CA C 13 53.4 0.4 . 1 . . . . 23 ALA CA . 18170 1 8 . 1 1 4 4 ALA CB C 13 18.2 0.4 . 1 . . . . 23 ALA CB . 18170 1 9 . 1 1 4 4 ALA N N 15 124.4 0.5 . 1 . . . . 23 ALA N . 18170 1 10 . 1 1 5 5 ASP C C 13 177.4 0.3 . 1 . . . . 24 ASP C . 18170 1 11 . 1 1 5 5 ASP CA C 13 53.1 0.4 . 1 . . . . 24 ASP CA . 18170 1 12 . 1 1 5 5 ASP CB C 13 39.5 0.4 . 1 . . . . 24 ASP CB . 18170 1 13 . 1 1 5 5 ASP N N 15 124.2 0.5 . 1 . . . . 24 ASP N . 18170 1 14 . 1 1 6 6 GLU C C 13 176.2 0.3 . 1 . . . . 25 GLU C . 18170 1 15 . 1 1 6 6 GLU CA C 13 57.9 0.4 . 1 . . . . 25 GLU CA . 18170 1 16 . 1 1 6 6 GLU N N 15 123.8 0.5 . 1 . . . . 25 GLU N . 18170 1 17 . 1 1 7 7 ASP C C 13 177.4 0.3 . 1 . . . . 26 ASP C . 18170 1 18 . 1 1 7 7 ASP CA C 13 54.2 0.4 . 1 . . . . 26 ASP CA . 18170 1 19 . 1 1 7 7 ASP CB C 13 39.2 0.4 . 1 . . . . 26 ASP CB . 18170 1 20 . 1 1 7 7 ASP N N 15 120.4 0.5 . 1 . . . . 26 ASP N . 18170 1 21 . 1 1 8 8 TYR C C 13 176.5 0.3 . 1 . . . . 27 TYR C . 18170 1 22 . 1 1 8 8 TYR CA C 13 57.25 0.4 . 1 . . . . 27 TYR CA . 18170 1 23 . 1 1 8 8 TYR CB C 13 37.25 0.4 . 1 . . . . 27 TYR CB . 18170 1 24 . 1 1 8 8 TYR N N 15 123 0.5 . 1 . . . . 27 TYR N . 18170 1 25 . 1 1 9 9 SER C C 13 173 0.3 . 1 . . . . 28 SER C . 18170 1 26 . 1 1 9 9 SER CA C 13 57.5 0.4 . 1 . . . . 28 SER CA . 18170 1 27 . 1 1 9 9 SER CB C 13 63 0.4 . 1 . . . . 28 SER CB . 18170 1 28 . 1 1 9 9 SER N N 15 120.4 0.5 . 1 . . . . 28 SER N . 18170 1 29 . 1 1 10 10 PRO N N 15 133 0.5 . 1 . . . . 29 PRO N . 18170 1 30 . 1 1 11 11 CYS C C 13 177.5 0.3 . 1 . . . . 30 CYS C . 18170 1 31 . 1 1 11 11 CYS CA C 13 56 0.4 . 1 . . . . 30 CYS CA . 18170 1 32 . 1 1 11 11 CYS CB C 13 40.3 0.4 . 1 . . . . 30 CYS CB . 18170 1 33 . 1 1 11 11 CYS N N 15 122.7 0.5 . 1 . . . . 30 CYS N . 18170 1 34 . 1 1 12 12 MET C C 13 173.2 0.3 . 1 . . . . 31 MET C . 18170 1 35 . 1 1 12 12 MET CA C 13 58.15 0.4 . 1 . . . . 31 MET CA . 18170 1 36 . 1 1 12 12 MET CB C 13 31.1 0.4 . 1 . . . . 31 MET CB . 18170 1 37 . 1 1 12 12 MET N N 15 117.9 0.5 . 1 . . . . 31 MET N . 18170 1 38 . 1 1 13 13 LEU C C 13 173.5 0.3 . 1 . . . . 32 LEU C . 18170 1 39 . 1 1 13 13 LEU CA C 13 53.78 0.4 . 1 . . . . 32 LEU CA . 18170 1 40 . 1 1 13 13 LEU CB C 13 39.66 0.4 . 1 . . . . 32 LEU CB . 18170 1 41 . 1 1 13 13 LEU N N 15 125.3 0.5 . 1 . . . . 32 LEU N . 18170 1 42 . 1 1 14 14 GLU C C 13 173.2 0.3 . 1 . . . . 33 GLU C . 18170 1 43 . 1 1 14 14 GLU CA C 13 55.9 0.4 . 1 . . . . 33 GLU CA . 18170 1 44 . 1 1 14 14 GLU CB C 13 31 0.4 . 1 . . . . 33 GLU CB . 18170 1 45 . 1 1 14 14 GLU N N 15 129.9 0.5 . 1 . . . . 33 GLU N . 18170 1 46 . 1 1 15 15 THR C C 13 172.5 0.3 . 1 . . . . 34 THR C . 18170 1 47 . 1 1 15 15 THR CA C 13 63.5 0.4 . 1 . . . . 34 THR CA . 18170 1 48 . 1 1 15 15 THR CB C 13 67.2 0.4 . 1 . . . . 34 THR CB . 18170 1 49 . 1 1 15 15 THR N N 15 113.9 0.5 . 1 . . . . 34 THR N . 18170 1 50 . 1 1 16 16 GLU C C 13 169.5 0.3 . 1 . . . . 35 GLU C . 18170 1 51 . 1 1 16 16 GLU CA C 13 55.84 0.4 . 1 . . . . 35 GLU CA . 18170 1 52 . 1 1 16 16 GLU CB C 13 28.12 0.4 . 1 . . . . 35 GLU CB . 18170 1 53 . 1 1 16 16 GLU N N 15 125.3 0.5 . 1 . . . . 35 GLU N . 18170 1 54 . 1 1 17 17 THR C C 13 174.2 0.3 . 1 . . . . 36 THR C . 18170 1 55 . 1 1 17 17 THR CA C 13 65 0.4 . 1 . . . . 36 THR CA . 18170 1 56 . 1 1 17 17 THR N N 15 106.7 0.5 . 1 . . . . 36 THR N . 18170 1 57 . 1 1 18 18 LEU C C 13 177.5 0.3 . 1 . . . . 37 LEU C . 18170 1 58 . 1 1 18 18 LEU CA C 13 56.4 0.4 . 1 . . . . 37 LEU CA . 18170 1 59 . 1 1 18 18 LEU CB C 13 39.8 0.4 . 1 . . . . 37 LEU CB . 18170 1 60 . 1 1 18 18 LEU N N 15 120.1 0.5 . 1 . . . . 37 LEU N . 18170 1 61 . 1 1 19 19 ASN C C 13 177.6 0.3 . 1 . . . . 38 ASN C . 18170 1 62 . 1 1 19 19 ASN CA C 13 55.9 0.4 . 1 . . . . 38 ASN CA . 18170 1 63 . 1 1 19 19 ASN CB C 13 40.87 0.4 . 1 . . . . 38 ASN CB . 18170 1 64 . 1 1 19 19 ASN N N 15 118.4 0.5 . 1 . . . . 38 ASN N . 18170 1 65 . 1 1 20 20 LYS C C 13 174.3 0.3 . 1 . . . . 39 LYS C . 18170 1 66 . 1 1 20 20 LYS CA C 13 56.7 0.4 . 1 . . . . 39 LYS CA . 18170 1 67 . 1 1 20 20 LYS CB C 13 29.9 0.4 . 1 . . . . 39 LYS CB . 18170 1 68 . 1 1 20 20 LYS N N 15 121.5 0.5 . 1 . . . . 39 LYS N . 18170 1 69 . 1 1 21 21 TYR C C 13 176.8 0.3 . 1 . . . . 40 TYR C . 18170 1 70 . 1 1 21 21 TYR CA C 13 58.2 0.4 . 1 . . . . 40 TYR CA . 18170 1 71 . 1 1 21 21 TYR CB C 13 40 0.4 . 1 . . . . 40 TYR CB . 18170 1 72 . 1 1 21 21 TYR N N 15 120.1 0.5 . 1 . . . . 40 TYR N . 18170 1 73 . 1 1 22 22 VAL C C 13 176 0.3 . 1 . . . . 41 VAL C . 18170 1 74 . 1 1 22 22 VAL CA C 13 65 0.4 . 1 . . . . 41 VAL CA . 18170 1 75 . 1 1 22 22 VAL CB C 13 29.75 0.4 . 1 . . . . 41 VAL CB . 18170 1 76 . 1 1 22 22 VAL N N 15 120.7 0.5 . 1 . . . . 41 VAL N . 18170 1 77 . 1 1 23 23 VAL C C 13 176.2 0.3 . 1 . . . . 42 VAL C . 18170 1 78 . 1 1 23 23 VAL CA C 13 65.56 0.4 . 1 . . . . 42 VAL CA . 18170 1 79 . 1 1 23 23 VAL CB C 13 29.7 0.4 . 1 . . . . 42 VAL CB . 18170 1 80 . 1 1 23 23 VAL N N 15 121.2 0.5 . 1 . . . . 42 VAL N . 18170 1 81 . 1 1 24 24 ILE C C 13 177 0.3 . 1 . . . . 43 ILE C . 18170 1 82 . 1 1 24 24 ILE CA C 13 64.3 0.4 . 1 . . . . 43 ILE CA . 18170 1 83 . 1 1 24 24 ILE CB C 13 36.6 0.4 . 1 . . . . 43 ILE CB . 18170 1 84 . 1 1 24 24 ILE N N 15 120.9 0.5 . 1 . . . . 43 ILE N . 18170 1 85 . 1 1 25 25 ILE C C 13 175 0.3 . 1 . . . . 44 ILE C . 18170 1 86 . 1 1 25 25 ILE CA C 13 59.7 0.4 . 1 . . . . 44 ILE CA . 18170 1 87 . 1 1 25 25 ILE CB C 13 37 0.4 . 1 . . . . 44 ILE CB . 18170 1 88 . 1 1 25 25 ILE N N 15 120.5 0.5 . 1 . . . . 44 ILE N . 18170 1 89 . 1 1 26 26 ALA C C 13 175.7 0.3 . 1 . . . . 45 ALA C . 18170 1 90 . 1 1 26 26 ALA CA C 13 52.7 0.4 . 1 . . . . 45 ALA CA . 18170 1 91 . 1 1 26 26 ALA CB C 13 16.6 0.4 . 1 . . . . 45 ALA CB . 18170 1 92 . 1 1 26 26 ALA N N 15 121.6 0.5 . 1 . . . . 45 ALA N . 18170 1 93 . 1 1 27 27 TYR C C 13 175.4 0.3 . 1 . . . . 46 TYR C . 18170 1 94 . 1 1 27 27 TYR CA C 13 58.53 0.4 . 1 . . . . 46 TYR CA . 18170 1 95 . 1 1 27 27 TYR CB C 13 39.85 0.4 . 1 . . . . 46 TYR CB . 18170 1 96 . 1 1 27 27 TYR N N 15 120.4 0.5 . 1 . . . . 46 TYR N . 18170 1 97 . 1 1 28 28 ALA C C 13 174.8 0.3 . 1 . . . . 47 ALA C . 18170 1 98 . 1 1 28 28 ALA CA C 13 53.8 0.4 . 1 . . . . 47 ALA CA . 18170 1 99 . 1 1 28 28 ALA CB C 13 15.53 0.4 . 1 . . . . 47 ALA CB . 18170 1 100 . 1 1 28 28 ALA N N 15 124.7 0.5 . 1 . . . . 47 ALA N . 18170 1 101 . 1 1 29 29 LEU C C 13 177.4 0.3 . 1 . . . . 48 LEU C . 18170 1 102 . 1 1 29 29 LEU CA C 13 56.86 0.4 . 1 . . . . 48 LEU CA . 18170 1 103 . 1 1 29 29 LEU N N 15 117.7 0.5 . 1 . . . . 48 LEU N . 18170 1 104 . 1 1 30 30 VAL C C 13 181.1 0.3 . 1 . . . . 49 VAL C . 18170 1 105 . 1 1 30 30 VAL CA C 13 67.8 0.4 . 1 . . . . 49 VAL CA . 18170 1 106 . 1 1 30 30 VAL CB C 13 29.9 0.4 . 1 . . . . 49 VAL CB . 18170 1 107 . 1 1 30 30 VAL N N 15 118.4 0.5 . 1 . . . . 49 VAL N . 18170 1 108 . 1 1 31 31 PHE C C 13 171.9 0.3 . 1 . . . . 50 PHE C . 18170 1 109 . 1 1 31 31 PHE CA C 13 61.6 0.4 . 1 . . . . 50 PHE CA . 18170 1 110 . 1 1 31 31 PHE CB C 13 42.62 0.4 . 1 . . . . 50 PHE CB . 18170 1 111 . 1 1 31 31 PHE N N 15 124.7 0.5 . 1 . . . . 50 PHE N . 18170 1 112 . 1 1 32 32 LEU C C 13 176.6 0.3 . 1 . . . . 51 LEU C . 18170 1 113 . 1 1 32 32 LEU CA C 13 55.85 0.4 . 1 . . . . 51 LEU CA . 18170 1 114 . 1 1 32 32 LEU CB C 13 40.22 0.4 . 1 . . . . 51 LEU CB . 18170 1 115 . 1 1 32 32 LEU N N 15 125.6 0.5 . 1 . . . . 51 LEU N . 18170 1 116 . 1 1 33 33 LEU C C 13 173.7 0.3 . 1 . . . . 52 LEU C . 18170 1 117 . 1 1 33 33 LEU CA C 13 56.3 0.4 . 1 . . . . 52 LEU CA . 18170 1 118 . 1 1 33 33 LEU CB C 13 39.2 0.4 . 1 . . . . 52 LEU CB . 18170 1 119 . 1 1 33 33 LEU N N 15 122.8 0.5 . 1 . . . . 52 LEU N . 18170 1 120 . 1 1 34 34 SER C C 13 173 0.3 . 1 . . . . 53 SER C . 18170 1 121 . 1 1 34 34 SER CA C 13 58.2 0.4 . 1 . . . . 53 SER CA . 18170 1 122 . 1 1 34 34 SER N N 15 118.7 0.5 . 1 . . . . 53 SER N . 18170 1 123 . 1 1 35 35 LEU C C 13 176.8 0.3 . 1 . . . . 54 LEU C . 18170 1 124 . 1 1 35 35 LEU CA C 13 56.4 0.4 . 1 . . . . 54 LEU CA . 18170 1 125 . 1 1 35 35 LEU CB C 13 40 0.4 . 1 . . . . 54 LEU CB . 18170 1 126 . 1 1 35 35 LEU N N 15 123.5 0.5 . 1 . . . . 54 LEU N . 18170 1 127 . 1 1 36 36 LEU C C 13 177.2 0.3 . 1 . . . . 55 LEU C . 18170 1 128 . 1 1 36 36 LEU CA C 13 56 0.4 . 1 . . . . 55 LEU CA . 18170 1 129 . 1 1 36 36 LEU CB C 13 40 0.4 . 1 . . . . 55 LEU CB . 18170 1 130 . 1 1 36 36 LEU N N 15 124.6 0.5 . 1 . . . . 55 LEU N . 18170 1 131 . 1 1 37 37 GLY C C 13 174.8 0.3 . 1 . . . . 56 GLY C . 18170 1 132 . 1 1 37 37 GLY CA C 13 47.4 0.4 . 1 . . . . 56 GLY CA . 18170 1 133 . 1 1 37 37 GLY N N 15 109.6 0.5 . 1 . . . . 56 GLY N . 18170 1 134 . 1 1 38 38 ASN C C 13 176.9 0.3 . 1 . . . . 57 ASN C . 18170 1 135 . 1 1 38 38 ASN CA C 13 55.7 0.4 . 1 . . . . 57 ASN CA . 18170 1 136 . 1 1 38 38 ASN CB C 13 39.3 0.4 . 1 . . . . 57 ASN CB . 18170 1 137 . 1 1 38 38 ASN N N 15 118.2 0.5 . 1 . . . . 57 ASN N . 18170 1 138 . 1 1 39 39 SER C C 13 180.1 0.3 . 1 . . . . 58 SER C . 18170 1 139 . 1 1 39 39 SER CA C 13 59.9 0.4 . 1 . . . . 58 SER CA . 18170 1 140 . 1 1 39 39 SER CB C 13 63.3 0.4 . 1 . . . . 58 SER CB . 18170 1 141 . 1 1 39 39 SER N N 15 111.3 0.5 . 1 . . . . 58 SER N . 18170 1 142 . 1 1 40 40 LEU C C 13 177.4 0.3 . 1 . . . . 59 LEU C . 18170 1 143 . 1 1 40 40 LEU CA C 13 56.15 0.4 . 1 . . . . 59 LEU CA . 18170 1 144 . 1 1 40 40 LEU CB C 13 41 0.4 . 1 . . . . 59 LEU CB . 18170 1 145 . 1 1 40 40 LEU N N 15 121.1 0.5 . 1 . . . . 59 LEU N . 18170 1 146 . 1 1 41 41 VAL C C 13 175.2 0.3 . 1 . . . . 60 VAL C . 18170 1 147 . 1 1 41 41 VAL CA C 13 65.4 0.4 . 1 . . . . 60 VAL CA . 18170 1 148 . 1 1 41 41 VAL CB C 13 29.5 0.4 . 1 . . . . 60 VAL CB . 18170 1 149 . 1 1 41 41 VAL N N 15 119.3 0.5 . 1 . . . . 60 VAL N . 18170 1 150 . 1 1 42 42 MET C C 13 176.5 0.3 . 1 . . . . 61 MET C . 18170 1 151 . 1 1 42 42 MET CA C 13 55.84 0.4 . 1 . . . . 61 MET CA . 18170 1 152 . 