data_11457 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11457 _Entry.Title ; Solution structure of the second dsRBD from RNA helicase A ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-11-29 _Entry.Accession_date 2011-11-30 _Entry.Last_release_date 2012-08-29 _Entry.Original_release_date 2012-08-29 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1.1.21 _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 Takashi Nagata . . . 11457 2 Yutaka Muto . . . 11457 3 Kengo Tsuda . . . 11457 4 Makoto Inoue . . . 11457 5 Takanori Kigawa . . . 11457 6 Takaho Terada . . . 11457 7 Mikako Shirouzu . . . 11457 8 Shigeyuki Yokoyama . . . 11457 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 'NPPSFA, National Project on Protein Structural and Functional Analyses' 'RIKEN Structural Genomics/Proteomics Initiative' . 11457 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'double-stranded RNA binding domain' . 11457 dsRBD . 11457 dsrm . 11457 Protein . 11457 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11457 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 485 11457 '15N chemical shifts' 122 11457 '1H chemical shifts' 771 11457 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2012-08-29 2011-11-29 original author . 11457 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1uil . 11457 PDB 2RS7 'BMRB Entry Tracking System' 11457 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 11457 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22454253 _Citation.Full_citation . _Citation.Title 'Solution structures of the double-stranded RNA-binding domains from RNA helicase A' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Proteins _Citation.Journal_name_full . _Citation.Journal_volume 80 _Citation.Journal_issue 6 _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 1699 _Citation.Page_last 1706 _Citation.Year 2012 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Takashi Nagata . . . 11457 1 2 Kengo Tsuda . . . 11457 1 3 Naohiro Kobayashi . . . 11457 1 4 Mikako Shirouzu . . . 11457 1 5 Takanori Kigawa . . . 11457 1 6 Peter Guntert . . . 11457 1 7 Shigeyuki Yokoyama . . . 11457 1 8 Yutaka Muto . . . 11457 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11457 _Assembly.ID 1 _Assembly.Name 'Solution structure of the second dsRBD' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'second dsRBD' 1 $entity A . yes native no no . . . 11457 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 11457 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity _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 ; GSSGSSGLESEEVDLNAGLH GNWTLENAKARLNQYFQKEK IQGEYKYTQVGPDHNRSFIA EMTIYIKQLGRRIFAREHGS NKKLAAQSCALSLVRQLYHL GVIEAYSSGPSSG ; _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 113 _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 12507.041 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1UIL . "Double-Stranded Rna-Binding Motif Of Hypothetical Protein Bab28848" . . . . . 100.00 113 100.00 100.00 6.98e-76 . . . . 11457 1 2 no PDB 2RS7 . "Solution Structure Of The Second Dsrbd From Rna Helicase A" . . . . . 100.00 113 100.00 100.00 6.98e-76 . . . . 11457 1 3 no PDB 3VYX . "Structural Insights Into Risc Assembly Facilitated By Dsrna Binding Domains Of Human Rna Helicase (dhx9)" . . . . . 88.50 114 99.00 100.00 8.16e-67 . . . . 11457 1 4 no DBJ BAB28848 . "unnamed protein product [Mus musculus]" . . . . . 88.50 265 99.00 99.00 6.55e-64 . . . . 11457 1 5 no DBJ BAE24846 . "unnamed protein product [Mus musculus]" . . . . . 88.50 735 100.00 100.00 9.86e-62 . . . . 11457 1 6 no DBJ BAE88384 . "unnamed protein product [Macaca fascicularis]" . . . . . 88.50 437 98.00 99.00 2.44e-62 . . . . 11457 1 7 no DBJ BAH90798 . "DEAH (Asp-Glu-Ala-His) box polypeptide 9, partial [synthetic construct]" . . . . . 88.50 1270 99.00 100.00 1.40e-59 . . . . 11457 1 8 no EMBL CAA58036 . "nuclear DNA helicase II [Bos taurus]" . . . . . 88.50 1287 98.00 99.00 8.51e-59 . . . . 11457 1 9 no EMBL CAA71668 . "nuclear DNA helicase II [Homo sapiens]" . . . . . 88.50 1270 99.00 100.00 1.29e-59 . . . . 11457 1 10 no EMBL CAH92036 . "hypothetical protein [Pongo abelii]" . . . . . 88.50 1269 99.00 100.00 1.40e-59 . . . . 11457 1 11 no GB AAB48855 . "RNA helicase A [Homo sapiens]" . . . . . 88.50 1279 97.00 99.00 4.29e-58 . . . . 11457 1 12 no GB AAC05725 . "RNA helicase A [Mus musculus]" . . . . . 88.50 1380 97.00 97.00 1.24e-57 . . . . 11457 1 13 no GB AAH08773 . "DHX9 protein, partial [Homo sapiens]" . . . . . 88.50 596 99.00 100.00 1.57e-61 . . . . 11457 1 14 no GB AAH14246 . "DHX9 protein, partial [Homo sapiens]" . . . . . 88.50 599 99.00 100.00 2.05e-61 . . . . 11457 1 15 no GB AAH25245 . "DHX9 protein, partial [Homo sapiens]" . . . . . 88.50 593 99.00 100.00 1.50e-61 . . . . 11457 1 16 no PIR A47363 . "RNA helicase A - human" . . . . . 88.50 1279 97.00 99.00 3.29e-58 . . . . 11457 1 17 no REF NP_001100654 . "ATP-dependent RNA helicase A [Rattus norvegicus]" . . . . . 88.50 1174 100.00 100.00 2.26e-61 . . . . 11457 1 18 no REF NP_001253117 . "ATP-dependent RNA helicase A [Macaca mulatta]" . . . . . 88.50 1275 99.00 100.00 1.60e-59 . . . . 11457 1 19 no REF NP_001348 . "ATP-dependent RNA helicase A [Homo sapiens]" . . . . . 88.50 1270 99.00 100.00 1.40e-59 . . . . 11457 1 20 no REF NP_031868 . "ATP-dependent RNA helicase A [Mus musculus]" . . . . . 88.50 1383 100.00 100.00 1.38e-59 . . . . 11457 1 21 no REF NP_776461 . "ATP-dependent RNA helicase A [Bos taurus]" . . . . . 88.50 1287 98.00 99.00 8.51e-59 . . . . 11457 1 22 no SP O70133 . "RecName: Full=ATP-dependent RNA helicase A; Short=RHA; AltName: Full=DEAH box protein 9; Short=mHEL-5; AltName: Full=Nuclear DN" . . . . . 88.50 1380 100.00 100.00 1.48e-59 . . . . 11457 1 23 no SP Q08211 . "RecName: Full=ATP-dependent RNA helicase A; Short=RHA; AltName: Full=DEAH box protein 9; AltName: Full=Leukophysin; Short=LKP; " . . . . . 88.50 1270 99.00 100.00 1.40e-59 . . . . 11457 1 24 no SP Q28141 . "RecName: Full=ATP-dependent RNA helicase A; Short=RHA; AltName: Full=DEAH box protein 9; AltName: Full=Nuclear DNA helicase II;" . . . . . 88.50 1287 98.00 99.00 8.51e-59 . . . . 11457 1 25 no SP Q5R874 . "RecName: Full=ATP-dependent RNA helicase A; Short=RHA; AltName: Full=DEAH box protein 9; AltName: Full=Nuclear DNA helicase II;" . . . . . 88.50 1269 99.00 100.00 1.40e-59 . . . . 11457 1 26 no TPG DAA21040 . "TPA: ATP-dependent RNA helicase A [Bos taurus]" . . . . . 88.50 1287 98.00 99.00 8.51e-59 . . . . 11457 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 1 156 GLY . 11457 1 2 157 SER . 11457 1 3 158 SER . 11457 1 4 159 GLY . 11457 1 5 160 SER . 11457 1 6 161 SER . 11457 1 7 162 GLY . 11457 1 8 163 LEU . 11457 1 9 164 GLU . 11457 1 10 165 SER . 11457 1 11 166 GLU . 11457 1 12 167 GLU . 11457 1 13 168 VAL . 11457 1 14 169 ASP . 11457 1 15 170 LEU . 11457 1 16 171 ASN . 11457 1 17 172 ALA . 11457 1 18 173 GLY . 11457 1 19 174 LEU . 11457 1 20 175 HIS . 11457 1 21 176 GLY . 11457 1 22 177 ASN . 11457 1 23 178 TRP . 11457 1 24 179 THR . 11457 1 25 180 LEU . 11457 1 26 181 GLU . 11457 1 27 182 ASN . 11457 1 28 183 ALA . 11457 1 29 184 LYS . 11457 1 30 185 ALA . 11457 1 31 186 ARG . 11457 1 32 187 LEU . 11457 1 33 188 ASN . 11457 1 34 189 GLN . 11457 1 35 190 TYR . 11457 1 36 191 PHE . 11457 1 37 192 GLN . 11457 1 38 193 LYS . 11457 1 39 194 GLU . 11457 1 40 195 LYS . 11457 1 41 196 ILE . 11457 1 42 197 GLN . 11457 1 43 198 GLY . 11457 1 44 199 GLU . 11457 1 45 200 TYR . 11457 1 46 201 LYS . 11457 1 47 202 TYR . 11457 1 48 203 THR . 11457 1 49 204 GLN . 11457 1 50 205 VAL . 11457 1 51 206 GLY . 11457 1 52 207 PRO . 11457 1 53 208 ASP . 11457 1 54 209 HIS . 11457 1 55 210 ASN . 11457 1 56 211 ARG . 11457 1 57 212 SER . 11457 1 58 213 PHE . 11457 1 59 214 ILE . 11457 1 60 215 ALA . 11457 1 61 216 GLU . 11457 1 62 217 MET . 11457 1 63 218 THR . 11457 1 64 219 ILE . 11457 1 65 220 TYR . 11457 1 66 221 ILE . 11457 1 67 222 LYS . 11457 1 68 223 GLN . 11457 1 69 224 LEU . 11457 1 70 225 GLY . 11457 1 71 226 ARG . 11457 1 72 227 ARG . 11457 1 73 228 ILE . 11457 1 74 229 PHE . 11457 1 75 230 ALA . 11457 1 76 231 ARG . 11457 1 77 232 GLU . 11457 1 78 233 HIS . 11457 1 79 234 GLY . 11457 1 80 235 SER . 11457 1 81 236 ASN . 11457 1 82 237 LYS . 11457 1 83 238 LYS . 11457 1 84 239 LEU . 11457 1 85 240 ALA . 11457 1 86 241 ALA . 11457 1 87 242 GLN . 11457 1 88 243 SER . 11457 1 89 244 CYS . 11457 1 90 245 ALA . 11457 1 91 246 LEU . 11457 1 92 247 SER . 11457 1 93 248 LEU . 11457 1 94 249 VAL . 11457 1 95 250 ARG . 11457 1 96 251 GLN . 11457 1 97 252 LEU . 11457 1 98 253 TYR . 11457 1 99 254 HIS . 11457 1 100 255 LEU . 11457 1 101 256 GLY . 11457 1 102 257 VAL . 11457 1 103 258 ILE . 11457 1 104 259 GLU . 11457 1 105 260 ALA . 11457 1 106 261 TYR . 11457 1 107 262 SER . 11457 1 108 263 SER . 11457 1 109 264 GLY . 11457 1 110 265 PRO . 11457 1 111 266 SER . 11457 1 112 267 SER . 11457 1 113 268 GLY . 