data_18826 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18826 _Entry.Title ; Complex structure of C-terminal CFTR peptide and extended PDZ2 domain from NHERF1. ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2012-11-06 _Entry.Accession_date 2012-11-06 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Shibani Bhattacharya . . . 18826 2 Jeong Ju . H. . 18826 3 David Cowburn . . . 18826 4 Zimei Bu . . . 18826 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' . 18826 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'PDZ domain' . 18826 Protein/Peptide . 18826 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18826 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 508 18826 '15N chemical shifts' 132 18826 '1H chemical shifts' 894 18826 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2013-07-09 2013-11-06 update BMRB 'update entry citation' 18826 1 . . 2013-04-22 2013-11-06 original author 'original release' 18826 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 18824 'extended PDZ1 domain from NHERF1' 18826 BMRB 18825 'C-terminal CFTR peptide and extended PDZ1 domain from NHERF1' 18826 PDB 2M0V 'BMRB Entry Tracking System' 18826 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18826 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 23583913 _Citation.Full_citation . _Citation.Title 'Ligand-Induced Dynamic Changes in Extended PDZ Domains from NHERF1.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full 'Journal of molecular biology' _Citation.Journal_volume 425 _Citation.Journal_issue 14 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 2509 _Citation.Page_last 2528 _Citation.Year 2013 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Shibani Bhattacharya . . . 18826 1 2 'Jeong Ho' Ju . . . 18826 1 3 Natalia Orlova . . . 18826 1 4 'Jahan Ali' Khajeh . . . 18826 1 5 David Cowburn . . . 18826 1 6 Zimei Bu . . . 18826 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18826 _Assembly.ID 1 _Assembly.Name 'C-terminal CFTR peptide and extended PDZ2 domain from NHERF1' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'extended PDZ2 domain from NHERF1' 1 $PDZ2 A . yes native no no . . . 18826 1 2 'C-terminal CFTR peptide' 2 $CFTR B . yes native no no . . . 18826 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_PDZ2 _Entity.Sf_category entity _Entity.Sf_framecode PDZ2 _Entity.Entry_ID 18826 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name PDZ2 _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 ; GIDPFTMLRPRLCTMKKGPS GYGFNLHSDKSKPGQFIRSV DPDSPAEASGLRAQDRIVEV NGVCMEGKQHGDVVSAIRAG GDETKLLVVDRETDEFFKKC RVIPSQEHLNGPLPVPFTNG EIQKENSR ; _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 128 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 14101.081 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 15567 . PDZ2 . . . . . 76.56 98 100.00 100.00 5.13e-64 . . . . 18826 1 2 no BMRB 16637 . PDZ2-270 . . . . . 100.00 128 100.00 100.00 5.71e-88 . . . . 18826 1 3 no BMRB 16638 . NHERF1_(150-358) . . . . . 100.00 216 100.00 100.00 2.92e-89 . . . . 18826 1 4 no PDB 2JXO . "Structure Of The Second Pdz Domain Of Nherf-1" . . . . . 76.56 98 100.00 100.00 5.13e-64 . . . . 18826 1 5 no PDB 2KJD . "Solution Structure Of Extended Pdz2 Domain From Nherf1 (150- 270)" . . . . . 100.00 128 100.00 100.00 5.71e-88 . . . . 18826 1 6 no PDB 2KRG . "Solution Structure Of Human Sodium HYDROGEN EXCHANGE Regulatory Factor 1(150-358)" . . . . . 100.00 216 100.00 100.00 2.92e-89 . . . . 18826 1 7 no PDB 2M0V . "Complex Structure Of C-terminal Cftr Peptide And Extended Pdz2 Domain From Nherf1" . . . . . 100.00 128 100.00 100.00 5.71e-88 . . . . 18826 1 8 no PDB 2OZF . "The Crystal Structure Of The 2nd Pdz Domain Of The Human Nherf-1 (Slc9a3r1)" . . . . . 69.53 92 97.75 100.00 1.09e-55 . . . . 18826 1 9 no PDB 4Q3H . "The Crystal Structure Of Nherf1 Pdz2 Cxcr2 Complex Revealed By The Nherf1 Cxcr2 Chimeric Protein" . . . . . 68.75 92 98.86 100.00 1.28e-55 . . . . 18826 1 10 no DBJ BAG54683 . "unnamed protein product [Homo sapiens]" . . . . . 89.06 202 100.00 100.00 2.25e-77 . . . . 18826 1 11 no GB EAW89189 . "solute carrier family 9 (sodium/hydrogen exchanger), member 3 regulator 1, isoform CRA_a [Homo sapiens]" . . . . . 89.06 202 100.00 100.00 2.25e-77 . . . . 18826 1 12 no GB EHH58322 . "hypothetical protein EGM_08144, partial [Macaca fascicularis]" . . . . . 94.53 233 97.52 98.35 3.17e-81 . . . . 18826 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 143 GLY . 18826 1 2 144 ILE . 18826 1 3 145 ASP . 18826 1 4 146 PRO . 18826 1 5 147 PHE . 18826 1 6 148 THR . 18826 1 7 149 MET . 18826 1 8 150 LEU . 18826 1 9 151 ARG . 18826 1 10 152 PRO . 18826 1 11 153 ARG . 18826 1 12 154 LEU . 18826 1 13 155 CYS . 18826 1 14 156 THR . 18826 1 15 157 MET . 18826 1 16 158 LYS . 18826 1 17 159 LYS . 18826 1 18 160 GLY . 18826 1 19 161 PRO . 18826 1 20 162 SER . 18826 1 21 163 GLY . 18826 1 22 164 TYR . 18826 1 23 165 GLY . 18826 1 24 166 PHE . 18826 1 25 167 ASN . 18826 1 26 168 LEU . 18826 1 27 169 HIS . 18826 1 28 170 SER . 18826 1 29 171 ASP . 18826 1 30 172 LYS . 18826 1 31 173 SER . 18826 1 32 174 LYS . 18826 1 33 175 PRO . 18826 1 34 176 GLY . 18826 1 35 177 GLN . 18826 1 36 178 PHE . 18826 1 37 179 ILE . 18826 1 38 180 ARG . 18826 1 39 181 SER . 18826 1 40 182 VAL . 18826 1 41 183 ASP . 18826 1 42 184 PRO . 18826 1 43 185 ASP . 18826 1 44 186 SER . 18826 1 45 187 PRO . 18826 1 46 188 ALA . 18826 1 47 189 GLU . 18826 1 48 190 ALA . 18826 1 49 191 SER . 18826 1 50 192 GLY . 18826 1 51 193 LEU . 18826 1 52 194 ARG . 18826 1 53 195 ALA . 18826 1 54 196 GLN . 18826 1 55 197 ASP . 18826 1 56 198 ARG . 18826 1 57 199 ILE . 18826 1 58 200 VAL . 18826 1 59 201 GLU . 18826 1 60 202 VAL . 18826 1 61 203 ASN . 18826 1 62 204 GLY . 18826 1 63 205 VAL . 18826 1 64 206 CYS . 18826 1 65 207 MET . 18826 1 66 208 GLU . 18826 1 67 209 GLY . 18826 1 68 210 LYS . 18826 1 69 211 GLN . 18826 1 70 212 HIS . 18826 1 71 213 GLY . 18826 1 72 214 ASP . 18826 1 73 215 VAL . 18826 1 74 216 VAL . 18826 1 75 217 SER . 18826 1 76 218 ALA . 18826 1 77 219 ILE . 18826 1 78 220 ARG . 18826 1 79 221 ALA . 18826 1 80 222 GLY . 18826 1 81 223 GLY . 18826 1 82 224 ASP . 18826 1 83 225 GLU . 18826 1 84 226 THR . 18826 1 85 227 LYS . 18826 1 86 228 LEU . 18826 1 87 229 LEU . 18826 1 88 230 VAL . 18826 1 89 231 VAL . 18826 1 90 232 ASP . 18826 1 91 233 ARG . 18826 1 92 234 GLU . 18826 1 93 235 THR . 18826 1 94 236 ASP . 18826 1 95 237 GLU . 18826 1 96 238 PHE . 18826 1 97 239 PHE . 18826 1 98 240 LYS . 18826 1 99 241 LYS . 18826 1 100 242 CYS . 18826 1 101 243 ARG . 18826 1 102 244 VAL . 18826 1 103 245 ILE . 18826 1 104 246 PRO . 18826 1 105 247 SER . 18826 1 106 248 GLN . 18826 1 107 249 GLU . 18826 1 108 250 HIS . 18826 1 109 251 LEU . 18826 1 110 252 ASN . 18826 1 111 253 GLY . 18826 1 112 254 PRO . 18826 1 113 255 LEU . 18826 1 114 256 PRO . 18826 1 115 257 VAL . 18826 1 116 258 PRO . 18826 1 117 259 PHE . 18826 1 118 260 THR . 18826 1 119 261 ASN . 18826 1 120 262 GLY . 18826 1 121 263 GLU . 18826 1 122 264 ILE . 18826 1 123 265 GLN . 18826 1 124 266 LYS . 18826 1 125 267 GLU . 18826 1 126 268 ASN . 18826 1 127 269 SER . 18826 1 128 270 ARG . 18826 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 18826 1 . ILE 2 2 18826 1 . ASP 3 3 18826 1 . PRO 4 4 18826 1 . PHE 5 5 18826 1 . THR 6 6 18826 1 . MET 7 7 18826 1 . LEU 8 8 18826 1 . ARG 9 9 18826 1 . PRO 10 10 18826 1 . ARG 11 11 18826 1 . LEU 12 12 18826 1 . CYS 13 13 18826 1 . THR 14 14 18826 1 . MET 15 15 18826 1 . LYS 16 16 18826 1 . LYS 17 17 18826 1 . GLY 18 18 18826 1 . PRO 19 19 18826 1 . SER 20 20 18826 1 . GLY 21 21 18826 1 . TYR 22 22 18826 1 . GLY 23 23 18826 1 . PHE 24 24 18826 1 . ASN 25 25 18826 1 . LEU 26 26 18826 1 . HIS 27 27 18826 1 . SER 28 28 18826 1 . ASP 29 29 18826 1 . LYS 30 30 18826 1 . SER 31 31 18826 1 . LYS 32 32 18826 1 . PRO 33 33 18826 1 . GLY 34 34 18826 1 . GLN 35 35 18826 1 . PHE 36 36 18826 1 . ILE 37 37 18826 1 . ARG 38 38 18826 1 . SER 39 39 18826 1 . VAL 40 40 18826 1 . ASP 41 41 18826 1 . PRO 42 42 18826 1 . ASP 43 43 18826 1 . SER 44 44 18826 1 . PRO 45 45 18826 1 . ALA 46 46 18826 1 . GLU 47 47 18826 1 . ALA 48 48 18826 1 . SER 49 49 18826 1 . GLY 50 50 18826 1 . LEU 51 51 18826 1 . ARG 52 52 18826 1 . ALA 53 53 18826 1 . GLN 54 54 18826 1 . ASP 55 55 18826 1 . ARG 56 56 18826 1 . ILE 57 57 18826 1 . VAL 58 58 18826 1 . GLU 59 59 18826 1 . VAL 60 60 18826 1 . ASN 61 61 18826 1 . GLY 62 62 18826 1 . VAL 63 63 18826 1 . CYS 64 64 18826 1 . MET 65 65 18826 1 . GLU 66 66 18826 1 . GLY 67 67 18826 1 . LYS 68 68 18826 1 . GLN 69 69 18826 1 . HIS 70 70 18826 1 . GLY 71 71 18826 1 . ASP 72 72 18826 1 . VAL 73 73 18826 1 . VAL 74 74 18826 1 . SER 75 75 18826 1 . ALA 76 76 18826 1 . ILE 77 77 18826 1 . ARG 78 78 18826 1 . ALA 79 79 18826 1 . GLY 80 80 18826 1 . GLY 81 81 18826 1 . ASP 82 82 18826 1 . GLU 83 83 18826 1 . THR 84 84 18826 1 . LYS 85 85 18826 1 . LEU 86 86 18826 1 . LEU 87 87 18826 1 . VAL 88 88 18826 1 . VAL 89 89 18826 1 . ASP 90 90 18826 1 . ARG 91 91 18826 1 . GLU 92 92 18826 1 . THR 93 93 18826 1 . ASP 94 94 18826 1 . GLU 95 95 18826 1 . PHE 96 96 18826 1 . PHE 97 97 18826 1 . LYS 98 98 18826 1 . LYS 99 99 18826 1 . CYS 100 100 18826 1 . ARG 101 101 18826 1 . VAL 102 102 18826 1 . ILE 103 103 18826 1 . PRO 104 104 18826 1 . SER 105 105 18826 1 . GLN 106 106 18826 1 . GLU 107 107 18826 1 . HIS 108 108 18826 1 . LEU 109 109 18826 1 . ASN 110 110 18826 1 . GLY 111 111 18826 1 . PRO 112 112 18826 1 . LEU 113 113 18826 1 . PRO 114 114 18826 1 . VAL 115 115 18826 1 . PRO 116 116 18826 1 . PHE 117 117 18826 1 . THR 118 118 18826 1 . ASN 119 119 18826 1 . GLY 120 120 18826 1 . GLU 121 121 18826 1 . ILE 122 122 18826 1 . GLN 123 123 18826 1 . LYS 124 124 18826 1 . GLU 125 125 18826 1 . ASN 126 126 18826 1 . SER 127 127 18826 1 . ARG 128 128 18826 1 stop_ save_ save_CFTR _Entity.Sf_category entity _Entity.Sf_framecode CFTR _Entity.Entry_ID 18826 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name CFTR _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code QDTRL _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 5 _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 632.693 _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 1 271 GLN . 18826 2 2 272 ASP . 18826 2 3 273 THR . 18826 2 4 274 ARG . 18826 2 5 275 LEU . 18826 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLN 1 1 18826 2 . ASP 2 2 18826 2 . THR 3 3 18826 2 . ARG 4 4 18826 2 . LEU 5 5 18826 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 18826 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $PDZ2 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 18826 1 2 2 $CFTR . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 18826 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 18826 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $PDZ2 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'Rosetta 2 (DE3)' . . . . . . . . . . . . . . . pET151/D-TOPO . . . . . . 18826 1 2 2 $CFTR . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18826 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18826 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 PDZ2 '[U-99% 13C; U-99% 15N]' . . 1 $PDZ2 . . 400 . . uM . . . . 18826 1 2 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 18826 1 3 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 18826 1 4 DTT 'natural abundance' . . . . . . 0.5 . . mM . . . . 18826 1 5 EDTA 'natural abundance' . . . . . . 0.5 . . mM . . . . 18826 1 6 CFTR 'natural abundance' . . 2 $CFTR . . 688 . . uM . . . . 18826 1 7 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18826 1 8 D2O 'natural abundance' . . . . . . 10 . . % . . . . 18826 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 18826 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 PDZ2 '[U-99% 13C; U-99% 15N]' . . 1 $PDZ2 . . 200 . . uM . . . . 18826 2 2 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 18826 2 3 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 18826 2 4 DTT 'natural abundance' . . . . . . 0.5 . . mM . . . . 18826 2 5 EDTA 'natural abundance' . . . . . . 0.5 . . mM . . . . 18826 2 6 CFTR 'natural abundance' . . 2 $CFTR . . 275 . . uM . . . . 18826 2 7 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18826 2 8 D2O 'natural abundance' . . . . . . 10 . . % . . . . 18826 2 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 18826 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 150 . mM 18826 1 pH 7.5 . pH 18826 1 pressure 1 . atm 18826 1 temperature 288 . K 18826 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 18826 _Software.ID 1 _Software.Name TOPSPIN _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 18826 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 18826 1 processing 18826 1 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 18826 _Software.ID 2 _Software.Name CARA _Software.Version 1.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 18826 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 18826 2 'peak picking' 18826 2 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 18826 _Software.ID 3 _Software.Name CYANA _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 18826 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 18826 3 stop_ save_ save_ARIA _Software.Sf_category software _Software.Sf_framecode ARIA _Software.Entry_ID 18826 _Software.ID 4 _Software.Name ARIA _Software.Version 2.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Linge, O'Donoghue and Nilges' . . 18826 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 18826 4 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 18826 _Software.ID 5 _Software.Name TALOS _Software.Version 1.01 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 18826 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 18826 5 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 18826 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 18826 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _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 18826 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_4 _NMR_spectrometer.Entry_ID 18826 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_5 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_5 _NMR_spectrometer.Entry_ID 18826 _NMR_spectrometer.ID 5 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 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 18826 _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 . 900 . . . 18826 1 2 spectrometer_2 Bruker Avance . 800 . . . 18826 1 3 spectrometer_3 Bruker Avance . 700 . . . 18826 1 4 spectrometer_4 Bruker Avance . 600 . . . 18826 1 5 spectrometer_5 Bruker Avance . 500 . . . 18826 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 18826 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18826 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18826 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18826 1 4 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18826 1 5 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18826 1 6 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18826 1 7 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18826 1 8 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18826 1 9 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18826 1 10 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18826 1 11 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18826 1 12 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 4 $spectrometer_4 . . . . . . . . . . . . . . . . 18826 1 13 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 5 $spectrometer_5 . . . . . . . . . . . . . . . . 18826 1 14 '2D 13C,15N f1,f2-filtered TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18826 1 15 '2D 13C,15N f1,f2-filtered NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18826 1 16 '2D 13C,15N f2-filtered NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18826 1 17 '3D 13C,15N f1-filtered 13C-edited NOESY-HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 18826 1 18 '3D 13C,15N f1-filtered 15N-edited NOESY-HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 18826 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 18826 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 18826 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 18826 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 18826 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 18826 _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' . . . 