1 1 42 42 MET N N 15 118.9 0.5 . 1 . . . . 61 MET N . 18170 1 153 . 1 1 43 43 LEU C C 13 177.7 0.3 . 1 . . . . 62 LEU C . 18170 1 154 . 1 1 43 43 LEU CA C 13 56.16 0.4 . 1 . . . . 62 LEU CA . 18170 1 155 . 1 1 43 43 LEU CB C 13 39.11 0.4 . 1 . . . . 62 LEU CB . 18170 1 156 . 1 1 43 43 LEU N N 15 122.1 0.5 . 1 . . . . 62 LEU N . 18170 1 157 . 1 1 44 44 VAL CA C 13 64.85 0.4 . 1 . . . . 63 VAL CA . 18170 1 158 . 1 1 44 44 VAL CB C 13 29.6 0.4 . 1 . . . . 63 VAL CB . 18170 1 159 . 1 1 44 44 VAL N N 15 121.1 0.5 . 1 . . . . 63 VAL N . 18170 1 160 . 1 1 45 45 ILE C C 13 175.1 0.3 . 1 . . . . 64 ILE C . 18170 1 161 . 1 1 45 45 ILE CA C 13 64.4 0.4 . 1 . . . . 64 ILE CA . 18170 1 162 . 1 1 45 45 ILE CB C 13 36.6 0.4 . 1 . . . . 64 ILE CB . 18170 1 163 . 1 1 45 45 ILE N N 15 121 0.5 . 1 . . . . 64 ILE N . 18170 1 164 . 1 1 46 46 LEU C C 13 173.8 0.3 . 1 . . . . 65 LEU C . 18170 1 165 . 1 1 46 46 LEU CA C 13 56.2 0.4 . 1 . . . . 65 LEU CA . 18170 1 166 . 1 1 46 46 LEU CB C 13 39.3 0.4 . 1 . . . . 65 LEU CB . 18170 1 167 . 1 1 46 46 LEU N N 15 119 0.5 . 1 . . . . 65 LEU N . 18170 1 168 . 1 1 47 47 TYR C C 13 176.7 0.3 . 1 . . . . 66 TYR C . 18170 1 169 . 1 1 47 47 TYR CA C 13 58.34 0.4 . 1 . . . . 66 TYR CA . 18170 1 170 . 1 1 47 47 TYR CB C 13 40 0.4 . 1 . . . . 66 TYR CB . 18170 1 171 . 1 1 47 47 TYR N N 15 120.2 0.5 . 1 . . . . 66 TYR N . 18170 1 172 . 1 1 48 48 SER C C 13 175.4 0.3 . 1 . . . . 67 SER C . 18170 1 173 . 1 1 48 48 SER CA C 13 60 0.4 . 1 . . . . 67 SER CA . 18170 1 174 . 1 1 48 48 SER CB C 13 62 0.4 . 1 . . . . 67 SER CB . 18170 1 175 . 1 1 48 48 SER N N 15 116.7 0.5 . 1 . . . . 67 SER N . 18170 1 176 . 1 1 49 49 ARG C C 13 175.3 0.3 . 1 . . . . 68 ARG C . 18170 1 177 . 1 1 49 49 ARG CA C 13 60.4 0.4 . 1 . . . . 68 ARG CA . 18170 1 178 . 1 1 49 49 ARG N N 15 121.5 0.5 . 1 . . . . 68 ARG N . 18170 1 179 . 1 1 50 50 VAL C C 13 174.6 0.3 . 1 . . . . 69 VAL C . 18170 1 180 . 1 1 50 50 VAL CA C 13 65.8 0.4 . 1 . . . . 69 VAL CA . 18170 1 181 . 1 1 50 50 VAL CB C 13 29.85 0.4 . 1 . . . . 69 VAL CB . 18170 1 182 . 1 1 50 50 VAL N N 15 120.6 0.5 . 1 . . . . 69 VAL N . 18170 1 183 . 1 1 51 51 GLY C C 13 174.4 0.3 . 1 . . . . 70 GLY C . 18170 1 184 . 1 1 51 51 GLY CA C 13 41.7 0.4 . 1 . . . . 70 GLY CA . 18170 1 185 . 1 1 51 51 GLY N N 15 110.7 0.5 . 1 . . . . 70 GLY N . 18170 1 186 . 1 1 52 52 ARG C C 13 176.5 0.3 . 1 . . . . 71 ARG C . 18170 1 187 . 1 1 52 52 ARG CA C 13 56.8 0.4 . 1 . . . . 71 ARG CA . 18170 1 188 . 1 1 52 52 ARG CB C 13 29.9 0.4 . 1 . . . . 71 ARG CB . 18170 1 189 . 1 1 52 52 ARG N N 15 122.9 0.5 . 1 . . . . 71 ARG N . 18170 1 190 . 1 1 53 53 SER C C 13 174.3 0.3 . 1 . . . . 72 SER C . 18170 1 191 . 1 1 53 53 SER CA C 13 57.8 0.4 . 1 . . . . 72 SER CA . 18170 1 192 . 1 1 53 53 SER N N 15 117.3 0.5 . 1 . . . . 72 SER N . 18170 1 193 . 1 1 54 54 VAL C C 13 175.7 0.3 . 1 . . . . 73 VAL C . 18170 1 194 . 1 1 54 54 VAL CA C 13 66.1 0.4 . 1 . . . . 73 VAL CA . 18170 1 195 . 1 1 54 54 VAL CB C 13 29.65 0.4 . 1 . . . . 73 VAL CB . 18170 1 196 . 1 1 54 54 VAL N N 15 120.4 0.5 . 1 . . . . 73 VAL N . 18170 1 197 . 1 1 55 55 THR C C 13 175.8 0.3 . 1 . . . . 74 THR C . 18170 1 198 . 1 1 55 55 THR CA C 13 64 0.4 . 1 . . . . 74 THR CA . 18170 1 199 . 1 1 55 55 THR N N 15 117.3 0.5 . 1 . . . . 74 THR N . 18170 1 200 . 1 1 56 56 ASP C C 13 176.5 0.3 . 1 . . . . 75 ASP C . 18170 1 201 . 1 1 56 56 ASP CA C 13 56 0.4 . 1 . . . . 75 ASP CA . 18170 1 202 . 1 1 56 56 ASP CB C 13 40.3 0.4 . 1 . . . . 75 ASP CB . 18170 1 203 . 1 1 56 56 ASP N N 15 122.9 0.5 . 1 . . . . 75 ASP N . 18170 1 204 . 1 1 57 57 VAL C C 13 175.6 0.3 . 1 . . . . 76 VAL C . 18170 1 205 . 1 1 57 57 VAL CA C 13 66.4 0.4 . 1 . . . . 76 VAL CA . 18170 1 206 . 1 1 57 57 VAL CB C 13 30.4 0.4 . 1 . . . . 76 VAL CB . 18170 1 207 . 1 1 57 57 VAL N N 15 120.8 0.5 . 1 . . . . 76 VAL N . 18170 1 208 . 1 1 58 58 TYR C C 13 175.7 0.3 . 1 . . . . 77 TYR C . 18170 1 209 . 1 1 58 58 TYR CA C 13 60.56 0.4 . 1 . . . . 77 TYR CA . 18170 1 210 . 1 1 58 58 TYR CB C 13 37 0.4 . 1 . . . . 77 TYR CB . 18170 1 211 . 1 1 58 58 TYR N N 15 123.8 0.5 . 1 . . . . 77 TYR N . 18170 1 212 . 1 1 59 59 LEU C C 13 176.5 0.3 . 1 . . . . 78 LEU C . 18170 1 213 . 1 1 59 59 LEU CA C 13 55.9 0.4 . 1 . . . . 78 LEU CA . 18170 1 214 . 1 1 59 59 LEU CB C 13 40 0.4 . 1 . . . . 78 LEU CB . 18170 1 215 . 1 1 59 59 LEU N N 15 121 0.5 . 1 . . . . 78 LEU N . 18170 1 216 . 1 1 60 60 LEU C C 13 176 0.3 . 1 . . . . 79 LEU C . 18170 1 217 . 1 1 60 60 LEU CA C 13 55.8 0.4 . 1 . . . . 79 LEU CA . 18170 1 218 . 1 1 60 60 LEU CB C 13 40.24 0.4 . 1 . . . . 79 LEU CB . 18170 1 219 . 1 1 60 60 LEU N N 15 126.2 0.5 . 1 . . . . 79 LEU N . 18170 1 220 . 1 1 61 61 ASN C C 13 178.1 0.3 . 1 . . . . 80 ASN C . 18170 1 221 . 1 1 61 61 ASN CA C 13 56.5 0.4 . 1 . . . . 80 ASN CA . 18170 1 222 . 1 1 61 61 ASN CB C 13 39.1 0.4 . 1 . . . . 80 ASN CB . 18170 1 223 . 1 1 61 61 ASN N N 15 121.3 0.5 . 1 . . . . 80 ASN N . 18170 1 224 . 1 1 62 62 LEU C C 13 176.3 0.3 . 1 . . . . 81 LEU C . 18170 1 225 . 1 1 62 62 LEU CA C 13 56 0.4 . 1 . . . . 81 LEU CA . 18170 1 226 . 1 1 62 62 LEU CB C 13 38.1 0.4 . 1 . . . . 81 LEU CB . 18170 1 227 . 1 1 62 62 LEU N N 15 124.1 0.5 . 1 . . . . 81 LEU N . 18170 1 228 . 1 1 63 63 ALA C C 13 177.5 0.3 . 1 . . . . 82 ALA C . 18170 1 229 . 1 1 63 63 ALA CA C 13 53.4 0.4 . 1 . . . . 82 ALA CA . 18170 1 230 . 1 1 63 63 ALA CB C 13 18.3 0.4 . 1 . . . . 82 ALA CB . 18170 1 231 . 1 1 63 63 ALA N N 15 124.7 0.5 . 1 . . . . 82 ALA N . 18170 1 232 . 1 1 64 64 LEU C C 13 176.5 0.3 . 1 . . . . 83 LEU C . 18170 1 233 . 1 1 64 64 LEU CA C 13 55.9 0.4 . 1 . . . . 83 LEU CA . 18170 1 234 . 1 1 64 64 LEU CB C 13 40.2 0.4 . 1 . . . . 83 LEU CB . 18170 1 235 . 1 1 64 64 LEU N N 15 121.4 0.5 . 1 . . . . 83 LEU N . 18170 1 236 . 1 1 65 65 ALA C C 13 176.6 0.3 . 1 . . . . 84 ALA C . 18170 1 237 . 1 1 65 65 ALA CA C 13 54.4 0.4 . 1 . . . . 84 ALA CA . 18170 1 238 . 1 1 65 65 ALA CB C 13 16.6 0.4 . 1 . . . . 84 ALA CB . 18170 1 239 . 1 1 65 65 ALA N N 15 123.9 0.5 . 1 . . . . 84 ALA N . 18170 1 240 . 1 1 66 66 ASP C C 13 178.4 0.3 . 1 . . . . 85 ASP C . 18170 1 241 . 1 1 66 66 ASP CA C 13 56.33 0.4 . 1 . . . . 85 ASP CA . 18170 1 242 . 1 1 66 66 ASP CB C 13 39.85 0.4 . 1 . . . . 85 ASP CB . 18170 1 243 . 1 1 66 66 ASP N N 15 120.3 0.5 . 1 . . . . 85 ASP N . 18170 1 244 . 1 1 67 67 LEU C C 13 173.6 0.3 . 1 . . . . 86 LEU C . 18170 1 245 . 1 1 67 67 LEU CA C 13 56.3 0.4 . 1 . . . . 86 LEU CA . 18170 1 246 . 1 1 67 67 LEU CB C 13 39.5 0.4 . 1 . . . . 86 LEU CB . 18170 1 247 . 1 1 67 67 LEU N N 15 122.7 0.5 . 1 . . . . 86 LEU N . 18170 1 248 . 1 1 68 68 LEU C C 13 175.6 0.3 . 1 . . . . 87 LEU C . 18170 1 249 . 1 1 68 68 LEU CA C 13 56.15 0.4 . 1 . . . . 87 LEU CA . 18170 1 250 . 1 1 68 68 LEU CB C 13 40 0.4 . 1 . . . . 87 LEU CB . 18170 1 251 . 1 1 68 68 LEU N N 15 122 0.5 . 1 . . . . 87 LEU N . 18170 1 252 . 1 1 69 69 PHE C C 13 173.9 0.3 . 1 . . . . 88 PHE C . 18170 1 253 . 1 1 69 69 PHE CA C 13 55.9 0.4 . 1 . . . . 88 PHE CA . 18170 1 254 . 1 1 69 69 PHE CB C 13 40.4 0.4 . 1 . . . . 88 PHE CB . 18170 1 255 . 1 1 69 69 PHE N N 15 119.2 0.5 . 1 . . . . 88 PHE N . 18170 1 256 . 1 1 70 70 ALA C C 13 172.9 0.3 . 1 . . . . 89 ALA C . 18170 1 257 . 1 1 70 70 ALA CA C 13 53.1 0.4 . 1 . . . . 89 ALA CA . 18170 1 258 . 1 1 70 70 ALA CB C 13 17 0.4 . 1 . . . . 89 ALA CB . 18170 1 259 . 1 1 70 70 ALA N N 15 126.6 0.5 . 1 . . . . 89 ALA N . 18170 1 260 . 1 1 71 71 LEU C C 13 172.5 0.3 . 1 . . . . 90 LEU C . 18170 1 261 . 1 1 71 71 LEU CA C 13 56.5 0.4 . 1 . . . . 90 LEU CA . 18170 1 262 . 1 1 71 71 LEU CB C 13 39.9 0.4 . 1 . . . . 90 LEU CB . 18170 1 263 . 1 1 71 71 LEU N N 15 119.7 0.5 . 1 . . . . 90 LEU N . 18170 1 264 . 1 1 72 72 THR C C 13 176.4 0.3 . 1 . . . . 91 THR C . 18170 1 265 . 1 1 72 72 THR CA C 13 60 0.4 . 1 . . . . 91 THR CA . 18170 1 266 . 1 1 72 72 THR CB C 13 69.5 0.4 . 1 . . . . 91 THR CB . 18170 1 267 . 1 1 72 72 THR N N 15 115.3 0.5 . 1 . . . . 91 THR N . 18170 1 268 . 1 1 73 73 LEU C C 13 175.4 0.3 . 1 . . . . 92 LEU C . 18170 1 269 . 1 1 73 73 LEU CA C 13 55.6 0.4 . 1 . . . . 92 LEU CA . 18170 1 270 . 1 1 73 73 LEU CB C 13 40.8 0.4 . 1 . . . . 92 LEU CB . 18170 1 271 . 1 1 73 73 LEU N N 15 123 0.5 . 1 . . . . 92 LEU N . 18170 1 272 . 1 1 75 75 ILE C C 13 176.8 0.3 . 1 . . . . 94 ILE C . 18170 1 273 . 1 1 75 75 ILE CA C 13 64.3 0.4 . 1 . . . . 94 ILE CA . 18170 1 274 . 1 1 75 75 ILE CB C 13 36.6 0.4 . 1 . . . . 94 ILE CB . 18170 1 275 . 1 1 75 75 ILE N N 15 121 0.5 . 1 . . . . 94 ILE N . 18170 1 276 . 1 1 76 76 TRP C C 13 176.7 0.3 . 1 . . . . 95 TRP C . 18170 1 277 . 1 1 76 76 TRP CA C 13 58.1 0.4 . 1 . . . . 95 TRP CA . 18170 1 278 . 1 1 76 76 TRP CB C 13 29 0.4 . 1 . . . . 95 TRP CB . 18170 1 279 . 1 1 76 76 TRP N N 15 120.5 0.5 . 1 . . . . 95 TRP N . 18170 1 280 . 1 1 77 77 ALA C C 13 178.3 0.3 . 1 . . . . 96 ALA C . 18170 1 281 . 1 1 77 77 ALA CA C 13 52.4 0.4 . 1 . . . . 96 ALA CA . 18170 1 282 . 1 1 77 77 ALA CB C 13 20.4 0.4 . 1 . . . . 96 ALA CB . 18170 1 283 . 1 1 77 77 ALA N N 15 126.3 0.5 . 1 . . . . 96 ALA N . 18170 1 284 . 1 1 78 78 ALA C C 13 178 0.3 . 1 . . . . 97 ALA C . 18170 1 285 . 1 1 78 78 ALA CA C 13 53.6 0.4 . 1 . . . . 97 ALA CA . 18170 1 286 . 1 1 78 78 ALA CB C 13 16.7 0.4 . 1 . . . . 97 ALA CB . 18170 1 287 . 1 1 78 78 ALA N N 15 123.2 0.5 . 1 . . . . 97 ALA N . 18170 1 288 . 1 1 79 79 SER CA C 13 63 0.4 . 1 . . . . 98 SER CA . 18170 1 289 . 1 1 79 79 SER N N 15 109.4 0.5 . 1 . . . . 98 SER N . 18170 1 290 . 1 1 80 80 LYS C C 13 177.3 0.3 . 1 . . . . 99 LYS C . 18170 1 291 . 1 1 80 80 LYS CA C 13 56.1 0.4 . 1 . . . . 99 LYS CA . 18170 1 292 . 1 1 80 80 LYS CB C 13 30.7 0.4 . 1 . . . . 99 LYS CB . 18170 1 293 . 1 1 80 80 LYS N N 15 121.5 0.5 . 1 . . . . 99 LYS N . 18170 1 294 . 1 1 81 81 VAL C C 13 176.3 0.3 . 1 . . . . 100 VAL C . 