11457 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 11457 1 . SER 2 2 11457 1 . SER 3 3 11457 1 . GLY 4 4 11457 1 . SER 5 5 11457 1 . SER 6 6 11457 1 . GLY 7 7 11457 1 . LEU 8 8 11457 1 . GLU 9 9 11457 1 . SER 10 10 11457 1 . GLU 11 11 11457 1 . GLU 12 12 11457 1 . VAL 13 13 11457 1 . ASP 14 14 11457 1 . LEU 15 15 11457 1 . ASN 16 16 11457 1 . ALA 17 17 11457 1 . GLY 18 18 11457 1 . LEU 19 19 11457 1 . HIS 20 20 11457 1 . GLY 21 21 11457 1 . ASN 22 22 11457 1 . TRP 23 23 11457 1 . THR 24 24 11457 1 . LEU 25 25 11457 1 . GLU 26 26 11457 1 . ASN 27 27 11457 1 . ALA 28 28 11457 1 . LYS 29 29 11457 1 . ALA 30 30 11457 1 . ARG 31 31 11457 1 . LEU 32 32 11457 1 . ASN 33 33 11457 1 . GLN 34 34 11457 1 . TYR 35 35 11457 1 . PHE 36 36 11457 1 . GLN 37 37 11457 1 . LYS 38 38 11457 1 . GLU 39 39 11457 1 . LYS 40 40 11457 1 . ILE 41 41 11457 1 . GLN 42 42 11457 1 . GLY 43 43 11457 1 . GLU 44 44 11457 1 . TYR 45 45 11457 1 . LYS 46 46 11457 1 . TYR 47 47 11457 1 . THR 48 48 11457 1 . GLN 49 49 11457 1 . VAL 50 50 11457 1 . GLY 51 51 11457 1 . PRO 52 52 11457 1 . ASP 53 53 11457 1 . HIS 54 54 11457 1 . ASN 55 55 11457 1 . ARG 56 56 11457 1 . SER 57 57 11457 1 . PHE 58 58 11457 1 . ILE 59 59 11457 1 . ALA 60 60 11457 1 . GLU 61 61 11457 1 . MET 62 62 11457 1 . THR 63 63 11457 1 . ILE 64 64 11457 1 . TYR 65 65 11457 1 . ILE 66 66 11457 1 . LYS 67 67 11457 1 . GLN 68 68 11457 1 . LEU 69 69 11457 1 . GLY 70 70 11457 1 . ARG 71 71 11457 1 . ARG 72 72 11457 1 . ILE 73 73 11457 1 . PHE 74 74 11457 1 . ALA 75 75 11457 1 . ARG 76 76 11457 1 . GLU 77 77 11457 1 . HIS 78 78 11457 1 . GLY 79 79 11457 1 . SER 80 80 11457 1 . ASN 81 81 11457 1 . LYS 82 82 11457 1 . LYS 83 83 11457 1 . LEU 84 84 11457 1 . ALA 85 85 11457 1 . ALA 86 86 11457 1 . GLN 87 87 11457 1 . SER 88 88 11457 1 . CYS 89 89 11457 1 . ALA 90 90 11457 1 . LEU 91 91 11457 1 . SER 92 92 11457 1 . LEU 93 93 11457 1 . VAL 94 94 11457 1 . ARG 95 95 11457 1 . GLN 96 96 11457 1 . LEU 97 97 11457 1 . TYR 98 98 11457 1 . HIS 99 99 11457 1 . LEU 100 100 11457 1 . GLY 101 101 11457 1 . VAL 102 102 11457 1 . ILE 103 103 11457 1 . GLU 104 104 11457 1 . ALA 105 105 11457 1 . TYR 106 106 11457 1 . SER 107 107 11457 1 . SER 108 108 11457 1 . GLY 109 109 11457 1 . PRO 110 110 11457 1 . SER 111 111 11457 1 . SER 112 112 11457 1 . GLY 113 113 11457 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 11457 _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 $entity . 10090 organism . 'Mus musculus' Mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 11457 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 11457 _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 $entity . 'recombinant technology' 'E. coli - cell free' 'E. coli' . 562 Eschrichia Coli . . . . . . . . . . . . . . . . 'not applicable' . . . . . . 11457 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11457 _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 entity '[U-100% 13C; U-100% 15N]' . . 1 $entity . protein 1.16 . . mM . . . . 11457 1 2 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 11457 1 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 11457 1 4 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 11457 1 5 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 11457 1 6 H2O . . . . . . solvent 90 . . % . . . . 11457 1 7 D2O . . . . . . solvent 10 . . % . . . . 11457 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 11457 _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' 120 . mM 11457 1 pH 6.0 . pH 11457 1 pressure 1 . atm 11457 1 temperature 298.15 . K 11457 1 stop_ save_ ############################ # Computer software used # ############################ save_AMBER _Software.Sf_category software _Software.Sf_framecode AMBER _Software.Entry_ID 11457 _Software.ID 1 _Software.Name AMBER _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollm' . . 11457 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11457 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 11457 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 11457 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 11457 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 11457 _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 . 800 . . . 11457 1 2 spectrometer_2 Bruker Avance . 700 . . . 11457 1 3 spectrometer_3 Bruker Avance . 600 . . . 11457 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 11457 _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 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11457 1 2 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11457 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 11457 _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 water protons . . . . ppm 0 internal indirect 0.251449530 . . . . . . . . . 11457 1 H 1 water protons . . . . ppm 4.784 internal indirect 1.0 . . . . . . . . . 11457 1 N 15 water protons . . . . ppm 0 internal indirect 0.101329118 . . . . . . . . . 11457 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 11457 _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 '3D 1H-13C NOESY' . . . 11457 1 2 '3D 1H-15N NOESY' . . . 11457 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 4 4 GLY HA2 H 1 3.989 0.03 . 1 . . . A 159 GLY HA2 . 11457 1 2 . 1 1 4 4 GLY HA3 H 1 3.989 0.03 . 1 . . . A 159 GLY HA3 . 11457 1 3 . 1 1 4 4 GLY C C 13 174.296 0.3 . 1 . . . A 159 GLY C . 11457 1 4 . 1 1 4 4 GLY CA C 13 45.359 0.3 . 1 . . . A 159 GLY CA . 11457 1 5 . 1 1 5 5 SER H H 1 8.258 0.03 . 1 . . . A 160 SER H . 11457 1 6 . 1 1 5 5 SER HA H 1 4.496 0.03 . 1 . . . A 160 SER HA . 11457 1 7 . 1 1 5 5 SER HB2 H 1 3.847 0.03 . 1 . . . A 160 SER HB2 . 11457 1 8 . 1 1 5 5 SER HB3 H 1 3.847 0.03 . 1 . . . A 160 SER HB3 . 11457 1 9 . 1 1 5 5 SER C C 13 174.808 0.3 . 1 . . . A 160 SER C . 11457 1 10 . 1 1 5 5 SER CA C 13 58.306 0.3 . 1 . . . A 160 SER CA . 11457 1 11 . 1 1 5 5 SER CB C 13 63.904 0.3 . 1 . . . A 160 SER CB . 11457 1 12 . 1 1 5 5 SER N N 15 115.715 0.3 . 1 . . . A 160 SER N . 11457 1 13 . 1 1 6 6 SER H H 1 8.506 0.03 . 1 . . . A 161 SER H . 11457 1 14 . 1 1 6 6 SER HA H 1 4.465 0.03 . 1 . . . A 161 SER HA . 11457 1 15 . 1 1 6 6 SER HB2 H 1 3.877 0.03 . 1 . . . A 161 SER HB2 . 11457 1 16 . 1 1 6 6 SER HB3 H 1 3.877 0.03 . 1 . . . A 161 SER HB3 . 11457 1 17 . 1 1 6 6 SER C C 13 174.992 0.3 . 1 . . . A 161 SER C . 11457 1 18 . 1 1 6 6 SER CA C 13 58.691 0.3 . 1 . . . A 161 SER CA . 11457 1 19 . 1 1 6 6 SER CB C 13 63.95 0.3 . 1 . . . A 161 SER CB . 11457 1 20 . 1 1 6 6 SER N N 15 117.989 0.3 . 1 . . . A 161 SER N . 11457 1 21 . 1 1 7 7 GLY H H 1 8.446 0.03 . 1 . . . A 162 GLY H . 11457 1 22 . 1 1 7 7 GLY HA2 H 1 3.985 0.03 . 2 . . . A 162 GLY HA2 . 11457 1 23 . 1 1 7 7 GLY HA3 H 1 3.955 0.03 . 2 . . . A 162 GLY HA3 . 11457 1 24 . 1 1 7 7 GLY C C 13 174.166 0.3 . 1 . . . A 162 GLY C . 11457 1 25 . 1 1 7 7 GLY CA C 13 45.385 0.3 . 1 . . . A 162 GLY CA . 11457 1 26 . 1 1 7 7 GLY N N 15 110.864 0.3 . 1 . . . A 162 GLY N . 11457 1 27 . 1 1 8 8 LEU H H 1 8.133 0.03 . 1 . . . A 163 LEU H . 11457 1 28 . 1 1 8 8 LEU HA H 1 4.342 0.03 . 1 . . . A 163 LEU HA . 11457 1 29 . 1 1 8 8 LEU HB2 H 1 1.574 0.03 . 1 . . . A 163 LEU HB2 . 11457 1 30 . 1 1 8 8 LEU HB3 H 1 1.574 0.03 . 1 . . . A 163 LEU HB3 . 11457 1 31 . 1 1 8 8 LEU HG H 1 1.571 0.03 . 1 . . . A 163 LEU HG . 11457 1 32 . 1 1 8 8 LEU HD11 H 1 0.834 0.03 . 1 . . . A 163 LEU HD11 . 11457 1 33 . 1 1 8 8 LEU HD12 H 1 0.834 0.03 . 1 . . . A 163 LEU HD12 . 11457 1 34 . 1 1 8 8 LEU HD13 H 1 0.834 0.03 . 1 . . . A 163 LEU HD13 . 11457 1 35 . 1 1 8 8 LEU HD21 H 1 0.886 0.03 . 1 . . . A 163 LEU HD21 . 11457 1 36 . 1 1 8 8 LEU HD22 H 1 0.886 0.03 . 1 . . . A 163 LEU HD22 . 11457 1 37 . 1 1 8 8 LEU HD23 H 1 0.886 0.03 . 1 . . . A 163 LEU HD23 . 11457 1 38 . 1 1 8 8 LEU C C 13 177.675 0.3 . 1 . . . A 163 LEU C . 11457 1 39 . 1 1 8 8 LEU CA C 13 55.267 0.3 . 1 . . . A 163 LEU CA . 11457 1 40 . 1 1 8 8 LEU CB C 13 42.51 0.3 . 1 . . . A 163 LEU CB . 11457 1 41 . 1 1 8 8 LEU CG C 13 27.06 0.3 . 1 . . . A 163 LEU CG . 11457 1 42 . 1 1 8 8 LEU CD1 C 13 23.467 0.3 . 2 . . . A 163 LEU CD1 . 11457 1 43 . 1 1 8 8 LEU CD2 C 13 24.962 0.3 . 2 . . . A 163 LEU CD2 . 11457 1 44 . 1 1 8 8 LEU N N 15 121.525 0.3 . 1 . . . A 163 LEU N . 11457 1 45 . 1 1 9 9 GLU H H 1 8.564 0.03 . 1 . . . A 164 GLU H . 11457 1 46 . 1 1 9 9 GLU HA H 1 4.265 0.03 . 1 . . . A 164 GLU HA . 11457 1 47 . 1 1 9 9 GLU HB2 H 1 1.95 0.03 . 2 . . . A 164 GLU HB2 . 11457 1 48 . 1 1 9 9 GLU HB3 H 1 2.063 0.03 . 2 . . . A 164 GLU HB3 . 11457 1 49 . 1 1 9 9 GLU HG2 H 1 2.271 0.03 . 1 . . . A 164 GLU HG2 . 11457 1 50 . 1 1 9 9 GLU HG3 H 1 2.271 0.03 . 1 . . . A 164 GLU HG3 . 11457 1 51 . 1 1 9 9 GLU C C 13 176.636 0.3 . 1 . . . A 164 GLU C . 11457 1 52 . 1 1 9 9 GLU CA C 13 57.054 0.3 . 1 . . . A 164 GLU CA . 11457 1 53 . 1 1 9 9 GLU CB C 13 29.921 0.3 . 1 . . . A 164 GLU CB . 11457 1 54 . 1 1 9 9 GLU CG C 13 36.189 0.3 . 1 . . . A 164 GLU CG . 11457 1 55 . 1 1 9 9 GLU N N 15 121.435 0.3 . 1 . . . A 164 GLU N . 11457 1 56 . 1 1 10 10 SER H H 1 8.213 0.03 . 1 . . . A 165 SER H . 11457 1 57 . 1 1 10 10 SER HA H 1 4.407 0.03 . 1 . . . A 165 SER HA . 11457 1 58 . 1 1 10 10 SER HB2 H 1 3.873 0.03 . 2 . . . A 165 SER HB2 . 11457 1 59 . 1 1 10 10 SER HB3 H 1 3.817 0.03 . 2 . . . A 165 SER HB3 . 11457 1 60 . 1 1 10 10 SER C C 13 174.522 0.3 . 1 . . . A 165 SER C . 11457 1 61 . 1 1 10 10 SER CA C 13 58.492 0.3 . 1 . . . A 165 SER CA . 11457 1 62 . 1 1 10 10 SER CB C 13 63.898 0.3 . 1 . . . A 165 SER CB . 11457 1 63 . 1 1 10 10 SER N N 15 115.855 0.3 . 1 . . . A 165 SER N . 11457 1 64 . 1 1 11 11 GLU H H 1 8.39 0.03 . 1 . . . A 166 GLU H . 11457 1 65 . 1 1 11 11 GLU HA H 1 4.296 0.03 . 1 . . . A 166 GLU HA . 11457 1 66 . 1 1 11 11 GLU HB2 H 1 1.94 0.03 . 2 . . . A 166 GLU HB2 . 11457 1 67 . 1 1 11 11 GLU HB3 H 1 2.065 0.03 . 