18826 1 10 '3D HNCACB' . . . 18826 1 12 '3D H(CCO)NH' . . . 18826 1 13 '3D HCCH-TOCSY' . . . 18826 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLY HA2 H 1 3.735 0.05 . 2 . . . A 143 GLY HA2 . 18826 1 2 . 1 1 1 1 GLY HA3 H 1 3.735 0.05 . 2 . . . A 143 GLY HA3 . 18826 1 3 . 1 1 1 1 GLY H H 1 8.310 0.05 . 1 . . . A 143 GLY H1 . 18826 1 4 . 1 1 1 1 GLY C C 13 169.863 0.50 . 1 . . . A 143 GLY C . 18826 1 5 . 1 1 1 1 GLY CA C 13 42.969 0.50 . 1 . . . A 143 GLY CA . 18826 1 6 . 1 1 1 1 GLY N N 15 109.071 0.10 . 1 . . . A 143 GLY N . 18826 1 7 . 1 1 2 2 ILE H H 1 8.393 0.05 . 1 . . . A 144 ILE H . 18826 1 8 . 1 1 2 2 ILE HA H 1 4.059 0.05 . 1 . . . A 144 ILE HA . 18826 1 9 . 1 1 2 2 ILE HB H 1 1.677 0.05 . 1 . . . A 144 ILE HB . 18826 1 10 . 1 1 2 2 ILE HG12 H 1 1.039 0.05 . 2 . . . A 144 ILE HG12 . 18826 1 11 . 1 1 2 2 ILE HG13 H 1 1.304 0.05 . 2 . . . A 144 ILE HG13 . 18826 1 12 . 1 1 2 2 ILE HG21 H 1 0.750 0.05 . 1 . . . A 144 ILE HG21 . 18826 1 13 . 1 1 2 2 ILE HG22 H 1 0.750 0.05 . 1 . . . A 144 ILE HG22 . 18826 1 14 . 1 1 2 2 ILE HG23 H 1 0.750 0.05 . 1 . . . A 144 ILE HG23 . 18826 1 15 . 1 1 2 2 ILE HD11 H 1 0.721 0.05 . 1 . . . A 144 ILE HD11 . 18826 1 16 . 1 1 2 2 ILE HD12 H 1 0.721 0.05 . 1 . . . A 144 ILE HD12 . 18826 1 17 . 1 1 2 2 ILE HD13 H 1 0.721 0.05 . 1 . . . A 144 ILE HD13 . 18826 1 18 . 1 1 2 2 ILE C C 13 175.668 0.50 . 1 . . . A 144 ILE C . 18826 1 19 . 1 1 2 2 ILE CA C 13 60.512 0.50 . 1 . . . A 144 ILE CA . 18826 1 20 . 1 1 2 2 ILE CB C 13 38.645 0.50 . 1 . . . A 144 ILE CB . 18826 1 21 . 1 1 2 2 ILE CG1 C 13 26.774 0.50 . 1 . . . A 144 ILE CG1 . 18826 1 22 . 1 1 2 2 ILE CG2 C 13 17.370 0.50 . 1 . . . A 144 ILE CG2 . 18826 1 23 . 1 1 2 2 ILE CD1 C 13 12.744 0.50 . 1 . . . A 144 ILE CD1 . 18826 1 24 . 1 1 2 2 ILE N N 15 119.559 0.10 . 1 . . . A 144 ILE N . 18826 1 25 . 1 1 3 3 ASP H H 1 8.465 0.05 . 1 . . . A 145 ASP H . 18826 1 26 . 1 1 3 3 ASP HA H 1 4.746 0.05 . 1 . . . A 145 ASP HA . 18826 1 27 . 1 1 3 3 ASP HB2 H 1 2.499 0.05 . 2 . . . A 145 ASP HB2 . 18826 1 28 . 1 1 3 3 ASP HB3 H 1 2.679 0.05 . 2 . . . A 145 ASP HB3 . 18826 1 29 . 1 1 3 3 ASP CA C 13 52.134 0.50 . 1 . . . A 145 ASP CA . 18826 1 30 . 1 1 3 3 ASP CB C 13 40.975 0.50 . 1 . . . A 145 ASP CB . 18826 1 31 . 1 1 3 3 ASP N N 15 126.392 0.10 . 1 . . . A 145 ASP N . 18826 1 32 . 1 1 4 4 PRO HA H 1 4.161 0.05 . 1 . . . A 146 PRO HA . 18826 1 33 . 1 1 4 4 PRO HB2 H 1 1.399 0.05 . 2 . . . A 146 PRO HB2 . 18826 1 34 . 1 1 4 4 PRO HB3 H 1 2.012 0.05 . 2 . . . A 146 PRO HB3 . 18826 1 35 . 1 1 4 4 PRO HG2 H 1 1.525 0.05 . 2 . . . A 146 PRO HG2 . 18826 1 36 . 1 1 4 4 PRO HG3 H 1 1.750 0.05 . 2 . . . A 146 PRO HG3 . 18826 1 37 . 1 1 4 4 PRO HD2 H 1 3.642 0.05 . 2 . . . A 146 PRO HD2 . 18826 1 38 . 1 1 4 4 PRO HD3 H 1 3.784 0.05 . 2 . . . A 146 PRO HD3 . 18826 1 39 . 1 1 4 4 PRO C C 13 177.127 0.50 . 1 . . . A 146 PRO C . 18826 1 40 . 1 1 4 4 PRO CA C 13 63.309 0.50 . 1 . . . A 146 PRO CA . 18826 1 41 . 1 1 4 4 PRO CB C 13 31.558 0.50 . 1 . . . A 146 PRO CB . 18826 1 42 . 1 1 4 4 PRO CG C 13 26.568 0.50 . 1 . . . A 146 PRO CG . 18826 1 43 . 1 1 4 4 PRO CD C 13 50.588 0.50 . 1 . . . A 146 PRO CD . 18826 1 44 . 1 1 5 5 PHE H H 1 8.122 0.05 . 1 . . . A 147 PHE H . 18826 1 45 . 1 1 5 5 PHE HA H 1 4.419 0.05 . 1 . . . A 147 PHE HA . 18826 1 46 . 1 1 5 5 PHE HB2 H 1 2.903 0.05 . 2 . . . A 147 PHE HB2 . 18826 1 47 . 1 1 5 5 PHE HB3 H 1 3.045 0.05 . 2 . . . A 147 PHE HB3 . 18826 1 48 . 1 1 5 5 PHE HD1 H 1 7.122 0.05 . 3 . . . A 147 PHE HD1 . 18826 1 49 . 1 1 5 5 PHE HD2 H 1 7.122 0.05 . 3 . . . A 147 PHE HD2 . 18826 1 50 . 1 1 5 5 PHE C C 13 175.977 0.50 . 1 . . . A 147 PHE C . 18826 1 51 . 1 1 5 5 PHE CA C 13 57.715 0.50 . 1 . . . A 147 PHE CA . 18826 1 52 . 1 1 5 5 PHE CB C 13 38.435 0.50 . 1 . . . A 147 PHE CB . 18826 1 53 . 1 1 5 5 PHE CD2 C 13 131.498 0.50 . 3 . . . A 147 PHE CD2 . 18826 1 54 . 1 1 5 5 PHE N N 15 117.697 0.10 . 1 . . . A 147 PHE N . 18826 1 55 . 1 1 6 6 THR H H 1 7.487 0.05 . 1 . . . A 148 THR H . 18826 1 56 . 1 1 6 6 THR HA H 1 3.997 0.05 . 1 . . . A 148 THR HA . 18826 1 57 . 1 1 6 6 THR HB H 1 4.061 0.05 . 1 . . . A 148 THR HB . 18826 1 58 . 1 1 6 6 THR HG21 H 1 1.097 0.05 . 1 . . . A 148 THR HG21 . 18826 1 59 . 1 1 6 6 THR HG22 H 1 1.097 0.05 . 1 . . . A 148 THR HG22 . 18826 1 60 . 1 1 6 6 THR HG23 H 1 1.097 0.05 . 1 . . . A 148 THR HG23 . 18826 1 61 . 1 1 6 6 THR C C 13 174.104 0.50 . 1 . . . A 148 THR C . 18826 1 62 . 1 1 6 6 THR CA C 13 62.812 0.50 . 1 . . . A 148 THR CA . 18826 1 63 . 1 1 6 6 THR CB C 13 69.377 0.50 . 1 . . . A 148 THR CB . 18826 1 64 . 1 1 6 6 THR CG2 C 13 21.157 0.50 . 1 . . . A 148 THR CG2 . 18826 1 65 . 1 1 6 6 THR N N 15 112.938 0.10 . 1 . . . A 148 THR N . 18826 1 66 . 1 1 7 7 MET H H 1 7.966 0.05 . 1 . . . A 149 MET H . 18826 1 67 . 1 1 7 7 MET HA H 1 4.302 0.05 . 1 . . . A 149 MET HA . 18826 1 68 . 1 1 7 7 MET HB2 H 1 1.948 0.05 . 2 . . . A 149 MET HB2 . 18826 1 69 . 1 1 7 7 MET HB3 H 1 1.860 0.05 . 2 . . . A 149 MET HB3 . 18826 1 70 . 1 1 7 7 MET HG2 H 1 2.369 0.05 . 2 . . . A 149 MET HG2 . 18826 1 71 . 1 1 7 7 MET HG3 H 1 2.483 0.05 . 2 . . . A 149 MET HG3 . 18826 1 72 . 1 1 7 7 MET C C 13 175.705 0.50 . 1 . . . A 149 MET C . 18826 1 73 . 1 1 7 7 MET CA C 13 55.202 0.50 . 1 . . . A 149 MET CA . 18826 1 74 . 1 1 7 7 MET CB C 13 31.850 0.50 . 1 . . . A 149 MET CB . 18826 1 75 . 1 1 7 7 MET CG C 13 31.835 0.50 . 1 . . . A 149 MET CG . 18826 1 76 . 1 1 7 7 MET N N 15 120.732 0.10 . 1 . . . A 149 MET N . 18826 1 77 . 1 1 8 8 LEU H H 1 7.788 0.05 . 1 . . . A 150 LEU H . 18826 1 78 . 1 1 8 8 LEU HA H 1 4.534 0.05 . 1 . . . A 150 LEU HA . 18826 1 79 . 1 1 8 8 LEU HB2 H 1 1.253 0.05 . 2 . . . A 150 LEU HB2 . 18826 1 80 . 1 1 8 8 LEU HB3 H 1 1.255 0.05 . 2 . . . A 150 LEU HB3 . 18826 1 81 . 1 1 8 8 LEU HG H 1 1.131 0.05 . 1 . . . A 150 LEU HG . 18826 1 82 . 1 1 8 8 LEU HD11 H 1 0.495 0.05 . 2 . . . A 150 LEU HD11 . 18826 1 83 . 1 1 8 8 LEU HD12 H 1 0.495 0.05 . 2 . . . A 150 LEU HD12 . 18826 1 84 . 1 1 8 8 LEU HD13 H 1 0.495 0.05 . 2 . . . A 150 LEU HD13 . 18826 1 85 . 1 1 8 8 LEU HD21 H 1 0.242 0.05 . 2 . . . A 150 LEU HD21 . 18826 1 86 . 1 1 8 8 LEU HD22 H 1 0.242 0.05 . 2 . . . A 150 LEU HD22 . 18826 1 87 . 1 1 8 8 LEU HD23 H 1 0.242 0.05 . 2 . . . A 150 LEU HD23 . 18826 1 88 . 1 1 8 8 LEU C C 13 173.286 0.50 . 1 . . . A 150 LEU C . 18826 1 89 . 1 1 8 8 LEU CA C 13 54.157 0.50 . 1 . . . A 150 LEU CA . 18826 1 90 . 1 1 8 8 LEU CB C 13 39.800 0.50 . 1 . . . A 150 LEU CB . 18826 1 91 . 1 1 8 8 LEU CG C 13 25.733 0.50 . 1 . . . A 150 LEU CG . 18826 1 92 . 1 1 8 8 LEU CD1 C 13 22.659 0.50 . 2 . . . A 150 LEU CD1 . 18826 1 93 . 1 1 8 8 LEU CD2 C 13 25.207 0.50 . 2 . . . A 150 LEU CD2 . 18826 1 94 . 1 1 8 8 LEU N N 15 123.707 0.10 . 1 . . . A 150 LEU N . 18826 1 95 . 1 1 9 9 ARG H H 1 6.912 0.05 . 1 . . . A 151 ARG H . 18826 1 96 . 1 1 9 9 ARG HA H 1 4.910 0.05 . 1 . . . A 151 ARG HA . 18826 1 97 . 1 1 9 9 ARG HB2 H 1 1.474 0.05 . 2 . . . A 151 ARG HB2 . 18826 1 98 . 1 1 9 9 ARG HB3 H 1 1.838 0.05 . 2 . . . A 151 ARG HB3 . 18826 1 99 . 1 1 9 9 ARG HG2 H 1 1.650 0.05 . 2 . . . A 151 ARG HG2 . 18826 1 100 . 1 1 9 9 ARG HG3 H 1 1.757 0.05 . 2 . . . A 151 ARG HG3 . 18826 1 101 . 1 1 9 9 ARG HD2 H 1 2.956 0.05 . 2 . . . A 151 ARG HD2 . 18826 1 102 . 1 1 9 9 ARG HD3 H 1 3.368 0.05 . 2 . . . A 151 ARG HD3 . 18826 1 103 . 1 1 9 9 ARG HE H 1 7.409 0.05 . 1 . . . A 151 ARG HE . 18826 1 104 . 1 1 9 9 ARG HH11 H 1 6.328 0.05 . 2 . . . A 151 ARG HH11 . 18826 1 105 . 1 1 9 9 ARG HH12 H 1 6.328 0.05 . 2 . . . A 151 ARG HH12 . 18826 1 106 . 1 1 9 9 ARG CA C 13 52.435 0.50 . 1 . . . A 151 ARG CA . 18826 1 107 . 1 1 9 9 ARG CB C 13 32.082 0.50 . 1 . . . A 151 ARG CB . 18826 1 108 . 1 1 9 9 ARG CG C 13 28.790 0.50 . 1 . . . A 151 ARG CG . 18826 1 109 . 1 1 9 9 ARG CD C 13 42.998 0.50 . 1 . . . A 151 ARG CD . 18826 1 110 . 1 1 9 9 ARG N N 15 113.035 0.10 . 1 . . . A 151 ARG N . 18826 1 111 . 1 1 10 10 PRO HA H 1 4.657 0.05 . 1 . . . A 152 PRO HA . 18826 1 112 . 1 1 10 10 PRO HB2 H 1 1.454 0.05 . 2 . . . A 152 PRO HB2 . 18826 1 113 . 1 1 10 10 PRO HB3 H 1 1.574 0.05 . 2 . . . A 152 PRO HB3 . 18826 1 114 . 1 1 10 10 PRO HD2 H 1 3.476 0.05 . 2 . . . A 152 PRO HD2 . 18826 1 115 . 1 1 10 10 PRO HD3 H 1 3.534 0.05 . 2 . . . A 152 PRO HD3 . 18826 1 116 . 1 1 10 10 PRO C C 13 173.106 0.50 . 1 . . . A 152 PRO C . 18826 1 117 . 1 1 10 10 PRO CA C 13 62.142 0.50 . 1 . . . A 152 PRO CA . 18826 1 118 . 1 1 10 10 PRO CB C 13 31.833 0.50 . 1 . . . A 152 PRO CB . 18826 1 119 . 1 1 10 10 PRO CD C 13 50.095 0.50 . 1 . . . A 152 PRO CD . 18826 1 120 . 1 1 11 11 ARG H H 1 8.423 0.05 . 1 . . . A 153 ARG H . 18826 1 121 . 1 1 11 11 ARG HA H 1 4.294 0.05 . 1 . . . A 153 ARG HA . 18826 1 122 . 1 1 11 11 ARG HB2 H 1 1.034 0.05 . 2 . . . A 153 ARG HB2 . 18826 1 123 . 1 1 11 11 ARG HB3 H 1 1.542 0.05 . 2 . . . A 153 ARG HB3 . 18826 1 124 . 1 1 11 11 ARG HG2 H 1 1.256 0.05 . 2 . . . A 153 ARG HG2 . 18826 1 125 . 1 1 11 11 ARG HG3 H 1 1.593 0.05 . 2 . . . A 153 ARG HG3 . 18826 1 126 . 1 1 11 11 ARG HD2 H 1 2.836 0.05 . 2 . . . A 153 ARG HD2 . 18826 1 127 . 1 1 11 11 ARG HD3 H 1 3.129 0.05 . 2 . . . A 153 ARG HD3 . 18826 1 128 . 1 1 11 11 ARG HE H 1 6.757 0.05 . 1 . . . A 153 ARG HE . 18826 1 129 . 1 1 11 11 ARG C C 13 173.640 0.50 . 1 . . . A 153 ARG C . 18826 1 130 . 1 1 11 11 ARG CA C 13 54.213 0.50 . 1 . . . A 153 ARG CA . 18826 1 131 . 1 1 11 11 ARG CB C 13 32.628 0.50 . 1 . . . A 153 ARG CB . 18826 1 132 . 1 1 11 11 ARG CG C 13 28.781 0.50 . 1 . . . A 153 ARG CG . 18826 1 133 . 1 1 11 11 ARG CD C 13 42.521 0.50 . 1 . . . A 153 ARG CD . 18826 1 134 . 1 1 11 11 ARG N N 15 116.260 0.10 . 1 . . . A 153 ARG N . 18826 1 135 . 1 1 11 11 ARG NE N 15 83.576 0.10 . 1 . . . A 153 ARG NE . 18826 1 136 . 1 1 12 12 LEU H H 1 8.666 0.05 . 1 . . . A 154 LEU H . 18826 1 137 . 1 1 12 12 LEU HA H 1 4.947 0.05 . 1 . . . A 154 LEU HA . 18826 1 138 . 1 1 12 12 LEU HB2 H 1 1.037 0.05 . 2 . . . A 154 LEU HB2 . 18826 1 139 . 1 1 12 12 LEU HB3 H 1 1.817 0.05 . 2 . . . A 154 LEU HB3 . 18826 1 140 . 1 1 12 12 LEU HG H 1 1.123 0.05 . 1 . . . A 154 LEU HG . 18826 1 141 . 1 1 12 12 LEU HD11 H 1 0.549 0.05 . 2 . . . A 154 LEU HD11 . 18826 1 142 . 1 1 12 12 LEU HD12 H 1 0.549 0.05 . 2 . . . A 154 LEU HD12 . 18826 1 143 . 1 1 12 12 LEU HD13 H 1 0.549 0.05 . 2 . . . A 154 LEU HD13 . 18826 1 144 . 1 1 12 12 LEU HD21 H 1 0.668 0.05 . 2 . . . A 154 LEU HD21 . 18826 1 145 . 1 1 12 12 LEU HD22 H 1 0.668 0.05 . 2 . . . A 154 LEU HD22 . 18826 1 146 . 1 1 12 12 LEU HD23 H 1 0.668 0.05 . 2 . . . A 154 LEU HD23 . 18826 1 147 . 1 1 12 12 LEU C C 13 176.169 0.50 . 1 . . . A 154 LEU C . 18826 1 148 . 1 1 12 12 LEU CA C 13 52.883 0.50 . 1 . . . A 154 LEU CA . 18826 1 149 . 1 1 12 12 LEU CB C 13 43.463 0.50 . 1 . . . A 154 LEU CB . 18826 1 150 . 1 1 12 12 LEU CG C 13 26.990 0.50 . 1 . . . A 154 LEU CG . 18826 1 151 . 1 1 12 12 LEU CD1 C 13 23.165 0.50 . 2 . . . A 154 LEU CD1 . 18826 1 152 . 1 1 12 12 LEU CD2 C 13 25.472 0.50 . 2 . . . A 154 LEU CD2 . 18826 1 153 . 1 1 12 12 LEU N N 15 124.350 0.10 . 1 . . . A 154 LEU N . 18826 1 154 . 1 1 13 13 CYS H H 1 9.357 0.05 . 1 . . . A 155 CYS H . 18826 1 155 . 1 1 13 13 CYS HA H 1 4.625 0.05 . 1 . . . A 155 CYS HA . 18826 1 156 . 1 1 13 13 CYS HB2 H 1 2.293 0.05 . 2 . . . A 155 CYS HB2 . 18826 1 157 . 1 1 13 13 CYS HB3 H 1 2.715 0.05 . 2 . . . A 155 CYS HB3 . 18826 1 158 . 1 1 13 13 CYS C C 13 173.624 0.50 . 1 . . . A 155 CYS C . 18826 1 159 . 1 1 13 13 CYS CA C 13 57.461 0.50 . 1 . . . A 155 CYS CA . 18826 1 160 . 1 1 13 13 CYS CB C 13 28.251 0.50 . 1 . . . A 155 CYS CB . 18826 1 161 . 1 1 13 13 CYS N N 15 129.065 0.10 . 1 . . . A 155 CYS N . 18826 1 162 . 1 1 14 14 THR H H 1 8.926 0.05 . 1 . . . A 156 THR H . 18826 1 163 . 1 1 14 14 THR HA H 1 3.975 0.05 . 1 . . . A 156 THR HA . 18826 1 164 . 1 1 14 14 THR HB H 1 3.932 0.05 . 1 . . . A 156 THR HB . 18826 1 165 . 1 1 14 14 THR HG21 H 1 1.023 0.05 . 1 . . . A 156 THR HG21 . 18826 1 166 . 1 1 14 14 THR HG22 H 1 1.023 0.05 . 1 . . . A 156 THR HG22 . 18826 1 167 . 1 1 14 14 THR HG23 H 1 1.023 0.05 . 1 . . . A 156 THR HG23 . 18826 1 168 . 1 1 14 14 THR C C 13 173.064 0.50 . 1 . . . A 156 THR C . 18826 1 169 . 1 1 14 14 THR CA C 13 61.019 0.50 . 1 . . . A 156 THR CA . 18826 1 170 . 1 1 14 14 THR CB C 13 68.906 0.50 . 1 . . . A 156 THR CB . 18826 1 171 . 1 1 14 14 THR CG2 C 13 21.142 0.50 . 1 . . . A 156 THR CG2 . 18826 1 172 . 1 1 14 14 THR N N 15 122.778 0.10 . 1 . . . A 156 THR N . 18826 1 173 . 1 1 15 15 MET H H 1 8.673 0.05 . 1 . . . A 157 MET H . 18826 1 174 . 1 1 15 15 MET HA H 1 4.839 0.05 . 1 . . . A 157 MET HA . 18826 1 175 . 1 1 15 15 MET HB2 H 1 1.652 0.05 . 2 . . . A 157 MET HB2 . 18826 1 176 . 1 1 15 15 MET HB3 H 1 1.912 0.05 . 2 . . . A 157 MET HB3 . 18826 1 177 . 1 1 15 15 MET HG2 H 1 2.149 0.05 . 2 . . . A 157 MET HG2 . 18826 1 178 . 1 1 15 15 MET HG3 H 1 2.048 0.05 . 2 . . . A 157 MET HG3 . 18826 1 179 . 1 1 15 15 MET HE1 H 1 1.440 0.05 . 1 . . . A 157 MET HE1 . 18826 1 180 . 1 1 15 15 MET HE2 H 1 1.440 0.05 . 1 . . . A 157 MET HE2 . 18826 1 181 . 1 1 15 15 MET HE3 H 1 1.440 0.05 . 1 . . . A 157 MET HE3 . 18826 1 182 . 1 1 15 15 MET C C 13 173.000 0.50 . 1 . . . A 157 MET C . 18826 1 183 . 1 1 15 15 MET CA C 13 54.186 0.50 . 1 . . . A 157 MET CA . 18826 1 184 . 1 1 15 15 MET CB C 13 37.924 0.50 . 1 . . . A 157 MET CB . 18826 1 185 . 1 1 15 15 MET CG C 13 32.288 0.50 . 1 . . . A 157 MET CG . 18826 1 186 . 1 1 15 15 MET CE C 13 18.111 0.50 . 1 . . . A 157 MET CE . 18826 1 187 . 1 1 15 15 MET N N 15 120.924 0.10 . 1 . . . A 157 MET N . 18826 1 188 . 1 1 16 16 LYS H H 1 8.467 0.05 . 1 . . . A 158 LYS H . 18826 1 189 . 1 1 16 16 LYS HA H 1 5.139 0.05 . 1 . . . A 158 LYS HA . 18826 1 190 . 1 1 16 16 LYS HB2 H 1 1.607 0.05 . 2 . . . A 158 LYS HB2 . 18826 1 191 . 1 1 16 16 LYS HB3 H 1 1.780 0.05 . 2 . . . A 158 LYS HB3 . 18826 1 192 . 1 1 16 16 LYS HG2 H 1 1.360 0.05 . 2 . . . A 158 LYS HG2 . 18826 1 193 . 1 1 16 16 LYS HG3 H 1 1.408 0.05 . 2 . . . A 158 LYS HG3 . 18826 1 194 . 1 1 16 16 LYS HD2 H 1 1.591 0.05 . 2 . . . A 158 LYS HD2 . 18826 1 195 . 1 1 16 16 LYS HD3 H 1 1.591 0.05 . 2 . . . A 158 LYS HD3 . 18826 1 196 . 1 1 16 16 LYS HE2 H 1 2.857 0.05 . 2 . . . A 158 LYS HE2 . 18826 1 197 . 1 1 16 16 LYS HE3 H 1 2.857 0.05 . 2 . . . A 158 LYS HE3 . 18826 1 198 . 1 1 16 16 LYS C C 13 175.785 0.50 . 1 . . . A 158 LYS C . 18826 1 199 . 1 1 16 16 LYS CA C 13 54.160 0.50 . 1 . . . A 158 LYS CA . 18826 1 200 . 1 1 16 16 LYS CB C 13 34.413 0.50 . 1 . . . A 158 LYS CB . 18826 1 201 . 1 1 16 16 LYS CG C 13 24.733 0.50 . 1 . . . A 158 LYS CG . 18826 1 202 . 1 1 16 16 LYS CD C 13 28.795 0.50 . 1 . . . A 158 LYS CD . 18826 1 203 . 1 1 16 16 LYS N N 15 122.084 0.10 . 1 . . . A 158 LYS N . 18826 1 204 . 1 1 17 17 LYS H H 1 8.383 0.05 . 1 . . . A 159 LYS H . 18826 1 205 . 1 1 17 17 LYS HA H 1 3.100 0.05 . 1 . . . A 159 LYS HA . 18826 1 206 . 1 1 17 17 LYS HB2 H 1 1.193 0.05 . 2 . . . A 159 LYS HB2 . 18826 1 207 . 1 1 17 17 LYS HB3 H 1 1.302 0.05 . 2 . . . A 159 LYS HB3 . 18826 1 208 . 1 1 17 17 LYS HG3 H 1 0.490 0.05 . 2 . . . A 159 LYS HG3 . 18826 1 209 . 1 1 17 17 LYS HD2 H 1 1.265 0.05 . 2 . . . A 159 LYS HD2 . 18826 1 210 . 1 1 17 17 LYS HD3 H 1 1.328 0.05 . 2 . . . A 159 LYS HD3 . 18826 1 211 . 1 1 17 17 LYS HE2 H 1 2.743 0.05 . 2 . . . A 159 LYS HE2 . 18826 1 212 . 1 1 17 17 LYS HE3 H 1 2.794 0.05 . 2 . . . A 159 LYS HE3 . 18826 1 213 . 1 1 17 17 LYS C C 13 177.176 0.50 . 1 . . . A 159 LYS C . 18826 1 214 . 1 1 17 17 LYS CA C 13 58.226 0.50 . 1 . . . A 159 LYS CA . 18826 1 215 . 1 1 17 17 LYS CB C 13 33.330 0.50 . 1 . . . A 159 LYS CB . 18826 1 216 . 1 1 17 17 LYS CD C 13 29.312 0.50 . 1 . . . A 159 LYS CD . 18826 1 217 . 1 1 17 17 LYS CE C 13 41.471 0.50 . 1 . . . A 159 LYS CE . 18826 1 218 . 1 1 17 17 LYS N N 15 123.393 0.10 . 1 . . . A 159 LYS N . 18826 1 219 . 1 1 18 18 GLY H H 1 7.297 0.05 . 1 . . . A 160 GLY H . 18826 1 220 . 1 1 18 18 GLY HA2 H 1 3.819 0.05 . 