data_26016 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26016 _Entry.Title ; Solution Structure of Ca2+-bound C2 domain from Protein Kinase C alpha in the form of complex with V5-pHM peptide ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-03-28 _Entry.Accession_date 2016-03-28 _Entry.Last_release_date 2016-07-06 _Entry.Original_release_date 2016-07-06 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Yuan Yang Y. . . . 26016 2 Tatyana Igumenova T. I. . . 26016 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' . 26016 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID protein/ion . 26016 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26016 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 604 26016 '15N chemical shifts' 148 26016 '1H chemical shifts' 967 26016 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 . . 2018-05-25 2016-03-28 update BMRB 'update entry citation' 26016 1 . . 2017-03-24 2016-03-28 original author 'original release' 26016 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2NCE 'BMRB Entry Tracking System' 26016 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 26016 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1016/j.bpj.2017.12.030 _Citation.PubMed_ID 29642029 _Citation.Full_citation . _Citation.Title ; Structural Basis of Protein Kinase Calpha Regulation by the C-Terminal Tail. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biophys. J.' _Citation.Journal_name_full 'Biophysical journal' _Citation.Journal_volume 114 _Citation.Journal_issue 7 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1542-0086 _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 1590 _Citation.Page_last 1603 _Citation.Year 2018 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Yuan Yang Y. . . . 26016 1 2 Chang Shu C. . . . 26016 1 3 Pingwei Li P. . . . 26016 1 4 Tatyana Igumenova T. I. . . 26016 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26016 _Assembly.ID 1 _Assembly.Name 'Ca2+-bound C2 domain in complex with V5-pHM peptide' _Assembly.BMRB_code . _Assembly.Number_of_components 3 _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 entity_1 1 $C2 A . yes native no no . . . 26016 1 2 'CALCIUM ION_1' 2 $entity_CA B . no native no no . . . 26016 1 3 'CALCIUM ION_2' 2 $entity_CA C . no native no no . . . 26016 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_C2 _Entity.Sf_category entity _Entity.Sf_framecode C2 _Entity.Entry_ID 26016 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name C2 _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 ; HTEKRGRIYLKAEVTDEKLH VTVRDAKNLIPMDPNGLSDP YVKLKLIPDPKNESKQKTKT IRSTLNPQWNESFTFKLKPS DKDRRLSVEIWDWDRTTRND FMGSLSFGVSELMKMPASGW YKLLNQEEGEYYNVPIPEG ; _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 139 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 16240.596 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 155 HIS . 26016 1 2 156 THR . 26016 1 3 157 GLU . 26016 1 4 158 LYS . 26016 1 5 159 ARG . 26016 1 6 160 GLY . 26016 1 7 161 ARG . 26016 1 8 162 ILE . 26016 1 9 163 TYR . 26016 1 10 164 LEU . 26016 1 11 165 LYS . 26016 1 12 166 ALA . 26016 1 13 167 GLU . 26016 1 14 168 VAL . 26016 1 15 169 THR . 26016 1 16 170 ASP . 26016 1 17 171 GLU . 26016 1 18 172 LYS . 26016 1 19 173 LEU . 26016 1 20 174 HIS . 26016 1 21 175 VAL . 26016 1 22 176 THR . 26016 1 23 177 VAL . 26016 1 24 178 ARG . 26016 1 25 179 ASP . 26016 1 26 180 ALA . 26016 1 27 181 LYS . 26016 1 28 182 ASN . 26016 1 29 183 LEU . 26016 1 30 184 ILE . 26016 1 31 185 PRO . 26016 1 32 186 MET . 26016 1 33 187 ASP . 26016 1 34 188 PRO . 26016 1 35 189 ASN . 26016 1 36 190 GLY . 26016 1 37 191 LEU . 26016 1 38 192 SER . 26016 1 39 193 ASP . 26016 1 40 194 PRO . 26016 1 41 195 TYR . 26016 1 42 196 VAL . 26016 1 43 197 LYS . 26016 1 44 198 LEU . 26016 1 45 199 LYS . 26016 1 46 200 LEU . 26016 1 47 201 ILE . 26016 1 48 202 PRO . 26016 1 49 203 ASP . 26016 1 50 204 PRO . 26016 1 51 205 LYS . 26016 1 52 206 ASN . 26016 1 53 207 GLU . 26016 1 54 208 SER . 26016 1 55 209 LYS . 26016 1 56 210 GLN . 26016 1 57 211 LYS . 26016 1 58 212 THR . 26016 1 59 213 LYS . 26016 1 60 214 THR . 26016 1 61 215 ILE . 26016 1 62 216 ARG . 26016 1 63 217 SER . 26016 1 64 218 THR . 26016 1 65 219 LEU . 26016 1 66 220 ASN . 26016 1 67 221 PRO . 26016 1 68 222 GLN . 26016 1 69 223 TRP . 26016 1 70 224 ASN . 26016 1 71 225 GLU . 26016 1 72 226 SER . 26016 1 73 227 PHE . 26016 1 74 228 THR . 26016 1 75 229 PHE . 26016 1 76 230 LYS . 26016 1 77 231 LEU . 26016 1 78 232 LYS . 26016 1 79 233 PRO . 26016 1 80 234 SER . 26016 1 81 235 ASP . 26016 1 82 236 LYS . 26016 1 83 237 ASP . 26016 1 84 238 ARG . 26016 1 85 239 ARG . 26016 1 86 240 LEU . 26016 1 87 241 SER . 26016 1 88 242 VAL . 26016 1 89 243 GLU . 26016 1 90 244 ILE . 26016 1 91 245 TRP . 26016 1 92 246 ASP . 26016 1 93 247 TRP . 26016 1 94 248 ASP . 26016 1 95 249 ARG . 26016 1 96 250 THR . 26016 1 97 251 THR . 26016 1 98 252 ARG . 26016 1 99 253 ASN . 26016 1 100 254 ASP . 26016 1 101 255 PHE . 26016 1 102 256 MET . 26016 1 103 257 GLY . 26016 1 104 258 SER . 26016 1 105 259 LEU . 26016 1 106 260 SER . 26016 1 107 261 PHE . 26016 1 108 262 GLY . 26016 1 109 263 VAL . 26016 1 110 264 SER . 26016 1 111 265 GLU . 26016 1 112 266 LEU . 26016 1 113 267 MET . 26016 1 114 268 LYS . 26016 1 115 269 MET . 26016 1 116 270 PRO . 26016 1 117 271 ALA . 26016 1 118 272 SER . 26016 1 119 273 GLY . 26016 1 120 274 TRP . 26016 1 121 275 TYR . 26016 1 122 276 LYS . 26016 1 123 277 LEU . 26016 1 124 278 LEU . 26016 1 125 279 ASN . 26016 1 126 280 GLN . 26016 1 127 281 GLU . 26016 1 128 282 GLU . 26016 1 129 283 GLY . 26016 1 130 284 GLU . 26016 1 131 285 TYR . 26016 1 132 286 TYR . 26016 1 133 287 ASN . 26016 1 134 288 VAL . 26016 1 135 289 PRO . 26016 1 136 290 ILE . 26016 1 137 291 PRO . 26016 1 138 292 GLU . 26016 1 139 293 GLY . 26016 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 . HIS 1 1 26016 1 . THR 2 2 26016 1 . GLU 3 3 26016 1 . LYS 4 4 26016 1 . ARG 5 5 26016 1 . GLY 6 6 26016 1 . ARG 7 7 26016 1 . ILE 8 8 26016 1 . TYR 9 9 26016 1 . LEU 10 10 26016 1 . LYS 11 11 26016 1 . ALA 12 12 26016 1 . GLU 13 13 26016 1 . VAL 14 14 26016 1 . THR 15 15 26016 1 . ASP 16 16 26016 1 . GLU 17 17 26016 1 . LYS 18 18 26016 1 . LEU 19 19 26016 1 . HIS 20 20 26016 1 . VAL 21 21 26016 1 . THR 22 22 26016 1 . VAL 23 23 26016 1 . ARG 24 24 26016 1 . ASP 25 25 26016 1 . ALA 26 26 26016 1 . LYS 27 27 26016 1 . ASN 28 28 26016 1 . LEU 29 29 26016 1 . ILE 30 30 26016 1 . PRO 31 31 26016 1 . MET 32 32 26016 1 . ASP 33 33 26016 1 . PRO 34 34 26016 1 . ASN 35 35 26016 1 . GLY 36 36 26016 1 . LEU 37 37 26016 1 . SER 38 38 26016 1 . ASP 39 39 26016 1 . PRO 40 40 26016 1 . TYR 41 41 26016 1 . VAL 42 42 26016 1 . LYS 43 43 26016 1 . LEU 44 44 26016 1 . LYS 45 45 26016 1 . LEU 46 46 26016 1 . ILE 47 47 26016 1 . PRO 48 48 26016 1 . ASP 49 49 26016 1 . PRO 50 50 26016 1 . LYS 51 51 26016 1 . ASN 52 52 26016 1 . GLU 53 53 26016 1 . SER 54 54 26016 1 . LYS 55 55 26016 1 . GLN 56 56 26016 1 . LYS 57 57 26016 1 . THR 58 58 26016 1 . LYS 59 59 26016 1 . THR 60 60 26016 1 . ILE 61 61 26016 1 . ARG 62 62 26016 1 . SER 63 63 26016 1 . THR 64 64 26016 1 . LEU 65 65 26016 1 . ASN 66 66 26016 1 . PRO 67 67 26016 1 . GLN 68 68 26016 1 . TRP 69 69 26016 1 . ASN 70 70 26016 1 . GLU 71 71 26016 1 . SER 72 72 26016 1 . PHE 73 73 26016 1 . THR 74 74 26016 1 . PHE 75 75 26016 1 . LYS 76 76 26016 1 . LEU 77 77 26016 1 . LYS 78 78 26016 1 . PRO 79 79 26016 1 . SER 80 80 26016 1 . ASP 81 81 26016 1 . LYS 82 82 26016 1 . ASP 83 83 26016 1 . ARG 84 84 26016 1 . ARG 85 85 26016 1 . LEU 86 86 26016 1 . SER 87 87 26016 1 . VAL 88 88 26016 1 . GLU 89 89 26016 1 . ILE 90 90 26016 1 . TRP 91 91 26016 1 . ASP 92 92 26016 1 . TRP 93 93 26016 1 . ASP 94 94 26016 1 . ARG 95 95 26016 1 . THR 96 96 26016 1 . THR 97 97 26016 1 . ARG 98 98 26016 1 . ASN 99 99 26016 1 . ASP 100 100 26016 1 . PHE 101 101 26016 1 . MET 102 102 26016 1 . GLY 103 103 26016 1 . SER 104 104 26016 1 . LEU 105 105 26016 1 . SER 106 106 26016 1 . PHE 107 107 26016 1 . GLY 108 108 26016 1 . VAL 109 109 26016 1 . SER 110 110 26016 1 . GLU 111 111 26016 1 . LEU 112 112 26016 1 . MET 113 113 26016 1 . LYS 114 114 26016 1 . MET 115 115 26016 1 . PRO 116 116 26016 1 . ALA 117 117 26016 1 . SER 118 118 26016 1 . GLY 119 119 26016 1 . TRP 120 120 26016 1 . TYR 121 121 26016 1 . LYS 122 122 26016 1 . LEU 123 123 26016 1 . LEU 124 124 26016 1 . ASN 125 125 26016 1 . GLN 126 126 26016 1 . GLU 127 127 26016 1 . GLU 128 128 26016 1 . GLY 129 129 26016 1 . GLU 130 130 26016 1 . TYR 131 131 26016 1 . TYR 132 132 26016 1 . ASN 133 133 26016 1 . VAL 134 134 26016 1 . PRO 135 135 26016 1 . ILE 136 136 26016 1 . PRO 137 137 26016 1 . GLU 138 138 26016 1 . GLY 139 139 26016 1 stop_ save_ save_entity_CA _Entity.Sf_category entity _Entity.Sf_framecode entity_CA _Entity.Entry_ID 26016 _Entity.ID 2 _Entity.BMRB_code CA _Entity.Name 'CALCIUM ION' _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 CA _Entity.Nonpolymer_comp_label $chem_comp_CA _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 40.078 _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 'CALCIUM ION' BMRB 26016 2 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'CALCIUM ION' BMRB 26016 2 CA 'Three letter code' 26016 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 CA $chem_comp_CA 26016 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 26016 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $C2 . 10116 organism . 'Rattus norvegicus' Rat . . Eukaryota Metazoa Rattus norvegicus . . . . . . . . . . . . . 26016 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 26016 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $C2 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET-SUMO . . . 26016 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_CA _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_CA _Chem_comp.Entry_ID 26016 _Chem_comp.ID CA _Chem_comp.Provenance PDB _Chem_comp.Name 'CALCIUM ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code CA _Chem_comp.PDB_code CA _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code CA _Chem_comp.Number_atoms_all 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Ca/q+2 _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 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Ca _Chem_comp.Formula_weight 40.078 _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 . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _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 BHPQYMZQTOCNFJ-UHFFFAOYSA-N InChIKey InChI 1.03 26016 CA InChI=1S/Ca/q+2 InChI InChI 1.03 26016 CA [Ca++] SMILES CACTVS 3.341 26016 CA [Ca++] SMILES_CANONICAL CACTVS 3.341 26016 CA [Ca+2] SMILES ACDLabs 10.04 26016 CA [Ca+2] SMILES 'OpenEye OEToolkits' 1.5.0 26016 CA [Ca+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 26016 CA 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 calcium 'SYSTEMATIC NAME' ACDLabs 10.04 26016 CA 'calcium(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 26016 CA 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 CA CA CA CA . CA . . N 2 . . . 0 no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 26016 CA stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26016 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '92% H2O/8% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'CALCIUM ION' 'natural abundance' . . 2 $entity_CA . . 2.225 . . mM . . . . 26016 1 2 C2 '[U-13C; U-15N]' . . 1 $C2 . . 0.89 . . mM . . . . 26016 1 3 MES 'natural abundance' . . . . . . 6.7 . . mM . . . . 26016 1 4 'potassium chloride' 'natural abundance' . . . . . . 67 . . mM . . . . 26016 1 5 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 26016 1 6 'pHM peptide' 'natural abundance' . . . . . . 2 . . mM . . . . 26016 1 7 H2O 'natural abundance' . . . . . . 92 . . % . . . . 26016 1 8 D2O 'natural abundance' . . . . . . 8 . . % . . . . 26016 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 26016 _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' 0.076 . M 26016 1 pH 6.0 . pH 26016 1 pressure 1 . atm 26016 1 temperature 296.15 . K 26016 1 stop_ save_ ############################ # Computer software used # ############################ save_ARIA _Software.Sf_category software _Software.Sf_framecode ARIA _Software.Entry_ID 26016 _Software.ID 1 _Software.Type . _Software.Name ARIA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "Linge, O'Donoghue and Nilges" . . 26016 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 26016 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 26016 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 26016 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 26016 2 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 26016 _Software.ID 3 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 26016 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 26016 3 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 26016 _Software.ID 4 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 26016 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 26016 4 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 26016 _Software.ID 5 _Software.Type . _Software.Name CNS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 26016 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 26016 5 stop_ save_ save_PSVS _Software.Sf_category software _Software.Sf_framecode PSVS _Software.Entry_ID 26016 _Software.ID 6 _Software.Type . _Software.Name PSVS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bhattacharya and Montelione' . . 26016 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structural validation' 26016 6 stop_ save_ save_CcpNMR _Software.Sf_category software _Software.Sf_framecode CcpNMR _Software.Entry_ID 26016 _Software.ID 7 _Software.Type . _Software.Name CcpNMR _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 26016 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 26016 7 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 26016 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'RT probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 26016 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'Cryo probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 26016 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details 'Cryo probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 26016 _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 . 500 'RT probe' . . 26016 1 2 spectrometer_2 Bruker Avance . 800 'Cryo probe' . . 26016 1 3 spectrometer_3 Bruker Avance . 600 'Cryo probe' . . 26016 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 26016 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26016 1 2 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26016 1 3 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 26016 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26016 1 5 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26016 1 6 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26016 1 7 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26016 1 8 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26016 1 9 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26016 1 10 '3D 1H-15N TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26016 1 11 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26016 1 12 '3D HCCH-TOCSY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26016 1 13 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26016 1 14 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26016 1 15 '3D HNHA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26016 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 26016 _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 26016 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 'separate tube (no insert) similar to the experimental sample tube' cylindrical parallel . . 26016 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 26016 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 26016 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 26016 1 2 '3D HNCO' . . . 26016 1 3 '3D HN(CA)CO' . . . 26016 1 4 '3D HNCACB' . . . 26016 1 5 '2D 1H-13C HSQC aliphatic' . . . 26016 1 6 '3D C(CO)NH' . . . 26016 1 7 '3D H(CCO)NH' . . . 26016 1 8 '3D HCCH-TOCSY' . . . 26016 1 9 '3D HCCH-COSY' . . . 26016 1 10 '3D 1H-15N TOCSY' . . . 26016 1 11 '2D 1H-13C HSQC aromatic' . . . 26016 1 12 '3D HCCH-TOCSY aromatic' . . . 26016 1 13 '3D 1H-15N NOESY' . . . 26016 1 15 '3D HNHA' . . . 26016 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 4 $SPARKY . . 26016 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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 HIS HA H 1 4.293 0.053 . 1 . . . . . 155 HIS HA . 26016 1 2 . 1 1 1 1 HIS HB2 H 1 3.24 0.053 . 2 . . . . . 155 HIS HB* . 26016 1 3 . 1 1 1 1 HIS HB3 H 1 3.24 0.053 . 2 . . . . . 155 HIS HB* . 26016 1 4 . 1 1 1 1 HIS HD2 H 1 7.257 0 . 1 . . . . . 155 HIS HD2 . 26016 1 5 . 1 1 1 1 HIS HE1 H 1 8.252 0 . 1 . . . . . 155 HIS HE1 . 26016 1 6 . 1 1 1 1 HIS CA C 13 55.847 0.386 . 1 . . . . . 155 HIS CA . 26016 1 7 . 1 1 1 1 HIS CB C 13 30.956 0.55 . 1 . . . . . 155 HIS CB . 26016 1 8 . 1 1 1 1 HIS CD2 C 13 120.383 0 . 1 . . . . . 155 HIS CD2 . 26016 1 9 . 1 1 1 1 HIS CE1 C 13 137.771 0 . 1 . . . . . 155 HIS CE1 . 26016 1 10 . 1 1 2 2 THR HA H 1 4.368 0.019 . 1 . . . . . 156 THR HA . 26016 1 11 . 1 1 2 2 THR HB H 1 4.185 0.005 . 1 . . . . . 156 THR HB . 26016 1 12 . 1 1 2 2 THR HG21 H 1 1.201 0.012 . 1 . . . . . 156 THR HG2 . 26016 1 13 . 1 1 2 2 THR HG22 H 1 1.201 0.012 . 1 . . . . . 156 THR HG2 . 26016 1 14 . 1 1 2 2 THR HG23 H 1 1.201 0.012 . 1 . . . . . 156 THR HG2 . 26016 1 15 . 1 1 2 2 THR C C 13 173.977 0 . 1 . . . . . 156 THR C . 26016 1 16 . 1 1 2 2 THR CA C 13 61.886 0.049 . 1 . . . . . 156 THR CA . 26016 1 17 . 1 1 2 2 THR CB C 13 69.938 0.104 . 1 . . . . . 156 THR CB . 26016 1 18 . 1 1 2 2 THR CG2 C 13 21.702 0.053 . 1 . . . . . 156 THR CG2 . 26016 1 19 . 1 1 3 3 GLU H H 1 8.895 0.006 . 1 . . . . . 157 GLU H . 26016 1 20 . 1 1 3 3 GLU HA H 1 4.556 0.01 . 1 . . . . . 157 GLU HA . 26016 1 21 . 1 1 3 3 GLU HB2 H 1 2.082 0.02 . 2 . . . . . 157 GLU HB2 . 26016 1 22 . 1 1 3 3 GLU HB3 H 1 1.942 0.011 . 2 . . . . . 157 GLU HB3 . 26016 1 23 . 1 1 3 3 GLU HG2 H 1 2.232 0.008 . 1 . . . . . 157 GLU HG* . 26016 1 24 . 