2 . . . A 166 GLU HB3 . 11457 1 68 . 1 1 11 11 GLU HG2 H 1 2.228 0.03 . 1 . . . A 166 GLU HG2 . 11457 1 69 . 1 1 11 11 GLU HG3 H 1 2.228 0.03 . 1 . . . A 166 GLU HG3 . 11457 1 70 . 1 1 11 11 GLU C C 13 176.521 0.3 . 1 . . . A 166 GLU C . 11457 1 71 . 1 1 11 11 GLU CA C 13 56.697 0.3 . 1 . . . A 166 GLU CA . 11457 1 72 . 1 1 11 11 GLU CB C 13 30.274 0.3 . 1 . . . A 166 GLU CB . 11457 1 73 . 1 1 11 11 GLU CG C 13 36.28 0.3 . 1 . . . A 166 GLU CG . 11457 1 74 . 1 1 11 11 GLU N N 15 122.527 0.3 . 1 . . . A 166 GLU N . 11457 1 75 . 1 1 12 12 GLU H H 1 8.371 0.03 . 1 . . . A 167 GLU H . 11457 1 76 . 1 1 12 12 GLU HA H 1 4.276 0.03 . 1 . . . A 167 GLU HA . 11457 1 77 . 1 1 12 12 GLU HB2 H 1 1.938 0.03 . 2 . . . A 167 GLU HB2 . 11457 1 78 . 1 1 12 12 GLU HB3 H 1 2.041 0.03 . 2 . . . A 167 GLU HB3 . 11457 1 79 . 1 1 12 12 GLU HG2 H 1 2.241 0.03 . 1 . . . A 167 GLU HG2 . 11457 1 80 . 1 1 12 12 GLU HG3 H 1 2.241 0.03 . 1 . . . A 167 GLU HG3 . 11457 1 81 . 1 1 12 12 GLU C C 13 176.784 0.3 . 1 . . . A 167 GLU C . 11457 1 82 . 1 1 12 12 GLU CA C 13 56.835 0.3 . 1 . . . A 167 GLU CA . 11457 1 83 . 1 1 12 12 GLU CB C 13 30.083 0.3 . 1 . . . A 167 GLU CB . 11457 1 84 . 1 1 12 12 GLU CG C 13 36.176 0.3 . 1 . . . A 167 GLU CG . 11457 1 85 . 1 1 12 12 GLU N N 15 121.951 0.3 . 1 . . . A 167 GLU N . 11457 1 86 . 1 1 13 13 VAL H H 1 8.087 0.03 . 1 . . . A 168 VAL H . 11457 1 87 . 1 1 13 13 VAL HA H 1 4.032 0.03 . 1 . . . A 168 VAL HA . 11457 1 88 . 1 1 13 13 VAL HB H 1 2.041 0.03 . 1 . . . A 168 VAL HB . 11457 1 89 . 1 1 13 13 VAL HG11 H 1 0.898 0.03 . 1 . . . A 168 VAL HG11 . 11457 1 90 . 1 1 13 13 VAL HG12 H 1 0.898 0.03 . 1 . . . A 168 VAL HG12 . 11457 1 91 . 1 1 13 13 VAL HG13 H 1 0.898 0.03 . 1 . . . A 168 VAL HG13 . 11457 1 92 . 1 1 13 13 VAL HG21 H 1 0.934 0.03 . 1 . . . A 168 VAL HG21 . 11457 1 93 . 1 1 13 13 VAL HG22 H 1 0.934 0.03 . 1 . . . A 168 VAL HG22 . 11457 1 94 . 1 1 13 13 VAL HG23 H 1 0.934 0.03 . 1 . . . A 168 VAL HG23 . 11457 1 95 . 1 1 13 13 VAL C C 13 175.916 0.3 . 1 . . . A 168 VAL C . 11457 1 96 . 1 1 13 13 VAL CA C 13 62.811 0.3 . 1 . . . A 168 VAL CA . 11457 1 97 . 1 1 13 13 VAL CB C 13 32.821 0.3 . 1 . . . A 168 VAL CB . 11457 1 98 . 1 1 13 13 VAL CG1 C 13 21.103 0.3 . 2 . . . A 168 VAL CG1 . 11457 1 99 . 1 1 13 13 VAL CG2 C 13 20.786 0.3 . 2 . . . A 168 VAL CG2 . 11457 1 100 . 1 1 13 13 VAL N N 15 120.99 0.3 . 1 . . . A 168 VAL N . 11457 1 101 . 1 1 14 14 ASP H H 1 8.412 0.03 . 1 . . . A 169 ASP H . 11457 1 102 . 1 1 14 14 ASP HA H 1 4.668 0.03 . 1 . . . A 169 ASP HA . 11457 1 103 . 1 1 14 14 ASP HB2 H 1 2.628 0.03 . 2 . . . A 169 ASP HB2 . 11457 1 104 . 1 1 14 14 ASP HB3 H 1 2.781 0.03 . 2 . . . A 169 ASP HB3 . 11457 1 105 . 1 1 14 14 ASP C C 13 177.252 0.3 . 1 . . . A 169 ASP C . 11457 1 106 . 1 1 14 14 ASP CA C 13 54.165 0.3 . 1 . . . A 169 ASP CA . 11457 1 107 . 1 1 14 14 ASP CB C 13 40.85 0.3 . 1 . . . A 169 ASP CB . 11457 1 108 . 1 1 14 14 ASP N N 15 123.082 0.3 . 1 . . . A 169 ASP N . 11457 1 109 . 1 1 15 15 LEU H H 1 8.315 0.03 . 1 . . . A 170 LEU H . 11457 1 110 . 1 1 15 15 LEU HA H 1 4.215 0.03 . 1 . . . A 170 LEU HA . 11457 1 111 . 1 1 15 15 LEU HB2 H 1 1.605 0.03 . 2 . . . A 170 LEU HB2 . 11457 1 112 . 1 1 15 15 LEU HB3 H 1 1.706 0.03 . 2 . . . A 170 LEU HB3 . 11457 1 113 . 1 1 15 15 LEU HG H 1 1.674 0.03 . 1 . . . A 170 LEU HG . 11457 1 114 . 1 1 15 15 LEU HD11 H 1 0.846 0.03 . 1 . . . A 170 LEU HD11 . 11457 1 115 . 1 1 15 15 LEU HD12 H 1 0.846 0.03 . 1 . . . A 170 LEU HD12 . 11457 1 116 . 1 1 15 15 LEU HD13 H 1 0.846 0.03 . 1 . . . A 170 LEU HD13 . 11457 1 117 . 1 1 15 15 LEU HD21 H 1 0.917 0.03 . 1 . . . A 170 LEU HD21 . 11457 1 118 . 1 1 15 15 LEU HD22 H 1 0.917 0.03 . 1 . . . A 170 LEU HD22 . 11457 1 119 . 1 1 15 15 LEU HD23 H 1 0.917 0.03 . 1 . . . A 170 LEU HD23 . 11457 1 120 . 1 1 15 15 LEU C C 13 178.008 0.3 . 1 . . . A 170 LEU C . 11457 1 121 . 1 1 15 15 LEU CA C 13 56.308 0.3 . 1 . . . A 170 LEU CA . 11457 1 122 . 1 1 15 15 LEU CB C 13 41.898 0.3 . 1 . . . A 170 LEU CB . 11457 1 123 . 1 1 15 15 LEU CG C 13 26.88 0.3 . 1 . . . A 170 LEU CG . 11457 1 124 . 1 1 15 15 LEU CD1 C 13 23.287 0.3 . 2 . . . A 170 LEU CD1 . 11457 1 125 . 1 1 15 15 LEU CD2 C 13 25.041 0.3 . 2 . . . A 170 LEU CD2 . 11457 1 126 . 1 1 15 15 LEU N N 15 124.443 0.3 . 1 . . . A 170 LEU N . 11457 1 127 . 1 1 16 16 ASN H H 1 8.322 0.03 . 1 . . . A 171 ASN H . 11457 1 128 . 1 1 16 16 ASN HA H 1 4.76 0.03 . 1 . . . A 171 ASN HA . 11457 1 129 . 1 1 16 16 ASN HB2 H 1 2.883 0.03 . 2 . . . A 171 ASN HB2 . 11457 1 130 . 1 1 16 16 ASN HB3 H 1 2.962 0.03 . 2 . . . A 171 ASN HB3 . 11457 1 131 . 1 1 16 16 ASN HD21 H 1 7.002 0.03 . 2 . . . A 171 ASN HD21 . 11457 1 132 . 1 1 16 16 ASN HD22 H 1 7.734 0.03 . 2 . . . A 171 ASN HD22 . 11457 1 133 . 1 1 16 16 ASN C C 13 176.049 0.3 . 1 . . . A 171 ASN C . 11457 1 134 . 1 1 16 16 ASN CA C 13 53.463 0.3 . 1 . . . A 171 ASN CA . 11457 1 135 . 1 1 16 16 ASN CB C 13 38.815 0.3 . 1 . . . A 171 ASN CB . 11457 1 136 . 1 1 16 16 ASN N N 15 116.851 0.3 . 1 . . . A 171 ASN N . 11457 1 137 . 1 1 16 16 ASN ND2 N 15 113.29 0.3 . 1 . . . A 171 ASN ND2 . 11457 1 138 . 1 1 17 17 ALA H H 1 7.925 0.03 . 1 . . . A 172 ALA H . 11457 1 139 . 1 1 17 17 ALA HA H 1 4.052 0.03 . 1 . . . A 172 ALA HA . 11457 1 140 . 1 1 17 17 ALA HB1 H 1 1.322 0.03 . 1 . . . A 172 ALA HB1 . 11457 1 141 . 1 1 17 17 ALA HB2 H 1 1.322 0.03 . 1 . . . A 172 ALA HB2 . 11457 1 142 . 1 1 17 17 ALA HB3 H 1 1.322 0.03 . 1 . . . A 172 ALA HB3 . 11457 1 143 . 1 1 17 17 ALA C C 13 180.1 0.3 . 1 . . . A 172 ALA C . 11457 1 144 . 1 1 17 17 ALA CA C 13 55.266 0.3 . 1 . . . A 172 ALA CA . 11457 1 145 . 1 1 17 17 ALA CB C 13 18.919 0.3 . 1 . . . A 172 ALA CB . 11457 1 146 . 1 1 17 17 ALA N N 15 123.059 0.3 . 1 . . . A 172 ALA N . 11457 1 147 . 1 1 18 18 GLY H H 1 8.649 0.03 . 1 . . . A 173 GLY H . 11457 1 148 . 1 1 18 18 GLY HA2 H 1 3.854 0.03 . 1 . . . A 173 GLY HA2 . 11457 1 149 . 1 1 18 18 GLY HA3 H 1 3.854 0.03 . 1 . . . A 173 GLY HA3 . 11457 1 150 . 1 1 18 18 GLY C C 13 175.675 0.3 . 1 . . . A 173 GLY C . 11457 1 151 . 1 1 18 18 GLY CA C 13 46.346 0.3 . 1 . . . A 173 GLY CA . 11457 1 152 . 1 1 18 18 GLY N N 15 107.099 0.3 . 1 . . . A 173 GLY N . 11457 1 153 . 1 1 19 19 LEU H H 1 7.619 0.03 . 1 . . . A 174 LEU H . 11457 1 154 . 1 1 19 19 LEU HA H 1 4.298 0.03 . 1 . . . A 174 LEU HA . 11457 1 155 . 1 1 19 19 LEU HB2 H 1 1.274 0.03 . 2 . . . A 174 LEU HB2 . 11457 1 156 . 1 1 19 19 LEU HB3 H 1 1.409 0.03 . 2 . . . A 174 LEU HB3 . 11457 1 157 . 1 1 19 19 LEU HG H 1 1.503 0.03 . 1 . . . A 174 LEU HG . 11457 1 158 . 1 1 19 19 LEU HD11 H 1 0.802 0.03 . 1 . . . A 174 LEU HD11 . 11457 1 159 . 1 1 19 19 LEU HD12 H 1 0.802 0.03 . 1 . . . A 174 LEU HD12 . 11457 1 160 . 1 1 19 19 LEU HD13 H 1 0.802 0.03 . 1 . . . A 174 LEU HD13 . 11457 1 161 . 1 1 19 19 LEU HD21 H 1 0.89 0.03 . 1 . . . A 174 LEU HD21 . 11457 1 162 . 1 1 19 19 LEU HD22 H 1 0.89 0.03 . 1 . . . A 174 LEU HD22 . 11457 1 163 . 1 1 19 19 LEU HD23 H 1 0.89 0.03 . 1 . . . A 174 LEU HD23 . 11457 1 164 . 1 1 19 19 LEU C C 13 177.5 0.3 . 1 . . . A 174 LEU C . 11457 1 165 . 1 1 19 19 LEU CA C 13 55.611 0.3 . 1 . . . A 174 LEU CA . 11457 1 166 . 1 1 19 19 LEU CB C 13 41.792 0.3 . 1 . . . A 174 LEU CB . 11457 1 167 . 1 1 19 19 LEU CG C 13 26.88 0.3 . 1 . . . A 174 LEU CG . 11457 1 168 . 1 1 19 19 LEU CD1 C 13 22.839 0.3 . 2 . . . A 174 LEU CD1 . 11457 1 169 . 1 1 19 19 LEU CD2 C 13 25.067 0.3 . 2 . . . A 174 LEU CD2 . 11457 1 170 . 1 1 19 19 LEU N N 15 120.099 0.3 . 1 . . . A 174 LEU N . 11457 1 171 . 1 1 20 20 HIS H H 1 7.776 0.03 . 1 . . . A 175 HIS H . 11457 1 172 . 1 1 20 20 HIS HA H 1 4.944 0.03 . 1 . . . A 175 HIS HA . 11457 1 173 . 1 1 20 20 HIS HB2 H 1 2.947 0.03 . 2 . . . A 175 HIS HB2 . 11457 1 174 . 1 1 20 20 HIS HB3 H 1 3.346 0.03 . 2 . . . A 175 HIS HB3 . 11457 1 175 . 1 1 20 20 HIS HD2 H 1 7.045 0.03 . 1 . . . A 175 HIS HD2 . 11457 1 176 . 1 1 20 20 HIS HE1 H 1 8.714 0.03 . 1 . . . A 175 HIS HE1 . 11457 1 177 . 1 1 20 20 HIS C C 13 175.098 0.3 . 1 . . . A 175 HIS C . 11457 1 178 . 1 1 20 20 HIS CA C 13 54.188 0.3 . 1 . . . A 175 HIS CA . 11457 1 179 . 1 1 20 20 HIS CB C 13 31.029 0.3 . 1 . . . A 175 HIS CB . 11457 1 180 . 1 1 20 20 HIS CD2 C 13 120.203 0.3 . 1 . . . A 175 HIS CD2 . 11457 1 181 . 1 1 20 20 HIS CE1 C 13 138.091 0.3 . 1 . . . A 175 HIS CE1 . 11457 1 182 . 1 1 20 20 HIS N N 15 117.089 0.3 . 1 . . . A 175 HIS N . 11457 1 183 . 1 1 21 21 GLY H H 1 8.087 0.03 . 1 . . . A 176 GLY H . 11457 1 184 . 1 1 21 21 GLY HA2 H 1 2.303 0.03 . 2 . . . A 176 GLY HA2 . 11457 1 185 . 1 1 21 21 GLY HA3 H 1 3.175 0.03 . 2 . . . A 176 GLY HA3 . 11457 1 186 . 1 1 21 21 GLY C C 13 172.148 0.3 . 1 . . . A 176 GLY C . 11457 1 187 . 1 1 21 21 GLY CA C 13 46.019 0.3 . 1 . . . A 176 GLY CA . 11457 1 188 . 1 1 21 21 GLY N N 15 108.301 0.3 . 1 . . . A 176 GLY N . 11457 1 189 . 1 1 22 22 ASN H H 1 8.044 0.03 . 1 . . . A 177 ASN H . 11457 1 190 . 1 1 22 22 ASN HA H 1 3.733 0.03 . 1 . . . A 177 ASN HA . 11457 1 191 . 1 1 22 22 ASN HB2 H 1 2.751 0.03 . 2 . . . A 177 ASN HB2 . 11457 1 192 . 1 1 22 22 ASN HB3 H 1 2.99 0.03 . 2 . . . A 177 ASN HB3 . 11457 1 193 . 1 1 22 22 ASN HD21 H 1 6.789 0.03 . 2 . . . A 177 ASN HD21 . 11457 1 194 . 1 1 22 22 ASN HD22 H 1 7.273 0.03 . 2 . . . A 177 ASN HD22 . 11457 1 195 . 1 1 22 22 ASN C C 13 173.478 0.3 . 1 . . . A 177 ASN C . 11457 1 196 . 1 1 22 22 ASN CA C 13 54.458 0.3 . 1 . . . A 177 ASN CA . 11457 1 197 . 1 1 22 22 ASN CB C 13 36.879 0.3 . 