2 . . . A 160 GLY HA2 . 18826 1 221 . 1 1 18 18 GLY HA3 H 1 4.512 0.05 . 2 . . . A 160 GLY HA3 . 18826 1 222 . 1 1 18 18 GLY CA C 13 43.926 0.50 . 1 . . . A 160 GLY CA . 18826 1 223 . 1 1 18 18 GLY N N 15 111.578 0.10 . 1 . . . A 160 GLY N . 18826 1 224 . 1 1 19 19 PRO HA H 1 4.192 0.05 . 1 . . . A 161 PRO HA . 18826 1 225 . 1 1 19 19 PRO HB2 H 1 1.849 0.05 . 2 . . . A 161 PRO HB2 . 18826 1 226 . 1 1 19 19 PRO HB3 H 1 2.247 0.05 . 2 . . . A 161 PRO HB3 . 18826 1 227 . 1 1 19 19 PRO HG2 H 1 1.918 0.05 . 2 . . . A 161 PRO HG2 . 18826 1 228 . 1 1 19 19 PRO HG3 H 1 1.983 0.05 . 2 . . . A 161 PRO HG3 . 18826 1 229 . 1 1 19 19 PRO HD2 H 1 3.553 0.05 . 2 . . . A 161 PRO HD2 . 18826 1 230 . 1 1 19 19 PRO HD3 H 1 3.654 0.05 . 2 . . . A 161 PRO HD3 . 18826 1 231 . 1 1 19 19 PRO C C 13 177.874 0.50 . 1 . . . A 161 PRO C . 18826 1 232 . 1 1 19 19 PRO CA C 13 64.830 0.50 . 1 . . . A 161 PRO CA . 18826 1 233 . 1 1 19 19 PRO CB C 13 31.863 0.50 . 1 . . . A 161 PRO CB . 18826 1 234 . 1 1 19 19 PRO CG C 13 26.999 0.50 . 1 . . . A 161 PRO CG . 18826 1 235 . 1 1 19 19 PRO CD C 13 49.423 0.50 . 1 . . . A 161 PRO CD . 18826 1 236 . 1 1 20 20 SER H H 1 8.347 0.05 . 1 . . . A 162 SER H . 18826 1 237 . 1 1 20 20 SER HA H 1 4.599 0.05 . 1 . . . A 162 SER HA . 18826 1 238 . 1 1 20 20 SER HB2 H 1 3.738 0.05 . 2 . . . A 162 SER HB2 . 18826 1 239 . 1 1 20 20 SER HB3 H 1 3.802 0.05 . 2 . . . A 162 SER HB3 . 18826 1 240 . 1 1 20 20 SER C C 13 173.944 0.50 . 1 . . . A 162 SER C . 18826 1 241 . 1 1 20 20 SER CA C 13 56.213 0.50 . 1 . . . A 162 SER CA . 18826 1 242 . 1 1 20 20 SER CB C 13 63.011 0.50 . 1 . . . A 162 SER CB . 18826 1 243 . 1 1 20 20 SER N N 15 111.402 0.10 . 1 . . . A 162 SER N . 18826 1 244 . 1 1 21 21 GLY H H 1 7.558 0.05 . 1 . . . A 163 GLY H . 18826 1 245 . 1 1 21 21 GLY HA2 H 1 3.060 0.05 . 2 . . . A 163 GLY HA2 . 18826 1 246 . 1 1 21 21 GLY HA3 H 1 4.285 0.05 . 2 . . . A 163 GLY HA3 . 18826 1 247 . 1 1 21 21 GLY C C 13 174.873 0.50 . 1 . . . A 163 GLY C . 18826 1 248 . 1 1 21 21 GLY CA C 13 43.987 0.50 . 1 . . . A 163 GLY CA . 18826 1 249 . 1 1 21 21 GLY N N 15 108.788 0.10 . 1 . . . A 163 GLY N . 18826 1 250 . 1 1 22 22 TYR H H 1 11.816 0.05 . 1 . . . A 164 TYR H . 18826 1 251 . 1 1 22 22 TYR HA H 1 4.316 0.05 . 1 . . . A 164 TYR HA . 18826 1 252 . 1 1 22 22 TYR HB2 H 1 2.600 0.05 . 2 . . . A 164 TYR HB2 . 18826 1 253 . 1 1 22 22 TYR HB3 H 1 3.227 0.05 . 2 . . . A 164 TYR HB3 . 18826 1 254 . 1 1 22 22 TYR HD1 H 1 6.746 0.05 . 3 . . . A 164 TYR HD1 . 18826 1 255 . 1 1 22 22 TYR HD2 H 1 6.746 0.05 . 3 . . . A 164 TYR HD2 . 18826 1 256 . 1 1 22 22 TYR HE1 H 1 6.441 0.05 . 3 . . . A 164 TYR HE1 . 18826 1 257 . 1 1 22 22 TYR HE2 H 1 6.441 0.05 . 3 . . . A 164 TYR HE2 . 18826 1 258 . 1 1 22 22 TYR C C 13 176.105 0.50 . 1 . . . A 164 TYR C . 18826 1 259 . 1 1 22 22 TYR CA C 13 61.019 0.50 . 1 . . . A 164 TYR CA . 18826 1 260 . 1 1 22 22 TYR CB C 13 39.254 0.50 . 1 . . . A 164 TYR CB . 18826 1 261 . 1 1 22 22 TYR CD2 C 13 132.177 0.50 . 3 . . . A 164 TYR CD2 . 18826 1 262 . 1 1 22 22 TYR CE2 C 13 117.330 0.50 . 3 . . . A 164 TYR CE2 . 18826 1 263 . 1 1 22 22 TYR N N 15 128.473 0.10 . 1 . . . A 164 TYR N . 18826 1 264 . 1 1 23 23 GLY H H 1 9.570 0.05 . 1 . . . A 165 GLY H . 18826 1 265 . 1 1 23 23 GLY HA2 H 1 3.671 0.05 . 2 . . . A 165 GLY HA2 . 18826 1 266 . 1 1 23 23 GLY HA3 H 1 4.356 0.05 . 2 . . . A 165 GLY HA3 . 18826 1 267 . 1 1 23 23 GLY C C 13 172.936 0.50 . 1 . . . A 165 GLY C . 18826 1 268 . 1 1 23 23 GLY CA C 13 46.038 0.50 . 1 . . . A 165 GLY CA . 18826 1 269 . 1 1 23 23 GLY N N 15 106.640 0.10 . 1 . . . A 165 GLY N . 18826 1 270 . 1 1 24 24 PHE H H 1 7.868 0.05 . 1 . . . A 166 PHE H . 18826 1 271 . 1 1 24 24 PHE HA H 1 5.341 0.05 . 1 . . . A 166 PHE HA . 18826 1 272 . 1 1 24 24 PHE HB2 H 1 2.552 0.05 . 2 . . . A 166 PHE HB2 . 18826 1 273 . 1 1 24 24 PHE HB3 H 1 3.096 0.05 . 2 . . . A 166 PHE HB3 . 18826 1 274 . 1 1 24 24 PHE HD1 H 1 6.687 0.05 . 3 . . . A 166 PHE HD1 . 18826 1 275 . 1 1 24 24 PHE HD2 H 1 6.687 0.05 . 3 . . . A 166 PHE HD2 . 18826 1 276 . 1 1 24 24 PHE HE1 H 1 6.719 0.05 . 3 . . . A 166 PHE HE1 . 18826 1 277 . 1 1 24 24 PHE HE2 H 1 6.719 0.05 . 3 . . . A 166 PHE HE2 . 18826 1 278 . 1 1 24 24 PHE HZ H 1 6.719 0.05 . 1 . . . A 166 PHE HZ . 18826 1 279 . 1 1 24 24 PHE C C 13 171.095 0.50 . 1 . . . A 166 PHE C . 18826 1 280 . 1 1 24 24 PHE CA C 13 55.189 0.50 . 1 . . . A 166 PHE CA . 18826 1 281 . 1 1 24 24 PHE CB C 13 41.957 0.50 . 1 . . . A 166 PHE CB . 18826 1 282 . 1 1 24 24 PHE CD2 C 13 132.366 0.50 . 3 . . . A 166 PHE CD2 . 18826 1 283 . 1 1 24 24 PHE CE2 C 13 130.194 0.50 . 3 . . . A 166 PHE CE2 . 18826 1 284 . 1 1 24 24 PHE CZ C 13 128.545 0.50 . 1 . . . A 166 PHE CZ . 18826 1 285 . 1 1 24 24 PHE N N 15 113.236 0.10 . 1 . . . A 166 PHE N . 18826 1 286 . 1 1 25 25 ASN H H 1 8.092 0.05 . 1 . . . A 167 ASN H . 18826 1 287 . 1 1 25 25 ASN HA H 1 5.293 0.05 . 1 . . . A 167 ASN HA . 18826 1 288 . 1 1 25 25 ASN HB2 H 1 2.457 0.05 . 2 . . . A 167 ASN HB2 . 18826 1 289 . 1 1 25 25 ASN HB3 H 1 2.620 0.05 . 2 . . . A 167 ASN HB3 . 18826 1 290 . 1 1 25 25 ASN HD21 H 1 6.831 0.05 . 2 . . . A 167 ASN HD21 . 18826 1 291 . 1 1 25 25 ASN HD22 H 1 7.073 0.05 . 2 . . . A 167 ASN HD22 . 18826 1 292 . 1 1 25 25 ASN C C 13 173.464 0.50 . 1 . . . A 167 ASN C . 18826 1 293 . 1 1 25 25 ASN CA C 13 52.075 0.50 . 1 . . . A 167 ASN CA . 18826 1 294 . 1 1 25 25 ASN CB C 13 41.025 0.50 . 1 . . . A 167 ASN CB . 18826 1 295 . 1 1 25 25 ASN N N 15 117.363 0.10 . 1 . . . A 167 ASN N . 18826 1 296 . 1 1 25 25 ASN ND2 N 15 111.610 0.10 . 1 . . . A 167 ASN ND2 . 18826 1 297 . 1 1 26 26 LEU H H 1 9.443 0.05 . 1 . . . A 168 LEU H . 18826 1 298 . 1 1 26 26 LEU HA H 1 5.067 0.05 . 1 . . . A 168 LEU HA . 18826 1 299 . 1 1 26 26 LEU HB2 H 1 1.194 0.05 . 2 . . . A 168 LEU HB2 . 18826 1 300 . 1 1 26 26 LEU HB3 H 1 1.911 0.05 . 2 . . . A 168 LEU HB3 . 18826 1 301 . 1 1 26 26 LEU HG H 1 1.332 0.05 . 1 . . . A 168 LEU HG . 18826 1 302 . 1 1 26 26 LEU HD11 H 1 0.272 0.05 . 2 . . . A 168 LEU HD11 . 18826 1 303 . 1 1 26 26 LEU HD12 H 1 0.272 0.05 . 2 . . . A 168 LEU HD12 . 18826 1 304 . 1 1 26 26 LEU HD13 H 1 0.272 0.05 . 2 . . . A 168 LEU HD13 . 18826 1 305 . 1 1 26 26 LEU HD21 H 1 0.706 0.05 . 2 . . . A 168 LEU HD21 . 18826 1 306 . 1 1 26 26 LEU HD22 H 1 0.706 0.05 . 2 . . . A 168 LEU HD22 . 18826 1 307 . 1 1 26 26 LEU HD23 H 1 0.706 0.05 . 2 . . . A 168 LEU HD23 . 18826 1 308 . 1 1 26 26 LEU C C 13 174.921 0.50 . 1 . . . A 168 LEU C . 18826 1 309 . 1 1 26 26 LEU CA C 13 53.434 0.50 . 1 . . . A 168 LEU CA . 18826 1 310 . 1 1 26 26 LEU CB C 13 45.920 0.50 . 1 . . . A 168 LEU CB . 18826 1 311 . 1 1 26 26 LEU CG C 13 25.360 0.50 . 1 . . . A 168 LEU CG . 18826 1 312 . 1 1 26 26 LEU CD1 C 13 25.703 0.50 . 2 . . . A 168 LEU CD1 . 18826 1 313 . 1 1 26 26 LEU CD2 C 13 25.254 0.50 . 2 . . . A 168 LEU CD2 . 18826 1 314 . 1 1 26 26 LEU N N 15 128.844 0.10 . 1 . . . A 168 LEU N . 18826 1 315 . 1 1 27 27 HIS H H 1 10.383 0.05 . 1 . . . A 169 HIS H . 18826 1 316 . 1 1 27 27 HIS HA H 1 5.901 0.05 . 1 . . . A 169 HIS HA . 18826 1 317 . 1 1 27 27 HIS HB2 H 1 3.084 0.05 . 2 . . . A 169 HIS HB2 . 18826 1 318 . 1 1 27 27 HIS HB3 H 1 3.084 0.05 . 2 . . . A 169 HIS HB3 . 18826 1 319 . 1 1 27 27 HIS HD2 H 1 7.102 0.05 . 1 . . . A 169 HIS HD2 . 18826 1 320 . 1 1 27 27 HIS CA C 13 55.120 0.50 . 1 . . . A 169 HIS CA . 18826 1 321 . 1 1 27 27 HIS CB C 13 33.452 0.50 . 1 . . . A 169 HIS CB . 18826 1 322 . 1 1 27 27 HIS CD2 C 13 120.075 0.50 . 1 . . . A 169 HIS CD2 . 18826 1 323 . 1 1 27 27 HIS CE1 C 13 138.805 0.50 . 1 . . . A 169 HIS CE1 . 18826 1 324 . 1 1 27 27 HIS N N 15 127.508 0.10 . 1 . . . A 169 HIS N . 18826 1 325 . 1 1 28 28 SER H H 1 8.077 0.05 . 1 . . . A 170 SER H . 18826 1 326 . 1 1 28 28 SER HA H 1 4.832 0.05 . 1 . . . A 170 SER HA . 18826 1 327 . 1 1 28 28 SER HB2 H 1 3.896 0.05 . 2 . . . A 170 SER HB2 . 18826 1 328 . 1 1 28 28 SER HB3 H 1 4.100 0.05 . 2 . . . A 170 SER HB3 . 18826 1 329 . 1 1 28 28 SER CA C 13 57.137 0.50 . 1 . . . A 170 SER CA . 18826 1 330 . 1 1 28 28 SER CB C 13 65.900 0.50 . 1 . . . A 170 SER CB . 18826 1 331 . 1 1 28 28 SER N N 15 119.111 0.10 . 1 . . . A 170 SER N . 18826 1 332 . 1 1 29 29 ASP H H 1 9.406 0.05 . 1 . . . A 171 ASP H . 18826 1 333 . 1 1 29 29 ASP HA H 1 4.719 0.05 . 1 . . . A 171 ASP HA . 18826 1 334 . 1 1 29 29 ASP HB2 H 1 2.821 0.05 . 2 . . . A 171 ASP HB2 . 18826 1 335 . 1 1 29 29 ASP HB3 H 1 2.821 0.05 . 2 . . . A 171 ASP HB3 . 18826 1 336 . 1 1 29 29 ASP C C 13 175.273 0.50 . 1 . . . A 171 ASP C . 18826 1 337 . 1 1 29 29 ASP CA C 13 53.974 0.50 . 1 . . . A 171 ASP CA . 18826 1 338 . 1 1 29 29 ASP CB C 13 43.516 0.50 . 1 . . . A 171 ASP CB . 18826 1 339 . 1 1 29 29 ASP N N 15 118.905 0.10 . 1 . . . A 171 ASP N . 18826 1 340 . 1 1 30 30 LYS H H 1 8.313 0.05 . 1 . . . A 172 LYS H . 18826 1 341 . 1 1 30 30 LYS HA H 1 4.098 0.05 . 1 . . . A 172 LYS HA . 18826 1 342 . 1 1 30 30 LYS HB2 H 1 1.780 0.05 . 2 . . . A 172 LYS HB2 . 18826 1 343 . 1 1 30 30 LYS HB3 H 1 1.750 0.05 . 2 . . . A 172 LYS HB3 . 18826 1 344 . 1 1 30 30 LYS HG2 H 1 1.366 0.05 . 2 . . . A 172 LYS HG2 . 18826 1 345 . 1 1 30 30 LYS HG3 H 1 1.401 0.05 . 2 . . . A 172 LYS HG3 . 18826 1 346 . 1 1 30 30 LYS HD2 H 1 1.584 0.05 . 2 . . . A 172 LYS HD2 . 18826 1 347 . 1 1 30 30 LYS HD3 H 1 1.584 0.05 . 2 . . . A 172 LYS HD3 . 18826 1 348 . 1 1 30 30 LYS HE2 H 1 2.994 0.05 . 2 . . . A 172 LYS HE2 . 18826 1 349 . 1 1 30 30 LYS HE3 H 1 3.018 0.05 . 2 . . . A 172 LYS HE3 . 18826 1 350 . 1 1 30 30 LYS C C 13 177.466 0.50 . 1 . . . A 172 LYS C . 18826 1 351 . 1 1 30 30 LYS CA C 13 57.356 0.50 . 1 . . . A 172 LYS CA . 18826 1 352 . 1 1 30 30 LYS CB C 13 31.840 0.50 . 1 . . . A 172 LYS CB . 18826 1 353 . 1 1 30 30 LYS CG C 13 24.661 0.50 . 1 . . . A 172 LYS CG . 18826 1 354 . 1 1 30 30 LYS N N 15 116.927 0.10 . 1 . . . A 172 LYS N . 18826 1 355 . 1 1 31 31 SER H H 1 8.923 0.05 . 1 . . . A 173 SER H . 18826 1 356 . 1 1 31 31 SER HA H 1 4.126 0.05 . 1 . . . A 173 SER HA . 18826 1 357 . 1 1 31 31 SER HB2 H 1 3.826 0.05 . 2 . . . A 173 SER HB2 . 18826 1 358 . 1 1 31 31 SER HB3 H 1 3.794 0.05 . 2 . . . A 173 SER HB3 . 18826 1 359 . 1 1 31 31 SER C C 13 173.920 0.50 . 1 . . . A 173 SER C . 18826 1 360 . 1 1 31 31 SER CA C 13 60.284 0.50 . 1 . . . A 173 SER CA . 18826 1 361 . 1 1 31 31 SER CB C 13 63.345 0.50 . 1 . . . A 173 SER CB . 18826 1 362 . 1 1 31 31 SER N N 15 116.386 0.10 . 1 . . . A 173 SER N . 18826 1 363 . 1 1 32 32 LYS H H 1 7.476 0.05 . 1 . . . A 174 LYS H . 18826 1 364 . 1 1 32 32 LYS HA H 1 4.757 0.05 . 1 . . . A 174 LYS HA . 18826 1 365 . 1 1 32 32 LYS HB2 H 1 1.650 0.05 . 2 . . . A 174 LYS HB2 . 18826 1 366 . 1 1 32 32 LYS HB3 H 1 1.822 0.05 . 2 . . . A 174 LYS HB3 . 18826 1 367 . 1 1 32 32 LYS HG2 H 1 1.233 0.05 . 2 . . . A 174 LYS HG2 . 18826 1 368 . 1 1 32 32 LYS HG3 H 1 1.290 0.05 . 2 . . . A 174 LYS HG3 . 18826 1 369 . 1 1 32 32 LYS HD2 H 1 1.401 0.05 . 2 . . . A 174 LYS HD2 . 18826 1 370 . 1 1 32 32 LYS HE2 H 1 2.477 0.05 . 2 . . . A 174 LYS HE2 . 18826 1 371 . 1 1 32 32 LYS HE3 H 1 2.546 0.05 . 2 . . . A 174 LYS HE3 . 18826 1 372 . 1 1 32 32 LYS CA C 13 53.638 0.50 . 1 . . . A 174 LYS CA . 18826 1 373 . 1 1 32 32 LYS CB C 13 33.365 0.50 . 1 . . . A 174 LYS CB . 18826 1 374 . 1 1 32 32 LYS CG C 13 22.706 0.50 . 1 . . . A 174 LYS CG . 18826 1 375 . 1 1 32 32 LYS CD C 13 29.029 0.50 . 1 . . . A 174 LYS CD . 18826 1 376 . 1 1 32 32 LYS CE C 13 41.444 0.50 . 1 . . . A 174 LYS CE . 18826 1 377 . 1 1 32 32 LYS N N 15 120.221 0.10 . 1 . . . A 174 LYS N . 18826 1 378 . 1 1 33 33 PRO HA H 1 4.567 0.05 . 1 . . . A 175 PRO HA . 18826 1 379 . 1 1 33 33 PRO HB2 H 1 1.794 0.05 . 2 . . . A 175 PRO HB2 . 18826 1 380 . 1 1 33 33 PRO HB3 H 1 2.220 0.05 . 2 . . . A 175 PRO HB3 . 18826 1 381 . 1 1 33 33 PRO HG2 H 1 1.943 0.05 . 2 . . . A 175 PRO HG2 . 18826 1 382 . 1 1 33 33 PRO HG3 H 1 2.028 0.05 . 2 . . . A 175 PRO HG3 . 18826 1 383 . 1 1 33 33 PRO HD2 H 1 3.645 0.05 . 2 . . . A 175 PRO HD2 . 18826 1 384 . 1 1 33 33 PRO HD3 H 1 3.781 0.05 . 2 . . . A 175 PRO HD3 . 18826 1 385 . 1 1 33 33 PRO C C 13 177.128 0.50 . 1 . . . A 175 PRO C . 18826 1 386 . 1 1 33 33 PRO CA C 13 62.731 0.50 . 1 . . . A 175 PRO CA . 18826 1 387 . 1 1 33 33 PRO CB C 13 31.842 0.50 . 1 . . . A 175 PRO CB . 18826 1 388 . 1 1 33 33 PRO CG C 13 27.233 0.50 . 1 . . . A 175 PRO CG . 18826 1 389 . 1 1 33 33 PRO CD C 13 50.605 0.50 . 1 . . . A 175 PRO CD . 18826 1 390 . 1 1 34 34 GLY H H 1 8.360 0.05 . 1 . . . A 176 GLY H . 18826 1 391 . 1 1 34 34 GLY HA2 H 1 3.325 0.05 . 2 . . . A 176 GLY HA2 . 18826 1 392 . 1 1 34 34 GLY HA3 H 1 4.203 0.05 . 2 . . . A 176 GLY HA3 . 18826 1 393 . 1 1 34 34 GLY C C 13 175.577 0.50 . 1 . . . A 176 GLY C . 18826 1 394 . 1 1 34 34 GLY CA C 13 43.587 0.50 . 1 . . . A 176 GLY CA . 18826 1 395 . 1 1 34 34 GLY N N 15 108.679 0.10 . 1 . . . A 176 GLY N . 18826 1 396 . 1 1 35 35 GLN HB2 H 1 1.857 0.05 . 2 . . . A 177 GLN HB2 . 18826 1 397 . 1 1 35 35 GLN HB3 H 1 1.990 0.05 . 2 . . . A 177 GLN HB3 . 18826 1 398 . 1 1 35 35 GLN HE21 H 1 6.376 0.05 . 2 . . . A 177 GLN HE21 . 18826 1 399 . 1 1 35 35 GLN HE22 H 1 7.201 0.05 . 2 . . . A 177 GLN HE22 . 18826 1 400 . 1 1 35 35 GLN C C 13 173.528 0.50 . 1 . . . A 177 GLN C . 18826 1 401 . 1 1 35 35 GLN CB C 13 28.251 0.50 . 1 . . . A 177 GLN CB . 18826 1 402 . 1 1 35 35 GLN NE2 N 15 110.042 0.10 . 1 . . . A 177 GLN NE2 . 18826 1 403 . 1 1 36 36 PHE H H 1 8.973 0.05 . 1 . . . A 178 PHE H . 18826 1 404 . 1 1 36 36 PHE HA H 1 5.213 0.05 . 1 . . . A 178 PHE HA . 18826 1 405 . 1 1 36 36 PHE HB2 H 1 2.704 0.05 . 2 . . . A 178 PHE HB2 . 18826 1 406 . 1 1 36 36 PHE HB3 H 1 2.704 0.05 . 2 . . . A 178 PHE HB3 . 18826 1 407 . 1 1 36 36 PHE HD1 H 1 7.020 0.05 . 3 . . . A 178 PHE HD1 . 18826 1 408 . 1 1 36 36 PHE HD2 H 1 7.020 0.05 . 3 . . . A 178 PHE HD2 . 18826 1 409 . 1 1 36 36 PHE HE1 H 1 7.225 0.05 . 3 . . . A 178 PHE HE1 . 18826 1 410 . 1 1 36 36 PHE HE2 H 1 7.225 0.05 . 3 . . . A 178 PHE HE2 . 18826 1 411 . 1 1 36 36 PHE HZ H 1 7.237 0.05 . 1 . . . A 178 PHE HZ . 18826 1 412 . 1 1 36 36 PHE C C 13 175.465 0.50 . 1 . . . A 178 PHE C . 18826 1 413 . 1 1 36 36 PHE CA C 13 56.183 0.50 . 1 . . . A 178 PHE CA . 18826 1 414 . 1 1 36 36 PHE CB C 13 43.242 0.50 . 1 . . . A 178 PHE CB . 18826 1 415 . 1 1 36 36 PHE CD2 C 13 132.218 0.50 . 3 . . . A 178 PHE CD2 . 18826 1 416 . 1 1 36 36 PHE CE2 C 13 131.342 0.50 . 3 . . . A 178 PHE CE2 . 18826 1 417 . 1 1 36 36 PHE N N 15 119.974 0.10 . 1 . . . A 178 PHE N . 18826 1 418 . 1 1 37 37 ILE H H 1 9.238 0.05 . 1 . . . A 179 ILE H . 18826 1 419 . 1 1 37 37 ILE HA H 1 4.434 0.05 . 1 . . . A 179 ILE HA . 18826 1 420 . 1 1 37 37 ILE HB H 1 2.326 0.05 . 1 . . . A 179 ILE HB . 18826 1 421 . 1 1 37 37 ILE HG12 H 1 0.902 0.05 . 2 . . . A 179 ILE HG12 . 18826 1 422 . 1 1 37 37 ILE HG13 H 1 1.377 0.05 . 2 . . . A 179 ILE HG13 . 18826 1 423 . 1 1 37 37 ILE HG21 H 1 0.501 0.05 . 1 . . . A 179 ILE HG21 . 18826 1 424 . 1 1 37 37 ILE HG22 H 1 0.501 0.05 . 1 . . . A 179 ILE HG22 . 18826 1 425 . 1 1 37 37 ILE HG23 H 1 0.501 0.05 . 1 . . . A 179 ILE HG23 . 18826 1 426 . 1 1 37 37 ILE HD11 H 1 0.228 0.05 . 1 . . . A 179 ILE HD11 . 18826 1 427 . 1 1 37 37 ILE HD12 H 1 0.228 0.05 . 1 . . . A 179 ILE HD12 . 18826 1 428 . 1 1 37 37 ILE HD13 H 1 0.228 0.05 . 1 . . . A 179 ILE HD13 . 18826 1 429 . 1 1 37 37 ILE C C 13 175.977 0.50 . 1 . . . A 179 ILE C . 18826 1 430 . 1 1 37 37 ILE CA C 13 57.501 0.50 . 1 . . . A 179 ILE CA . 18826 1 431 . 1 1 37 37 ILE CB C 13 34.065 0.50 . 1 . . . A 179 ILE CB . 18826 1 432 . 1 1 37 37 ILE CG1 C 13 26.260 0.50 . 1 . . . A 179 ILE CG1 . 18826 1 433 . 1 1 37 37 ILE CG2 C 13 19.139 0.50 . 1 . . . A 179 ILE CG2 . 18826 1 434 . 1 1 37 37 ILE CD1 C 13 10.243 0.50 . 1 . . . A 179 ILE CD1 . 18826 1 435 . 1 1 37 37 ILE N N 15 120.918 0.10 . 1 . . . A 179 ILE N . 18826 1 436 . 1 1 38 38 ARG H H 1 9.266 0.05 . 1 . . . A 180 ARG H . 18826 1 437 . 1 1 38 38 ARG HA H 1 4.216 0.05 . 1 . . . A 180 ARG HA . 18826 1 438 . 1 1 38 38 ARG HB2 H 1 1.652 0.05 . 2 . . . A 180 ARG HB2 . 18826 1 439 . 1 1 38 38 ARG HB3 H 1 1.652 0.05 . 2 . . . A 180 ARG HB3 . 18826 1 440 . 1 1 38 38 ARG HG2 H 1 1.448 0.05 . 2 . . . A 180 ARG HG2 . 18826 1 441 . 1 1 38 38 ARG HG3 H 1 1.464 0.05 . 2 . . . A 180 ARG HG3 . 18826 1 442 . 