18170 1 295 . 1 1 81 81 VAL CA C 13 64.9 0.4 . 1 . . . . 100 VAL CA . 18170 1 296 . 1 1 81 81 VAL CB C 13 29.85 0.4 . 1 . . . . 100 VAL CB . 18170 1 297 . 1 1 81 81 VAL N N 15 121.2 0.5 . 1 . . . . 100 VAL N . 18170 1 298 . 1 1 82 82 ASN C C 13 173.8 0.3 . 1 . . . . 101 ASN C . 18170 1 299 . 1 1 82 82 ASN CA C 13 52.3 0.4 . 1 . . . . 101 ASN CA . 18170 1 300 . 1 1 82 82 ASN CB C 13 39.7 0.4 . 1 . . . . 101 ASN CB . 18170 1 301 . 1 1 82 82 ASN N N 15 116.7 0.5 . 1 . . . . 101 ASN N . 18170 1 302 . 1 1 83 83 GLY C C 13 174.6 0.3 . 1 . . . . 102 GLY C . 18170 1 303 . 1 1 83 83 GLY CA C 13 45.9 0.4 . 1 . . . . 102 GLY CA . 18170 1 304 . 1 1 83 83 GLY N N 15 109.5 0.5 . 1 . . . . 102 GLY N . 18170 1 305 . 1 1 84 84 TRP C C 13 173.9 0.3 . 1 . . . . 103 TRP C . 18170 1 306 . 1 1 84 84 TRP CA C 13 58 0.4 . 1 . . . . 103 TRP CA . 18170 1 307 . 1 1 84 84 TRP CB C 13 31 0.4 . 1 . . . . 103 TRP CB . 18170 1 308 . 1 1 84 84 TRP N N 15 117.7 0.5 . 1 . . . . 103 TRP N . 18170 1 309 . 1 1 85 85 ILE C C 13 175.7 0.3 . 1 . . . . 104 ILE C . 18170 1 310 . 1 1 85 85 ILE CA C 13 60.4 0.4 . 1 . . . . 104 ILE CA . 18170 1 311 . 1 1 85 85 ILE CB C 13 35.6 0.4 . 1 . . . . 104 ILE CB . 18170 1 312 . 1 1 85 85 ILE N N 15 124.3 0.5 . 1 . . . . 104 ILE N . 18170 1 313 . 1 1 86 86 PHE C C 13 177.2 0.3 . 1 . . . . 105 PHE C . 18170 1 314 . 1 1 86 86 PHE CA C 13 55.7 0.4 . 1 . . . . 105 PHE CA . 18170 1 315 . 1 1 86 86 PHE CB C 13 40.5 0.4 . 1 . . . . 105 PHE CB . 18170 1 316 . 1 1 86 86 PHE N N 15 121.1 0.5 . 1 . . . . 105 PHE N . 18170 1 317 . 1 1 87 87 GLY C C 13 174.5 0.3 . 1 . . . . 106 GLY C . 18170 1 318 . 1 1 87 87 GLY CA C 13 41.9 0.4 . 1 . . . . 106 GLY CA . 18170 1 319 . 1 1 87 87 GLY N N 15 110 0.5 . 1 . . . . 106 GLY N . 18170 1 320 . 1 1 88 88 THR C C 13 173.5 0.3 . 1 . . . . 107 THR C . 18170 1 321 . 1 1 88 88 THR CA C 13 60.5 0.4 . 1 . . . . 107 THR CA . 18170 1 322 . 1 1 88 88 THR CB C 13 69.7 0.4 . 1 . . . . 107 THR CB . 18170 1 323 . 1 1 88 88 THR N N 15 114.7 0.5 . 1 . . . . 107 THR N . 18170 1 324 . 1 1 89 89 PHE C C 13 173.5 0.3 . 1 . . . . 108 PHE C . 18170 1 325 . 1 1 89 89 PHE CA C 13 60 0.4 . 1 . . . . 108 PHE CA . 18170 1 326 . 1 1 89 89 PHE CB C 13 37.03 0.4 . 1 . . . . 108 PHE CB . 18170 1 327 . 1 1 89 89 PHE N N 15 124.2 0.5 . 1 . . . . 108 PHE N . 18170 1 328 . 1 1 90 90 LEU C C 13 176 0.3 . 1 . . . . 109 LEU C . 18170 1 329 . 1 1 90 90 LEU CA C 13 55.5 0.4 . 1 . . . . 109 LEU CA . 18170 1 330 . 1 1 90 90 LEU CB C 13 40.9 0.4 . 1 . . . . 109 LEU CB . 18170 1 331 . 1 1 90 90 LEU N N 15 123.2 0.5 . 1 . . . . 109 LEU N . 18170 1 332 . 1 1 91 91 CYS C C 13 176.7 0.3 . 1 . . . . 110 CYS C . 18170 1 333 . 1 1 91 91 CYS CA C 13 55.7 0.4 . 1 . . . . 110 CYS CA . 18170 1 334 . 1 1 91 91 CYS CB C 13 39.4 0.4 . 1 . . . . 110 CYS CB . 18170 1 335 . 1 1 91 91 CYS N N 15 117.6 0.5 . 1 . . . . 110 CYS N . 18170 1 336 . 1 1 92 92 LYS C C 13 176.4 0.3 . 1 . . . . 111 LYS C . 18170 1 337 . 1 1 92 92 LYS CA C 13 57.3 0.4 . 1 . . . . 111 LYS CA . 18170 1 338 . 1 1 92 92 LYS CB C 13 30 0.4 . 1 . . . . 111 LYS CB . 18170 1 339 . 1 1 92 92 LYS N N 15 121.6 0.5 . 1 . . . . 111 LYS N . 18170 1 340 . 1 1 93 93 VAL C C 13 174.1 0.3 . 1 . . . . 112 VAL C . 18170 1 341 . 1 1 93 93 VAL CA C 13 68 0.4 . 1 . . . . 112 VAL CA . 18170 1 342 . 1 1 93 93 VAL N N 15 123.6 0.5 . 1 . . . . 112 VAL N . 18170 1 343 . 1 1 94 94 VAL C C 13 169.6 0.3 . 1 . . . . 113 VAL C . 18170 1 344 . 1 1 94 94 VAL CA C 13 68.8 0.4 . 1 . . . . 113 VAL CA . 18170 1 345 . 1 1 94 94 VAL N N 15 127.8 0.5 . 1 . . . . 113 VAL N . 18170 1 346 . 1 1 95 95 SER C C 13 175.2 0.3 . 1 . . . . 114 SER C . 18170 1 347 . 1 1 95 95 SER CA C 13 60.2 0.4 . 1 . . . . 114 SER CA . 18170 1 348 . 1 1 95 95 SER CB C 13 61.89 0.4 . 1 . . . . 114 SER CB . 18170 1 349 . 1 1 95 95 SER N N 15 117.5 0.5 . 1 . . . . 114 SER N . 18170 1 350 . 1 1 96 96 LEU C C 13 173.7 0.3 . 1 . . . . 115 LEU C . 18170 1 351 . 1 1 96 96 LEU CA C 13 55.9 0.4 . 1 . . . . 115 LEU CA . 18170 1 352 . 1 1 96 96 LEU CB C 13 40.6 0.4 . 1 . . . . 115 LEU CB . 18170 1 353 . 1 1 96 96 LEU N N 15 120 0.5 . 1 . . . . 115 LEU N . 18170 1 354 . 1 1 97 97 LEU C C 13 177.8 0.3 . 1 . . . . 116 LEU C . 18170 1 355 . 1 1 97 97 LEU CA C 13 55.9 0.4 . 1 . . . . 116 LEU CA . 18170 1 356 . 1 1 97 97 LEU CB C 13 40.25 0.4 . 1 . . . . 116 LEU CB . 18170 1 357 . 1 1 97 97 LEU N N 15 126 0.5 . 1 . . . . 116 LEU N . 18170 1 358 . 1 1 98 98 LYS C C 13 173.2 0.3 . 1 . . . . 117 LYS C . 18170 1 359 . 1 1 98 98 LYS CA C 13 57 0.4 . 1 . . . . 117 LYS CA . 18170 1 360 . 1 1 98 98 LYS CB C 13 29.8 0.4 . 1 . . . . 117 LYS CB . 18170 1 361 . 1 1 98 98 LYS N N 15 120.9 0.5 . 1 . . . . 117 LYS N . 18170 1 362 . 1 1 99 99 GLU C C 13 177.1 0.3 . 1 . . . . 118 GLU C . 18170 1 363 . 1 1 99 99 GLU CA C 13 55.3 0.4 . 1 . . . . 118 GLU CA . 18170 1 364 . 1 1 99 99 GLU CB C 13 28 0.4 . 1 . . . . 118 GLU CB . 18170 1 365 . 1 1 99 99 GLU N N 15 118.9 0.5 . 1 . . . . 118 GLU N . 18170 1 366 . 1 1 100 100 VAL C C 13 173.6 0.3 . 1 . . . . 119 VAL C . 18170 1 367 . 1 1 100 100 VAL CA C 13 65.33 0.4 . 1 . . . . 119 VAL CA . 18170 1 368 . 1 1 100 100 VAL CB C 13 29.25 0.4 . 1 . . . . 119 VAL CB . 18170 1 369 . 1 1 100 100 VAL N N 15 123.4 0.5 . 1 . . . . 119 VAL N . 18170 1 370 . 1 1 101 101 ASN C C 13 174.5 0.3 . 1 . . . . 120 ASN C . 18170 1 371 . 1 1 101 101 ASN CA C 13 55.8 0.4 . 1 . . . . 120 ASN CA . 18170 1 372 . 1 1 101 101 ASN CB C 13 38.9 0.4 . 1 . . . . 120 ASN CB . 18170 1 373 . 1 1 101 101 ASN N N 15 120.3 0.5 . 1 . . . . 120 ASN N . 18170 1 374 . 1 1 102 102 PHE C C 13 175.5 0.3 . 1 . . . . 121 PHE C . 18170 1 375 . 1 1 102 102 PHE CA C 13 60.5 0.4 . 1 . . . . 121 PHE CA . 18170 1 376 . 1 1 102 102 PHE CB C 13 37 0.4 . 1 . . . . 121 PHE CB . 18170 1 377 . 1 1 102 102 PHE N N 15 123.6 0.5 . 1 . . . . 121 PHE N . 18170 1 378 . 1 1 103 103 TYR C C 13 176.1 0.3 . 1 . . . . 122 TYR C . 18170 1 379 . 1 1 103 103 TYR CA C 13 60.9 0.4 . 1 . . . . 122 TYR CA . 18170 1 380 . 1 1 103 103 TYR CB C 13 37.3 0.4 . 1 . . . . 122 TYR CB . 18170 1 381 . 1 1 103 103 TYR N N 15 120.5 0.5 . 1 . . . . 122 TYR N . 18170 1 382 . 1 1 104 104 SER C C 13 173.9 0.3 . 1 . . . . 123 SER C . 18170 1 383 . 1 1 104 104 SER CA C 13 57.74 0.4 . 1 . . . . 123 SER CA . 18170 1 384 . 1 1 104 104 SER CB C 13 59.87 0.4 . 1 . . . . 123 SER CB . 18170 1 385 . 1 1 104 104 SER N N 15 124.6 0.5 . 1 . . . . 123 SER N . 18170 1 386 . 1 1 105 105 GLY C C 13 171 0.3 . 1 . . . . 124 GLY C . 18170 1 387 . 1 1 105 105 GLY CA C 13 42.75 0.4 . 1 . . . . 124 GLY CA . 18170 1 388 . 1 1 105 105 GLY N N 15 107.7 0.5 . 1 . . . . 124 GLY N . 18170 1 389 . 1 1 106 106 ILE C C 13 175.2 0.3 . 1 . . . . 125 ILE C . 18170 1 390 . 1 1 106 106 ILE CA C 13 62.95 0.4 . 1 . . . . 125 ILE CA . 18170 1 391 . 1 1 106 106 ILE CB C 13 36.96 0.4 . 1 . . . . 125 ILE CB . 18170 1 392 . 1 1 106 106 ILE N N 15 119.5 0.5 . 1 . . . . 125 ILE N . 18170 1 393 . 1 1 107 107 LEU C C 13 173.6 0.3 . 1 . . . . 126 LEU C . 18170 1 394 . 1 1 107 107 LEU CA C 13 56.25 0.4 . 1 . . . . 126 LEU CA . 18170 1 395 . 1 1 107 107 LEU N N 15 122.3 0.5 . 1 . . . . 126 LEU N . 18170 1 396 . 1 1 108 108 LEU C C 13 176.1 0.3 . 1 . . . . 127 LEU C . 18170 1 397 . 1 1 108 108 LEU CA C 13 55.22 0.4 . 1 . . . . 127 LEU CA . 18170 1 398 . 1 1 108 108 LEU CB C 13 41.67 0.4 . 1 . . . . 127 LEU CB . 18170 1 399 . 1 1 108 108 LEU N N 15 126.5 0.5 . 1 . . . . 127 LEU N . 18170 1 400 . 1 1 109 109 LEU C C 13 175.6 0.3 . 1 . . . . 128 LEU C . 18170 1 401 . 1 1 109 109 LEU CA C 13 57.17 0.4 . 1 . . . . 128 LEU CA . 18170 1 402 . 1 1 109 109 LEU CB C 13 40.3 0.4 . 1 . . . . 128 LEU CB . 18170 1 403 . 1 1 109 109 LEU N N 15 121 0.5 . 1 . . . . 128 LEU N . 18170 1 404 . 1 1 110 110 ALA C C 13 176 0.3 . 1 . . . . 129 ALA C . 18170 1 405 . 1 1 110 110 ALA CA C 13 52.97 0.4 . 1 . . . . 129 ALA CA . 18170 1 406 . 1 1 110 110 ALA CB C 13 17 0.4 . 1 . . . . 129 ALA CB . 18170 1 407 . 1 1 110 110 ALA N N 15 125.8 0.5 . 1 . . . . 129 ALA N . 18170 1 408 . 1 1 111 111 CYS C C 13 177 0.3 . 1 . . . . 130 CYS C . 18170 1 409 . 1 1 111 111 CYS CA C 13 62.07 0.4 . 1 . . . . 130 CYS CA . 18170 1 410 . 1 1 111 111 CYS CB C 13 29.88 0.4 . 1 . . . . 130 CYS CB . 18170 1 411 . 1 1 111 111 CYS N N 15 120.3 0.5 . 1 . . . . 130 CYS N . 18170 1 412 . 1 1 112 112 ILE C C 13 174 0.3 . 1 . . . . 131 ILE C . 18170 1 413 . 1 1 112 112 ILE CA C 13 63.08 0.4 . 1 . . . . 131 ILE CA . 18170 1 414 . 1 1 112 112 ILE CB C 13 36.22 0.4 . 1 . . . . 131 ILE CB . 18170 1 415 . 1 1 112 112 ILE N N 15 121.3 0.5 . 1 . . . . 131 ILE N . 18170 1 416 . 1 1 113 113 SER C C 13 175.1 0.3 . 1 . . . . 132 SER C . 18170 1 417 . 1 1 113 113 SER CA C 13 63.99 0.4 . 1 . . . . 132 SER CA . 18170 1 418 . 1 1 113 113 SER CB C 13 66.12 0.4 . 1 . . . . 132 SER CB . 18170 1 419 . 1 1 113 113 SER N N 15 117.7 0.5 . 1 . . . . 132 SER N . 18170 1 420 . 1 1 114 114 VAL C C 13 177.7 0.3 . 1 . . . . 133 VAL C . 18170 1 421 . 1 1 114 114 VAL CA C 13 68.05 0.4 . 1 . . . . 133 VAL CA . 18170 1 422 . 1 1 114 114 VAL N N 15 129.8 0.5 . 1 . . . . 133 VAL N . 18170 1 423 . 1 1 115 115 ASP C C 13 174.1 0.3 . 1 . . . . 134 ASP C . 18170 1 424 . 1 1 115 115 ASP CA C 13 57.5 0.4 . 1 . . . . 134 ASP CA . 18170 1 425 . 1 1 115 115 ASP CB C 13 40.4 0.4 . 1 . . . . 134 ASP CB . 18170 1 426 . 1 1 115 115 ASP N N 15 124 0.5 . 1 . . . . 134 ASP N . 18170 1 427 . 1 1 116 116 ARG C C 13 174.4 0.3 . 1 . . . . 135 ARG C . 18170 1 428 . 1 1 116 116 ARG CA C 13 58.42 0.4 . 1 . . . . 135 ARG CA . 18170 1 429 . 1 1 116 116 ARG CB C 13 30.7 0.4 . 1 . . . . 135 ARG CB . 18170 1 430 . 1 1 116 116 ARG N N 15 124.2 0.5 . 1 . . . . 135 ARG N . 18170 1 431 . 1 1 117 117 TYR C C 13 176.4 0.3 . 1 . . . . 136 TYR C . 18170 1 432 . 1 1 117 117 TYR CA C 13 60.25 0.4 . 1 . . . . 136 TYR CA . 18170 1 433 . 1 1 117 117 TYR CB C 13 37.35 0.4 . 