1 1 3 3 GLU HG3 H 1 2.232 0.008 . 1 . . . . . 157 GLU HG* . 26016 1 25 . 1 1 3 3 GLU C C 13 176.915 0 . 1 . . . . . 157 GLU C . 26016 1 26 . 1 1 3 3 GLU CA C 13 55.814 0.082 . 1 . . . . . 157 GLU CA . 26016 1 27 . 1 1 3 3 GLU CB C 13 30.058 0.091 . 1 . . . . . 157 GLU CB . 26016 1 28 . 1 1 3 3 GLU CG C 13 36.364 0.101 . 1 . . . . . 157 GLU CG . 26016 1 29 . 1 1 3 3 GLU N N 15 125.405 0.036 . 1 . . . . . 157 GLU N . 26016 1 30 . 1 1 4 4 LYS H H 1 8.674 0.01 . 1 . . . . . 158 LYS H . 26016 1 31 . 1 1 4 4 LYS HA H 1 4.287 0.018 . 1 . . . . . 158 LYS HA . 26016 1 32 . 1 1 4 4 LYS HB2 H 1 1.861 0.013 . 2 . . . . . 158 LYS HB* . 26016 1 33 . 1 1 4 4 LYS HB3 H 1 1.861 0.013 . 2 . . . . . 158 LYS HB* . 26016 1 34 . 1 1 4 4 LYS HG2 H 1 1.505 0.01 . 2 . . . . . 158 LYS HG* . 26016 1 35 . 1 1 4 4 LYS HG3 H 1 1.505 0.01 . 2 . . . . . 158 LYS HG* . 26016 1 36 . 1 1 4 4 LYS HD2 H 1 1.723 0.027 . 2 . . . . . 158 LYS HD* . 26016 1 37 . 1 1 4 4 LYS HD3 H 1 1.723 0.027 . 2 . . . . . 158 LYS HD* . 26016 1 38 . 1 1 4 4 LYS HE2 H 1 3.009 0.01 . 2 . . . . . 158 LYS HE* . 26016 1 39 . 1 1 4 4 LYS HE3 H 1 3.009 0.01 . 2 . . . . . 158 LYS HE* . 26016 1 40 . 1 1 4 4 LYS C C 13 177.19 0 . 1 . . . . . 158 LYS C . 26016 1 41 . 1 1 4 4 LYS CA C 13 57.626 0.129 . 1 . . . . . 158 LYS CA . 26016 1 42 . 1 1 4 4 LYS CB C 13 32.554 0.114 . 1 . . . . . 158 LYS CB . 26016 1 43 . 1 1 4 4 LYS CG C 13 25.118 0.087 . 1 . . . . . 158 LYS CG . 26016 1 44 . 1 1 4 4 LYS CD C 13 29.047 0.024 . 1 . . . . . 158 LYS CD . 26016 1 45 . 1 1 4 4 LYS CE C 13 42.587 0 . 1 . . . . . 158 LYS CE . 26016 1 46 . 1 1 4 4 LYS N N 15 123.382 0.026 . 1 . . . . . 158 LYS N . 26016 1 47 . 1 1 5 5 ARG H H 1 8.64 0.007 . 1 . . . . . 159 ARG H . 26016 1 48 . 1 1 5 5 ARG HA H 1 4.548 0.006 . 1 . . . . . 159 ARG HA . 26016 1 49 . 1 1 5 5 ARG HB2 H 1 2.061 0.008 . 2 . . . . . 159 ARG HB2 . 26016 1 50 . 1 1 5 5 ARG HB3 H 1 1.914 0.005 . 2 . . . . . 159 ARG HB3 . 26016 1 51 . 1 1 5 5 ARG HG2 H 1 1.569 0 . 2 . . . . . 159 ARG HG* . 26016 1 52 . 1 1 5 5 ARG HG3 H 1 1.569 0 . 2 . . . . . 159 ARG HG* . 26016 1 53 . 1 1 5 5 ARG HD2 H 1 3.213 0.01 . 2 . . . . . 159 ARG HD* . 26016 1 54 . 1 1 5 5 ARG HD3 H 1 3.213 0.01 . 2 . . . . . 159 ARG HD* . 26016 1 55 . 1 1 5 5 ARG HE H 1 7.646 0.013 . 1 . . . . . 159 ARG HE . 26016 1 56 . 1 1 5 5 ARG C C 13 175.026 0 . 1 . . . . . 159 ARG C . 26016 1 57 . 1 1 5 5 ARG CA C 13 55.325 0.035 . 1 . . . . . 159 ARG CA . 26016 1 58 . 1 1 5 5 ARG CB C 13 32.293 0.134 . 1 . . . . . 159 ARG CB . 26016 1 59 . 1 1 5 5 ARG CG C 13 28.403 0 . 1 . . . . . 159 ARG CG . 26016 1 60 . 1 1 5 5 ARG CD C 13 43.297 0.066 . 1 . . . . . 159 ARG CD . 26016 1 61 . 1 1 5 5 ARG N N 15 118.664 0.101 . 1 . . . . . 159 ARG N . 26016 1 62 . 1 1 5 5 ARG NE N 15 83.978 0 . 1 . . . . . 159 ARG NE . 26016 1 63 . 1 1 6 6 GLY H H 1 7.649 0.006 . 1 . . . . . 160 GLY H . 26016 1 64 . 1 1 6 6 GLY HA2 H 1 4.504 0.016 . 2 . . . . . 160 GLY HA2 . 26016 1 65 . 1 1 6 6 GLY HA3 H 1 3.866 0.015 . 2 . . . . . 160 GLY HA3 . 26016 1 66 . 1 1 6 6 GLY C C 13 174.61 0 . 1 . . . . . 160 GLY C . 26016 1 67 . 1 1 6 6 GLY CA C 13 45.658 0.121 . 1 . . . . . 160 GLY CA . 26016 1 68 . 1 1 6 6 GLY N N 15 106.166 0.049 . 1 . . . . . 160 GLY N . 26016 1 69 . 1 1 7 7 ARG H H 1 8.561 0.006 . 1 . . . . . 161 ARG H . 26016 1 70 . 1 1 7 7 ARG HA H 1 5.668 0.015 . 1 . . . . . 161 ARG HA . 26016 1 71 . 1 1 7 7 ARG HB2 H 1 2.05 0.007 . 2 . . . . . 161 ARG HB2 . 26016 1 72 . 1 1 7 7 ARG HB3 H 1 1.598 0.018 . 2 . . . . . 161 ARG HB3 . 26016 1 73 . 1 1 7 7 ARG HG2 H 1 2.482 0 . 2 . . . . . 161 ARG HG* . 26016 1 74 . 1 1 7 7 ARG HG3 H 1 2.482 0 . 2 . . . . . 161 ARG HG* . 26016 1 75 . 1 1 7 7 ARG HD2 H 1 2.911 0.004 . 2 . . . . . 161 ARG HD* . 26016 1 76 . 1 1 7 7 ARG HD3 H 1 2.911 0.004 . 2 . . . . . 161 ARG HD* . 26016 1 77 . 1 1 7 7 ARG HE H 1 7.665 0.006 . 1 . . . . . 161 ARG HE . 26016 1 78 . 1 1 7 7 ARG C C 13 173.39 0 . 1 . . . . . 161 ARG C . 26016 1 79 . 1 1 7 7 ARG CA C 13 54.375 0.136 . 1 . . . . . 161 ARG CA . 26016 1 80 . 1 1 7 7 ARG CB C 13 34.455 0.092 . 1 . . . . . 161 ARG CB . 26016 1 81 . 1 1 7 7 ARG CG C 13 33.33 0 . 1 . . . . . 161 ARG CG . 26016 1 82 . 1 1 7 7 ARG CD C 13 42.909 0.162 . 1 . . . . . 161 ARG CD . 26016 1 83 . 1 1 7 7 ARG CZ C 13 159.486 0 . 1 . . . . . 161 ARG CZ . 26016 1 84 . 1 1 7 7 ARG N N 15 114.941 0.026 . 1 . . . . . 161 ARG N . 26016 1 85 . 1 1 7 7 ARG NE N 15 84.314 0.014 . 1 . . . . . 161 ARG NE . 26016 1 86 . 1 1 8 8 ILE H H 1 9.399 0.005 . 1 . . . . . 162 ILE H . 26016 1 87 . 1 1 8 8 ILE HA H 1 5.58 0.015 . 1 . . . . . 162 ILE HA . 26016 1 88 . 1 1 8 8 ILE HB H 1 1.728 0.02 . 1 . . . . . 162 ILE HB . 26016 1 89 . 1 1 8 8 ILE HG12 H 1 2.148 0.012 . 1 . . . . . 162 ILE HG1* . 26016 1 90 . 1 1 8 8 ILE HG13 H 1 2.148 0.012 . 1 . . . . . 162 ILE HG1* . 26016 1 91 . 1 1 8 8 ILE HG21 H 1 0.984 0.013 . 1 . . . . . 162 ILE HG2 . 26016 1 92 . 1 1 8 8 ILE HG22 H 1 0.984 0.013 . 1 . . . . . 162 ILE HG2 . 26016 1 93 . 1 1 8 8 ILE HG23 H 1 0.984 0.013 . 1 . . . . . 162 ILE HG2 . 26016 1 94 . 1 1 8 8 ILE HD11 H 1 0.789 0.012 . 1 . . . . . 162 ILE HD1 . 26016 1 95 . 1 1 8 8 ILE HD12 H 1 0.789 0.012 . 1 . . . . . 162 ILE HD1 . 26016 1 96 . 1 1 8 8 ILE HD13 H 1 0.789 0.012 . 1 . . . . . 162 ILE HD1 . 26016 1 97 . 1 1 8 8 ILE C C 13 170.72 0 . 1 . . . . . 162 ILE C . 26016 1 98 . 1 1 8 8 ILE CA C 13 59.324 0.048 . 1 . . . . . 162 ILE CA . 26016 1 99 . 1 1 8 8 ILE CB C 13 43.789 0.084 . 1 . . . . . 162 ILE CB . 26016 1 100 . 1 1 8 8 ILE CG2 C 13 16.021 0.128 . 1 . . . . . 162 ILE CG2 . 26016 1 101 . 1 1 8 8 ILE CD1 C 13 14.905 0.072 . 1 . . . . . 162 ILE CD1 . 26016 1 102 . 1 1 8 8 ILE N N 15 119.371 0.044 . 1 . . . . . 162 ILE N . 26016 1 103 . 1 1 9 9 TYR H H 1 9.105 0.006 . 1 . . . . . 163 TYR H . 26016 1 104 . 1 1 9 9 TYR HA H 1 4.921 0.008 . 1 . . . . . 163 TYR HA . 26016 1 105 . 1 1 9 9 TYR HB2 H 1 2.641 0.01 . 2 . . . . . 163 TYR HB* . 26016 1 106 . 1 1 9 9 TYR HB3 H 1 2.641 0.01 . 2 . . . . . 163 TYR HB* . 26016 1 107 . 1 1 9 9 TYR HD1 H 1 5.522 0.009 . 3 . . . . . 163 TYR HD* . 26016 1 108 . 1 1 9 9 TYR HD2 H 1 5.522 0.009 . 3 . . . . . 163 TYR HD* . 26016 1 109 . 1 1 9 9 TYR HE1 H 1 6.684 0.014 . 3 . . . . . 163 TYR HE1 . 26016 1 110 . 1 1 9 9 TYR HE2 H 1 6.42 0.008 . 3 . . . . . 163 TYR HE2 . 26016 1 111 . 1 1 9 9 TYR C C 13 174.831 0 . 1 . . . . . 163 TYR C . 26016 1 112 . 1 1 9 9 TYR CA C 13 56.289 0.041 . 1 . . . . . 163 TYR CA . 26016 1 113 . 1 1 9 9 TYR CB C 13 38.132 0.075 . 1 . . . . . 163 TYR CB . 26016 1 114 . 1 1 9 9 TYR CD1 C 13 132.62 0 . 3 . . . . . 163 TYR CD* . 26016 1 115 . 1 1 9 9 TYR CD2 C 13 132.62 0 . 3 . . . . . 163 TYR CD* . 26016 1 116 . 1 1 9 9 TYR CE1 C 13 117.842 0 . 3 . . . . . 163 TYR CE1 . 26016 1 117 . 1 1 9 9 TYR CE2 C 13 116.846 0 . 3 . . . . . 163 TYR CE2 . 26016 1 118 . 1 1 9 9 TYR N N 15 131.603 0.044 . 1 . . . . . 163 TYR N . 26016 1 119 . 1 1 10 10 LEU H H 1 8.125 0.009 . 1 . . . . . 164 LEU H . 26016 1 120 . 1 1 10 10 LEU HA H 1 5.254 0.017 . 1 . . . . . 164 LEU HA . 26016 1 121 . 1 1 10 10 LEU HB2 H 1 1.625 0.012 . 2 . . . . . 164 LEU HB2 . 26016 1 122 . 1 1 10 10 LEU HB3 H 1 1.412 0.014 . 2 . . . . . 164 LEU HB3 . 26016 1 123 . 1 1 10 10 LEU HG H 1 1.681 0.015 . 1 . . . . . 164 LEU HG . 26016 1 124 . 1 1 10 10 LEU HD11 H 1 0.823 0.011 . 2 . . . . . 164 LEU HD1 . 26016 1 125 . 1 1 10 10 LEU HD12 H 1 0.823 0.011 . 2 . . . . . 164 LEU HD1 . 26016 1 126 . 1 1 10 10 LEU HD13 H 1 0.823 0.011 . 2 . . . . . 164 LEU HD1 . 26016 1 127 . 1 1 10 10 LEU HD21 H 1 0.578 0.012 . 2 . . . . . 164 LEU HD2 . 26016 1 128 . 1 1 10 10 LEU HD22 H 1 0.578 0.012 . 2 . . . . . 164 LEU HD2 . 26016 1 129 . 1 1 10 10 LEU HD23 H 1 0.578 0.012 . 2 . . . . . 164 LEU HD2 . 26016 1 130 . 1 1 10 10 LEU C C 13 174.358 0 . 1 . . . . . 164 LEU C . 26016 1 131 . 1 1 10 10 LEU CA C 13 52.778 0.032 . 1 . . . . . 164 LEU CA . 26016 1 132 . 1 1 10 10 LEU CB C 13 47.489 0.053 . 1 . . . . . 164 LEU CB . 26016 1 133 . 1 1 10 10 LEU CG C 13 26.313 0.123 . 1 . . . . . 164 LEU CG . 26016 1 134 . 1 1 10 10 LEU CD1 C 13 26.869 0.045 . 1 . . . . . 164 LEU CD1 . 26016 1 135 . 1 1 10 10 LEU CD2 C 13 26.582 0.025 . 1 . . . . . 164 LEU CD2 . 26016 1 136 . 1 1 10 10 LEU N N 15 126.243 0.048 . 1 . . . . . 164 LEU N . 26016 1 137 . 1 1 11 11 LYS H H 1 8.297 0.005 . 1 . . . . . 165 LYS H . 26016 1 138 . 1 1 11 11 LYS HA H 1 4.956 0.009 . 1 . . . . . 165 LYS HA . 26016 1 139 . 1 1 11 11 LYS HB2 H 1 1.882 0.011 . 2 . . . . . 165 LYS HB2 . 26016 1 140 . 1 1 11 11 LYS HB3 H 1 1.661 0.009 . 2 . . . . . 165 LYS HB3 . 26016 1 141 . 1 1 11 11 LYS HG2 H 1 1.483 0.003 . 2 . . . . . 165 LYS HG* . 26016 1 142 . 1 1 11 11 LYS HG3 H 1 1.483 0.003 . 2 . . . . . 165 LYS HG* . 26016 1 143 . 1 1 11 11 LYS HD2 H 1 1.684 0 . 2 . . . . . 165 LYS HD2 . 26016 1 144 . 1 1 11 11 LYS HE2 H 1 2.978 0.017 . 2 . . . . . 165 LYS HE* . 26016 1 145 . 1 1 11 11 LYS HE3 H 1 2.978 0.017 . 2 . . . . . 165 LYS HE* . 26016 1 146 . 1 1 11 11 LYS C C 13 175.272 0 . 1 . . . . . 165 LYS C . 26016 1 147 . 1 1 11 11 LYS CA C 13 54.985 0.099 . 1 . . . . . 165 LYS CA . 26016 1 148 . 1 1 11 11 LYS CB C 13 36.346 0.094 . 1 . . . . . 165 LYS CB . 26016 1 149 . 1 1 11 11 LYS CG C 13 25.158 0 . 1 . . . . . 165 LYS CG . 26016 1 150 . 1 1 11 11 LYS CD C 13 29.471 0 . 1 . . . . . 165 LYS CD . 26016 1 151 . 1 1 11 11 LYS CE C 13 42.05 0 . 1 . . . . . 165 LYS CE . 26016 1 152 . 1 1 11 11 LYS N N 15 116.213 0.04 . 1 . . . . . 165 LYS N . 26016 1 153 . 1 1 12 12 ALA H H 1 8.888 0.003 . 1 . . . . . 166 ALA H . 26016 1 154 . 1 1 12 12 ALA HA H 1 5.461 0.01 . 1 . . . . . 166 ALA HA . 26016 1 155 . 1 1 12 12 ALA HB1 H 1 0.796 0.01 . 1 . . . . . 166 ALA HB . 26016 1 156 . 1 1 12 12 ALA HB2 H 1 0.796 0.01 . 1 . . . . . 166 ALA HB . 26016 1 157 . 1 1 12 12 ALA HB3 H 1 0.796 0.01 . 1 . . . . . 166 ALA HB . 26016 1 158 . 1 1 12 12 ALA C C 13 174.137 0 . 1 . . . . . 166 ALA C . 26016 1 159 . 1 1 12 12 ALA CA C 13 51.332 0.066 . 1 . . . . . 166 ALA CA . 26016 1 160 . 1 1 12 12 ALA CB C 13 21.655 0.063 . 1 . . . . . 166 ALA CB . 26016 1 161 . 1 1 12 12 ALA N N 15 125.758 0.072 . 1 . . . . . 166 ALA N . 26016 1 162 . 1 1 13 13 GLU H H 1 8.65 0.003 . 1 . . . . . 167 GLU H . 26016 1 163 . 1 1 13 13 GLU HA H 1 4.767 0.012 . 1 . . . . . 167 GLU HA . 26016 1 164 . 1 1 13 13 GLU HB2 H 1 2.059 0.018 . 2 . . . . . 167 GLU HB* . 26016 1 165 . 1 1 13 13 GLU HB3 H 1 2.059 0.018 . 2 . . . . . 167 GLU HB* . 26016 1 166 . 1 1 13 13 GLU HG2 H 1 2.161 0.019 . 2 . . . . . 167 GLU HG* . 26016 1 167 . 1 1 13 13 GLU HG3 H 1 2.161 0.019 . 2 . . . . . 167 GLU HG* . 26016 1 168 . 1 1 13 13 GLU C C 13 173.631 0 . 1 . . . . . 167 GLU C . 26016 1 169 . 1 1 13 13 GLU CA C 13 54.498 0.067 . 1 . . . . . 167 GLU CA . 26016 1 170 . 1 1 13 13 GLU CB C 13 33.364 0 . 1 . . . . . 167 GLU CB . 26016 1 171 . 1 1 13 13 GLU CG C 13 34.762 0.119 . 1 . . . . . 167 GLU CG . 26016 1 172 . 1 1 13 13 GLU N N 15 119.087 0.047 . 1 . . . . . 167 GLU N . 26016 1 173 . 1 1 14 14 VAL H H 1 9.508 0.008 . 1 . . . . . 168 VAL H . 26016 1 174 . 1 1 14 14 VAL HA H 1 5.034 0.007 . 1 . . . . . 168 VAL HA . 26016 1 175 . 1 1 14 14 VAL HB H 1 1.803 0.013 . 1 . . . . . 168 VAL HB . 26016 1 176 . 1 1 14 14 VAL HG11 H 1 0.678 0.007 . 2 . . . . . 168 VAL HG1 . 26016 1 177 . 1 1 14 14 VAL HG12 H 1 0.678 0.007 . 2 . . . . . 168 VAL HG1 . 26016 1 178 . 1 1 14 14 VAL HG13 H 1 0.678 0.007 . 2 . . . . . 168 VAL HG1 . 26016 1 179 . 1 1 14 14 VAL C C 13 175.991 0 . 1 . . . . . 168 VAL C . 26016 1 180 . 1 1 14 14 VAL CA C 13 61.197 0.114 . 1 . . . . . 168 VAL CA . 26016 1 181 . 1 1 14 14 VAL CB C 13 33.045 0.095 . 1 . . . . . 168 VAL CB . 26016 1 182 . 1 1 14 14 VAL CG1 C 13 21.57 0.176 . 2 . . . . . 168 VAL CG1 . 26016 1 183 . 1 1 14 14 VAL CG2 C 13 21.57 0.176 . 2 . . . . . 168 VAL CG2 . 26016 1 184 . 1 1 14 14 VAL N N 15 125.054 0.04 . 1 . . . . . 168 VAL N . 26016 1 185 . 1 1 15 15 THR H H 1 8.842 0.004 . 1 . . . . . 169 THR H . 26016 1 186 . 1 1 15 15 THR HA H 1 4.525 0.008 . 1 . . . . . 169 THR HA . 26016 1 187 . 1 1 15 15 THR HB H 1 4.03 0.005 . 1 . . . . . 169 THR HB . 26016 1 188 . 1 1 15 15 THR HG21 H 1 1.169 0.007 . 1 . . . . . 169 THR HG2 . 26016 1 189 . 1 1 15 15 THR HG22 H 1 1.169 0.007 . 1 . . . . . 169 THR HG2 . 26016 1 190 . 1 1 15 15 THR HG23 H 1 1.169 0.007 . 1 . . . . . 169 THR HG2 . 26016 1 191 . 1 1 15 15 THR C C 13 174.323 0 . 1 . . . . . 169 THR C . 26016 1 192 . 1 1 15 15 THR CA C 13 60.898 0.08 . 1 . . . . . 169 THR CA . 26016 1 193 . 1 1 15 15 THR CB C 13 70.986 0.127 . 1 . . . . . 169 THR CB . 26016 1 194 . 1 1 15 15 THR CG2 C 13 21.623 0.091 . 1 . . . . . 169 THR CG2 . 26016 1 195 . 1 1 15 15 THR N N 15 122.59 0.028 . 1 . . . . . 169 THR N . 26016 1 196 . 1 1 16 16 ASP H H 1 9.417 0.009 . 1 . . . . . 170 ASP H . 26016 1 197 . 1 1 16 16 ASP HA H 1 4.251 0.008 . 1 . . . . . 170 ASP HA . 26016 1 198 . 1 1 16 16 ASP HB2 H 1 2.892 0.012 . 2 . . . . . 170 ASP HB2 . 26016 1 199 . 1 1 16 16 ASP HB3 H 1 2.65 0.013 . 2 . . . . . 170 ASP HB3 . 26016 1 200 . 1 1 16 16 ASP CA C 13 55.928 0.125 . 1 . . . . . 170 ASP CA . 26016 1 201 . 1 1 16 16 ASP CB C 13 39.616 0.066 . 1 . . . . . 170 ASP CB . 26016 1 202 . 1 1 16 16 ASP N N 15 127.664 0.078 . 1 . . . . . 170 ASP N . 26016 1 203 . 1 1 17 17 GLU H H 1 8.734 0.003 . 1 . . . . . 171 GLU H . 26016 1 204 . 1 1 17 17 GLU HA H 1 3.741 0.008 . 1 . . . . . 171 GLU HA . 26016 1 205 . 1 1 17 17 GLU HB2 H 1 2.33 0.02 . 2 . . . . . 171 GLU HB2 . 26016 1 206 . 1 1 17 17 GLU HB3 H 1 2.224 0.012 . 2 . . . . . 171 GLU HB3 . 26016 1 207 . 1 1 17 17 GLU HG2 H 1 2.159 0.008 . 2 . . . . . 171 GLU HG* . 26016 1 208 . 1 1 17 17 GLU HG3 H 1 2.159 0.008 . 2 . . . . . 171 GLU HG* . 26016 1 209 . 1 1 17 17 GLU C C 13 174.302 0 . 1 . . . . . 171 GLU C . 26016 1 210 . 1 1 17 17 GLU CA C 13 57.416 0.125 . 1 . . . . . 171 GLU CA . 26016 1 211 . 1 1 17 17 GLU CB C 13 27.529 0.183 . 1 . . . . . 171 GLU CB . 26016 1 212 . 1 1 17 17 GLU CG C 13 36.803 0.072 . 1 . . . . . 171 GLU CG . 26016 1 213 . 1 1 17 17 GLU N N 15 111.445 0.095 . 1 . . . . . 171 GLU N . 26016 1 214 . 1 1 18 18 LYS H H 1 7.9 0.003 . 1 . . . . . 172 LYS H . 26016 1 215 . 1 1 18 18 LYS HA H 1 4.916 0.012 . 1 . . . . . 172 LYS HA . 26016 1 216 . 1 1 18 18 LYS HB2 H 1 1.798 0.021 . 2 . . . . . 172 LYS HB2 . 26016 1 217 . 1 1 18 18 LYS HB3 H 1 1.183 0.014 . 2 . . . . . 172 LYS HB3 . 26016 1 218 . 1 1 18 18 LYS HG2 H 1 1.516 0.013 . 2 . . . . . 172 LYS HG2 . 26016 1 219 . 1 1 18 18 LYS HG3 H 1 1.228 0.018 . 2 . . . . . 172 LYS HG3 . 26016 1 220 . 1 1 18 18 LYS HD2 H 1 1.649 0.003 . 2 . . . . . 172 LYS HD2 . 26016 1 221 . 1 1 18 18 LYS HD3 H 1 1.611 0.008 . 2 . . . . . 172 LYS HD3 . 26016 1 222 . 1 1 18 18 LYS HE2 H 1 3.009 0.009 . 2 . . . . . 172 LYS HE* . 26016 1 223 . 1 1 18 18 LYS HE3 H 1 3.009 0.009 . 2 . . . . . 172 LYS HE* . 26016 1 224 . 1 1 18 18 LYS C C 13 173.734 0 . 1 . . . . . 172 LYS C . 26016 1 225 . 1 1 18 18 LYS CA C 13 55.084 0.119 . 1 . . . . . 172 LYS CA . 26016 1 226 . 1 1 18 18 LYS CB C 13 35.388 0.123 . 1 . . . . . 172 LYS CB . 26016 1 227 . 1 1 18 18 LYS CG C 13 25.247 0 . 1 . . . . . 172 LYS CG . 26016 1 228 . 1 1 18 18 LYS CD C 13 29.174 0 . 1 . . . . . 172 LYS CD . 26016 1 229 . 1 1 18 18 LYS CE C 13 42.253 0 . 1 . . . . . 172 LYS CE . 26016 1 230 . 1 1 18 18 LYS N N 15 117.825 0.031 . 1 . . . . . 172 LYS N . 26016 1 231 . 1 1 19 19 LEU H H 1 8.971 0.008 . 1 . . . . . 173 LEU H . 26016 1 232 . 1 1 19 19 LEU HA H 1 4.921 0.014 . 1 . . . . . 173 LEU HA . 26016 1 233 . 1 1 19 19 LEU HB2 H 1 1.971 0.023 . 2 . . . . . 173 LEU HB2 . 26016 1 234 . 1 1 19 19 LEU HB3 H 1 1.323 0.015 . 2 . . . . . 173 LEU HB3 . 26016 1 235 . 1 1 19 19 LEU HG H 1 1.477 0.01 . 1 . . . . . 173 LEU HG . 26016 1 236 . 1 1 19 19 LEU HD11 H 1 0.626 0.014 . 2 . . . . . 173 LEU HD1 . 26016 1 237 . 1 1 19 19 LEU HD12 H 1 0.626 0.014 . 2 . . . . . 173 LEU HD1 . 26016 1 238 . 1 1 19 19 LEU HD13 H 1 0.626 0.014 . 2 . . . . . 173 LEU HD1 . 26016 1 239 . 1 1 19 19 LEU HD21 H 1 0.518 0.015 . 2 . . . . . 173 LEU HD2 . 26016 1 240 . 1 1 19 19 LEU HD22 H 1 0.518 0.015 . 2 . . . . . 173 LEU HD2 . 26016 1 241 . 1 1 19 19 LEU HD23 H 1 0.518 0.015 . 2 . . . . . 173 LEU HD2 . 26016 1 242 . 1 1 19 19 LEU C C 13 174.579 0 . 1 . . . . . 173 LEU C . 26016 1 243 . 1 1 19 19 LEU CA C 13 53.56 0.059 . 1 . . . . . 173 LEU CA . 26016 1 244 . 1 1 19 19 LEU CB C 13 44.214 0.071 . 1 . . . . . 173 LEU CB . 26016 1 245 . 1 1 19 19 LEU CG C 13 27.902 0.067 . 1 . . . . . 173 LEU CG . 26016 1 246 . 1 1 19 19 LEU CD1 C 13 24.821 0.129 . 2 . . . . . 173 LEU CD1 . 26016 1 247 . 1 1 19 19 LEU CD2 C 13 26.675 0.062 . 2 . . . . . 173 LEU CD2 . 26016 1 248 . 1 1 19 19 LEU N N 15 124.479 0.103 . 1 . . . . . 173 LEU N . 26016 1 249 . 1 1 20 20 HIS H H 1 9.433 0.005 . 1 . . . . . 174 HIS H . 26016 1 250 . 1 1 20 20 HIS HA H 1 5.528 0.014 . 1 . . . . . 174 HIS HA . 26016 1 251 . 1 1 20 20 HIS HB2 H 1 3.269 0.029 . 2 . . . . . 174 HIS HB2 . 26016 1 252 . 1 1 20 20 HIS HB3 H 1 3.126 0.027 . 2 . . . . . 174 HIS HB3 . 26016 1 253 . 1 1 20 20 HIS HD2 H 1 7.151 0 . 1 . . . . . 174 HIS HD2 . 26016 1 254 . 1 1 20 20 HIS HE1 H 1 8.534 0 . 1 . . . . . 174 HIS HE1 . 26016 1 255 . 1 1 20 20 HIS C C 13 174.46 0 . 1 . . . . . 174 HIS C . 26016 1 256 . 1 1 20 20 HIS CA C 13 54.666 0.12 . 1 . . . . . 174 HIS CA . 26016 1 257 . 1 1 20 20 HIS CB C 13 30.79 0.254 . 1 . . . . . 174 HIS CB . 26016 1 258 . 1 1 20 20 HIS CE1 C 13 136.134 0 . 1 . . . . . 174 HIS CE1 . 26016 1 259 . 1 1 20 20 HIS N N 15 127.605 0.075 . 1 . . . . . 174 HIS N . 26016 1 260 . 1 1 21 21 VAL H H 1 9.254 0.005 . 1 . . . . . 175 VAL H . 26016 1 261 . 1 1 21 21 VAL HA H 1 5.217 0.009 . 1 . . . . . 175 VAL HA . 26016 1 262 . 1 1 21 21 VAL HB H 1 1.976 0.009 . 1 . . . . . 175 VAL HB . 26016 1 263 . 1 1 21 21 VAL HG11 H 1 0.908 0.011 . 2 . . . . . 175 VAL HG1 . 26016 1 264 . 1 1 21 21 VAL HG12 H 1 0.908 0.011 . 2 . . . . . 175 VAL HG1 . 26016 1 265 . 1 1 21 21 VAL HG13 H 1 0.908 0.011 . 2 . . . . . 175 VAL HG1 . 26016 1 266 . 1 1 21 21 VAL HG21 H 1 0.872 0.011 . 2 . . . . . 175 VAL HG2 . 26016 1 267 . 1 1 21 21 VAL HG22 H 1 0.872 0.011 . 2 . . . . . 175 VAL HG2 . 26016 1 268 . 1 1 21 21 VAL HG23 H 1 0.872 0.011 . 2 . . . . . 175 VAL HG2 . 26016 1 269 . 1 1 21 21 VAL C C 13 174.908 0 . 1 . . . . . 175 VAL C . 26016 1 270 . 1 1 21 21 VAL CA C 13 60.043 0.088 . 1 . . . . . 175 VAL CA . 26016 1 271 . 1 1 21 21 VAL CB C 13 35.666 0.053 . 1 . . . . . 175 VAL CB . 26016 1 272 . 1 1 21 21 VAL CG1 C 13 21.379 0.112 . 