1 1 38 38 ARG C C 13 175.881 0.50 . 1 . . . A 180 ARG C . 18826 1 443 . 1 1 38 38 ARG CA C 13 57.716 0.50 . 1 . . . A 180 ARG CA . 18826 1 444 . 1 1 38 38 ARG CB C 13 31.303 0.50 . 1 . . . A 180 ARG CB . 18826 1 445 . 1 1 38 38 ARG CG C 13 26.742 0.50 . 1 . . . A 180 ARG CG . 18826 1 446 . 1 1 38 38 ARG N N 15 132.009 0.10 . 1 . . . A 180 ARG N . 18826 1 447 . 1 1 39 39 SER H H 1 7.396 0.05 . 1 . . . A 181 SER H . 18826 1 448 . 1 1 39 39 SER HA H 1 4.445 0.05 . 1 . . . A 181 SER HA . 18826 1 449 . 1 1 39 39 SER HB2 H 1 3.769 0.05 . 2 . . . A 181 SER HB2 . 18826 1 450 . 1 1 39 39 SER HB3 H 1 3.747 0.05 . 2 . . . A 181 SER HB3 . 18826 1 451 . 1 1 39 39 SER C C 13 171.159 0.50 . 1 . . . A 181 SER C . 18826 1 452 . 1 1 39 39 SER CA C 13 56.950 0.50 . 1 . . . A 181 SER CA . 18826 1 453 . 1 1 39 39 SER CB C 13 64.427 0.50 . 1 . . . A 181 SER CB . 18826 1 454 . 1 1 39 39 SER N N 15 107.702 0.10 . 1 . . . A 181 SER N . 18826 1 455 . 1 1 40 40 VAL H H 1 8.567 0.05 . 1 . . . A 182 VAL H . 18826 1 456 . 1 1 40 40 VAL HA H 1 4.424 0.05 . 1 . . . A 182 VAL HA . 18826 1 457 . 1 1 40 40 VAL HB H 1 1.734 0.05 . 1 . . . A 182 VAL HB . 18826 1 458 . 1 1 40 40 VAL HG11 H 1 0.497 0.05 . 2 . . . A 182 VAL HG11 . 18826 1 459 . 1 1 40 40 VAL HG12 H 1 0.497 0.05 . 2 . . . A 182 VAL HG12 . 18826 1 460 . 1 1 40 40 VAL HG13 H 1 0.497 0.05 . 2 . . . A 182 VAL HG13 . 18826 1 461 . 1 1 40 40 VAL HG21 H 1 0.663 0.05 . 2 . . . A 182 VAL HG21 . 18826 1 462 . 1 1 40 40 VAL HG22 H 1 0.663 0.05 . 2 . . . A 182 VAL HG22 . 18826 1 463 . 1 1 40 40 VAL HG23 H 1 0.663 0.05 . 2 . . . A 182 VAL HG23 . 18826 1 464 . 1 1 40 40 VAL C C 13 175.401 0.50 . 1 . . . A 182 VAL C . 18826 1 465 . 1 1 40 40 VAL CA C 13 60.503 0.50 . 1 . . . A 182 VAL CA . 18826 1 466 . 1 1 40 40 VAL CB C 13 34.399 0.50 . 1 . . . A 182 VAL CB . 18826 1 467 . 1 1 40 40 VAL CG1 C 13 21.167 0.50 . 2 . . . A 182 VAL CG1 . 18826 1 468 . 1 1 40 40 VAL CG2 C 13 21.137 0.50 . 2 . . . A 182 VAL CG2 . 18826 1 469 . 1 1 40 40 VAL N N 15 120.045 0.10 . 1 . . . A 182 VAL N . 18826 1 470 . 1 1 41 41 ASP H H 1 9.201 0.05 . 1 . . . A 183 ASP H . 18826 1 471 . 1 1 41 41 ASP HA H 1 4.619 0.05 . 1 . . . A 183 ASP HA . 18826 1 472 . 1 1 41 41 ASP HB2 H 1 2.562 0.05 . 2 . . . A 183 ASP HB2 . 18826 1 473 . 1 1 41 41 ASP HB3 H 1 2.486 0.05 . 2 . . . A 183 ASP HB3 . 18826 1 474 . 1 1 41 41 ASP CA C 13 52.170 0.50 . 1 . . . A 183 ASP CA . 18826 1 475 . 1 1 41 41 ASP CB C 13 38.904 0.50 . 1 . . . A 183 ASP CB . 18826 1 476 . 1 1 41 41 ASP N N 15 129.188 0.10 . 1 . . . A 183 ASP N . 18826 1 477 . 1 1 42 42 PRO HA H 1 4.455 0.05 . 1 . . . A 184 PRO HA . 18826 1 478 . 1 1 42 42 PRO HB2 H 1 1.762 0.05 . 2 . . . A 184 PRO HB2 . 18826 1 479 . 1 1 42 42 PRO HB3 H 1 2.251 0.05 . 2 . . . A 184 PRO HB3 . 18826 1 480 . 1 1 42 42 PRO HG2 H 1 1.966 0.05 . 2 . . . A 184 PRO HG2 . 18826 1 481 . 1 1 42 42 PRO HG3 H 1 2.028 0.05 . 2 . . . A 184 PRO HG3 . 18826 1 482 . 1 1 42 42 PRO HD2 H 1 3.885 0.05 . 2 . . . A 184 PRO HD2 . 18826 1 483 . 1 1 42 42 PRO HD3 H 1 3.578 0.05 . 2 . . . A 184 PRO HD3 . 18826 1 484 . 1 1 42 42 PRO C C 13 176.962 0.50 . 1 . . . A 184 PRO C . 18826 1 485 . 1 1 42 42 PRO CA C 13 62.827 0.50 . 1 . . . A 184 PRO CA . 18826 1 486 . 1 1 42 42 PRO CB C 13 31.492 0.50 . 1 . . . A 184 PRO CB . 18826 1 487 . 1 1 42 42 PRO CG C 13 27.235 0.50 . 1 . . . A 184 PRO CG . 18826 1 488 . 1 1 42 42 PRO CD C 13 50.524 0.50 . 1 . . . A 184 PRO CD . 18826 1 489 . 1 1 43 43 ASP H H 1 9.120 0.05 . 1 . . . A 185 ASP H . 18826 1 490 . 1 1 43 43 ASP HA H 1 4.269 0.05 . 1 . . . A 185 ASP HA . 18826 1 491 . 1 1 43 43 ASP HB2 H 1 2.686 0.05 . 2 . . . A 185 ASP HB2 . 18826 1 492 . 1 1 43 43 ASP HB3 H 1 2.873 0.05 . 2 . . . A 185 ASP HB3 . 18826 1 493 . 1 1 43 43 ASP C C 13 174.232 0.50 . 1 . . . A 185 ASP C . 18826 1 494 . 1 1 43 43 ASP CA C 13 55.427 0.50 . 1 . . . A 185 ASP CA . 18826 1 495 . 1 1 43 43 ASP CB C 13 38.899 0.50 . 1 . . . A 185 ASP CB . 18826 1 496 . 1 1 43 43 ASP N N 15 118.191 0.10 . 1 . . . A 185 ASP N . 18826 1 497 . 1 1 44 44 SER H H 1 7.242 0.05 . 1 . . . A 186 SER H . 18826 1 498 . 1 1 44 44 SER HA H 1 4.782 0.05 . 1 . . . A 186 SER HA . 18826 1 499 . 1 1 44 44 SER HB2 H 1 3.765 0.05 . 2 . . . A 186 SER HB2 . 18826 1 500 . 1 1 44 44 SER HB3 H 1 3.765 0.05 . 2 . . . A 186 SER HB3 . 18826 1 501 . 1 1 44 44 SER HG H 1 6.456 0.05 . 1 . . . A 186 SER HG . 18826 1 502 . 1 1 44 44 SER CA C 13 56.207 0.50 . 1 . . . A 186 SER CA . 18826 1 503 . 1 1 44 44 SER CB C 13 64.983 0.50 . 1 . . . A 186 SER CB . 18826 1 504 . 1 1 44 44 SER N N 15 111.603 0.10 . 1 . . . A 186 SER N . 18826 1 505 . 1 1 45 45 PRO HA H 1 4.401 0.05 . 1 . . . A 187 PRO HA . 18826 1 506 . 1 1 45 45 PRO HB2 H 1 2.183 0.05 . 2 . . . A 187 PRO HB2 . 18826 1 507 . 1 1 45 45 PRO HB3 H 1 2.860 0.05 . 2 . . . A 187 PRO HB3 . 18826 1 508 . 1 1 45 45 PRO HG2 H 1 2.129 0.05 . 2 . . . A 187 PRO HG2 . 18826 1 509 . 1 1 45 45 PRO HG3 H 1 2.432 0.05 . 2 . . . A 187 PRO HG3 . 18826 1 510 . 1 1 45 45 PRO HD2 H 1 3.702 0.05 . 2 . . . A 187 PRO HD2 . 18826 1 511 . 1 1 45 45 PRO HD3 H 1 3.918 0.05 . 2 . . . A 187 PRO HD3 . 18826 1 512 . 1 1 45 45 PRO C C 13 180.215 0.50 . 1 . . . A 187 PRO C . 18826 1 513 . 1 1 45 45 PRO CA C 13 65.084 0.50 . 1 . . . A 187 PRO CA . 18826 1 514 . 1 1 45 45 PRO CB C 13 32.861 0.50 . 1 . . . A 187 PRO CB . 18826 1 515 . 1 1 45 45 PRO CG C 13 28.615 0.50 . 1 . . . A 187 PRO CG . 18826 1 516 . 1 1 45 45 PRO CD C 13 50.134 0.50 . 1 . . . A 187 PRO CD . 18826 1 517 . 1 1 46 46 ALA H H 1 8.415 0.05 . 1 . . . A 188 ALA H . 18826 1 518 . 1 1 46 46 ALA HA H 1 4.188 0.05 . 1 . . . A 188 ALA HA . 18826 1 519 . 1 1 46 46 ALA HB1 H 1 1.296 0.05 . 1 . . . A 188 ALA HB1 . 18826 1 520 . 1 1 46 46 ALA HB2 H 1 1.296 0.05 . 1 . . . A 188 ALA HB2 . 18826 1 521 . 1 1 46 46 ALA HB3 H 1 1.296 0.05 . 1 . . . A 188 ALA HB3 . 18826 1 522 . 1 1 46 46 ALA C C 13 179.738 0.50 . 1 . . . A 188 ALA C . 18826 1 523 . 1 1 46 46 ALA CA C 13 54.678 0.50 . 1 . . . A 188 ALA CA . 18826 1 524 . 1 1 46 46 ALA CB C 13 19.113 0.50 . 1 . . . A 188 ALA CB . 18826 1 525 . 1 1 46 46 ALA N N 15 118.124 0.10 . 1 . . . A 188 ALA N . 18826 1 526 . 1 1 47 47 GLU H H 1 8.362 0.05 . 1 . . . A 189 GLU H . 18826 1 527 . 1 1 47 47 GLU HA H 1 3.760 0.05 . 1 . . . A 189 GLU HA . 18826 1 528 . 1 1 47 47 GLU HB2 H 1 2.181 0.05 . 2 . . . A 189 GLU HB2 . 18826 1 529 . 1 1 47 47 GLU HB3 H 1 2.181 0.05 . 2 . . . A 189 GLU HB3 . 18826 1 530 . 1 1 47 47 GLU HG2 H 1 2.127 0.05 . 2 . . . A 189 GLU HG2 . 18826 1 531 . 1 1 47 47 GLU HG3 H 1 2.127 0.05 . 2 . . . A 189 GLU HG3 . 18826 1 532 . 1 1 47 47 GLU C C 13 180.432 0.50 . 1 . . . A 189 GLU C . 18826 1 533 . 1 1 47 47 GLU CA C 13 59.726 0.50 . 1 . . . A 189 GLU CA . 18826 1 534 . 1 1 47 47 GLU CB C 13 29.410 0.50 . 1 . . . A 189 GLU CB . 18826 1 535 . 1 1 47 47 GLU CG C 13 36.647 0.50 . 1 . . . A 189 GLU CG . 18826 1 536 . 1 1 47 47 GLU N N 15 122.627 0.10 . 1 . . . A 189 GLU N . 18826 1 537 . 1 1 48 48 ALA H H 1 8.345 0.05 . 1 . . . A 190 ALA H . 18826 1 538 . 1 1 48 48 ALA HA H 1 4.094 0.05 . 1 . . . A 190 ALA HA . 18826 1 539 . 1 1 48 48 ALA HB1 H 1 1.491 0.05 . 1 . . . A 190 ALA HB1 . 18826 1 540 . 1 1 48 48 ALA HB2 H 1 1.491 0.05 . 1 . . . A 190 ALA HB2 . 18826 1 541 . 1 1 48 48 ALA HB3 H 1 1.491 0.05 . 1 . . . A 190 ALA HB3 . 18826 1 542 . 1 1 48 48 ALA C C 13 178.842 0.50 . 1 . . . A 190 ALA C . 18826 1 543 . 1 1 48 48 ALA CA C 13 54.208 0.50 . 1 . . . A 190 ALA CA . 18826 1 544 . 1 1 48 48 ALA CB C 13 17.643 0.50 . 1 . . . A 190 ALA CB . 18826 1 545 . 1 1 48 48 ALA N N 15 122.464 0.10 . 1 . . . A 190 ALA N . 18826 1 546 . 1 1 49 49 SER H H 1 7.751 0.05 . 1 . . . A 191 SER H . 18826 1 547 . 1 1 49 49 SER HA H 1 4.416 0.05 . 1 . . . A 191 SER HA . 18826 1 548 . 1 1 49 49 SER HB2 H 1 3.902 0.05 . 2 . . . A 191 SER HB2 . 18826 1 549 . 1 1 49 49 SER HB3 H 1 3.804 0.05 . 2 . . . A 191 SER HB3 . 18826 1 550 . 1 1 49 49 SER HG H 1 5.009 0.05 . 1 . . . A 191 SER HG . 18826 1 551 . 1 1 49 49 SER C C 13 174.793 0.50 . 1 . . . A 191 SER C . 18826 1 552 . 1 1 49 49 SER CA C 13 59.740 0.50 . 1 . . . A 191 SER CA . 18826 1 553 . 1 1 49 49 SER CB C 13 64.613 0.50 . 1 . . . A 191 SER CB . 18826 1 554 . 1 1 49 49 SER N N 15 111.921 0.10 . 1 . . . A 191 SER N . 18826 1 555 . 1 1 50 50 GLY H H 1 7.489 0.05 . 1 . . . A 192 GLY H . 18826 1 556 . 1 1 50 50 GLY HA2 H 1 3.577 0.05 . 2 . . . A 192 GLY HA2 . 18826 1 557 . 1 1 50 50 GLY HA3 H 1 4.324 0.05 . 2 . . . A 192 GLY HA3 . 18826 1 558 . 1 1 50 50 GLY C C 13 173.592 0.50 . 1 . . . A 192 GLY C . 18826 1 559 . 1 1 50 50 GLY CA C 13 44.543 0.50 . 1 . . . A 192 GLY CA . 18826 1 560 . 1 1 50 50 GLY N N 15 107.554 0.10 . 1 . . . A 192 GLY N . 18826 1 561 . 1 1 51 51 LEU H H 1 7.071 0.05 . 1 . . . A 193 LEU H . 18826 1 562 . 1 1 51 51 LEU HA H 1 3.785 0.05 . 1 . . . A 193 LEU HA . 18826 1 563 . 1 1 51 51 LEU HB2 H 1 0.941 0.05 . 2 . . . A 193 LEU HB2 . 18826 1 564 . 1 1 51 51 LEU HB3 H 1 1.189 0.05 . 2 . . . A 193 LEU HB3 . 18826 1 565 . 1 1 51 51 LEU HG H 1 1.230 0.05 . 1 . . . A 193 LEU HG . 18826 1 566 . 1 1 51 51 LEU HD11 H 1 -0.052 0.05 . 2 . . . A 193 LEU HD11 . 18826 1 567 . 1 1 51 51 LEU HD12 H 1 -0.052 0.05 . 2 . . . A 193 LEU HD12 . 18826 1 568 . 1 1 51 51 LEU HD13 H 1 -0.052 0.05 . 2 . . . A 193 LEU HD13 . 18826 1 569 . 1 1 51 51 LEU HD21 H 1 0.488 0.05 . 2 . . . A 193 LEU HD21 . 18826 1 570 . 1 1 51 51 LEU HD22 H 1 0.488 0.05 . 2 . . . A 193 LEU HD22 . 18826 1 571 . 1 1 51 51 LEU HD23 H 1 0.488 0.05 . 2 . . . A 193 LEU HD23 . 18826 1 572 . 1 1 51 51 LEU C C 13 175.288 0.50 . 1 . . . A 193 LEU C . 18826 1 573 . 1 1 51 51 LEU CA C 13 55.182 0.50 . 1 . . . A 193 LEU CA . 18826 1 574 . 1 1 51 51 LEU CB C 13 43.512 0.50 . 1 . . . A 193 LEU CB . 18826 1 575 . 1 1 51 51 LEU CG C 13 25.763 0.50 . 1 . . . A 193 LEU CG . 18826 1 576 . 1 1 51 51 LEU CD1 C 13 25.757 0.50 . 2 . . . A 193 LEU CD1 . 18826 1 577 . 1 1 51 51 LEU CD2 C 13 24.741 0.50 . 2 . . . A 193 LEU CD2 . 18826 1 578 . 1 1 51 51 LEU N N 15 123.852 0.10 . 1 . . . A 193 LEU N . 18826 1 579 . 1 1 52 52 ARG H H 1 8.638 0.05 . 1 . . . A 194 ARG H . 18826 1 580 . 1 1 52 52 ARG HA H 1 4.510 0.05 . 1 . . . A 194 ARG HA . 18826 1 581 . 1 1 52 52 ARG HB2 H 1 1.619 0.05 . 2 . . . A 194 ARG HB2 . 18826 1 582 . 1 1 52 52 ARG HB3 H 1 1.619 0.05 . 2 . . . A 194 ARG HB3 . 18826 1 583 . 1 1 52 52 ARG HG2 H 1 1.381 0.05 . 2 . . . A 194 ARG HG2 . 18826 1 584 . 1 1 52 52 ARG HG3 H 1 1.507 0.05 . 2 . . . A 194 ARG HG3 . 18826 1 585 . 1 1 52 52 ARG HD2 H 1 2.963 0.05 . 2 . . . A 194 ARG HD2 . 18826 1 586 . 1 1 52 52 ARG HD3 H 1 3.146 0.05 . 2 . . . A 194 ARG HD3 . 18826 1 587 . 1 1 52 52 ARG HE H 1 7.175 0.05 . 1 . . . A 194 ARG HE . 18826 1 588 . 1 1 52 52 ARG HH11 H 1 6.839 0.05 . 2 . . . A 194 ARG HH11 . 18826 1 589 . 1 1 52 52 ARG HH12 H 1 6.355 0.05 . 2 . . . A 194 ARG HH12 . 18826 1 590 . 1 1 52 52 ARG C C 13 175.289 0.50 . 1 . . . A 194 ARG C . 18826 1 591 . 1 1 52 52 ARG CA C 13 53.858 0.50 . 1 . . . A 194 ARG CA . 18826 1 592 . 1 1 52 52 ARG CB C 13 33.874 0.50 . 1 . . . A 194 ARG CB . 18826 1 593 . 1 1 52 52 ARG CG C 13 26.729 0.50 . 1 . . . A 194 ARG CG . 18826 1 594 . 1 1 52 52 ARG CD C 13 43.575 0.50 . 1 . . . A 194 ARG CD . 18826 1 595 . 1 1 52 52 ARG N N 15 124.234 0.10 . 1 . . . A 194 ARG N . 18826 1 596 . 1 1 52 52 ARG NE N 15 84.976 0.10 . 1 . . . A 194 ARG NE . 18826 1 597 . 1 1 53 53 ALA H H 1 8.565 0.05 . 1 . . . A 195 ALA H . 18826 1 598 . 1 1 53 53 ALA HA H 1 3.701 0.05 . 1 . . . A 195 ALA HA . 18826 1 599 . 1 1 53 53 ALA HB1 H 1 1.275 0.05 . 1 . . . A 195 ALA HB1 . 18826 1 600 . 1 1 53 53 ALA HB2 H 1 1.275 0.05 . 1 . . . A 195 ALA HB2 . 18826 1 601 . 1 1 53 53 ALA HB3 H 1 1.275 0.05 . 1 . . . A 195 ALA HB3 . 18826 1 602 . 1 1 53 53 ALA C C 13 179.226 0.50 . 1 . . . A 195 ALA C . 18826 1 603 . 1 1 53 53 ALA CA C 13 53.156 0.50 . 1 . . . A 195 ALA CA . 18826 1 604 . 1 1 53 53 ALA CB C 13 17.616 0.50 . 1 . . . A 195 ALA CB . 18826 1 605 . 1 1 53 53 ALA N N 15 121.931 0.10 . 1 . . . A 195 ALA N . 18826 1 606 . 1 1 54 54 GLN H H 1 9.628 0.05 . 1 . . . A 196 GLN H . 18826 1 607 . 1 1 54 54 GLN HA H 1 3.794 0.05 . 1 . . . A 196 GLN HA . 18826 1 608 . 1 1 54 54 GLN HB2 H 1 2.320 0.05 . 2 . . . A 196 GLN HB2 . 18826 1 609 . 1 1 54 54 GLN HB3 H 1 2.560 0.05 . 2 . . . A 196 GLN HB3 . 18826 1 610 . 1 1 54 54 GLN HG2 H 1 2.336 0.05 . 2 . . . A 196 GLN HG2 . 18826 1 611 . 1 1 54 54 GLN HG3 H 1 2.234 0.05 . 2 . . . A 196 GLN HG3 . 18826 1 612 . 1 1 54 54 GLN HE21 H 1 6.720 0.05 . 2 . . . A 196 GLN HE21 . 18826 1 613 . 1 1 54 54 GLN HE22 H 1 7.481 0.05 . 2 . . . A 196 GLN HE22 . 18826 1 614 . 1 1 54 54 GLN C C 13 175.167 0.50 . 1 . . . A 196 GLN C . 18826 1 615 . 1 1 54 54 GLN CA C 13 58.233 0.50 . 1 . . . A 196 GLN CA . 18826 1 616 . 1 1 54 54 GLN CB C 13 26.246 0.50 . 1 . . . A 196 GLN CB . 18826 1 617 . 1 1 54 54 GLN CG C 13 33.880 0.50 . 1 . . . A 196 GLN CG . 18826 1 618 . 1 1 54 54 GLN N N 15 114.928 0.10 . 1 . . . A 196 GLN N . 18826 1 619 . 1 1 54 54 GLN NE2 N 15 112.040 0.10 . 1 . . . A 196 GLN NE2 . 18826 1 620 . 1 1 55 55 ASP H H 1 7.806 0.05 . 1 . . . A 197 ASP H . 18826 1 621 . 1 1 55 55 ASP HA H 1 4.668 0.05 . 1 . . . A 197 ASP HA . 18826 1 622 . 1 1 55 55 ASP HB2 H 1 1.951 0.05 . 2 . . . A 197 ASP HB2 . 18826 1 623 . 1 1 55 55 ASP HB3 H 1 2.646 0.05 . 2 . . . A 197 ASP HB3 . 18826 1 624 . 1 1 55 55 ASP C C 13 174.377 0.50 . 1 . . . A 197 ASP C . 18826 1 625 . 1 1 55 55 ASP CA C 13 55.412 0.50 . 1 . . . A 197 ASP CA . 18826 1 626 . 1 1 55 55 ASP CB C 13 41.515 0.50 . 1 . . . A 197 ASP CB . 18826 1 627 . 1 1 55 55 ASP N N 15 120.697 0.10 . 1 . . . A 197 ASP N . 18826 1 628 . 1 1 56 56 ARG H H 1 8.726 0.05 . 1 . . . A 198 ARG H . 18826 1 629 . 1 1 56 56 ARG HA H 1 4.557 0.05 . 1 . . . A 198 ARG HA . 18826 1 630 . 1 1 56 56 ARG HG2 H 1 0.129 0.05 . 2 . . . A 198 ARG HG2 . 18826 1 631 . 1 1 56 56 ARG HG3 H 1 0.839 0.05 . 2 . . . A 198 ARG HG3 . 18826 1 632 . 1 1 56 56 ARG HD3 H 1 3.044 0.05 . 2 . . . A 198 ARG HD3 . 18826 1 633 . 1 1 56 56 ARG C C 13 176.552 0.50 . 1 . . . A 198 ARG C . 18826 1 634 . 1 1 56 56 ARG CA C 13 54.175 0.50 . 1 . . . A 198 ARG CA . 18826 1 635 . 1 1 56 56 ARG CB C 13 33.088 0.50 . 1 . . . A 198 ARG CB . 18826 1 636 . 1 1 56 56 ARG CG C 13 28.142 0.50 . 1 . . . A 198 ARG CG . 18826 1 637 . 1 1 56 56 ARG N N 15 120.902 0.10 . 1 . . . A 198 ARG N . 18826 1 638 . 1 1 57 57 ILE H H 1 7.838 0.05 . 1 . . . A 199 ILE H . 18826 1 639 . 1 1 57 57 ILE HA H 1 3.605 0.05 . 1 . . . A 199 ILE HA . 18826 1 640 . 1 1 57 57 ILE HB H 1 1.431 0.05 . 1 . . . A 199 ILE HB . 18826 1 641 . 1 1 57 57 ILE HG12 H 1 0.607 0.05 . 2 . . . A 199 ILE HG12 . 18826 1 642 . 1 1 57 57 ILE HG13 H 1 1.210 0.05 . 2 . . . A 199 ILE HG13 . 18826 1 643 . 1 1 57 57 ILE HG21 H 1 0.435 0.05 . 1 . . . A 199 ILE HG21 . 18826 1 644 . 1 1 57 57 ILE HG22 H 1 0.435 0.05 . 1 . . . A 199 ILE HG22 . 18826 1 645 . 1 1 57 57 ILE HG23 H 1 0.435 0.05 . 1 . . . A 199 ILE HG23 . 18826 1 646 . 1 1 57 57 ILE HD11 H 1 0.442 0.05 . 1 . . . A 199 ILE HD11 . 18826 1 647 . 1 1 57 57 ILE HD12 H 1 0.442 0.05 . 1 . . . A 199 ILE HD12 . 18826 1 648 . 1 1 57 57 ILE HD13 H 1 0.442 0.05 . 1 . . . A 199 ILE HD13 . 18826 1 649 . 1 1 57 57 ILE C C 13 174.324 0.50 . 1 . . . A 199 ILE C . 18826 1 650 . 1 1 57 57 ILE CA C 13 62.029 0.50 . 1 . . . A 199 ILE CA . 18826 1 651 . 1 1 57 57 ILE CB C 13 38.434 0.50 . 1 . . . A 199 ILE CB . 18826 1 652 . 1 1 57 57 ILE CG1 C 13 27.741 0.50 . 1 . . . A 199 ILE CG1 . 18826 1 653 . 1 1 57 57 ILE CG2 C 13 17.603 0.50 . 1 . . . A 199 ILE CG2 . 18826 1 654 . 1 1 57 57 ILE CD1 C 13 14.216 0.50 . 1 . . . A 199 ILE CD1 . 18826 1 655 . 1 1 57 57 ILE N N 15 123.523 0.10 . 1 . . . A 199 ILE N . 18826 1 656 . 1 1 58 58 VAL H H 1 9.072 0.05 . 1 . . . A 200 VAL H . 18826 1 657 . 1 1 58 58 VAL HA H 1 4.025 0.05 . 1 . . . A 200 VAL HA . 18826 1 658 . 1 1 58 58 VAL HB H 1 1.484 0.05 . 1 . . . A 200 VAL HB . 18826 1 659 . 1 1 58 58 VAL HG11 H 1 0.567 0.05 . 2 . . . A 200 VAL HG11 . 18826 1 660 . 1 1 58 58 VAL HG12 H 1 0.567 0.05 . 2 . . . A 200 VAL HG12 . 18826 1 661 . 1 1 58 58 VAL HG13 H 1 0.567 0.05 . 2 . . . A 200 VAL HG13 . 18826 1 662 . 1 1 58 58 VAL HG21 H 1 0.894 0.05 . 2 . . . A 200 VAL HG21 . 18826 1 663 . 1 1 58 58 VAL HG22 H 1 0.894 0.05 . 2 . . . A 200 VAL HG22 . 18826 1 664 . 1 1 58 58 VAL HG23 H 1 0.894 0.05 . 