1 . . . A 177 ASN CB . 11457 1 198 . 1 1 22 22 ASN N N 15 108.121 0.3 . 1 . . . A 177 ASN N . 11457 1 199 . 1 1 22 22 ASN ND2 N 15 113.29 0.3 . 1 . . . A 177 ASN ND2 . 11457 1 200 . 1 1 23 23 TRP H H 1 6.875 0.03 . 1 . . . A 178 TRP H . 11457 1 201 . 1 1 23 23 TRP HA H 1 4.793 0.03 . 1 . . . A 178 TRP HA . 11457 1 202 . 1 1 23 23 TRP HB2 H 1 2.857 0.03 . 2 . . . A 178 TRP HB2 . 11457 1 203 . 1 1 23 23 TRP HB3 H 1 2.99 0.03 . 2 . . . A 178 TRP HB3 . 11457 1 204 . 1 1 23 23 TRP HD1 H 1 6.89 0.03 . 1 . . . A 178 TRP HD1 . 11457 1 205 . 1 1 23 23 TRP HE1 H 1 9.822 0.03 . 1 . . . A 178 TRP HE1 . 11457 1 206 . 1 1 23 23 TRP HE3 H 1 7.405 0.03 . 1 . . . A 178 TRP HE3 . 11457 1 207 . 1 1 23 23 TRP HZ2 H 1 7.558 0.03 . 1 . . . A 178 TRP HZ2 . 11457 1 208 . 1 1 23 23 TRP HZ3 H 1 6.927 0.03 . 1 . . . A 178 TRP HZ3 . 11457 1 209 . 1 1 23 23 TRP HH2 H 1 7.386 0.03 . 1 . . . A 178 TRP HH2 . 11457 1 210 . 1 1 23 23 TRP C C 13 176.151 0.3 . 1 . . . A 178 TRP C . 11457 1 211 . 1 1 23 23 TRP CA C 13 56.864 0.3 . 1 . . . A 178 TRP CA . 11457 1 212 . 1 1 23 23 TRP CB C 13 29.941 0.3 . 1 . . . A 178 TRP CB . 11457 1 213 . 1 1 23 23 TRP CD1 C 13 126.409 0.3 . 1 . . . A 178 TRP CD1 . 11457 1 214 . 1 1 23 23 TRP CE3 C 13 120.121 0.3 . 1 . . . A 178 TRP CE3 . 11457 1 215 . 1 1 23 23 TRP CZ2 C 13 115.575 0.3 . 1 . . . A 178 TRP CZ2 . 11457 1 216 . 1 1 23 23 TRP CZ3 C 13 122.209 0.3 . 1 . . . A 178 TRP CZ3 . 11457 1 217 . 1 1 23 23 TRP CH2 C 13 124.002 0.3 . 1 . . . A 178 TRP CH2 . 11457 1 218 . 1 1 23 23 TRP N N 15 119.934 0.3 . 1 . . . A 178 TRP N . 11457 1 219 . 1 1 23 23 TRP NE1 N 15 126.349 0.3 . 1 . . . A 178 TRP NE1 . 11457 1 220 . 1 1 24 24 THR H H 1 9.868 0.03 . 1 . . . A 179 THR H . 11457 1 221 . 1 1 24 24 THR HA H 1 4.575 0.03 . 1 . . . A 179 THR HA . 11457 1 222 . 1 1 24 24 THR HB H 1 4.559 0.03 . 1 . . . A 179 THR HB . 11457 1 223 . 1 1 24 24 THR HG21 H 1 0.951 0.03 . 1 . . . A 179 THR HG21 . 11457 1 224 . 1 1 24 24 THR HG22 H 1 0.951 0.03 . 1 . . . A 179 THR HG22 . 11457 1 225 . 1 1 24 24 THR HG23 H 1 0.951 0.03 . 1 . . . A 179 THR HG23 . 11457 1 226 . 1 1 24 24 THR C C 13 174.582 0.3 . 1 . . . A 179 THR C . 11457 1 227 . 1 1 24 24 THR CA C 13 60.013 0.3 . 1 . . . A 179 THR CA . 11457 1 228 . 1 1 24 24 THR CB C 13 72.835 0.3 . 1 . . . A 179 THR CB . 11457 1 229 . 1 1 24 24 THR CG2 C 13 21.67 0.3 . 1 . . . A 179 THR CG2 . 11457 1 230 . 1 1 24 24 THR N N 15 118.668 0.3 . 1 . . . A 179 THR N . 11457 1 231 . 1 1 25 25 LEU H H 1 9.029 0.03 . 1 . . . A 180 LEU H . 11457 1 232 . 1 1 25 25 LEU HA H 1 3.866 0.03 . 1 . . . A 180 LEU HA . 11457 1 233 . 1 1 25 25 LEU HB2 H 1 1.54 0.03 . 2 . . . A 180 LEU HB2 . 11457 1 234 . 1 1 25 25 LEU HB3 H 1 1.69 0.03 . 2 . . . A 180 LEU HB3 . 11457 1 235 . 1 1 25 25 LEU HG H 1 1.698 0.03 . 1 . . . A 180 LEU HG . 11457 1 236 . 1 1 25 25 LEU HD11 H 1 0.869 0.03 . 1 . . . A 180 LEU HD11 . 11457 1 237 . 1 1 25 25 LEU HD12 H 1 0.869 0.03 . 1 . . . A 180 LEU HD12 . 11457 1 238 . 1 1 25 25 LEU HD13 H 1 0.869 0.03 . 1 . . . A 180 LEU HD13 . 11457 1 239 . 1 1 25 25 LEU HD21 H 1 0.906 0.03 . 1 . . . A 180 LEU HD21 . 11457 1 240 . 1 1 25 25 LEU HD22 H 1 0.906 0.03 . 1 . . . A 180 LEU HD22 . 11457 1 241 . 1 1 25 25 LEU HD23 H 1 0.906 0.03 . 1 . . . A 180 LEU HD23 . 11457 1 242 . 1 1 25 25 LEU C C 13 178.779 0.3 . 1 . . . A 180 LEU C . 11457 1 243 . 1 1 25 25 LEU CA C 13 58.14 0.3 . 1 . . . A 180 LEU CA . 11457 1 244 . 1 1 25 25 LEU CB C 13 42.504 0.3 . 1 . . . A 180 LEU CB . 11457 1 245 . 1 1 25 25 LEU CG C 13 26.701 0.3 . 1 . . . A 180 LEU CG . 11457 1 246 . 1 1 25 25 LEU CD1 C 13 24.356 0.3 . 2 . . . A 180 LEU CD1 . 11457 1 247 . 1 1 25 25 LEU CD2 C 13 25.084 0.3 . 2 . . . A 180 LEU CD2 . 11457 1 248 . 1 1 25 25 LEU N N 15 120.777 0.3 . 1 . . . A 180 LEU N . 11457 1 249 . 1 1 26 26 GLU H H 1 8.136 0.03 . 1 . . . A 181 GLU H . 11457 1 250 . 1 1 26 26 GLU HA H 1 4.041 0.03 . 1 . . . A 181 GLU HA . 11457 1 251 . 1 1 26 26 GLU HB2 H 1 1.884 0.03 . 1 . . . A 181 GLU HB2 . 11457 1 252 . 1 1 26 26 GLU HB3 H 1 1.884 0.03 . 1 . . . A 181 GLU HB3 . 11457 1 253 . 1 1 26 26 GLU HG2 H 1 2.194 0.03 . 2 . . . A 181 GLU HG2 . 11457 1 254 . 1 1 26 26 GLU HG3 H 1 2.242 0.03 . 2 . . . A 181 GLU HG3 . 11457 1 255 . 1 1 26 26 GLU C C 13 177.407 0.3 . 1 . . . A 181 GLU C . 11457 1 256 . 1 1 26 26 GLU CA C 13 58.859 0.3 . 1 . . . A 181 GLU CA . 11457 1 257 . 1 1 26 26 GLU CB C 13 29.882 0.3 . 1 . . . A 181 GLU CB . 11457 1 258 . 1 1 26 26 GLU CG C 13 36.402 0.3 . 1 . . . A 181 GLU CG . 11457 1 259 . 1 1 26 26 GLU N N 15 114.005 0.3 . 1 . . . A 181 GLU N . 11457 1 260 . 1 1 27 27 ASN H H 1 7.382 0.03 . 1 . . . A 182 ASN H . 11457 1 261 . 1 1 27 27 ASN HA H 1 4.975 0.03 . 1 . . . A 182 ASN HA . 11457 1 262 . 1 1 27 27 ASN HB2 H 1 2.525 0.03 . 2 . . . A 182 ASN HB2 . 11457 1 263 . 1 1 27 27 ASN HB3 H 1 3.005 0.03 . 2 . . . A 182 ASN HB3 . 11457 1 264 . 1 1 27 27 ASN HD21 H 1 5.797 0.03 . 2 . . . A 182 ASN HD21 . 11457 1 265 . 1 1 27 27 ASN HD22 H 1 4.984 0.03 . 2 . . . A 182 ASN HD22 . 11457 1 266 . 1 1 27 27 ASN C C 13 178.326 0.3 . 1 . . . A 182 ASN C . 11457 1 267 . 1 1 27 27 ASN CA C 13 52.619 0.3 . 1 . . . A 182 ASN CA . 11457 1 268 . 1 1 27 27 ASN CB C 13 38.921 0.3 . 1 . . . A 182 ASN CB . 11457 1 269 . 1 1 27 27 ASN N N 15 114.057 0.3 . 1 . . . A 182 ASN N . 11457 1 270 . 1 1 27 27 ASN ND2 N 15 106.466 0.3 . 1 . . . A 182 ASN ND2 . 11457 1 271 . 1 1 28 28 ALA H H 1 8.128 0.03 . 1 . . . A 183 ALA H . 11457 1 272 . 1 1 28 28 ALA HA H 1 4.059 0.03 . 1 . . . A 183 ALA HA . 11457 1 273 . 1 1 28 28 ALA HB1 H 1 1.449 0.03 . 1 . . . A 183 ALA HB1 . 11457 1 274 . 1 1 28 28 ALA HB2 H 1 1.449 0.03 . 1 . . . A 183 ALA HB2 . 11457 1 275 . 1 1 28 28 ALA HB3 H 1 1.449 0.03 . 1 . . . A 183 ALA HB3 . 11457 1 276 . 1 1 28 28 ALA C C 13 178.945 0.3 . 1 . . . A 183 ALA C . 11457 1 277 . 1 1 28 28 ALA CA C 13 56.462 0.3 . 1 . . . A 183 ALA CA . 11457 1 278 . 1 1 28 28 ALA CB C 13 18.796 0.3 . 1 . . . A 183 ALA CB . 11457 1 279 . 1 1 28 28 ALA N N 15 123.408 0.3 . 1 . . . A 183 ALA N . 11457 1 280 . 1 1 29 29 LYS H H 1 8.319 0.03 . 1 . . . A 184 LYS H . 11457 1 281 . 1 1 29 29 LYS HA H 1 3.558 0.03 . 1 . . . A 184 LYS HA . 11457 1 282 . 1 1 29 29 LYS HB2 H 1 1.774 0.03 . 2 . . . A 184 LYS HB2 . 11457 1 283 . 1 1 29 29 LYS HB3 H 1 1.852 0.03 . 2 . . . A 184 LYS HB3 . 11457 1 284 . 1 1 29 29 LYS HG2 H 1 1.393 0.03 . 1 . . . A 184 LYS HG2 . 11457 1 285 . 1 1 29 29 LYS HG3 H 1 1.393 0.03 . 1 . . . A 184 LYS HG3 . 11457 1 286 . 1 1 29 29 LYS HD2 H 1 1.571 0.03 . 2 . . . A 184 LYS HD2 . 11457 1 287 . 1 1 29 29 LYS HD3 H 1 1.571 0.03 . 2 . . . A 184 LYS HD3 . 11457 1 288 . 1 1 29 29 LYS HE2 H 1 2.893 0.03 . 2 . . . A 184 LYS HE2 . 11457 1 289 . 1 1 29 29 LYS HE3 H 1 2.976 0.03 . 2 . . . A 184 LYS HE3 . 11457 1 290 . 1 1 29 29 LYS C C 13 178.387 0.3 . 1 . . . A 184 LYS C . 11457 1 291 . 1 1 29 29 LYS CA C 13 60.848 0.3 . 1 . . . A 184 LYS CA . 11457 1 292 . 1 1 29 29 LYS CB C 13 32.076 0.3 . 1 . . . A 184 LYS CB . 11457 1 293 . 1 1 29 29 LYS CG C 13 24.999 0.3 . 1 . . . A 184 LYS CG . 11457 1 294 . 1 1 29 29 LYS CD C 13 29.934 0.3 . 1 . . . A 184 LYS CD . 11457 1 295 . 1 1 29 29 LYS CE C 13 41.922 0.3 . 1 . . . A 184 LYS CE . 11457 1 296 . 1 1 29 29 LYS N N 15 119.002 0.3 . 1 . . . A 184 LYS N . 11457 1 297 . 1 1 30 30 ALA H H 1 8.439 0.03 . 1 . . . A 185 ALA H . 11457 1 298 . 1 1 30 30 ALA HA H 1 4.143 0.03 . 1 . . . A 185 ALA HA . 11457 1 299 . 1 1 30 30 ALA HB1 H 1 1.474 0.03 . 1 . . . A 185 ALA HB1 . 11457 1 300 . 1 1 30 30 ALA HB2 H 1 1.474 0.03 . 1 . . . A 185 ALA HB2 . 11457 1 301 . 1 1 30 30 ALA HB3 H 1 1.474 0.03 . 1 . . . A 185 ALA HB3 . 11457 1 302 . 1 1 30 30 ALA C C 13 180.659 0.3 . 1 . . . A 185 ALA C . 11457 1 303 . 1 1 30 30 ALA CA C 13 54.883 0.3 . 1 . . . A 185 ALA CA . 11457 1 304 . 1 1 30 30 ALA CB C 13 18.077 0.3 . 1 . . . A 185 ALA CB . 11457 1 305 . 1 1 30 30 ALA N N 15 119.769 0.3 . 1 . . . A 185 ALA N . 11457 1 306 . 1 1 31 31 ARG H H 1 7.179 0.03 . 1 . . . A 186 ARG H . 11457 1 307 . 1 1 31 31 ARG HA H 1 4.366 0.03 . 1 . . . A 186 ARG HA . 11457 1 308 . 1 1 31 31 ARG HB2 H 1 1.47 0.03 . 2 . . . A 186 ARG HB2 . 11457 1 309 . 1 1 31 31 ARG HB3 H 1 1.826 0.03 . 2 . . . A 186 ARG HB3 . 11457 1 310 . 1 1 31 31 ARG HG2 H 1 0.761 0.03 . 1 . . . A 186 ARG HG2 . 11457 1 311 . 1 1 31 31 ARG HG3 H 1 0.761 0.03 . 1 . . . A 186 ARG HG3 . 11457 1 312 . 1 1 31 31 ARG HD2 H 1 3.339 0.03 . 2 . . . A 186 ARG HD2 . 11457 1 313 . 1 1 31 31 ARG HD3 H 1 3.442 0.03 . 2 . . . A 186 ARG HD3 . 11457 1 314 . 1 1 31 31 ARG HE H 1 8.935 0.03 . 1 . . . A 186 ARG HE . 11457 1 315 . 1 1 31 31 ARG C C 13 179.531 0.3 . 1 . . . A 186 ARG C . 11457 1 316 . 1 1 31 31 ARG CA C 13 56.3 0.3 . 1 . . . A 186 ARG CA . 11457 1 317 . 1 1 31 31 ARG CB C 13 29.038 0.3 . 1 . . . A 186 ARG CB . 11457 1 318 . 1 1 31 31 ARG CG C 13 26.261 0.3 . 1 . . . A 186 ARG CG . 11457 1 319 . 1 1 31 31 ARG CD C 13 42.091 0.3 . 1 . . . A 186 ARG CD . 11457 1 320 . 1 1 31 31 ARG N N 15 118.703 0.3 . 1 . . . A 186 ARG N . 11457 1 321 . 1 1 31 31 ARG NE N 15 85.263 0.3 . 1 . . . A 186 ARG NE . 11457 1 322 . 1 1 32 32 LEU H H 1 8.422 0.03 . 1 . . . A 187 LEU H . 11457 1 323 . 1 1 32 32 LEU HA H 1 3.608 0.03 . 1 . . . A 187 LEU HA . 11457 1 324 . 1 1 32 32 LEU HB2 H 1 0.999 0.03 . 2 . . . A 187 LEU HB2 . 11457 1 325 . 1 1 32 32 LEU HB3 H 1 1.679 0.03 . 2 . . . A 187 LEU HB3 . 11457 1 326 . 1 1 32 32 LEU HG H 1 0.636 0.03 . 1 . . . A 187 LEU HG . 