1 . . . . 136 TYR CB . 18170 1 434 . 1 1 117 117 TYR N N 15 121 0.5 . 1 . . . . 136 TYR N . 18170 1 435 . 1 1 118 118 LEU C C 13 173.7 0.3 . 1 . . . . 137 LEU C . 18170 1 436 . 1 1 118 118 LEU CA C 13 54.87 0.4 . 1 . . . . 137 LEU CA . 18170 1 437 . 1 1 118 118 LEU CB C 13 41.67 0.4 . 1 . . . . 137 LEU CB . 18170 1 438 . 1 1 118 118 LEU N N 15 121.4 0.5 . 1 . . . . 137 LEU N . 18170 1 439 . 1 1 119 119 ALA C C 13 176.1 0.3 . 1 . . . . 138 ALA C . 18170 1 440 . 1 1 119 119 ALA CA C 13 52.86 0.4 . 1 . . . . 138 ALA CA . 18170 1 441 . 1 1 119 119 ALA CB C 13 17.27 0.4 . 1 . . . . 138 ALA CB . 18170 1 442 . 1 1 119 119 ALA N N 15 125.8 0.5 . 1 . . . . 138 ALA N . 18170 1 443 . 1 1 120 120 ILE C C 13 175.7 0.3 . 1 . . . . 139 ILE C . 18170 1 444 . 1 1 120 120 ILE CA C 13 60 0.4 . 1 . . . . 139 ILE CA . 18170 1 445 . 1 1 120 120 ILE N N 15 120 0.5 . 1 . . . . 139 ILE N . 18170 1 446 . 1 1 121 121 VAL C C 13 173.9 0.3 . 1 . . . . 140 VAL C . 18170 1 447 . 1 1 121 121 VAL CA C 13 61.92 0.4 . 1 . . . . 140 VAL CA . 18170 1 448 . 1 1 121 121 VAL CB C 13 30.9 0.4 . 1 . . . . 140 VAL CB . 18170 1 449 . 1 1 121 121 VAL N N 15 118.7 0.5 . 1 . . . . 140 VAL N . 18170 1 450 . 1 1 122 122 HIS C C 13 177.9 0.3 . 1 . . . . 141 HIS C . 18170 1 451 . 1 1 122 122 HIS CA C 13 58.86 0.4 . 1 . . . . 141 HIS CA . 18170 1 452 . 1 1 122 122 HIS CB C 13 30.09 0.4 . 1 . . . . 141 HIS CB . 18170 1 453 . 1 1 122 122 HIS N N 15 117.2 0.5 . 1 . . . . 141 HIS N . 18170 1 454 . 1 1 123 123 ALA C C 13 174.6 0.3 . 1 . . . . 142 ALA C . 18170 1 455 . 1 1 123 123 ALA CA C 13 53.17 0.4 . 1 . . . . 142 ALA CA . 18170 1 456 . 1 1 123 123 ALA CB C 13 16.58 0.4 . 1 . . . . 142 ALA CB . 18170 1 457 . 1 1 123 123 ALA N N 15 121.2 0.5 . 1 . . . . 142 ALA N . 18170 1 458 . 1 1 124 124 THR C C 13 177 0.3 . 1 . . . . 143 THR C . 18170 1 459 . 1 1 124 124 THR CA C 13 62.52 0.4 . 1 . . . . 143 THR CA . 18170 1 460 . 1 1 124 124 THR N N 15 118 0.5 . 1 . . . . 143 THR N . 18170 1 461 . 1 1 125 125 ARG CA C 13 57.25 0.4 . 1 . . . . 144 ARG CA . 18170 1 462 . 1 1 125 125 ARG CB C 13 30.34 0.4 . 1 . . . . 144 ARG CB . 18170 1 463 . 1 1 126 126 THR C C 13 177 0.3 . 1 . . . . 145 THR C . 18170 1 464 . 1 1 126 126 THR CA C 13 62.37 0.4 . 1 . . . . 145 THR CA . 18170 1 465 . 1 1 126 126 THR N N 15 119.7 0.5 . 1 . . . . 145 THR N . 18170 1 466 . 1 1 127 127 LEU C C 13 173.2 0.3 . 1 . . . . 146 LEU C . 18170 1 467 . 1 1 127 127 LEU CA C 13 55.79 0.4 . 1 . . . . 146 LEU CA . 18170 1 468 . 1 1 127 127 LEU CB C 13 40.57 0.4 . 1 . . . . 146 LEU CB . 18170 1 469 . 1 1 127 127 LEU N N 15 127.9 0.5 . 1 . . . . 146 LEU N . 18170 1 470 . 1 1 128 128 THR C C 13 177.7 0.3 . 1 . . . . 147 THR C . 18170 1 471 . 1 1 128 128 THR CA C 13 62.05 0.4 . 1 . . . . 147 THR CA . 18170 1 472 . 1 1 128 128 THR CB C 13 68.57 0.4 . 1 . . . . 147 THR CB . 18170 1 473 . 1 1 128 128 THR N N 15 124 0.5 . 1 . . . . 147 THR N . 18170 1 474 . 1 1 129 129 GLN C C 13 176.7 0.3 . 1 . . . . 148 GLN C . 18170 1 475 . 1 1 129 129 GLN CA C 13 53.47 0.4 . 1 . . . . 148 GLN CA . 18170 1 476 . 1 1 129 129 GLN CB C 13 29.31 0.4 . 1 . . . . 148 GLN CB . 18170 1 477 . 1 1 129 129 GLN N N 15 122.8 0.5 . 1 . . . . 148 GLN N . 18170 1 478 . 1 1 130 130 LYS C C 13 175.9 0.3 . 1 . . . . 149 LYS C . 18170 1 479 . 1 1 130 130 LYS CA C 13 59.44 0.4 . 1 . . . . 149 LYS CA . 18170 1 480 . 1 1 130 130 LYS N N 15 120.9 0.5 . 1 . . . . 149 LYS N . 18170 1 481 . 1 1 131 131 ARG C C 13 177.5 0.3 . 1 . . . . 150 ARG C . 18170 1 482 . 1 1 131 131 ARG CA C 13 56.7 0.4 . 1 . . . . 150 ARG CA . 18170 1 483 . 1 1 131 131 ARG CB C 13 31.15 0.4 . 1 . . . . 150 ARG CB . 18170 1 484 . 1 1 131 131 ARG N N 15 122.2 0.5 . 1 . . . . 150 ARG N . 18170 1 485 . 1 1 132 132 HIS C C 13 177.8 0.3 . 1 . . . . 151 HIS C . 18170 1 486 . 1 1 132 132 HIS CA C 13 59.13 0.4 . 1 . . . . 151 HIS CA . 18170 1 487 . 1 1 132 132 HIS CB C 13 29.4 0.4 . 1 . . . . 151 HIS CB . 18170 1 488 . 1 1 132 132 HIS N N 15 117.3 0.5 . 1 . . . . 151 HIS N . 18170 1 489 . 1 1 133 133 LEU C C 13 176.8 0.3 . 1 . . . . 152 LEU C . 18170 1 490 . 1 1 133 133 LEU CA C 13 56.15 0.4 . 1 . . . . 152 LEU CA . 18170 1 491 . 1 1 133 133 LEU CB C 13 39.81 0.4 . 1 . . . . 152 LEU CB . 18170 1 492 . 1 1 133 133 LEU N N 15 120.4 0.5 . 1 . . . . 152 LEU N . 18170 1 493 . 1 1 134 134 VAL C C 13 174.3 0.3 . 1 . . . . 153 VAL C . 18170 1 494 . 1 1 134 134 VAL CA C 13 61.24 0.4 . 1 . . . . 153 VAL CA . 18170 1 495 . 1 1 134 134 VAL N N 15 121.5 0.5 . 1 . . . . 153 VAL N . 18170 1 496 . 1 1 135 135 LYS C C 13 175.3 0.3 . 1 . . . . 154 LYS C . 18170 1 497 . 1 1 135 135 LYS CA C 13 59 0.4 . 1 . . . . 154 LYS CA . 18170 1 498 . 1 1 135 135 LYS N N 15 117 0.5 . 1 . . . . 154 LYS N . 18170 1 499 . 1 1 136 136 PHE C C 13 176.6 0.3 . 1 . . . . 155 PHE C . 18170 1 500 . 1 1 136 136 PHE CA C 13 61.2 0.4 . 1 . . . . 155 PHE CA . 18170 1 501 . 1 1 136 136 PHE N N 15 121.1 0.5 . 1 . . . . 155 PHE N . 18170 1 502 . 1 1 137 137 VAL C C 13 177.7 0.3 . 1 . . . . 156 VAL C . 18170 1 503 . 1 1 137 137 VAL CA C 13 62.17 0.4 . 1 . . . . 156 VAL CA . 18170 1 504 . 1 1 137 137 VAL CB C 13 33.4 0.4 . 1 . . . . 156 VAL CB . 18170 1 505 . 1 1 137 137 VAL N N 15 123.8 0.5 . 1 . . . . 156 VAL N . 18170 1 506 . 1 1 138 138 CYS CA C 13 58.26 0.4 . 1 . . . . 157 CYS CA . 18170 1 507 . 1 1 139 139 LEU C C 13 175.5 0.3 . 1 . . . . 158 LEU C . 18170 1 508 . 1 1 139 139 LEU CA C 13 55.75 0.4 . 1 . . . . 158 LEU CA . 18170 1 509 . 1 1 139 139 LEU N N 15 122.9 0.5 . 1 . . . . 158 LEU N . 18170 1 510 . 1 1 140 140 GLY C C 13 176.2 0.3 . 1 . . . . 159 GLY C . 18170 1 511 . 1 1 140 140 GLY CA C 13 44.75 0.4 . 1 . . . . 159 GLY CA . 18170 1 512 . 1 1 140 140 GLY N N 15 104.9 0.5 . 1 . . . . 159 GLY N . 18170 1 513 . 1 1 141 141 CYS C C 13 177 0.3 . 1 . . . . 160 CYS C . 18170 1 514 . 1 1 141 141 CYS CA C 13 59 0.4 . 1 . . . . 160 CYS CA . 18170 1 515 . 1 1 141 141 CYS N N 15 113.6 0.5 . 1 . . . . 160 CYS N . 18170 1 516 . 1 1 142 142 TRP C C 13 174.9 0.3 . 1 . . . . 161 TRP C . 18170 1 517 . 1 1 142 142 TRP CA C 13 55.88 0.4 . 1 . . . . 161 TRP CA . 18170 1 518 . 1 1 142 142 TRP N N 15 119 0.5 . 1 . . . . 161 TRP N . 18170 1 519 . 1 1 143 143 GLY C C 13 173.6 0.3 . 1 . . . . 162 GLY C . 18170 1 520 . 1 1 143 143 GLY CA C 13 45.1 0.4 . 1 . . . . 162 GLY CA . 18170 1 521 . 1 1 143 143 GLY N N 15 108.3 0.5 . 1 . . . . 162 GLY N . 18170 1 522 . 1 1 144 144 LEU C C 13 173.5 0.3 . 1 . . . . 163 LEU C . 18170 1 523 . 1 1 144 144 LEU CA C 13 55.8 0.4 . 1 . . . . 163 LEU CA . 18170 1 524 . 1 1 144 144 LEU CB C 13 39.85 0.4 . 1 . . . . 163 LEU CB . 18170 1 525 . 1 1 144 144 LEU N N 15 120.2 0.5 . 1 . . . . 163 LEU N . 18170 1 526 . 1 1 145 145 SER C C 13 175 0.3 . 1 . . . . 164 SER C . 18170 1 527 . 1 1 145 145 SER CA C 13 55.6 0.4 . 1 . . . . 164 SER CA . 18170 1 528 . 1 1 145 145 SER CB C 13 65.66 0.4 . 1 . . . . 164 SER CB . 18170 1 529 . 1 1 145 145 SER N N 15 117.2 0.5 . 1 . . . . 164 SER N . 18170 1 530 . 1 1 146 146 MET C C 13 175.5 0.3 . 1 . . . . 165 MET C . 18170 1 531 . 1 1 146 146 MET CA C 13 57.6 0.4 . 1 . . . . 165 MET CA . 18170 1 532 . 1 1 146 146 MET CB C 13 30 0.4 . 1 . . . . 165 MET CB . 18170 1 533 . 1 1 146 146 MET N N 15 121.2 0.5 . 1 . . . . 165 MET N . 18170 1 534 . 1 1 147 147 ASN C C 13 176.5 0.3 . 1 . . . . 166 ASN C . 18170 1 535 . 1 1 147 147 ASN CA C 13 56.08 0.4 . 1 . . . . 166 ASN CA . 18170 1 536 . 1 1 147 147 ASN CB C 13 38.94 0.4 . 1 . . . . 166 ASN CB . 18170 1 537 . 1 1 147 147 ASN N N 15 120.2 0.5 . 1 . . . . 166 ASN N . 18170 1 538 . 1 1 148 148 LEU C C 13 171.9 0.3 . 1 . . . . 167 LEU C . 18170 1 539 . 1 1 148 148 LEU CA C 13 54.62 0.4 . 1 . . . . 167 LEU CA . 18170 1 540 . 1 1 148 148 LEU CB C 13 30.03 0.4 . 1 . . . . 167 LEU CB . 18170 1 541 . 1 1 148 148 LEU N N 15 123.2 0.5 . 1 . . . . 167 LEU N . 18170 1 542 . 1 1 149 149 SER C C 13 175.6 0.3 . 1 . . . . 168 SER C . 18170 1 543 . 1 1 149 149 SER CA C 13 60.31 0.4 . 1 . . . . 168 SER CA . 18170 1 544 . 1 1 149 149 SER N N 15 123.3 0.5 . 1 . . . . 168 SER N . 18170 1 545 . 1 1 150 150 LEU C C 13 176.6 0.3 . 1 . . . . 169 LEU C . 18170 1 546 . 1 1 150 150 LEU CA C 13 54.2 0.4 . 1 . . . . 169 LEU CA . 18170 1 547 . 1 1 150 150 LEU N N 15 120.4 0.5 . 1 . . . . 169 LEU N . 18170 1 548 . 1 1 152 152 PHE C C 13 173.6 0.3 . 1 . . . . 171 PHE C . 18170 1 549 . 1 1 152 152 PHE CA C 13 61.7 0.4 . 1 . . . . 171 PHE CA . 18170 1 550 . 1 1 152 152 PHE N N 15 118.6 0.5 . 1 . . . . 171 PHE N . 18170 1 551 . 1 1 153 153 PHE C C 13 174.2 0.3 . 1 . . . . 172 PHE C . 18170 1 552 . 1 1 153 153 PHE CA C 13 59.5 0.4 . 1 . . . . 172 PHE CA . 18170 1 553 . 1 1 153 153 PHE CB C 13 42 0.4 . 1 . . . . 172 PHE CB . 18170 1 554 . 1 1 153 153 PHE N N 15 116.3 0.5 . 1 . . . . 172 PHE N . 18170 1 555 . 1 1 154 154 LEU C C 13 177.3 0.3 . 1 . . . . 173 LEU C . 18170 1 556 . 1 1 154 154 LEU CA C 13 54.73 0.4 . 1 . . . . 173 LEU CA . 18170 1 557 . 1 1 154 154 LEU CB C 13 37.23 0.4 . 1 . . . . 173 LEU CB . 18170 1 558 . 1 1 154 154 LEU N N 15 120.4 0.5 . 1 . . . . 173 LEU N . 18170 1 559 . 1 1 155 155 PHE C C 13 177 0.3 . 1 . . . . 174 PHE C . 18170 1 560 . 1 1 155 155 PHE CA C 13 59 0.4 . 1 . . . . 174 PHE CA . 18170 1 561 . 1 1 155 155 PHE CB C 13 43.22 0.4 . 1 . . . . 174 PHE CB . 18170 1 562 . 1 1 155 155 PHE N N 15 121.2 0.5 . 1 . . . . 174 PHE N . 18170 1 563 . 1 1 156 156 ARG C C 13 178.4 0.3 . 1 . . . . 175 ARG C . 18170 1 564 . 1 1 156 156 ARG CA C 13 56.2 0.4 . 1 . . . . 175 ARG CA . 18170 1 565 . 1 1 156 156 ARG N N 15 118.5 0.5 . 1 . . . . 175 ARG N . 18170 1 566 . 1 1 157 157 GLN C C 13 178 0.3 . 1 . . . . 176 GLN C . 18170 1 567 . 1 1 157 157 GLN CA C 13 56.2 0.4 . 1 . . . . 176 GLN CA . 18170 1 568 . 1 1 157 157 GLN N N 15 122.1 0.5 . 1 . . . . 176 GLN N . 18170 1 569 . 1 1 158 158 ALA C C 13 176.9 0.3 . 1 . . . . 177 ALA C . 18170 1 570 . 