2 . . . A 200 VAL HG23 . 18826 1 665 . 1 1 58 58 VAL C C 13 175.826 0.50 . 1 . . . A 200 VAL C . 18826 1 666 . 1 1 58 58 VAL CA C 13 63.306 0.50 . 1 . . . A 200 VAL CA . 18826 1 667 . 1 1 58 58 VAL CB C 13 33.082 0.50 . 1 . . . A 200 VAL CB . 18826 1 668 . 1 1 58 58 VAL CG1 C 13 21.659 0.50 . 2 . . . A 200 VAL CG1 . 18826 1 669 . 1 1 58 58 VAL CG2 C 13 21.650 0.50 . 2 . . . A 200 VAL CG2 . 18826 1 670 . 1 1 58 58 VAL N N 15 126.127 0.10 . 1 . . . A 200 VAL N . 18826 1 671 . 1 1 59 59 GLU H H 1 7.643 0.05 . 1 . . . A 201 GLU H . 18826 1 672 . 1 1 59 59 GLU HA H 1 5.113 0.05 . 1 . . . A 201 GLU HA . 18826 1 673 . 1 1 59 59 GLU HB2 H 1 1.352 0.05 . 2 . . . A 201 GLU HB2 . 18826 1 674 . 1 1 59 59 GLU HB3 H 1 1.787 0.05 . 2 . . . A 201 GLU HB3 . 18826 1 675 . 1 1 59 59 GLU HG2 H 1 2.111 0.05 . 2 . . . A 201 GLU HG2 . 18826 1 676 . 1 1 59 59 GLU HG3 H 1 2.111 0.05 . 2 . . . A 201 GLU HG3 . 18826 1 677 . 1 1 59 59 GLU C C 13 175.769 0.50 . 1 . . . A 201 GLU C . 18826 1 678 . 1 1 59 59 GLU CA C 13 54.194 0.50 . 1 . . . A 201 GLU CA . 18826 1 679 . 1 1 59 59 GLU CB C 13 34.329 0.50 . 1 . . . A 201 GLU CB . 18826 1 680 . 1 1 59 59 GLU CG C 13 35.349 0.50 . 1 . . . A 201 GLU CG . 18826 1 681 . 1 1 59 59 GLU N N 15 114.466 0.10 . 1 . . . A 201 GLU N . 18826 1 682 . 1 1 60 60 VAL H H 1 7.922 0.05 . 1 . . . A 202 VAL H . 18826 1 683 . 1 1 60 60 VAL HA H 1 4.292 0.05 . 1 . . . A 202 VAL HA . 18826 1 684 . 1 1 60 60 VAL HB H 1 1.659 0.05 . 1 . . . A 202 VAL HB . 18826 1 685 . 1 1 60 60 VAL HG11 H 1 0.541 0.05 . 2 . . . A 202 VAL HG11 . 18826 1 686 . 1 1 60 60 VAL HG12 H 1 0.541 0.05 . 2 . . . A 202 VAL HG12 . 18826 1 687 . 1 1 60 60 VAL HG13 H 1 0.541 0.05 . 2 . . . A 202 VAL HG13 . 18826 1 688 . 1 1 60 60 VAL HG21 H 1 0.681 0.05 . 2 . . . A 202 VAL HG21 . 18826 1 689 . 1 1 60 60 VAL HG22 H 1 0.681 0.05 . 2 . . . A 202 VAL HG22 . 18826 1 690 . 1 1 60 60 VAL HG23 H 1 0.681 0.05 . 2 . . . A 202 VAL HG23 . 18826 1 691 . 1 1 60 60 VAL C C 13 176.150 0.50 . 1 . . . A 202 VAL C . 18826 1 692 . 1 1 60 60 VAL CA C 13 60.775 0.50 . 1 . . . A 202 VAL CA . 18826 1 693 . 1 1 60 60 VAL CB C 13 33.841 0.50 . 1 . . . A 202 VAL CB . 18826 1 694 . 1 1 60 60 VAL CG1 C 13 20.606 0.50 . 2 . . . A 202 VAL CG1 . 18826 1 695 . 1 1 60 60 VAL CG2 C 13 20.657 0.50 . 2 . . . A 202 VAL CG2 . 18826 1 696 . 1 1 60 60 VAL N N 15 118.048 0.10 . 1 . . . A 202 VAL N . 18826 1 697 . 1 1 61 61 ASN H H 1 9.834 0.05 . 1 . . . A 203 ASN H . 18826 1 698 . 1 1 61 61 ASN HA H 1 4.203 0.05 . 1 . . . A 203 ASN HA . 18826 1 699 . 1 1 61 61 ASN HB2 H 1 2.752 0.05 . 2 . . . A 203 ASN HB2 . 18826 1 700 . 1 1 61 61 ASN HB3 H 1 2.892 0.05 . 2 . . . A 203 ASN HB3 . 18826 1 701 . 1 1 61 61 ASN HD21 H 1 7.779 0.05 . 2 . . . A 203 ASN HD21 . 18826 1 702 . 1 1 61 61 ASN HD22 H 1 8.101 0.05 . 2 . . . A 203 ASN HD22 . 18826 1 703 . 1 1 61 61 ASN C C 13 174.987 0.50 . 1 . . . A 203 ASN C . 18826 1 704 . 1 1 61 61 ASN CA C 13 54.172 0.50 . 1 . . . A 203 ASN CA . 18826 1 705 . 1 1 61 61 ASN CB C 13 36.898 0.50 . 1 . . . A 203 ASN CB . 18826 1 706 . 1 1 61 61 ASN N N 15 128.720 0.10 . 1 . . . A 203 ASN N . 18826 1 707 . 1 1 61 61 ASN ND2 N 15 116.534 0.10 . 1 . . . A 203 ASN ND2 . 18826 1 708 . 1 1 62 62 GLY H H 1 9.132 0.05 . 1 . . . A 204 GLY H . 18826 1 709 . 1 1 62 62 GLY HA2 H 1 3.507 0.05 . 2 . . . A 204 GLY HA2 . 18826 1 710 . 1 1 62 62 GLY HA3 H 1 3.892 0.05 . 2 . . . A 204 GLY HA3 . 18826 1 711 . 1 1 62 62 GLY C C 13 173.416 0.50 . 1 . . . A 204 GLY C . 18826 1 712 . 1 1 62 62 GLY CA C 13 44.767 0.50 . 1 . . . A 204 GLY CA . 18826 1 713 . 1 1 62 62 GLY N N 15 103.049 0.10 . 1 . . . A 204 GLY N . 18826 1 714 . 1 1 63 63 VAL H H 1 7.634 0.05 . 1 . . . A 205 VAL H . 18826 1 715 . 1 1 63 63 VAL HA H 1 3.974 0.05 . 1 . . . A 205 VAL HA . 18826 1 716 . 1 1 63 63 VAL HB H 1 1.834 0.05 . 1 . . . A 205 VAL HB . 18826 1 717 . 1 1 63 63 VAL HG11 H 1 0.766 0.05 . 2 . . . A 205 VAL HG11 . 18826 1 718 . 1 1 63 63 VAL HG12 H 1 0.766 0.05 . 2 . . . A 205 VAL HG12 . 18826 1 719 . 1 1 63 63 VAL HG13 H 1 0.766 0.05 . 2 . . . A 205 VAL HG13 . 18826 1 720 . 1 1 63 63 VAL HG21 H 1 0.766 0.05 . 2 . . . A 205 VAL HG21 . 18826 1 721 . 1 1 63 63 VAL HG22 H 1 0.766 0.05 . 2 . . . A 205 VAL HG22 . 18826 1 722 . 1 1 63 63 VAL HG23 H 1 0.766 0.05 . 2 . . . A 205 VAL HG23 . 18826 1 723 . 1 1 63 63 VAL C C 13 175.033 0.50 . 1 . . . A 205 VAL C . 18826 1 724 . 1 1 63 63 VAL CA C 13 61.238 0.50 . 1 . . . A 205 VAL CA . 18826 1 725 . 1 1 63 63 VAL CB C 13 32.851 0.50 . 1 . . . A 205 VAL CB . 18826 1 726 . 1 1 63 63 VAL CG1 C 13 20.694 0.50 . 2 . . . A 205 VAL CG1 . 18826 1 727 . 1 1 63 63 VAL CG2 C 13 20.695 0.50 . 2 . . . A 205 VAL CG2 . 18826 1 728 . 1 1 63 63 VAL N N 15 121.818 0.10 . 1 . . . A 205 VAL N . 18826 1 729 . 1 1 64 64 CYS H H 1 8.942 0.05 . 1 . . . A 206 CYS H . 18826 1 730 . 1 1 64 64 CYS HA H 1 4.197 0.05 . 1 . . . A 206 CYS HA . 18826 1 731 . 1 1 64 64 CYS HB2 H 1 2.694 0.05 . 2 . . . A 206 CYS HB2 . 18826 1 732 . 1 1 64 64 CYS HB3 H 1 3.092 0.05 . 2 . . . A 206 CYS HB3 . 18826 1 733 . 1 1 64 64 CYS C C 13 175.950 0.50 . 1 . . . A 206 CYS C . 18826 1 734 . 1 1 64 64 CYS CA C 13 61.019 0.50 . 1 . . . A 206 CYS CA . 18826 1 735 . 1 1 64 64 CYS CB C 13 27.257 0.50 . 1 . . . A 206 CYS CB . 18826 1 736 . 1 1 64 64 CYS N N 15 127.514 0.10 . 1 . . . A 206 CYS N . 18826 1 737 . 1 1 65 65 MET H H 1 9.036 0.05 . 1 . . . A 207 MET H . 18826 1 738 . 1 1 65 65 MET HA H 1 4.658 0.05 . 1 . . . A 207 MET HA . 18826 1 739 . 1 1 65 65 MET HB2 H 1 1.446 0.05 . 2 . . . A 207 MET HB2 . 18826 1 740 . 1 1 65 65 MET HB3 H 1 1.872 0.05 . 2 . . . A 207 MET HB3 . 18826 1 741 . 1 1 65 65 MET HG2 H 1 2.339 0.05 . 2 . . . A 207 MET HG2 . 18826 1 742 . 1 1 65 65 MET HG3 H 1 2.447 0.05 . 2 . . . A 207 MET HG3 . 18826 1 743 . 1 1 65 65 MET HE1 H 1 1.790 0.05 . 1 . . . A 207 MET HE1 . 18826 1 744 . 1 1 65 65 MET HE2 H 1 1.790 0.05 . 1 . . . A 207 MET HE2 . 18826 1 745 . 1 1 65 65 MET HE3 H 1 1.790 0.05 . 1 . . . A 207 MET HE3 . 18826 1 746 . 1 1 65 65 MET C C 13 176.864 0.50 . 1 . . . A 207 MET C . 18826 1 747 . 1 1 65 65 MET CA C 13 53.000 0.50 . 1 . . . A 207 MET CA . 18826 1 748 . 1 1 65 65 MET CB C 13 32.825 0.50 . 1 . . . A 207 MET CB . 18826 1 749 . 1 1 65 65 MET CG C 13 32.377 0.50 . 1 . . . A 207 MET CG . 18826 1 750 . 1 1 65 65 MET CE C 13 19.131 0.50 . 1 . . . A 207 MET CE . 18826 1 751 . 1 1 65 65 MET N N 15 126.717 0.10 . 1 . . . A 207 MET N . 18826 1 752 . 1 1 66 66 GLU H H 1 8.138 0.05 . 1 . . . A 208 GLU H . 18826 1 753 . 1 1 66 66 GLU HA H 1 4.109 0.05 . 1 . . . A 208 GLU HA . 18826 1 754 . 1 1 66 66 GLU HB2 H 1 1.881 0.05 . 2 . . . A 208 GLU HB2 . 18826 1 755 . 1 1 66 66 GLU HB3 H 1 1.918 0.05 . 2 . . . A 208 GLU HB3 . 18826 1 756 . 1 1 66 66 GLU HG2 H 1 2.103 0.05 . 2 . . . A 208 GLU HG2 . 18826 1 757 . 1 1 66 66 GLU HG3 H 1 2.149 0.05 . 2 . . . A 208 GLU HG3 . 18826 1 758 . 1 1 66 66 GLU C C 13 178.090 0.50 . 1 . . . A 208 GLU C . 18826 1 759 . 1 1 66 66 GLU CA C 13 58.128 0.50 . 1 . . . A 208 GLU CA . 18826 1 760 . 1 1 66 66 GLU CB C 13 29.320 0.50 . 1 . . . A 208 GLU CB . 18826 1 761 . 1 1 66 66 GLU CG C 13 35.368 0.50 . 1 . . . A 208 GLU CG . 18826 1 762 . 1 1 66 66 GLU N N 15 125.431 0.10 . 1 . . . A 208 GLU N . 18826 1 763 . 1 1 67 67 GLY H H 1 8.993 0.05 . 1 . . . A 209 GLY H . 18826 1 764 . 1 1 67 67 GLY HA2 H 1 3.670 0.05 . 2 . . . A 209 GLY HA2 . 18826 1 765 . 1 1 67 67 GLY HA3 H 1 4.054 0.05 . 2 . . . A 209 GLY HA3 . 18826 1 766 . 1 1 67 67 GLY C C 13 174.232 0.50 . 1 . . . A 209 GLY C . 18826 1 767 . 1 1 67 67 GLY CA C 13 45.492 0.50 . 1 . . . A 209 GLY CA . 18826 1 768 . 1 1 67 67 GLY N N 15 113.877 0.10 . 1 . . . A 209 GLY N . 18826 1 769 . 1 1 68 68 LYS H H 1 7.437 0.05 . 1 . . . A 210 LYS H . 18826 1 770 . 1 1 68 68 LYS HA H 1 4.443 0.05 . 1 . . . A 210 LYS HA . 18826 1 771 . 1 1 68 68 LYS HB2 H 1 1.870 0.05 . 2 . . . A 210 LYS HB2 . 18826 1 772 . 1 1 68 68 LYS HB3 H 1 1.782 0.05 . 2 . . . A 210 LYS HB3 . 18826 1 773 . 1 1 68 68 LYS HG2 H 1 1.130 0.05 . 2 . . . A 210 LYS HG2 . 18826 1 774 . 1 1 68 68 LYS HG3 H 1 1.347 0.05 . 2 . . . A 210 LYS HG3 . 18826 1 775 . 1 1 68 68 LYS HD2 H 1 1.510 0.05 . 2 . . . A 210 LYS HD2 . 18826 1 776 . 1 1 68 68 LYS HD3 H 1 1.510 0.05 . 2 . . . A 210 LYS HD3 . 18826 1 777 . 1 1 68 68 LYS HE2 H 1 2.857 0.05 . 2 . . . A 210 LYS HE2 . 18826 1 778 . 1 1 68 68 LYS HE3 H 1 2.857 0.05 . 2 . . . A 210 LYS HE3 . 18826 1 779 . 1 1 68 68 LYS CA C 13 54.257 0.50 . 1 . . . A 210 LYS CA . 18826 1 780 . 1 1 68 68 LYS CB C 13 32.310 0.50 . 1 . . . A 210 LYS CB . 18826 1 781 . 1 1 68 68 LYS CG C 13 25.244 0.50 . 1 . . . A 210 LYS CG . 18826 1 782 . 1 1 68 68 LYS N N 15 118.740 0.10 . 1 . . . A 210 LYS N . 18826 1 783 . 1 1 69 69 GLN H H 1 8.887 0.05 . 1 . . . A 211 GLN H . 18826 1 784 . 1 1 69 69 GLN HA H 1 4.410 0.05 . 1 . . . A 211 GLN HA . 18826 1 785 . 1 1 69 69 GLN HB2 H 1 1.864 0.05 . 2 . . . A 211 GLN HB2 . 18826 1 786 . 1 1 69 69 GLN HB3 H 1 2.303 0.05 . 2 . . . A 211 GLN HB3 . 18826 1 787 . 1 1 69 69 GLN HG2 H 1 2.350 0.05 . 2 . . . A 211 GLN HG2 . 18826 1 788 . 1 1 69 69 GLN HG3 H 1 2.408 0.05 . 2 . . . A 211 GLN HG3 . 18826 1 789 . 1 1 69 69 GLN HE21 H 1 6.845 0.05 . 2 . . . A 211 GLN HE21 . 18826 1 790 . 1 1 69 69 GLN HE22 H 1 7.554 0.05 . 2 . . . A 211 GLN HE22 . 18826 1 791 . 1 1 69 69 GLN C C 13 177.033 0.50 . 1 . . . A 211 GLN C . 18826 1 792 . 1 1 69 69 GLN CA C 13 54.135 0.50 . 1 . . . A 211 GLN CA . 18826 1 793 . 1 1 69 69 GLN CB C 13 30.344 0.50 . 1 . . . A 211 GLN CB . 18826 1 794 . 1 1 69 69 GLN CG C 13 33.592 0.50 . 1 . . . A 211 GLN CG . 18826 1 795 . 1 1 69 69 GLN N N 15 117.177 0.10 . 1 . . . A 211 GLN N . 18826 1 796 . 1 1 69 69 GLN NE2 N 15 113.398 0.10 . 1 . . . A 211 GLN NE2 . 18826 1 797 . 1 1 70 70 HIS H H 1 8.754 0.05 . 1 . . . A 212 HIS H . 18826 1 798 . 1 1 70 70 HIS HA H 1 3.482 0.05 . 1 . . . A 212 HIS HA . 18826 1 799 . 1 1 70 70 HIS HB2 H 1 2.933 0.05 . 2 . . . A 212 HIS HB2 . 18826 1 800 . 1 1 70 70 HIS HB3 H 1 3.134 0.05 . 2 . . . A 212 HIS HB3 . 18826 1 801 . 1 1 70 70 HIS HD2 H 1 7.184 0.05 . 1 . . . A 212 HIS HD2 . 18826 1 802 . 1 1 70 70 HIS HE1 H 1 7.582 0.05 . 1 . . . A 212 HIS HE1 . 18826 1 803 . 1 1 70 70 HIS C C 13 177.441 0.50 . 1 . . . A 212 HIS C . 18826 1 804 . 1 1 70 70 HIS CA C 13 61.012 0.50 . 1 . . . A 212 HIS CA . 18826 1 805 . 1 1 70 70 HIS CB C 13 30.335 0.50 . 1 . . . A 212 HIS CB . 18826 1 806 . 1 1 70 70 HIS CD2 C 13 115.136 0.50 . 1 . . . A 212 HIS CD2 . 18826 1 807 . 1 1 70 70 HIS CE1 C 13 137.975 0.50 . 1 . . . A 212 HIS CE1 . 18826 1 808 . 1 1 70 70 HIS N N 15 122.337 0.10 . 1 . . . A 212 HIS N . 18826 1 809 . 1 1 71 71 GLY H H 1 9.122 0.05 . 1 . . . A 213 GLY H . 18826 1 810 . 1 1 71 71 GLY HA2 H 1 3.722 0.05 . 2 . . . A 213 GLY HA2 . 18826 1 811 . 1 1 71 71 GLY HA3 H 1 3.860 0.05 . 2 . . . A 213 GLY HA3 . 18826 1 812 . 1 1 71 71 GLY C C 13 176.698 0.50 . 1 . . . A 213 GLY C . 18826 1 813 . 1 1 71 71 GLY CA C 13 46.564 0.50 . 1 . . . A 213 GLY CA . 18826 1 814 . 1 1 71 71 GLY N N 15 102.830 0.10 . 1 . . . A 213 GLY N . 18826 1 815 . 1 1 72 72 ASP H H 1 7.162 0.05 . 1 . . . A 214 ASP H . 18826 1 816 . 1 1 72 72 ASP HA H 1 4.344 0.05 . 1 . . . A 214 ASP HA . 18826 1 817 . 1 1 72 72 ASP HB2 H 1 2.545 0.05 . 2 . . . A 214 ASP HB2 . 18826 1 818 . 1 1 72 72 ASP HB3 H 1 2.894 0.05 . 2 . . . A 214 ASP HB3 . 18826 1 819 . 1 1 72 72 ASP C C 13 178.635 0.50 . 1 . . . A 214 ASP C . 18826 1 820 . 1 1 72 72 ASP CA C 13 56.714 0.50 . 1 . . . A 214 ASP CA . 18826 1 821 . 1 1 72 72 ASP CB C 13 40.978 0.50 . 1 . . . A 214 ASP CB . 18826 1 822 . 1 1 72 72 ASP N N 15 120.107 0.10 . 1 . . . A 214 ASP N . 18826 1 823 . 1 1 73 73 VAL H H 1 7.398 0.05 . 1 . . . A 215 VAL H . 18826 1 824 . 1 1 73 73 VAL HA H 1 3.557 0.05 . 1 . . . A 215 VAL HA . 18826 1 825 . 1 1 73 73 VAL HB H 1 1.759 0.05 . 1 . . . A 215 VAL HB . 18826 1 826 . 1 1 73 73 VAL HG11 H 1 0.755 0.05 . 2 . . . A 215 VAL HG11 . 18826 1 827 . 1 1 73 73 VAL HG12 H 1 0.755 0.05 . 2 . . . A 215 VAL HG12 . 18826 1 828 . 1 1 73 73 VAL HG13 H 1 0.755 0.05 . 2 . . . A 215 VAL HG13 . 18826 1 829 . 1 1 73 73 VAL HG21 H 1 0.576 0.05 . 2 . . . A 215 VAL HG21 . 18826 1 830 . 1 1 73 73 VAL HG22 H 1 0.576 0.05 . 2 . . . A 215 VAL HG22 . 18826 1 831 . 1 1 73 73 VAL HG23 H 1 0.576 0.05 . 2 . . . A 215 VAL HG23 . 18826 1 832 . 1 1 73 73 VAL C C 13 177.386 0.50 . 1 . . . A 215 VAL C . 18826 1 833 . 1 1 73 73 VAL CA C 13 65.855 0.50 . 1 . . . A 215 VAL CA . 18826 1 834 . 1 1 73 73 VAL CB C 13 31.315 0.50 . 1 . . . A 215 VAL CB . 18826 1 835 . 1 1 73 73 VAL CG1 C 13 22.184 0.50 . 2 . . . A 215 VAL CG1 . 18826 1 836 . 1 1 73 73 VAL CG2 C 13 21.656 0.50 . 2 . . . A 215 VAL CG2 . 18826 1 837 . 1 1 73 73 VAL N N 15 122.322 0.10 . 1 . . . A 215 VAL N . 18826 1 838 . 1 1 74 74 VAL H H 1 8.001 0.05 . 1 . . . A 216 VAL H . 18826 1 839 . 1 1 74 74 VAL HA H 1 3.150 0.05 . 1 . . . A 216 VAL HA . 18826 1 840 . 1 1 74 74 VAL HB H 1 1.914 0.05 . 1 . . . A 216 VAL HB . 18826 1 841 . 1 1 74 74 VAL HG11 H 1 0.667 0.05 . 2 . . . A 216 VAL HG11 . 18826 1 842 . 1 1 74 74 VAL HG12 H 1 0.667 0.05 . 2 . . . A 216 VAL HG12 . 18826 1 843 . 1 1 74 74 VAL HG13 H 1 0.667 0.05 . 2 . . . A 216 VAL HG13 . 18826 1 844 . 1 1 74 74 VAL HG21 H 1 0.848 0.05 . 2 . . . A 216 VAL HG21 . 18826 1 845 . 1 1 74 74 VAL HG22 H 1 0.848 0.05 . 2 . . . A 216 VAL HG22 . 18826 1 846 . 1 1 74 74 VAL HG23 H 1 0.848 0.05 . 2 . . . A 216 VAL HG23 . 18826 1 847 . 1 1 74 74 VAL C C 13 178.154 0.50 . 1 . . . A 216 VAL C . 18826 1 848 . 1 1 74 74 VAL CA C 13 67.618 0.50 . 1 . . . A 216 VAL CA . 18826 1 849 . 1 1 74 74 VAL CB C 13 31.787 0.50 . 1 . . . A 216 VAL CB . 18826 1 850 . 1 1 74 74 VAL CG1 C 13 23.665 0.50 . 2 . . . A 216 VAL CG1 . 18826 1 851 . 1 1 74 74 VAL CG2 C 13 21.166 0.50 . 2 . . . A 216 VAL CG2 . 18826 1 852 . 1 1 74 74 VAL N N 15 119.039 0.10 . 1 . . . A 216 VAL N . 18826 1 853 . 1 1 75 75 SER H H 1 8.177 0.05 . 1 . . . A 217 SER H . 18826 1 854 . 1 1 75 75 SER HA H 1 3.845 0.05 . 1 . . . A 217 SER HA . 18826 1 855 . 1 1 75 75 SER HB2 H 1 3.827 0.05 . 2 . . . A 217 SER HB2 . 18826 1 856 . 1 1 75 75 SER HB3 H 1 3.912 0.05 . 2 . . . A 217 SER HB3 . 18826 1 857 . 1 1 75 75 SER C C 13 176.661 0.50 . 1 . . . A 217 SER C . 18826 1 858 . 1 1 75 75 SER CA C 13 61.808 0.50 . 1 . . . A 217 SER CA . 18826 1 859 . 1 1 75 75 SER CB C 13 62.299 0.50 . 1 . . . A 217 SER CB . 18826 1 860 . 1 1 75 75 SER N N 15 113.835 0.10 . 1 . . . A 217 SER N . 18826 1 861 . 1 1 76 76 ALA H H 1 7.740 0.05 . 1 . . . A 218 ALA H . 18826 1 862 . 1 1 76 76 ALA HA H 1 4.089 0.05 . 1 . . . A 218 ALA HA . 18826 1 863 . 1 1 76 76 ALA HB1 H 1 1.383 0.05 . 1 . . . A 218 ALA HB1 . 18826 1 864 . 1 1 76 76 ALA HB2 H 1 1.383 0.05 . 1 . . . A 218 ALA HB2 . 18826 1 865 . 1 1 76 76 ALA HB3 H 1 1.383 0.05 . 1 . . . A 218 ALA HB3 . 18826 1 866 . 1 1 76 76 ALA C C 13 180.516 0.50 . 1 . . . A 218 ALA C . 18826 1 867 . 1 1 76 76 ALA CA C 13 54.680 0.50 . 1 . . . A 218 ALA CA . 18826 1 868 . 1 1 76 76 ALA CB C 13 17.349 0.50 . 1 . . . A 218 ALA CB . 18826 1 869 . 1 1 76 76 ALA N N 15 124.216 0.10 . 1 . . . A 218 ALA N . 18826 1 870 . 1 1 77 77 ILE H H 1 8.155 0.05 . 1 . . . A 219 ILE H . 18826 1 871 . 1 1 77 77 ILE HA H 1 3.417 0.05 . 1 . . . A 219 ILE HA . 18826 1 872 . 1 1 77 77 ILE HB H 1 1.875 0.05 . 1 . . . A 219 ILE HB . 18826 1 873 . 1 1 77 77 ILE HG12 H 1 0.843 0.05 . 2 . . . A 219 ILE HG12 . 18826 1 874 . 1 1 77 77 ILE HG13 H 1 1.880 0.05 . 2 . . . A 219 ILE HG13 . 18826 1 875 . 1 1 77 77 ILE HG21 H 1 0.855 0.05 . 1 . . . A 219 ILE HG21 . 18826 1 876 . 1 1 77 77 ILE HG22 H 1 0.855 0.05 . 1 . . . A 219 ILE HG22 . 18826 1 877 . 1 1 77 77 ILE HG23 H 1 0.855 0.05 . 1 . . . A 219 ILE HG23 . 18826 1 878 . 1 1 77 77 ILE HD11 H 1 0.650 0.05 . 1 . . . A 219 ILE HD11 . 18826 1 879 . 1 1 77 77 ILE HD12 H 1 0.650 0.05 . 1 . . . A 219 ILE HD12 . 18826 1 880 . 1 1 77 77 ILE HD13 H 1 0.650 0.05 . 1 . . . A 219 ILE HD13 . 18826 1 881 . 1 1 77 77 ILE C C 13 181.771 0.50 . 1 . . . A 219 ILE C . 18826 1 882 . 1 1 77 77 ILE CA C 13 64.846 0.50 . 1 . . . A 219 ILE CA . 18826 1 883 . 1 1 77 77 ILE CB C 13 38.166 0.50 . 1 . . . A 219 ILE CB . 18826 1 884 . 1 1 77 77 ILE CG1 C 13 29.280 0.50 . 1 . . . A 219 ILE CG1 . 18826 1 885 . 1 1 77 77 ILE CG2 C 13 16.488 0.50 . 1 . . . A 219 ILE CG2 . 18826 1 886 . 