11457 1 327 . 1 1 32 32 LEU HD11 H 1 0.329 0.03 . 1 . . . A 187 LEU HD11 . 11457 1 328 . 1 1 32 32 LEU HD12 H 1 0.329 0.03 . 1 . . . A 187 LEU HD12 . 11457 1 329 . 1 1 32 32 LEU HD13 H 1 0.329 0.03 . 1 . . . A 187 LEU HD13 . 11457 1 330 . 1 1 32 32 LEU HD21 H 1 0.742 0.03 . 1 . . . A 187 LEU HD21 . 11457 1 331 . 1 1 32 32 LEU HD22 H 1 0.742 0.03 . 1 . . . A 187 LEU HD22 . 11457 1 332 . 1 1 32 32 LEU HD23 H 1 0.742 0.03 . 1 . . . A 187 LEU HD23 . 11457 1 333 . 1 1 32 32 LEU C C 13 177.583 0.3 . 1 . . . A 187 LEU C . 11457 1 334 . 1 1 32 32 LEU CA C 13 56.857 0.3 . 1 . . . A 187 LEU CA . 11457 1 335 . 1 1 32 32 LEU CB C 13 40.534 0.3 . 1 . . . A 187 LEU CB . 11457 1 336 . 1 1 32 32 LEU CG C 13 25.263 0.3 . 1 . . . A 187 LEU CG . 11457 1 337 . 1 1 32 32 LEU CD1 C 13 22.358 0.3 . 2 . . . A 187 LEU CD1 . 11457 1 338 . 1 1 32 32 LEU CD2 C 13 26.617 0.3 . 2 . . . A 187 LEU CD2 . 11457 1 339 . 1 1 32 32 LEU N N 15 123.996 0.3 . 1 . . . A 187 LEU N . 11457 1 340 . 1 1 33 33 ASN H H 1 8.137 0.03 . 1 . . . A 188 ASN H . 11457 1 341 . 1 1 33 33 ASN HA H 1 4.401 0.03 . 1 . . . A 188 ASN HA . 11457 1 342 . 1 1 33 33 ASN HB2 H 1 2.881 0.03 . 1 . . . A 188 ASN HB2 . 11457 1 343 . 1 1 33 33 ASN HB3 H 1 2.881 0.03 . 1 . . . A 188 ASN HB3 . 11457 1 344 . 1 1 33 33 ASN HD21 H 1 6.884 0.03 . 2 . . . A 188 ASN HD21 . 11457 1 345 . 1 1 33 33 ASN HD22 H 1 7.661 0.03 . 2 . . . A 188 ASN HD22 . 11457 1 346 . 1 1 33 33 ASN C C 13 178.368 0.3 . 1 . . . A 188 ASN C . 11457 1 347 . 1 1 33 33 ASN CA C 13 56.334 0.3 . 1 . . . A 188 ASN CA . 11457 1 348 . 1 1 33 33 ASN CB C 13 37.839 0.3 . 1 . . . A 188 ASN CB . 11457 1 349 . 1 1 33 33 ASN N N 15 116.942 0.3 . 1 . . . A 188 ASN N . 11457 1 350 . 1 1 33 33 ASN ND2 N 15 111.734 0.3 . 1 . . . A 188 ASN ND2 . 11457 1 351 . 1 1 34 34 GLN H H 1 7.725 0.03 . 1 . . . A 189 GLN H . 11457 1 352 . 1 1 34 34 GLN HA H 1 4.124 0.03 . 1 . . . A 189 GLN HA . 11457 1 353 . 1 1 34 34 GLN HB2 H 1 2.192 0.03 . 2 . . . A 189 GLN HB2 . 11457 1 354 . 1 1 34 34 GLN HB3 H 1 2.346 0.03 . 2 . . . A 189 GLN HB3 . 11457 1 355 . 1 1 34 34 GLN HG2 H 1 2.408 0.03 . 2 . . . A 189 GLN HG2 . 11457 1 356 . 1 1 34 34 GLN HG3 H 1 2.613 0.03 . 2 . . . A 189 GLN HG3 . 11457 1 357 . 1 1 34 34 GLN HE21 H 1 6.923 0.03 . 2 . . . A 189 GLN HE21 . 11457 1 358 . 1 1 34 34 GLN HE22 H 1 7.507 0.03 . 2 . . . A 189 GLN HE22 . 11457 1 359 . 1 1 34 34 GLN C C 13 178.169 0.3 . 1 . . . A 189 GLN C . 11457 1 360 . 1 1 34 34 GLN CA C 13 59.038 0.3 . 1 . . . A 189 GLN CA . 11457 1 361 . 1 1 34 34 GLN CB C 13 28.677 0.3 . 1 . . . A 189 GLN CB . 11457 1 362 . 1 1 34 34 GLN CG C 13 33.646 0.3 . 1 . . . A 189 GLN CG . 11457 1 363 . 1 1 34 34 GLN N N 15 119.61 0.3 . 1 . . . A 189 GLN N . 11457 1 364 . 1 1 34 34 GLN NE2 N 15 111.102 0.3 . 1 . . . A 189 GLN NE2 . 11457 1 365 . 1 1 35 35 TYR H H 1 7.834 0.03 . 1 . . . A 190 TYR H . 11457 1 366 . 1 1 35 35 TYR HA H 1 4.51 0.03 . 1 . . . A 190 TYR HA . 11457 1 367 . 1 1 35 35 TYR HB2 H 1 2.755 0.03 . 2 . . . A 190 TYR HB2 . 11457 1 368 . 1 1 35 35 TYR HB3 H 1 3.157 0.03 . 2 . . . A 190 TYR HB3 . 11457 1 369 . 1 1 35 35 TYR HD1 H 1 6.856 0.03 . 1 . . . A 190 TYR HD1 . 11457 1 370 . 1 1 35 35 TYR HD2 H 1 6.856 0.03 . 1 . . . A 190 TYR HD2 . 11457 1 371 . 1 1 35 35 TYR HE1 H 1 6.563 0.03 . 1 . . . A 190 TYR HE1 . 11457 1 372 . 1 1 35 35 TYR HE2 H 1 6.563 0.03 . 1 . . . A 190 TYR HE2 . 11457 1 373 . 1 1 35 35 TYR C C 13 176.941 0.3 . 1 . . . A 190 TYR C . 11457 1 374 . 1 1 35 35 TYR CA C 13 61.721 0.3 . 1 . . . A 190 TYR CA . 11457 1 375 . 1 1 35 35 TYR CB C 13 38.02 0.3 . 1 . . . A 190 TYR CB . 11457 1 376 . 1 1 35 35 TYR CD1 C 13 132.404 0.3 . 1 . . . A 190 TYR CD1 . 11457 1 377 . 1 1 35 35 TYR CD2 C 13 132.404 0.3 . 1 . . . A 190 TYR CD2 . 11457 1 378 . 1 1 35 35 TYR CE1 C 13 118.127 0.3 . 1 . . . A 190 TYR CE1 . 11457 1 379 . 1 1 35 35 TYR CE2 C 13 118.127 0.3 . 1 . . . A 190 TYR CE2 . 11457 1 380 . 1 1 35 35 TYR N N 15 122.312 0.3 . 1 . . . A 190 TYR N . 11457 1 381 . 1 1 36 36 PHE H H 1 8.667 0.03 . 1 . . . A 191 PHE H . 11457 1 382 . 1 1 36 36 PHE HA H 1 4.298 0.03 . 1 . . . A 191 PHE HA . 11457 1 383 . 1 1 36 36 PHE HB2 H 1 3.331 0.03 . 2 . . . A 191 PHE HB2 . 11457 1 384 . 1 1 36 36 PHE HB3 H 1 3.648 0.03 . 2 . . . A 191 PHE HB3 . 11457 1 385 . 1 1 36 36 PHE HD1 H 1 7.197 0.03 . 1 . . . A 191 PHE HD1 . 11457 1 386 . 1 1 36 36 PHE HD2 H 1 7.197 0.03 . 1 . . . A 191 PHE HD2 . 11457 1 387 . 1 1 36 36 PHE HE1 H 1 7.106 0.03 . 1 . . . A 191 PHE HE1 . 11457 1 388 . 1 1 36 36 PHE HE2 H 1 7.106 0.03 . 1 . . . A 191 PHE HE2 . 11457 1 389 . 1 1 36 36 PHE HZ H 1 7.14 0.03 . 1 . . . A 191 PHE HZ . 11457 1 390 . 1 1 36 36 PHE C C 13 179.157 0.3 . 1 . . . A 191 PHE C . 11457 1 391 . 1 1 36 36 PHE CA C 13 58.338 0.3 . 1 . . . A 191 PHE CA . 11457 1 392 . 1 1 36 36 PHE CB C 13 36.706 0.3 . 1 . . . A 191 PHE CB . 11457 1 393 . 1 1 36 36 PHE CD1 C 13 130.098 0.3 . 1 . . . A 191 PHE CD1 . 11457 1 394 . 1 1 36 36 PHE CD2 C 13 130.098 0.3 . 1 . . . A 191 PHE CD2 . 11457 1 395 . 1 1 36 36 PHE CE1 C 13 130.361 0.3 . 1 . . . A 191 PHE CE1 . 11457 1 396 . 1 1 36 36 PHE CE2 C 13 130.361 0.3 . 1 . . . A 191 PHE CE2 . 11457 1 397 . 1 1 36 36 PHE CZ C 13 128.924 0.3 . 1 . . . A 191 PHE CZ . 11457 1 398 . 1 1 36 36 PHE N N 15 117.719 0.3 . 1 . . . A 191 PHE N . 11457 1 399 . 1 1 37 37 GLN H H 1 8.085 0.03 . 1 . . . A 192 GLN H . 11457 1 400 . 1 1 37 37 GLN HA H 1 4.12 0.03 . 1 . . . A 192 GLN HA . 11457 1 401 . 1 1 37 37 GLN HB2 H 1 2.189 0.03 . 2 . . . A 192 GLN HB2 . 11457 1 402 . 1 1 37 37 GLN HB3 H 1 2.189 0.03 . 2 . . . A 192 GLN HB3 . 11457 1 403 . 1 1 37 37 GLN HG2 H 1 2.432 0.03 . 2 . . . A 192 GLN HG2 . 11457 1 404 . 1 1 37 37 GLN HG3 H 1 2.568 0.03 . 2 . . . A 192 GLN HG3 . 11457 1 405 . 1 1 37 37 GLN HE21 H 1 6.856 0.03 . 2 . . . A 192 GLN HE21 . 11457 1 406 . 1 1 37 37 GLN HE22 H 1 7.449 0.03 . 2 . . . A 192 GLN HE22 . 11457 1 407 . 1 1 37 37 GLN C C 13 178.821 0.3 . 1 . . . A 192 GLN C . 11457 1 408 . 1 1 37 37 GLN CA C 13 58.836 0.3 . 1 . . . A 192 GLN CA . 11457 1 409 . 1 1 37 37 GLN CB C 13 28.677 0.3 . 1 . . . A 192 GLN CB . 11457 1 410 . 1 1 37 37 GLN CG C 13 34.066 0.3 . 1 . . . A 192 GLN CG . 11457 1 411 . 1 1 37 37 GLN N N 15 117.211 0.3 . 1 . . . A 192 GLN N . 11457 1 412 . 1 1 37 37 GLN NE2 N 15 111.796 0.3 . 1 . . . A 192 GLN NE2 . 11457 1 413 . 1 1 38 38 LYS H H 1 8.081 0.03 . 1 . . . A 193 LYS H . 11457 1 414 . 1 1 38 38 LYS HA H 1 4.033 0.03 . 1 . . . A 193 LYS HA . 11457 1 415 . 1 1 38 38 LYS HB2 H 1 1.94 0.03 . 2 . . . A 193 LYS HB2 . 11457 1 416 . 1 1 38 38 LYS HB3 H 1 1.977 0.03 . 2 . . . A 193 LYS HB3 . 11457 1 417 . 1 1 38 38 LYS HG2 H 1 1.431 0.03 . 1 . . . A 193 LYS HG2 . 11457 1 418 . 1 1 38 38 LYS HG3 H 1 1.431 0.03 . 1 . . . A 193 LYS HG3 . 11457 1 419 . 1 1 38 38 LYS HD2 H 1 1.687 0.03 . 2 . . . A 193 LYS HD2 . 11457 1 420 . 1 1 38 38 LYS HD3 H 1 1.75 0.03 . 2 . . . A 193 LYS HD3 . 11457 1 421 . 1 1 38 38 LYS HE2 H 1 3.006 0.03 . 1 . . . A 193 LYS HE2 . 11457 1 422 . 1 1 38 38 LYS HE3 H 1 3.006 0.03 . 1 . . . A 193 LYS HE3 . 11457 1 423 . 1 1 38 38 LYS C C 13 178.525 0.3 . 1 . . . A 193 LYS C . 11457 1 424 . 1 1 38 38 LYS CA C 13 58.919 0.3 . 1 . . . A 193 LYS CA . 11457 1 425 . 1 1 38 38 LYS CB C 13 32.611 0.3 . 1 . . . A 193 LYS CB . 11457 1 426 . 1 1 38 38 LYS CG C 13 24.904 0.3 . 1 . . . A 193 LYS CG . 11457 1 427 . 1 1 38 38 LYS CD C 13 29.02 0.3 . 1 . . . A 193 LYS CD . 11457 1 428 . 1 1 38 38 LYS CE C 13 42.424 0.3 . 1 . . . A 193 LYS CE . 11457 1 429 . 1 1 38 38 LYS N N 15 120.761 0.3 . 1 . . . A 193 LYS N . 11457 1 430 . 1 1 39 39 GLU H H 1 8.065 0.03 . 1 . . . A 194 GLU H . 11457 1 431 . 1 1 39 39 GLU HA H 1 4.15 0.03 . 1 . . . A 194 GLU HA . 11457 1 432 . 1 1 39 39 GLU HB2 H 1 1.31 0.03 . 2 . . . A 194 GLU HB2 . 11457 1 433 . 1 1 39 39 GLU HB3 H 1 2.088 0.03 . 2 . . . A 194 GLU HB3 . 11457 1 434 . 1 1 39 39 GLU HG2 H 1 1.599 0.03 . 2 . . . A 194 GLU HG2 . 11457 1 435 . 1 1 39 39 GLU HG3 H 1 1.673 0.03 . 2 . . . A 194 GLU HG3 . 11457 1 436 . 1 1 39 39 GLU C C 13 175.389 0.3 . 1 . . . A 194 GLU C . 11457 1 437 . 1 1 39 39 GLU CA C 13 55.597 0.3 . 1 . . . A 194 GLU CA . 11457 1 438 . 1 1 39 39 GLU CB C 13 29.934 0.3 . 1 . . . A 194 GLU CB . 11457 1 439 . 1 1 39 39 GLU CG C 13 35.371 0.3 . 1 . . . A 194 GLU CG . 11457 1 440 . 1 1 39 39 GLU N N 15 114.609 0.3 . 1 . . . A 194 GLU N . 11457 1 441 . 1 1 40 40 LYS H H 1 7.716 0.03 . 1 . . . A 195 LYS H . 11457 1 442 . 1 1 40 40 LYS HA H 1 3.877 0.03 . 1 . . . A 195 LYS HA . 11457 1 443 . 1 1 40 40 LYS HB2 H 1 1.804 0.03 . 2 . . . A 195 LYS HB2 . 11457 1 444 . 1 1 40 40 LYS HB3 H 1 2.095 0.03 . 2 . . . A 195 LYS HB3 . 11457 1 445 . 1 1 40 40 LYS HG2 H 1 1.323 0.03 . 1 . . . A 195 LYS HG2 . 11457 1 446 . 1 1 40 40 LYS HG3 H 1 1.323 0.03 . 1 . . . A 195 LYS HG3 . 11457 1 447 . 1 1 40 40 LYS HD2 H 1 1.631 0.03 . 2 . . . A 195 LYS HD2 . 11457 1 448 . 1 1 40 40 LYS HD3 H 1 1.7 0.03 . 2 . . . A 195 LYS HD3 . 11457 1 449 . 1 1 40 40 LYS HE2 H 1 3.006 0.03 . 1 . . . A 195 LYS HE2 . 11457 1 450 . 1 1 40 40 LYS HE3 H 1 3.006 0.03 . 1 . . . A 195 LYS HE3 . 11457 1 451 . 1 1 40 40 LYS C C 13 175.726 0.3 . 1 . . . A 195 LYS C . 11457 1 452 . 1 1 40 40 LYS CA C 13 57.062 0.3 . 1 . . . A 195 LYS CA . 11457 1 453 . 1 1 40 40 LYS CB C 13 28.677 0.3 . 1 . . . A 195 LYS CB . 11457 1 454 . 1 1 40 40 LYS CG C 13 24.904 0.3 . 1 . . . A 195 LYS CG . 11457 1 455 . 1 1 40 40 LYS CD C 13 29.216 0.3 . 1 . . . A 195 LYS CD . 11457 1 456 . 