2 . . . . . 175 VAL CG1 . 26016 1 273 . 1 1 21 21 VAL CG2 C 13 21.379 0.112 . 2 . . . . . 175 VAL CG2 . 26016 1 274 . 1 1 21 21 VAL N N 15 124.647 0.036 . 1 . . . . . 175 VAL N . 26016 1 275 . 1 1 22 22 THR H H 1 9.694 0.005 . 1 . . . . . 176 THR H . 26016 1 276 . 1 1 22 22 THR HA H 1 5.037 0.009 . 1 . . . . . 176 THR HA . 26016 1 277 . 1 1 22 22 THR HB H 1 3.904 0.008 . 1 . . . . . 176 THR HB . 26016 1 278 . 1 1 22 22 THR HG21 H 1 1.068 0.01 . 1 . . . . . 176 THR HG2 . 26016 1 279 . 1 1 22 22 THR HG22 H 1 1.068 0.01 . 1 . . . . . 176 THR HG2 . 26016 1 280 . 1 1 22 22 THR HG23 H 1 1.068 0.01 . 1 . . . . . 176 THR HG2 . 26016 1 281 . 1 1 22 22 THR C C 13 173.384 0 . 1 . . . . . 176 THR C . 26016 1 282 . 1 1 22 22 THR CA C 13 62.307 0.082 . 1 . . . . . 176 THR CA . 26016 1 283 . 1 1 22 22 THR CB C 13 71.263 0.124 . 1 . . . . . 176 THR CB . 26016 1 284 . 1 1 22 22 THR CG2 C 13 20.713 0.085 . 1 . . . . . 176 THR CG2 . 26016 1 285 . 1 1 22 22 THR N N 15 125.025 0.128 . 1 . . . . . 176 THR N . 26016 1 286 . 1 1 23 23 VAL H H 1 9.426 0.006 . 1 . . . . . 177 VAL H . 26016 1 287 . 1 1 23 23 VAL HA H 1 4.263 0.005 . 1 . . . . . 177 VAL HA . 26016 1 288 . 1 1 23 23 VAL HB H 1 2.155 0.012 . 1 . . . . . 177 VAL HB . 26016 1 289 . 1 1 23 23 VAL HG11 H 1 0.801 0.01 . 2 . . . . . 177 VAL HG1 . 26016 1 290 . 1 1 23 23 VAL HG12 H 1 0.801 0.01 . 2 . . . . . 177 VAL HG1 . 26016 1 291 . 1 1 23 23 VAL HG13 H 1 0.801 0.01 . 2 . . . . . 177 VAL HG1 . 26016 1 292 . 1 1 23 23 VAL HG21 H 1 0.788 0.009 . 2 . . . . . 177 VAL HG2 . 26016 1 293 . 1 1 23 23 VAL HG22 H 1 0.788 0.009 . 2 . . . . . 177 VAL HG2 . 26016 1 294 . 1 1 23 23 VAL HG23 H 1 0.788 0.009 . 2 . . . . . 177 VAL HG2 . 26016 1 295 . 1 1 23 23 VAL C C 13 174.182 0 . 1 . . . . . 177 VAL C . 26016 1 296 . 1 1 23 23 VAL CA C 13 61.42 0.158 . 1 . . . . . 177 VAL CA . 26016 1 297 . 1 1 23 23 VAL CB C 13 32.435 0.049 . 1 . . . . . 177 VAL CB . 26016 1 298 . 1 1 23 23 VAL CG1 C 13 22.58 0.333 . 2 . . . . . 177 VAL CG1 . 26016 1 299 . 1 1 23 23 VAL CG2 C 13 22.58 0.333 . 2 . . . . . 177 VAL CG2 . 26016 1 300 . 1 1 23 23 VAL N N 15 126.893 0.061 . 1 . . . . . 177 VAL N . 26016 1 301 . 1 1 24 24 ARG H H 1 8.395 0.005 . 1 . . . . . 178 ARG H . 26016 1 302 . 1 1 24 24 ARG HA H 1 4.552 0.008 . 1 . . . . . 178 ARG HA . 26016 1 303 . 1 1 24 24 ARG HB2 H 1 2.476 0.018 . 2 . . . . . 178 ARG HB* . 26016 1 304 . 1 1 24 24 ARG HB3 H 1 2.476 0.018 . 2 . . . . . 178 ARG HB* . 26016 1 305 . 1 1 24 24 ARG HG2 H 1 2.119 0.004 . 2 . . . . . 178 ARG HG2 . 26016 1 306 . 1 1 24 24 ARG HG3 H 1 1.988 0.008 . 2 . . . . . 178 ARG HG3 . 26016 1 307 . 1 1 24 24 ARG HD2 H 1 2.909 0.008 . 2 . . . . . 178 ARG HD* . 26016 1 308 . 1 1 24 24 ARG HD3 H 1 2.909 0.008 . 2 . . . . . 178 ARG HD* . 26016 1 309 . 1 1 24 24 ARG HE H 1 7.238 0.005 . 1 . . . . . 178 ARG HE . 26016 1 310 . 1 1 24 24 ARG C C 13 173.829 0 . 1 . . . . . 178 ARG C . 26016 1 311 . 1 1 24 24 ARG CA C 13 59.19 0.167 . 1 . . . . . 178 ARG CA . 26016 1 312 . 1 1 24 24 ARG CB C 13 32.797 0.007 . 1 . . . . . 178 ARG CB . 26016 1 313 . 1 1 24 24 ARG CG C 13 27.11 0.132 . 1 . . . . . 178 ARG CG . 26016 1 314 . 1 1 24 24 ARG CD C 13 42.712 0.07 . 1 . . . . . 178 ARG CD . 26016 1 315 . 1 1 24 24 ARG CZ C 13 158.856 0 . 1 . . . . . 178 ARG CZ . 26016 1 316 . 1 1 24 24 ARG N N 15 128.305 0.038 . 1 . . . . . 178 ARG N . 26016 1 317 . 1 1 24 24 ARG NE N 15 84.233 0.027 . 1 . . . . . 178 ARG NE . 26016 1 318 . 1 1 25 25 ASP H H 1 8.267 0.004 . 1 . . . . . 179 ASP H . 26016 1 319 . 1 1 25 25 ASP HA H 1 5.257 0.018 . 1 . . . . . 179 ASP HA . 26016 1 320 . 1 1 25 25 ASP HB2 H 1 3.127 0.011 . 2 . . . . . 179 ASP HB2 . 26016 1 321 . 1 1 25 25 ASP HB3 H 1 2.81 0.017 . 2 . . . . . 179 ASP HB3 . 26016 1 322 . 1 1 25 25 ASP C C 13 171.669 0 . 1 . . . . . 179 ASP C . 26016 1 323 . 1 1 25 25 ASP CA C 13 52.491 0.171 . 1 . . . . . 179 ASP CA . 26016 1 324 . 1 1 25 25 ASP CB C 13 43.232 0.094 . 1 . . . . . 179 ASP CB . 26016 1 325 . 1 1 25 25 ASP N N 15 116.531 0.048 . 1 . . . . . 179 ASP N . 26016 1 326 . 1 1 26 26 ALA H H 1 8.667 0.005 . 1 . . . . . 180 ALA H . 26016 1 327 . 1 1 26 26 ALA HA H 1 5.737 0.013 . 1 . . . . . 180 ALA HA . 26016 1 328 . 1 1 26 26 ALA HB1 H 1 1.68 0.009 . 1 . . . . . 180 ALA HB . 26016 1 329 . 1 1 26 26 ALA HB2 H 1 1.68 0.009 . 1 . . . . . 180 ALA HB . 26016 1 330 . 1 1 26 26 ALA HB3 H 1 1.68 0.009 . 1 . . . . . 180 ALA HB . 26016 1 331 . 1 1 26 26 ALA C C 13 175.522 0 . 1 . . . . . 180 ALA C . 26016 1 332 . 1 1 26 26 ALA CA C 13 51.234 0.06 . 1 . . . . . 180 ALA CA . 26016 1 333 . 1 1 26 26 ALA CB C 13 23.93 0.088 . 1 . . . . . 180 ALA CB . 26016 1 334 . 1 1 26 26 ALA N N 15 118.152 0.074 . 1 . . . . . 180 ALA N . 26016 1 335 . 1 1 27 27 LYS H H 1 8.867 0.004 . 1 . . . . . 181 LYS H . 26016 1 336 . 1 1 27 27 LYS HA H 1 5.398 0.015 . 1 . . . . . 181 LYS HA . 26016 1 337 . 1 1 27 27 LYS HB2 H 1 1.649 0.008 . 2 . . . . . 181 LYS HB2 . 26016 1 338 . 1 1 27 27 LYS HB3 H 1 1.294 0.012 . 2 . . . . . 181 LYS HB3 . 26016 1 339 . 1 1 27 27 LYS HG2 H 1 1.389 0.015 . 2 . . . . . 181 LYS HG2 . 26016 1 340 . 1 1 27 27 LYS HG3 H 1 1.319 0.01 . 2 . . . . . 181 LYS HG3 . 26016 1 341 . 1 1 27 27 LYS HD2 H 1 1.375 0.017 . 2 . . . . . 181 LYS HD* . 26016 1 342 . 1 1 27 27 LYS HD3 H 1 1.375 0.017 . 2 . . . . . 181 LYS HD* . 26016 1 343 . 1 1 27 27 LYS HE2 H 1 2.884 0.022 . 2 . . . . . 181 LYS HE2 . 26016 1 344 . 1 1 27 27 LYS HE3 H 1 2.802 0.022 . 2 . . . . . 181 LYS HE3 . 26016 1 345 . 1 1 27 27 LYS C C 13 175.094 0 . 1 . . . . . 181 LYS C . 26016 1 346 . 1 1 27 27 LYS CA C 13 54.452 0.072 . 1 . . . . . 181 LYS CA . 26016 1 347 . 1 1 27 27 LYS CB C 13 38.312 0.072 . 1 . . . . . 181 LYS CB . 26016 1 348 . 1 1 27 27 LYS CG C 13 25.308 0.02 . 1 . . . . . 181 LYS CG . 26016 1 349 . 1 1 27 27 LYS CD C 13 29.476 0.043 . 1 . . . . . 181 LYS CD . 26016 1 350 . 1 1 27 27 LYS CE C 13 41.827 0.134 . 1 . . . . . 181 LYS CE . 26016 1 351 . 1 1 27 27 LYS N N 15 116.323 0.029 . 1 . . . . . 181 LYS N . 26016 1 352 . 1 1 28 28 ASN H H 1 8.45 0.003 . 1 . . . . . 182 ASN H . 26016 1 353 . 1 1 28 28 ASN HA H 1 4.256 0.033 . 1 . . . . . 182 ASN HA . 26016 1 354 . 1 1 28 28 ASN HB2 H 1 2.35 0 . 2 . . . . . 182 ASN HB* . 26016 1 355 . 1 1 28 28 ASN HB3 H 1 2.35 0 . 2 . . . . . 182 ASN HB* . 26016 1 356 . 1 1 28 28 ASN HD21 H 1 7.577 0.003 . 2 . . . . . 182 ASN HD21 . 26016 1 357 . 1 1 28 28 ASN HD22 H 1 7.276 0.004 . 2 . . . . . 182 ASN HD22 . 26016 1 358 . 1 1 28 28 ASN C C 13 173.581 0 . 1 . . . . . 182 ASN C . 26016 1 359 . 1 1 28 28 ASN CA C 13 54.073 0.304 . 1 . . . . . 182 ASN CA . 26016 1 360 . 1 1 28 28 ASN CB C 13 36.577 0.028 . 1 . . . . . 182 ASN CB . 26016 1 361 . 1 1 28 28 ASN CG C 13 175.434 0 . 1 . . . . . 182 ASN CG . 26016 1 362 . 1 1 28 28 ASN N N 15 114.556 0.072 . 1 . . . . . 182 ASN N . 26016 1 363 . 1 1 28 28 ASN ND2 N 15 117.727 0.083 . 1 . . . . . 182 ASN ND2 . 26016 1 364 . 1 1 29 29 LEU H H 1 8.006 0.005 . 1 . . . . . 183 LEU H . 26016 1 365 . 1 1 29 29 LEU HA H 1 4.134 0.013 . 1 . . . . . 183 LEU HA . 26016 1 366 . 1 1 29 29 LEU HB2 H 1 1.458 0.01 . 2 . . . . . 183 LEU HB* . 26016 1 367 . 1 1 29 29 LEU HB3 H 1 1.458 0.01 . 2 . . . . . 183 LEU HB* . 26016 1 368 . 1 1 29 29 LEU HG H 1 1.595 0.01 . 1 . . . . . 183 LEU HG . 26016 1 369 . 1 1 29 29 LEU HD11 H 1 0.866 0.018 . 2 . . . . . 183 LEU HD1 . 26016 1 370 . 1 1 29 29 LEU HD12 H 1 0.866 0.018 . 2 . . . . . 183 LEU HD1 . 26016 1 371 . 1 1 29 29 LEU HD13 H 1 0.866 0.018 . 2 . . . . . 183 LEU HD1 . 26016 1 372 . 1 1 29 29 LEU HD21 H 1 0.716 0.014 . 2 . . . . . 183 LEU HD2 . 26016 1 373 . 1 1 29 29 LEU HD22 H 1 0.716 0.014 . 2 . . . . . 183 LEU HD2 . 26016 1 374 . 1 1 29 29 LEU HD23 H 1 0.716 0.014 . 2 . . . . . 183 LEU HD2 . 26016 1 375 . 1 1 29 29 LEU C C 13 175.775 0 . 1 . . . . . 183 LEU C . 26016 1 376 . 1 1 29 29 LEU CA C 13 54.261 0.045 . 1 . . . . . 183 LEU CA . 26016 1 377 . 1 1 29 29 LEU CB C 13 41.491 0.098 . 1 . . . . . 183 LEU CB . 26016 1 378 . 1 1 29 29 LEU CG C 13 26.45 0.11 . 1 . . . . . 183 LEU CG . 26016 1 379 . 1 1 29 29 LEU CD1 C 13 22.936 0.01 . 2 . . . . . 183 LEU CD1 . 26016 1 380 . 1 1 29 29 LEU CD2 C 13 27.252 0.119 . 2 . . . . . 183 LEU CD2 . 26016 1 381 . 1 1 29 29 LEU N N 15 113.641 0.095 . 1 . . . . . 183 LEU N . 26016 1 382 . 1 1 30 30 ILE H H 1 7.844 0.007 . 1 . . . . . 184 ILE H . 26016 1 383 . 1 1 30 30 ILE HA H 1 4.447 0.007 . 1 . . . . . 184 ILE HA . 26016 1 384 . 1 1 30 30 ILE HB H 1 1.78 0.01 . 1 . . . . . 184 ILE HB . 26016 1 385 . 1 1 30 30 ILE HG12 H 1 1.607 0.007 . 2 . . . . . 184 ILE HG12 . 26016 1 386 . 1 1 30 30 ILE HG13 H 1 1.216 0.01 . 2 . . . . . 184 ILE HG13 . 26016 1 387 . 1 1 30 30 ILE HG21 H 1 0.978 0.013 . 1 . . . . . 184 ILE HG2 . 26016 1 388 . 1 1 30 30 ILE HG22 H 1 0.978 0.013 . 1 . . . . . 184 ILE HG2 . 26016 1 389 . 1 1 30 30 ILE HG23 H 1 0.978 0.013 . 1 . . . . . 184 ILE HG2 . 26016 1 390 . 1 1 30 30 ILE HD11 H 1 0.884 0.013 . 1 . . . . . 184 ILE HD1 . 26016 1 391 . 1 1 30 30 ILE HD12 H 1 0.884 0.013 . 1 . . . . . 184 ILE HD1 . 26016 1 392 . 1 1 30 30 ILE HD13 H 1 0.884 0.013 . 1 . . . . . 184 ILE HD1 . 26016 1 393 . 1 1 30 30 ILE CA C 13 58.767 0.08 . 1 . . . . . 184 ILE CA . 26016 1 394 . 1 1 30 30 ILE CB C 13 39.554 0.111 . 1 . . . . . 184 ILE CB . 26016 1 395 . 1 1 30 30 ILE CG1 C 13 27.612 0.117 . 1 . . . . . 184 ILE CG1 . 26016 1 396 . 1 1 30 30 ILE CG2 C 13 17.872 0.1 . 1 . . . . . 184 ILE CG2 . 26016 1 397 . 1 1 30 30 ILE CD1 C 13 14.187 0.1 . 1 . . . . . 184 ILE CD1 . 26016 1 398 . 1 1 30 30 ILE N N 15 118.248 0.115 . 1 . . . . . 184 ILE N . 26016 1 399 . 1 1 31 31 PRO C C 13 178.082 0 . 1 . . . . . 185 PRO C . 26016 1 400 . 1 1 31 31 PRO CB C 13 36.392 0 . 1 . . . . . 185 PRO CB . 26016 1 401 . 1 1 32 32 MET H H 1 7.984 0.009 . 1 . . . . . 186 MET H . 26016 1 402 . 1 1 32 32 MET HA H 1 4.788 0.005 . 1 . . . . . 186 MET HA . 26016 1 403 . 1 1 32 32 MET HB2 H 1 1.537 0.012 . 2 . . . . . 186 MET HB* . 26016 1 404 . 1 1 32 32 MET HB3 H 1 1.537 0.012 . 2 . . . . . 186 MET HB* . 26016 1 405 . 1 1 32 32 MET HG2 H 1 1.902 0.007 . 2 . . . . . 186 MET HG* . 26016 1 406 . 1 1 32 32 MET HG3 H 1 1.902 0.007 . 2 . . . . . 186 MET HG* . 26016 1 407 . 1 1 32 32 MET HE1 H 1 2.196 0.002 . 1 . . . . . 186 MET HE* . 26016 1 408 . 1 1 32 32 MET HE2 H 1 2.196 0.002 . 1 . . . . . 186 MET HE* . 26016 1 409 . 1 1 32 32 MET HE3 H 1 2.196 0.002 . 1 . . . . . 186 MET HE* . 26016 1 410 . 1 1 32 32 MET C C 13 175.973 0 . 1 . . . . . 186 MET C . 26016 1 411 . 1 1 32 32 MET CA C 13 53.934 0.033 . 1 . . . . . 186 MET CA . 26016 1 412 . 1 1 32 32 MET CB C 13 32.807 0.137 . 1 . . . . . 186 MET CB . 26016 1 413 . 1 1 32 32 MET CE C 13 16.938 0 . 1 . . . . . 186 MET CE . 26016 1 414 . 1 1 32 32 MET N N 15 121.606 0.055 . 1 . . . . . 186 MET N . 26016 1 415 . 1 1 33 33 ASP H H 1 8.228 0.006 . 1 . . . . . 187 ASP H . 26016 1 416 . 1 1 33 33 ASP HA H 1 4.917 0.037 . 1 . . . . . 187 ASP HA . 26016 1 417 . 1 1 33 33 ASP HB2 H 1 2.929 0 . 2 . . . . . 187 ASP HB2 . 26016 1 418 . 1 1 33 33 ASP HB3 H 1 2.752 0.023 . 2 . . . . . 187 ASP HB3 . 26016 1 419 . 1 1 33 33 ASP CA C 13 52.05 0.001 . 1 . . . . . 187 ASP CA . 26016 1 420 . 1 1 33 33 ASP CB C 13 41.935 0 . 1 . . . . . 187 ASP CB . 26016 1 421 . 1 1 33 33 ASP N N 15 123.441 0.118 . 1 . . . . . 187 ASP N . 26016 1 422 . 1 1 34 34 PRO HA H 1 4.388 0.014 . 1 . . . . . 188 PRO HA . 26016 1 423 . 1 1 34 34 PRO HB2 H 1 2.392 0.015 . 2 . . . . . 188 PRO HB2 . 26016 1 424 . 1 1 34 34 PRO HB3 H 1 1.994 0.007 . 2 . . . . . 188 PRO HB3 . 26016 1 425 . 1 1 34 34 PRO C C 13 176.161 0 . 1 . . . . . 188 PRO C . 26016 1 426 . 1 1 34 34 PRO CA C 13 64.976 0.032 . 1 . . . . . 188 PRO CA . 26016 1 427 . 1 1 34 34 PRO CB C 13 31.845 0.114 . 1 . . . . . 188 PRO CB . 26016 1 428 . 1 1 34 34 PRO CG C 13 27.76 0 . 1 . . . . . 188 PRO CG . 26016 1 429 . 1 1 35 35 ASN H H 1 7.632 0.033 . 1 . . . . . 189 ASN H . 26016 1 430 . 1 1 35 35 ASN HA H 1 4.538 0.015 . 1 . . . . . 189 ASN HA . 26016 1 431 . 1 1 35 35 ASN HB2 H 1 2.817 0.014 . 2 . . . . . 189 ASN HB2 . 26016 1 432 . 1 1 35 35 ASN HD21 H 1 7.64 0 . 2 . . . . . 189 ASN HD21 . 26016 1 433 . 1 1 35 35 ASN HD22 H 1 6.793 0.008 . 2 . . . . . 189 ASN HD22 . 26016 1 434 . 1 1 35 35 ASN C C 13 175.953 0 . 1 . . . . . 189 ASN C . 26016 1 435 . 1 1 35 35 ASN CA C 13 52.748 0.051 . 1 . . . . . 189 ASN CA . 26016 1 436 . 1 1 35 35 ASN CB C 13 36.99 0.105 . 1 . . . . . 189 ASN CB . 26016 1 437 . 1 1 35 35 ASN N N 15 114.324 0.102 . 1 . . . . . 189 ASN N . 26016 1 438 . 1 1 35 35 ASN ND2 N 15 112.781 0.035 . 1 . . . . . 189 ASN ND2 . 26016 1 439 . 1 1 36 36 GLY H H 1 8.258 0.004 . 1 . . . . . 190 GLY H . 26016 1 440 . 1 1 36 36 GLY HA2 H 1 4.121 0.01 . 2 . . . . . 190 GLY HA2 . 26016 1 441 . 1 1 36 36 GLY HA3 H 1 3.724 0.007 . 2 . . . . . 190 GLY HA3 . 26016 1 442 . 1 1 36 36 GLY C C 13 172.836 0 . 1 . . . . . 190 GLY C . 26016 1 443 . 1 1 36 36 GLY CA C 13 45.48 0.094 . 1 . . . . . 190 GLY CA . 26016 1 444 . 1 1 36 36 GLY N N 15 107.391 0.047 . 1 . . . . . 190 GLY N . 26016 1 445 . 1 1 37 37 LEU H H 1 7.591 0.006 . 1 . . . . . 191 LEU H . 26016 1 446 . 1 1 37 37 LEU HA H 1 4.705 0.012 . 1 . . . . . 191 LEU HA . 26016 1 447 . 1 1 37 37 LEU HB2 H 1 1.822 0.015 . 2 . . . . . 191 LEU HB2 . 26016 1 448 . 1 1 37 37 LEU HB3 H 1 1.147 0.019 . 2 . . . . . 191 LEU HB3 . 26016 1 449 . 1 1 37 37 LEU HG H 1 1.317 0.011 . 1 . . . . . 191 LEU HG . 26016 1 450 . 1 1 37 37 LEU HD11 H 1 0.838 0.009 . 2 . . . . . 191 LEU HD1 . 26016 1 451 . 1 1 37 37 LEU HD12 H 1 0.838 0.009 . 2 . . . . . 191 LEU HD1 . 26016 1 452 . 1 1 37 37 LEU HD13 H 1 0.838 0.009 . 2 . . . . . 191 LEU HD1 . 26016 1 453 . 1 1 37 37 LEU HD21 H 1 0.808 0.01 . 2 . . . . . 191 LEU HD2 . 26016 1 454 . 1 1 37 37 LEU HD22 H 1 0.808 0.01 . 2 . . . . . 191 LEU HD2 . 26016 1 455 . 1 1 37 37 LEU HD23 H 1 0.808 0.01 . 2 . . . . . 191 LEU HD2 . 26016 1 456 . 1 1 37 37 LEU C C 13 173.111 0 . 1 . . . . . 191 LEU C . 26016 1 457 . 1 1 37 37 LEU CA C 13 52.961 0.1 . 1 . . . . . 191 LEU CA . 26016 1 458 . 1 1 37 37 LEU CB C 13 44.43 0.138 . 1 . . . . . 191 LEU CB . 26016 1 459 . 1 1 37 37 LEU CG C 13 26.673 0.123 . 1 . . . . . 191 LEU CG . 26016 1 460 . 1 1 37 37 LEU CD1 C 13 23.47 0.032 . 2 . . . . . 191 LEU CD1 . 26016 1 461 . 1 1 37 37 LEU CD2 C 13 25.572 0.006 . 2 . . . . . 191 LEU CD2 . 26016 1 462 . 1 1 37 37 LEU N N 15 120.503 0.052 . 1 . . . . . 191 LEU N . 26016 1 463 . 1 1 38 38 SER H H 1 6.874 0.003 . 1 . . . . . 192 SER H . 26016 1 464 . 1 1 38 38 SER HA H 1 4.792 0.025 . 1 . . . . . 192 SER HA . 26016 1 465 . 1 1 38 38 SER HB2 H 1 3.946 0.016 . 2 . . . . . 192 SER HB2 . 26016 1 466 . 1 1 38 38 SER HB3 H 1 3.566 0.007 . 2 . . . . . 192 SER HB3 . 26016 1 467 . 1 1 38 38 SER C C 13 170.78 0 . 1 . . . . . 192 SER C . 26016 1 468 . 1 1 38 38 SER CA C 13 57.415 0.066 . 1 . . . . . 192 SER CA . 26016 1 469 . 1 1 38 38 SER CB C 13 68.452 0.017 . 1 . . . . . 192 SER CB . 26016 1 470 . 1 1 38 38 SER N N 15 112.239 0.043 . 1 . . . . . 192 SER N . 26016 1 471 . 1 1 39 39 ASP H H 1 9.267 0.007 . 1 . . . . . 193 ASP H . 26016 1 472 . 1 1 39 39 ASP HB2 H 1 2.587 0.011 . 2 . . . . . 193 ASP HB2 . 26016 1 473 . 1 1 39 39 ASP HB3 H 1 2.155 0.01 . 2 . . . . . 193 ASP HB3 . 26016 1 474 . 1 1 39 39 ASP CA C 13 51.991 0 . 1 . . . . . 193 ASP CA . 26016 1 475 . 1 1 39 39 ASP CB C 13 43.647 0 . 1 . . . . . 193 ASP CB . 26016 1 476 . 1 1 39 39 ASP N N 15 120.555 0.029 . 1 . . . . . 193 ASP N . 26016 1 477 . 1 1 40 40 PRO HA H 1 5.732 0.009 . 1 . . . . . 194 PRO HA . 26016 1 478 . 1 1 40 40 PRO HB2 H 1 2.142 0.012 . 2 . . . . . 194 PRO HB2 . 26016 1 479 . 1 1 40 40 PRO HB3 H 1 1.986 0.012 . 2 . . . . . 194 PRO HB3 . 26016 1 480 . 1 1 40 40 PRO HG2 H 1 1.791 0.014 . 2 . . . . . 194 PRO HG2 . 26016 1 481 . 1 1 40 40 PRO HG3 H 1 1.489 0.019 . 2 . . . . . 194 PRO HG3 . 26016 1 482 . 1 1 40 40 PRO C C 13 177.364 0 . 1 . . . . . 194 PRO C . 26016 1 483 . 1 1 40 40 PRO CA C 13 63.369 0.173 . 1 . . . . . 194 PRO CA . 26016 1 484 . 1 1 40 40 PRO CB C 13 34.168 0.183 . 1 . . . . . 194 PRO CB . 26016 1 485 . 1 1 40 40 PRO CG C 13 28.298 0.036 . 1 . . . . . 194 PRO CG . 26016 1 486 . 1 1 41 41 TYR H H 1 9.486 0.007 . 1 . . . . . 195 TYR H . 26016 1 487 . 1 1 41 41 TYR HA H 1 4.927 0.015 . 1 . . . . . 195 TYR HA . 26016 1 488 . 1 1 41 41 TYR HB2 H 1 3.11 0.006 . 2 . . . . . 195 TYR HB2 . 26016 1 489 . 1 1 41 41 TYR HB3 H 1 2.714 0.009 . 2 . . . . . 195 TYR HB3 . 26016 1 490 . 1 1 41 41 TYR HD1 H 1 7.108 0.004 . 3 . . . . . 195 TYR HD* . 26016 1 491 . 1 1 41 41 TYR HD2 H 1 7.108 0.004 . 3 . . . . . 195 TYR HD* . 26016 1 492 . 1 1 41 41 TYR HE1 H 1 6.523 0.008 . 3 . . . . . 195 TYR HE* . 26016 1 493 . 1 1 41 41 TYR HE2 H 1 6.523 0.008 . 3 . . . . . 195 TYR HE* . 26016 1 494 . 1 1 41 41 TYR C C 13 171.307 0 . 1 . . . . . 195 TYR C . 26016 1 495 . 1 1 41 41 TYR CA C 13 56.471 0.114 . 1 . . . . . 195 TYR CA . 26016 1 496 . 1 1 41 41 TYR CB C 13 41.995 0.06 . 1 . . . . . 195 TYR CB . 26016 1 497 . 1 1 41 41 TYR CD1 C 13 134.232 0 . 3 . . . . . 195 TYR CD* . 26016 1 498 . 1 1 41 41 TYR CD2 C 13 134.232 0 . 3 . . . . . 195 TYR CD* . 26016 1 499 . 1 1 41 41 TYR CE1 C 13 117.041 0 . 3 . . . . . 195 TYR CE* . 26016 1 500 . 1 1 41 41 TYR CE2 C 13 117.041 0 . 3 . . . . . 195 TYR CE* . 26016 1 501 . 1 1 41 41 TYR N N 15 119.57 0.073 . 1 . . . . . 195 TYR N . 26016 1 502 . 1 1 42 42 VAL H H 1 8.31 0.006 . 1 . . . . . 196 VAL H . 26016 1 503 . 1 1 42 42 VAL HA H 1 4.827 0.008 . 1 . . . . . 196 VAL HA . 26016 1 504 . 1 1 42 42 VAL HB H 1 1.311 0.012 . 1 . . . . . 196 VAL HB . 26016 1 505 . 1 1 42 42 VAL HG11 H 1 0.454 0.01 . 2 . . . . . 196 VAL HG1 . 26016 1 506 . 1 1 42 42 VAL HG12 H 1 0.454 0.01 . 2 . . . . . 196 VAL HG1 . 26016 1 507 . 1 1 42 42 VAL HG13 H 1 0.454 0.01 . 2 . . . . . 196 VAL HG1 . 26016 1 508 . 1 1 42 42 VAL HG21 H 1 -0.415 0.009 . 2 . . . . . 196 VAL HG2 . 26016 1 509 . 1 1 42 42 VAL HG22 H 1 -0.415 0.009 . 2 . . . . . 196 VAL HG2 . 26016 1 510 . 1 1 42 42 VAL HG23 H 1 -0.415 0.009 . 2 . . . . . 196 VAL HG2 . 26016 1 511 . 1 1 42 42 VAL C C 13 174.97 0 . 1 . . . . . 196 VAL C . 26016 1 512 . 1 1 42 42 VAL CA C 13 60.134 0.076 . 1 . . . . . 196 VAL CA . 26016 1 513 . 1 1 42 42 VAL CB C 13 32.743 0.079 . 1 . . . . . 196 VAL CB . 26016 1 514 . 1 1 42 42 VAL CG1 C 13 22.878 0.151 . 2 . . . . . 196 VAL CG1 . 26016 1 515 . 1 1 42 42 VAL CG2 C 13 21.569 0.006 . 2 . . . . . 196 VAL CG2 . 26016 1 516 . 1 1 42 42 VAL N N 15 119.566 0.045 . 1 . . . . . 196 VAL N . 26016 1 517 . 