1 1 77 77 ILE CD1 C 13 14.047 0.50 . 1 . . . A 219 ILE CD1 . 18826 1 887 . 1 1 77 77 ILE N N 15 118.575 0.10 . 1 . . . A 219 ILE N . 18826 1 888 . 1 1 78 78 ARG H H 1 8.818 0.05 . 1 . . . A 220 ARG H . 18826 1 889 . 1 1 78 78 ARG HA H 1 4.057 0.05 . 1 . . . A 220 ARG HA . 18826 1 890 . 1 1 78 78 ARG HB2 H 1 1.814 0.05 . 2 . . . A 220 ARG HB2 . 18826 1 891 . 1 1 78 78 ARG HB3 H 1 1.816 0.05 . 2 . . . A 220 ARG HB3 . 18826 1 892 . 1 1 78 78 ARG HG2 H 1 1.783 0.05 . 2 . . . A 220 ARG HG2 . 18826 1 893 . 1 1 78 78 ARG HG3 H 1 1.669 0.05 . 2 . . . A 220 ARG HG3 . 18826 1 894 . 1 1 78 78 ARG HD2 H 1 3.040 0.05 . 2 . . . A 220 ARG HD2 . 18826 1 895 . 1 1 78 78 ARG HD3 H 1 3.040 0.05 . 2 . . . A 220 ARG HD3 . 18826 1 896 . 1 1 78 78 ARG HE H 1 6.907 0.05 . 1 . . . A 220 ARG HE . 18826 1 897 . 1 1 78 78 ARG HH11 H 1 6.510 0.05 . 2 . . . A 220 ARG HH11 . 18826 1 898 . 1 1 78 78 ARG HH12 H 1 6.510 0.05 . 2 . . . A 220 ARG HH12 . 18826 1 899 . 1 1 78 78 ARG C C 13 178.362 0.50 . 1 . . . A 220 ARG C . 18826 1 900 . 1 1 78 78 ARG CA C 13 59.996 0.50 . 1 . . . A 220 ARG CA . 18826 1 901 . 1 1 78 78 ARG CB C 13 29.526 0.50 . 1 . . . A 220 ARG CB . 18826 1 902 . 1 1 78 78 ARG CG C 13 27.762 0.50 . 1 . . . A 220 ARG CG . 18826 1 903 . 1 1 78 78 ARG CD C 13 43.046 0.50 . 1 . . . A 220 ARG CD . 18826 1 904 . 1 1 78 78 ARG N N 15 123.404 0.10 . 1 . . . A 220 ARG N . 18826 1 905 . 1 1 78 78 ARG NE N 15 84.376 0.10 . 1 . . . A 220 ARG NE . 18826 1 906 . 1 1 79 79 ALA H H 1 8.242 0.05 . 1 . . . A 221 ALA H . 18826 1 907 . 1 1 79 79 ALA HA H 1 4.107 0.05 . 1 . . . A 221 ALA HA . 18826 1 908 . 1 1 79 79 ALA HB1 H 1 1.406 0.05 . 1 . . . A 221 ALA HB1 . 18826 1 909 . 1 1 79 79 ALA HB2 H 1 1.406 0.05 . 1 . . . A 221 ALA HB2 . 18826 1 910 . 1 1 79 79 ALA HB3 H 1 1.406 0.05 . 1 . . . A 221 ALA HB3 . 18826 1 911 . 1 1 79 79 ALA C C 13 178.788 0.50 . 1 . . . A 221 ALA C . 18826 1 912 . 1 1 79 79 ALA CA C 13 54.186 0.50 . 1 . . . A 221 ALA CA . 18826 1 913 . 1 1 79 79 ALA CB C 13 18.003 0.50 . 1 . . . A 221 ALA CB . 18826 1 914 . 1 1 79 79 ALA N N 15 120.623 0.10 . 1 . . . A 221 ALA N . 18826 1 915 . 1 1 80 80 GLY H H 1 7.045 0.05 . 1 . . . A 222 GLY H . 18826 1 916 . 1 1 80 80 GLY HA2 H 1 4.162 0.05 . 2 . . . A 222 GLY HA2 . 18826 1 917 . 1 1 80 80 GLY HA3 H 1 4.162 0.05 . 2 . . . A 222 GLY HA3 . 18826 1 918 . 1 1 80 80 GLY C C 13 174.312 0.50 . 1 . . . A 222 GLY C . 18826 1 919 . 1 1 80 80 GLY CA C 13 45.020 0.50 . 1 . . . A 222 GLY CA . 18826 1 920 . 1 1 80 80 GLY N N 15 101.804 0.10 . 1 . . . A 222 GLY N . 18826 1 921 . 1 1 81 81 GLY H H 1 7.689 0.05 . 1 . . . A 223 GLY H . 18826 1 922 . 1 1 81 81 GLY HA2 H 1 3.609 0.05 . 2 . . . A 223 GLY HA2 . 18826 1 923 . 1 1 81 81 GLY HA3 H 1 4.111 0.05 . 2 . . . A 223 GLY HA3 . 18826 1 924 . 1 1 81 81 GLY C C 13 174.502 0.50 . 1 . . . A 223 GLY C . 18826 1 925 . 1 1 81 81 GLY CA C 13 46.587 0.50 . 1 . . . A 223 GLY CA . 18826 1 926 . 1 1 81 81 GLY N N 15 107.024 0.10 . 1 . . . A 223 GLY N . 18826 1 927 . 1 1 82 82 ASP H H 1 9.016 0.05 . 1 . . . A 224 ASP H . 18826 1 928 . 1 1 82 82 ASP HA H 1 4.514 0.05 . 1 . . . A 224 ASP HA . 18826 1 929 . 1 1 82 82 ASP HB2 H 1 2.576 0.05 . 2 . . . A 224 ASP HB2 . 18826 1 930 . 1 1 82 82 ASP HB3 H 1 2.908 0.05 . 2 . . . A 224 ASP HB3 . 18826 1 931 . 1 1 82 82 ASP C C 13 173.432 0.50 . 1 . . . A 224 ASP C . 18826 1 932 . 1 1 82 82 ASP CA C 13 54.195 0.50 . 1 . . . A 224 ASP CA . 18826 1 933 . 1 1 82 82 ASP CB C 13 40.940 0.50 . 1 . . . A 224 ASP CB . 18826 1 934 . 1 1 82 82 ASP N N 15 127.759 0.10 . 1 . . . A 224 ASP N . 18826 1 935 . 1 1 83 83 GLU H H 1 7.304 0.05 . 1 . . . A 225 GLU H . 18826 1 936 . 1 1 83 83 GLU HA H 1 5.367 0.05 . 1 . . . A 225 GLU HA . 18826 1 937 . 1 1 83 83 GLU HB2 H 1 1.857 0.05 . 2 . . . A 225 GLU HB2 . 18826 1 938 . 1 1 83 83 GLU HB3 H 1 1.958 0.05 . 2 . . . A 225 GLU HB3 . 18826 1 939 . 1 1 83 83 GLU HG2 H 1 2.114 0.05 . 2 . . . A 225 GLU HG2 . 18826 1 940 . 1 1 83 83 GLU HG3 H 1 2.114 0.05 . 2 . . . A 225 GLU HG3 . 18826 1 941 . 1 1 83 83 GLU C C 13 175.546 0.50 . 1 . . . A 225 GLU C . 18826 1 942 . 1 1 83 83 GLU CA C 13 54.674 0.50 . 1 . . . A 225 GLU CA . 18826 1 943 . 1 1 83 83 GLU CB C 13 33.594 0.50 . 1 . . . A 225 GLU CB . 18826 1 944 . 1 1 83 83 GLU CG C 13 35.410 0.50 . 1 . . . A 225 GLU CG . 18826 1 945 . 1 1 83 83 GLU N N 15 117.594 0.10 . 1 . . . A 225 GLU N . 18826 1 946 . 1 1 84 84 THR H H 1 8.528 0.05 . 1 . . . A 226 THR H . 18826 1 947 . 1 1 84 84 THR HA H 1 4.533 0.05 . 1 . . . A 226 THR HA . 18826 1 948 . 1 1 84 84 THR HB H 1 3.693 0.05 . 1 . . . A 226 THR HB . 18826 1 949 . 1 1 84 84 THR HG1 H 1 4.095 0.05 . 1 . . . A 226 THR HG1 . 18826 1 950 . 1 1 84 84 THR HG21 H 1 0.288 0.05 . 1 . . . A 226 THR HG21 . 18826 1 951 . 1 1 84 84 THR HG22 H 1 0.288 0.05 . 1 . . . A 226 THR HG22 . 18826 1 952 . 1 1 84 84 THR HG23 H 1 0.288 0.05 . 1 . . . A 226 THR HG23 . 18826 1 953 . 1 1 84 84 THR C C 13 170.743 0.50 . 1 . . . A 226 THR C . 18826 1 954 . 1 1 84 84 THR CA C 13 62.334 0.50 . 1 . . . A 226 THR CA . 18826 1 955 . 1 1 84 84 THR CB C 13 70.329 0.50 . 1 . . . A 226 THR CB . 18826 1 956 . 1 1 84 84 THR CG2 C 13 18.105 0.50 . 1 . . . A 226 THR CG2 . 18826 1 957 . 1 1 84 84 THR N N 15 114.978 0.10 . 1 . . . A 226 THR N . 18826 1 958 . 1 1 85 85 LYS H H 1 7.660 0.05 . 1 . . . A 227 LYS H . 18826 1 959 . 1 1 85 85 LYS HA H 1 4.976 0.05 . 1 . . . A 227 LYS HA . 18826 1 960 . 1 1 85 85 LYS HB2 H 1 1.425 0.05 . 2 . . . A 227 LYS HB2 . 18826 1 961 . 1 1 85 85 LYS HB3 H 1 1.660 0.05 . 2 . . . A 227 LYS HB3 . 18826 1 962 . 1 1 85 85 LYS HG2 H 1 1.342 0.05 . 2 . . . A 227 LYS HG2 . 18826 1 963 . 1 1 85 85 LYS HG3 H 1 1.323 0.05 . 2 . . . A 227 LYS HG3 . 18826 1 964 . 1 1 85 85 LYS HD2 H 1 1.488 0.05 . 2 . . . A 227 LYS HD2 . 18826 1 965 . 1 1 85 85 LYS HD3 H 1 1.488 0.05 . 2 . . . A 227 LYS HD3 . 18826 1 966 . 1 1 85 85 LYS HE2 H 1 2.791 0.05 . 2 . . . A 227 LYS HE2 . 18826 1 967 . 1 1 85 85 LYS HE3 H 1 2.791 0.05 . 2 . . . A 227 LYS HE3 . 18826 1 968 . 1 1 85 85 LYS C C 13 175.202 0.50 . 1 . . . A 227 LYS C . 18826 1 969 . 1 1 85 85 LYS CA C 13 54.666 0.50 . 1 . . . A 227 LYS CA . 18826 1 970 . 1 1 85 85 LYS CB C 13 34.368 0.50 . 1 . . . A 227 LYS CB . 18826 1 971 . 1 1 85 85 LYS CG C 13 24.693 0.50 . 1 . . . A 227 LYS CG . 18826 1 972 . 1 1 85 85 LYS CD C 13 29.298 0.50 . 1 . . . A 227 LYS CD . 18826 1 973 . 1 1 85 85 LYS CE C 13 41.955 0.50 . 1 . . . A 227 LYS CE . 18826 1 974 . 1 1 85 85 LYS N N 15 124.718 0.10 . 1 . . . A 227 LYS N . 18826 1 975 . 1 1 86 86 LEU H H 1 8.887 0.05 . 1 . . . A 228 LEU H . 18826 1 976 . 1 1 86 86 LEU HA H 1 5.002 0.05 . 1 . . . A 228 LEU HA . 18826 1 977 . 1 1 86 86 LEU HB2 H 1 1.429 0.05 . 2 . . . A 228 LEU HB2 . 18826 1 978 . 1 1 86 86 LEU HB3 H 1 0.832 0.05 . 2 . . . A 228 LEU HB3 . 18826 1 979 . 1 1 86 86 LEU HG H 1 1.358 0.05 . 1 . . . A 228 LEU HG . 18826 1 980 . 1 1 86 86 LEU HD11 H 1 0.615 0.05 . 2 . . . A 228 LEU HD11 . 18826 1 981 . 1 1 86 86 LEU HD12 H 1 0.615 0.05 . 2 . . . A 228 LEU HD12 . 18826 1 982 . 1 1 86 86 LEU HD13 H 1 0.615 0.05 . 2 . . . A 228 LEU HD13 . 18826 1 983 . 1 1 86 86 LEU HD21 H 1 0.204 0.05 . 2 . . . A 228 LEU HD21 . 18826 1 984 . 1 1 86 86 LEU HD22 H 1 0.204 0.05 . 2 . . . A 228 LEU HD22 . 18826 1 985 . 1 1 86 86 LEU HD23 H 1 0.204 0.05 . 2 . . . A 228 LEU HD23 . 18826 1 986 . 1 1 86 86 LEU C C 13 174.873 0.50 . 1 . . . A 228 LEU C . 18826 1 987 . 1 1 86 86 LEU CA C 13 52.124 0.50 . 1 . . . A 228 LEU CA . 18826 1 988 . 1 1 86 86 LEU CB C 13 44.035 0.50 . 1 . . . A 228 LEU CB . 18826 1 989 . 1 1 86 86 LEU CG C 13 26.207 0.50 . 1 . . . A 228 LEU CG . 18826 1 990 . 1 1 86 86 LEU CD1 C 13 24.232 0.50 . 2 . . . A 228 LEU CD1 . 18826 1 991 . 1 1 86 86 LEU CD2 C 13 25.705 0.50 . 2 . . . A 228 LEU CD2 . 18826 1 992 . 1 1 86 86 LEU N N 15 124.405 0.10 . 1 . . . A 228 LEU N . 18826 1 993 . 1 1 87 87 LEU H H 1 8.489 0.05 . 1 . . . A 229 LEU H . 18826 1 994 . 1 1 87 87 LEU HA H 1 5.205 0.05 . 1 . . . A 229 LEU HA . 18826 1 995 . 1 1 87 87 LEU HB2 H 1 1.320 0.05 . 2 . . . A 229 LEU HB2 . 18826 1 996 . 1 1 87 87 LEU HB3 H 1 1.524 0.05 . 2 . . . A 229 LEU HB3 . 18826 1 997 . 1 1 87 87 LEU HG H 1 1.005 0.05 . 1 . . . A 229 LEU HG . 18826 1 998 . 1 1 87 87 LEU HD11 H 1 0.319 0.05 . 2 . . . A 229 LEU HD11 . 18826 1 999 . 1 1 87 87 LEU HD12 H 1 0.319 0.05 . 2 . . . A 229 LEU HD12 . 18826 1 1000 . 1 1 87 87 LEU HD13 H 1 0.319 0.05 . 2 . . . A 229 LEU HD13 . 18826 1 1001 . 1 1 87 87 LEU HD21 H 1 0.535 0.05 . 2 . . . A 229 LEU HD21 . 18826 1 1002 . 1 1 87 87 LEU HD22 H 1 0.535 0.05 . 2 . . . A 229 LEU HD22 . 18826 1 1003 . 1 1 87 87 LEU HD23 H 1 0.535 0.05 . 2 . . . A 229 LEU HD23 . 18826 1 1004 . 1 1 87 87 LEU C C 13 176.281 0.50 . 1 . . . A 229 LEU C . 18826 1 1005 . 1 1 87 87 LEU CA C 13 53.652 0.50 . 1 . . . A 229 LEU CA . 18826 1 1006 . 1 1 87 87 LEU CB C 13 43.518 0.50 . 1 . . . A 229 LEU CB . 18826 1 1007 . 1 1 87 87 LEU CG C 13 27.168 0.50 . 1 . . . A 229 LEU CG . 18826 1 1008 . 1 1 87 87 LEU CD1 C 13 24.727 0.50 . 2 . . . A 229 LEU CD1 . 18826 1 1009 . 1 1 87 87 LEU CD2 C 13 24.454 0.50 . 2 . . . A 229 LEU CD2 . 18826 1 1010 . 1 1 87 87 LEU N N 15 127.092 0.10 . 1 . . . A 229 LEU N . 18826 1 1011 . 1 1 88 88 VAL H H 1 9.242 0.05 . 1 . . . A 230 VAL H . 18826 1 1012 . 1 1 88 88 VAL HA H 1 5.439 0.05 . 1 . . . A 230 VAL HA . 18826 1 1013 . 1 1 88 88 VAL HB H 1 1.683 0.05 . 1 . . . A 230 VAL HB . 18826 1 1014 . 1 1 88 88 VAL HG11 H 1 0.413 0.05 . 2 . . . A 230 VAL HG11 . 18826 1 1015 . 1 1 88 88 VAL HG12 H 1 0.413 0.05 . 2 . . . A 230 VAL HG12 . 18826 1 1016 . 1 1 88 88 VAL HG13 H 1 0.413 0.05 . 2 . . . A 230 VAL HG13 . 18826 1 1017 . 1 1 88 88 VAL HG21 H 1 0.595 0.05 . 2 . . . A 230 VAL HG21 . 18826 1 1018 . 1 1 88 88 VAL HG22 H 1 0.595 0.05 . 2 . . . A 230 VAL HG22 . 18826 1 1019 . 1 1 88 88 VAL HG23 H 1 0.595 0.05 . 2 . . . A 230 VAL HG23 . 18826 1 1020 . 1 1 88 88 VAL C C 13 174.723 0.50 . 1 . . . A 230 VAL C . 18826 1 1021 . 1 1 88 88 VAL CA C 13 57.977 0.50 . 1 . . . A 230 VAL CA . 18826 1 1022 . 1 1 88 88 VAL CB C 13 36.408 0.50 . 1 . . . A 230 VAL CB . 18826 1 1023 . 1 1 88 88 VAL CG1 C 13 20.659 0.50 . 2 . . . A 230 VAL CG1 . 18826 1 1024 . 1 1 88 88 VAL CG2 C 13 17.604 0.50 . 2 . . . A 230 VAL CG2 . 18826 1 1025 . 1 1 88 88 VAL N N 15 120.408 0.10 . 1 . . . A 230 VAL N . 18826 1 1026 . 1 1 89 89 VAL H H 1 7.972 0.05 . 1 . . . A 231 VAL H . 18826 1 1027 . 1 1 89 89 VAL HA H 1 4.799 0.05 . 1 . . . A 231 VAL HA . 18826 1 1028 . 1 1 89 89 VAL HB H 1 2.044 0.05 . 1 . . . A 231 VAL HB . 18826 1 1029 . 1 1 89 89 VAL HG11 H 1 0.661 0.05 . 2 . . . A 231 VAL HG11 . 18826 1 1030 . 1 1 89 89 VAL HG12 H 1 0.661 0.05 . 2 . . . A 231 VAL HG12 . 18826 1 1031 . 1 1 89 89 VAL HG13 H 1 0.661 0.05 . 2 . . . A 231 VAL HG13 . 18826 1 1032 . 1 1 89 89 VAL HG21 H 1 0.498 0.05 . 2 . . . A 231 VAL HG21 . 18826 1 1033 . 1 1 89 89 VAL HG22 H 1 0.498 0.05 . 2 . . . A 231 VAL HG22 . 18826 1 1034 . 1 1 89 89 VAL HG23 H 1 0.498 0.05 . 2 . . . A 231 VAL HG23 . 18826 1 1035 . 1 1 89 89 VAL C C 13 175.634 0.50 . 1 . . . A 231 VAL C . 18826 1 1036 . 1 1 89 89 VAL CA C 13 59.694 0.50 . 1 . . . A 231 VAL CA . 18826 1 1037 . 1 1 89 89 VAL CB C 13 35.124 0.50 . 1 . . . A 231 VAL CB . 18826 1 1038 . 1 1 89 89 VAL CG1 C 13 17.340 0.50 . 2 . . . A 231 VAL CG1 . 18826 1 1039 . 1 1 89 89 VAL CG2 C 13 23.549 0.50 . 2 . . . A 231 VAL CG2 . 18826 1 1040 . 1 1 89 89 VAL N N 15 107.052 0.10 . 1 . . . A 231 VAL N . 18826 1 1041 . 1 1 90 90 ASP H H 1 7.651 0.05 . 1 . . . A 232 ASP H . 18826 1 1042 . 1 1 90 90 ASP HA H 1 4.736 0.05 . 1 . . . A 232 ASP HA . 18826 1 1043 . 1 1 90 90 ASP HB2 H 1 2.513 0.05 . 2 . . . A 232 ASP HB2 . 18826 1 1044 . 1 1 90 90 ASP HB3 H 1 3.259 0.05 . 2 . . . A 232 ASP HB3 . 18826 1 1045 . 1 1 90 90 ASP C C 13 175.513 0.50 . 1 . . . A 232 ASP C . 18826 1 1046 . 1 1 90 90 ASP CA C 13 52.659 0.50 . 1 . . . A 232 ASP CA . 18826 1 1047 . 1 1 90 90 ASP CB C 13 40.948 0.50 . 1 . . . A 232 ASP CB . 18826 1 1048 . 1 1 90 90 ASP N N 15 121.802 0.10 . 1 . . . A 232 ASP N . 18826 1 1049 . 1 1 91 91 ARG H H 1 8.989 0.05 . 1 . . . A 233 ARG H . 18826 1 1050 . 1 1 91 91 ARG HA H 1 4.169 0.05 . 1 . . . A 233 ARG HA . 18826 1 1051 . 1 1 91 91 ARG HB2 H 1 1.840 0.05 . 2 . . . A 233 ARG HB2 . 18826 1 1052 . 1 1 91 91 ARG HB3 H 1 1.774 0.05 . 2 . . . A 233 ARG HB3 . 18826 1 1053 . 1 1 91 91 ARG HG2 H 1 1.638 0.05 . 2 . . . A 233 ARG HG2 . 18826 1 1054 . 1 1 91 91 ARG HG3 H 1 1.794 0.05 . 2 . . . A 233 ARG HG3 . 18826 1 1055 . 1 1 91 91 ARG HD2 H 1 3.124 0.05 . 2 . . . A 233 ARG HD2 . 18826 1 1056 . 1 1 91 91 ARG HD3 H 1 3.183 0.05 . 2 . . . A 233 ARG HD3 . 18826 1 1057 . 1 1 91 91 ARG HE H 1 7.327 0.05 . 1 . . . A 233 ARG HE . 18826 1 1058 . 1 1 91 91 ARG HH11 H 1 6.337 0.05 . 2 . . . A 233 ARG HH11 . 18826 1 1059 . 1 1 91 91 ARG HH12 H 1 6.883 0.05 . 2 . . . A 233 ARG HH12 . 18826 1 1060 . 1 1 91 91 ARG C C 13 179.154 0.50 . 1 . . . A 233 ARG C . 18826 1 1061 . 1 1 91 91 ARG CA C 13 59.851 0.50 . 1 . . . A 233 ARG CA . 18826 1 1062 . 1 1 91 91 ARG CB C 13 29.784 0.50 . 1 . . . A 233 ARG CB . 18826 1 1063 . 1 1 91 91 ARG CG C 13 26.763 0.50 . 1 . . . A 233 ARG CG . 18826 1 1064 . 1 1 91 91 ARG CD C 13 43.002 0.50 . 1 . . . A 233 ARG CD . 18826 1 1065 . 1 1 91 91 ARG N N 15 120.219 0.10 . 1 . . . A 233 ARG N . 18826 1 1066 . 1 1 91 91 ARG NE N 15 84.526 0.10 . 1 . . . A 233 ARG NE . 18826 1 1067 . 1 1 92 92 GLU H H 1 8.670 0.05 . 1 . . . A 234 GLU H . 18826 1 1068 . 1 1 92 92 GLU HA H 1 3.936 0.05 . 1 . . . A 234 GLU HA . 18826 1 1069 . 1 1 92 92 GLU HB2 H 1 1.854 0.05 . 2 . . . A 234 GLU HB2 . 18826 1 1070 . 1 1 92 92 GLU HB3 H 1 1.983 0.05 . 2 . . . A 234 GLU HB3 . 18826 1 1071 . 1 1 92 92 GLU HG2 H 1 2.302 0.05 . 2 . . . A 234 GLU HG2 . 18826 1 1072 . 1 1 92 92 GLU HG3 H 1 2.227 0.05 . 2 . . . A 234 GLU HG3 . 18826 1 1073 . 1 1 92 92 GLU C C 13 180.161 0.50 . 1 . . . A 234 GLU C . 18826 1 1074 . 1 1 92 92 GLU CA C 13 59.749 0.50 . 1 . . . A 234 GLU CA . 18826 1 1075 . 1 1 92 92 GLU CB C 13 28.733 0.50 . 1 . . . A 234 GLU CB . 18826 1 1076 . 1 1 92 92 GLU CG C 13 36.349 0.50 . 1 . . . A 234 GLU CG . 18826 1 1077 . 1 1 92 92 GLU N N 15 119.058 0.10 . 1 . . . A 234 GLU N . 18826 1 1078 . 1 1 93 93 THR H H 1 8.479 0.05 . 1 . . . A 235 THR H . 18826 1 1079 . 1 1 93 93 THR HA H 1 3.872 0.05 . 1 . . . A 235 THR HA . 18826 1 1080 . 1 1 93 93 THR HG1 H 1 6.087 0.05 . 1 . . . A 235 THR HG1 . 18826 1 1081 . 1 1 93 93 THR HG21 H 1 1.040 0.05 . 1 . . . A 235 THR HG21 . 18826 1 1082 . 1 1 93 93 THR HG22 H 1 1.040 0.05 . 1 . . . A 235 THR HG22 . 18826 1 1083 . 1 1 93 93 THR HG23 H 1 1.040 0.05 . 1 . . . A 235 THR HG23 . 18826 1 1084 . 1 1 93 93 THR C C 13 176.057 0.50 . 1 . . . A 235 THR C . 18826 1 1085 . 1 1 93 93 THR CA C 13 67.858 0.50 . 1 . . . A 235 THR CA . 18826 1 1086 . 1 1 93 93 THR CG2 C 13 21.915 0.50 . 1 . . . A 235 THR CG2 . 18826 1 1087 . 1 1 93 93 THR N N 15 120.004 0.10 . 1 . . . A 235 THR N . 18826 1 1088 . 1 1 94 94 ASP H H 1 8.768 0.05 . 1 . . . A 236 ASP H . 18826 1 1089 . 1 1 94 94 ASP HA H 1 4.389 0.05 . 1 . . . A 236 ASP HA . 18826 1 1090 . 1 1 94 94 ASP HB2 H 1 2.791 0.05 . 2 . . . A 236 ASP HB2 . 18826 1 1091 . 1 1 94 94 ASP HB3 H 1 2.961 0.05 . 2 . . . A 236 ASP HB3 . 18826 1 1092 . 1 1 94 94 ASP C C 13 179.003 0.50 . 1 . . . A 236 ASP C . 18826 1 1093 . 1 1 94 94 ASP CA C 13 56.769 0.50 . 1 . . . A 236 ASP CA . 18826 1 1094 . 1 1 94 94 ASP CB C 13 41.215 0.50 . 1 . . . A 236 ASP CB . 18826 1 1095 . 1 1 94 94 ASP N N 15 123.124 0.10 . 1 . . . A 236 ASP N . 18826 1 1096 . 1 1 95 95 GLU H H 1 8.171 0.05 . 1 . . . A 237 GLU H . 18826 1 1097 . 1 1 95 95 GLU HA H 1 3.854 0.05 . 1 . . . A 237 GLU HA . 18826 1 1098 . 1 1 95 95 GLU HB2 H 1 2.070 0.05 . 2 . . . A 237 GLU HB2 . 18826 1 1099 . 1 1 95 95 GLU HB3 H 1 2.012 0.05 . 2 . . . A 237 GLU HB3 . 18826 1 1100 . 1 1 95 95 GLU HG2 H 1 2.323 0.05 . 2 . . . A 237 GLU HG2 . 18826 1 1101 . 1 1 95 95 GLU HG3 H 1 2.406 0.05 . 2 . . . A 237 GLU HG3 . 18826 1 1102 . 1 1 95 95 GLU C C 13 178.794 0.50 . 1 . . . A 237 GLU C . 18826 1 1103 . 1 1 95 95 GLU CA C 13 59.193 0.50 . 1 . . . A 237 GLU CA . 18826 1 1104 . 1 1 95 95 GLU CB C 13 29.025 0.50 . 1 . . . A 237 GLU CB . 18826 1 1105 . 1 1 95 95 GLU CG C 13 35.864 0.50 . 1 . . . A 237 GLU CG . 18826 1 1106 . 1 1 95 95 GLU N N 15 115.596 0.10 . 