1 1 158 158 ALA CA C 13 54.3 0.4 . 1 . . . . 177 ALA CA . 18170 1 571 . 1 1 158 158 ALA CB C 13 16.87 0.4 . 1 . . . . 177 ALA CB . 18170 1 572 . 1 1 158 158 ALA N N 15 123.2 0.5 . 1 . . . . 177 ALA N . 18170 1 573 . 1 1 159 159 TYR C C 13 174.8 0.3 . 1 . . . . 178 TYR C . 18170 1 574 . 1 1 159 159 TYR CA C 13 56.6 0.4 . 1 . . . . 178 TYR CA . 18170 1 575 . 1 1 159 159 TYR CB C 13 39.9 0.4 . 1 . . . . 178 TYR CB . 18170 1 576 . 1 1 159 159 TYR N N 15 120.7 0.5 . 1 . . . . 178 TYR N . 18170 1 577 . 1 1 160 160 HIS C C 13 176.6 0.3 . 1 . . . . 179 HIS C . 18170 1 578 . 1 1 160 160 HIS CA C 13 58.22 0.4 . 1 . . . . 179 HIS CA . 18170 1 579 . 1 1 160 160 HIS CB C 13 31.56 0.4 . 1 . . . . 179 HIS CB . 18170 1 580 . 1 1 160 160 HIS N N 15 119.6 0.5 . 1 . . . . 179 HIS N . 18170 1 581 . 1 1 162 162 ASN C C 13 172.5 0.3 . 1 . . . . 181 ASN C . 18170 1 582 . 1 1 162 162 ASN CA C 13 56.15 0.4 . 1 . . . . 181 ASN CA . 18170 1 583 . 1 1 162 162 ASN CB C 13 36.5 0.4 . 1 . . . . 181 ASN CB . 18170 1 584 . 1 1 162 162 ASN N N 15 119.2 0.5 . 1 . . . . 181 ASN N . 18170 1 585 . 1 1 163 163 ASN C C 13 175.8 0.3 . 1 . . . . 182 ASN C . 18170 1 586 . 1 1 163 163 ASN CA C 13 55.5 0.4 . 1 . . . . 182 ASN CA . 18170 1 587 . 1 1 163 163 ASN N N 15 114.1 0.5 . 1 . . . . 182 ASN N . 18170 1 588 . 1 1 164 164 SER C C 13 175.6 0.3 . 1 . . . . 183 SER C . 18170 1 589 . 1 1 164 164 SER CA C 13 55.4 0.4 . 1 . . . . 183 SER CA . 18170 1 590 . 1 1 164 164 SER CB C 13 63.8 0.4 . 1 . . . . 183 SER CB . 18170 1 591 . 1 1 164 164 SER N N 15 117.2 0.5 . 1 . . . . 183 SER N . 18170 1 592 . 1 1 165 165 SER C C 13 175 0.3 . 1 . . . . 184 SER C . 18170 1 593 . 1 1 165 165 SER CA C 13 55.5 0.4 . 1 . . . . 184 SER CA . 18170 1 594 . 1 1 165 165 SER CB C 13 63.8 0.4 . 1 . . . . 184 SER CB . 18170 1 595 . 1 1 165 165 SER N N 15 117 0.5 . 1 . . . . 184 SER N . 18170 1 596 . 1 1 167 167 VAL C C 13 175.3 0.3 . 1 . . . . 186 VAL C . 18170 1 597 . 1 1 167 167 VAL CA C 13 65.29 0.4 . 1 . . . . 186 VAL CA . 18170 1 598 . 1 1 167 167 VAL CB C 13 30.12 0.4 . 1 . . . . 186 VAL CB . 18170 1 599 . 1 1 167 167 VAL N N 15 119.5 0.5 . 1 . . . . 186 VAL N . 18170 1 600 . 1 1 168 168 CYS C C 13 176.3 0.3 . 1 . . . . 187 CYS C . 18170 1 601 . 1 1 168 168 CYS CA C 13 56 0.4 . 1 . . . . 187 CYS CA . 18170 1 602 . 1 1 168 168 CYS CB C 13 40 0.4 . 1 . . . . 187 CYS CB . 18170 1 603 . 1 1 168 168 CYS N N 15 116.5 0.5 . 1 . . . . 187 CYS N . 18170 1 604 . 1 1 169 169 TYR C C 13 176.5 0.3 . 1 . . . . 188 TYR C . 18170 1 605 . 1 1 169 169 TYR CA C 13 55.86 0.4 . 1 . . . . 188 TYR CA . 18170 1 606 . 1 1 169 169 TYR CB C 13 40.24 0.4 . 1 . . . . 188 TYR CB . 18170 1 607 . 1 1 169 169 TYR N N 15 121.3 0.5 . 1 . . . . 188 TYR N . 18170 1 608 . 1 1 170 170 GLU C C 13 175.5 0.3 . 1 . . . . 189 GLU C . 18170 1 609 . 1 1 170 170 GLU CA C 13 57.9 0.4 . 1 . . . . 189 GLU CA . 18170 1 610 . 1 1 170 170 GLU CB C 13 31.84 0.4 . 1 . . . . 189 GLU CB . 18170 1 611 . 1 1 170 170 GLU N N 15 122 0.5 . 1 . . . . 189 GLU N . 18170 1 612 . 1 1 171 171 VAL C C 13 172.8 0.3 . 1 . . . . 190 VAL C . 18170 1 613 . 1 1 171 171 VAL CA C 13 65.67 0.4 . 1 . . . . 190 VAL CA . 18170 1 614 . 1 1 171 171 VAL CB C 13 29.2 0.4 . 1 . . . . 190 VAL CB . 18170 1 615 . 1 1 171 171 VAL N N 15 123.5 0.5 . 1 . . . . 190 VAL N . 18170 1 616 . 1 1 172 172 LEU CA C 13 55.5 0.4 . 1 . . . . 191 LEU CA . 18170 1 617 . 1 1 172 172 LEU N N 15 129.9 0.5 . 1 . . . . 191 LEU N . 18170 1 618 . 1 1 173 173 GLY C C 13 173.5 0.3 . 1 . . . . 192 GLY C . 18170 1 619 . 1 1 173 173 GLY CA C 13 44.87 0.4 . 1 . . . . 192 GLY CA . 18170 1 620 . 1 1 173 173 GLY N N 15 107.5 0.5 . 1 . . . . 192 GLY N . 18170 1 621 . 1 1 174 174 ASN CA C 13 52.8 0.4 . 1 . . . . 193 ASN CA . 18170 1 622 . 1 1 174 174 ASN CB C 13 39.56 0.4 . 1 . . . . 193 ASN CB . 18170 1 623 . 1 1 174 174 ASN N N 15 116.6 0.5 . 1 . . . . 193 ASN N . 18170 1 624 . 1 1 175 175 ASP C C 13 172.8 0.3 . 1 . . . . 194 ASP C . 18170 1 625 . 1 1 175 175 ASP CA C 13 53.9 0.4 . 1 . . . . 194 ASP CA . 18170 1 626 . 1 1 175 175 ASP CB C 13 39.7 0.4 . 1 . . . . 194 ASP CB . 18170 1 627 . 1 1 175 175 ASP N N 15 123.1 0.5 . 1 . . . . 194 ASP N . 18170 1 628 . 1 1 176 176 THR C C 13 175.5 0.3 . 1 . . . . 195 THR C . 18170 1 629 . 1 1 176 176 THR CA C 13 63 0.4 . 1 . . . . 195 THR CA . 18170 1 630 . 1 1 176 176 THR N N 15 118.8 0.5 . 1 . . . . 195 THR N . 18170 1 631 . 1 1 177 177 ALA C C 13 173 0.3 . 1 . . . . 196 ALA C . 18170 1 632 . 1 1 177 177 ALA CA C 13 53.8 0.4 . 1 . . . . 196 ALA CA . 18170 1 633 . 1 1 177 177 ALA CB C 13 17.24 0.4 . 1 . . . . 196 ALA CB . 18170 1 634 . 1 1 177 177 ALA N N 15 123.3 0.5 . 1 . . . . 196 ALA N . 18170 1 635 . 1 1 178 178 LYS C C 13 175 0.3 . 1 . . . . 197 LYS C . 18170 1 636 . 1 1 178 178 LYS CA C 13 56.9 0.4 . 1 . . . . 197 LYS CA . 18170 1 637 . 1 1 178 178 LYS CB C 13 29.9 0.4 . 1 . . . . 197 LYS CB . 18170 1 638 . 1 1 178 178 LYS N N 15 121.7 0.5 . 1 . . . . 197 LYS N . 18170 1 639 . 1 1 179 179 TRP C C 13 177.6 0.3 . 1 . . . . 198 TRP C . 18170 1 640 . 1 1 179 179 TRP CA C 13 59.3 0.4 . 1 . . . . 198 TRP CA . 18170 1 641 . 1 1 179 179 TRP CB C 13 29.7 0.4 . 1 . . . . 198 TRP CB . 18170 1 642 . 1 1 179 179 TRP N N 15 120.7 0.5 . 1 . . . . 198 TRP N . 18170 1 643 . 1 1 180 180 ARG C C 13 178.1 0.3 . 1 . . . . 199 ARG C . 18170 1 644 . 1 1 180 180 ARG CA C 13 55.95 0.4 . 1 . . . . 199 ARG CA . 18170 1 645 . 1 1 180 180 ARG CB C 13 31.06 0.4 . 1 . . . . 199 ARG CB . 18170 1 646 . 1 1 180 180 ARG N N 15 123.5 0.5 . 1 . . . . 199 ARG N . 18170 1 647 . 1 1 181 181 MET C C 13 175.4 0.3 . 1 . . . . 200 MET C . 18170 1 648 . 1 1 181 181 MET CA C 13 58.1 0.4 . 1 . . . . 200 MET CA . 18170 1 649 . 1 1 181 181 MET CB C 13 31.1 0.4 . 1 . . . . 200 MET CB . 18170 1 650 . 1 1 181 181 MET N N 15 119.9 0.5 . 1 . . . . 200 MET N . 18170 1 651 . 1 1 182 182 VAL C C 13 174.9 0.3 . 1 . . . . 201 VAL C . 18170 1 652 . 1 1 182 182 VAL CA C 13 65.7 0.4 . 1 . . . . 201 VAL CA . 18170 1 653 . 1 1 182 182 VAL CB C 13 29.18 0.4 . 1 . . . . 201 VAL CB . 18170 1 654 . 1 1 182 182 VAL N N 15 123.7 0.5 . 1 . . . . 201 VAL N . 18170 1 655 . 1 1 183 183 LEU C C 13 172.7 0.3 . 1 . . . . 202 LEU C . 18170 1 656 . 1 1 183 183 LEU CA C 13 54.8 0.4 . 1 . . . . 202 LEU CA . 18170 1 657 . 1 1 183 183 LEU N N 15 124 0.5 . 1 . . . . 202 LEU N . 18170 1 658 . 1 1 184 184 ARG C C 13 176.2 0.3 . 1 . . . . 203 ARG C . 18170 1 659 . 1 1 184 184 ARG CA C 13 55.8 0.4 . 1 . . . . 203 ARG CA . 18170 1 660 . 1 1 184 184 ARG CB C 13 31.26 0.4 . 1 . . . . 203 ARG CB . 18170 1 661 . 1 1 184 184 ARG N N 15 124 0.5 . 1 . . . . 203 ARG N . 18170 1 662 . 1 1 185 185 ILE C C 13 176 0.3 . 1 . . . . 204 ILE C . 18170 1 663 . 1 1 185 185 ILE CA C 13 64.7 0.4 . 1 . . . . 204 ILE CA . 18170 1 664 . 1 1 185 185 ILE CB C 13 36.4 0.4 . 1 . . . . 204 ILE CB . 18170 1 665 . 1 1 185 185 ILE N N 15 120.5 0.5 . 1 . . . . 204 ILE N . 18170 1 666 . 1 1 186 186 LEU C C 13 176 0.3 . 1 . . . . 205 LEU C . 18170 1 667 . 1 1 186 186 LEU CA C 13 55 0.4 . 1 . . . . 205 LEU CA . 18170 1 668 . 1 1 186 186 LEU N N 15 123.4 0.5 . 1 . . . . 205 LEU N . 18170 1 669 . 1 1 187 187 PRO CA C 13 62.5 0.4 . 1 . . . . 206 PRO CA . 18170 1 670 . 1 1 187 187 PRO N N 15 138.7 0.5 . 1 . . . . 206 PRO N . 18170 1 671 . 1 1 188 188 HIS C C 13 175.2 0.3 . 1 . . . . 207 HIS C . 18170 1 672 . 1 1 188 188 HIS CA C 13 53.11 0.4 . 1 . . . . 207 HIS CA . 18170 1 673 . 1 1 188 188 HIS CB C 13 30 0.4 . 1 . . . . 207 HIS CB . 18170 1 674 . 1 1 188 188 HIS N N 15 113.5 0.5 . 1 . . . . 207 HIS N . 18170 1 675 . 1 1 189 189 THR C C 13 178 0.3 . 1 . . . . 208 THR C . 18170 1 676 . 1 1 189 189 THR CA C 13 62.85 0.4 . 1 . . . . 208 THR CA . 18170 1 677 . 1 1 189 189 THR N N 15 122.1 0.5 . 1 . . . . 208 THR N . 18170 1 678 . 1 1 190 190 PHE C C 13 175.4 0.3 . 1 . . . . 209 PHE C . 18170 1 679 . 1 1 190 190 PHE CA C 13 59.85 0.4 . 1 . . . . 209 PHE CA . 18170 1 680 . 1 1 190 190 PHE N N 15 117.5 0.5 . 1 . . . . 209 PHE N . 18170 1 681 . 1 1 191 191 GLY C C 13 174.1 0.3 . 1 . . . . 210 GLY C . 18170 1 682 . 1 1 191 191 GLY CA C 13 45 0.4 . 1 . . . . 210 GLY CA . 18170 1 683 . 1 1 191 191 GLY N N 15 111.7 0.5 . 1 . . . . 210 GLY N . 18170 1 684 . 1 1 192 192 PHE C C 13 175 0.3 . 1 . . . . 211 PHE C . 18170 1 685 . 1 1 192 192 PHE CA C 13 55.95 0.4 . 1 . . . . 211 PHE CA . 18170 1 686 . 1 1 192 192 PHE N N 15 120.9 0.5 . 1 . . . . 211 PHE N . 18170 1 687 . 1 1 193 193 ILE C C 13 175.9 0.3 . 1 . . . . 212 ILE C . 18170 1 688 . 1 1 193 193 ILE CA C 13 64.44 0.4 . 1 . . . . 212 ILE CA . 18170 1 689 . 1 1 193 193 ILE CB C 13 36.6 0.4 . 1 . . . . 212 ILE CB . 18170 1 690 . 1 1 193 193 ILE N N 15 120.1 0.5 . 1 . . . . 212 ILE N . 18170 1 691 . 1 1 194 194 VAL C C 13 175.3 0.3 . 1 . . . . 213 VAL C . 18170 1 692 . 1 1 194 194 VAL CA C 13 65.75 0.4 . 1 . . . . 213 VAL CA . 18170 1 693 . 1 1 194 194 VAL CB C 13 29.68 0.4 . 1 . . . . 213 VAL CB . 18170 1 694 . 1 1 194 194 VAL N N 15 123.4 0.5 . 1 . . . . 213 VAL N . 18170 1 695 . 1 1 196 196 LEU C C 13 177.2 0.3 . 1 . . . . 215 LEU C . 18170 1 696 . 1 1 196 196 LEU CA C 13 55.7 0.4 . 1 . . . . 215 LEU CA . 18170 1 697 . 1 1 196 196 LEU CB C 13 40.15 0.4 . 1 . . . . 215 LEU CB . 18170 1 698 . 1 1 196 196 LEU N N 15 125.3 0.5 . 1 . . . . 215 LEU N . 18170 1 699 . 1 1 197 197 PHE C C 13 179.2 0.3 . 1 . . . . 216 PHE C . 18170 1 700 . 1 1 197 197 PHE CA C 13 60.65 0.4 . 1 . . . . 216 PHE CA . 18170 1 701 . 1 1 197 197 PHE CB C 13 37 0.4 . 1 . . . . 216 PHE CB . 18170 1 702 . 1 1 197 197 PHE N N 15 123.8 0.5 . 1 . . . . 216 PHE N . 18170 1 703 . 1 1 198 198 VAL C C 13 175.4 0.3 . 1 . . . . 217 VAL C . 18170 1 704 . 1 1 198 198 VAL CA C 13 65.66 0.4 . 1 . . . . 217 VAL CA . 18170 1 705 . 1 1 198 198 VAL CB C 13 29.92 0.4 . 1 . . . . 217 VAL CB . 18170 1 706 . 1 1 198 198 VAL N N 15 118.5 0.5 . 1 . . . . 