1 1 43 43 LYS H H 1 9.679 0.007 . 1 . . . . . 197 LYS H . 26016 1 518 . 1 1 43 43 LYS HA H 1 4.924 0.011 . 1 . . . . . 197 LYS HA . 26016 1 519 . 1 1 43 43 LYS HB2 H 1 1.921 0.017 . 2 . . . . . 197 LYS HB2 . 26016 1 520 . 1 1 43 43 LYS HB3 H 1 1.679 0.018 . 2 . . . . . 197 LYS HB3 . 26016 1 521 . 1 1 43 43 LYS HG2 H 1 1.321 0.013 . 2 . . . . . 197 LYS HG* . 26016 1 522 . 1 1 43 43 LYS HG3 H 1 1.321 0.013 . 2 . . . . . 197 LYS HG* . 26016 1 523 . 1 1 43 43 LYS C C 13 174.899 0 . 1 . . . . . 197 LYS C . 26016 1 524 . 1 1 43 43 LYS CA C 13 54.939 0.083 . 1 . . . . . 197 LYS CA . 26016 1 525 . 1 1 43 43 LYS CB C 13 36.431 0.123 . 1 . . . . . 197 LYS CB . 26016 1 526 . 1 1 43 43 LYS CG C 13 25.215 0 . 1 . . . . . 197 LYS CG . 26016 1 527 . 1 1 43 43 LYS CD C 13 29.966 0 . 1 . . . . . 197 LYS CD . 26016 1 528 . 1 1 43 43 LYS CE C 13 41.67 0 . 1 . . . . . 197 LYS CE . 26016 1 529 . 1 1 43 43 LYS N N 15 126.071 0.038 . 1 . . . . . 197 LYS N . 26016 1 530 . 1 1 44 44 LEU H H 1 9.06 0.009 . 1 . . . . . 198 LEU H . 26016 1 531 . 1 1 44 44 LEU HA H 1 5.579 0.02 . 1 . . . . . 198 LEU HA . 26016 1 532 . 1 1 44 44 LEU HB2 H 1 1.328 0.011 . 2 . . . . . 198 LEU HB* . 26016 1 533 . 1 1 44 44 LEU HB3 H 1 1.328 0.011 . 2 . . . . . 198 LEU HB* . 26016 1 534 . 1 1 44 44 LEU HG H 1 1.222 0.014 . 1 . . . . . 198 LEU HG . 26016 1 535 . 1 1 44 44 LEU HD11 H 1 0.558 0.012 . 2 . . . . . 198 LEU HD1 . 26016 1 536 . 1 1 44 44 LEU HD12 H 1 0.558 0.012 . 2 . . . . . 198 LEU HD1 . 26016 1 537 . 1 1 44 44 LEU HD13 H 1 0.558 0.012 . 2 . . . . . 198 LEU HD1 . 26016 1 538 . 1 1 44 44 LEU HD21 H 1 0.026 0.008 . 2 . . . . . 198 LEU HD2 . 26016 1 539 . 1 1 44 44 LEU HD22 H 1 0.026 0.008 . 2 . . . . . 198 LEU HD2 . 26016 1 540 . 1 1 44 44 LEU HD23 H 1 0.026 0.008 . 2 . . . . . 198 LEU HD2 . 26016 1 541 . 1 1 44 44 LEU C C 13 175.059 0 . 1 . . . . . 198 LEU C . 26016 1 542 . 1 1 44 44 LEU CA C 13 53.749 0.096 . 1 . . . . . 198 LEU CA . 26016 1 543 . 1 1 44 44 LEU CB C 13 45.708 0.106 . 1 . . . . . 198 LEU CB . 26016 1 544 . 1 1 44 44 LEU CG C 13 27.717 0.308 . 1 . . . . . 198 LEU CG . 26016 1 545 . 1 1 44 44 LEU CD1 C 13 27.021 0.084 . 2 . . . . . 198 LEU CD1 . 26016 1 546 . 1 1 44 44 LEU CD2 C 13 26.192 0.099 . 2 . . . . . 198 LEU CD2 . 26016 1 547 . 1 1 44 44 LEU N N 15 126.363 0.062 . 1 . . . . . 198 LEU N . 26016 1 548 . 1 1 45 45 LYS H H 1 8.405 0.004 . 1 . . . . . 199 LYS H . 26016 1 549 . 1 1 45 45 LYS HA H 1 4.607 0.013 . 1 . . . . . 199 LYS HA . 26016 1 550 . 1 1 45 45 LYS HB2 H 1 1.709 0.016 . 2 . . . . . 199 LYS HB2 . 26016 1 551 . 1 1 45 45 LYS HB3 H 1 1.623 0.01 . 2 . . . . . 199 LYS HB3 . 26016 1 552 . 1 1 45 45 LYS HG3 H 1 1.231 0.007 . 2 . . . . . 199 LYS HG3 . 26016 1 553 . 1 1 45 45 LYS HE2 H 1 2.891 0.003 . 2 . . . . . 199 LYS HE2 . 26016 1 554 . 1 1 45 45 LYS C C 13 174.108 0 . 1 . . . . . 199 LYS C . 26016 1 555 . 1 1 45 45 LYS CA C 13 55.045 0.095 . 1 . . . . . 199 LYS CA . 26016 1 556 . 1 1 45 45 LYS CB C 13 36.98 0.099 . 1 . . . . . 199 LYS CB . 26016 1 557 . 1 1 45 45 LYS CG C 13 24.058 0 . 1 . . . . . 199 LYS CG . 26016 1 558 . 1 1 45 45 LYS CE C 13 42.081 0 . 1 . . . . . 199 LYS CE . 26016 1 559 . 1 1 45 45 LYS N N 15 117.771 0.039 . 1 . . . . . 199 LYS N . 26016 1 560 . 1 1 46 46 LEU H H 1 8.493 0.008 . 1 . . . . . 200 LEU H . 26016 1 561 . 1 1 46 46 LEU HA H 1 5.193 0.012 . 1 . . . . . 200 LEU HA . 26016 1 562 . 1 1 46 46 LEU HB2 H 1 1.568 0.021 . 2 . . . . . 200 LEU HB2 . 26016 1 563 . 1 1 46 46 LEU HB3 H 1 0.826 0.015 . 2 . . . . . 200 LEU HB3 . 26016 1 564 . 1 1 46 46 LEU HG H 1 0.998 0.01 . 1 . . . . . 200 LEU HG . 26016 1 565 . 1 1 46 46 LEU HD11 H 1 0.542 0.01 . 2 . . . . . 200 LEU HD1 . 26016 1 566 . 1 1 46 46 LEU HD12 H 1 0.542 0.01 . 2 . . . . . 200 LEU HD1 . 26016 1 567 . 1 1 46 46 LEU HD13 H 1 0.542 0.01 . 2 . . . . . 200 LEU HD1 . 26016 1 568 . 1 1 46 46 LEU HD21 H 1 0.127 0.004 . 2 . . . . . 200 LEU HD2 . 26016 1 569 . 1 1 46 46 LEU HD22 H 1 0.127 0.004 . 2 . . . . . 200 LEU HD2 . 26016 1 570 . 1 1 46 46 LEU HD23 H 1 0.127 0.004 . 2 . . . . . 200 LEU HD2 . 26016 1 571 . 1 1 46 46 LEU C C 13 175.786 0 . 1 . . . . . 200 LEU C . 26016 1 572 . 1 1 46 46 LEU CA C 13 53.134 0.074 . 1 . . . . . 200 LEU CA . 26016 1 573 . 1 1 46 46 LEU CB C 13 42.143 0.094 . 1 . . . . . 200 LEU CB . 26016 1 574 . 1 1 46 46 LEU CG C 13 26.486 0.219 . 1 . . . . . 200 LEU CG . 26016 1 575 . 1 1 46 46 LEU CD1 C 13 25.83 0.107 . 2 . . . . . 200 LEU CD1 . 26016 1 576 . 1 1 46 46 LEU CD2 C 13 22.972 0.103 . 2 . . . . . 200 LEU CD2 . 26016 1 577 . 1 1 46 46 LEU N N 15 122.022 0.049 . 1 . . . . . 200 LEU N . 26016 1 578 . 1 1 47 47 ILE H H 1 9.143 0.004 . 1 . . . . . 201 ILE H . 26016 1 579 . 1 1 47 47 ILE HA H 1 4.507 0.016 . 1 . . . . . 201 ILE HA . 26016 1 580 . 1 1 47 47 ILE HB H 1 1.871 0.013 . 1 . . . . . 201 ILE HB . 26016 1 581 . 1 1 47 47 ILE HG12 H 1 1.582 0.013 . 2 . . . . . 201 ILE HG1* . 26016 1 582 . 1 1 47 47 ILE HG13 H 1 1.582 0.013 . 2 . . . . . 201 ILE HG1* . 26016 1 583 . 1 1 47 47 ILE HG21 H 1 0.867 0.009 . 1 . . . . . 201 ILE HG2 . 26016 1 584 . 1 1 47 47 ILE HG22 H 1 0.867 0.009 . 1 . . . . . 201 ILE HG2 . 26016 1 585 . 1 1 47 47 ILE HG23 H 1 0.867 0.009 . 1 . . . . . 201 ILE HG2 . 26016 1 586 . 1 1 47 47 ILE HD11 H 1 0.79 0.007 . 1 . . . . . 201 ILE HD1 . 26016 1 587 . 1 1 47 47 ILE HD12 H 1 0.79 0.007 . 1 . . . . . 201 ILE HD1 . 26016 1 588 . 1 1 47 47 ILE HD13 H 1 0.79 0.007 . 1 . . . . . 201 ILE HD1 . 26016 1 589 . 1 1 47 47 ILE CA C 13 58.176 0.152 . 1 . . . . . 201 ILE CA . 26016 1 590 . 1 1 47 47 ILE CB C 13 39.268 0.076 . 1 . . . . . 201 ILE CB . 26016 1 591 . 1 1 47 47 ILE CG2 C 13 19.122 0.034 . 1 . . . . . 201 ILE CG2 . 26016 1 592 . 1 1 47 47 ILE CD1 C 13 13.105 0.039 . 1 . . . . . 201 ILE CD1 . 26016 1 593 . 1 1 47 47 ILE N N 15 114.03 0.044 . 1 . . . . . 201 ILE N . 26016 1 594 . 1 1 48 48 PRO HA H 1 4.525 0.022 . 1 . . . . . 202 PRO HA . 26016 1 595 . 1 1 48 48 PRO HB2 H 1 2.496 0.011 . 2 . . . . . 202 PRO HB2 . 26016 1 596 . 1 1 48 48 PRO HB3 H 1 2.057 0.012 . 2 . . . . . 202 PRO HB3 . 26016 1 597 . 1 1 48 48 PRO HG2 H 1 1.946 0.011 . 2 . . . . . 202 PRO HG* . 26016 1 598 . 1 1 48 48 PRO HG3 H 1 1.946 0.011 . 2 . . . . . 202 PRO HG* . 26016 1 599 . 1 1 48 48 PRO HD2 H 1 3.719 0.014 . 2 . . . . . 202 PRO HD2 . 26016 1 600 . 1 1 48 48 PRO HD3 H 1 3.594 0.012 . 2 . . . . . 202 PRO HD3 . 26016 1 601 . 1 1 48 48 PRO C C 13 176.559 0 . 1 . . . . . 202 PRO C . 26016 1 602 . 1 1 48 48 PRO CA C 13 63.091 0.071 . 1 . . . . . 202 PRO CA . 26016 1 603 . 1 1 48 48 PRO CB C 13 35.135 0.168 . 1 . . . . . 202 PRO CB . 26016 1 604 . 1 1 48 48 PRO CG C 13 25.464 0.099 . 1 . . . . . 202 PRO CG . 26016 1 605 . 1 1 49 49 ASP H H 1 9.295 0.009 . 1 . . . . . 203 ASP H . 26016 1 606 . 1 1 49 49 ASP HA H 1 4.785 0.002 . 1 . . . . . 203 ASP HA . 26016 1 607 . 1 1 49 49 ASP HB2 H 1 2.895 0 . 2 . . . . . 203 ASP HB2 . 26016 1 608 . 1 1 49 49 ASP CA C 13 51.573 0 . 1 . . . . . 203 ASP CA . 26016 1 609 . 1 1 49 49 ASP CB C 13 43.579 0 . 1 . . . . . 203 ASP CB . 26016 1 610 . 1 1 49 49 ASP N N 15 121.459 0.143 . 1 . . . . . 203 ASP N . 26016 1 611 . 1 1 50 50 PRO HA H 1 4.384 0.008 . 1 . . . . . 204 PRO HA . 26016 1 612 . 1 1 50 50 PRO HB2 H 1 2.394 0.007 . 2 . . . . . 204 PRO HB2 . 26016 1 613 . 1 1 50 50 PRO HB3 H 1 2.004 0.011 . 2 . . . . . 204 PRO HB3 . 26016 1 614 . 1 1 50 50 PRO HG2 H 1 2.055 0.012 . 2 . . . . . 204 PRO HG* . 26016 1 615 . 1 1 50 50 PRO HG3 H 1 2.055 0.012 . 2 . . . . . 204 PRO HG* . 26016 1 616 . 1 1 50 50 PRO HD2 H 1 3.978 0.013 . 2 . . . . . 204 PRO HD2 . 26016 1 617 . 1 1 50 50 PRO HD3 H 1 3.448 0.012 . 2 . . . . . 204 PRO HD3 . 26016 1 618 . 1 1 50 50 PRO C C 13 178.117 0 . 1 . . . . . 204 PRO C . 26016 1 619 . 1 1 50 50 PRO CA C 13 65.206 0.187 . 1 . . . . . 204 PRO CA . 26016 1 620 . 1 1 50 50 PRO CB C 13 32.229 0 . 1 . . . . . 204 PRO CB . 26016 1 621 . 1 1 50 50 PRO CG C 13 27.431 0.042 . 1 . . . . . 204 PRO CG . 26016 1 622 . 1 1 50 50 PRO CD C 13 50.439 0.133 . 1 . . . . . 204 PRO CD . 26016 1 623 . 1 1 51 51 LYS H H 1 8.484 0.008 . 1 . . . . . 205 LYS H . 26016 1 624 . 1 1 51 51 LYS HA H 1 4.372 0.004 . 1 . . . . . 205 LYS HA . 26016 1 625 . 1 1 51 51 LYS HB2 H 1 2.016 0.007 . 2 . . . . . 205 LYS HB2 . 26016 1 626 . 1 1 51 51 LYS HG3 H 1 1.394 0.009 . 2 . . . . . 205 LYS HG3 . 26016 1 627 . 1 1 51 51 LYS HD3 H 1 1.676 0.003 . 2 . . . . . 205 LYS HD3 . 26016 1 628 . 1 1 51 51 LYS HE2 H 1 2.959 0.018 . 2 . . . . . 205 LYS HE* . 26016 1 629 . 1 1 51 51 LYS HE3 H 1 2.959 0.018 . 2 . . . . . 205 LYS HE* . 26016 1 630 . 1 1 51 51 LYS C C 13 175.893 0 . 1 . . . . . 205 LYS C . 26016 1 631 . 1 1 51 51 LYS CA C 13 55.687 0.073 . 1 . . . . . 205 LYS CA . 26016 1 632 . 1 1 51 51 LYS CB C 13 31.886 0.031 . 1 . . . . . 205 LYS CB . 26016 1 633 . 1 1 51 51 LYS CG C 13 25.115 0 . 1 . . . . . 205 LYS CG . 26016 1 634 . 1 1 51 51 LYS CD C 13 28.789 0 . 1 . . . . . 205 LYS CD . 26016 1 635 . 1 1 51 51 LYS CE C 13 42.05 0 . 1 . . . . . 205 LYS CE . 26016 1 636 . 1 1 51 51 LYS N N 15 114.983 0.036 . 1 . . . . . 205 LYS N . 26016 1 637 . 1 1 52 52 ASN H H 1 8.121 0.004 . 1 . . . . . 206 ASN H . 26016 1 638 . 1 1 52 52 ASN HA H 1 4.237 0.011 . 1 . . . . . 206 ASN HA . 26016 1 639 . 1 1 52 52 ASN HB2 H 1 3.09 0.013 . 2 . . . . . 206 ASN HB2 . 26016 1 640 . 1 1 52 52 ASN HB3 H 1 2.644 0.006 . 2 . . . . . 206 ASN HB3 . 26016 1 641 . 1 1 52 52 ASN HD21 H 1 7.598 0.005 . 2 . . . . . 206 ASN HD21 . 26016 1 642 . 1 1 52 52 ASN HD22 H 1 6.879 0.003 . 2 . . . . . 206 ASN HD22 . 26016 1 643 . 1 1 52 52 ASN C C 13 175.064 0 . 1 . . . . . 206 ASN C . 26016 1 644 . 1 1 52 52 ASN CA C 13 54.277 0.15 . 1 . . . . . 206 ASN CA . 26016 1 645 . 1 1 52 52 ASN CB C 13 37.295 0.107 . 1 . . . . . 206 ASN CB . 26016 1 646 . 1 1 52 52 ASN N N 15 118.386 0.04 . 1 . . . . . 206 ASN N . 26016 1 647 . 1 1 52 52 ASN ND2 N 15 113.109 0.029 . 1 . . . . . 206 ASN ND2 . 26016 1 648 . 1 1 53 53 GLU H H 1 8.993 0.003 . 1 . . . . . 207 GLU H . 26016 1 649 . 1 1 53 53 GLU HA H 1 4.395 0.01 . 1 . . . . . 207 GLU HA . 26016 1 650 . 1 1 53 53 GLU HB2 H 1 2.02 0.011 . 2 . . . . . 207 GLU HB* . 26016 1 651 . 1 1 53 53 GLU HB3 H 1 2.02 0.011 . 2 . . . . . 207 GLU HB* . 26016 1 652 . 1 1 53 53 GLU HG2 H 1 2.298 0.012 . 2 . . . . . 207 GLU HG2 . 26016 1 653 . 1 1 53 53 GLU HG3 H 1 2.242 0.01 . 2 . . . . . 207 GLU HG3 . 26016 1 654 . 1 1 53 53 GLU C C 13 178.549 0 . 1 . . . . . 207 GLU C . 26016 1 655 . 1 1 53 53 GLU CA C 13 57.416 0.115 . 1 . . . . . 207 GLU CA . 26016 1 656 . 1 1 53 53 GLU CB C 13 31.853 0.101 . 1 . . . . . 207 GLU CB . 26016 1 657 . 1 1 53 53 GLU CG C 13 36.553 0 . 1 . . . . . 207 GLU CG . 26016 1 658 . 1 1 53 53 GLU N N 15 117.663 0.022 . 1 . . . . . 207 GLU N . 26016 1 659 . 1 1 54 54 SER H H 1 10.259 0.01 . 1 . . . . . 208 SER H . 26016 1 660 . 1 1 54 54 SER HA H 1 4.582 0.008 . 1 . . . . . 208 SER HA . 26016 1 661 . 1 1 54 54 SER HB2 H 1 4.189 0.016 . 2 . . . . . 208 SER HB2 . 26016 1 662 . 1 1 54 54 SER HB3 H 1 4.092 0.015 . 2 . . . . . 208 SER HB3 . 26016 1 663 . 1 1 54 54 SER C C 13 175.001 0 . 1 . . . . . 208 SER C . 26016 1 664 . 1 1 54 54 SER CA C 13 59.819 0.115 . 1 . . . . . 208 SER CA . 26016 1 665 . 1 1 54 54 SER CB C 13 65.253 0.131 . 1 . . . . . 208 SER CB . 26016 1 666 . 1 1 54 54 SER N N 15 119.323 0.037 . 1 . . . . . 208 SER N . 26016 1 667 . 1 1 55 55 LYS H H 1 7.378 0.007 . 1 . . . . . 209 LYS H . 26016 1 668 . 1 1 55 55 LYS HA H 1 4.916 0.021 . 1 . . . . . 209 LYS HA . 26016 1 669 . 1 1 55 55 LYS HB2 H 1 1.889 0.016 . 2 . . . . . 209 LYS HB2 . 26016 1 670 . 1 1 55 55 LYS HB3 H 1 1.683 0.024 . 2 . . . . . 209 LYS HB3 . 26016 1 671 . 1 1 55 55 LYS HG2 H 1 1.361 0.02 . 2 . . . . . 209 LYS HG2 . 26016 1 672 . 1 1 55 55 LYS HG3 H 1 1.309 0.015 . 2 . . . . . 209 LYS HG3 . 26016 1 673 . 1 1 55 55 LYS HD3 H 1 1.628 0.008 . 2 . . . . . 209 LYS HD3 . 26016 1 674 . 1 1 55 55 LYS HE2 H 1 2.888 0.004 . 2 . . . . . 209 LYS HE2 . 26016 1 675 . 1 1 55 55 LYS C C 13 176.199 0 . 1 . . . . . 209 LYS C . 26016 1 676 . 1 1 55 55 LYS CA C 13 56.899 0.111 . 1 . . . . . 209 LYS CA . 26016 1 677 . 1 1 55 55 LYS CB C 13 32.97 0.106 . 1 . . . . . 209 LYS CB . 26016 1 678 . 1 1 55 55 LYS CG C 13 23.9 0 . 1 . . . . . 209 LYS CG . 26016 1 679 . 1 1 55 55 LYS CD C 13 29.483 0 . 1 . . . . . 209 LYS CD . 26016 1 680 . 1 1 55 55 LYS CE C 13 42.021 0 . 1 . . . . . 209 LYS CE . 26016 1 681 . 1 1 55 55 LYS N N 15 121.061 0.029 . 1 . . . . . 209 LYS N . 26016 1 682 . 1 1 56 56 GLN H H 1 9.167 0.007 . 1 . . . . . 210 GLN H . 26016 1 683 . 1 1 56 56 GLN HA H 1 4.656 0.012 . 1 . . . . . 210 GLN HA . 26016 1 684 . 1 1 56 56 GLN HB2 H 1 1.282 0.015 . 2 . . . . . 210 GLN HB* . 26016 1 685 . 1 1 56 56 GLN HB3 H 1 1.282 0.015 . 2 . . . . . 210 GLN HB* . 26016 1 686 . 1 1 56 56 GLN HG2 H 1 2.249 0.007 . 2 . . . . . 210 GLN HG* . 26016 1 687 . 1 1 56 56 GLN HG3 H 1 2.249 0.007 . 2 . . . . . 210 GLN HG* . 26016 1 688 . 1 1 56 56 GLN HE21 H 1 6.089 0.004 . 2 . . . . . 210 GLN HE21 . 26016 1 689 . 1 1 56 56 GLN HE22 H 1 5.881 0.003 . 2 . . . . . 210 GLN HE22 . 26016 1 690 . 1 1 56 56 GLN C C 13 173.653 0 . 1 . . . . . 210 GLN C . 26016 1 691 . 1 1 56 56 GLN CA C 13 55.4 0.037 . 1 . . . . . 210 GLN CA . 26016 1 692 . 1 1 56 56 GLN CB C 13 34.224 0.194 . 1 . . . . . 210 GLN CB . 26016 1 693 . 1 1 56 56 GLN N N 15 123.158 0.051 . 1 . . . . . 210 GLN N . 26016 1 694 . 1 1 56 56 GLN NE2 N 15 110.65 0.031 . 1 . . . . . 210 GLN NE2 . 26016 1 695 . 1 1 57 57 LYS H H 1 8.753 0.007 . 1 . . . . . 211 LYS H . 26016 1 696 . 1 1 57 57 LYS HA H 1 5.652 0.012 . 1 . . . . . 211 LYS HA . 26016 1 697 . 1 1 57 57 LYS HB2 H 1 1.876 0.009 . 2 . . . . . 211 LYS HB* . 26016 1 698 . 1 1 57 57 LYS HB3 H 1 1.876 0.009 . 2 . . . . . 211 LYS HB* . 26016 1 699 . 1 1 57 57 LYS HG2 H 1 1.408 0.015 . 2 . . . . . 211 LYS HG2 . 26016 1 700 . 1 1 57 57 LYS HG3 H 1 1.289 0.002 . 2 . . . . . 211 LYS HG3 . 26016 1 701 . 1 1 57 57 LYS HD2 H 1 1.442 0.006 . 2 . . . . . 211 LYS HD* . 26016 1 702 . 1 1 57 57 LYS HD3 H 1 1.442 0.006 . 2 . . . . . 211 LYS HD* . 26016 1 703 . 1 1 57 57 LYS HE2 H 1 2.68 0.008 . 2 . . . . . 211 LYS HE* . 26016 1 704 . 1 1 57 57 LYS HE3 H 1 2.68 0.008 . 2 . . . . . 211 LYS HE* . 26016 1 705 . 1 1 57 57 LYS C C 13 176.513 0 . 1 . . . . . 211 LYS C . 26016 1 706 . 1 1 57 57 LYS CA C 13 54.849 0.11 . 1 . . . . . 211 LYS CA . 26016 1 707 . 1 1 57 57 LYS CB C 13 36.759 0.102 . 1 . . . . . 211 LYS CB . 26016 1 708 . 1 1 57 57 LYS CG C 13 23.636 0.049 . 1 . . . . . 211 LYS CG . 26016 1 709 . 1 1 57 57 LYS CD C 13 29.935 0.08 . 1 . . . . . 211 LYS CD . 26016 1 710 . 1 1 57 57 LYS CE C 13 42.04 0 . 1 . . . . . 211 LYS CE . 26016 1 711 . 1 1 57 57 LYS N N 15 118.5 0.028 . 1 . . . . . 211 LYS N . 26016 1 712 . 1 1 58 58 THR H H 1 8.471 0.004 . 1 . . . . . 212 THR H . 26016 1 713 . 1 1 58 58 THR HA H 1 5.082 0.011 . 1 . . . . . 212 THR HA . 26016 1 714 . 1 1 58 58 THR HB H 1 4.793 0.017 . 1 . . . . . 212 THR HB . 26016 1 715 . 1 1 58 58 THR HG21 H 1 0.823 0.009 . 1 . . . . . 212 THR HG2 . 26016 1 716 . 1 1 58 58 THR HG22 H 1 0.823 0.009 . 1 . . . . . 212 THR HG2 . 26016 1 717 . 1 1 58 58 THR HG23 H 1 0.823 0.009 . 1 . . . . . 212 THR HG2 . 26016 1 718 . 1 1 58 58 THR C C 13 175.873 0 . 1 . . . . . 212 THR C . 26016 1 719 . 1 1 58 58 THR CA C 13 61.054 0.146 . 1 . . . . . 212 THR CA . 26016 1 720 . 1 1 58 58 THR CB C 13 72.823 0.111 . 1 . . . . . 212 THR CB . 26016 1 721 . 1 1 58 58 THR CG2 C 13 20.136 0.027 . 1 . . . . . 212 THR CG2 . 26016 1 722 . 1 1 58 58 THR N N 15 109.962 0.055 . 1 . . . . . 212 THR N . 26016 1 723 . 1 1 59 59 LYS H H 1 10.147 0.008 . 1 . . . . . 213 LYS H . 26016 1 724 . 1 1 59 59 LYS HA H 1 4.367 0.009 . 1 . . . . . 213 LYS HA . 26016 1 725 . 1 1 59 59 LYS HB2 H 1 1.98 0.007 . 2 . . . . . 213 LYS HB* . 26016 1 726 . 1 1 59 59 LYS HB3 H 1 1.98 0.007 . 2 . . . . . 213 LYS HB* . 26016 1 727 . 1 1 59 59 LYS HG2 H 1 1.729 0.025 . 2 . . . . . 213 LYS HG* . 26016 1 728 . 1 1 59 59 LYS HG3 H 1 1.729 0.025 . 2 . . . . . 213 LYS HG* . 26016 1 729 . 1 1 59 59 LYS HD2 H 1 1.773 0.018 . 2 . . . . . 213 LYS HD* . 26016 1 730 . 1 1 59 59 LYS HD3 H 1 1.773 0.018 . 2 . . . . . 213 LYS HD* . 26016 1 731 . 1 1 59 59 LYS HE2 H 1 3.081 0.014 . 2 . . . . . 213 LYS HE* . 26016 1 732 . 1 1 59 59 LYS HE3 H 1 3.081 0.014 . 2 . . . . . 213 LYS HE* . 26016 1 733 . 1 1 59 59 LYS C C 13 177.533 0 . 1 . . . . . 213 LYS C . 26016 1 734 . 1 1 59 59 LYS CA C 13 57.27 0.065 . 1 . . . . . 213 LYS CA . 26016 1 735 . 1 1 59 59 LYS CB C 13 33.07 0.12 . 1 . . . . . 213 LYS CB . 26016 1 736 . 1 1 59 59 LYS CG C 13 24.933 0.033 . 1 . . . . . 213 LYS CG . 26016 1 737 . 1 1 59 59 LYS CD C 13 29.034 0.096 . 1 . . . . . 213 LYS CD . 26016 1 738 . 1 1 59 59 LYS CE C 13 42.088 0.058 . 1 . . . . . 213 LYS CE . 26016 1 739 . 1 1 59 59 LYS N N 15 119.491 0.035 . 1 . . . . . 213 LYS N . 26016 1 740 . 1 1 60 60 THR H H 1 8.59 0.009 . 1 . . . . . 214 THR H . 26016 1 741 . 1 1 60 60 THR HA H 1 4.809 0.014 . 1 . . . . . 214 THR HA . 26016 1 742 . 1 1 60 60 THR HB H 1 3.633 0.01 . 1 . . . . . 214 THR HB . 26016 1 743 . 1 1 60 60 THR HG21 H 1 0.92 0.012 . 1 . . . . . 214 THR HG2 . 26016 1 744 . 1 1 60 60 THR HG22 H 1 0.92 0.012 . 1 . . . . . 214 THR HG2 . 26016 1 745 . 1 1 60 60 THR HG23 H 1 0.92 0.012 . 1 . . . . . 214 THR HG2 . 26016 1 746 . 1 1 60 60 THR C C 13 174.468 0 . 1 . . . . . 214 THR C . 26016 1 747 . 1 1 60 60 THR CA C 13 62.194 0.124 . 1 . . . . . 214 THR CA . 26016 1 748 . 1 1 60 60 THR CB C 13 69.675 0.075 . 1 . . . . . 214 THR CB . 26016 1 749 . 1 1 60 60 THR CG2 C 13 22.56 0.105 . 1 . . . . . 214 THR CG2 . 26016 1 750 . 1 1 60 60 THR N N 15 120.675 0.053 . 1 . . . . . 214 THR N . 26016 1 751 . 1 1 61 61 ILE H H 1 8.452 0.007 . 1 . . . . . 215 ILE H . 26016 1 752 . 1 1 61 61 ILE HA H 1 4.283 0.01 . 1 . . . . . 215 ILE HA . 26016 1 753 . 1 1 61 61 ILE HB H 1 1.646 0.013 . 1 . . . . . 215 ILE HB . 26016 1 754 . 1 1 61 61 ILE HG12 H 1 1.287 0.01 . 2 . . . . . 215 ILE HG1 . 26016 1 755 . 1 1 61 61 ILE HG13 H 1 1.287 0.01 . 2 . . . . . 215 ILE HG1 . 26016 1 756 . 1 1 61 61 ILE HG21 H 1 0.893 0.01 . 1 . . . . . 215 ILE HG2 . 26016 1 757 . 1 1 61 61 ILE HG22 H 1 0.893 0.01 . 1 . . . . . 215 ILE HG2 . 26016 1 758 . 1 1 61 61 ILE HG23 H 1 0.893 0.01 . 1 . . . . . 215 ILE HG2 . 26016 1 759 . 1 1 61 61 ILE HD11 H 1 0.522 0.008 . 1 . . . . . 215 ILE HD1 . 26016 1 760 . 1 1 61 61 ILE HD12 H 1 0.522 0.008 . 1 . . . . . 215 ILE HD1 . 26016 1 761 . 1 1 61 61 ILE HD13 H 1 0.522 0.008 . 1 . . . . . 