1 . . . A 237 GLU N . 18826 1 1107 . 1 1 96 96 PHE H H 1 7.885 0.05 . 1 . . . A 238 PHE H . 18826 1 1108 . 1 1 96 96 PHE HA H 1 4.215 0.05 . 1 . . . A 238 PHE HA . 18826 1 1109 . 1 1 96 96 PHE HB2 H 1 3.236 0.05 . 2 . . . A 238 PHE HB2 . 18826 1 1110 . 1 1 96 96 PHE HB3 H 1 3.236 0.05 . 2 . . . A 238 PHE HB3 . 18826 1 1111 . 1 1 96 96 PHE HD1 H 1 6.827 0.05 . 3 . . . A 238 PHE HD1 . 18826 1 1112 . 1 1 96 96 PHE HD2 H 1 6.827 0.05 . 3 . . . A 238 PHE HD2 . 18826 1 1113 . 1 1 96 96 PHE HE1 H 1 6.584 0.05 . 3 . . . A 238 PHE HE1 . 18826 1 1114 . 1 1 96 96 PHE HE2 H 1 6.584 0.05 . 3 . . . A 238 PHE HE2 . 18826 1 1115 . 1 1 96 96 PHE HZ H 1 7.036 0.05 . 1 . . . A 238 PHE HZ . 18826 1 1116 . 1 1 96 96 PHE C C 13 177.568 0.50 . 1 . . . A 238 PHE C . 18826 1 1117 . 1 1 96 96 PHE CA C 13 60.867 0.50 . 1 . . . A 238 PHE CA . 18826 1 1118 . 1 1 96 96 PHE CB C 13 39.223 0.50 . 1 . . . A 238 PHE CB . 18826 1 1119 . 1 1 96 96 PHE CD1 C 13 131.895 0.50 . 3 . . . A 238 PHE CD1 . 18826 1 1120 . 1 1 96 96 PHE CE1 C 13 130.498 0.50 . 3 . . . A 238 PHE CE1 . 18826 1 1121 . 1 1 96 96 PHE CZ C 13 130.404 0.50 . 1 . . . A 238 PHE CZ . 18826 1 1122 . 1 1 96 96 PHE N N 15 121.300 0.10 . 1 . . . A 238 PHE N . 18826 1 1123 . 1 1 97 97 PHE H H 1 8.720 0.05 . 1 . . . A 239 PHE H . 18826 1 1124 . 1 1 97 97 PHE HA H 1 3.245 0.05 . 1 . . . A 239 PHE HA . 18826 1 1125 . 1 1 97 97 PHE HB2 H 1 2.926 0.05 . 2 . . . A 239 PHE HB2 . 18826 1 1126 . 1 1 97 97 PHE HB3 H 1 3.468 0.05 . 2 . . . A 239 PHE HB3 . 18826 1 1127 . 1 1 97 97 PHE HD1 H 1 7.257 0.05 . 3 . . . A 239 PHE HD1 . 18826 1 1128 . 1 1 97 97 PHE HD2 H 1 7.257 0.05 . 3 . . . A 239 PHE HD2 . 18826 1 1129 . 1 1 97 97 PHE HE1 H 1 6.491 0.05 . 3 . . . A 239 PHE HE1 . 18826 1 1130 . 1 1 97 97 PHE HE2 H 1 6.491 0.05 . 3 . . . A 239 PHE HE2 . 18826 1 1131 . 1 1 97 97 PHE HZ H 1 6.811 0.05 . 1 . . . A 239 PHE HZ . 18826 1 1132 . 1 1 97 97 PHE C C 13 178.810 0.50 . 1 . . . A 239 PHE C . 18826 1 1133 . 1 1 97 97 PHE CA C 13 64.323 0.50 . 1 . . . A 239 PHE CA . 18826 1 1134 . 1 1 97 97 PHE CB C 13 36.429 0.50 . 1 . . . A 239 PHE CB . 18826 1 1135 . 1 1 97 97 PHE CD2 C 13 130.858 0.50 . 3 . . . A 239 PHE CD2 . 18826 1 1136 . 1 1 97 97 PHE CE2 C 13 130.788 0.50 . 3 . . . A 239 PHE CE2 . 18826 1 1137 . 1 1 97 97 PHE CZ C 13 128.550 0.50 . 1 . . . A 239 PHE CZ . 18826 1 1138 . 1 1 97 97 PHE N N 15 119.966 0.10 . 1 . . . A 239 PHE N . 18826 1 1139 . 1 1 98 98 LYS H H 1 8.285 0.05 . 1 . . . A 240 LYS H . 18826 1 1140 . 1 1 98 98 LYS HA H 1 4.045 0.05 . 1 . . . A 240 LYS HA . 18826 1 1141 . 1 1 98 98 LYS HB2 H 1 1.816 0.05 . 2 . . . A 240 LYS HB2 . 18826 1 1142 . 1 1 98 98 LYS HB3 H 1 1.816 0.05 . 2 . . . A 240 LYS HB3 . 18826 1 1143 . 1 1 98 98 LYS HG2 H 1 1.272 0.05 . 2 . . . A 240 LYS HG2 . 18826 1 1144 . 1 1 98 98 LYS HG3 H 1 1.576 0.05 . 2 . . . A 240 LYS HG3 . 18826 1 1145 . 1 1 98 98 LYS HE2 H 1 2.785 0.05 . 2 . . . A 240 LYS HE2 . 18826 1 1146 . 1 1 98 98 LYS HE3 H 1 2.785 0.05 . 2 . . . A 240 LYS HE3 . 18826 1 1147 . 1 1 98 98 LYS C C 13 181.410 0.50 . 1 . . . A 240 LYS C . 18826 1 1148 . 1 1 98 98 LYS CA C 13 59.745 0.50 . 1 . . . A 240 LYS CA . 18826 1 1149 . 1 1 98 98 LYS CB C 13 31.865 0.50 . 1 . . . A 240 LYS CB . 18826 1 1150 . 1 1 98 98 LYS CG C 13 25.728 0.50 . 1 . . . A 240 LYS CG . 18826 1 1151 . 1 1 98 98 LYS N N 15 119.043 0.10 . 1 . . . A 240 LYS N . 18826 1 1152 . 1 1 99 99 LYS H H 1 7.841 0.05 . 1 . . . A 241 LYS H . 18826 1 1153 . 1 1 99 99 LYS HA H 1 3.990 0.05 . 1 . . . A 241 LYS HA . 18826 1 1154 . 1 1 99 99 LYS HB2 H 1 1.807 0.05 . 2 . . . A 241 LYS HB2 . 18826 1 1155 . 1 1 99 99 LYS HB3 H 1 1.934 0.05 . 2 . . . A 241 LYS HB3 . 18826 1 1156 . 1 1 99 99 LYS HG2 H 1 1.396 0.05 . 2 . . . A 241 LYS HG2 . 18826 1 1157 . 1 1 99 99 LYS HG3 H 1 1.577 0.05 . 2 . . . A 241 LYS HG3 . 18826 1 1158 . 1 1 99 99 LYS HD2 H 1 1.602 0.05 . 2 . . . A 241 LYS HD2 . 18826 1 1159 . 1 1 99 99 LYS HE2 H 1 2.865 0.05 . 2 . . . A 241 LYS HE2 . 18826 1 1160 . 1 1 99 99 LYS HE3 H 1 2.865 0.05 . 2 . . . A 241 LYS HE3 . 18826 1 1161 . 1 1 99 99 LYS C C 13 179.098 0.50 . 1 . . . A 241 LYS C . 18826 1 1162 . 1 1 99 99 LYS CA C 13 58.817 0.50 . 1 . . . A 241 LYS CA . 18826 1 1163 . 1 1 99 99 LYS CB C 13 31.878 0.50 . 1 . . . A 241 LYS CB . 18826 1 1164 . 1 1 99 99 LYS CG C 13 25.262 0.50 . 1 . . . A 241 LYS CG . 18826 1 1165 . 1 1 99 99 LYS CD C 13 29.140 0.50 . 1 . . . A 241 LYS CD . 18826 1 1166 . 1 1 99 99 LYS N N 15 121.170 0.10 . 1 . . . A 241 LYS N . 18826 1 1167 . 1 1 100 100 CYS H H 1 7.260 0.05 . 1 . . . A 242 CYS H . 18826 1 1168 . 1 1 100 100 CYS HA H 1 3.965 0.05 . 1 . . . A 242 CYS HA . 18826 1 1169 . 1 1 100 100 CYS HB2 H 1 2.251 0.05 . 2 . . . A 242 CYS HB2 . 18826 1 1170 . 1 1 100 100 CYS HB3 H 1 2.457 0.05 . 2 . . . A 242 CYS HB3 . 18826 1 1171 . 1 1 100 100 CYS C C 13 173.262 0.50 . 1 . . . A 242 CYS C . 18826 1 1172 . 1 1 100 100 CYS CA C 13 60.244 0.50 . 1 . . . A 242 CYS CA . 18826 1 1173 . 1 1 100 100 CYS CB C 13 26.756 0.50 . 1 . . . A 242 CYS CB . 18826 1 1174 . 1 1 100 100 CYS N N 15 115.958 0.10 . 1 . . . A 242 CYS N . 18826 1 1175 . 1 1 101 101 ARG H H 1 7.760 0.05 . 1 . . . A 243 ARG H . 18826 1 1176 . 1 1 101 101 ARG HA H 1 3.714 0.05 . 1 . . . A 243 ARG HA . 18826 1 1177 . 1 1 101 101 ARG HB2 H 1 1.725 0.05 . 2 . . . A 243 ARG HB2 . 18826 1 1178 . 1 1 101 101 ARG HB3 H 1 1.970 0.05 . 2 . . . A 243 ARG HB3 . 18826 1 1179 . 1 1 101 101 ARG HG2 H 1 1.293 0.05 . 2 . . . A 243 ARG HG2 . 18826 1 1180 . 1 1 101 101 ARG HG3 H 1 1.424 0.05 . 2 . . . A 243 ARG HG3 . 18826 1 1181 . 1 1 101 101 ARG HD2 H 1 2.819 0.05 . 2 . . . A 243 ARG HD2 . 18826 1 1182 . 1 1 101 101 ARG HD3 H 1 2.610 0.05 . 2 . . . A 243 ARG HD3 . 18826 1 1183 . 1 1 101 101 ARG HE H 1 6.865 0.05 . 1 . . . A 243 ARG HE . 18826 1 1184 . 1 1 101 101 ARG HH11 H 1 6.146 0.05 . 2 . . . A 243 ARG HH11 . 18826 1 1185 . 1 1 101 101 ARG HH12 H 1 6.460 0.05 . 2 . . . A 243 ARG HH12 . 18826 1 1186 . 1 1 101 101 ARG C C 13 174.868 0.50 . 1 . . . A 243 ARG C . 18826 1 1187 . 1 1 101 101 ARG CA C 13 56.692 0.50 . 1 . . . A 243 ARG CA . 18826 1 1188 . 1 1 101 101 ARG CB C 13 27.000 0.50 . 1 . . . A 243 ARG CB . 18826 1 1189 . 1 1 101 101 ARG CG C 13 27.002 0.50 . 1 . . . A 243 ARG CG . 18826 1 1190 . 1 1 101 101 ARG CD C 13 43.455 0.50 . 1 . . . A 243 ARG CD . 18826 1 1191 . 1 1 101 101 ARG N N 15 115.392 0.10 . 1 . . . A 243 ARG N . 18826 1 1192 . 1 1 101 101 ARG NE N 15 84.903 0.10 . 1 . . . A 243 ARG NE . 18826 1 1193 . 1 1 102 102 VAL H H 1 7.370 0.05 . 1 . . . A 244 VAL H . 18826 1 1194 . 1 1 102 102 VAL HA H 1 4.185 0.05 . 1 . . . A 244 VAL HA . 18826 1 1195 . 1 1 102 102 VAL HB H 1 1.413 0.05 . 1 . . . A 244 VAL HB . 18826 1 1196 . 1 1 102 102 VAL HG11 H 1 0.786 0.05 . 2 . . . A 244 VAL HG11 . 18826 1 1197 . 1 1 102 102 VAL HG12 H 1 0.786 0.05 . 2 . . . A 244 VAL HG12 . 18826 1 1198 . 1 1 102 102 VAL HG13 H 1 0.786 0.05 . 2 . . . A 244 VAL HG13 . 18826 1 1199 . 1 1 102 102 VAL HG21 H 1 0.891 0.05 . 2 . . . A 244 VAL HG21 . 18826 1 1200 . 1 1 102 102 VAL HG22 H 1 0.891 0.05 . 2 . . . A 244 VAL HG22 . 18826 1 1201 . 1 1 102 102 VAL HG23 H 1 0.891 0.05 . 2 . . . A 244 VAL HG23 . 18826 1 1202 . 1 1 102 102 VAL C C 13 174.930 0.50 . 1 . . . A 244 VAL C . 18826 1 1203 . 1 1 102 102 VAL CA C 13 60.258 0.50 . 1 . . . A 244 VAL CA . 18826 1 1204 . 1 1 102 102 VAL CB C 13 36.667 0.50 . 1 . . . A 244 VAL CB . 18826 1 1205 . 1 1 102 102 VAL CG1 C 13 21.169 0.50 . 2 . . . A 244 VAL CG1 . 18826 1 1206 . 1 1 102 102 VAL CG2 C 13 21.359 0.50 . 2 . . . A 244 VAL CG2 . 18826 1 1207 . 1 1 102 102 VAL N N 15 118.077 0.10 . 1 . . . A 244 VAL N . 18826 1 1208 . 1 1 103 103 ILE H H 1 8.516 0.05 . 1 . . . A 245 ILE H . 18826 1 1209 . 1 1 103 103 ILE HA H 1 4.187 0.05 . 1 . . . A 245 ILE HA . 18826 1 1210 . 1 1 103 103 ILE HB H 1 1.706 0.05 . 1 . . . A 245 ILE HB . 18826 1 1211 . 1 1 103 103 ILE HG12 H 1 1.118 0.05 . 2 . . . A 245 ILE HG12 . 18826 1 1212 . 1 1 103 103 ILE HG13 H 1 1.433 0.05 . 2 . . . A 245 ILE HG13 . 18826 1 1213 . 1 1 103 103 ILE HG21 H 1 0.778 0.05 . 1 . . . A 245 ILE HG21 . 18826 1 1214 . 1 1 103 103 ILE HG22 H 1 0.778 0.05 . 1 . . . A 245 ILE HG22 . 18826 1 1215 . 1 1 103 103 ILE HG23 H 1 0.778 0.05 . 1 . . . A 245 ILE HG23 . 18826 1 1216 . 1 1 103 103 ILE HD11 H 1 0.670 0.05 . 1 . . . A 245 ILE HD11 . 18826 1 1217 . 1 1 103 103 ILE HD12 H 1 0.670 0.05 . 1 . . . A 245 ILE HD12 . 18826 1 1218 . 1 1 103 103 ILE HD13 H 1 0.670 0.05 . 1 . . . A 245 ILE HD13 . 18826 1 1219 . 1 1 103 103 ILE CA C 13 57.724 0.50 . 1 . . . A 245 ILE CA . 18826 1 1220 . 1 1 103 103 ILE CB C 13 37.950 0.50 . 1 . . . A 245 ILE CB . 18826 1 1221 . 1 1 103 103 ILE CG1 C 13 27.242 0.50 . 1 . . . A 245 ILE CG1 . 18826 1 1222 . 1 1 103 103 ILE CG2 C 13 16.069 0.50 . 1 . . . A 245 ILE CG2 . 18826 1 1223 . 1 1 103 103 ILE CD1 C 13 11.513 0.50 . 1 . . . A 245 ILE CD1 . 18826 1 1224 . 1 1 103 103 ILE N N 15 129.413 0.10 . 1 . . . A 245 ILE N . 18826 1 1225 . 1 1 104 104 PRO HA H 1 3.923 0.05 . 1 . . . A 246 PRO HA . 18826 1 1226 . 1 1 104 104 PRO HB2 H 1 0.390 0.05 . 2 . . . A 246 PRO HB2 . 18826 1 1227 . 1 1 104 104 PRO HB3 H 1 0.977 0.05 . 2 . . . A 246 PRO HB3 . 18826 1 1228 . 1 1 104 104 PRO HG2 H 1 1.229 0.05 . 2 . . . A 246 PRO HG2 . 18826 1 1229 . 1 1 104 104 PRO HG3 H 1 1.720 0.05 . 2 . . . A 246 PRO HG3 . 18826 1 1230 . 1 1 104 104 PRO HD2 H 1 3.420 0.05 . 2 . . . A 246 PRO HD2 . 18826 1 1231 . 1 1 104 104 PRO HD3 H 1 3.676 0.05 . 2 . . . A 246 PRO HD3 . 18826 1 1232 . 1 1 104 104 PRO C C 13 175.060 0.50 . 1 . . . A 246 PRO C . 18826 1 1233 . 1 1 104 104 PRO CA C 13 62.304 0.50 . 1 . . . A 246 PRO CA . 18826 1 1234 . 1 1 104 104 PRO CB C 13 30.320 0.50 . 1 . . . A 246 PRO CB . 18826 1 1235 . 1 1 104 104 PRO CD C 13 50.024 0.50 . 1 . . . A 246 PRO CD . 18826 1 1236 . 1 1 105 105 SER H H 1 10.684 0.05 . 1 . . . A 247 SER H . 18826 1 1237 . 1 1 105 105 SER HA H 1 4.393 0.05 . 1 . . . A 247 SER HA . 18826 1 1238 . 1 1 105 105 SER HB2 H 1 3.527 0.05 . 2 . . . A 247 SER HB2 . 18826 1 1239 . 1 1 105 105 SER HB3 H 1 4.022 0.05 . 2 . . . A 247 SER HB3 . 18826 1 1240 . 1 1 105 105 SER C C 13 175.721 0.50 . 1 . . . A 247 SER C . 18826 1 1241 . 1 1 105 105 SER CA C 13 56.216 0.50 . 1 . . . A 247 SER CA . 18826 1 1242 . 1 1 105 105 SER CB C 13 66.601 0.50 . 1 . . . A 247 SER CB . 18826 1 1243 . 1 1 105 105 SER N N 15 120.069 0.10 . 1 . . . A 247 SER N . 18826 1 1244 . 1 1 106 106 GLN H H 1 8.590 0.05 . 1 . . . A 248 GLN H . 18826 1 1245 . 1 1 106 106 GLN HA H 1 3.645 0.05 . 1 . . . A 248 GLN HA . 18826 1 1246 . 1 1 106 106 GLN HB2 H 1 2.029 0.05 . 2 . . . A 248 GLN HB2 . 18826 1 1247 . 1 1 106 106 GLN HB3 H 1 2.031 0.05 . 2 . . . A 248 GLN HB3 . 18826 1 1248 . 1 1 106 106 GLN HG2 H 1 2.175 0.05 . 2 . . . A 248 GLN HG2 . 18826 1 1249 . 1 1 106 106 GLN HG3 H 1 2.357 0.05 . 2 . . . A 248 GLN HG3 . 18826 1 1250 . 1 1 106 106 GLN HE21 H 1 6.567 0.05 . 2 . . . A 248 GLN HE21 . 18826 1 1251 . 1 1 106 106 GLN HE22 H 1 7.872 0.05 . 2 . . . A 248 GLN HE22 . 18826 1 1252 . 1 1 106 106 GLN C C 13 178.490 0.50 . 1 . . . A 248 GLN C . 18826 1 1253 . 1 1 106 106 GLN CA C 13 58.670 0.50 . 1 . . . A 248 GLN CA . 18826 1 1254 . 1 1 106 106 GLN CB C 13 27.750 0.50 . 1 . . . A 248 GLN CB . 18826 1 1255 . 1 1 106 106 GLN CG C 13 34.407 0.50 . 1 . . . A 248 GLN CG . 18826 1 1256 . 1 1 106 106 GLN N N 15 119.175 0.10 . 1 . . . A 248 GLN N . 18826 1 1257 . 1 1 106 106 GLN NE2 N 15 112.313 0.10 . 1 . . . A 248 GLN NE2 . 18826 1 1258 . 1 1 107 107 GLU H H 1 8.475 0.05 . 1 . . . A 249 GLU H . 18826 1 1259 . 1 1 107 107 GLU HA H 1 3.877 0.05 . 1 . . . A 249 GLU HA . 18826 1 1260 . 1 1 107 107 GLU HB2 H 1 1.401 0.05 . 2 . . . A 249 GLU HB2 . 18826 1 1261 . 1 1 107 107 GLU HB3 H 1 1.521 0.05 . 2 . . . A 249 GLU HB3 . 18826 1 1262 . 1 1 107 107 GLU HG2 H 1 1.800 0.05 . 2 . . . A 249 GLU HG2 . 18826 1 1263 . 1 1 107 107 GLU HG3 H 1 1.800 0.05 . 2 . . . A 249 GLU HG3 . 18826 1 1264 . 1 1 107 107 GLU C C 13 177.306 0.50 . 1 . . . A 249 GLU C . 18826 1 1265 . 1 1 107 107 GLU CA C 13 57.819 0.50 . 1 . . . A 249 GLU CA . 18826 1 1266 . 1 1 107 107 GLU CB C 13 28.314 0.50 . 1 . . . A 249 GLU CB . 18826 1 1267 . 1 1 107 107 GLU CG C 13 34.872 0.50 . 1 . . . A 249 GLU CG . 18826 1 1268 . 1 1 107 107 GLU N N 15 119.805 0.10 . 1 . . . A 249 GLU N . 18826 1 1269 . 1 1 108 108 HIS H H 1 7.448 0.05 . 1 . . . A 250 HIS H . 18826 1 1270 . 1 1 108 108 HIS HA H 1 4.413 0.05 . 1 . . . A 250 HIS HA . 18826 1 1271 . 1 1 108 108 HIS HB2 H 1 2.942 0.05 . 2 . . . A 250 HIS HB2 . 18826 1 1272 . 1 1 108 108 HIS HB3 H 1 3.489 0.05 . 2 . . . A 250 HIS HB3 . 18826 1 1273 . 1 1 108 108 HIS C C 13 175.810 0.50 . 1 . . . A 250 HIS C . 18826 1 1274 . 1 1 108 108 HIS CA C 13 57.732 0.50 . 1 . . . A 250 HIS CA . 18826 1 1275 . 1 1 108 108 HIS CB C 13 31.369 0.50 . 1 . . . A 250 HIS CB . 18826 1 1276 . 1 1 108 108 HIS N N 15 115.351 0.10 . 1 . . . A 250 HIS N . 18826 1 1277 . 1 1 109 109 LEU H H 1 7.450 0.05 . 1 . . . A 251 LEU H . 18826 1 1278 . 1 1 109 109 LEU HA H 1 3.979 0.05 . 1 . . . A 251 LEU HA . 18826 1 1279 . 1 1 109 109 LEU HB2 H 1 1.420 0.05 . 2 . . . A 251 LEU HB2 . 18826 1 1280 . 1 1 109 109 LEU HB3 H 1 1.737 0.05 . 2 . . . A 251 LEU HB3 . 18826 1 1281 . 1 1 109 109 LEU HG H 1 1.505 0.05 . 1 . . . A 251 LEU HG . 18826 1 1282 . 1 1 109 109 LEU HD11 H 1 0.683 0.05 . 2 . . . A 251 LEU HD11 . 18826 1 1283 . 1 1 109 109 LEU HD12 H 1 0.683 0.05 . 2 . . . A 251 LEU HD12 . 18826 1 1284 . 1 1 109 109 LEU HD13 H 1 0.683 0.05 . 2 . . . A 251 LEU HD13 . 18826 1 1285 . 1 1 109 109 LEU HD21 H 1 0.856 0.05 . 2 . . . A 251 LEU HD21 . 18826 1 1286 . 1 1 109 109 LEU HD22 H 1 0.856 0.05 . 2 . . . A 251 LEU HD22 . 18826 1 1287 . 1 1 109 109 LEU HD23 H 1 0.856 0.05 . 2 . . . A 251 LEU HD23 . 18826 1 1288 . 1 1 109 109 LEU C C 13 177.466 0.50 . 1 . . . A 251 LEU C . 18826 1 1289 . 1 1 109 109 LEU CA C 13 57.736 0.50 . 1 . . . A 251 LEU CA . 18826 1 1290 . 1 1 109 109 LEU CB C 13 41.475 0.50 . 1 . . . A 251 LEU CB . 18826 1 1291 . 1 1 109 109 LEU CG C 13 27.242 0.50 . 1 . . . A 251 LEU CG . 18826 1 1292 . 1 1 109 109 LEU CD1 C 13 23.154 0.50 . 2 . . . A 251 LEU CD1 . 18826 1 1293 . 1 1 109 109 LEU CD2 C 13 25.731 0.50 . 2 . . . A 251 LEU CD2 . 18826 1 1294 . 1 1 109 109 LEU N N 15 120.389 0.10 . 1 . . . A 251 LEU N . 18826 1 1295 . 1 1 110 110 ASN H H 1 7.981 0.05 . 1 . . . A 252 ASN H . 18826 1 1296 . 1 1 110 110 ASN HA H 1 4.730 0.05 . 1 . . . A 252 ASN HA . 18826 1 1297 . 1 1 110 110 ASN HB2 H 1 2.450 0.05 . 2 . . . A 252 ASN HB2 . 18826 1 1298 . 1 1 110 110 ASN HB3 H 1 2.647 0.05 . 2 . . . A 252 ASN HB3 . 18826 1 1299 . 1 1 110 110 ASN HD21 H 1 6.833 0.05 . 2 . . . A 252 ASN HD21 . 18826 1 1300 . 1 1 110 110 ASN HD22 H 1 7.556 0.05 . 2 . . . A 252 ASN HD22 . 18826 1 1301 . 1 1 110 110 ASN C C 13 174.905 0.50 . 1 . . . A 252 ASN C . 18826 1 1302 . 1 1 110 110 ASN CA C 13 52.653 0.50 . 1 . . . A 252 ASN CA . 18826 1 1303 . 1 1 110 110 ASN CB C 13 41.482 0.50 . 1 . . . A 252 ASN CB . 18826 1 1304 . 1 1 110 110 ASN N N 15 111.936 0.10 . 1 . . . A 252 ASN N . 18826 1 1305 . 1 1 110 110 ASN ND2 N 15 113.873 0.10 . 1 . . . A 252 ASN ND2 . 18826 1 1306 . 1 1 111 111 GLY H H 1 7.826 0.05 . 1 . . . A 253 GLY H . 18826 1 1307 . 1 1 111 111 GLY HA2 H 1 4.094 0.05 . 2 . . . A 253 GLY HA2 . 18826 1 1308 . 1 1 111 111 GLY HA3 H 1 4.134 0.05 . 2 . . . A 253 GLY HA3 . 18826 1 1309 . 1 1 111 111 GLY CA C 13 44.535 0.50 . 1 . . . A 253 GLY CA . 18826 1 1310 . 1 1 111 111 GLY N N 15 107.861 0.10 . 1 . . . A 253 GLY N . 18826 1 1311 . 1 1 112 112 PRO HA H 1 4.311 0.05 . 1 . . . A 254 PRO HA . 18826 1 1312 . 1 1 112 112 PRO HB2 H 1 1.753 0.05 . 2 . . . A 254 PRO HB2 . 18826 1 1313 . 1 1 112 112 PRO HB3 H 1 2.193 0.05 . 2 . . . A 254 PRO HB3 . 18826 1 1314 . 1 1 112 112 PRO HG2 H 1 1.903 0.05 . 2 . . . A 254 PRO HG2 . 18826 1 1315 . 1 1 112 112 PRO HG3 H 1 1.974 0.05 . 2 . . . A 254 PRO HG3 . 18826 1 1316 . 1 1 112 112 PRO HD2 H 1 3.540 0.05 . 2 . . . A 254 PRO HD2 . 18826 1 1317 . 1 1 112 112 PRO HD3 H 1 3.544 0.05 . 2 . . . A 254 PRO HD3 . 18826 1 1318 . 1 1 112 112 PRO C C 13 177.336 0.50 . 1 . . . A 254 PRO C . 18826 1 1319 . 1 1 112 112 PRO CA C 13 62.785 0.50 . 1 . . . A 254 PRO CA . 18826 1 1320 . 1 1 112 112 PRO CB C 13 31.821 0.50 . 1 . . . A 254 PRO CB . 