217 VAL N . 18170 1 707 . 1 1 199 199 MET C C 13 174.4 0.3 . 1 . . . . 218 MET C . 18170 1 708 . 1 1 199 199 MET CA C 13 55 0.4 . 1 . . . . 218 MET CA . 18170 1 709 . 1 1 199 199 MET CB C 13 31.65 0.4 . 1 . . . . 218 MET CB . 18170 1 710 . 1 1 199 199 MET N N 15 118.3 0.5 . 1 . . . . 218 MET N . 18170 1 711 . 1 1 200 200 LEU C C 13 177.6 0.3 . 1 . . . . 219 LEU C . 18170 1 712 . 1 1 200 200 LEU CA C 13 55.8 0.4 . 1 . . . . 219 LEU CA . 18170 1 713 . 1 1 200 200 LEU CB C 13 40.81 0.4 . 1 . . . . 219 LEU CB . 18170 1 714 . 1 1 200 200 LEU N N 15 120.5 0.5 . 1 . . . . 219 LEU N . 18170 1 715 . 1 1 201 201 PHE C C 13 176 0.3 . 1 . . . . 220 PHE C . 18170 1 716 . 1 1 201 201 PHE CA C 13 61.17 0.4 . 1 . . . . 220 PHE CA . 18170 1 717 . 1 1 201 201 PHE N N 15 124.7 0.5 . 1 . . . . 220 PHE N . 18170 1 718 . 1 1 202 202 CYS C C 13 176 0.3 . 1 . . . . 221 CYS C . 18170 1 719 . 1 1 202 202 CYS CA C 13 61.87 0.4 . 1 . . . . 221 CYS CA . 18170 1 720 . 1 1 202 202 CYS N N 15 117.8 0.5 . 1 . . . . 221 CYS N . 18170 1 721 . 1 1 203 203 TYR C C 13 178.4 0.3 . 1 . . . . 222 TYR C . 18170 1 722 . 1 1 203 203 TYR CA C 13 57.5 0.4 . 1 . . . . 222 TYR CA . 18170 1 723 . 1 1 203 203 TYR CB C 13 37.15 0.4 . 1 . . . . 222 TYR CB . 18170 1 724 . 1 1 203 203 TYR N N 15 122 0.5 . 1 . . . . 222 TYR N . 18170 1 725 . 1 1 204 204 GLY C C 13 174.5 0.3 . 1 . . . . 223 GLY C . 18170 1 726 . 1 1 204 204 GLY CA C 13 41.7 0.4 . 1 . . . . 223 GLY CA . 18170 1 727 . 1 1 204 204 GLY N N 15 110.3 0.5 . 1 . . . . 223 GLY N . 18170 1 728 . 1 1 205 205 PHE C C 13 176.5 0.3 . 1 . . . . 224 PHE C . 18170 1 729 . 1 1 205 205 PHE CA C 13 62.3 0.4 . 1 . . . . 224 PHE CA . 18170 1 730 . 1 1 205 205 PHE CB C 13 36.9 0.4 . 1 . . . . 224 PHE CB . 18170 1 731 . 1 1 205 205 PHE N N 15 120.1 0.5 . 1 . . . . 224 PHE N . 18170 1 732 . 1 1 206 206 THR C C 13 175 0.3 . 1 . . . . 225 THR C . 18170 1 733 . 1 1 206 206 THR CA C 13 64.65 0.4 . 1 . . . . 225 THR CA . 18170 1 734 . 1 1 206 206 THR N N 15 118.5 0.5 . 1 . . . . 225 THR N . 18170 1 735 . 1 1 207 207 LEU C C 13 177.2 0.3 . 1 . . . . 226 LEU C . 18170 1 736 . 1 1 207 207 LEU CA C 13 55.9 0.4 . 1 . . . . 226 LEU CA . 18170 1 737 . 1 1 207 207 LEU CB C 13 39.4 0.4 . 1 . . . . 226 LEU CB . 18170 1 738 . 1 1 207 207 LEU N N 15 122.9 0.5 . 1 . . . . 226 LEU N . 18170 1 739 . 1 1 208 208 ARG C C 13 177.2 0.3 . 1 . . . . 227 ARG C . 18170 1 740 . 1 1 208 208 ARG CA C 13 54.6 0.4 . 1 . . . . 227 ARG CA . 18170 1 741 . 1 1 208 208 ARG CB C 13 28.5 0.4 . 1 . . . . 227 ARG CB . 18170 1 742 . 1 1 208 208 ARG N N 15 121 0.5 . 1 . . . . 227 ARG N . 18170 1 743 . 1 1 209 209 THR C C 13 176.9 0.3 . 1 . . . . 228 THR C . 18170 1 744 . 1 1 209 209 THR CA C 13 64.75 0.4 . 1 . . . . 228 THR CA . 18170 1 745 . 1 1 209 209 THR CB C 13 66.56 0.4 . 1 . . . . 228 THR CB . 18170 1 746 . 1 1 209 209 THR N N 15 119.6 0.5 . 1 . . . . 228 THR N . 18170 1 747 . 1 1 210 210 LEU C C 13 177.8 0.3 . 1 . . . . 229 LEU C . 18170 1 748 . 1 1 210 210 LEU CA C 13 55.7 0.4 . 1 . . . . 229 LEU CA . 18170 1 749 . 1 1 210 210 LEU CB C 13 40.26 0.4 . 1 . . . . 229 LEU CB . 18170 1 750 . 1 1 210 210 LEU N N 15 125.6 0.5 . 1 . . . . 229 LEU N . 18170 1 751 . 1 1 211 211 PHE C C 13 176.9 0.3 . 1 . . . . 230 PHE C . 18170 1 752 . 1 1 211 211 PHE CA C 13 58.77 0.4 . 1 . . . . 230 PHE CA . 18170 1 753 . 1 1 211 211 PHE CB C 13 41.94 0.4 . 1 . . . . 230 PHE CB . 18170 1 754 . 1 1 211 211 PHE N N 15 121.9 0.5 . 1 . . . . 230 PHE N . 18170 1 755 . 1 1 212 212 LYS C C 13 174.9 0.3 . 1 . . . . 231 LYS C . 18170 1 756 . 1 1 212 212 LYS CA C 13 56 0.4 . 1 . . . . 231 LYS CA . 18170 1 757 . 1 1 212 212 LYS CB C 13 30.9 0.4 . 1 . . . . 231 LYS CB . 18170 1 758 . 1 1 212 212 LYS N N 15 121.6 0.5 . 1 . . . . 231 LYS N . 18170 1 759 . 1 1 213 213 ALA C C 13 176.9 0.3 . 1 . . . . 232 ALA C . 18170 1 760 . 1 1 213 213 ALA CA C 13 54 0.4 . 1 . . . . 232 ALA CA . 18170 1 761 . 1 1 213 213 ALA CB C 13 21.83 0.4 . 1 . . . . 232 ALA CB . 18170 1 762 . 1 1 213 213 ALA N N 15 123.5 0.5 . 1 . . . . 232 ALA N . 18170 1 763 . 1 1 214 214 HIS C C 13 176.1 0.3 . 1 . . . . 233 HIS C . 18170 1 764 . 1 1 214 214 HIS CA C 13 55.7 0.4 . 1 . . . . 233 HIS CA . 18170 1 765 . 1 1 214 214 HIS CB C 13 29.06 0.4 . 1 . . . . 233 HIS CB . 18170 1 766 . 1 1 214 214 HIS N N 15 123.5 0.5 . 1 . . . . 233 HIS N . 18170 1 767 . 1 1 215 215 MET C C 13 176.7 0.3 . 1 . . . . 234 MET C . 18170 1 768 . 1 1 215 215 MET CA C 13 58 0.4 . 1 . . . . 234 MET CA . 18170 1 769 . 1 1 215 215 MET CB C 13 31.81 0.4 . 1 . . . . 234 MET CB . 18170 1 770 . 1 1 215 215 MET N N 15 120 0.5 . 1 . . . . 234 MET N . 18170 1 771 . 1 1 216 216 GLY C C 13 173.3 0.3 . 1 . . . . 235 GLY C . 18170 1 772 . 1 1 216 216 GLY CA C 13 42.8 0.4 . 1 . . . . 235 GLY CA . 18170 1 773 . 1 1 216 216 GLY N N 15 109.6 0.5 . 1 . . . . 235 GLY N . 18170 1 774 . 1 1 217 217 GLN C C 13 173.1 0.3 . 1 . . . . 236 GLN C . 18170 1 775 . 1 1 217 217 GLN CA C 13 55 0.4 . 1 . . . . 236 GLN CA . 18170 1 776 . 1 1 217 217 GLN CB C 13 25.4 0.4 . 1 . . . . 236 GLN CB . 18170 1 777 . 1 1 217 217 GLN N N 15 116.8 0.5 . 1 . . . . 236 GLN N . 18170 1 778 . 1 1 218 218 LYS C C 13 178.1 0.3 . 1 . . . . 237 LYS C . 18170 1 779 . 1 1 218 218 LYS CA C 13 56 0.4 . 1 . . . . 237 LYS CA . 18170 1 780 . 1 1 218 218 LYS CB C 13 31.11 0.4 . 1 . . . . 237 LYS CB . 18170 1 781 . 1 1 218 218 LYS N N 15 123.2 0.5 . 1 . . . . 237 LYS N . 18170 1 782 . 1 1 219 219 HIS C C 13 177 0.3 . 1 . . . . 238 HIS C . 18170 1 783 . 1 1 219 219 HIS CA C 13 54.72 0.4 . 1 . . . . 238 HIS CA . 18170 1 784 . 1 1 219 219 HIS CB C 13 30 0.4 . 1 . . . . 238 HIS CB . 18170 1 785 . 1 1 219 219 HIS N N 15 123.6 0.5 . 1 . . . . 238 HIS N . 18170 1 786 . 1 1 220 220 ARG C C 13 176.6 0.3 . 1 . . . . 239 ARG C . 18170 1 787 . 1 1 220 220 ARG CA C 13 55.65 0.4 . 1 . . . . 239 ARG CA . 18170 1 788 . 1 1 220 220 ARG CB C 13 31.1 0.4 . 1 . . . . 239 ARG CB . 18170 1 789 . 1 1 220 220 ARG N N 15 122.1 0.5 . 1 . . . . 239 ARG N . 18170 1 790 . 1 1 221 221 ALA C C 13 175.9 0.3 . 1 . . . . 240 ALA C . 18170 1 791 . 1 1 221 221 ALA CA C 13 52.8 0.4 . 1 . . . . 240 ALA CA . 18170 1 792 . 1 1 221 221 ALA CB C 13 16.7 0.4 . 1 . . . . 240 ALA CB . 18170 1 793 . 1 1 221 221 ALA N N 15 121.8 0.5 . 1 . . . . 240 ALA N . 18170 1 794 . 1 1 222 222 MET C C 13 175.6 0.3 . 1 . . . . 241 MET C . 18170 1 795 . 1 1 222 222 MET CA C 13 58.1 0.4 . 1 . . . . 241 MET CA . 18170 1 796 . 1 1 222 222 MET CB C 13 31.81 0.4 . 1 . . . . 241 MET CB . 18170 1 797 . 1 1 222 222 MET N N 15 120.2 0.5 . 1 . . . . 241 MET N . 18170 1 798 . 1 1 223 223 ARG C C 13 177.4 0.3 . 1 . . . . 242 ARG C . 18170 1 799 . 1 1 223 223 ARG CA C 13 56 0.4 . 1 . . . . 242 ARG CA . 18170 1 800 . 1 1 223 223 ARG CB C 13 30.91 0.4 . 1 . . . . 242 ARG CB . 18170 1 801 . 1 1 223 223 ARG N N 15 121.2 0.5 . 1 . . . . 242 ARG N . 18170 1 802 . 1 1 224 224 VAL C C 13 175.6 0.3 . 1 . . . . 243 VAL C . 18170 1 803 . 1 1 224 224 VAL CA C 13 65.47 0.4 . 1 . . . . 243 VAL CA . 18170 1 804 . 1 1 224 224 VAL CB C 13 29.4 0.4 . 1 . . . . 243 VAL CB . 18170 1 805 . 1 1 224 224 VAL N N 15 119.7 0.5 . 1 . . . . 243 VAL N . 18170 1 806 . 1 1 225 225 ILE C C 13 175.5 0.3 . 1 . . . . 244 ILE C . 18170 1 807 . 1 1 225 225 ILE CA C 13 64.6 0.4 . 1 . . . . 244 ILE CA . 18170 1 808 . 1 1 225 225 ILE CB C 13 36.8 0.4 . 1 . . . . 244 ILE CB . 18170 1 809 . 1 1 225 225 ILE N N 15 120.9 0.5 . 1 . . . . 244 ILE N . 18170 1 810 . 1 1 226 226 PHE C C 13 175.1 0.3 . 1 . . . . 245 PHE C . 18170 1 811 . 1 1 226 226 PHE CA C 13 60.2 0.4 . 1 . . . . 245 PHE CA . 18170 1 812 . 1 1 226 226 PHE CB C 13 39.77 0.4 . 1 . . . . 245 PHE CB . 18170 1 813 . 1 1 226 226 PHE N N 15 117.2 0.5 . 1 . . . . 245 PHE N . 18170 1 814 . 1 1 227 227 ALA C C 13 177.7 0.3 . 1 . . . . 246 ALA C . 18170 1 815 . 1 1 227 227 ALA CA C 13 53.2 0.4 . 1 . . . . 246 ALA CA . 18170 1 816 . 1 1 227 227 ALA CB C 13 16.88 0.4 . 1 . . . . 246 ALA CB . 18170 1 817 . 1 1 227 227 ALA N N 15 122.3 0.5 . 1 . . . . 246 ALA N . 18170 1 818 . 1 1 228 228 VAL C C 13 175 0.3 . 1 . . . . 247 VAL C . 18170 1 819 . 1 1 228 228 VAL CA C 13 66.45 0.4 . 1 . . . . 247 VAL CA . 18170 1 820 . 1 1 228 228 VAL CB C 13 29.55 0.4 . 1 . . . . 247 VAL CB . 18170 1 821 . 1 1 228 228 VAL N N 15 121 0.5 . 1 . . . . 247 VAL N . 18170 1 822 . 1 1 229 229 VAL C C 13 177.2 0.3 . 1 . . . . 248 VAL C . 18170 1 823 . 1 1 229 229 VAL CA C 13 64.86 0.4 . 1 . . . . 248 VAL CA . 18170 1 824 . 1 1 229 229 VAL CB C 13 30.14 0.4 . 1 . . . . 248 VAL CB . 18170 1 825 . 1 1 229 229 VAL N N 15 122.3 0.5 . 1 . . . . 248 VAL N . 18170 1 826 . 1 1 230 230 LEU C C 13 176.4 0.3 . 1 . . . . 249 LEU C . 18170 1 827 . 1 1 230 230 LEU CA C 13 56.18 0.4 . 1 . . . . 249 LEU CA . 18170 1 828 . 1 1 230 230 LEU CB C 13 40.65 0.4 . 1 . . . . 249 LEU CB . 18170 1 829 . 1 1 230 230 LEU N N 15 119.3 0.5 . 1 . . . . 249 LEU N . 18170 1 830 . 1 1 231 231 ILE C C 13 176.9 0.3 . 1 . . . . 250 ILE C . 18170 1 831 . 1 1 231 231 ILE CA C 13 64.2 0.4 . 1 . . . . 250 ILE CA . 18170 1 832 . 1 1 231 231 ILE CB C 13 36.7 0.4 . 1 . . . . 250 ILE CB . 18170 1 833 . 1 1 231 231 ILE N N 15 121.2 0.5 . 1 . . . . 250 ILE N . 18170 1 834 . 1 1 232 232 PHE C C 13 177.1 0.3 . 1 . . . . 251 PHE C . 18170 1 835 . 1 1 232 232 PHE CA C 13 59.8 0.4 . 1 . . . . 251 PHE CA . 18170 1 836 . 1 1 232 232 PHE N N 15 125.1 0.5 . 1 . . . . 251 PHE N . 18170 1 837 . 1 1 233 233 LEU C C 13 176.7 0.3 . 1 . . . . 252 LEU C . 18170 1 838 . 1 1 233 233 LEU CA C 13 56 0.4 . 1 . . . . 252 LEU CA . 18170 1 839 . 1 1 233 233 LEU CB C 13 40.7 0.4 . 1 . . . . 252 LEU CB . 18170 1 840 . 1 1 233 233 LEU N N 15 118.8 0.5 . 1 . . . . 252 LEU N . 18170 1 841 . 1 1 234 234 LEU C C 13 176.7 0.3 . 1 . . . . 253 LEU C . 18170 1 842 . 1 1 234 234 LEU CA C 13 56.22 0.4 . 1 . . . . 253 LEU CA . 18170 1 843 . 1 1 234 234 LEU CB C 13 40 0.4 . 