1 1 40 40 LYS CE C 13 42.51 0.3 . 1 . . . A 195 LYS CE . 11457 1 457 . 1 1 40 40 LYS N N 15 116.665 0.3 . 1 . . . A 195 LYS N . 11457 1 458 . 1 1 41 41 ILE H H 1 7.994 0.03 . 1 . . . A 196 ILE H . 11457 1 459 . 1 1 41 41 ILE HA H 1 4.258 0.03 . 1 . . . A 196 ILE HA . 11457 1 460 . 1 1 41 41 ILE HB H 1 1.494 0.03 . 1 . . . A 196 ILE HB . 11457 1 461 . 1 1 41 41 ILE HG12 H 1 0.987 0.03 . 2 . . . A 196 ILE HG12 . 11457 1 462 . 1 1 41 41 ILE HG13 H 1 1.328 0.03 . 2 . . . A 196 ILE HG13 . 11457 1 463 . 1 1 41 41 ILE HG21 H 1 0.589 0.03 . 1 . . . A 196 ILE HG21 . 11457 1 464 . 1 1 41 41 ILE HG22 H 1 0.589 0.03 . 1 . . . A 196 ILE HG22 . 11457 1 465 . 1 1 41 41 ILE HG23 H 1 0.589 0.03 . 1 . . . A 196 ILE HG23 . 11457 1 466 . 1 1 41 41 ILE HD11 H 1 0.936 0.03 . 1 . . . A 196 ILE HD11 . 11457 1 467 . 1 1 41 41 ILE HD12 H 1 0.936 0.03 . 1 . . . A 196 ILE HD12 . 11457 1 468 . 1 1 41 41 ILE HD13 H 1 0.936 0.03 . 1 . . . A 196 ILE HD13 . 11457 1 469 . 1 1 41 41 ILE C C 13 174.789 0.3 . 1 . . . A 196 ILE C . 11457 1 470 . 1 1 41 41 ILE CA C 13 59.873 0.3 . 1 . . . A 196 ILE CA . 11457 1 471 . 1 1 41 41 ILE CB C 13 41.504 0.3 . 1 . . . A 196 ILE CB . 11457 1 472 . 1 1 41 41 ILE CG1 C 13 27.05 0.3 . 1 . . . A 196 ILE CG1 . 11457 1 473 . 1 1 41 41 ILE CG2 C 13 17.359 0.3 . 1 . . . A 196 ILE CG2 . 11457 1 474 . 1 1 41 41 ILE CD1 C 13 14.154 0.3 . 1 . . . A 196 ILE CD1 . 11457 1 475 . 1 1 41 41 ILE N N 15 117.095 0.3 . 1 . . . A 196 ILE N . 11457 1 476 . 1 1 42 42 GLN H H 1 8.202 0.03 . 1 . . . A 197 GLN H . 11457 1 477 . 1 1 42 42 GLN HA H 1 4.171 0.03 . 1 . . . A 197 GLN HA . 11457 1 478 . 1 1 42 42 GLN HB2 H 1 1.799 0.03 . 2 . . . A 197 GLN HB2 . 11457 1 479 . 1 1 42 42 GLN HB3 H 1 1.892 0.03 . 2 . . . A 197 GLN HB3 . 11457 1 480 . 1 1 42 42 GLN HG2 H 1 2.182 0.03 . 1 . . . A 197 GLN HG2 . 11457 1 481 . 1 1 42 42 GLN HG3 H 1 2.182 0.03 . 1 . . . A 197 GLN HG3 . 11457 1 482 . 1 1 42 42 GLN HE21 H 1 6.765 0.03 . 2 . . . A 197 GLN HE21 . 11457 1 483 . 1 1 42 42 GLN HE22 H 1 7.467 0.03 . 2 . . . A 197 GLN HE22 . 11457 1 484 . 1 1 42 42 GLN C C 13 174.951 0.3 . 1 . . . A 197 GLN C . 11457 1 485 . 1 1 42 42 GLN CA C 13 54.386 0.3 . 1 . . . A 197 GLN CA . 11457 1 486 . 1 1 42 42 GLN CB C 13 29.777 0.3 . 1 . . . A 197 GLN CB . 11457 1 487 . 1 1 42 42 GLN CG C 13 33.643 0.3 . 1 . . . A 197 GLN CG . 11457 1 488 . 1 1 42 42 GLN N N 15 122.58 0.3 . 1 . . . A 197 GLN N . 11457 1 489 . 1 1 42 42 GLN NE2 N 15 112.352 0.3 . 1 . . . A 197 GLN NE2 . 11457 1 490 . 1 1 43 43 GLY H H 1 7.364 0.03 . 1 . . . A 198 GLY H . 11457 1 491 . 1 1 43 43 GLY HA2 H 1 3.058 0.03 . 2 . . . A 198 GLY HA2 . 11457 1 492 . 1 1 43 43 GLY HA3 H 1 3.852 0.03 . 2 . . . A 198 GLY HA3 . 11457 1 493 . 1 1 43 43 GLY C C 13 172.133 0.3 . 1 . . . A 198 GLY C . 11457 1 494 . 1 1 43 43 GLY CA C 13 45.148 0.3 . 1 . . . A 198 GLY CA . 11457 1 495 . 1 1 43 43 GLY N N 15 110.969 0.3 . 1 . . . A 198 GLY N . 11457 1 496 . 1 1 44 44 GLU H H 1 8.105 0.03 . 1 . . . A 199 GLU H . 11457 1 497 . 1 1 44 44 GLU HA H 1 4.484 0.03 . 1 . . . A 199 GLU HA . 11457 1 498 . 1 1 44 44 GLU HB2 H 1 1.765 0.03 . 2 . . . A 199 GLU HB2 . 11457 1 499 . 1 1 44 44 GLU HB3 H 1 1.904 0.03 . 2 . . . A 199 GLU HB3 . 11457 1 500 . 1 1 44 44 GLU HG2 H 1 2.078 0.03 . 2 . . . A 199 GLU HG2 . 11457 1 501 . 1 1 44 44 GLU HG3 H 1 2.186 0.03 . 2 . . . A 199 GLU HG3 . 11457 1 502 . 1 1 44 44 GLU C C 13 174.918 0.3 . 1 . . . A 199 GLU C . 11457 1 503 . 1 1 44 44 GLU CA C 13 54.603 0.3 . 1 . . . A 199 GLU CA . 11457 1 504 . 1 1 44 44 GLU CB C 13 32.427 0.3 . 1 . . . A 199 GLU CB . 11457 1 505 . 1 1 44 44 GLU CG C 13 35.785 0.3 . 1 . . . A 199 GLU CG . 11457 1 506 . 1 1 44 44 GLU N N 15 122.675 0.3 . 1 . . . A 199 GLU N . 11457 1 507 . 1 1 45 45 TYR H H 1 8.245 0.03 . 1 . . . A 200 TYR H . 11457 1 508 . 1 1 45 45 TYR HA H 1 4.36 0.03 . 1 . . . A 200 TYR HA . 11457 1 509 . 1 1 45 45 TYR HB2 H 1 1.997 0.03 . 2 . . . A 200 TYR HB2 . 11457 1 510 . 1 1 45 45 TYR HB3 H 1 2.472 0.03 . 2 . . . A 200 TYR HB3 . 11457 1 511 . 1 1 45 45 TYR HD1 H 1 6.962 0.03 . 1 . . . A 200 TYR HD1 . 11457 1 512 . 1 1 45 45 TYR HD2 H 1 6.962 0.03 . 1 . . . A 200 TYR HD2 . 11457 1 513 . 1 1 45 45 TYR HE1 H 1 6.641 0.03 . 1 . . . A 200 TYR HE1 . 11457 1 514 . 1 1 45 45 TYR HE2 H 1 6.641 0.03 . 1 . . . A 200 TYR HE2 . 11457 1 515 . 1 1 45 45 TYR C C 13 175.251 0.3 . 1 . . . A 200 TYR C . 11457 1 516 . 1 1 45 45 TYR CA C 13 58.713 0.3 . 1 . . . A 200 TYR CA . 11457 1 517 . 1 1 45 45 TYR CB C 13 39.638 0.3 . 1 . . . A 200 TYR CB . 11457 1 518 . 1 1 45 45 TYR CD1 C 13 132.726 0.3 . 1 . . . A 200 TYR CD1 . 11457 1 519 . 1 1 45 45 TYR CD2 C 13 132.726 0.3 . 1 . . . A 200 TYR CD2 . 11457 1 520 . 1 1 45 45 TYR CE1 C 13 118.734 0.3 . 1 . . . A 200 TYR CE1 . 11457 1 521 . 1 1 45 45 TYR CE2 C 13 118.734 0.3 . 1 . . . A 200 TYR CE2 . 11457 1 522 . 1 1 45 45 TYR N N 15 123.367 0.3 . 1 . . . A 200 TYR N . 11457 1 523 . 1 1 46 46 LYS H H 1 8.856 0.03 . 1 . . . A 201 LYS H . 11457 1 524 . 1 1 46 46 LYS HA H 1 4.591 0.03 . 1 . . . A 201 LYS HA . 11457 1 525 . 1 1 46 46 LYS HB2 H 1 1.73 0.03 . 1 . . . A 201 LYS HB2 . 11457 1 526 . 1 1 46 46 LYS HB3 H 1 1.73 0.03 . 1 . . . A 201 LYS HB3 . 11457 1 527 . 1 1 46 46 LYS HG2 H 1 1.458 0.03 . 2 . . . A 201 LYS HG2 . 11457 1 528 . 1 1 46 46 LYS HG3 H 1 1.274 0.03 . 2 . . . A 201 LYS HG3 . 11457 1 529 . 1 1 46 46 LYS HD2 H 1 1.649 0.03 . 2 . . . A 201 LYS HD2 . 11457 1 530 . 1 1 46 46 LYS HD3 H 1 1.593 0.03 . 2 . . . A 201 LYS HD3 . 11457 1 531 . 1 1 46 46 LYS HE2 H 1 2.914 0.03 . 1 . . . A 201 LYS HE2 . 11457 1 532 . 1 1 46 46 LYS HE3 H 1 2.914 0.03 . 1 . . . A 201 LYS HE3 . 11457 1 533 . 1 1 46 46 LYS C C 13 176.541 0.3 . 1 . . . A 201 LYS C . 11457 1 534 . 1 1 46 46 LYS CA C 13 54.886 0.3 . 1 . . . A 201 LYS CA . 11457 1 535 . 1 1 46 46 LYS CB C 13 33.883 0.3 . 1 . . . A 201 LYS CB . 11457 1 536 . 1 1 46 46 LYS CG C 13 24.904 0.3 . 1 . . . A 201 LYS CG . 11457 1 537 . 1 1 46 46 LYS CD C 13 29.29 0.3 . 1 . . . A 201 LYS CD . 11457 1 538 . 1 1 46 46 LYS CE C 13 42.331 0.3 . 1 . . . A 201 LYS CE . 11457 1 539 . 1 1 46 46 LYS N N 15 122.791 0.3 . 1 . . . A 201 LYS N . 11457 1 540 . 1 1 47 47 TYR H H 1 9.13 0.03 . 1 . . . A 202 TYR H . 11457 1 541 . 1 1 47 47 TYR HA H 1 5.905 0.03 . 1 . . . A 202 TYR HA . 11457 1 542 . 1 1 47 47 TYR HB2 H 1 2.936 0.03 . 1 . . . A 202 TYR HB2 . 11457 1 543 . 1 1 47 47 TYR HB3 H 1 2.936 0.03 . 1 . . . A 202 TYR HB3 . 11457 1 544 . 1 1 47 47 TYR HD1 H 1 7.019 0.03 . 1 . . . A 202 TYR HD1 . 11457 1 545 . 1 1 47 47 TYR HD2 H 1 7.019 0.03 . 1 . . . A 202 TYR HD2 . 11457 1 546 . 1 1 47 47 TYR HE1 H 1 6.744 0.03 . 1 . . . A 202 TYR HE1 . 11457 1 547 . 1 1 47 47 TYR HE2 H 1 6.744 0.03 . 1 . . . A 202 TYR HE2 . 11457 1 548 . 1 1 47 47 TYR C C 13 176.585 0.3 . 1 . . . A 202 TYR C . 11457 1 549 . 1 1 47 47 TYR CA C 13 57.422 0.3 . 1 . . . A 202 TYR CA . 11457 1 550 . 1 1 47 47 TYR CB C 13 41.526 0.3 . 1 . . . A 202 TYR CB . 11457 1 551 . 1 1 47 47 TYR CD1 C 13 132.908 0.3 . 1 . . . A 202 TYR CD1 . 11457 1 552 . 1 1 47 47 TYR CD2 C 13 132.908 0.3 . 1 . . . A 202 TYR CD2 . 11457 1 553 . 1 1 47 47 TYR CE1 C 13 118.263 0.3 . 1 . . . A 202 TYR CE1 . 11457 1 554 . 1 1 47 47 TYR CE2 C 13 118.263 0.3 . 1 . . . A 202 TYR CE2 . 11457 1 555 . 1 1 47 47 TYR N N 15 125.575 0.3 . 1 . . . A 202 TYR N . 11457 1 556 . 1 1 48 48 THR H H 1 9.266 0.03 . 1 . . . A 203 THR H . 11457 1 557 . 1 1 48 48 THR HA H 1 4.543 0.03 . 1 . . . A 203 THR HA . 11457 1 558 . 1 1 48 48 THR HB H 1 3.851 0.03 . 1 . . . A 203 THR HB . 11457 1 559 . 1 1 48 48 THR HG21 H 1 1.166 0.03 . 1 . . . A 203 THR HG21 . 11457 1 560 . 1 1 48 48 THR HG22 H 1 1.166 0.03 . 1 . . . A 203 THR HG22 . 11457 1 561 . 1 1 48 48 THR HG23 H 1 1.166 0.03 . 1 . . . A 203 THR HG23 . 11457 1 562 . 1 1 48 48 THR C C 13 172.845 0.3 . 1 . . . A 203 THR C . 11457 1 563 . 1 1 48 48 THR CA C 13 62.013 0.3 . 1 . . . A 203 THR CA . 11457 1 564 . 1 1 48 48 THR CB C 13 71.795 0.3 . 1 . . . A 203 THR CB . 11457 1 565 . 1 1 48 48 THR CG2 C 13 20.952 0.3 . 1 . . . A 203 THR CG2 . 11457 1 566 . 1 1 48 48 THR N N 15 118.773 0.3 . 1 . . . A 203 THR N . 11457 1 567 . 1 1 49 49 GLN H H 1 8.976 0.03 . 1 . . . A 204 GLN H . 11457 1 568 . 1 1 49 49 GLN HA H 1 4.272 0.03 . 1 . . . A 204 GLN HA . 11457 1 569 . 1 1 49 49 GLN HB2 H 1 1.826 0.03 . 1 . . . A 204 GLN HB2 . 11457 1 570 . 1 1 49 49 GLN HB3 H 1 1.826 0.03 . 1 . . . A 204 GLN HB3 . 11457 1 571 . 1 1 49 49 GLN HG2 H 1 1.719 0.03 . 2 . . . A 204 GLN HG2 . 11457 1 572 . 1 1 49 49 GLN HG3 H 1 1.919 0.03 . 2 . . . A 204 GLN HG3 . 11457 1 573 . 1 1 49 49 GLN HE21 H 1 7.1 0.03 . 2 . . . A 204 GLN HE21 . 11457 1 574 . 1 1 49 49 GLN HE22 H 1 7.3 0.03 . 2 . . . A 204 GLN HE22 . 11457 1 575 . 1 1 49 49 GLN C C 13 174.562 0.3 . 1 . . . A 204 GLN C . 11457 1 576 . 1 1 49 49 GLN CA C 13 55.889 0.3 . 1 . . . A 204 GLN CA . 11457 1 577 . 1 1 49 49 GLN CB C 13 30.045 0.3 . 1 . . . A 204 GLN CB . 11457 1 578 . 1 1 49 49 GLN CG C 13 34.702 0.3 . 1 . . . A 204 GLN CG . 11457 1 579 . 1 1 49 49 GLN N N 15 127.36 0.3 . 1 . . . A 204 GLN N . 11457 1 580 . 1 1 49 49 GLN NE2 N 15 112.77 0.3 . 1 . . . A 204 GLN NE2 . 11457 1 581 . 1 1 50 50 VAL H H 1 8.513 0.03 . 1 . . . A 205 VAL H . 11457 1 582 . 1 1 50 50 VAL HA H 1 4.336 0.03 . 1 . . . A 205 VAL HA . 11457 1 583 . 1 1 50 50 VAL HB H 1 1.998 0.03 . 1 . . . A 205 VAL HB . 11457 1 584 . 1 1 50 50 VAL HG11 H 1 0.668 0.03 . 1 . . . A 205 VAL HG11 . 11457 1 585 . 