18826 1 1321 . 1 1 112 112 PRO CG C 13 27.250 0.50 . 1 . . . A 254 PRO CG . 18826 1 1322 . 1 1 112 112 PRO CD C 13 49.115 0.50 . 1 . . . A 254 PRO CD . 18826 1 1323 . 1 1 113 113 LEU H H 1 8.323 0.05 . 1 . . . A 255 LEU H . 18826 1 1324 . 1 1 113 113 LEU HA H 1 4.620 0.05 . 1 . . . A 255 LEU HA . 18826 1 1325 . 1 1 113 113 LEU HB2 H 1 1.414 0.05 . 2 . . . A 255 LEU HB2 . 18826 1 1326 . 1 1 113 113 LEU HB3 H 1 1.617 0.05 . 2 . . . A 255 LEU HB3 . 18826 1 1327 . 1 1 113 113 LEU HG H 1 1.688 0.05 . 1 . . . A 255 LEU HG . 18826 1 1328 . 1 1 113 113 LEU HD11 H 1 1.141 0.05 . 2 . . . A 255 LEU HD11 . 18826 1 1329 . 1 1 113 113 LEU HD12 H 1 1.141 0.05 . 2 . . . A 255 LEU HD12 . 18826 1 1330 . 1 1 113 113 LEU HD13 H 1 1.141 0.05 . 2 . . . A 255 LEU HD13 . 18826 1 1331 . 1 1 113 113 LEU HD21 H 1 0.760 0.05 . 2 . . . A 255 LEU HD21 . 18826 1 1332 . 1 1 113 113 LEU HD22 H 1 0.760 0.05 . 2 . . . A 255 LEU HD22 . 18826 1 1333 . 1 1 113 113 LEU HD23 H 1 0.760 0.05 . 2 . . . A 255 LEU HD23 . 18826 1 1334 . 1 1 113 113 LEU CA C 13 52.194 0.50 . 1 . . . A 255 LEU CA . 18826 1 1335 . 1 1 113 113 LEU CB C 13 41.441 0.50 . 1 . . . A 255 LEU CB . 18826 1 1336 . 1 1 113 113 LEU CG C 13 27.198 0.50 . 1 . . . A 255 LEU CG . 18826 1 1337 . 1 1 113 113 LEU CD1 C 13 23.173 0.50 . 2 . . . A 255 LEU CD1 . 18826 1 1338 . 1 1 113 113 LEU CD2 C 13 25.690 0.50 . 2 . . . A 255 LEU CD2 . 18826 1 1339 . 1 1 113 113 LEU N N 15 123.654 0.10 . 1 . . . A 255 LEU N . 18826 1 1340 . 1 1 114 114 PRO HA H 1 4.459 0.05 . 1 . . . A 256 PRO HA . 18826 1 1341 . 1 1 114 114 PRO HB2 H 1 1.687 0.05 . 2 . . . A 256 PRO HB2 . 18826 1 1342 . 1 1 114 114 PRO HB3 H 1 2.126 0.05 . 2 . . . A 256 PRO HB3 . 18826 1 1343 . 1 1 114 114 PRO HG2 H 1 1.341 0.05 . 2 . . . A 256 PRO HG2 . 18826 1 1344 . 1 1 114 114 PRO HG3 H 1 1.451 0.05 . 2 . . . A 256 PRO HG3 . 18826 1 1345 . 1 1 114 114 PRO HD2 H 1 3.137 0.05 . 2 . . . A 256 PRO HD2 . 18826 1 1346 . 1 1 114 114 PRO HD3 H 1 3.416 0.05 . 2 . . . A 256 PRO HD3 . 18826 1 1347 . 1 1 114 114 PRO C C 13 172.792 0.50 . 1 . . . A 256 PRO C . 18826 1 1348 . 1 1 114 114 PRO CA C 13 61.817 0.50 . 1 . . . A 256 PRO CA . 18826 1 1349 . 1 1 114 114 PRO CB C 13 31.557 0.50 . 1 . . . A 256 PRO CB . 18826 1 1350 . 1 1 114 114 PRO CG C 13 26.141 0.50 . 1 . . . A 256 PRO CG . 18826 1 1351 . 1 1 114 114 PRO CD C 13 49.590 0.50 . 1 . . . A 256 PRO CD . 18826 1 1352 . 1 1 115 115 VAL H H 1 7.638 0.05 . 1 . . . A 257 VAL H . 18826 1 1353 . 1 1 115 115 VAL HA H 1 4.416 0.05 . 1 . . . A 257 VAL HA . 18826 1 1354 . 1 1 115 115 VAL HB H 1 1.824 0.05 . 1 . . . A 257 VAL HB . 18826 1 1355 . 1 1 115 115 VAL HG11 H 1 0.764 0.05 . 2 . . . A 257 VAL HG11 . 18826 1 1356 . 1 1 115 115 VAL HG12 H 1 0.764 0.05 . 2 . . . A 257 VAL HG12 . 18826 1 1357 . 1 1 115 115 VAL HG13 H 1 0.764 0.05 . 2 . . . A 257 VAL HG13 . 18826 1 1358 . 1 1 115 115 VAL HG21 H 1 0.817 0.05 . 2 . . . A 257 VAL HG21 . 18826 1 1359 . 1 1 115 115 VAL HG22 H 1 0.817 0.05 . 2 . . . A 257 VAL HG22 . 18826 1 1360 . 1 1 115 115 VAL HG23 H 1 0.817 0.05 . 2 . . . A 257 VAL HG23 . 18826 1 1361 . 1 1 115 115 VAL CA C 13 58.229 0.50 . 1 . . . A 257 VAL CA . 18826 1 1362 . 1 1 115 115 VAL CB C 13 33.091 0.50 . 1 . . . A 257 VAL CB . 18826 1 1363 . 1 1 115 115 VAL CG1 C 13 19.878 0.50 . 2 . . . A 257 VAL CG1 . 18826 1 1364 . 1 1 115 115 VAL CG2 C 13 20.648 0.50 . 2 . . . A 257 VAL CG2 . 18826 1 1365 . 1 1 115 115 VAL N N 15 114.359 0.10 . 1 . . . A 257 VAL N . 18826 1 1366 . 1 1 116 116 PRO HA H 1 3.951 0.05 . 1 . . . A 258 PRO HA . 18826 1 1367 . 1 1 116 116 PRO HB2 H 1 1.623 0.05 . 2 . . . A 258 PRO HB2 . 18826 1 1368 . 1 1 116 116 PRO HB3 H 1 1.853 0.05 . 2 . . . A 258 PRO HB3 . 18826 1 1369 . 1 1 116 116 PRO HD2 H 1 3.580 0.05 . 2 . . . A 258 PRO HD2 . 18826 1 1370 . 1 1 116 116 PRO HD3 H 1 3.580 0.05 . 2 . . . A 258 PRO HD3 . 18826 1 1371 . 1 1 116 116 PRO C C 13 175.961 0.50 . 1 . . . A 258 PRO C . 18826 1 1372 . 1 1 116 116 PRO CA C 13 63.310 0.50 . 1 . . . A 258 PRO CA . 18826 1 1373 . 1 1 116 116 PRO CB C 13 31.833 0.50 . 1 . . . A 258 PRO CB . 18826 1 1374 . 1 1 116 116 PRO CG C 13 26.683 0.50 . 1 . . . A 258 PRO CG . 18826 1 1375 . 1 1 116 116 PRO CD C 13 50.619 0.50 . 1 . . . A 258 PRO CD . 18826 1 1376 . 1 1 117 117 PHE H H 1 7.916 0.05 . 1 . . . A 259 PHE H . 18826 1 1377 . 1 1 117 117 PHE HA H 1 4.401 0.05 . 1 . . . A 259 PHE HA . 18826 1 1378 . 1 1 117 117 PHE HB2 H 1 2.937 0.05 . 2 . . . A 259 PHE HB2 . 18826 1 1379 . 1 1 117 117 PHE HB3 H 1 2.937 0.05 . 2 . . . A 259 PHE HB3 . 18826 1 1380 . 1 1 117 117 PHE HD1 H 1 7.125 0.05 . 3 . . . A 259 PHE HD1 . 18826 1 1381 . 1 1 117 117 PHE HD2 H 1 7.125 0.05 . 3 . . . A 259 PHE HD2 . 18826 1 1382 . 1 1 117 117 PHE HE1 H 1 7.265 0.05 . 3 . . . A 259 PHE HE1 . 18826 1 1383 . 1 1 117 117 PHE HE2 H 1 7.265 0.05 . 3 . . . A 259 PHE HE2 . 18826 1 1384 . 1 1 117 117 PHE C C 13 176.110 0.50 . 1 . . . A 259 PHE C . 18826 1 1385 . 1 1 117 117 PHE CA C 13 58.205 0.50 . 1 . . . A 259 PHE CA . 18826 1 1386 . 1 1 117 117 PHE CB C 13 39.420 0.50 . 1 . . . A 259 PHE CB . 18826 1 1387 . 1 1 117 117 PHE CD1 C 13 131.401 0.50 . 3 . . . A 259 PHE CD1 . 18826 1 1388 . 1 1 117 117 PHE N N 15 121.701 0.10 . 1 . . . A 259 PHE N . 18826 1 1389 . 1 1 118 118 THR H H 1 8.030 0.05 . 1 . . . A 260 THR H . 18826 1 1390 . 1 1 118 118 THR HA H 1 4.211 0.05 . 1 . . . A 260 THR HA . 18826 1 1391 . 1 1 118 118 THR HB H 1 4.051 0.05 . 1 . . . A 260 THR HB . 18826 1 1392 . 1 1 118 118 THR HG21 H 1 1.005 0.05 . 1 . . . A 260 THR HG21 . 18826 1 1393 . 1 1 118 118 THR HG22 H 1 1.005 0.05 . 1 . . . A 260 THR HG22 . 18826 1 1394 . 1 1 118 118 THR HG23 H 1 1.005 0.05 . 1 . . . A 260 THR HG23 . 18826 1 1395 . 1 1 118 118 THR C C 13 172.888 0.50 . 1 . . . A 260 THR C . 18826 1 1396 . 1 1 118 118 THR CA C 13 60.812 0.50 . 1 . . . A 260 THR CA . 18826 1 1397 . 1 1 118 118 THR CB C 13 69.906 0.50 . 1 . . . A 260 THR CB . 18826 1 1398 . 1 1 118 118 THR CG2 C 13 21.021 0.50 . 1 . . . A 260 THR CG2 . 18826 1 1399 . 1 1 118 118 THR N N 15 116.561 0.10 . 1 . . . A 260 THR N . 18826 1 1400 . 1 1 119 119 ASN H H 1 7.816 0.05 . 1 . . . A 261 ASN H . 18826 1 1401 . 1 1 119 119 ASN HA H 1 4.347 0.05 . 1 . . . A 261 ASN HA . 18826 1 1402 . 1 1 119 119 ASN HB2 H 1 2.603 0.05 . 2 . . . A 261 ASN HB2 . 18826 1 1403 . 1 1 119 119 ASN HB3 H 1 2.689 0.05 . 2 . . . A 261 ASN HB3 . 18826 1 1404 . 1 1 119 119 ASN HD21 H 1 6.836 0.05 . 2 . . . A 261 ASN HD21 . 18826 1 1405 . 1 1 119 119 ASN HD22 H 1 7.538 0.05 . 2 . . . A 261 ASN HD22 . 18826 1 1406 . 1 1 119 119 ASN C C 13 176.057 0.50 . 1 . . . A 261 ASN C . 18826 1 1407 . 1 1 119 119 ASN CA C 13 54.417 0.50 . 1 . . . A 261 ASN CA . 18826 1 1408 . 1 1 119 119 ASN CB C 13 40.457 0.50 . 1 . . . A 261 ASN CB . 18826 1 1409 . 1 1 119 119 ASN N N 15 125.472 0.10 . 1 . . . A 261 ASN N . 18826 1 1410 . 1 1 119 119 ASN ND2 N 15 112.979 0.10 . 1 . . . A 261 ASN ND2 . 18826 1 1411 . 1 1 120 120 GLY H H 1 8.257 0.05 . 1 . . . A 262 GLY H . 18826 1 1412 . 1 1 120 120 GLY HA2 H 1 3.799 0.05 . 2 . . . A 262 GLY HA2 . 18826 1 1413 . 1 1 120 120 GLY HA3 H 1 3.802 0.05 . 2 . . . A 262 GLY HA3 . 18826 1 1414 . 1 1 120 120 GLY C C 13 173.960 0.50 . 1 . . . A 262 GLY C . 18826 1 1415 . 1 1 120 120 GLY CA C 13 45.024 0.50 . 1 . . . A 262 GLY CA . 18826 1 1416 . 1 1 120 120 GLY N N 15 113.570 0.10 . 1 . . . A 262 GLY N . 18826 1 1417 . 1 1 121 121 GLU H H 1 8.114 0.05 . 1 . . . A 263 GLU H . 18826 1 1418 . 1 1 121 121 GLU HA H 1 4.159 0.05 . 1 . . . A 263 GLU HA . 18826 1 1419 . 1 1 121 121 GLU HB2 H 1 1.892 0.05 . 2 . . . A 263 GLU HB2 . 18826 1 1420 . 1 1 121 121 GLU HB3 H 1 1.814 0.05 . 2 . . . A 263 GLU HB3 . 18826 1 1421 . 1 1 121 121 GLU HG2 H 1 2.101 0.05 . 2 . . . A 263 GLU HG2 . 18826 1 1422 . 1 1 121 121 GLU HG3 H 1 2.101 0.05 . 2 . . . A 263 GLU HG3 . 18826 1 1423 . 1 1 121 121 GLU C C 13 176.537 0.50 . 1 . . . A 263 GLU C . 18826 1 1424 . 1 1 121 121 GLU CA C 13 56.225 0.50 . 1 . . . A 263 GLU CA . 18826 1 1425 . 1 1 121 121 GLU CB C 13 29.819 0.50 . 1 . . . A 263 GLU CB . 18826 1 1426 . 1 1 121 121 GLU CG C 13 36.120 0.50 . 1 . . . A 263 GLU CG . 18826 1 1427 . 1 1 121 121 GLU N N 15 120.423 0.10 . 1 . . . A 263 GLU N . 18826 1 1428 . 1 1 122 122 ILE H H 1 8.135 0.05 . 1 . . . A 264 ILE H . 18826 1 1429 . 1 1 122 122 ILE HA H 1 3.968 0.05 . 1 . . . A 264 ILE HA . 18826 1 1430 . 1 1 122 122 ILE HB H 1 1.709 0.05 . 1 . . . A 264 ILE HB . 18826 1 1431 . 1 1 122 122 ILE HG12 H 1 1.056 0.05 . 2 . . . A 264 ILE HG12 . 18826 1 1432 . 1 1 122 122 ILE HG13 H 1 1.356 0.05 . 2 . . . A 264 ILE HG13 . 18826 1 1433 . 1 1 122 122 ILE HG21 H 1 0.739 0.05 . 1 . . . A 264 ILE HG21 . 18826 1 1434 . 1 1 122 122 ILE HG22 H 1 0.739 0.05 . 1 . . . A 264 ILE HG22 . 18826 1 1435 . 1 1 122 122 ILE HG23 H 1 0.739 0.05 . 1 . . . A 264 ILE HG23 . 18826 1 1436 . 1 1 122 122 ILE HD11 H 1 0.724 0.05 . 1 . . . A 264 ILE HD11 . 18826 1 1437 . 1 1 122 122 ILE HD12 H 1 0.724 0.05 . 1 . . . A 264 ILE HD12 . 18826 1 1438 . 1 1 122 122 ILE HD13 H 1 0.724 0.05 . 1 . . . A 264 ILE HD13 . 18826 1 1439 . 1 1 122 122 ILE C C 13 176.265 0.50 . 1 . . . A 264 ILE C . 18826 1 1440 . 1 1 122 122 ILE CA C 13 60.834 0.50 . 1 . . . A 264 ILE CA . 18826 1 1441 . 1 1 122 122 ILE CB C 13 38.159 0.50 . 1 . . . A 264 ILE CB . 18826 1 1442 . 1 1 122 122 ILE CG1 C 13 27.174 0.50 . 1 . . . A 264 ILE CG1 . 18826 1 1443 . 1 1 122 122 ILE CG2 C 13 17.324 0.50 . 1 . . . A 264 ILE CG2 . 18826 1 1444 . 1 1 122 122 ILE CD1 C 13 12.764 0.50 . 1 . . . A 264 ILE CD1 . 18826 1 1445 . 1 1 122 122 ILE N N 15 122.115 0.10 . 1 . . . A 264 ILE N . 18826 1 1446 . 1 1 123 123 GLN H H 1 8.388 0.05 . 1 . . . A 265 GLN H . 18826 1 1447 . 1 1 123 123 GLN HA H 1 4.190 0.05 . 1 . . . A 265 GLN HA . 18826 1 1448 . 1 1 123 123 GLN HB2 H 1 1.847 0.05 . 2 . . . A 265 GLN HB2 . 18826 1 1449 . 1 1 123 123 GLN HB3 H 1 1.959 0.05 . 2 . . . A 265 GLN HB3 . 18826 1 1450 . 1 1 123 123 GLN HG2 H 1 2.235 0.05 . 2 . . . A 265 GLN HG2 . 18826 1 1451 . 1 1 123 123 GLN HG3 H 1 2.235 0.05 . 2 . . . A 265 GLN HG3 . 18826 1 1452 . 1 1 123 123 GLN HE21 H 1 6.781 0.05 . 2 . . . A 265 GLN HE21 . 18826 1 1453 . 1 1 123 123 GLN HE22 H 1 7.448 0.05 . 2 . . . A 265 GLN HE22 . 18826 1 1454 . 1 1 123 123 GLN C C 13 175.769 0.50 . 1 . . . A 265 GLN C . 18826 1 1455 . 1 1 123 123 GLN CA C 13 55.682 0.50 . 1 . . . A 265 GLN CA . 18826 1 1456 . 1 1 123 123 GLN CB C 13 29.021 0.50 . 1 . . . A 265 GLN CB . 18826 1 1457 . 1 1 123 123 GLN CG C 13 33.420 0.50 . 1 . . . A 265 GLN CG . 18826 1 1458 . 1 1 123 123 GLN N N 15 124.723 0.10 . 1 . . . A 265 GLN N . 18826 1 1459 . 1 1 123 123 GLN NE2 N 15 112.650 0.10 . 1 . . . A 265 GLN NE2 . 18826 1 1460 . 1 1 124 124 LYS H H 1 8.317 0.05 . 1 . . . A 266 LYS H . 18826 1 1461 . 1 1 124 124 LYS HA H 1 4.154 0.05 . 1 . . . A 266 LYS HA . 18826 1 1462 . 1 1 124 124 LYS HB2 H 1 1.712 0.05 . 2 . . . A 266 LYS HB2 . 18826 1 1463 . 1 1 124 124 LYS HB3 H 1 1.643 0.05 . 2 . . . A 266 LYS HB3 . 18826 1 1464 . 1 1 124 124 LYS HG2 H 1 1.291 0.05 . 2 . . . A 266 LYS HG2 . 18826 1 1465 . 1 1 124 124 LYS HG3 H 1 1.332 0.05 . 2 . . . A 266 LYS HG3 . 18826 1 1466 . 1 1 124 124 LYS HD3 H 1 1.714 0.05 . 2 . . . A 266 LYS HD3 . 18826 1 1467 . 1 1 124 124 LYS HE2 H 1 2.880 0.05 . 2 . . . A 266 LYS HE2 . 18826 1 1468 . 1 1 124 124 LYS HE3 H 1 2.880 0.05 . 2 . . . A 266 LYS HE3 . 18826 1 1469 . 1 1 124 124 LYS C C 13 176.601 0.50 . 1 . . . A 266 LYS C . 18826 1 1470 . 1 1 124 124 LYS CA C 13 56.251 0.50 . 1 . . . A 266 LYS CA . 18826 1 1471 . 1 1 124 124 LYS CB C 13 32.843 0.50 . 1 . . . A 266 LYS CB . 18826 1 1472 . 1 1 124 124 LYS CG C 13 24.842 0.50 . 1 . . . A 266 LYS CG . 18826 1 1473 . 1 1 124 124 LYS CE C 13 41.980 0.50 . 1 . . . A 266 LYS CE . 18826 1 1474 . 1 1 124 124 LYS N N 15 123.366 0.10 . 1 . . . A 266 LYS N . 18826 1 1475 . 1 1 125 125 GLU H H 1 8.437 0.05 . 1 . . . A 267 GLU H . 18826 1 1476 . 1 1 125 125 GLU HA H 1 4.145 0.05 . 1 . . . A 267 GLU HA . 18826 1 1477 . 1 1 125 125 GLU HB2 H 1 1.829 0.05 . 2 . . . A 267 GLU HB2 . 18826 1 1478 . 1 1 125 125 GLU HB3 H 1 1.934 0.05 . 2 . . . A 267 GLU HB3 . 18826 1 1479 . 1 1 125 125 GLU HG2 H 1 2.179 0.05 . 2 . . . A 267 GLU HG2 . 18826 1 1480 . 1 1 125 125 GLU HG3 H 1 2.179 0.05 . 2 . . . A 267 GLU HG3 . 18826 1 1481 . 1 1 125 125 GLU C C 13 176.185 0.50 . 1 . . . A 267 GLU C . 18826 1 1482 . 1 1 125 125 GLU CA C 13 56.225 0.50 . 1 . . . A 267 GLU CA . 18826 1 1483 . 1 1 125 125 GLU CB C 13 29.584 0.50 . 1 . . . A 267 GLU CB . 18826 1 1484 . 1 1 125 125 GLU CG C 13 35.479 0.50 . 1 . . . A 267 GLU CG . 18826 1 1485 . 1 1 125 125 GLU N N 15 121.772 0.10 . 1 . . . A 267 GLU N . 18826 1 1486 . 1 1 126 126 ASN H H 1 8.446 0.05 . 1 . . . A 268 ASN H . 18826 1 1487 . 1 1 126 126 ASN HA H 1 4.615 0.05 . 1 . . . A 268 ASN HA . 18826 1 1488 . 1 1 126 126 ASN HB2 H 1 2.650 0.05 . 2 . . . A 268 ASN HB2 . 18826 1 1489 . 1 1 126 126 ASN HB3 H 1 2.746 0.05 . 2 . . . A 268 ASN HB3 . 18826 1 1490 . 1 1 126 126 ASN HD21 H 1 6.870 0.05 . 2 . . . A 268 ASN HD21 . 18826 1 1491 . 1 1 126 126 ASN HD22 H 1 7.564 0.05 . 2 . . . A 268 ASN HD22 . 18826 1 1492 . 1 1 126 126 ASN C C 13 174.953 0.50 . 1 . . . A 268 ASN C . 18826 1 1493 . 1 1 126 126 ASN CA C 13 53.130 0.50 . 1 . . . A 268 ASN CA . 18826 1 1494 . 1 1 126 126 ASN CB C 13 38.452 0.50 . 1 . . . A 268 ASN CB . 18826 1 1495 . 1 1 126 126 ASN N N 15 119.545 0.10 . 1 . . . A 268 ASN N . 18826 1 1496 . 1 1 126 126 ASN ND2 N 15 112.538 0.10 . 1 . . . A 268 ASN ND2 . 18826 1 1497 . 1 1 127 127 SER H H 1 8.173 0.05 . 1 . . . A 269 SER H . 18826 1 1498 . 1 1 127 127 SER HA H 1 4.329 0.05 . 1 . . . A 269 SER HA . 18826 1 1499 . 1 1 127 127 SER HB2 H 1 3.764 0.05 . 2 . . . A 269 SER HB2 . 18826 1 1500 . 1 1 127 127 SER HB3 H 1 3.764 0.05 . 2 . . . A 269 SER HB3 . 18826 1 1501 . 1 1 127 127 SER C C 13 173.400 0.50 . 1 . . . A 269 SER C . 18826 1 1502 . 1 1 127 127 SER CA C 13 58.357 0.50 . 1 . . . A 269 SER CA . 18826 1 1503 . 1 1 127 127 SER CB C 13 63.561 0.50 . 1 . . . A 269 SER CB . 18826 1 1504 . 1 1 127 127 SER N N 15 116.287 0.10 . 1 . . . A 269 SER N . 18826 1 1505 . 1 1 128 128 ARG H H 1 7.915 0.05 . 1 . . . A 270 ARG H . 18826 1 1506 . 1 1 128 128 ARG HB2 H 1 1.605 0.05 . 2 . . . A 270 ARG HB2 . 18826 1 1507 . 1 1 128 128 ARG HB3 H 1 1.737 0.05 . 2 . . . A 270 ARG HB3 . 18826 1 1508 . 1 1 128 128 ARG CA C 13 57.489 0.50 . 1 . . . A 270 ARG CA . 18826 1 1509 . 1 1 128 128 ARG CB C 13 31.127 0.50 . 1 . . . A 270 ARG CB . 18826 1 1510 . 1 1 128 128 ARG N N 15 127.502 0.10 . 1 . . . A 270 ARG N . 18826 1 1511 . 2 2 1 1 GLN HE21 H 1 7.357 0.05 . 2 . . . . 271 GLN HE21 . 18826 1 1512 . 2 2 1 1 GLN HE22 H 1 7.507 0.05 . 2 . . . . 271 GLN HE22 . 18826 1 1513 . 2 2 2 2 ASP H H 1 8.667 0.05 . 1 . . . . 272 ASP H . 18826 1 1514 . 2 2 2 2 ASP HA H 1 3.947 0.05 . 1 . . . . 272 ASP HA . 18826 1 1515 . 2 2 2 2 ASP HB2 H 1 2.407 0.05 . 2 . . . . 272 ASP HB2 . 18826 1 1516 . 2 2 2 2 ASP HB3 H 1 2.727 0.05 . 2 . . . . 272 ASP HB3 . 18826 1 1517 . 2 2 3 3 THR H H 1 9.200 0.05 . 1 . . . . 273 THR H . 18826 1 1518 . 2 2 3 3 THR HA H 1 6.000 0.05 . 1 . . . . 273 THR HA . 18826 1 1519 . 2 2 3 3 THR HB H 1 4.617 0.05 . 1 . . . . 273 THR HB . 18826 1 1520 . 2 2 3 3 THR HG21 H 1 1.156 0.05 . 1 . . . . 273 THR HG2 . 18826 1 1521 . 2 2 3 3 THR HG22 H 1 1.156 0.05 . 1 . . . . 273 THR HG2 . 18826 1 1522 . 2 2 3 3 THR HG23 H 1 1.156 0.05 . 1 . . . . 273 THR HG2 . 18826 1 1523 . 2 2 4 4 ARG H H 1 8.703 0.05 . 1 . . . . 274 ARG H . 18826 1 1524 . 2 2 4 4 ARG HA H 1 4.230 0.05 . 1 . . . . 274 ARG HA . 18826 1 1525 . 2 2 4 4 ARG HB2 H 1 1.661 0.05 . 2 . . . . 274 ARG HB2 . 18826 1 1526 . 2 2 4 4 ARG HB3 H 1 1.757 0.05 . 2 . . . . 274 ARG HB3 . 18826 1 1527 . 2 2 4 4 ARG HG2 H 1 1.367 0.05 . 2 . . . . 274 ARG HG2 . 18826 1 1528 . 2 2 5 5 LEU H H 1 8.638 0.05 . 1 . . . . 275 LEU H . 18826 1 1529 . 2 2 5 5 LEU HA H 1 4.307 0.05 . 1 . . . . 275 LEU HA . 18826 1 1530 . 2 2 5 5 LEU HB2 H 1 1.457 0.05 . 2 . . . . 275 LEU HB2 . 18826 1 1531 . 2 2 5 5 LEU HB3 H 1 1.234 0.05 . 2 . . . . 275 LEU HB3 . 18826 1 1532 . 2 2 5 5 LEU HD11 H 1 0.318 0.05 . 2 . . . . 275 LEU HD1 . 18826 1 1533 . 2 2 5 5 LEU HD12 H 1 0.318 0.05 . 2 . . . . 275 LEU HD1 . 18826 1 1534 . 2 2 5 5 LEU HD13 H 1 0.318 0.05 . 2 . . . . 275 LEU HD1 . 18826 1 stop_ save_