215 ILE HD1 . 26016 1 762 . 1 1 61 61 ILE C C 13 174.281 0 . 1 . . . . . 215 ILE C . 26016 1 763 . 1 1 61 61 ILE CA C 13 58.959 0.111 . 1 . . . . . 215 ILE CA . 26016 1 764 . 1 1 61 61 ILE CB C 13 36.669 0.139 . 1 . . . . . 215 ILE CB . 26016 1 765 . 1 1 61 61 ILE CG1 C 13 27.485 0 . 1 . . . . . 215 ILE CG1 . 26016 1 766 . 1 1 61 61 ILE CG2 C 13 18.683 0.087 . 1 . . . . . 215 ILE CG2 . 26016 1 767 . 1 1 61 61 ILE CD1 C 13 10.622 0.069 . 1 . . . . . 215 ILE CD1 . 26016 1 768 . 1 1 61 61 ILE N N 15 130.775 0.034 . 1 . . . . . 215 ILE N . 26016 1 769 . 1 1 62 62 ARG H H 1 8.118 0.008 . 1 . . . . . 216 ARG H . 26016 1 770 . 1 1 62 62 ARG HA H 1 4.788 0.011 . 1 . . . . . 216 ARG HA . 26016 1 771 . 1 1 62 62 ARG HB2 H 1 1.9 0.003 . 2 . . . . . 216 ARG HB2 . 26016 1 772 . 1 1 62 62 ARG HB3 H 1 1.741 0.018 . 2 . . . . . 216 ARG HB3 . 26016 1 773 . 1 1 62 62 ARG HG2 H 1 1.728 0.006 . 2 . . . . . 216 ARG HG2 . 26016 1 774 . 1 1 62 62 ARG HG3 H 1 1.488 0.01 . 2 . . . . . 216 ARG HG3 . 26016 1 775 . 1 1 62 62 ARG HD2 H 1 3.048 0.007 . 2 . . . . . 216 ARG HD2 . 26016 1 776 . 1 1 62 62 ARG HE H 1 6.272 0.016 . 1 . . . . . 216 ARG HE . 26016 1 777 . 1 1 62 62 ARG C C 13 177.605 0 . 1 . . . . . 216 ARG C . 26016 1 778 . 1 1 62 62 ARG CA C 13 55.741 0.087 . 1 . . . . . 216 ARG CA . 26016 1 779 . 1 1 62 62 ARG CB C 13 30.422 0.039 . 1 . . . . . 216 ARG CB . 26016 1 780 . 1 1 62 62 ARG CG C 13 27.428 0.207 . 1 . . . . . 216 ARG CG . 26016 1 781 . 1 1 62 62 ARG CD C 13 42.36 0.179 . 1 . . . . . 216 ARG CD . 26016 1 782 . 1 1 62 62 ARG CZ C 13 159.198 0 . 1 . . . . . 216 ARG CZ . 26016 1 783 . 1 1 62 62 ARG N N 15 122.232 0.04 . 1 . . . . . 216 ARG N . 26016 1 784 . 1 1 62 62 ARG NE N 15 77.014 0.029 . 1 . . . . . 216 ARG NE . 26016 1 785 . 1 1 63 63 SER H H 1 9.372 0.007 . 1 . . . . . 217 SER H . 26016 1 786 . 1 1 63 63 SER HA H 1 3.96 0.01 . 1 . . . . . 217 SER HA . 26016 1 787 . 1 1 63 63 SER HB2 H 1 3.975 0.01 . 2 . . . . . 217 SER HB* . 26016 1 788 . 1 1 63 63 SER HB3 H 1 3.975 0.01 . 2 . . . . . 217 SER HB* . 26016 1 789 . 1 1 63 63 SER C C 13 173.876 0 . 1 . . . . . 217 SER C . 26016 1 790 . 1 1 63 63 SER CA C 13 58.044 0.117 . 1 . . . . . 217 SER CA . 26016 1 791 . 1 1 63 63 SER CB C 13 61.807 0.085 . 1 . . . . . 217 SER CB . 26016 1 792 . 1 1 63 63 SER N N 15 116.032 0.059 . 1 . . . . . 217 SER N . 26016 1 793 . 1 1 64 64 THR H H 1 9.055 0.006 . 1 . . . . . 218 THR H . 26016 1 794 . 1 1 64 64 THR HA H 1 4.711 0.016 . 1 . . . . . 218 THR HA . 26016 1 795 . 1 1 64 64 THR HB H 1 4.09 0.007 . 1 . . . . . 218 THR HB . 26016 1 796 . 1 1 64 64 THR HG21 H 1 0.7 0.008 . 1 . . . . . 218 THR HG2 . 26016 1 797 . 1 1 64 64 THR HG22 H 1 0.7 0.008 . 1 . . . . . 218 THR HG2 . 26016 1 798 . 1 1 64 64 THR HG23 H 1 0.7 0.008 . 1 . . . . . 218 THR HG2 . 26016 1 799 . 1 1 64 64 THR C C 13 170.153 0 . 1 . . . . . 218 THR C . 26016 1 800 . 1 1 64 64 THR CA C 13 60.844 0.164 . 1 . . . . . 218 THR CA . 26016 1 801 . 1 1 64 64 THR CB C 13 68.776 0.074 . 1 . . . . . 218 THR CB . 26016 1 802 . 1 1 64 64 THR CG2 C 13 20.717 0.022 . 1 . . . . . 218 THR CG2 . 26016 1 803 . 1 1 64 64 THR N N 15 114.343 0.029 . 1 . . . . . 218 THR N . 26016 1 804 . 1 1 65 65 LEU H H 1 8.523 0.006 . 1 . . . . . 219 LEU H . 26016 1 805 . 1 1 65 65 LEU HA H 1 4.486 0.011 . 1 . . . . . 219 LEU HA . 26016 1 806 . 1 1 65 65 LEU HB2 H 1 1.873 0.007 . 2 . . . . . 219 LEU HB2 . 26016 1 807 . 1 1 65 65 LEU HB3 H 1 1.472 0.016 . 2 . . . . . 219 LEU HB3 . 26016 1 808 . 1 1 65 65 LEU HG H 1 1.594 0.01 . 1 . . . . . 219 LEU HG . 26016 1 809 . 1 1 65 65 LEU HD11 H 1 1.019 0.009 . 2 . . . . . 219 LEU HD1 . 26016 1 810 . 1 1 65 65 LEU HD12 H 1 1.019 0.009 . 2 . . . . . 219 LEU HD1 . 26016 1 811 . 1 1 65 65 LEU HD13 H 1 1.019 0.009 . 2 . . . . . 219 LEU HD1 . 26016 1 812 . 1 1 65 65 LEU HD21 H 1 0.575 0.008 . 2 . . . . . 219 LEU HD2 . 26016 1 813 . 1 1 65 65 LEU HD22 H 1 0.575 0.008 . 2 . . . . . 219 LEU HD2 . 26016 1 814 . 1 1 65 65 LEU HD23 H 1 0.575 0.008 . 2 . . . . . 219 LEU HD2 . 26016 1 815 . 1 1 65 65 LEU C C 13 175.36 0 . 1 . . . . . 219 LEU C . 26016 1 816 . 1 1 65 65 LEU CA C 13 53.167 0.062 . 1 . . . . . 219 LEU CA . 26016 1 817 . 1 1 65 65 LEU CB C 13 41.553 0.078 . 1 . . . . . 219 LEU CB . 26016 1 818 . 1 1 65 65 LEU CG C 13 27.036 0.038 . 1 . . . . . 219 LEU CG . 26016 1 819 . 1 1 65 65 LEU CD1 C 13 24.633 0.146 . 2 . . . . . 219 LEU CD1 . 26016 1 820 . 1 1 65 65 LEU CD2 C 13 21.245 0.159 . 2 . . . . . 219 LEU CD2 . 26016 1 821 . 1 1 65 65 LEU N N 15 122.091 0.087 . 1 . . . . . 219 LEU N . 26016 1 822 . 1 1 66 66 ASN H H 1 8.661 0.004 . 1 . . . . . 220 ASN H . 26016 1 823 . 1 1 66 66 ASN HA H 1 5.479 0.013 . 1 . . . . . 220 ASN HA . 26016 1 824 . 1 1 66 66 ASN HB2 H 1 2.605 0.009 . 2 . . . . . 220 ASN HB2 . 26016 1 825 . 1 1 66 66 ASN HB3 H 1 2.515 0.003 . 2 . . . . . 220 ASN HB3 . 26016 1 826 . 1 1 66 66 ASN HD21 H 1 7.604 0.014 . 2 . . . . . 220 ASN HD21 . 26016 1 827 . 1 1 66 66 ASN HD22 H 1 7.28 0.003 . 2 . . . . . 220 ASN HD22 . 26016 1 828 . 1 1 66 66 ASN CA C 13 51.318 0.054 . 1 . . . . . 220 ASN CA . 26016 1 829 . 1 1 66 66 ASN CB C 13 41.511 0.036 . 1 . . . . . 220 ASN CB . 26016 1 830 . 1 1 66 66 ASN N N 15 116.613 0.073 . 1 . . . . . 220 ASN N . 26016 1 831 . 1 1 67 67 PRO HA H 1 3.922 0.01 . 1 . . . . . 221 PRO HA . 26016 1 832 . 1 1 67 67 PRO HB2 H 1 1.228 0.01 . 2 . . . . . 221 PRO HB2 . 26016 1 833 . 1 1 67 67 PRO HB3 H 1 0.08 0.008 . 2 . . . . . 221 PRO HB3 . 26016 1 834 . 1 1 67 67 PRO HG2 H 1 1.815 0.018 . 2 . . . . . 221 PRO HG2 . 26016 1 835 . 1 1 67 67 PRO HG3 H 1 1.498 0.012 . 2 . . . . . 221 PRO HG3 . 26016 1 836 . 1 1 67 67 PRO HD2 H 1 4.128 0.013 . 2 . . . . . 221 PRO HD2 . 26016 1 837 . 1 1 67 67 PRO HD3 H 1 3.755 0.017 . 2 . . . . . 221 PRO HD3 . 26016 1 838 . 1 1 67 67 PRO C C 13 174.368 0 . 1 . . . . . 221 PRO C . 26016 1 839 . 1 1 67 67 PRO CA C 13 62.899 0.157 . 1 . . . . . 221 PRO CA . 26016 1 840 . 1 1 67 67 PRO CB C 13 32.471 0.082 . 1 . . . . . 221 PRO CB . 26016 1 841 . 1 1 67 67 PRO CD C 13 51.248 0.075 . 1 . . . . . 221 PRO CD . 26016 1 842 . 1 1 68 68 GLN H H 1 7.626 0.006 . 1 . . . . . 222 GLN H . 26016 1 843 . 1 1 68 68 GLN HA H 1 4.377 0.007 . 1 . . . . . 222 GLN HA . 26016 1 844 . 1 1 68 68 GLN HB2 H 1 2.018 0.007 . 2 . . . . . 222 GLN HB2 . 26016 1 845 . 1 1 68 68 GLN HB3 H 1 1.937 0.007 . 2 . . . . . 222 GLN HB3 . 26016 1 846 . 1 1 68 68 GLN HG2 H 1 2.257 0.01 . 2 . . . . . 222 GLN HG2 . 26016 1 847 . 1 1 68 68 GLN HG3 H 1 0.801 0.005 . 2 . . . . . 222 GLN HG3 . 26016 1 848 . 1 1 68 68 GLN HE21 H 1 7.389 0.008 . 2 . . . . . 222 GLN HE21 . 26016 1 849 . 1 1 68 68 GLN HE22 H 1 7.163 0.003 . 2 . . . . . 222 GLN HE22 . 26016 1 850 . 1 1 68 68 GLN C C 13 174.145 0 . 1 . . . . . 222 GLN C . 26016 1 851 . 1 1 68 68 GLN CA C 13 54.821 0.126 . 1 . . . . . 222 GLN CA . 26016 1 852 . 1 1 68 68 GLN CB C 13 29.985 0 . 1 . . . . . 222 GLN CB . 26016 1 853 . 1 1 68 68 GLN CG C 13 33.651 0.041 . 1 . . . . . 222 GLN CG . 26016 1 854 . 1 1 68 68 GLN N N 15 116.698 0.03 . 1 . . . . . 222 GLN N . 26016 1 855 . 1 1 68 68 GLN NE2 N 15 109.005 0.07 . 1 . . . . . 222 GLN NE2 . 26016 1 856 . 1 1 69 69 TRP H H 1 8.284 0.008 . 1 . . . . . 223 TRP H . 26016 1 857 . 1 1 69 69 TRP HA H 1 4.752 0.014 . 1 . . . . . 223 TRP HA . 26016 1 858 . 1 1 69 69 TRP HB2 H 1 3.386 0.005 . 2 . . . . . 223 TRP HB2 . 26016 1 859 . 1 1 69 69 TRP HB3 H 1 3.19 0.014 . 2 . . . . . 223 TRP HB3 . 26016 1 860 . 1 1 69 69 TRP HD1 H 1 7.446 0.004 . 1 . . . . . 223 TRP HD1 . 26016 1 861 . 1 1 69 69 TRP HE1 H 1 9.491 0.002 . 1 . . . . . 223 TRP HE1 . 26016 1 862 . 1 1 69 69 TRP HE3 H 1 7.271 0.011 . 1 . . . . . 223 TRP HE3 . 26016 1 863 . 1 1 69 69 TRP HZ2 H 1 6.901 0.014 . 1 . . . . . 223 TRP HZ2 . 26016 1 864 . 1 1 69 69 TRP HZ3 H 1 6.678 0.005 . 1 . . . . . 223 TRP HZ3 . 26016 1 865 . 1 1 69 69 TRP HH2 H 1 6.957 0.013 . 1 . . . . . 223 TRP HH2 . 26016 1 866 . 1 1 69 69 TRP C C 13 176.492 0 . 1 . . . . . 223 TRP C . 26016 1 867 . 1 1 69 69 TRP CA C 13 62.075 0.106 . 1 . . . . . 223 TRP CA . 26016 1 868 . 1 1 69 69 TRP CB C 13 29.583 0.146 . 1 . . . . . 223 TRP CB . 26016 1 869 . 1 1 69 69 TRP CD1 C 13 127.819 0 . 1 . . . . . 223 TRP CD1 . 26016 1 870 . 1 1 69 69 TRP CE2 C 13 138.298 0 . 1 . . . . . 223 TRP CE2 . 26016 1 871 . 1 1 69 69 TRP CZ2 C 13 113.55 0 . 1 . . . . . 223 TRP CZ2 . 26016 1 872 . 1 1 69 69 TRP CZ3 C 13 124.203 0 . 1 . . . . . 223 TRP CZ3 . 26016 1 873 . 1 1 69 69 TRP CH2 C 13 122.651 0 . 1 . . . . . 223 TRP CH2 . 26016 1 874 . 1 1 69 69 TRP N N 15 122.038 0.036 . 1 . . . . . 223 TRP N . 26016 1 875 . 1 1 69 69 TRP NE1 N 15 129.576 0.016 . 1 . . . . . 223 TRP NE1 . 26016 1 876 . 1 1 70 70 ASN H H 1 9.346 0.006 . 1 . . . . . 224 ASN H . 26016 1 877 . 1 1 70 70 ASN HA H 1 4.571 0.012 . 1 . . . . . 224 ASN HA . 26016 1 878 . 1 1 70 70 ASN HB2 H 1 2.906 0.009 . 2 . . . . . 224 ASN HB2 . 26016 1 879 . 1 1 70 70 ASN HB3 H 1 2.89 0.003 . 2 . . . . . 224 ASN HB3 . 26016 1 880 . 1 1 70 70 ASN HD21 H 1 7.613 0.001 . 2 . . . . . 224 ASN HD21 . 26016 1 881 . 1 1 70 70 ASN HD22 H 1 6.779 0.006 . 2 . . . . . 224 ASN HD22 . 26016 1 882 . 1 1 70 70 ASN C C 13 174.32 0 . 1 . . . . . 224 ASN C . 26016 1 883 . 1 1 70 70 ASN CA C 13 54.59 0.124 . 1 . . . . . 224 ASN CA . 26016 1 884 . 1 1 70 70 ASN CB C 13 37.704 0.01 . 1 . . . . . 224 ASN CB . 26016 1 885 . 1 1 70 70 ASN N N 15 116.955 0.054 . 1 . . . . . 224 ASN N . 26016 1 886 . 1 1 70 70 ASN ND2 N 15 112.816 0.011 . 1 . . . . . 224 ASN ND2 . 26016 1 887 . 1 1 71 71 GLU H H 1 8.163 0.004 . 1 . . . . . 225 GLU H . 26016 1 888 . 1 1 71 71 GLU HA H 1 4.78 0.012 . 1 . . . . . 225 GLU HA . 26016 1 889 . 1 1 71 71 GLU HB2 H 1 2.068 0.005 . 2 . . . . . 225 GLU HB2 . 26016 1 890 . 1 1 71 71 GLU HB3 H 1 1.642 0.019 . 2 . . . . . 225 GLU HB3 . 26016 1 891 . 1 1 71 71 GLU HG2 H 1 2.411 0.017 . 2 . . . . . 225 GLU HG2 . 26016 1 892 . 1 1 71 71 GLU HG3 H 1 2.227 0.034 . 2 . . . . . 225 GLU HG3 . 26016 1 893 . 1 1 71 71 GLU C C 13 174.4 0 . 1 . . . . . 225 GLU C . 26016 1 894 . 1 1 71 71 GLU CA C 13 56.4 0.039 . 1 . . . . . 225 GLU CA . 26016 1 895 . 1 1 71 71 GLU CB C 13 36.551 0.032 . 1 . . . . . 225 GLU CB . 26016 1 896 . 1 1 71 71 GLU CG C 13 38.333 0.057 . 1 . . . . . 225 GLU CG . 26016 1 897 . 1 1 71 71 GLU N N 15 117.153 0.033 . 1 . . . . . 225 GLU N . 26016 1 898 . 1 1 72 72 SER H H 1 8.33 0.008 . 1 . . . . . 226 SER H . 26016 1 899 . 1 1 72 72 SER HA H 1 5.664 0.012 . 1 . . . . . 226 SER HA . 26016 1 900 . 1 1 72 72 SER HB2 H 1 3.739 0.014 . 2 . . . . . 226 SER HB2 . 26016 1 901 . 1 1 72 72 SER HB3 H 1 3.545 0.014 . 2 . . . . . 226 SER HB3 . 26016 1 902 . 1 1 72 72 SER C C 13 172.508 0 . 1 . . . . . 226 SER C . 26016 1 903 . 1 1 72 72 SER CA C 13 57.017 0.116 . 1 . . . . . 226 SER CA . 26016 1 904 . 1 1 72 72 SER CB C 13 65.979 0.095 . 1 . . . . . 226 SER CB . 26016 1 905 . 1 1 72 72 SER N N 15 115.933 0.046 . 1 . . . . . 226 SER N . 26016 1 906 . 1 1 73 73 PHE H H 1 9.237 0.004 . 1 . . . . . 227 PHE H . 26016 1 907 . 1 1 73 73 PHE HA H 1 4.687 0.01 . 1 . . . . . 227 PHE HA . 26016 1 908 . 1 1 73 73 PHE HB2 H 1 2.713 0.008 . 2 . . . . . 227 PHE HB2 . 26016 1 909 . 1 1 73 73 PHE HB3 H 1 2.428 0.014 . 2 . . . . . 227 PHE HB3 . 26016 1 910 . 1 1 73 73 PHE HD1 H 1 7.088 0.013 . 3 . . . . . 227 PHE HD* . 26016 1 911 . 1 1 73 73 PHE HD2 H 1 7.088 0.013 . 3 . . . . . 227 PHE HD* . 26016 1 912 . 1 1 73 73 PHE HE1 H 1 6.943 0.005 . 3 . . . . . 227 PHE HE* . 26016 1 913 . 1 1 73 73 PHE HE2 H 1 6.943 0.005 . 3 . . . . . 227 PHE HE* . 26016 1 914 . 1 1 73 73 PHE HZ H 1 6.816 0.017 . 1 . . . . . 227 PHE HZ . 26016 1 915 . 1 1 73 73 PHE C C 13 175.418 0 . 1 . . . . . 227 PHE C . 26016 1 916 . 1 1 73 73 PHE CA C 13 57.427 0.089 . 1 . . . . . 227 PHE CA . 26016 1 917 . 1 1 73 73 PHE CB C 13 44.142 0.001 . 1 . . . . . 227 PHE CB . 26016 1 918 . 1 1 73 73 PHE CD1 C 13 132.282 0 . 3 . . . . . 227 PHE CD . 26016 1 919 . 1 1 73 73 PHE CD2 C 13 132.282 0 . 3 . . . . . 227 PHE CD . 26016 1 920 . 1 1 73 73 PHE CE1 C 13 130.648 0 . 3 . . . . . 227 PHE CE . 26016 1 921 . 1 1 73 73 PHE CE2 C 13 130.648 0 . 3 . . . . . 227 PHE CE . 26016 1 922 . 1 1 73 73 PHE CZ C 13 128.73 0 . 1 . . . . . 227 PHE CZ . 26016 1 923 . 1 1 73 73 PHE N N 15 119.728 0.088 . 1 . . . . . 227 PHE N . 26016 1 924 . 1 1 74 74 THR H H 1 9.235 0.01 . 1 . . . . . 228 THR H . 26016 1 925 . 1 1 74 74 THR HA H 1 5.378 0.006 . 1 . . . . . 228 THR HA . 26016 1 926 . 1 1 74 74 THR HB H 1 3.787 0.014 . 1 . . . . . 228 THR HB . 26016 1 927 . 1 1 74 74 THR HG21 H 1 0.93 0.004 . 1 . . . . . 228 THR HG2 . 26016 1 928 . 1 1 74 74 THR HG22 H 1 0.93 0.004 . 1 . . . . . 228 THR HG2 . 26016 1 929 . 1 1 74 74 THR HG23 H 1 0.93 0.004 . 1 . . . . . 228 THR HG2 . 26016 1 930 . 1 1 74 74 THR C C 13 173.695 0 . 1 . . . . . 228 THR C . 26016 1 931 . 1 1 74 74 THR CA C 13 61.768 0.09 . 1 . . . . . 228 THR CA . 26016 1 932 . 1 1 74 74 THR CB C 13 71.53 0.142 . 1 . . . . . 228 THR CB . 26016 1 933 . 1 1 74 74 THR CG2 C 13 22.096 0.068 . 1 . . . . . 228 THR CG2 . 26016 1 934 . 1 1 74 74 THR N N 15 118.305 0.04 . 1 . . . . . 228 THR N . 26016 1 935 . 1 1 75 75 PHE H H 1 9.441 0.004 . 1 . . . . . 229 PHE H . 26016 1 936 . 1 1 75 75 PHE HA H 1 4.68 0.012 . 1 . . . . . 229 PHE HA . 26016 1 937 . 1 1 75 75 PHE HB2 H 1 2.893 0.013 . 2 . . . . . 229 PHE HB* . 26016 1 938 . 1 1 75 75 PHE HB3 H 1 2.893 0.013 . 2 . . . . . 229 PHE HB* . 26016 1 939 . 1 1 75 75 PHE HD1 H 1 7.156 0.009 . 3 . . . . . 229 PHE HD* . 26016 1 940 . 1 1 75 75 PHE HD2 H 1 7.156 0.009 . 3 . . . . . 229 PHE HD* . 26016 1 941 . 1 1 75 75 PHE HE1 H 1 7.159 0.003 . 3 . . . . . 229 PHE HE* . 26016 1 942 . 1 1 75 75 PHE HE2 H 1 7.159 0.003 . 3 . . . . . 229 PHE HE* . 26016 1 943 . 1 1 75 75 PHE HZ H 1 6.777 0.006 . 1 . . . . . 229 PHE HZ . 26016 1 944 . 1 1 75 75 PHE C C 13 174.91 0 . 1 . . . . . 229 PHE C . 26016 1 945 . 1 1 75 75 PHE CA C 13 56.197 0.11 . 1 . . . . . 229 PHE CA . 26016 1 946 . 1 1 75 75 PHE CB C 13 40.875 0.031 . 1 . . . . . 229 PHE CB . 26016 1 947 . 1 1 75 75 PHE CD1 C 13 131.863 0 . 3 . . . . . 229 PHE CD . 26016 1 948 . 1 1 75 75 PHE CD2 C 13 131.863 0 . 3 . . . . . 229 PHE CD . 26016 1 949 . 1 1 75 75 PHE CE1 C 13 130.488 0 . 3 . . . . . 229 PHE CE . 26016 1 950 . 1 1 75 75 PHE CE2 C 13 130.488 0 . 3 . . . . . 229 PHE CE . 26016 1 951 . 1 1 75 75 PHE CZ C 13 128.785 0 . 1 . . . . . 229 PHE CZ . 26016 1 952 . 1 1 75 75 PHE N N 15 125.283 0.047 . 1 . . . . . 229 PHE N . 26016 1 953 . 1 1 76 76 LYS H H 1 8.947 0.006 . 1 . . . . . 230 LYS H . 26016 1 954 . 1 1 76 76 LYS HA H 1 4.381 0.013 . 1 . . . . . 230 LYS HA . 26016 1 955 . 1 1 76 76 LYS HB2 H 1 1.906 0 . 2 . . . . . 230 LYS HB2 . 26016 1 956 . 1 1 76 76 LYS HB3 H 1 1.732 0.012 . 2 . . . . . 230 LYS HB3 . 26016 1 957 . 1 1 76 76 LYS HG2 H 1 1.475 0.007 . 2 . . . . . 230 LYS HG2 . 26016 1 958 . 1 1 76 76 LYS HG3 H 1 1.34 0 . 2 . . . . . 230 LYS HG3 . 26016 1 959 . 1 1 76 76 LYS HD2 H 1 1.727 0.009 . 2 . . . . . 230 LYS HD2 . 26016 1 960 . 1 1 76 76 LYS HD3 H 1 1.768 0.005 . 2 . . . . . 230 LYS HD3 . 26016 1 961 . 1 1 76 76 LYS HE2 H 1 2.992 0.006 . 2 . . . . . 230 LYS HE2 . 26016 1 962 . 1 1 76 76 LYS C C 13 175.826 0 . 1 . . . . . 230 LYS C . 26016 1 963 . 1 1 76 76 LYS CA C 13 56.969 0.187 . 1 . . . . . 230 LYS CA . 26016 1 964 . 1 1 76 76 LYS CB C 13 31.853 0.031 . 1 . . . . . 230 LYS CB . 26016 1 965 . 1 1 76 76 LYS CG C 13 25.067 0.13 . 1 . . . . . 230 LYS CG . 26016 1 966 . 1 1 76 76 LYS CD C 13 28.986 0 . 1 . . . . . 230 LYS CD . 26016 1 967 . 1 1 76 76 LYS CE C 13 42.082 0.042 . 1 . . . . . 230 LYS CE . 26016 1 968 . 1 1 76 76 LYS N N 15 125.757 0.037 . 1 . . . . . 230 LYS N . 26016 1 969 . 1 1 77 77 LEU H H 1 8.359 0.005 . 1 . . . . . 231 LEU H . 26016 1 970 . 1 1 77 77 LEU HA H 1 4.795 0.019 . 1 . . . . . 231 LEU HA . 26016 1 971 . 1 1 77 77 LEU HB2 H 1 1.616 0.015 . 2 . . . . . 231 LEU HB2 . 26016 1 972 . 1 1 77 77 LEU HB3 H 1 1.328 0.024 . 2 . . . . . 231 LEU HB3 . 26016 1 973 . 1 1 77 77 LEU HG H 1 1.572 0.017 . 1 . . . . . 231 LEU HG . 26016 1 974 . 1 1 77 77 LEU HD11 H 1 0.66 0.016 . 2 . . . . . 231 LEU HD1 . 26016 1 975 . 1 1 77 77 LEU HD12 H 1 0.66 0.016 . 2 . . . . . 231 LEU HD1 . 26016 1 976 . 1 1 77 77 LEU HD13 H 1 0.66 0.016 . 2 . . . . . 231 LEU HD1 . 26016 1 977 . 1 1 77 77 LEU HD21 H 1 0.63 0.015 . 2 . . . . . 231 LEU HD2 . 26016 1 978 . 1 1 77 77 LEU HD22 H 1 0.63 0.015 . 2 . . . . . 231 LEU HD2 . 26016 1 979 . 1 1 77 77 LEU HD23 H 1 0.63 0.015 . 2 . . . . . 231 LEU HD2 . 26016 1 980 . 1 1 77 77 LEU C C 13 177.137 0 . 1 . . . . . 231 LEU C . 26016 1 981 . 1 1 77 77 LEU CA C 13 54.119 0.203 . 1 . . . . . 231 LEU CA . 26016 1 982 . 1 1 77 77 LEU CB C 13 43.205 0.087 . 1 . . . . . 231 LEU CB . 26016 1 983 . 1 1 77 77 LEU CG C 13 26.517 0.057 . 1 . . . . . 231 LEU CG . 26016 1 984 . 1 1 77 77 LEU CD1 C 13 22.26 0.16 . 2 . . . . . 231 LEU CD1 . 26016 1 985 . 1 1 77 77 LEU CD2 C 13 21.715 0.015 . 2 . . . . . 231 LEU CD2 . 26016 1 986 . 1 1 77 77 LEU N N 15 125.585 0.046 . 1 . . . . . 231 LEU N . 26016 1 987 . 1 1 78 78 LYS H H 1 9.437 0.009 . 1 . . . . . 232 LYS H . 26016 1 988 . 1 1 78 78 LYS HA H 1 4.782 0.01 . 1 . . . . . 232 LYS HA . 26016 1 989 . 1 1 78 78 LYS HB2 H 1 1.914 0.014 . 2 . . . . . 232 LYS HB2 . 26016 1 990 . 1 1 78 78 LYS HB3 H 1 1.502 0 . 2 . . . . . 232 LYS HB3 . 26016 1 991 . 1 1 78 78 LYS HE2 H 1 2.986 0 . 2 . . . . . 232 LYS HE2 . 26016 1 992 . 1 1 78 78 LYS CB C 13 32.671 0.028 . 1 . . . . . 232 LYS CB . 26016 1 993 . 1 1 78 78 LYS N N 15 123.453 0.073 . 1 . . . . . 232 LYS N . 26016 1 994 . 1 1 79 79 PRO HA H 1 4.244 0.009 . 1 . . . . . 233 PRO HA . 26016 1 995 . 1 1 79 79 PRO HB2 H 1 2.394 0.009 . 2 . . . . . 233 PRO HB2 . 26016 1 996 . 1 1 79 79 PRO HB3 H 1 1.966 0.009 . 2 . . . . . 233 PRO HB3 . 26016 1 997 . 1 1 79 79 PRO HG2 H 1 2.193 0 . 2 . . . . . 233 PRO HG2 . 26016 1 998 . 1 1 79 79 PRO HG3 H 1 2.002 0 . 2 . . . . . 233 PRO HG3 . 26016 1 999 . 1 1 79 79 PRO HD2 H 1 4.112 0.007 . 2 . . . . . 233 PRO HD2 . 26016 1 1000 . 1 1 79 79 PRO C C 13 178.765 0 . 1 . . . . . 233 PRO C . 26016 1 1001 . 1 1 79 79 PRO CA C 13 66.367 0.133 . 1 . . . . . 233 PRO CA . 26016 1 1002 . 1 1 79 79 PRO CB C 13 31.603 0.049 . 1 . . . . . 233 PRO CB . 26016 1 1003 . 1 1 79 79 PRO CG C 13 27.859 0 . 1 . . . . . 233 PRO CG . 26016 1 1004 . 1 1 79 79 PRO CD C 13 50.29 0 . 1 . . . . . 233 PRO CD . 26016 1 1005 . 1 1 80 80 SER H H 1 7.749 0.007 . 1 . . . . . 234 SER H . 26016 1 1006 . 1 1 80 80 SER HA H 1 4.288 0.013 . 