1 . . . . 253 LEU CB . 18170 1 844 . 1 1 234 234 LEU N N 15 121.8 0.5 . 1 . . . . 253 LEU N . 18170 1 845 . 1 1 235 235 CYS C C 13 176.8 0.3 . 1 . . . . 254 CYS C . 18170 1 846 . 1 1 235 235 CYS CA C 13 58.3 0.4 . 1 . . . . 254 CYS CA . 18170 1 847 . 1 1 235 235 CYS CB C 13 28.04 0.4 . 1 . . . . 254 CYS CB . 18170 1 848 . 1 1 235 235 CYS N N 15 119.8 0.5 . 1 . . . . 254 CYS N . 18170 1 849 . 1 1 236 236 TRP C C 13 178.4 0.3 . 1 . . . . 255 TRP C . 18170 1 850 . 1 1 236 236 TRP CA C 13 56.94 0.4 . 1 . . . . 255 TRP CA . 18170 1 851 . 1 1 236 236 TRP CB C 13 29.85 0.4 . 1 . . . . 255 TRP CB . 18170 1 852 . 1 1 236 236 TRP N N 15 121.3 0.5 . 1 . . . . 255 TRP N . 18170 1 853 . 1 1 237 237 LEU C C 13 177.7 0.3 . 1 . . . . 256 LEU C . 18170 1 854 . 1 1 237 237 LEU CA C 13 55.84 0.4 . 1 . . . . 256 LEU CA . 18170 1 855 . 1 1 237 237 LEU CB C 13 40 0.4 . 1 . . . . 256 LEU CB . 18170 1 856 . 1 1 237 237 LEU N N 15 124.9 0.5 . 1 . . . . 256 LEU N . 18170 1 857 . 1 1 239 239 TYR C C 13 179 0.3 . 1 . . . . 258 TYR C . 18170 1 858 . 1 1 239 239 TYR CA C 13 58.33 0.4 . 1 . . . . 258 TYR CA . 18170 1 859 . 1 1 239 239 TYR CB C 13 42.07 0.4 . 1 . . . . 258 TYR CB . 18170 1 860 . 1 1 239 239 TYR N N 15 124.9 0.5 . 1 . . . . 258 TYR N . 18170 1 861 . 1 1 240 240 ASN C C 13 173 0.3 . 1 . . . . 259 ASN C . 18170 1 862 . 1 1 240 240 ASN CA C 13 53.9 0.4 . 1 . . . . 259 ASN CA . 18170 1 863 . 1 1 240 240 ASN CB C 13 37.62 0.4 . 1 . . . . 259 ASN CB . 18170 1 864 . 1 1 240 240 ASN N N 15 123 0.5 . 1 . . . . 259 ASN N . 18170 1 865 . 1 1 241 241 LEU C C 13 175.3 0.3 . 1 . . . . 260 LEU C . 18170 1 866 . 1 1 241 241 LEU CA C 13 56.19 0.4 . 1 . . . . 260 LEU CA . 18170 1 867 . 1 1 241 241 LEU CB C 13 39.06 0.4 . 1 . . . . 260 LEU CB . 18170 1 868 . 1 1 241 241 LEU N N 15 121.8 0.5 . 1 . . . . 260 LEU N . 18170 1 869 . 1 1 242 242 VAL C C 13 175 0.3 . 1 . . . . 261 VAL C . 18170 1 870 . 1 1 242 242 VAL CA C 13 65.2 0.4 . 1 . . . . 261 VAL CA . 18170 1 871 . 1 1 242 242 VAL CB C 13 29.62 0.4 . 1 . . . . 261 VAL CB . 18170 1 872 . 1 1 242 242 VAL N N 15 118.6 0.5 . 1 . . . . 261 VAL N . 18170 1 873 . 1 1 243 243 LEU C C 13 176.6 0.3 . 1 . . . . 262 LEU C . 18170 1 874 . 1 1 243 243 LEU CA C 13 56 0.4 . 1 . . . . 262 LEU CA . 18170 1 875 . 1 1 243 243 LEU CB C 13 40.07 0.4 . 1 . . . . 262 LEU CB . 18170 1 876 . 1 1 243 243 LEU N N 15 121.8 0.5 . 1 . . . . 262 LEU N . 18170 1 877 . 1 1 244 244 LEU C C 13 176 0.3 . 1 . . . . 263 LEU C . 18170 1 878 . 1 1 244 244 LEU CA C 13 55.6 0.4 . 1 . . . . 263 LEU CA . 18170 1 879 . 1 1 244 244 LEU CB C 13 40.62 0.4 . 1 . . . . 263 LEU CB . 18170 1 880 . 1 1 244 244 LEU N N 15 123.5 0.5 . 1 . . . . 263 LEU N . 18170 1 881 . 1 1 245 245 ALA C C 13 174.4 0.3 . 1 . . . . 264 ALA C . 18170 1 882 . 1 1 245 245 ALA CA C 13 53.3 0.4 . 1 . . . . 264 ALA CA . 18170 1 883 . 1 1 245 245 ALA CB C 13 15.82 0.4 . 1 . . . . 264 ALA CB . 18170 1 884 . 1 1 245 245 ALA N N 15 122.2 0.5 . 1 . . . . 264 ALA N . 18170 1 885 . 1 1 246 246 ASP C C 13 171.6 0.3 . 1 . . . . 265 ASP C . 18170 1 886 . 1 1 246 246 ASP CA C 13 56.3 0.4 . 1 . . . . 265 ASP CA . 18170 1 887 . 1 1 246 246 ASP N N 15 126.5 0.5 . 1 . . . . 265 ASP N . 18170 1 888 . 1 1 247 247 THR C C 13 175.3 0.3 . 1 . . . . 266 THR C . 18170 1 889 . 1 1 247 247 THR CA C 13 60.3 0.4 . 1 . . . . 266 THR CA . 18170 1 890 . 1 1 247 247 THR N N 15 120.7 0.5 . 1 . . . . 266 THR N . 18170 1 891 . 1 1 248 248 LEU C C 13 176.1 0.3 . 1 . . . . 267 LEU C . 18170 1 892 . 1 1 248 248 LEU CA C 13 55.95 0.4 . 1 . . . . 267 LEU CA . 18170 1 893 . 1 1 248 248 LEU CB C 13 40.13 0.4 . 1 . . . . 267 LEU CB . 18170 1 894 . 1 1 248 248 LEU N N 15 121.6 0.5 . 1 . . . . 267 LEU N . 18170 1 895 . 1 1 249 249 MET C C 13 176.8 0.3 . 1 . . . . 268 MET C . 18170 1 896 . 1 1 249 249 MET CA C 13 58.2 0.4 . 1 . . . . 268 MET CA . 18170 1 897 . 1 1 249 249 MET CB C 13 31.9 0.4 . 1 . . . . 268 MET CB . 18170 1 898 . 1 1 249 249 MET N N 15 120.2 0.5 . 1 . . . . 268 MET N . 18170 1 899 . 1 1 250 250 ARG C C 13 175.5 0.3 . 1 . . . . 269 ARG C . 18170 1 900 . 1 1 250 250 ARG CA C 13 57 0.4 . 1 . . . . 269 ARG CA . 18170 1 901 . 1 1 250 250 ARG CB C 13 29.7 0.4 . 1 . . . . 269 ARG CB . 18170 1 902 . 1 1 250 250 ARG N N 15 116.7 0.5 . 1 . . . . 269 ARG N . 18170 1 903 . 1 1 251 251 THR C C 13 175.7 0.3 . 1 . . . . 270 THR C . 18170 1 904 . 1 1 251 251 THR CA C 13 64 0.4 . 1 . . . . 270 THR CA . 18170 1 905 . 1 1 251 251 THR N N 15 117.1 0.5 . 1 . . . . 270 THR N . 18170 1 906 . 1 1 252 252 GLN C C 13 176 0.3 . 1 . . . . 271 GLN C . 18170 1 907 . 1 1 252 252 GLN CA C 13 57.4 0.4 . 1 . . . . 271 GLN CA . 18170 1 908 . 1 1 252 252 GLN N N 15 122.8 0.5 . 1 . . . . 271 GLN N . 18170 1 909 . 1 1 253 253 VAL C C 13 176 0.3 . 1 . . . . 272 VAL C . 18170 1 910 . 1 1 253 253 VAL CA C 13 63.67 0.4 . 1 . . . . 272 VAL CA . 18170 1 911 . 1 1 253 253 VAL CB C 13 35.31 0.4 . 1 . . . . 272 VAL CB . 18170 1 912 . 1 1 253 253 VAL N N 15 121.3 0.5 . 1 . . . . 272 VAL N . 18170 1 913 . 1 1 254 254 ILE C C 13 178.3 0.3 . 1 . . . . 273 ILE C . 18170 1 914 . 1 1 254 254 ILE CA C 13 64 0.4 . 1 . . . . 273 ILE CA . 18170 1 915 . 1 1 254 254 ILE CB C 13 36 0.4 . 1 . . . . 273 ILE CB . 18170 1 916 . 1 1 254 254 ILE N N 15 123.3 0.5 . 1 . . . . 273 ILE N . 18170 1 917 . 1 1 255 255 GLN C C 13 176 0.3 . 1 . . . . 274 GLN C . 18170 1 918 . 1 1 255 255 GLN CA C 13 56.95 0.4 . 1 . . . . 274 GLN CA . 18170 1 919 . 1 1 255 255 GLN N N 15 123.4 0.5 . 1 . . . . 274 GLN N . 18170 1 920 . 1 1 256 256 GLU C C 13 177.2 0.3 . 1 . . . . 275 GLU C . 18170 1 921 . 1 1 256 256 GLU CA C 13 55.73 0.4 . 1 . . . . 275 GLU CA . 18170 1 922 . 1 1 256 256 GLU CB C 13 29.13 0.4 . 1 . . . . 275 GLU CB . 18170 1 923 . 1 1 256 256 GLU N N 15 123.6 0.5 . 1 . . . . 275 GLU N . 18170 1 924 . 1 1 257 257 SER CA C 13 61.3 0.4 . 1 . . . . 276 SER CA . 18170 1 925 . 1 1 257 257 SER CB C 13 63.34 0.4 . 1 . . . . 276 SER CB . 18170 1 926 . 1 1 257 257 SER N N 15 116.4 0.5 . 1 . . . . 276 SER N . 18170 1 927 . 1 1 258 258 CYS C C 13 175.6 0.3 . 1 . . . . 277 CYS C . 18170 1 928 . 1 1 258 258 CYS CA C 13 55.3 0.4 . 1 . . . . 277 CYS CA . 18170 1 929 . 1 1 258 258 CYS CB C 13 39.7 0.4 . 1 . . . . 277 CYS CB . 18170 1 930 . 1 1 258 258 CYS N N 15 117.2 0.5 . 1 . . . . 277 CYS N . 18170 1 931 . 1 1 259 259 GLU C C 13 175.2 0.3 . 1 . . . . 278 GLU C . 18170 1 932 . 1 1 259 259 GLU CA C 13 58.2 0.4 . 1 . . . . 278 GLU CA . 18170 1 933 . 1 1 259 259 GLU CB C 13 28.89 0.4 . 1 . . . . 278 GLU CB . 18170 1 934 . 1 1 259 259 GLU N N 15 120.9 0.5 . 1 . . . . 278 GLU N . 18170 1 935 . 1 1 260 260 ARG C C 13 176.6 0.3 . 1 . . . . 279 ARG C . 18170 1 936 . 1 1 260 260 ARG CA C 13 56.2 0.4 . 1 . . . . 279 ARG CA . 18170 1 937 . 1 1 260 260 ARG CB C 13 29.5 0.4 . 1 . . . . 279 ARG CB . 18170 1 938 . 1 1 260 260 ARG N N 15 123 0.5 . 1 . . . . 279 ARG N . 18170 1 939 . 1 1 261 261 ARG C C 13 176.3 0.3 . 1 . . . . 280 ARG C . 18170 1 940 . 1 1 261 261 ARG CA C 13 55.87 0.4 . 1 . . . . 280 ARG CA . 18170 1 941 . 1 1 261 261 ARG CB C 13 28.25 0.4 . 1 . . . . 280 ARG CB . 18170 1 942 . 1 1 261 261 ARG N N 15 124 0.5 . 1 . . . . 280 ARG N . 18170 1 943 . 1 1 262 262 ASN C C 13 174.6 0.3 . 1 . . . . 281 ASN C . 18170 1 944 . 1 1 262 262 ASN CA C 13 51.88 0.4 . 1 . . . . 281 ASN CA . 18170 1 945 . 1 1 262 262 ASN CB C 13 37.7 0.4 . 1 . . . . 281 ASN CB . 18170 1 946 . 1 1 262 262 ASN N N 15 121.1 0.5 . 1 . . . . 281 ASN N . 18170 1 947 . 1 1 263 263 ASN C C 13 176.6 0.3 . 1 . . . . 282 ASN C . 18170 1 948 . 1 1 263 263 ASN CA C 13 55.8 0.4 . 1 . . . . 282 ASN CA . 18170 1 949 . 1 1 263 263 ASN CB C 13 39 0.4 . 1 . . . . 282 ASN CB . 18170 1 950 . 1 1 263 263 ASN N N 15 121.6 0.5 . 1 . . . . 282 ASN N . 18170 1 951 . 1 1 264 264 ILE C C 13 175.2 0.3 . 1 . . . . 283 ILE C . 18170 1 952 . 1 1 264 264 ILE CA C 13 64.5 0.4 . 1 . . . . 283 ILE CA . 18170 1 953 . 1 1 264 264 ILE CB C 13 36.6 0.4 . 1 . . . . 283 ILE CB . 18170 1 954 . 1 1 264 264 ILE N N 15 120.8 0.5 . 1 . . . . 283 ILE N . 18170 1 955 . 1 1 265 265 GLY C C 13 176.8 0.3 . 1 . . . . 284 GLY C . 18170 1 956 . 1 1 265 265 GLY CA C 13 41.4 0.4 . 1 . . . . 284 GLY CA . 18170 1 957 . 1 1 265 265 GLY N N 15 110.5 0.5 . 1 . . . . 284 GLY N . 18170 1 958 . 1 1 267 267 ALA C C 13 178.5 0.3 . 1 . . . . 286 ALA C . 18170 1 959 . 1 1 267 267 ALA CA C 13 53.84 0.4 . 1 . . . . 286 ALA CA . 18170 1 960 . 1 1 267 267 ALA CB C 13 16.63 0.4 . 1 . . . . 286 ALA CB . 18170 1 961 . 1 1 267 267 ALA N N 15 122.8 0.5 . 1 . . . . 286 ALA N . 18170 1 962 . 1 1 268 268 LEU C C 13 175.8 0.3 . 1 . . . . 287 LEU C . 18170 1 963 . 1 1 268 268 LEU CA C 13 56.15 0.4 . 1 . . . . 287 LEU CA . 18170 1 964 . 1 1 268 268 LEU CB C 13 40.2 0.4 . 1 . . . . 287 LEU CB . 18170 1 965 . 1 1 268 268 LEU N N 15 125.5 0.5 . 1 . . . . 287 LEU N . 18170 1 966 . 1 1 269 269 ASP C C 13 176.5 0.3 . 1 . . . . 288 ASP C . 18170 1 967 . 1 1 269 269 ASP CA C 13 56.25 0.4 . 1 . . . . 288 ASP CA . 18170 1 968 . 1 1 269 269 ASP N N 15 116.8 0.5 . 1 . . . . 288 ASP N . 18170 1 969 . 1 1 270 270 ALA C C 13 177.5 0.3 . 1 . . . . 289 ALA C . 18170 1 970 . 1 1 270 270 ALA CA C 13 53.25 0.4 . 1 . . . . 289 ALA CA . 18170 1 971 . 1 1 270 270 ALA CB C 13 16.9 0.4 . 1 . . . . 289 ALA CB . 18170 1 972 . 1 1 270 270 ALA N N 15 124.6 0.5 . 1 . . . . 289 ALA N . 18170 1 973 . 1 1 271 271 THR C C 13 177 0.3 . 1 . . . . 290 THR C . 18170 1 974 . 1 1 271 271 THR CA C 13 64.1 0.4 . 1 . . . . 290 THR CA . 18170 1 975 . 1 1 271 271 THR N N 15 114.9 0.5 . 1 . . . . 290 THR N . 18170 1 976 . 1 1 272 272 GLU C C 13 177 0.3 . 1 . . . . 291 GLU C . 18170 1 977 . 1 1 272 272 GLU CA C 13 57.5 0.4 . 1 . . . . 291 GLU CA . 18170 1 978 . 1 1 272 272 GLU CB C 13 29.7 0.4 . 1 . . . . 291 GLU CB . 18170 1 979 . 1 1 272 272 GLU N N 15 120.8 0.5 . 1 . . . . 291 GLU N . 18170 1 980 . 