1 1 50 50 VAL HG12 H 1 0.668 0.03 . 1 . . . A 205 VAL HG12 . 11457 1 586 . 1 1 50 50 VAL HG13 H 1 0.668 0.03 . 1 . . . A 205 VAL HG13 . 11457 1 587 . 1 1 50 50 VAL HG21 H 1 0.764 0.03 . 1 . . . A 205 VAL HG21 . 11457 1 588 . 1 1 50 50 VAL HG22 H 1 0.764 0.03 . 1 . . . A 205 VAL HG22 . 11457 1 589 . 1 1 50 50 VAL HG23 H 1 0.764 0.03 . 1 . . . A 205 VAL HG23 . 11457 1 590 . 1 1 50 50 VAL C C 13 175.246 0.3 . 1 . . . A 205 VAL C . 11457 1 591 . 1 1 50 50 VAL CA C 13 60.78 0.3 . 1 . . . A 205 VAL CA . 11457 1 592 . 1 1 50 50 VAL CB C 13 34.536 0.3 . 1 . . . A 205 VAL CB . 11457 1 593 . 1 1 50 50 VAL CG1 C 13 19.67 0.3 . 2 . . . A 205 VAL CG1 . 11457 1 594 . 1 1 50 50 VAL CG2 C 13 21.67 0.3 . 2 . . . A 205 VAL CG2 . 11457 1 595 . 1 1 50 50 VAL N N 15 123.634 0.3 . 1 . . . A 205 VAL N . 11457 1 596 . 1 1 51 51 GLY H H 1 8.188 0.03 . 1 . . . A 206 GLY H . 11457 1 597 . 1 1 51 51 GLY HA2 H 1 4.54 0.03 . 2 . . . A 206 GLY HA2 . 11457 1 598 . 1 1 51 51 GLY HA3 H 1 3.81 0.03 . 2 . . . A 206 GLY HA3 . 11457 1 599 . 1 1 51 51 GLY C C 13 172.12 0.3 . 1 . . . A 206 GLY C . 11457 1 600 . 1 1 51 51 GLY CA C 13 43.905 0.3 . 1 . . . A 206 GLY CA . 11457 1 601 . 1 1 51 51 GLY N N 15 109.656 0.3 . 1 . . . A 206 GLY N . 11457 1 602 . 1 1 52 52 PRO HA H 1 4.536 0.03 . 1 . . . A 207 PRO HA . 11457 1 603 . 1 1 52 52 PRO HB2 H 1 2.209 0.03 . 2 . . . A 207 PRO HB2 . 11457 1 604 . 1 1 52 52 PRO HB3 H 1 1.852 0.03 . 2 . . . A 207 PRO HB3 . 11457 1 605 . 1 1 52 52 PRO HG2 H 1 1.216 0.03 . 2 . . . A 207 PRO HG2 . 11457 1 606 . 1 1 52 52 PRO HG3 H 1 1.946 0.03 . 2 . . . A 207 PRO HG3 . 11457 1 607 . 1 1 52 52 PRO HD2 H 1 3.461 0.03 . 2 . . . A 207 PRO HD2 . 11457 1 608 . 1 1 52 52 PRO HD3 H 1 3.571 0.03 . 2 . . . A 207 PRO HD3 . 11457 1 609 . 1 1 52 52 PRO C C 13 177.109 0.3 . 1 . . . A 207 PRO C . 11457 1 610 . 1 1 52 52 PRO CA C 13 62.201 0.3 . 1 . . . A 207 PRO CA . 11457 1 611 . 1 1 52 52 PRO CB C 13 32.561 0.3 . 1 . . . A 207 PRO CB . 11457 1 612 . 1 1 52 52 PRO CG C 13 26.88 0.3 . 1 . . . A 207 PRO CG . 11457 1 613 . 1 1 52 52 PRO CD C 13 48.797 0.3 . 1 . . . A 207 PRO CD . 11457 1 614 . 1 1 53 53 ASP H H 1 8.578 0.03 . 1 . . . A 208 ASP H . 11457 1 615 . 1 1 53 53 ASP HA H 1 4.003 0.03 . 1 . . . A 208 ASP HA . 11457 1 616 . 1 1 53 53 ASP HB2 H 1 2.576 0.03 . 2 . . . A 208 ASP HB2 . 11457 1 617 . 1 1 53 53 ASP HB3 H 1 2.605 0.03 . 2 . . . A 208 ASP HB3 . 11457 1 618 . 1 1 53 53 ASP C C 13 177.069 0.3 . 1 . . . A 208 ASP C . 11457 1 619 . 1 1 53 53 ASP CA C 13 57.663 0.3 . 1 . . . A 208 ASP CA . 11457 1 620 . 1 1 53 53 ASP CB C 13 40.318 0.3 . 1 . . . A 208 ASP CB . 11457 1 621 . 1 1 53 53 ASP N N 15 118.547 0.3 . 1 . . . A 208 ASP N . 11457 1 622 . 1 1 54 54 HIS HA H 1 4.579 0.03 . 1 . . . A 209 HIS HA . 11457 1 623 . 1 1 54 54 HIS HB2 H 1 3.032 0.03 . 2 . . . A 209 HIS HB2 . 11457 1 624 . 1 1 54 54 HIS HB3 H 1 3.322 0.03 . 2 . . . A 209 HIS HB3 . 11457 1 625 . 1 1 54 54 HIS HD2 H 1 7.02 0.03 . 1 . . . A 209 HIS HD2 . 11457 1 626 . 1 1 54 54 HIS HE1 H 1 7.949 0.03 . 1 . . . A 209 HIS HE1 . 11457 1 627 . 1 1 54 54 HIS C C 13 174.683 0.3 . 1 . . . A 209 HIS C . 11457 1 628 . 1 1 54 54 HIS CA C 13 56.164 0.3 . 1 . . . A 209 HIS CA . 11457 1 629 . 1 1 54 54 HIS CB C 13 29.628 0.3 . 1 . . . A 209 HIS CB . 11457 1 630 . 1 1 54 54 HIS CD2 C 13 119.033 0.3 . 1 . . . A 209 HIS CD2 . 11457 1 631 . 1 1 54 54 HIS CE1 C 13 138.747 0.3 . 1 . . . A 209 HIS CE1 . 11457 1 632 . 1 1 55 55 ASN H H 1 7.655 0.03 . 1 . . . A 210 ASN H . 11457 1 633 . 1 1 55 55 ASN HA H 1 4.77 0.03 . 1 . . . A 210 ASN HA . 11457 1 634 . 1 1 55 55 ASN HB2 H 1 2.379 0.03 . 1 . . . A 210 ASN HB2 . 11457 1 635 . 1 1 55 55 ASN HB3 H 1 2.379 0.03 . 1 . . . A 210 ASN HB3 . 11457 1 636 . 1 1 55 55 ASN HD21 H 1 7.437 0.03 . 2 . . . A 210 ASN HD21 . 11457 1 637 . 1 1 55 55 ASN HD22 H 1 6.722 0.03 . 2 . . . A 210 ASN HD22 . 11457 1 638 . 1 1 55 55 ASN C C 13 172.457 0.3 . 1 . . . A 210 ASN C . 11457 1 639 . 1 1 55 55 ASN CA C 13 52.669 0.3 . 1 . . . A 210 ASN CA . 11457 1 640 . 1 1 55 55 ASN CB C 13 38.169 0.3 . 1 . . . A 210 ASN CB . 11457 1 641 . 1 1 55 55 ASN N N 15 121.628 0.3 . 1 . . . A 210 ASN N . 11457 1 642 . 1 1 55 55 ASN ND2 N 15 110.864 0.3 . 1 . . . A 210 ASN ND2 . 11457 1 643 . 1 1 56 56 ARG H H 1 8.238 0.03 . 1 . . . A 211 ARG H . 11457 1 644 . 1 1 56 56 ARG HA H 1 4.636 0.03 . 1 . . . A 211 ARG HA . 11457 1 645 . 1 1 56 56 ARG HB2 H 1 1.63 0.03 . 1 . . . A 211 ARG HB2 . 11457 1 646 . 1 1 56 56 ARG HB3 H 1 1.63 0.03 . 1 . . . A 211 ARG HB3 . 11457 1 647 . 1 1 56 56 ARG HG2 H 1 1.38 0.03 . 2 . . . A 211 ARG HG2 . 11457 1 648 . 1 1 56 56 ARG HG3 H 1 1.631 0.03 . 2 . . . A 211 ARG HG3 . 11457 1 649 . 1 1 56 56 ARG HD2 H 1 2.779 0.03 . 2 . . . A 211 ARG HD2 . 11457 1 650 . 1 1 56 56 ARG HD3 H 1 2.965 0.03 . 2 . . . A 211 ARG HD3 . 11457 1 651 . 1 1 56 56 ARG HE H 1 6.747 0.03 . 1 . . . A 211 ARG HE . 11457 1 652 . 1 1 56 56 ARG C C 13 176.178 0.3 . 1 . . . A 211 ARG C . 11457 1 653 . 1 1 56 56 ARG CA C 13 55.279 0.3 . 1 . . . A 211 ARG CA . 11457 1 654 . 1 1 56 56 ARG CB C 13 31.043 0.3 . 1 . . . A 211 ARG CB . 11457 1 655 . 1 1 56 56 ARG CG C 13 25.611 0.3 . 1 . . . A 211 ARG CG . 11457 1 656 . 1 1 56 56 ARG CD C 13 43.15 0.3 . 1 . . . A 211 ARG CD . 11457 1 657 . 1 1 56 56 ARG N N 15 122.254 0.3 . 1 . . . A 211 ARG N . 11457 1 658 . 1 1 57 57 SER H H 1 8.788 0.03 . 1 . . . A 212 SER H . 11457 1 659 . 1 1 57 57 SER HA H 1 4.571 0.03 . 1 . . . A 212 SER HA . 11457 1 660 . 1 1 57 57 SER HB2 H 1 3.811 0.03 . 2 . . . A 212 SER HB2 . 11457 1 661 . 1 1 57 57 SER HB3 H 1 4.037 0.03 . 2 . . . A 212 SER HB3 . 11457 1 662 . 1 1 57 57 SER C C 13 172.11 0.3 . 1 . . . A 212 SER C . 11457 1 663 . 1 1 57 57 SER CA C 13 57.961 0.3 . 1 . . . A 212 SER CA . 11457 1 664 . 1 1 57 57 SER CB C 13 64.317 0.3 . 1 . . . A 212 SER CB . 11457 1 665 . 1 1 57 57 SER N N 15 117.701 0.3 . 1 . . . A 212 SER N . 11457 1 666 . 1 1 58 58 PHE H H 1 8.521 0.03 . 1 . . . A 213 PHE H . 11457 1 667 . 1 1 58 58 PHE HA H 1 5.457 0.03 . 1 . . . A 213 PHE HA . 11457 1 668 . 1 1 58 58 PHE HB2 H 1 2.363 0.03 . 2 . . . A 213 PHE HB2 . 11457 1 669 . 1 1 58 58 PHE HB3 H 1 2.744 0.03 . 2 . . . A 213 PHE HB3 . 11457 1 670 . 1 1 58 58 PHE HD1 H 1 6.829 0.03 . 1 . . . A 213 PHE HD1 . 11457 1 671 . 1 1 58 58 PHE HD2 H 1 6.829 0.03 . 1 . . . A 213 PHE HD2 . 11457 1 672 . 1 1 58 58 PHE HE1 H 1 7.328 0.03 . 1 . . . A 213 PHE HE1 . 11457 1 673 . 1 1 58 58 PHE HE2 H 1 7.328 0.03 . 1 . . . A 213 PHE HE2 . 11457 1 674 . 1 1 58 58 PHE HZ H 1 7.25 0.03 . 1 . . . A 213 PHE HZ . 11457 1 675 . 1 1 58 58 PHE C C 13 174.477 0.3 . 1 . . . A 213 PHE C . 11457 1 676 . 1 1 58 58 PHE CA C 13 57.961 0.3 . 1 . . . A 213 PHE CA . 11457 1 677 . 1 1 58 58 PHE CB C 13 44.564 0.3 . 1 . . . A 213 PHE CB . 11457 1 678 . 1 1 58 58 PHE CD1 C 13 131.018 0.3 . 1 . . . A 213 PHE CD1 . 11457 1 679 . 1 1 58 58 PHE CD2 C 13 131.018 0.3 . 1 . . . A 213 PHE CD2 . 11457 1 680 . 1 1 58 58 PHE CE1 C 13 131.351 0.3 . 1 . . . A 213 PHE CE1 . 11457 1 681 . 1 1 58 58 PHE CE2 C 13 131.351 0.3 . 1 . . . A 213 PHE CE2 . 11457 1 682 . 1 1 58 58 PHE CZ C 13 130.002 0.3 . 1 . . . A 213 PHE CZ . 11457 1 683 . 1 1 58 58 PHE N N 15 114.344 0.3 . 1 . . . A 213 PHE N . 11457 1 684 . 1 1 59 59 ILE H H 1 9.066 0.03 . 1 . . . A 214 ILE H . 11457 1 685 . 1 1 59 59 ILE HA H 1 4.71 0.03 . 1 . . . A 214 ILE HA . 11457 1 686 . 1 1 59 59 ILE HB H 1 1.606 0.03 . 1 . . . A 214 ILE HB . 11457 1 687 . 1 1 59 59 ILE HG12 H 1 1.375 0.03 . 2 . . . A 214 ILE HG12 . 11457 1 688 . 1 1 59 59 ILE HG13 H 1 0.469 0.03 . 2 . . . A 214 ILE HG13 . 11457 1 689 . 1 1 59 59 ILE HG21 H 1 0.66 0.03 . 1 . . . A 214 ILE HG21 . 11457 1 690 . 1 1 59 59 ILE HG22 H 1 0.66 0.03 . 1 . . . A 214 ILE HG22 . 11457 1 691 . 1 1 59 59 ILE HG23 H 1 0.66 0.03 . 1 . . . A 214 ILE HG23 . 11457 1 692 . 1 1 59 59 ILE HD11 H 1 0.638 0.03 . 1 . . . A 214 ILE HD11 . 11457 1 693 . 1 1 59 59 ILE HD12 H 1 0.638 0.03 . 1 . . . A 214 ILE HD12 . 11457 1 694 . 1 1 59 59 ILE HD13 H 1 0.638 0.03 . 1 . . . A 214 ILE HD13 . 11457 1 695 . 1 1 59 59 ILE C C 13 175.477 0.3 . 1 . . . A 214 ILE C . 11457 1 696 . 1 1 59 59 ILE CA C 13 59.736 0.3 . 1 . . . A 214 ILE CA . 11457 1 697 . 1 1 59 59 ILE CB C 13 40.544 0.3 . 1 . . . A 214 ILE CB . 11457 1 698 . 1 1 59 59 ILE CG1 C 13 27.599 0.3 . 1 . . . A 214 ILE CG1 . 11457 1 699 . 1 1 59 59 ILE CG2 C 13 18.423 0.3 . 1 . . . A 214 ILE CG2 . 11457 1 700 . 1 1 59 59 ILE CD1 C 13 13.406 0.3 . 1 . . . A 214 ILE CD1 . 11457 1 701 . 1 1 59 59 ILE N N 15 120.432 0.3 . 1 . . . A 214 ILE N . 11457 1 702 . 1 1 60 60 ALA H H 1 9.089 0.03 . 1 . . . A 215 ALA H . 11457 1 703 . 1 1 60 60 ALA HA H 1 5.273 0.03 . 1 . . . A 215 ALA HA . 11457 1 704 . 1 1 60 60 ALA HB1 H 1 1.052 0.03 . 1 . . . A 215 ALA HB1 . 11457 1 705 . 1 1 60 60 ALA HB2 H 1 1.052 0.03 . 1 . . . A 215 ALA HB2 . 11457 1 706 . 1 1 60 60 ALA HB3 H 1 1.052 0.03 . 1 . . . A 215 ALA HB3 . 11457 1 707 . 1 1 60 60 ALA C C 13 175.166 0.3 . 1 . . . A 215 ALA C . 11457 1 708 . 1 1 60 60 ALA CA C 13 50.123 0.3 . 1 . . . A 215 ALA CA . 11457 1 709 . 1 1 60 60 ALA CB C 13 21.814 0.3 . 1 . . . A 215 ALA CB . 11457 1 710 . 1 1 60 60 ALA N N 15 127.317 0.3 . 1 . . . A 215 ALA N . 11457 1 711 . 1 1 61 61 GLU H H 1 8.787 0.03 . 1 . . . A 216 GLU H . 11457 1 712 . 1 1 61 61 GLU HA H 1 5.573 0.03 . 1 . . . A 216 GLU HA . 11457 1 713 . 1 1 61 61 GLU HB2 H 1 1.951 0.03 . 2 . . . A 216 GLU HB2 . 11457 1 714 . 1 1 61 61 GLU HB3 H 1 2.095 0.03 . 