1 . . . . . 234 SER HA . 26016 1 1007 . 1 1 80 80 SER HB2 H 1 3.855 0.011 . 2 . . . . . 234 SER HB2 . 26016 1 1008 . 1 1 80 80 SER C C 13 176.27 0 . 1 . . . . . 234 SER C . 26016 1 1009 . 1 1 80 80 SER CA C 13 59.472 0.137 . 1 . . . . . 234 SER CA . 26016 1 1010 . 1 1 80 80 SER CB C 13 62.388 0.201 . 1 . . . . . 234 SER CB . 26016 1 1011 . 1 1 80 80 SER N N 15 107.864 0.03 . 1 . . . . . 234 SER N . 26016 1 1012 . 1 1 81 81 ASP H H 1 8.308 0.004 . 1 . . . . . 235 ASP H . 26016 1 1013 . 1 1 81 81 ASP HA H 1 4.525 0.013 . 1 . . . . . 235 ASP HA . 26016 1 1014 . 1 1 81 81 ASP HB2 H 1 2.96 0.015 . 2 . . . . . 235 ASP HB2 . 26016 1 1015 . 1 1 81 81 ASP HB3 H 1 2.631 0.021 . 2 . . . . . 235 ASP HB3 . 26016 1 1016 . 1 1 81 81 ASP C C 13 177.012 0 . 1 . . . . . 235 ASP C . 26016 1 1017 . 1 1 81 81 ASP CA C 13 57.083 0.074 . 1 . . . . . 235 ASP CA . 26016 1 1018 . 1 1 81 81 ASP CB C 13 41.462 0.073 . 1 . . . . . 235 ASP CB . 26016 1 1019 . 1 1 81 81 ASP N N 15 122.063 0.034 . 1 . . . . . 235 ASP N . 26016 1 1020 . 1 1 82 82 LYS H H 1 7.325 0.003 . 1 . . . . . 236 LYS H . 26016 1 1021 . 1 1 82 82 LYS HA H 1 3.849 0.012 . 1 . . . . . 236 LYS HA . 26016 1 1022 . 1 1 82 82 LYS HB2 H 1 1.869 0.008 . 2 . . . . . 236 LYS HB* . 26016 1 1023 . 1 1 82 82 LYS HB3 H 1 1.869 0.008 . 2 . . . . . 236 LYS HB* . 26016 1 1024 . 1 1 82 82 LYS HG2 H 1 1.428 0.005 . 2 . . . . . 236 LYS HG* . 26016 1 1025 . 1 1 82 82 LYS HG3 H 1 1.428 0.005 . 2 . . . . . 236 LYS HG* . 26016 1 1026 . 1 1 82 82 LYS HD2 H 1 1.664 0.004 . 2 . . . . . 236 LYS HD* . 26016 1 1027 . 1 1 82 82 LYS HD3 H 1 1.664 0.004 . 2 . . . . . 236 LYS HD* . 26016 1 1028 . 1 1 82 82 LYS HE2 H 1 2.983 0.008 . 2 . . . . . 236 LYS HE* . 26016 1 1029 . 1 1 82 82 LYS HE3 H 1 2.983 0.008 . 2 . . . . . 236 LYS HE* . 26016 1 1030 . 1 1 82 82 LYS C C 13 175.907 0 . 1 . . . . . 236 LYS C . 26016 1 1031 . 1 1 82 82 LYS CA C 13 59.411 0.112 . 1 . . . . . 236 LYS CA . 26016 1 1032 . 1 1 82 82 LYS CB C 13 31.738 0.062 . 1 . . . . . 236 LYS CB . 26016 1 1033 . 1 1 82 82 LYS CG C 13 24.454 0.022 . 1 . . . . . 236 LYS CG . 26016 1 1034 . 1 1 82 82 LYS CD C 13 29.08 0 . 1 . . . . . 236 LYS CD . 26016 1 1035 . 1 1 82 82 LYS CE C 13 42.217 0 . 1 . . . . . 236 LYS CE . 26016 1 1036 . 1 1 82 82 LYS N N 15 117.96 0.055 . 1 . . . . . 236 LYS N . 26016 1 1037 . 1 1 83 83 ASP H H 1 7.323 0.003 . 1 . . . . . 237 ASP H . 26016 1 1038 . 1 1 83 83 ASP HA H 1 4.99 0.01 . 1 . . . . . 237 ASP HA . 26016 1 1039 . 1 1 83 83 ASP HB2 H 1 3.001 0.01 . 2 . . . . . 237 ASP HB2 . 26016 1 1040 . 1 1 83 83 ASP HB3 H 1 2.556 0.012 . 2 . . . . . 237 ASP HB3 . 26016 1 1041 . 1 1 83 83 ASP C C 13 176.423 0 . 1 . . . . . 237 ASP C . 26016 1 1042 . 1 1 83 83 ASP CA C 13 54.403 0.073 . 1 . . . . . 237 ASP CA . 26016 1 1043 . 1 1 83 83 ASP CB C 13 41.434 0.137 . 1 . . . . . 237 ASP CB . 26016 1 1044 . 1 1 83 83 ASP N N 15 116.287 0.078 . 1 . . . . . 237 ASP N . 26016 1 1045 . 1 1 84 84 ARG H H 1 7.732 0.005 . 1 . . . . . 238 ARG H . 26016 1 1046 . 1 1 84 84 ARG HA H 1 4.792 0.008 . 1 . . . . . 238 ARG HA . 26016 1 1047 . 1 1 84 84 ARG HB2 H 1 2.059 0 . 2 . . . . . 238 ARG HB2 . 26016 1 1048 . 1 1 84 84 ARG HB3 H 1 1.897 0.009 . 2 . . . . . 238 ARG HB3 . 26016 1 1049 . 1 1 84 84 ARG HG2 H 1 1.938 0.011 . 2 . . . . . 238 ARG HG2 . 26016 1 1050 . 1 1 84 84 ARG HG3 H 1 1.558 0.007 . 2 . . . . . 238 ARG HG3 . 26016 1 1051 . 1 1 84 84 ARG HD2 H 1 3.142 0.014 . 2 . . . . . 238 ARG HD* . 26016 1 1052 . 1 1 84 84 ARG HD3 H 1 3.142 0.014 . 2 . . . . . 238 ARG HD* . 26016 1 1053 . 1 1 84 84 ARG HE H 1 6.439 0.002 . 1 . . . . . 238 ARG HE . 26016 1 1054 . 1 1 84 84 ARG C C 13 175.129 0 . 1 . . . . . 238 ARG C . 26016 1 1055 . 1 1 84 84 ARG CA C 13 57.165 0.171 . 1 . . . . . 238 ARG CA . 26016 1 1056 . 1 1 84 84 ARG CB C 13 33.225 0.067 . 1 . . . . . 238 ARG CB . 26016 1 1057 . 1 1 84 84 ARG CG C 13 28.829 0 . 1 . . . . . 238 ARG CG . 26016 1 1058 . 1 1 84 84 ARG CD C 13 45.551 0.109 . 1 . . . . . 238 ARG CD . 26016 1 1059 . 1 1 84 84 ARG CZ C 13 160.549 0 . 1 . . . . . 238 ARG CZ . 26016 1 1060 . 1 1 84 84 ARG N N 15 119.554 0.02 . 1 . . . . . 238 ARG N . 26016 1 1061 . 1 1 84 84 ARG NE N 15 83.097 0.015 . 1 . . . . . 238 ARG NE . 26016 1 1062 . 1 1 85 85 ARG H H 1 9.027 0.013 . 1 . . . . . 239 ARG H . 26016 1 1063 . 1 1 85 85 ARG HA H 1 5.036 0.013 . 1 . . . . . 239 ARG HA . 26016 1 1064 . 1 1 85 85 ARG HB2 H 1 1.48 0.029 . 2 . . . . . 239 ARG HB2 . 26016 1 1065 . 1 1 85 85 ARG HB3 H 1 1.286 0.023 . 2 . . . . . 239 ARG HB3 . 26016 1 1066 . 1 1 85 85 ARG HG2 H 1 1.666 0.013 . 2 . . . . . 239 ARG HG2 . 26016 1 1067 . 1 1 85 85 ARG HE H 1 7.332 0.006 . 1 . . . . . 239 ARG HE . 26016 1 1068 . 1 1 85 85 ARG C C 13 175.041 0 . 1 . . . . . 239 ARG C . 26016 1 1069 . 1 1 85 85 ARG CA C 13 55.072 0.206 . 1 . . . . . 239 ARG CA . 26016 1 1070 . 1 1 85 85 ARG CB C 13 32.846 0.09 . 1 . . . . . 239 ARG CB . 26016 1 1071 . 1 1 85 85 ARG CD C 13 42.441 0 . 1 . . . . . 239 ARG CD . 26016 1 1072 . 1 1 85 85 ARG N N 15 116.965 0.089 . 1 . . . . . 239 ARG N . 26016 1 1073 . 1 1 85 85 ARG NE N 15 84.451 0 . 1 . . . . . 239 ARG NE . 26016 1 1074 . 1 1 86 86 LEU H H 1 9.243 0.005 . 1 . . . . . 240 LEU H . 26016 1 1075 . 1 1 86 86 LEU HA H 1 4.525 0.009 . 1 . . . . . 240 LEU HA . 26016 1 1076 . 1 1 86 86 LEU HB2 H 1 1.647 0.021 . 2 . . . . . 240 LEU HB2 . 26016 1 1077 . 1 1 86 86 LEU HB3 H 1 0.804 0.013 . 2 . . . . . 240 LEU HB3 . 26016 1 1078 . 1 1 86 86 LEU HG H 1 1.264 0.014 . 1 . . . . . 240 LEU HG . 26016 1 1079 . 1 1 86 86 LEU HD11 H 1 0.52 0.01 . 2 . . . . . 240 LEU HD1 . 26016 1 1080 . 1 1 86 86 LEU HD12 H 1 0.52 0.01 . 2 . . . . . 240 LEU HD1 . 26016 1 1081 . 1 1 86 86 LEU HD13 H 1 0.52 0.01 . 2 . . . . . 240 LEU HD1 . 26016 1 1082 . 1 1 86 86 LEU HD21 H 1 0.37 0.007 . 2 . . . . . 240 LEU HD2 . 26016 1 1083 . 1 1 86 86 LEU HD22 H 1 0.37 0.007 . 2 . . . . . 240 LEU HD2 . 26016 1 1084 . 1 1 86 86 LEU HD23 H 1 0.37 0.007 . 2 . . . . . 240 LEU HD2 . 26016 1 1085 . 1 1 86 86 LEU C C 13 174.273 0 . 1 . . . . . 240 LEU C . 26016 1 1086 . 1 1 86 86 LEU CA C 13 53.989 0.208 . 1 . . . . . 240 LEU CA . 26016 1 1087 . 1 1 86 86 LEU CB C 13 42.583 0.131 . 1 . . . . . 240 LEU CB . 26016 1 1088 . 1 1 86 86 LEU CG C 13 27.445 0.037 . 1 . . . . . 240 LEU CG . 26016 1 1089 . 1 1 86 86 LEU CD1 C 13 26.533 0 . 2 . . . . . 240 LEU CD1 . 26016 1 1090 . 1 1 86 86 LEU CD2 C 13 22.321 0.035 . 2 . . . . . 240 LEU CD2 . 26016 1 1091 . 1 1 86 86 LEU N N 15 122.287 0.082 . 1 . . . . . 240 LEU N . 26016 1 1092 . 1 1 87 87 SER H H 1 9.447 0.005 . 1 . . . . . 241 SER H . 26016 1 1093 . 1 1 87 87 SER HA H 1 4.57 0.011 . 1 . . . . . 241 SER HA . 26016 1 1094 . 1 1 87 87 SER HB2 H 1 3.663 0.012 . 2 . . . . . 241 SER HB2 . 26016 1 1095 . 1 1 87 87 SER HB3 H 1 3.547 0.004 . 2 . . . . . 241 SER HB3 . 26016 1 1096 . 1 1 87 87 SER C C 13 172.834 0 . 1 . . . . . 241 SER C . 26016 1 1097 . 1 1 87 87 SER CA C 13 56.532 0.076 . 1 . . . . . 241 SER CA . 26016 1 1098 . 1 1 87 87 SER CB C 13 64.043 0.133 . 1 . . . . . 241 SER CB . 26016 1 1099 . 1 1 87 87 SER N N 15 123.757 0.062 . 1 . . . . . 241 SER N . 26016 1 1100 . 1 1 88 88 VAL H H 1 8.361 0.004 . 1 . . . . . 242 VAL H . 26016 1 1101 . 1 1 88 88 VAL HA H 1 4.432 0.013 . 1 . . . . . 242 VAL HA . 26016 1 1102 . 1 1 88 88 VAL HB H 1 1.878 0.012 . 1 . . . . . 242 VAL HB . 26016 1 1103 . 1 1 88 88 VAL HG11 H 1 0.539 0.012 . 2 . . . . . 242 VAL HG1 . 26016 1 1104 . 1 1 88 88 VAL HG12 H 1 0.539 0.012 . 2 . . . . . 242 VAL HG1 . 26016 1 1105 . 1 1 88 88 VAL HG13 H 1 0.539 0.012 . 2 . . . . . 242 VAL HG1 . 26016 1 1106 . 1 1 88 88 VAL HG21 H 1 0.639 0.016 . 2 . . . . . 242 VAL HG2 . 26016 1 1107 . 1 1 88 88 VAL HG22 H 1 0.639 0.016 . 2 . . . . . 242 VAL HG2 . 26016 1 1108 . 1 1 88 88 VAL HG23 H 1 0.639 0.016 . 2 . . . . . 242 VAL HG2 . 26016 1 1109 . 1 1 88 88 VAL C C 13 173.981 0 . 1 . . . . . 242 VAL C . 26016 1 1110 . 1 1 88 88 VAL CA C 13 61.34 0.198 . 1 . . . . . 242 VAL CA . 26016 1 1111 . 1 1 88 88 VAL CB C 13 33.015 0.066 . 1 . . . . . 242 VAL CB . 26016 1 1112 . 1 1 88 88 VAL CG1 C 13 20.924 0.018 . 2 . . . . . 242 VAL CG1 . 26016 1 1113 . 1 1 88 88 VAL CG2 C 13 19.11 0.068 . 2 . . . . . 242 VAL CG2 . 26016 1 1114 . 1 1 88 88 VAL N N 15 128.303 0.019 . 1 . . . . . 242 VAL N . 26016 1 1115 . 1 1 89 89 GLU H H 1 8.736 0.006 . 1 . . . . . 243 GLU H . 26016 1 1116 . 1 1 89 89 GLU HA H 1 4.783 0.01 . 1 . . . . . 243 GLU HA . 26016 1 1117 . 1 1 89 89 GLU HB2 H 1 1.91 0.012 . 2 . . . . . 243 GLU HB2 . 26016 1 1118 . 1 1 89 89 GLU HB3 H 1 1.55 0.012 . 2 . . . . . 243 GLU HB3 . 26016 1 1119 . 1 1 89 89 GLU HG2 H 1 2.553 0.001 . 2 . . . . . 243 GLU HG2 . 26016 1 1120 . 1 1 89 89 GLU HG3 H 1 2.352 0.004 . 2 . . . . . 243 GLU HG3 . 26016 1 1121 . 1 1 89 89 GLU C C 13 174.467 0 . 1 . . . . . 243 GLU C . 26016 1 1122 . 1 1 89 89 GLU CA C 13 53.734 0.071 . 1 . . . . . 243 GLU CA . 26016 1 1123 . 1 1 89 89 GLU CB C 13 34.877 0 . 1 . . . . . 243 GLU CB . 26016 1 1124 . 1 1 89 89 GLU CG C 13 35.101 0 . 1 . . . . . 243 GLU CG . 26016 1 1125 . 1 1 89 89 GLU N N 15 121.517 0.034 . 1 . . . . . 243 GLU N . 26016 1 1126 . 1 1 90 90 ILE H H 1 9.172 0.01 . 1 . . . . . 244 ILE H . 26016 1 1127 . 1 1 90 90 ILE HA H 1 4.859 0.011 . 1 . . . . . 244 ILE HA . 26016 1 1128 . 1 1 90 90 ILE HB H 1 1.421 0.022 . 1 . . . . . 244 ILE HB . 26016 1 1129 . 1 1 90 90 ILE HG12 H 1 1.362 0.012 . 2 . . . . . 244 ILE HG1* . 26016 1 1130 . 1 1 90 90 ILE HG13 H 1 1.362 0.012 . 2 . . . . . 244 ILE HG1* . 26016 1 1131 . 1 1 90 90 ILE HG21 H 1 0.976 0.014 . 1 . . . . . 244 ILE HG2 . 26016 1 1132 . 1 1 90 90 ILE HG22 H 1 0.976 0.014 . 1 . . . . . 244 ILE HG2 . 26016 1 1133 . 1 1 90 90 ILE HG23 H 1 0.976 0.014 . 1 . . . . . 244 ILE HG2 . 26016 1 1134 . 1 1 90 90 ILE HD11 H 1 0.827 0.011 . 1 . . . . . 244 ILE HD1 . 26016 1 1135 . 1 1 90 90 ILE HD12 H 1 0.827 0.011 . 1 . . . . . 244 ILE HD1 . 26016 1 1136 . 1 1 90 90 ILE HD13 H 1 0.827 0.011 . 1 . . . . . 244 ILE HD1 . 26016 1 1137 . 1 1 90 90 ILE C C 13 173.966 0 . 1 . . . . . 244 ILE C . 26016 1 1138 . 1 1 90 90 ILE CA C 13 60.6 0.153 . 1 . . . . . 244 ILE CA . 26016 1 1139 . 1 1 90 90 ILE CB C 13 37.59 0.05 . 1 . . . . . 244 ILE CB . 26016 1 1140 . 1 1 90 90 ILE CG1 C 13 27.956 0.072 . 1 . . . . . 244 ILE CG1 . 26016 1 1141 . 1 1 90 90 ILE CG2 C 13 19.198 0.045 . 1 . . . . . 244 ILE CG2 . 26016 1 1142 . 1 1 90 90 ILE CD1 C 13 16.233 0.032 . 1 . . . . . 244 ILE CD1 . 26016 1 1143 . 1 1 90 90 ILE N N 15 122.102 0.051 . 1 . . . . . 244 ILE N . 26016 1 1144 . 1 1 91 91 TRP H H 1 8.677 0.006 . 1 . . . . . 245 TRP H . 26016 1 1145 . 1 1 91 91 TRP HA H 1 4.481 0.012 . 1 . . . . . 245 TRP HA . 26016 1 1146 . 1 1 91 91 TRP HB2 H 1 2.772 0.022 . 2 . . . . . 245 TRP HB* . 26016 1 1147 . 1 1 91 91 TRP HB3 H 1 2.772 0.022 . 2 . . . . . 245 TRP HB* . 26016 1 1148 . 1 1 91 91 TRP HD1 H 1 6.695 0.011 . 1 . . . . . 245 TRP HD1 . 26016 1 1149 . 1 1 91 91 TRP HE1 H 1 11.11 0.005 . 1 . . . . . 245 TRP HE1 . 26016 1 1150 . 1 1 91 91 TRP HZ2 H 1 7.582 0.004 . 1 . . . . . 245 TRP HZ2 . 26016 1 1151 . 1 1 91 91 TRP HH2 H 1 7.321 0 . 1 . . . . . 245 TRP HH2 . 26016 1 1152 . 1 1 91 91 TRP C C 13 171.921 0 . 1 . . . . . 245 TRP C . 26016 1 1153 . 1 1 91 91 TRP CA C 13 55.543 0 . 1 . . . . . 245 TRP CA . 26016 1 1154 . 1 1 91 91 TRP CB C 13 33.147 0.098 . 1 . . . . . 245 TRP CB . 26016 1 1155 . 1 1 91 91 TRP CD1 C 13 124.764 0 . 1 . . . . . 245 TRP CD1 . 26016 1 1156 . 1 1 91 91 TRP CE2 C 13 138.947 0 . 1 . . . . . 245 TRP CE2 . 26016 1 1157 . 1 1 91 91 TRP CZ2 C 13 114.758 0 . 1 . . . . . 245 TRP CZ2 . 26016 1 1158 . 1 1 91 91 TRP CH2 C 13 124.779 0 . 1 . . . . . 245 TRP CH2 . 26016 1 1159 . 1 1 91 91 TRP N N 15 128.015 0.078 . 1 . . . . . 245 TRP N . 26016 1 1160 . 1 1 91 91 TRP NE1 N 15 132.495 0.01 . 1 . . . . . 245 TRP NE1 . 26016 1 1161 . 1 1 92 92 ASP H H 1 9.479 0.011 . 1 . . . . . 246 ASP H . 26016 1 1162 . 1 1 92 92 ASP HA H 1 4.849 0.01 . 1 . . . . . 246 ASP HA . 26016 1 1163 . 1 1 92 92 ASP HB2 H 1 2.734 0.012 . 2 . . . . . 246 ASP HB2 . 26016 1 1164 . 1 1 92 92 ASP HB3 H 1 3.321 0 . 2 . . . . . 246 ASP HB3 . 26016 1 1165 . 1 1 92 92 ASP C C 13 175.903 0 . 1 . . . . . 246 ASP C . 26016 1 1166 . 1 1 92 92 ASP CA C 13 52.163 0.273 . 1 . . . . . 246 ASP CA . 26016 1 1167 . 1 1 92 92 ASP CB C 13 42.559 0.058 . 1 . . . . . 246 ASP CB . 26016 1 1168 . 1 1 92 92 ASP N N 15 119.21 0.052 . 1 . . . . . 246 ASP N . 26016 1 1169 . 1 1 93 93 TRP H H 1 9.582 0.006 . 1 . . . . . 247 TRP H . 26016 1 1170 . 1 1 93 93 TRP HA H 1 4.489 0.007 . 1 . . . . . 247 TRP HA . 26016 1 1171 . 1 1 93 93 TRP HB2 H 1 3.969 0 . 2 . . . . . 247 TRP HB2 . 26016 1 1172 . 1 1 93 93 TRP HB3 H 1 3.597 0 . 2 . . . . . 247 TRP HB3 . 26016 1 1173 . 1 1 93 93 TRP HD1 H 1 7.24 0.007 . 1 . . . . . 247 TRP HD1 . 26016 1 1174 . 1 1 93 93 TRP HE1 H 1 10.13 0.005 . 1 . . . . . 247 TRP HE1 . 26016 1 1175 . 1 1 93 93 TRP HZ2 H 1 7.412 0.005 . 1 . . . . . 247 TRP HZ2 . 26016 1 1176 . 1 1 93 93 TRP HZ3 H 1 6.986 0.001 . 1 . . . . . 247 TRP HZ3 . 26016 1 1177 . 1 1 93 93 TRP HH2 H 1 7.138 0 . 1 . . . . . 247 TRP HH2 . 26016 1 1178 . 1 1 93 93 TRP C C 13 175.758 0 . 1 . . . . . 247 TRP C . 26016 1 1179 . 1 1 93 93 TRP CB C 13 29.775 0 . 1 . . . . . 247 TRP CB . 26016 1 1180 . 1 1 93 93 TRP CD1 C 13 127.416 0 . 1 . . . . . 247 TRP CD1 . 26016 1 1181 . 1 1 93 93 TRP CE2 C 13 138.823 0 . 1 . . . . . 247 TRP CE2 . 26016 1 1182 . 1 1 93 93 TRP CZ2 C 13 114.139 0 . 1 . . . . . 247 TRP CZ2 . 26016 1 1183 . 1 1 93 93 TRP CZ3 C 13 121.483 0 . 1 . . . . . 247 TRP CZ3 . 26016 1 1184 . 1 1 93 93 TRP CH2 C 13 124.334 0 . 1 . . . . . 247 TRP CH2 . 26016 1 1185 . 1 1 93 93 TRP N N 15 127.377 0.053 . 1 . . . . . 247 TRP N . 26016 1 1186 . 1 1 93 93 TRP NE1 N 15 130.549 0.029 . 1 . . . . . 247 TRP NE1 . 26016 1 1187 . 1 1 94 94 ASP H H 1 7.697 0.019 . 1 . . . . . 248 ASP H . 26016 1 1188 . 1 1 94 94 ASP HA H 1 4.479 0.029 . 1 . . . . . 248 ASP HA . 26016 1 1189 . 1 1 94 94 ASP HB2 H 1 2.538 0.006 . 2 . . . . . 248 ASP HB* . 26016 1 1190 . 1 1 94 94 ASP HB3 H 1 2.538 0.006 . 2 . . . . . 248 ASP HB* . 26016 1 1191 . 1 1 94 94 ASP C C 13 173.15 0 . 1 . . . . . 248 ASP C . 26016 1 1192 . 1 1 94 94 ASP N N 15 130.25 0.176 . 1 . . . . . 248 ASP N . 26016 1 1193 . 1 1 95 95 ARG H H 1 7.722 0.007 . 1 . . . . . 249 ARG H . 26016 1 1194 . 1 1 95 95 ARG HA H 1 4.787 0.001 . 1 . . . . . 249 ARG HA . 26016 1 1195 . 1 1 95 95 ARG HB2 H 1 1.722 0.004 . 2 . . . . . 249 ARG HB2 . 26016 1 1196 . 1 1 95 95 ARG HB3 H 1 1.551 0.008 . 2 . . . . . 249 ARG HB3 . 26016 1 1197 . 1 1 95 95 ARG HD2 H 1 3.669 0.001 . 2 . . . . . 249 ARG HD2 . 26016 1 1198 . 1 1 95 95 ARG HE H 1 7.119 0.004 . 1 . . . . . 249 ARG HE . 26016 1 1199 . 1 1 95 95 ARG CG C 13 27.524 0 . 1 . . . . . 249 ARG CG . 26016 1 1200 . 1 1 95 95 ARG CD C 13 42.451 0 . 1 . . . . . 249 ARG CD . 26016 1 1201 . 1 1 95 95 ARG CZ C 13 159.406 0 . 1 . . . . . 249 ARG CZ . 26016 1 1202 . 1 1 95 95 ARG N N 15 117.931 0.059 . 1 . . . . . 249 ARG N . 26016 1 1203 . 1 1 95 95 ARG NE N 15 84.043 0.029 . 1 . . . . . 249 ARG NE . 26016 1 1204 . 1 1 96 96 THR H H 1 8.007 0.008 . 1 . . . . . 250 THR H . 26016 1 1205 . 1 1 96 96 THR HG21 H 1 1.183 0 . 1 . . . . . 250 THR HG2 . 26016 1 1206 . 1 1 96 96 THR HG22 H 1 1.183 0 . 1 . . . . . 250 THR HG2 . 26016 1 1207 . 1 1 96 96 THR HG23 H 1 1.183 0 . 1 . . . . . 250 THR HG2 . 26016 1 1208 . 1 1 96 96 THR N N 15 109.614 0.054 . 1 . . . . . 250 THR N . 26016 1 1209 . 1 1 97 97 THR H H 1 7.247 0 . 1 . . . . . 251 THR H . 26016 1 1210 . 1 1 97 97 THR HA H 1 4.306 0.019 . 1 . . . . . 251 THR HA . 26016 1 1211 . 1 1 97 97 THR HB H 1 4.403 0.009 . 1 . . . . . 251 THR HB . 26016 1 1212 . 1 1 97 97 THR HG21 H 1 1.183 0.015 . 1 . . . . . 251 THR HG2 . 26016 1 1213 . 1 1 97 97 THR HG22 H 1 1.183 0.015 . 1 . . . . . 251 THR HG2 . 26016 1 1214 . 1 1 97 97 THR HG23 H 1 1.183 0.015 . 1 . . . . . 251 THR HG2 . 26016 1 1215 . 1 1 97 97 THR C C 13 175.816 0 . 1 . . . . . 251 THR C . 26016 1 1216 . 1 1 97 97 THR CB C 13 69.776 0.177 . 1 . . . . . 251 THR CB . 26016 1 1217 . 1 1 97 97 THR CG2 C 13 21.894 0.072 . 1 . . . . . 251 THR CG2 . 26016 1 1218 . 1 1 97 97 THR N N 15 110.685 0.013 . 1 . . . . . 251 THR N . 26016 1 1219 . 1 1 98 98 ARG H H 1 7.963 0.011 . 1 . . . . . 252 ARG H . 26016 1 1220 . 1 1 98 98 ARG HA H 1 4.295 0.053 . 1 . . . . . 252 ARG HA . 26016 1 1221 . 1 1 98 98 ARG HB2 H 1 1.79 0.004 . 2 . . . . . 252 ARG HB* . 26016 1 1222 . 1 1 98 98 ARG HB3 H 1 1.79 0.004 . 2 . . . . . 252 ARG HB* . 26016 1 1223 . 1 1 98 98 ARG HG2 H 1 1.58 0.011 . 2 . . . . . 252 ARG HG2 . 26016 1 1224 . 1 1 98 98 ARG HD2 H 1 3.168 0.012 . 2 . . . . . 252 ARG HD* . 26016 1 1225 . 1 1 98 98 ARG HD3 H 1 3.168 0.012 . 2 . . . . . 252 ARG HD* . 26016 1 1226 . 1 1 98 98 ARG HE H 1 7.253 0.002 . 1 . . . . . 252 ARG HE . 26016 1 1227 . 1 1 98 98 ARG C C 13 176.865 0 . 1 . . . . . 252 ARG C . 26016 1 1228 . 1 1 98 98 ARG CA C 13 56.542 0 . 1 . . . . . 252 ARG CA . 26016 1 1229 . 1 1 98 98 ARG CB C 13 30.747 0.103 . 1 . . . . . 252 ARG CB . 26016 1 1230 . 1 1 98 98 ARG CG C 13 27.024 0.04 . 1 . . . . . 252 ARG CG . 26016 1 1231 . 1 1 98 98 ARG CD C 13 43.365 0.033 . 1 . . . . . 252 ARG CD . 26016 1 1232 . 1 1 98 98 ARG N N 15 120.055 0.156 . 1 . . . . . 252 ARG N . 26016 1 1233 . 1 1 98 98 ARG NE N 15 84.971 0.016 . 1 . . . . . 252 ARG NE . 26016 1 1234 . 1 1 99 99 ASN H H 1 8.47 0.017 . 1 . . . . . 253 ASN H . 26016 1 1235 . 1 1 99 99 ASN HA H 1 4.953 0.011 . 1 . . . . . 253 ASN HA . 26016 1 1236 . 1 1 99 99 ASN HB2 H 1 2.744 0.008 . 2 . . . . . 253 ASN HB2 . 26016 1 1237 . 1 1 99 99 ASN HD21 H 1 7.653 0.001 . 2 . . . . . 253 ASN HD21 . 26016 1 1238 . 1 1 99 99 ASN HD22 H 1 6.817 0.006 . 2 . . . . . 253 ASN HD22 . 26016 1 1239 . 1 1 99 99 ASN C C 13 174.451 0 . 1 . . . . . 253 ASN C . 26016 1 1240 . 1 1 99 99 ASN CA C 13 56.227 0.066 . 1 . . . . . 253 ASN CA . 26016 1 1241 . 1 1 99 99 ASN CB C 13 30.009 0 . 1 . . . . . 253 ASN CB . 26016 1 1242 . 1 1 99 99 ASN N N 15 122.887 0.198 . 1 . . . . . 253 ASN N . 26016 1 1243 . 1 1 99 99 ASN ND2 N 15 113.493 0.013 . 1 . . . . . 253 ASN ND2 . 26016 1 1244 . 1 1 100 100 ASP H H 1 8.547 0.012 . 1 . . . . . 254 ASP H . 26016 1 1245 . 1 1 100 100 ASP HA H 1 5.267 0 . 1 . . . . . 254 ASP HA . 26016 1 1246 . 1 1 100 100 ASP HB2 H 1 3.268 0 . 2 . . . . . 254 ASP HB2 . 26016 1 1247 . 1 1 100 100 ASP HB3 H 1 3.137 0 . 2 . . . . . 254 ASP HB3 . 26016 1 1248 . 1 1 100 100 ASP C C 13 175.185 0 . 1 . . . . . 254 ASP C . 