1 1 273 273 ILE C C 13 176 0.3 . 1 . . . . 292 ILE C . 18170 1 981 . 1 1 273 273 ILE CA C 13 64.3 0.4 . 1 . . . . 292 ILE CA . 18170 1 982 . 1 1 273 273 ILE CB C 13 36.64 0.4 . 1 . . . . 292 ILE CB . 18170 1 983 . 1 1 273 273 ILE N N 15 121.3 0.5 . 1 . . . . 292 ILE N . 18170 1 984 . 1 1 274 274 LEU C C 13 175.1 0.3 . 1 . . . . 293 LEU C . 18170 1 985 . 1 1 274 274 LEU CA C 13 55.6 0.4 . 1 . . . . 293 LEU CA . 18170 1 986 . 1 1 274 274 LEU CB C 13 39.44 0.4 . 1 . . . . 293 LEU CB . 18170 1 987 . 1 1 274 274 LEU N N 15 122.7 0.5 . 1 . . . . 293 LEU N . 18170 1 988 . 1 1 275 275 GLY C C 13 173.8 0.3 . 1 . . . . 294 GLY C . 18170 1 989 . 1 1 275 275 GLY CA C 13 45.03 0.4 . 1 . . . . 294 GLY CA . 18170 1 990 . 1 1 275 275 GLY N N 15 108.5 0.5 . 1 . . . . 294 GLY N . 18170 1 991 . 1 1 276 276 PHE C C 13 177.5 0.3 . 1 . . . . 295 PHE C . 18170 1 992 . 1 1 276 276 PHE CA C 13 58.5 0.4 . 1 . . . . 295 PHE CA . 18170 1 993 . 1 1 276 276 PHE N N 15 121.6 0.5 . 1 . . . . 295 PHE N . 18170 1 994 . 1 1 277 277 LEU C C 13 175.3 0.3 . 1 . . . . 296 LEU C . 18170 1 995 . 1 1 277 277 LEU CA C 13 55.9 0.4 . 1 . . . . 296 LEU CA . 18170 1 996 . 1 1 277 277 LEU CB C 13 40 0.4 . 1 . . . . 296 LEU CB . 18170 1 997 . 1 1 277 277 LEU N N 15 120.9 0.5 . 1 . . . . 296 LEU N . 18170 1 998 . 1 1 278 278 HIS C C 13 176.6 0.3 . 1 . . . . 297 HIS C . 18170 1 999 . 1 1 278 278 HIS CA C 13 57.7 0.4 . 1 . . . . 297 HIS CA . 18170 1 1000 . 1 1 278 278 HIS CB C 13 30.13 0.4 . 1 . . . . 297 HIS CB . 18170 1 1001 . 1 1 278 278 HIS N N 15 120.6 0.5 . 1 . . . . 297 HIS N . 18170 1 1002 . 1 1 279 279 SER C C 13 177.7 0.3 . 1 . . . . 298 SER C . 18170 1 1003 . 1 1 279 279 SER CA C 13 62.58 0.4 . 1 . . . . 298 SER CA . 18170 1 1004 . 1 1 279 279 SER CB C 13 64.53 0.4 . 1 . . . . 298 SER CB . 18170 1 1005 . 1 1 279 279 SER N N 15 122.5 0.5 . 1 . . . . 298 SER N . 18170 1 1006 . 1 1 280 280 CYS C C 13 177.3 0.3 . 1 . . . . 299 CYS C . 18170 1 1007 . 1 1 280 280 CYS CA C 13 59.2 0.4 . 1 . . . . 299 CYS CA . 18170 1 1008 . 1 1 280 280 CYS CB C 13 27.36 0.4 . 1 . . . . 299 CYS CB . 18170 1 1009 . 1 1 280 280 CYS N N 15 121.6 0.5 . 1 . . . . 299 CYS N . 18170 1 1010 . 1 1 281 281 LEU C C 13 179 0.3 . 1 . . . . 300 LEU C . 18170 1 1011 . 1 1 281 281 LEU CA C 13 54.96 0.4 . 1 . . . . 300 LEU CA . 18170 1 1012 . 1 1 281 281 LEU CB C 13 40.74 0.4 . 1 . . . . 300 LEU CB . 18170 1 1013 . 1 1 281 281 LEU N N 15 121.3 0.5 . 1 . . . . 300 LEU N . 18170 1 1014 . 1 1 282 282 ASN C C 13 176.6 0.3 . 1 . . . . 301 ASN C . 18170 1 1015 . 1 1 282 282 ASN CA C 13 53.3 0.4 . 1 . . . . 301 ASN CA . 18170 1 1016 . 1 1 282 282 ASN CB C 13 36.76 0.4 . 1 . . . . 301 ASN CB . 18170 1 1017 . 1 1 282 282 ASN N N 15 119 0.5 . 1 . . . . 301 ASN N . 18170 1 1018 . 1 1 283 283 PRO CA C 13 58.86 0.4 . 1 . . . . 302 PRO CA . 18170 1 1019 . 1 1 284 284 ILE C C 13 173.7 0.3 . 1 . . . . 303 ILE C . 18170 1 1020 . 1 1 284 284 ILE CA C 13 66.5 0.4 . 1 . . . . 303 ILE CA . 18170 1 1021 . 1 1 284 284 ILE CB C 13 36.65 0.4 . 1 . . . . 303 ILE CB . 18170 1 1022 . 1 1 284 284 ILE N N 15 120.9 0.5 . 1 . . . . 303 ILE N . 18170 1 1023 . 1 1 285 285 ILE C C 13 175.9 0.3 . 1 . . . . 304 ILE C . 18170 1 1024 . 1 1 285 285 ILE CA C 13 65.8 0.4 . 1 . . . . 304 ILE CA . 18170 1 1025 . 1 1 285 285 ILE CB C 13 36.33 0.4 . 1 . . . . 304 ILE CB . 18170 1 1026 . 1 1 285 285 ILE N N 15 120.4 0.5 . 1 . . . . 304 ILE N . 18170 1 1027 . 1 1 286 286 TYR C C 13 174.8 0.3 . 1 . . . . 305 TYR C . 18170 1 1028 . 1 1 286 286 TYR CA C 13 56.7 0.4 . 1 . . . . 305 TYR CA . 18170 1 1029 . 1 1 286 286 TYR CB C 13 37.9 0.4 . 1 . . . . 305 TYR CB . 18170 1 1030 . 1 1 286 286 TYR N N 15 120.3 0.5 . 1 . . . . 305 TYR N . 18170 1 1031 . 1 1 287 287 ALA C C 13 172 0.3 . 1 . . . . 306 ALA C . 18170 1 1032 . 1 1 287 287 ALA CA C 13 54.35 0.4 . 1 . . . . 306 ALA CA . 18170 1 1033 . 1 1 287 287 ALA CB C 13 16.4 0.4 . 1 . . . . 306 ALA CB . 18170 1 1034 . 1 1 287 287 ALA N N 15 123.3 0.5 . 1 . . . . 306 ALA N . 18170 1 1035 . 1 1 288 288 PHE C C 13 175.9 0.3 . 1 . . . . 307 PHE C . 18170 1 1036 . 1 1 288 288 PHE CA C 13 60.25 0.4 . 1 . . . . 307 PHE CA . 18170 1 1037 . 1 1 288 288 PHE CB C 13 40.2 0.4 . 1 . . . . 307 PHE CB . 18170 1 1038 . 1 1 288 288 PHE N N 15 120.4 0.5 . 1 . . . . 307 PHE N . 18170 1 1039 . 1 1 289 289 ILE C C 13 177.2 0.3 . 1 . . . . 308 ILE C . 18170 1 1040 . 1 1 289 289 ILE CA C 13 64.55 0.4 . 1 . . . . 308 ILE CA . 18170 1 1041 . 1 1 289 289 ILE CB C 13 36.6 0.4 . 1 . . . . 308 ILE CB . 18170 1 1042 . 1 1 289 289 ILE N N 15 120.7 0.5 . 1 . . . . 308 ILE N . 18170 1 1043 . 1 1 290 290 GLY C C 13 174 0.3 . 1 . . . . 309 GLY C . 18170 1 1044 . 1 1 290 290 GLY CA C 13 41.6 0.4 . 1 . . . . 309 GLY CA . 18170 1 1045 . 1 1 290 290 GLY N N 15 111.3 0.5 . 1 . . . . 309 GLY N . 18170 1 1046 . 1 1 291 291 GLN C C 13 176.2 0.3 . 1 . . . . 310 GLN C . 18170 1 1047 . 1 1 291 291 GLN CA C 13 57.8 0.4 . 1 . . . . 310 GLN CA . 18170 1 1048 . 1 1 291 291 GLN CB C 13 31.9 0.4 . 1 . . . . 310 GLN CB . 18170 1 1049 . 1 1 291 291 GLN N N 15 119.4 0.5 . 1 . . . . 310 GLN N . 18170 1 1050 . 1 1 292 292 ASN C C 13 175.6 0.3 . 1 . . . . 311 ASN C . 18170 1 1051 . 1 1 292 292 ASN CA C 13 55.5 0.4 . 1 . . . . 311 ASN CA . 18170 1 1052 . 1 1 292 292 ASN CB C 13 38.8 0.4 . 1 . . . . 311 ASN CB . 18170 1 1053 . 1 1 292 292 ASN N N 15 120.1 0.5 . 1 . . . . 311 ASN N . 18170 1 1054 . 1 1 293 293 PHE C C 13 175.4 0.3 . 1 . . . . 312 PHE C . 18170 1 1055 . 1 1 293 293 PHE CA C 13 58.3 0.4 . 1 . . . . 312 PHE CA . 18170 1 1056 . 1 1 293 293 PHE CB C 13 36.8 0.4 . 1 . . . . 312 PHE CB . 18170 1 1057 . 1 1 293 293 PHE N N 15 120.7 0.5 . 1 . . . . 312 PHE N . 18170 1 1058 . 1 1 294 294 ARG C C 13 174.5 0.3 . 1 . . . . 313 ARG C . 18170 1 1059 . 1 1 294 294 ARG CA C 13 56 0.4 . 1 . . . . 313 ARG CA . 18170 1 1060 . 1 1 294 294 ARG CB C 13 29.3 0.4 . 1 . . . . 313 ARG CB . 18170 1 1061 . 1 1 294 294 ARG N N 15 123 0.5 . 1 . . . . 313 ARG N . 18170 1 1062 . 1 1 295 295 HIS C C 13 176.3 0.3 . 1 . . . . 314 HIS C . 18170 1 1063 . 1 1 295 295 HIS CA C 13 58.6 0.4 . 1 . . . . 314 HIS CA . 18170 1 1064 . 1 1 295 295 HIS CB C 13 29.9 0.4 . 1 . . . . 314 HIS CB . 18170 1 1065 . 1 1 295 295 HIS N N 15 122.1 0.5 . 1 . . . . 314 HIS N . 18170 1 1066 . 1 1 296 296 GLY C C 13 174.1 0.3 . 1 . . . . 315 GLY C . 18170 1 1067 . 1 1 296 296 GLY CA C 13 47.2 0.4 . 1 . . . . 315 GLY CA . 18170 1 1068 . 1 1 296 296 GLY N N 15 109.7 0.5 . 1 . . . . 315 GLY N . 18170 1 1069 . 1 1 297 297 PHE C C 13 176.2 0.3 . 1 . . . . 316 PHE C . 18170 1 1070 . 1 1 297 297 PHE CA C 13 58.2 0.4 . 1 . . . . 316 PHE CA . 18170 1 1071 . 1 1 297 297 PHE N N 15 123.6 0.5 . 1 . . . . 316 PHE N . 18170 1 1072 . 1 1 298 298 LEU C C 13 176.6 0.3 . 1 . . . . 317 LEU C . 18170 1 1073 . 1 1 298 298 LEU CA C 13 55.7 0.4 . 1 . . . . 317 LEU CA . 18170 1 1074 . 1 1 298 298 LEU CB C 13 40.2 0.4 . 1 . . . . 317 LEU CB . 18170 1 1075 . 1 1 298 298 LEU N N 15 122 0.5 . 1 . . . . 317 LEU N . 18170 1 1076 . 1 1 299 299 LYS C C 13 177.5 0.3 . 1 . . . . 318 LYS C . 18170 1 1077 . 1 1 299 299 LYS CA C 13 56.2 0.4 . 1 . . . . 318 LYS CA . 18170 1 1078 . 1 1 299 299 LYS CB C 13 30 0.4 . 1 . . . . 318 LYS CB . 18170 1 1079 . 1 1 299 299 LYS N N 15 121.8 0.5 . 1 . . . . 318 LYS N . 18170 1 1080 . 1 1 300 300 ILE C C 13 176 0.3 . 1 . . . . 319 ILE C . 18170 1 1081 . 1 1 300 300 ILE CA C 13 65.2 0.4 . 1 . . . . 319 ILE CA . 18170 1 1082 . 1 1 300 300 ILE CB C 13 36.4 0.4 . 1 . . . . 319 ILE CB . 18170 1 1083 . 1 1 300 300 ILE N N 15 120.6 0.5 . 1 . . . . 319 ILE N . 18170 1 1084 . 1 1 301 301 LEU C C 13 176.8 0.3 . 1 . . . . 320 LEU C . 18170 1 1085 . 1 1 301 301 LEU CA C 13 56.2 0.4 . 1 . . . . 320 LEU CA . 18170 1 1086 . 1 1 301 301 LEU CB C 13 40 0.4 . 1 . . . . 320 LEU CB . 18170 1 1087 . 1 1 301 301 LEU N N 15 121.9 0.5 . 1 . . . . 320 LEU N . 18170 1 1088 . 1 1 302 302 ALA C C 13 177.1 0.3 . 1 . . . . 321 ALA C . 18170 1 1089 . 1 1 302 302 ALA CA C 13 55 0.4 . 1 . . . . 321 ALA CA . 18170 1 1090 . 1 1 302 302 ALA CB C 13 18 0.4 . 1 . . . . 321 ALA CB . 18170 1 1091 . 1 1 302 302 ALA N N 15 123 0.5 . 1 . . . . 321 ALA N . 18170 1 1092 . 1 1 303 303 MET C C 13 173.3 0.3 . 1 . . . . 322 MET C . 18170 1 1093 . 1 1 303 303 MET CA C 13 56.1 0.4 . 1 . . . . 322 MET CA . 18170 1 1094 . 1 1 303 303 MET N N 15 120.4 0.5 . 1 . . . . 322 MET N . 18170 1 1095 . 1 1 304 304 HIS C C 13 173.2 0.3 . 1 . . . . 323 HIS C . 18170 1 1096 . 1 1 304 304 HIS CA C 13 57 0.4 . 1 . . . . 323 HIS CA . 18170 1 1097 . 1 1 304 304 HIS CB C 13 29.7 0.4 . 1 . . . . 323 HIS CB . 18170 1 1098 . 1 1 304 304 HIS N N 15 120.7 0.5 . 1 . . . . 323 HIS N . 18170 1 1099 . 1 1 305 305 GLY C C 13 173.8 0.3 . 1 . . . . 324 GLY C . 18170 1 1100 . 1 1 305 305 GLY CA C 13 45.23 0.4 . 1 . . . . 324 GLY CA . 18170 1 1101 . 1 1 305 305 GLY N N 15 108.6 0.5 . 1 . . . . 324 GLY N . 18170 1 1102 . 1 1 306 306 LEU C C 13 177.6 0.3 . 1 . . . . 325 LEU C . 18170 1 1103 . 1 1 306 306 LEU CA C 13 53.9 0.4 . 1 . . . . 325 LEU CA . 18170 1 1104 . 1 1 306 306 LEU CB C 13 39.6 0.4 . 1 . . . . 325 LEU CB . 18170 1 1105 . 1 1 306 306 LEU N N 15 123.7 0.5 . 1 . . . . 325 LEU N . 18170 1 1106 . 1 1 307 307 VAL C C 13 175.4 0.3 . 1 . . . . 326 VAL C . 18170 1 1107 . 1 1 307 307 VAL CA C 13 63 0.4 . 1 . . . . 326 VAL CA . 18170 1 1108 . 1 1 307 307 VAL CB C 13 30.55 0.4 . 1 . . . . 326 VAL CB . 18170 1 1109 . 1 1 307 307 VAL N N 15 119.7 0.5 . 1 . . . . 326 VAL N . 18170 1 1110 . 1 1 308 308 SER C C 13 175.3 0.3 . 1 . . . . 327 SER C . 18170 1 1111 . 1 1 308 308 SER CA C 13 59.7 0.4 . 1 . . . . 327 SER CA . 18170 1 1112 . 1 1 308 308 SER N N 15 116.8 0.5 . 1 . . . . 327 SER N . 18170 1 1113 . 1 1 309 309 LYS CA C 13 56.64 0.4 . 1 . . . . 328 LYS CA . 18170 1 1114 . 1 1 309 309 LYS N N 15 121.4 0.5 . 1 . . . . 328 LYS N . 18170 1 stop_ save_