26016 1 1249 . 1 1 100 100 ASP N N 15 120.561 0.084 . 1 . . . . . 254 ASP N . 26016 1 1250 . 1 1 101 101 PHE H H 1 8.896 0.023 . 1 . . . . . 255 PHE H . 26016 1 1251 . 1 1 101 101 PHE HA H 1 4.476 0 . 1 . . . . . 255 PHE HA . 26016 1 1252 . 1 1 101 101 PHE HB2 H 1 2.784 0.01 . 2 . . . . . 255 PHE HB2 . 26016 1 1253 . 1 1 101 101 PHE HD1 H 1 6.243 0.01 . 3 . . . . . 255 PHE HD* . 26016 1 1254 . 1 1 101 101 PHE HD2 H 1 6.243 0.01 . 3 . . . . . 255 PHE HD* . 26016 1 1255 . 1 1 101 101 PHE HE1 H 1 6.869 0.004 . 3 . . . . . 255 PHE HE* . 26016 1 1256 . 1 1 101 101 PHE HE2 H 1 6.869 0.004 . 3 . . . . . 255 PHE HE* . 26016 1 1257 . 1 1 101 101 PHE HZ H 1 7.303 0.008 . 1 . . . . . 255 PHE HZ . 26016 1 1258 . 1 1 101 101 PHE C C 13 174.625 0 . 1 . . . . . 255 PHE C . 26016 1 1259 . 1 1 101 101 PHE CA C 13 60.244 0 . 1 . . . . . 255 PHE CA . 26016 1 1260 . 1 1 101 101 PHE CB C 13 38.946 0 . 1 . . . . . 255 PHE CB . 26016 1 1261 . 1 1 101 101 PHE CD1 C 13 131.754 0 . 3 . . . . . 255 PHE CD* . 26016 1 1262 . 1 1 101 101 PHE CD2 C 13 131.754 0 . 3 . . . . . 255 PHE CD* . 26016 1 1263 . 1 1 101 101 PHE N N 15 127.065 0.083 . 1 . . . . . 255 PHE N . 26016 1 1264 . 1 1 102 102 MET H H 1 7.624 0.006 . 1 . . . . . 256 MET H . 26016 1 1265 . 1 1 102 102 MET HA H 1 4.21 0.003 . 1 . . . . . 256 MET HA . 26016 1 1266 . 1 1 102 102 MET HB2 H 1 2.158 0.004 . 2 . . . . . 256 MET HB* . 26016 1 1267 . 1 1 102 102 MET HB3 H 1 2.158 0.004 . 2 . . . . . 256 MET HB* . 26016 1 1268 . 1 1 102 102 MET HE1 H 1 2.173 0.002 . 1 . . . . . 256 MET HE* . 26016 1 1269 . 1 1 102 102 MET HE2 H 1 2.173 0.002 . 1 . . . . . 256 MET HE* . 26016 1 1270 . 1 1 102 102 MET HE3 H 1 2.173 0.002 . 1 . . . . . 256 MET HE* . 26016 1 1271 . 1 1 102 102 MET C C 13 176.877 0 . 1 . . . . . 256 MET C . 26016 1 1272 . 1 1 102 102 MET CA C 13 56.985 0.023 . 1 . . . . . 256 MET CA . 26016 1 1273 . 1 1 102 102 MET CB C 13 32.496 0.059 . 1 . . . . . 256 MET CB . 26016 1 1274 . 1 1 102 102 MET CE C 13 19.104 0 . 1 . . . . . 256 MET CE . 26016 1 1275 . 1 1 102 102 MET N N 15 122.52 0.043 . 1 . . . . . 256 MET N . 26016 1 1276 . 1 1 103 103 GLY H H 1 6.013 0.003 . 1 . . . . . 257 GLY H . 26016 1 1277 . 1 1 103 103 GLY HA2 H 1 3.952 0.002 . 2 . . . . . 257 GLY HA2 . 26016 1 1278 . 1 1 103 103 GLY HA3 H 1 3.739 0.008 . 2 . . . . . 257 GLY HA3 . 26016 1 1279 . 1 1 103 103 GLY C C 13 170.675 0 . 1 . . . . . 257 GLY C . 26016 1 1280 . 1 1 103 103 GLY CA C 13 47.002 0.34 . 1 . . . . . 257 GLY CA . 26016 1 1281 . 1 1 103 103 GLY N N 15 107.427 0.026 . 1 . . . . . 257 GLY N . 26016 1 1282 . 1 1 104 104 SER H H 1 9.257 0.004 . 1 . . . . . 258 SER H . 26016 1 1283 . 1 1 104 104 SER HA H 1 5.492 0.015 . 1 . . . . . 258 SER HA . 26016 1 1284 . 1 1 104 104 SER HB2 H 1 4.299 0.009 . 2 . . . . . 258 SER HB2 . 26016 1 1285 . 1 1 104 104 SER HB3 H 1 4.089 0.019 . 2 . . . . . 258 SER HB3 . 26016 1 1286 . 1 1 104 104 SER C C 13 172.594 0 . 1 . . . . . 258 SER C . 26016 1 1287 . 1 1 104 104 SER CA C 13 57.478 0.053 . 1 . . . . . 258 SER CA . 26016 1 1288 . 1 1 104 104 SER CB C 13 68.005 0.073 . 1 . . . . . 258 SER CB . 26016 1 1289 . 1 1 104 104 SER N N 15 115.718 0.036 . 1 . . . . . 258 SER N . 26016 1 1290 . 1 1 105 105 LEU H H 1 8.721 0.005 . 1 . . . . . 259 LEU H . 26016 1 1291 . 1 1 105 105 LEU HA H 1 4.803 0.012 . 1 . . . . . 259 LEU HA . 26016 1 1292 . 1 1 105 105 LEU HB2 H 1 2.461 0.014 . 2 . . . . . 259 LEU HB2 . 26016 1 1293 . 1 1 105 105 LEU HB3 H 1 1.476 0.025 . 2 . . . . . 259 LEU HB3 . 26016 1 1294 . 1 1 105 105 LEU HG H 1 1.259 0.009 . 1 . . . . . 259 LEU HG . 26016 1 1295 . 1 1 105 105 LEU HD11 H 1 0.747 0.011 . 2 . . . . . 259 LEU HD1 . 26016 1 1296 . 1 1 105 105 LEU HD12 H 1 0.747 0.011 . 2 . . . . . 259 LEU HD1 . 26016 1 1297 . 1 1 105 105 LEU HD13 H 1 0.747 0.011 . 2 . . . . . 259 LEU HD1 . 26016 1 1298 . 1 1 105 105 LEU HD21 H 1 0.348 0.009 . 2 . . . . . 259 LEU HD2 . 26016 1 1299 . 1 1 105 105 LEU HD22 H 1 0.348 0.009 . 2 . . . . . 259 LEU HD2 . 26016 1 1300 . 1 1 105 105 LEU HD23 H 1 0.348 0.009 . 2 . . . . . 259 LEU HD2 . 26016 1 1301 . 1 1 105 105 LEU C C 13 175.009 0 . 1 . . . . . 259 LEU C . 26016 1 1302 . 1 1 105 105 LEU CA C 13 57.082 0.042 . 1 . . . . . 259 LEU CA . 26016 1 1303 . 1 1 105 105 LEU CB C 13 42.93 0.109 . 1 . . . . . 259 LEU CB . 26016 1 1304 . 1 1 105 105 LEU CG C 13 26.736 0.174 . 1 . . . . . 259 LEU CG . 26016 1 1305 . 1 1 105 105 LEU CD1 C 13 27.387 0.123 . 2 . . . . . 259 LEU CD1 . 26016 1 1306 . 1 1 105 105 LEU CD2 C 13 29.453 0.059 . 2 . . . . . 259 LEU CD2 . 26016 1 1307 . 1 1 105 105 LEU N N 15 111.307 0.029 . 1 . . . . . 259 LEU N . 26016 1 1308 . 1 1 106 106 SER H H 1 7.518 0.005 . 1 . . . . . 260 SER H . 26016 1 1309 . 1 1 106 106 SER HA H 1 5.295 0.013 . 1 . . . . . 260 SER HA . 26016 1 1310 . 1 1 106 106 SER HB2 H 1 4.098 0.009 . 2 . . . . . 260 SER HB2 . 26016 1 1311 . 1 1 106 106 SER HB3 H 1 3.347 0.001 . 2 . . . . . 260 SER HB3 . 26016 1 1312 . 1 1 106 106 SER C C 13 171.973 0 . 1 . . . . . 260 SER C . 26016 1 1313 . 1 1 106 106 SER CA C 13 57.55 0.07 . 1 . . . . . 260 SER CA . 26016 1 1314 . 1 1 106 106 SER CB C 13 66.073 0.071 . 1 . . . . . 260 SER CB . 26016 1 1315 . 1 1 106 106 SER N N 15 107.584 0.031 . 1 . . . . . 260 SER N . 26016 1 1316 . 1 1 107 107 PHE H H 1 8.423 0.006 . 1 . . . . . 261 PHE H . 26016 1 1317 . 1 1 107 107 PHE HA H 1 4.604 0.016 . 1 . . . . . 261 PHE HA . 26016 1 1318 . 1 1 107 107 PHE HB2 H 1 2.867 0.015 . 2 . . . . . 261 PHE HB2 . 26016 1 1319 . 1 1 107 107 PHE HB3 H 1 2.359 0.01 . 2 . . . . . 261 PHE HB3 . 26016 1 1320 . 1 1 107 107 PHE HD1 H 1 6.851 0.01 . 3 . . . . . 261 PHE HD* . 26016 1 1321 . 1 1 107 107 PHE HD2 H 1 6.851 0.01 . 3 . . . . . 261 PHE HD* . 26016 1 1322 . 1 1 107 107 PHE HE1 H 1 6.597 0.01 . 3 . . . . . 261 PHE HE* . 26016 1 1323 . 1 1 107 107 PHE HE2 H 1 6.597 0.01 . 3 . . . . . 261 PHE HE* . 26016 1 1324 . 1 1 107 107 PHE HZ H 1 6.291 0.003 . 1 . . . . . 261 PHE HZ . 26016 1 1325 . 1 1 107 107 PHE C C 13 176.395 0 . 1 . . . . . 261 PHE C . 26016 1 1326 . 1 1 107 107 PHE CA C 13 55.551 0.017 . 1 . . . . . 261 PHE CA . 26016 1 1327 . 1 1 107 107 PHE CB C 13 43.94 0.085 . 1 . . . . . 261 PHE CB . 26016 1 1328 . 1 1 107 107 PHE CD1 C 13 131.899 0 . 3 . . . . . 261 PHE CD . 26016 1 1329 . 1 1 107 107 PHE CD2 C 13 131.899 0 . 3 . . . . . 261 PHE CD . 26016 1 1330 . 1 1 107 107 PHE CE1 C 13 130.625 0 . 3 . . . . . 261 PHE CE . 26016 1 1331 . 1 1 107 107 PHE CE2 C 13 130.625 0 . 3 . . . . . 261 PHE CE . 26016 1 1332 . 1 1 107 107 PHE N N 15 114.258 0.062 . 1 . . . . . 261 PHE N . 26016 1 1333 . 1 1 108 108 GLY H H 1 9.603 0.004 . 1 . . . . . 262 GLY H . 26016 1 1334 . 1 1 108 108 GLY HA2 H 1 4.177 0.025 . 2 . . . . . 262 GLY HA2 . 26016 1 1335 . 1 1 108 108 GLY HA3 H 1 4.078 0.012 . 2 . . . . . 262 GLY HA3 . 26016 1 1336 . 1 1 108 108 GLY C C 13 174.967 0 . 1 . . . . . 262 GLY C . 26016 1 1337 . 1 1 108 108 GLY CA C 13 46.686 0.239 . 1 . . . . . 262 GLY CA . 26016 1 1338 . 1 1 108 108 GLY N N 15 111.982 0.029 . 1 . . . . . 262 GLY N . 26016 1 1339 . 1 1 109 109 VAL H H 1 8.691 0.003 . 1 . . . . . 263 VAL H . 26016 1 1340 . 1 1 109 109 VAL HA H 1 3.392 0.008 . 1 . . . . . 263 VAL HA . 26016 1 1341 . 1 1 109 109 VAL HB H 1 2.268 0.012 . 1 . . . . . 263 VAL HB . 26016 1 1342 . 1 1 109 109 VAL HG11 H 1 0.687 0.011 . 2 . . . . . 263 VAL HG1 . 26016 1 1343 . 1 1 109 109 VAL HG12 H 1 0.687 0.011 . 2 . . . . . 263 VAL HG1 . 26016 1 1344 . 1 1 109 109 VAL HG13 H 1 0.687 0.011 . 2 . . . . . 263 VAL HG1 . 26016 1 1345 . 1 1 109 109 VAL HG21 H 1 0.622 0.008 . 2 . . . . . 263 VAL HG2 . 26016 1 1346 . 1 1 109 109 VAL HG22 H 1 0.622 0.008 . 2 . . . . . 263 VAL HG2 . 26016 1 1347 . 1 1 109 109 VAL HG23 H 1 0.622 0.008 . 2 . . . . . 263 VAL HG2 . 26016 1 1348 . 1 1 109 109 VAL C C 13 177.897 0 . 1 . . . . . 263 VAL C . 26016 1 1349 . 1 1 109 109 VAL CA C 13 68.336 0.086 . 1 . . . . . 263 VAL CA . 26016 1 1350 . 1 1 109 109 VAL CB C 13 30.642 0.045 . 1 . . . . . 263 VAL CB . 26016 1 1351 . 1 1 109 109 VAL CG1 C 13 22.403 0.042 . 2 . . . . . 263 VAL CG1 . 26016 1 1352 . 1 1 109 109 VAL CG2 C 13 23.678 0 . 2 . . . . . 263 VAL CG2 . 26016 1 1353 . 1 1 109 109 VAL N N 15 128.463 0.044 . 1 . . . . . 263 VAL N . 26016 1 1354 . 1 1 110 110 SER H H 1 8.305 0.004 . 1 . . . . . 264 SER H . 26016 1 1355 . 1 1 110 110 SER HA H 1 4.307 0.009 . 1 . . . . . 264 SER HA . 26016 1 1356 . 1 1 110 110 SER HB2 H 1 4.02 0.007 . 2 . . . . . 264 SER HB* . 26016 1 1357 . 1 1 110 110 SER HB3 H 1 4.02 0.007 . 2 . . . . . 264 SER HB* . 26016 1 1358 . 1 1 110 110 SER C C 13 177.12 0 . 1 . . . . . 264 SER C . 26016 1 1359 . 1 1 110 110 SER CA C 13 61.822 0.264 . 1 . . . . . 264 SER CA . 26016 1 1360 . 1 1 110 110 SER N N 15 112.564 0.028 . 1 . . . . . 264 SER N . 26016 1 1361 . 1 1 111 111 GLU H H 1 7.025 0.002 . 1 . . . . . 265 GLU H . 26016 1 1362 . 1 1 111 111 GLU HA H 1 4.147 0.011 . 1 . . . . . 265 GLU HA . 26016 1 1363 . 1 1 111 111 GLU HB2 H 1 2.366 0.011 . 2 . . . . . 265 GLU HB* . 26016 1 1364 . 1 1 111 111 GLU HB3 H 1 2.366 0.011 . 2 . . . . . 265 GLU HB* . 26016 1 1365 . 1 1 111 111 GLU HG2 H 1 2.458 0.014 . 2 . . . . . 265 GLU HG2 . 26016 1 1366 . 1 1 111 111 GLU HG3 H 1 2.436 0.013 . 2 . . . . . 265 GLU HG3 . 26016 1 1367 . 1 1 111 111 GLU C C 13 178.688 0 . 1 . . . . . 265 GLU C . 26016 1 1368 . 1 1 111 111 GLU CA C 13 59.246 0.113 . 1 . . . . . 265 GLU CA . 26016 1 1369 . 1 1 111 111 GLU CB C 13 29.272 0.078 . 1 . . . . . 265 GLU CB . 26016 1 1370 . 1 1 111 111 GLU CG C 13 35.813 0 . 1 . . . . . 265 GLU CG . 26016 1 1371 . 1 1 111 111 GLU N N 15 122.859 0.021 . 1 . . . . . 265 GLU N . 26016 1 1372 . 1 1 112 112 LEU H H 1 7.783 0.007 . 1 . . . . . 266 LEU H . 26016 1 1373 . 1 1 112 112 LEU HA H 1 4.414 0.011 . 1 . . . . . 266 LEU HA . 26016 1 1374 . 1 1 112 112 LEU HB2 H 1 1.886 0.018 . 2 . . . . . 266 LEU HB2 . 26016 1 1375 . 1 1 112 112 LEU HB3 H 1 0.945 0.01 . 2 . . . . . 266 LEU HB3 . 26016 1 1376 . 1 1 112 112 LEU HG H 1 1.74 0.012 . 1 . . . . . 266 LEU HG . 26016 1 1377 . 1 1 112 112 LEU HD11 H 1 0.45 0.013 . 2 . . . . . 266 LEU HD1 . 26016 1 1378 . 1 1 112 112 LEU HD12 H 1 0.45 0.013 . 2 . . . . . 266 LEU HD1 . 26016 1 1379 . 1 1 112 112 LEU HD13 H 1 0.45 0.013 . 2 . . . . . 266 LEU HD1 . 26016 1 1380 . 1 1 112 112 LEU HD21 H 1 0.39 0.015 . 2 . . . . . 266 LEU HD2 . 26016 1 1381 . 1 1 112 112 LEU HD22 H 1 0.39 0.015 . 2 . . . . . 266 LEU HD2 . 26016 1 1382 . 1 1 112 112 LEU HD23 H 1 0.39 0.015 . 2 . . . . . 266 LEU HD2 . 26016 1 1383 . 1 1 112 112 LEU C C 13 178.533 0 . 1 . . . . . 266 LEU C . 26016 1 1384 . 1 1 112 112 LEU CA C 13 56.17 0.077 . 1 . . . . . 266 LEU CA . 26016 1 1385 . 1 1 112 112 LEU CB C 13 42.802 0.079 . 1 . . . . . 266 LEU CB . 26016 1 1386 . 1 1 112 112 LEU CG C 13 26.59 0.077 . 1 . . . . . 266 LEU CG . 26016 1 1387 . 1 1 112 112 LEU CD1 C 13 23.228 0.071 . 2 . . . . . 266 LEU CD1 . 26016 1 1388 . 1 1 112 112 LEU CD2 C 13 26.648 0.071 . 2 . . . . . 266 LEU CD2 . 26016 1 1389 . 1 1 112 112 LEU N N 15 119.943 0.037 . 1 . . . . . 266 LEU N . 26016 1 1390 . 1 1 113 113 MET H H 1 7.847 0.005 . 1 . . . . . 267 MET H . 26016 1 1391 . 1 1 113 113 MET HA H 1 3.896 0.011 . 1 . . . . . 267 MET HA . 26016 1 1392 . 1 1 113 113 MET HB2 H 1 2.418 0.012 . 2 . . . . . 267 MET HB2 . 26016 1 1393 . 1 1 113 113 MET HB3 H 1 2.138 0.004 . 2 . . . . . 267 MET HB3 . 26016 1 1394 . 1 1 113 113 MET HG2 H 1 2.783 0.01 . 2 . . . . . 267 MET HG* . 26016 1 1395 . 1 1 113 113 MET HG3 H 1 2.783 0.01 . 2 . . . . . 267 MET HG* . 26016 1 1396 . 1 1 113 113 MET HE1 H 1 2.008 0.002 . 1 . . . . . 267 MET HE* . 26016 1 1397 . 1 1 113 113 MET HE2 H 1 2.008 0.002 . 1 . . . . . 267 MET HE* . 26016 1 1398 . 1 1 113 113 MET HE3 H 1 2.008 0.002 . 1 . . . . . 267 MET HE* . 26016 1 1399 . 1 1 113 113 MET C C 13 177.46 0 . 1 . . . . . 267 MET C . 26016 1 1400 . 1 1 113 113 MET CA C 13 59.026 0.077 . 1 . . . . . 267 MET CA . 26016 1 1401 . 1 1 113 113 MET CB C 13 32.985 0.113 . 1 . . . . . 267 MET CB . 26016 1 1402 . 1 1 113 113 MET CE C 13 17.013 0 . 1 . . . . . 267 MET CE . 26016 1 1403 . 1 1 113 113 MET N N 15 115.602 0.04 . 1 . . . . . 267 MET N . 26016 1 1404 . 1 1 114 114 LYS H H 1 7.161 0.003 . 1 . . . . . 268 LYS H . 26016 1 1405 . 1 1 114 114 LYS HA H 1 4.289 0.007 . 1 . . . . . 268 LYS HA . 26016 1 1406 . 1 1 114 114 LYS HB2 H 1 1.952 0.014 . 2 . . . . . 268 LYS HB* . 26016 1 1407 . 1 1 114 114 LYS HB3 H 1 1.952 0.014 . 2 . . . . . 268 LYS HB* . 26016 1 1408 . 1 1 114 114 LYS HG2 H 1 1.613 0.008 . 2 . . . . . 268 LYS HG2 . 26016 1 1409 . 1 1 114 114 LYS HG3 H 1 1.481 0.017 . 2 . . . . . 268 LYS HG3 . 26016 1 1410 . 1 1 114 114 LYS HD2 H 1 1.735 0.01 . 2 . . . . . 268 LYS HD* . 26016 1 1411 . 1 1 114 114 LYS HD3 H 1 1.735 0.01 . 2 . . . . . 268 LYS HD* . 26016 1 1412 . 1 1 114 114 LYS HE2 H 1 3.02 0.01 . 2 . . . . . 268 LYS HE* . 26016 1 1413 . 1 1 114 114 LYS HE3 H 1 3.02 0.01 . 2 . . . . . 268 LYS HE* . 26016 1 1414 . 1 1 114 114 LYS HZ1 H 1 4.764 0 . 1 . . . . . 268 LYS HZ . 26016 1 1415 . 1 1 114 114 LYS HZ2 H 1 4.764 0 . 1 . . . . . 268 LYS HZ . 26016 1 1416 . 1 1 114 114 LYS HZ3 H 1 4.764 0 . 1 . . . . . 268 LYS HZ . 26016 1 1417 . 1 1 114 114 LYS C C 13 176.655 0 . 1 . . . . . 268 LYS C . 26016 1 1418 . 1 1 114 114 LYS CA C 13 57.661 0.069 . 1 . . . . . 268 LYS CA . 26016 1 1419 . 1 1 114 114 LYS CB C 13 33.537 0.11 . 1 . . . . . 268 LYS CB . 26016 1 1420 . 1 1 114 114 LYS CG C 13 24.935 0 . 1 . . . . . 268 LYS CG . 26016 1 1421 . 1 1 114 114 LYS CD C 13 29.016 0 . 1 . . . . . 268 LYS CD . 26016 1 1422 . 1 1 114 114 LYS CE C 13 42.227 0.124 . 1 . . . . . 268 LYS CE . 26016 1 1423 . 1 1 114 114 LYS N N 15 116.7 0.028 . 1 . . . . . 268 LYS N . 26016 1 1424 . 1 1 115 115 MET H H 1 8.061 0.005 . 1 . . . . . 269 MET H . 26016 1 1425 . 1 1 115 115 MET HA H 1 4.952 0.004 . 1 . . . . . 269 MET HA . 26016 1 1426 . 1 1 115 115 MET HB2 H 1 2.134 0.004 . 2 . . . . . 269 MET HB2 . 26016 1 1427 . 1 1 115 115 MET HB3 H 1 1.994 0.003 . 2 . . . . . 269 MET HB3 . 26016 1 1428 . 1 1 115 115 MET HG2 H 1 2.651 0.006 . 2 . . . . . 269 MET HG2 . 26016 1 1429 . 1 1 115 115 MET HG3 H 1 2.564 0.008 . 2 . . . . . 269 MET HG3 . 26016 1 1430 . 1 1 115 115 MET HE1 H 1 2.077 0.001 . 1 . . . . . 269 MET HE* . 26016 1 1431 . 1 1 115 115 MET HE2 H 1 2.077 0.001 . 1 . . . . . 269 MET HE* . 26016 1 1432 . 1 1 115 115 MET HE3 H 1 2.077 0.001 . 1 . . . . . 269 MET HE* . 26016 1 1433 . 1 1 115 115 MET CA C 13 53.005 0.08 . 1 . . . . . 269 MET CA . 26016 1 1434 . 1 1 115 115 MET CB C 13 34.436 0.039 . 1 . . . . . 269 MET CB . 26016 1 1435 . 1 1 115 115 MET CG C 13 31.65 0 . 1 . . . . . 269 MET CG . 26016 1 1436 . 1 1 115 115 MET CE C 13 17.692 0 . 1 . . . . . 269 MET CE . 26016 1 1437 . 1 1 115 115 MET N N 15 119.922 0.021 . 1 . . . . . 269 MET N . 26016 1 1438 . 1 1 116 116 PRO HA H 1 4.554 0.01 . 1 . . . . . 270 PRO HA . 26016 1 1439 . 1 1 116 116 PRO HB2 H 1 2.484 0.012 . 2 . . . . . 270 PRO HB2 . 26016 1 1440 . 1 1 116 116 PRO HB3 H 1 1.9 0.011 . 2 . . . . . 270 PRO HB3 . 26016 1 1441 . 1 1 116 116 PRO HG2 H 1 2.14 0.011 . 2 . . . . . 270 PRO HG* . 26016 1 1442 . 1 1 116 116 PRO HG3 H 1 2.14 0.011 . 2 . . . . . 270 PRO HG* . 26016 1 1443 . 1 1 116 116 PRO HD2 H 1 3.809 0.028 . 2 . . . . . 270 PRO HD2 . 26016 1 1444 . 1 1 116 116 PRO HD3 H 1 3.657 0 . 2 . . . . . 270 PRO HD3 . 26016 1 1445 . 1 1 116 116 PRO C C 13 176.404 0 . 1 . . . . . 270 PRO C . 26016 1 1446 . 1 1 116 116 PRO CA C 13 63.361 0.139 . 1 . . . . . 270 PRO CA . 26016 1 1447 . 1 1 116 116 PRO CB C 13 32.852 0.042 . 1 . . . . . 270 PRO CB . 26016 1 1448 . 1 1 116 116 PRO CG C 13 27.337 0 . 1 . . . . . 270 PRO CG . 26016 1 1449 . 1 1 116 116 PRO CD C 13 50.819 0.236 . 1 . . . . . 270 PRO CD . 26016 1 1450 . 1 1 117 117 ALA H H 1 8.435 0.006 . 1 . . . . . 271 ALA H . 26016 1 1451 . 1 1 117 117 ALA HA H 1 4.539 0.008 . 1 . . . . . 271 ALA HA . 26016 1 1452 . 1 1 117 117 ALA HB1 H 1 0.792 0.007 . 1 . . . . . 271 ALA HB . 26016 1 1453 . 1 1 117 117 ALA HB2 H 1 0.792 0.007 . 1 . . . . . 271 ALA HB . 26016 1 1454 . 1 1 117 117 ALA HB3 H 1 0.792 0.007 . 1 . . . . . 271 ALA HB . 26016 1 1455 . 1 1 117 117 ALA C C 13 177.97 0 . 1 . . . . . 271 ALA C . 26016 1 1456 . 1 1 117 117 ALA CA C 13 51.185 0.063 . 1 . . . . . 271 ALA CA . 26016 1 1457 . 1 1 117 117 ALA CB C 13 21.034 0.062 . 1 . . . . . 271 ALA CB . 26016 1 1458 . 1 1 117 117 ALA N N 15 124.765 0.039 . 1 . . . . . 271 ALA N . 26016 1 1459 . 1 1 118 118 SER H H 1 8.228 0.012 . 1 . . . . . 272 SER H . 26016 1 1460 . 1 1 118 118 SER HA H 1 5.128 0.012 . 1 . . . . . 272 SER HA . 26016 1 1461 . 1 1 118 118 SER HB2 H 1 3.826 0.01 . 2 . . . . . 272 SER HB2 . 26016 1 1462 . 1 1 118 118 SER HB3 H 1 3.78 0.004 . 2 . . . . . 272 SER HB3 . 26016 1 1463 . 1 1 118 118 SER C C 13 173.476 0 . 1 . . . . . 272 SER C . 26016 1 1464 . 1 1 118 118 SER CA C 13 57.91 0.117 . 1 . . . . . 272 SER CA . 26016 1 1465 . 1 1 118 118 SER CB C 13 64.076 0.103 . 1 . . . . . 272 SER CB . 26016 1 1466 . 1 1 118 118 SER N N 15 116.241 0.035 . 1 . . . . . 272 SER N . 26016 1 1467 . 1 1 119 119 GLY H H 1 7.692 0.004 . 1 . . . . . 273 GLY H . 26016 1 1468 . 1 1 119 119 GLY HA2 H 1 4.341 0.01 . 2 . . . . . 273 GLY HA2 . 26016 1 1469 . 1 1 119 119 GLY HA3 H 1 3.115 0.009 . 2 . . . . . 273 GLY HA3 . 26016 1 1470 . 1 1 119 119 GLY C C 13 170.586 0 . 1 . . . . . 273 GLY C . 26016 1 1471 . 1 1 119 119 GLY CA C 13 44.66 0.272 . 1 . . . . . 273 GLY CA . 26016 1 1472 . 1 1 119 119 GLY N N 15 112.583 0.045 . 1 . . . . . 273 GLY N . 26016 1 1473 . 1 1 120 120 TRP H H 1 8.192 0.005 . 1 . . . . . 274 TRP H . 26016 1 1474 . 1 1 120 120 TRP HA H 1 5.181 0.019 . 1 . . . . . 274 TRP HA . 26016 1 1475 . 1 1 120 120 TRP HB2 H 1 3.29 0.008 . 2 . . . . . 274 TRP HB2 . 26016 1 1476 . 1 1 120 120 TRP HB3 H 1 2.862 0.013 . 2 . . . . . 274 TRP HB3 . 26016 1 1477 . 1 1 120 120 TRP HD1 H 1 7.486 0.011 . 1 . . . . . 274 TRP HD1 . 26016 1 1478 . 1 1 120 120 TRP HE1 H 1 10.344 0.003 . 1 . . . . . 274 TRP HE1 . 26016 1 1479 . 1 1 120 120 TRP HE3 H 1 7.374 0.007 . 1 . . . . . 274 TRP HE3 . 26016 1 1480 . 1 1 120 120 TRP HZ2 H 1 7.469 0.004 . 1 . . . . . 274 TRP HZ2 . 26016 1 1481 . 1 1 120 120 TRP HZ3 H 1 6.954 0.005 . 1 . . . . . 274 TRP HZ3 . 26016 1 1482 . 1 1 120 120 TRP HH2 H 1 7.236 0.009 . 1 . . . . . 274 TRP HH2 . 26016 1 1483 . 1 1 120 120 TRP C C 13 177.579 0 . 1 . . . . . 274 TRP C . 26016 1 1484 . 1 1 120 120 TRP CA C 13 56.458 0.037 . 1 . . . . . 274 TRP CA . 26016 1 1485 . 1 1 120 120 TRP CB C 13 31.669 0.115 . 1 . . . . . 274 TRP CB . 26016 1 1486 . 1 1 120 120 TRP CD1 C 13 127.942 0 . 1 . . . . . 274 TRP CD1 . 26016 1 1487 . 1 1 120 120 TRP CE2 C 13 139.126 0 . 1 . . . . . 274 TRP CE2 . 26016 1 1488 . 1 1 120 120 TRP CZ2 C 13 114.613 0 . 1 . . . . . 274 TRP CZ2 . 26016 1 1489 . 1 1 120 120 TRP CH2 C 13 125.726 0 . 1 . . . . . 274 TRP CH2 . 26016 1 1490 . 1 1 120 120 TRP N N 15 116.757 0.051 . 1 . . . . . 274 TRP N . 26016 1 1491 . 1 1 120 120 TRP NE1 N 15 130.049 0.019 . 1 . . . . . 274 TRP NE1 . 26016 1 1492 . 1 1 121 121 TYR H H 1 9.77 0.007 . 1 . . . . . 275 TYR H . 26016 1 1493 . 1 1 121 121 TYR HA H 1 4.948 0.015 . 1 . . . . . 275 TYR HA . 26016 1 1494 . 1 1 121 121 TYR HB2 H 1 3.167 0.009 . 2 . . . . . 275 TYR HB2 . 26016 1 1495 . 1 1 121 121 TYR HB3 H 1 2.568 0.011 . 2 . . . . . 275 TYR HB3 . 26016 1 1496 . 1 1 121 121 TYR HD1 H 1 7.185 0 . 3 . . . . . 275 TYR HD* . 26016 1 1497 . 1 1 121 121 TYR HD2 H 1 7.185 0 . 3 . . . . . 275 TYR HD* . 26016 1 1498 . 1 1 121 121 TYR C C 13 175.514 0 . 1 . . . . . 275 TYR C . 26016 1 1499 . 1 1 121 121 TYR CA C 13 57.937 0.081 . 1 . . . . . 275 TYR CA . 26016 1 1500 . 1 1 121 121 TYR CB C 13 43.226 0.091 . 1 . . . . . 275 TYR CB . 26016 1 1501 . 1 1 121 121 TYR CD1 C 13 133.258 0 . 3 . . . . . 275 TYR CD . 26016 1 1502 . 1 1 121 121 TYR CD2 C 13 133.258 0 . 3 . . . . . 275 TYR CD . 26016 1 1503 . 1 1 121 121 TYR N N 15 120.043 0.051 . 1 . . . . . 275 TYR N . 26016 1 1504 . 1 1 122 122 LYS H H 1 8.628 0.006 . 1 . . . . . 276 LYS H . 26016 1 1505 . 1 1 122 122 LYS HA H 1 4.288 0.004 . 1 . . . . . 276 LYS HA . 26016 1 1506 . 1 1 122 122 LYS HB2 H 1 1.92 0.012 . 2 . . . . . 276 LYS HB2 . 26016 1 1507 . 1 1 122 122 LYS HB3 H 1 1.769 0.01 . 2 . . . . . 276 LYS HB3 . 26016 1 1508 . 1 1 122 122 LYS HG2 H 1 1.644 0.004 . 2 . . . . . 276 LYS HG2 . 26016 1 1509 . 1 1 122 122 LYS HG3 H 1 1.449 0.008 . 2 . . . . . 276 LYS HG3 . 26016 1 1510 . 1 1 122 122 LYS C C 13 176.308 0 . 1 . . . . . 276 LYS C . 26016 1 1511 . 1 1 122 122 LYS CA C 13 57.05 0.111 . 1 . . . . . 276 LYS CA . 26016 1 1512 . 1 1 122 122 LYS CB C 13 34.288 0.227 . 1 . . . . . 276 LYS CB . 26016 1 1513 . 1 1 122 122 LYS CG C 13 25.643 0 . 1 . . . . . 276 LYS CG . 26016 1 1514 . 1 1 122 122 LYS CD C 13 29.951 0 . 1 . . . . . 276 LYS CD . 26016 1 1515 . 1 1 122 122 LYS CE C 13 42.047 0 . 1 . . . . . 276 LYS CE . 26016 1 1516 . 1 1 122 122 LYS N N 15 121.361 0.03 . 1 . . . . . 276 LYS N . 26016 1 1517 . 1 1 123 123 LEU H H 1 7.853 0.006 . 1 . . . . . 277 LEU H . 26016 1 1518 . 1 1 123 123 LEU HA H 1 4.298 0.015 . 1 . . . . . 277 LEU HA . 26016 1 1519 . 1 1 123 123 LEU HB2 H 1 1.587 0.009 . 2 . . . . . 277 LEU HB2 . 26016 1 1520 . 1 1 123 123 LEU HB3 H 1 1.032 0.018 . 2 . . . . . 277 LEU HB3 . 26016 1 1521 . 1 1 123 123 LEU HG H 1 1.426 0.013 . 1 . . . . . 277 LEU HG . 26016 1 1522 . 1 1 123 123 LEU HD11 H 1 0.71 0.014 . 2 . . . . . 277 LEU HD1 . 26016 1 1523 . 1 1 123 123 LEU HD12 H 1 0.71 0.014 . 2 . . . . . 277 LEU HD1 . 26016 1 1524 . 1 1 123 123 LEU HD13 H 1 0.71 0.014 . 2 . . . . . 277 LEU HD1 . 26016 1 1525 . 1 1 123 123 LEU HD21 H 1 0.624 0.009 . 2 . . . . . 277 LEU HD2 . 26016 1 1526 . 1 1 123 123 LEU HD22 H 1 0.624 0.009 . 2 . . . . . 277 LEU HD2 . 26016 1 1527 . 1 1 123 123 LEU HD23 H 1 0.624 0.009 . 2 . . . . . 277 LEU HD2 . 26016 1 1528 . 1 1 123 123 LEU C C 13 176.17 0 . 1 . . . . . 277 LEU C . 26016 1 1529 . 1 1 123 123 LEU CA C 13 55.918 0.083 . 1 . . . . . 277 LEU CA . 26016 1 1530 . 1 1 123 123 LEU CB C 13 42.363 0.152 . 1 . . . . . 277 LEU CB . 26016 1 1531 . 1 1 123 123 LEU CG C 13 27.987 0.751 . 1 . . . . . 277 LEU CG . 26016 1 1532 . 1 1 123 123 LEU CD1 C 13 26.302 0.048 . 2 . . . . . 277 LEU CD1 . 26016 1 1533 . 1 1 123 123 LEU CD2 C 13 23.976 0.013 . 2 . . . . . 277 LEU CD2 . 26016 1 1534 . 1 1 123 123 LEU N N 15 124.754 0.06 . 1 . . . . . 277 LEU N . 26016 1 1535 . 1 1 124 124 LEU H H 1 9.444 0.009 . 1 . . . . . 278 LEU H . 26016 1 1536 . 1 1 124 124 LEU HA H 1 4.78 0.007 . 1 . . . . . 278 LEU HA . 26016 1 1537 . 1 1 124 124 LEU HB3 H 1 1.915 0.015 . 2 . . . . . 278 LEU HB3 . 26016 1 1538 . 1 1 124 124 LEU HG H 1 1.933 0.013 . 1 . . . . . 278 LEU HG . 26016 1 1539 . 1 1 124 124 LEU HD11 H 1 0.786 0.013 . 2 . . . . . 278 LEU HD1 . 26016 1 1540 . 1 1 124 124 LEU HD12 H 1 0.786 0.013 . 2 . . . . . 278 LEU HD1 . 26016 1 1541 . 1 1 124 124 LEU HD13 H 1 0.786 0.013 . 2 . . . . . 278 LEU HD1 . 26016 1 1542 . 1 1 124 124 LEU HD21 H 1 0.676 0.006 . 2 . . . . . 278 LEU HD2 . 26016 1 1543 . 1 1 124 124 LEU HD22 H 1 0.676 0.006 . 2 . . . . . 278 LEU HD2 . 26016 1 1544 . 1 1 124 124 LEU HD23 H 1 0.676 0.006 . 2 . . . . . 278 LEU HD2 . 26016 1 1545 . 1 1 124 124 LEU C C 13 176.906 0 . 1 . . . . . 278 LEU C . 26016 1 1546 . 1 1 124 124 LEU CA C 13 53.79 0.091 . 1 . . . . . 278 LEU CA . 26016 1 1547 . 1 1 124 124 LEU CB C 13 42.982 0.04 . 1 . . . . . 278 LEU CB . 26016 1 1548 . 1 1 124 124 LEU CG C 13 27.057 0.091 . 1 . . . . . 278 LEU CG . 26016 1 1549 . 1 1 124 124 LEU CD1 C 13 22.301 0.324 . 2 . . . . . 278 LEU CD1 . 26016 1 1550 . 1 1 124 124 LEU CD2 C 13 26.379 0.015 . 2 . . . . . 278 LEU CD2 . 26016 1 1551 . 1 1 124 124 LEU N N 15 123.556 0.105 . 1 . . . . . 278 LEU N . 26016 1 1552 . 1 1 125 125 ASN H H 1 8.512 0.008 . 1 . . . . . 279 ASN H . 26016 1 1553 . 1 1 125 125 ASN HA H 1 4.537 0.01 . 1 . . . . . 279 ASN HA . 26016 1 1554 . 1 1 125 125 ASN HB2 H 1 3.056 0.013 . 2 . . . . . 279 ASN HB2 . 26016 1 1555 . 1 1 125 125 ASN HD21 H 1 7.634 0.004 . 2 . . . . . 279 ASN HD21 . 26016 1 1556 . 1 1 125 125 ASN HD22 H 1 7.03 0.003 . 2 . . . . . 279 ASN HD22 . 26016 1 1557 . 1 1 125 125 ASN C C 13 174.155 0 . 1 . . . . . 279 ASN C . 26016 1 1558 . 1 1 125 125 ASN CA C 13 52.828 0.138 . 1 . . . . . 279 ASN CA . 26016 1 1559 . 1 1 125 125 ASN CB C 13 38.157 0.069 . 1 . . . . . 279 ASN CB . 26016 1 1560 . 1 1 125 125 ASN N N 15 115.616 0.052 . 1 . . . . . 279 ASN N . 26016 1 1561 . 1 1 125 125 ASN ND2 N 15 113.377 0.05 . 1 . . . . . 279 ASN ND2 . 26016 1 1562 . 1 1 126 126 GLN H H 1 8.203 0.005 . 1 . . . . . 280 GLN H . 26016 1 1563 . 1 1 126 126 GLN HA H 1 3.355 0.009 . 1 . . . . . 280 GLN HA . 26016 1 1564 . 1 1 126 126 GLN HB2 H 1 1.287 0.007 . 2 . . . . . 280 GLN HB2 . 26016 1 1565 . 1 1 126 126 GLN HB3 H 1 0.179 0.011 . 2 . . . . . 280 GLN HB3 . 26016 1 1566 . 1 1 126 126 GLN HG2 H 1 1.898 0.005 . 2 . . . . . 280 GLN HG2 . 26016 1 1567 . 1 1 126 126 GLN HG3 H 1 1.51 0.011 . 2 . . . . . 280 GLN HG3 . 26016 1 1568 . 1 1 126 126 GLN HE21 H 1 7.588 0.003 . 2 . . . . . 280 GLN HE21 . 26016 1 1569 . 1 1 126 126 GLN HE22 H 1 6.651 0.001 . 2 . . . . . 280 GLN HE22 . 26016 1 1570 . 1 1 126 126 GLN C C 13 178.109 0 . 1 . . . . . 280 GLN C . 26016 1 1571 . 1 1 126 126 GLN CA C 13 59.585 0.071 . 1 . . . . . 280 GLN CA . 26016 1 1572 . 1 1 126 126 GLN CB C 13 27.513 0.096 . 1 . . . . . 280 GLN CB . 26016 1 1573 . 1 1 126 126 GLN CG C 13 32.959 0 . 1 . . . . . 280 GLN CG . 26016 1 1574 . 1 1 126 126 GLN N N 15 119.468 0.032 . 1 . . . . . 280 GLN N . 26016 1 1575 . 1 1 126 126 GLN NE2 N 15 110.367 0.032 . 1 . . . . . 280 GLN NE2 . 26016 1 1576 . 1 1 127 127 GLU H H 1 8.523 0.003 . 1 . . . . . 281 GLU H . 26016 1 1577 . 1 1 127 127 GLU HA H 1 4.061 0.006 . 1 . . . . . 281 GLU HA . 26016 1 1578 . 1 1 127 127 GLU HB2 H 1 2.022 0.004 . 2 . . . . . 281 GLU HB2 . 26016 1 1579 . 1 1 127 127 GLU HB3 H 1 2.005 0.003 . 2 . . . . . 281 GLU HB3 . 26016 1 1580 . 1 1 127 127 GLU HG2 H 1 2.257 0.003 . 2 . . . . . 281 GLU HG2 . 26016 1 1581 . 1 1 127 127 GLU C C 13 178.182 0 . 1 . . . . . 281 GLU C . 26016 1 1582 . 1 1 127 127 GLU CA C 13 59.072 0.094 . 1 . . . . . 281 GLU CA . 26016 1 1583 . 1 1 127 127 GLU CB C 13 28.891 0.097 . 1 . . . . . 281 GLU CB . 26016 1 1584 . 1 1 127 127 GLU CG C 13 36.468 0 . 1 . . . . . 281 GLU CG . 26016 1 1585 . 1 1 127 127 GLU N N 15 117.482 0.084 . 1 . . . . . 281 GLU N . 26016 1 1586 . 1 1 128 128 GLU H H 1 8.041 0.007 . 1 . . . . . 282 GLU H . 26016 1 1587 . 1 1 128 128 GLU HA H 1 4.221 0.008 . 1 . . . . . 282 GLU HA . 26016 1 1588 . 1 1 128 128 GLU HB2 H 1 2.035 0.012 . 2 . . . . . 282 GLU HB* . 26016 1 1589 . 1 1 128 128 GLU HB3 H 1 2.035 0.012 . 2 . . . . . 282 GLU HB* . 26016 1 1590 . 1 1 128 128 GLU HG2 H 1 2.433 0.021 . 2 . . . . . 282 GLU HG* . 26016 1 1591 . 1 1 128 128 GLU HG3 H 1 2.433 0.021 . 2 . . . . . 282 GLU HG* . 26016 1 1592 . 1 1 128 128 GLU C C 13 179.052 0 . 1 . . . . . 282 GLU C . 26016 1 1593 . 1 1 128 128 GLU CA C 13 58.756 0.102 . 1 . . . . . 282 GLU CA . 26016 1 1594 . 1 1 128 128 GLU CB C 13 30.951 0.171 . 1 . . . . . 282 GLU CB . 26016 1 1595 . 1 1 128 128 GLU CG C 13 37.122 0 . 1 . . . . . 282 GLU CG . 26016 1 1596 . 1 1 128 128 GLU N N 15 118.183 0.045 . 1 . . . . . 282 GLU N . 26016 1 1597 . 1 1 129 129 GLY H H 1 8.596 0.005 . 1 . . . . . 283 GLY H . 26016 1 1598 . 1 1 129 129 GLY HA2 H 1 3.754 0.008 . 2 . . . . . 283 GLY HA* . 26016 1 1599 . 1 1 129 129 GLY HA3 H 1 3.754 0.008 . 2 . . . . . 283 GLY HA* . 26016 1 1600 . 1 1 129 129 GLY C C 13 176.217 0 . 1 . . . . . 283 GLY C . 26016 1 1601 . 1 1 129 129 GLY CA C 13 46.7 0.176 . 1 . . . . . 283 GLY CA . 26016 1 1602 . 1 1 129 129 GLY N N 15 105.427 0.039 . 1 . . . . . 283 GLY N . 26016 1 1603 . 1 1 130 130 GLU H H 1 7.249 0.004 . 1 . . . . . 284 GLU H . 26016 1 1604 . 1 1 130 130 GLU HA H 1 3.83 0.018 . 1 . . . . . 284 GLU HA . 26016 1 1605 . 1 1 130 130 GLU HB2 H 1 1.572 0.01 . 2 . . . . . 284 GLU HB* . 26016 1 1606 . 1 1 130 130 GLU HB3 H 1 1.572 0.01 . 2 . . . . . 284 GLU HB* . 26016 1 1607 . 1 1 130 130 GLU HG2 H 1 2.295 0.017 . 2 . . . . . 284 GLU HG2 . 26016 1 1608 . 1 1 130 130 GLU HG3 H 1 1.869 0.021 . 2 . . . . . 284 GLU HG3 . 26016 1 1609 . 1 1 130 130 GLU C C 13 176.046 0 . 1 . . . . . 284 GLU C . 26016 1 1610 . 1 1 130 130 GLU CA C 13 57.933 0.174 . 1 . . . . . 284 GLU CA . 26016 1 1611 . 1 1 130 130 GLU CB C 13 29.032 0.205 . 1 . . . . . 284 GLU CB . 26016 1 1612 . 1 1 130 130 GLU CG C 13 36.545 0.105 . 1 . . . . . 284 GLU CG . 26016 1 1613 . 1 1 130 130 GLU N N 15 117.098 0.034 . 1 . . . . . 284 GLU N . 26016 1 1614 . 1 1 131 131 TYR H H 1 7.635 0.007 . 1 . . . . . 285 TYR H . 26016 1 1615 . 1 1 131 131 TYR HA H 1 4.318 0.012 . 1 . . . . . 285 TYR HA . 26016 1 1616 . 1 1 131 131 TYR HB2 H 1 2.609 0.004 . 2 . . . . . 285 TYR HB2 . 26016 1 1617 . 1 1 131 131 TYR HB3 H 1 2.447 0.001 . 2 . . . . . 285 TYR HB3 . 26016 1 1618 . 1 1 131 131 TYR HD1 H 1 7.04 0.003 . 3 . . . . . 285 TYR HD1 . 26016 1 1619 . 1 1 131 131 TYR HD2 H 1 6.269 0 . 3 . . . . . 285 TYR HD2 . 26016 1 1620 . 1 1 131 131 TYR HE1 H 1 6.758 0.006 . 3 . . . . . 285 TYR HE* . 26016 1 1621 . 1 1 131 131 TYR HE2 H 1 6.758 0.006 . 3 . . . . . 285 TYR HE* . 26016 1 1622 . 1 1 131 131 TYR C C 13 174.592 0 . 1 . . . . . 285 TYR C . 26016 1 1623 . 1 1 131 131 TYR CA C 13 58.293 0.015 . 1 . . . . . 285 TYR CA . 26016 1 1624 . 1 1 131 131 TYR CB C 13 41.336 0.041 . 1 . . . . . 285 TYR CB . 26016 1 1625 . 1 1 131 131 TYR CD1 C 13 133.396 0 . 3 . . . . . 285 TYR CD1 . 26016 1 1626 . 1 1 131 131 TYR CE1 C 13 118.266 0 . 3 . . . . . 285 TYR CE* . 26016 1 1627 . 1 1 131 131 TYR CE2 C 13 118.266 0 . 3 . . . . . 285 TYR CE* . 26016 1 1628 . 1 1 131 131 TYR N N 15 114.407 0.043 . 1 . . . . . 285 TYR N . 26016 1 1629 . 1 1 132 132 TYR H H 1 7.196 0.007 . 1 . . . . . 286 TYR H . 26016 1 1630 . 1 1 132 132 TYR HA H 1 4.915 0.005 . 1 . . . . . 286 TYR HA . 26016 1 1631 . 1 1 132 132 TYR HB2 H 1 3.109 0.019 . 2 . . . . . 286 TYR HB2 . 26016 1 1632 . 1 1 132 132 TYR HB3 H 1 2.724 0.017 . 2 . . . . . 286 TYR HB3 . 26016 1 1633 . 1 1 132 132 TYR HD1 H 1 7.084 0.012 . 3 . . . . . 286 TYR HD* . 26016 1 1634 . 1 1 132 132 TYR HD2 H 1 7.084 0.012 . 3 . . . . . 286 TYR HD* . 26016 1 1635 . 1 1 132 132 TYR HE2 H 1 6.729 0.007 . 3 . . . . . 286 TYR HE2 . 26016 1 1636 . 1 1 132 132 TYR C C 13 172.894 0 . 1 . . . . . 286 TYR C . 26016 1 1637 . 1 1 132 132 TYR CA C 13 56.679 0.183 . 1 . . . . . 286 TYR CA . 26016 1 1638 . 1 1 132 132 TYR CB C 13 41.385 0.113 . 1 . . . . . 286 TYR CB . 26016 1 1639 . 1 1 132 132 TYR CD1 C 13 134.239 0 . 3 . . . . . 286 TYR CD* . 26016 1 1640 . 1 1 132 132 TYR CD2 C 13 134.239 0 . 3 . . . . . 286 TYR CD* . 26016 1 1641 . 1 1 132 132 TYR CE2 C 13 117.844 0 . 3 . . . . . 286 TYR CE2 . 26016 1 1642 . 1 1 132 132 TYR N N 15 114.301 0.035 . 1 . . . . . 286 TYR N . 26016 1 1643 . 1 1 133 133 ASN H H 1 7.983 0.007 . 1 . . . . . 287 ASN H . 26016 1 1644 . 1 1 133 133 ASN HA H 1 4.724 0.014 . 1 . . . . . 287 ASN HA . 26016 1 1645 . 1 1 133 133 ASN HB2 H 1 2.319 0.01 . 2 . . . . . 287 ASN HB2 . 26016 1 1646 . 1 1 133 133 ASN HB3 H 1 1.975 0.018 . 2 . . . . . 287 ASN HB3 . 26016 1 1647 . 1 1 133 133 ASN HD22 H 1 7.253 0.008 . 2 . . . . . 287 ASN HD22 . 26016 1 1648 . 1 1 133 133 ASN C C 13 173.346 0 . 1 . . . . . 287 ASN C . 26016 1 1649 . 1 1 133 133 ASN CA C 13 52.901 0.071 . 1 . . . . . 287 ASN CA . 26016 1 1650 . 1 1 133 133 ASN CB C 13 42.889 0.088 . 1 . . . . . 287 ASN CB . 26016 1 1651 . 1 1 133 133 ASN N N 15 111.201 0.063 . 1 . . . . . 287 ASN N . 26016 1 1652 . 1 1 134 134 VAL H H 1 9.823 0.007 . 1 . . . . . 288 VAL H . 26016 1 1653 . 1 1 134 134 VAL HA H 1 4.683 0.005 . 1 . . . . . 288 VAL HA . 26016 1 1654 . 1 1 134 134 VAL HB H 1 2.136 0.006 . 1 . . . . . 288 VAL HB . 26016 1 1655 . 1 1 134 134 VAL HG11 H 1 1.009 0.007 . 2 . . . . . 288 VAL HG . 26016 1 1656 . 1 1 134 134 VAL HG12 H 1 1.009 0.007 . 2 . . . . . 288 VAL HG . 26016 1 1657 . 1 1 134 134 VAL HG13 H 1 1.009 0.007 . 2 . . . . . 288 VAL HG . 26016 1 1658 . 1 1 134 134 VAL HG21 H 1 1.009 0.007 . 2 . . . . . 288 VAL HG . 26016 1 1659 . 1 1 134 134 VAL HG22 H 1 1.009 0.007 . 2 . . . . . 288 VAL HG . 26016 1 1660 . 1 1 134 134 VAL HG23 H 1 1.009 0.007 . 2 . . . . . 288 VAL HG . 26016 1 1661 . 1 1 134 134 VAL CA C 13 59.717 0.021 . 1 . . . . . 288 VAL CA . 26016 1 1662 . 1 1 134 134 VAL CB C 13 34.63 0.155 . 1 . . . . . 288 VAL CB . 26016 1 1663 . 1 1 134 134 VAL N N 15 120.997 0.055 . 1 . . . . . 288 VAL N . 26016 1 1664 . 1 1 135 135 PRO HA H 1 4.31 0.016 . 1 . . . . . 289 PRO HA . 26016 1 1665 . 1 1 135 135 PRO HB2 H 1 2.243 0.012 . 2 . . . . . 289 PRO HB2 . 26016 1 1666 . 1 1 135 135 PRO HB3 H 1 1.782 0.008 . 2 . . . . . 289 PRO HB3 . 26016 1 1667 . 1 1 135 135 PRO HG2 H 1 2.24 0.012 . 2 . . . . . 289 PRO HG2 . 26016 1 1668 . 1 1 135 135 PRO HG3 H 1 2.19 0.01 . 2 . . . . . 289 PRO HG3 . 26016 1 1669 . 1 1 135 135 PRO HD2 H 1 4.032 0.014 . 2 . . . . . 289 PRO HD* . 26016 1 1670 . 1 1 135 135 PRO HD3 H 1 4.032 0.014 . 2 . . . . . 289 PRO HD* . 26016 1 1671 . 1 1 135 135 PRO C C 13 176.719 0 . 1 . . . . . 289 PRO C . 26016 1 1672 . 1 1 135 135 PRO CA C 13 62.485 0.132 . 1 . . . . . 289 PRO CA . 26016 1 1673 . 1 1 135 135 PRO CB C 13 32.888 0.074 . 1 . . . . . 289 PRO CB . 26016 1 1674 . 1 1 135 135 PRO CG C 13 27.173 0 . 1 . . . . . 289 PRO CG . 26016 1 1675 . 1 1 135 135 PRO CD C 13 51.378 0.045 . 1 . . . . . 289 PRO CD . 26016 1 1676 . 1 1 136 136 ILE H H 1 7.998 0.004 . 1 . . . . . 290 ILE H . 26016 1 1677 . 1 1 136 136 ILE HA H 1 4.506 0.012 . 1 . . . . . 290 ILE HA . 26016 1 1678 . 1 1 136 136 ILE HB H 1 1.663 0.014 . 1 . . . . . 290 ILE HB . 26016 1 1679 . 1 1 136 136 ILE HG12 H 1 1.438 0.012 . 2 . . . . . 290 ILE HG12 . 26016 1 1680 . 1 1 136 136 ILE HG13 H 1 0.94 0.011 . 2 . . . . . 290 ILE HG13 . 26016 1 1681 . 1 1 136 136 ILE HG21 H 1 0.794 0.01 . 1 . . . . . 290 ILE HG2 . 26016 1 1682 . 1 1 136 136 ILE HG22 H 1 0.794 0.01 . 1 . . . . . 290 ILE HG2 . 26016 1 1683 . 1 1 136 136 ILE HG23 H 1 0.794 0.01 . 1 . . . . . 290 ILE HG2 . 26016 1 1684 . 1 1 136 136 ILE HD11 H 1 0.693 0.014 . 1 . . . . . 290 ILE HD1 . 26016 1 1685 . 1 1 136 136 ILE HD12 H 1 0.693 0.014 . 1 . . . . . 290 ILE HD1 . 26016 1 1686 . 1 1 136 136 ILE HD13 H 1 0.693 0.014 . 1 . . . . . 290 ILE HD1 . 26016 1 1687 . 1 1 136 136 ILE CA C 13 58.088 0.062 . 1 . . . . . 290 ILE CA . 26016 1 1688 . 1 1 136 136 ILE CB C 13 39.127 0.151 . 1 . . . . . 290 ILE CB . 26016 1 1689 . 1 1 136 136 ILE CG1 C 13 27.028 0.028 . 1 . . . . . 290 ILE CG1 . 26016 1 1690 . 1 1 136 136 ILE CG2 C 13 17.38 0.061 . 1 . . . . . 290 ILE CG2 . 26016 1 1691 . 1 1 136 136 ILE CD1 C 13 14.361 0.027 . 1 . . . . . 290 ILE CD1 . 26016 1 1692 . 1 1 136 136 ILE N N 15 121.8 0.058 . 1 . . . . . 290 ILE N . 26016 1 1693 . 1 1 137 137 PRO HA H 1 4.544 0.008 . 1 . . . . . 291 PRO HA . 26016 1 1694 . 1 1 137 137 PRO HB2 H 1 2.336 0.011 . 2 . . . . . 291 PRO HB2 . 26016 1 1695 . 1 1 137 137 PRO HB3 H 1 2.002 0.012 . 2 . . . . . 291 PRO HB3 . 26016 1 1696 . 1 1 137 137 PRO HG2 H 1 2.01 0.013 . 2 . . . . . 291 PRO HG* . 26016 1 1697 . 1 1 137 137 PRO HG3 H 1 2.01 0.013 . 2 . . . . . 291 PRO HG* . 26016 1 1698 . 1 1 137 137 PRO HD2 H 1 3.707 0.01 . 2 . . . . . 291 PRO HD* . 26016 1 1699 . 1 1 137 137 PRO HD3 H 1 3.707 0.01 . 2 . . . . . 291 PRO HD* . 26016 1 1700 . 1 1 137 137 PRO C C 13 176.858 0 . 1 . . . . . 291 PRO C . 26016 1 1701 . 1 1 137 137 PRO CA C 13 63.292 0.032 . 1 . . . . . 291 PRO CA . 26016 1 1702 . 1 1 137 137 PRO CB C 13 32.165 0.073 . 1 . . . . . 291 PRO CB . 26016 1 1703 . 1 1 137 137 PRO CG C 13 27.293 0.092 . 1 . . . . . 291 PRO CG . 26016 1 1704 . 1 1 137 137 PRO CD C 13 50.888 0.017 . 1 . . . . . 291 PRO CD . 26016 1 1705 . 1 1 138 138 GLU H H 1 8.514 0.007 . 1 . . . . . 292 GLU H . 26016 1 1706 . 1 1 138 138 GLU HA H 1 4.331 0.006 . 1 . . . . . 292 GLU HA . 26016 1 1707 . 1 1 138 138 GLU HB2 H 1 2.126 0.003 . 2 . . . . . 292 GLU HB2 . 26016 1 1708 . 1 1 138 138 GLU HB3 H 1 2.015 0.005 . 2 . . . . . 292 GLU HB3 . 26016 1 1709 . 1 1 138 138 GLU HG2 H 1 2.348 0.009 . 2 . . . . . 292 GLU HG2 . 26016 1 1710 . 1 1 138 138 GLU C C 13 175.814 0 . 1 . . . . . 292 GLU C . 26016 1 1711 . 1 1 138 138 GLU CA C 13 56.685 0.101 . 1 . . . . . 292 GLU CA . 26016 1 1712 . 1 1 138 138 GLU CB C 13 30.881 0.034 . 1 . . . . . 292 GLU CB . 26016 1 1713 . 1 1 138 138 GLU CG C 13 36.301 0.096 . 1 . . . . . 292 GLU CG . 26016 1 1714 . 1 1 138 138 GLU N N 15 120.568 0.014 . 1 . . . . . 292 GLU N . 26016 1 1715 . 1 1 139 139 GLY H H 1 7.987 0.007 . 1 . . . . . 293 GLY H . 26016 1 1716 . 1 1 139 139 GLY HA2 H 1 3.689 0.003 . 2 . . . . . 293 GLY HA . 26016 1 1717 . 1 1 139 139 GLY HA3 H 1 3.689 0.003 . 2 . . . . . 293 GLY HA . 26016 1 1718 . 1 1 139 139 GLY CA C 13 46.149 0.074 . 1 . . . . . 293 GLY CA . 26016 1 1719 . 1 1 139 139 GLY N N 15 116.113 0.011 . 1 . . . . . 293 GLY N . 26016 1 stop_ save_