2 . . . A 216 GLU HB3 . 11457 1 715 . 1 1 61 61 GLU HG2 H 1 2.17 0.03 . 2 . . . A 216 GLU HG2 . 11457 1 716 . 1 1 61 61 GLU HG3 H 1 2.205 0.03 . 2 . . . A 216 GLU HG3 . 11457 1 717 . 1 1 61 61 GLU C C 13 174.613 0.3 . 1 . . . A 216 GLU C . 11457 1 718 . 1 1 61 61 GLU CA C 13 53.873 0.3 . 1 . . . A 216 GLU CA . 11457 1 719 . 1 1 61 61 GLU CB C 13 35.504 0.3 . 1 . . . A 216 GLU CB . 11457 1 720 . 1 1 61 61 GLU CG C 13 37.301 0.3 . 1 . . . A 216 GLU CG . 11457 1 721 . 1 1 61 61 GLU N N 15 120.138 0.3 . 1 . . . A 216 GLU N . 11457 1 722 . 1 1 62 62 MET H H 1 8.089 0.03 . 1 . . . A 217 MET H . 11457 1 723 . 1 1 62 62 MET HA H 1 4.517 0.03 . 1 . . . A 217 MET HA . 11457 1 724 . 1 1 62 62 MET HB2 H 1 1.471 0.03 . 2 . . . A 217 MET HB2 . 11457 1 725 . 1 1 62 62 MET HB3 H 1 1.913 0.03 . 2 . . . A 217 MET HB3 . 11457 1 726 . 1 1 62 62 MET HG2 H 1 2.008 0.03 . 2 . . . A 217 MET HG2 . 11457 1 727 . 1 1 62 62 MET HG3 H 1 2.248 0.03 . 2 . . . A 217 MET HG3 . 11457 1 728 . 1 1 62 62 MET HE1 H 1 0.851 0.03 . 1 . . . A 217 MET HE1 . 11457 1 729 . 1 1 62 62 MET HE2 H 1 0.851 0.03 . 1 . . . A 217 MET HE2 . 11457 1 730 . 1 1 62 62 MET HE3 H 1 0.851 0.03 . 1 . . . A 217 MET HE3 . 11457 1 731 . 1 1 62 62 MET C C 13 173.163 0.3 . 1 . . . A 217 MET C . 11457 1 732 . 1 1 62 62 MET CA C 13 56.344 0.3 . 1 . . . A 217 MET CA . 11457 1 733 . 1 1 62 62 MET CB C 13 38.019 0.3 . 1 . . . A 217 MET CB . 11457 1 734 . 1 1 62 62 MET CG C 13 31.372 0.3 . 1 . . . A 217 MET CG . 11457 1 735 . 1 1 62 62 MET CE C 13 15.203 0.3 . 1 . . . A 217 MET CE . 11457 1 736 . 1 1 62 62 MET N N 15 120.567 0.3 . 1 . . . A 217 MET N . 11457 1 737 . 1 1 63 63 THR H H 1 8.145 0.03 . 1 . . . A 218 THR H . 11457 1 738 . 1 1 63 63 THR HA H 1 5.3 0.03 . 1 . . . A 218 THR HA . 11457 1 739 . 1 1 63 63 THR HB H 1 3.958 0.03 . 1 . . . A 218 THR HB . 11457 1 740 . 1 1 63 63 THR HG21 H 1 1.147 0.03 . 1 . . . A 218 THR HG21 . 11457 1 741 . 1 1 63 63 THR HG22 H 1 1.147 0.03 . 1 . . . A 218 THR HG22 . 11457 1 742 . 1 1 63 63 THR HG23 H 1 1.147 0.03 . 1 . . . A 218 THR HG23 . 11457 1 743 . 1 1 63 63 THR C C 13 173.584 0.3 . 1 . . . A 218 THR C . 11457 1 744 . 1 1 63 63 THR CA C 13 60.476 0.3 . 1 . . . A 218 THR CA . 11457 1 745 . 1 1 63 63 THR CB C 13 70.636 0.3 . 1 . . . A 218 THR CB . 11457 1 746 . 1 1 63 63 THR CG2 C 13 20.952 0.3 . 1 . . . A 218 THR CG2 . 11457 1 747 . 1 1 63 63 THR N N 15 120.331 0.3 . 1 . . . A 218 THR N . 11457 1 748 . 1 1 64 64 ILE H H 1 8.55 0.03 . 1 . . . A 219 ILE H . 11457 1 749 . 1 1 64 64 ILE HA H 1 4.56 0.03 . 1 . . . A 219 ILE HA . 11457 1 750 . 1 1 64 64 ILE HB H 1 1.595 0.03 . 1 . . . A 219 ILE HB . 11457 1 751 . 1 1 64 64 ILE HG12 H 1 1.015 0.03 . 2 . . . A 219 ILE HG12 . 11457 1 752 . 1 1 64 64 ILE HG13 H 1 1.44 0.03 . 2 . . . A 219 ILE HG13 . 11457 1 753 . 1 1 64 64 ILE HG21 H 1 0.889 0.03 . 1 . . . A 219 ILE HG21 . 11457 1 754 . 1 1 64 64 ILE HG22 H 1 0.889 0.03 . 1 . . . A 219 ILE HG22 . 11457 1 755 . 1 1 64 64 ILE HG23 H 1 0.889 0.03 . 1 . . . A 219 ILE HG23 . 11457 1 756 . 1 1 64 64 ILE HD11 H 1 0.848 0.03 . 1 . . . A 219 ILE HD11 . 11457 1 757 . 1 1 64 64 ILE HD12 H 1 0.848 0.03 . 1 . . . A 219 ILE HD12 . 11457 1 758 . 1 1 64 64 ILE HD13 H 1 0.848 0.03 . 1 . . . A 219 ILE HD13 . 11457 1 759 . 1 1 64 64 ILE C C 13 173.612 0.3 . 1 . . . A 219 ILE C . 11457 1 760 . 1 1 64 64 ILE CA C 13 59.776 0.3 . 1 . . . A 219 ILE CA . 11457 1 761 . 1 1 64 64 ILE CB C 13 42.627 0.3 . 1 . . . A 219 ILE CB . 11457 1 762 . 1 1 64 64 ILE CG1 C 13 26.341 0.3 . 1 . . . A 219 ILE CG1 . 11457 1 763 . 1 1 64 64 ILE CG2 C 13 18.616 0.3 . 1 . . . A 219 ILE CG2 . 11457 1 764 . 1 1 64 64 ILE CD1 C 13 15.382 0.3 . 1 . . . A 219 ILE CD1 . 11457 1 765 . 1 1 64 64 ILE N N 15 121.26 0.3 . 1 . . . A 219 ILE N . 11457 1 766 . 1 1 65 65 TYR H H 1 8.863 0.03 . 1 . . . A 220 TYR H . 11457 1 767 . 1 1 65 65 TYR HA H 1 4.546 0.03 . 1 . . . A 220 TYR HA . 11457 1 768 . 1 1 65 65 TYR HB2 H 1 2.773 0.03 . 2 . . . A 220 TYR HB2 . 11457 1 769 . 1 1 65 65 TYR HB3 H 1 2.925 0.03 . 2 . . . A 220 TYR HB3 . 11457 1 770 . 1 1 65 65 TYR HD1 H 1 6.826 0.03 . 1 . . . A 220 TYR HD1 . 11457 1 771 . 1 1 65 65 TYR HD2 H 1 6.826 0.03 . 1 . . . A 220 TYR HD2 . 11457 1 772 . 1 1 65 65 TYR HE1 H 1 6.588 0.03 . 1 . . . A 220 TYR HE1 . 11457 1 773 . 1 1 65 65 TYR HE2 H 1 6.588 0.03 . 1 . . . A 220 TYR HE2 . 11457 1 774 . 1 1 65 65 TYR C C 13 173.963 0.3 . 1 . . . A 220 TYR C . 11457 1 775 . 1 1 65 65 TYR CA C 13 57.743 0.3 . 1 . . . A 220 TYR CA . 11457 1 776 . 1 1 65 65 TYR CB C 13 39.145 0.3 . 1 . . . A 220 TYR CB . 11457 1 777 . 1 1 65 65 TYR CD1 C 13 132.761 0.3 . 1 . . . A 220 TYR CD1 . 11457 1 778 . 1 1 65 65 TYR CD2 C 13 132.761 0.3 . 1 . . . A 220 TYR CD2 . 11457 1 779 . 1 1 65 65 TYR CE1 C 13 117.701 0.3 . 1 . . . A 220 TYR CE1 . 11457 1 780 . 1 1 65 65 TYR CE2 C 13 117.701 0.3 . 1 . . . A 220 TYR CE2 . 11457 1 781 . 1 1 65 65 TYR N N 15 125.955 0.3 . 1 . . . A 220 TYR N . 11457 1 782 . 1 1 66 66 ILE H H 1 8.202 0.03 . 1 . . . A 221 ILE H . 11457 1 783 . 1 1 66 66 ILE HA H 1 4.214 0.03 . 1 . . . A 221 ILE HA . 11457 1 784 . 1 1 66 66 ILE HB H 1 1.971 0.03 . 1 . . . A 221 ILE HB . 11457 1 785 . 1 1 66 66 ILE HG12 H 1 1.26 0.03 . 1 . . . A 221 ILE HG12 . 11457 1 786 . 1 1 66 66 ILE HG13 H 1 1.26 0.03 . 1 . . . A 221 ILE HG13 . 11457 1 787 . 1 1 66 66 ILE HG21 H 1 0.848 0.03 . 1 . . . A 221 ILE HG21 . 11457 1 788 . 1 1 66 66 ILE HG22 H 1 0.848 0.03 . 1 . . . A 221 ILE HG22 . 11457 1 789 . 1 1 66 66 ILE HG23 H 1 0.848 0.03 . 1 . . . A 221 ILE HG23 . 11457 1 790 . 1 1 66 66 ILE HD11 H 1 0.643 0.03 . 1 . . . A 221 ILE HD11 . 11457 1 791 . 1 1 66 66 ILE HD12 H 1 0.643 0.03 . 1 . . . A 221 ILE HD12 . 11457 1 792 . 1 1 66 66 ILE HD13 H 1 0.643 0.03 . 1 . . . A 221 ILE HD13 . 11457 1 793 . 1 1 66 66 ILE C C 13 176.226 0.3 . 1 . . . A 221 ILE C . 11457 1 794 . 1 1 66 66 ILE CA C 13 58.32 0.3 . 1 . . . A 221 ILE CA . 11457 1 795 . 1 1 66 66 ILE CB C 13 36.267 0.3 . 1 . . . A 221 ILE CB . 11457 1 796 . 1 1 66 66 ILE CG1 C 13 26.341 0.3 . 1 . . . A 221 ILE CG1 . 11457 1 797 . 1 1 66 66 ILE CG2 C 13 18.574 0.3 . 1 . . . A 221 ILE CG2 . 11457 1 798 . 1 1 66 66 ILE CD1 C 13 13.227 0.3 . 1 . . . A 221 ILE CD1 . 11457 1 799 . 1 1 66 66 ILE N N 15 128.371 0.3 . 1 . . . A 221 ILE N . 11457 1 800 . 1 1 67 67 LYS H H 1 8.845 0.03 . 1 . . . A 222 LYS H . 11457 1 801 . 1 1 67 67 LYS HA H 1 3.701 0.03 . 1 . . . A 222 LYS HA . 11457 1 802 . 1 1 67 67 LYS HB2 H 1 1.848 0.03 . 2 . . . A 222 LYS HB2 . 11457 1 803 . 1 1 67 67 LYS HB3 H 1 1.91 0.03 . 2 . . . A 222 LYS HB3 . 11457 1 804 . 1 1 67 67 LYS HG2 H 1 1.481 0.03 . 2 . . . A 222 LYS HG2 . 11457 1 805 . 1 1 67 67 LYS HG3 H 1 1.554 0.03 . 2 . . . A 222 LYS HG3 . 11457 1 806 . 1 1 67 67 LYS HD2 H 1 1.766 0.03 . 1 . . . A 222 LYS HD2 . 11457 1 807 . 1 1 67 67 LYS HD3 H 1 1.766 0.03 . 1 . . . A 222 LYS HD3 . 11457 1 808 . 1 1 67 67 LYS HE2 H 1 3.045 0.03 . 1 . . . A 222 LYS HE2 . 11457 1 809 . 1 1 67 67 LYS HE3 H 1 3.045 0.03 . 1 . . . A 222 LYS HE3 . 11457 1 810 . 1 1 67 67 LYS C C 13 178.94 0.3 . 1 . . . A 222 LYS C . 11457 1 811 . 1 1 67 67 LYS CA C 13 60.334 0.3 . 1 . . . A 222 LYS CA . 11457 1 812 . 1 1 67 67 LYS CB C 13 32.023 0.3 . 1 . . . A 222 LYS CB . 11457 1 813 . 1 1 67 67 LYS CG C 13 24.904 0.3 . 1 . . . A 222 LYS CG . 11457 1 814 . 1 1 67 67 LYS CD C 13 29.55 0.3 . 1 . . . A 222 LYS CD . 11457 1 815 . 1 1 67 67 LYS CE C 13 42.016 0.3 . 1 . . . A 222 LYS CE . 11457 1 816 . 1 1 67 67 LYS N N 15 130.709 0.3 . 1 . . . A 222 LYS N . 11457 1 817 . 1 1 68 68 GLN H H 1 9.116 0.03 . 1 . . . A 223 GLN H . 11457 1 818 . 1 1 68 68 GLN HA H 1 4.061 0.03 . 1 . . . A 223 GLN HA . 11457 1 819 . 1 1 68 68 GLN HB2 H 1 1.946 0.03 . 2 . . . A 223 GLN HB2 . 11457 1 820 . 1 1 68 68 GLN HB3 H 1 2.044 0.03 . 2 . . . A 223 GLN HB3 . 11457 1 821 . 1 1 68 68 GLN HG2 H 1 2.441 0.03 . 1 . . . A 223 GLN HG2 . 11457 1 822 . 1 1 68 68 GLN HG3 H 1 2.441 0.03 . 1 . . . A 223 GLN HG3 . 11457 1 823 . 1 1 68 68 GLN HE21 H 1 7.255 0.03 . 2 . . . A 223 GLN HE21 . 11457 1 824 . 1 1 68 68 GLN HE22 H 1 7.668 0.03 . 2 . . . A 223 GLN HE22 . 11457 1 825 . 1 1 68 68 GLN C C 13 176.137 0.3 . 1 . . . A 223 GLN C . 11457 1 826 . 1 1 68 68 GLN CA C 13 59.058 0.3 . 1 . . . A 223 GLN CA . 11457 1 827 . 1 1 68 68 GLN CB C 13 28.119 0.3 . 1 . . . A 223 GLN CB . 11457 1 828 . 1 1 68 68 GLN CG C 13 34.001 0.3 . 1 . . . A 223 GLN CG . 11457 1 829 . 1 1 68 68 GLN N N 15 116.342 0.3 . 1 . . . A 223 GLN N . 11457 1 830 . 1 1 68 68 GLN NE2 N 15 113.071 0.3 . 1 . . . A 223 GLN NE2 . 11457 1 831 . 1 1 69 69 LEU H H 1 6.736 0.03 . 1 . . . A 224 LEU H . 11457 1 832 . 1 1 69 69 LEU HA H 1 4.536 0.03 . 1 . . . A 224 LEU HA . 11457 1 833 . 1 1 69 69 LEU HB2 H 1 1.322 0.03 . 2 . . . A 224 LEU HB2 . 11457 1 834 . 1 1 69 69 LEU HB3 H 1 1.572 0.03 . 2 . . . A 224 LEU HB3 . 11457 1 835 . 1 1 69 69 LEU HG H 1 1.398 0.03 . 1 . . . A 224 LEU HG . 11457 1 836 . 1 1 69 69 LEU HD11 H 1 0.825 0.03 . 1 . . . A 224 LEU HD11 . 11457 1 837 . 1 1 69 69 LEU HD12 H 1 0.825 0.03 . 1 . . . A 224 LEU HD12 . 11457 1 838 . 1 1 69 69 LEU HD13 H 1 0.825 0.03 . 1 . . . A 224 LEU HD13 . 11457 1 839 . 1 1 69 69 LEU HD21 H 1 0.798 0.03 . 1 . . . A 224 LEU HD21 . 11457 1 840 . 1 1 69 69 LEU HD22 H 1 0.798 0.03 . 1 . . . A 224 LEU HD22 . 11457 1 841 . 1 1 69 69 LEU HD23 H 1 0.798 0.03 . 1 . . . A 224 LEU HD23 . 11457 1 842 . 1 1 69 69 LEU C C 13 177.034 0.3 . 1 . . . A 224 LEU C . 11457 1 843 . 1 1 69 69 LEU CA C 13 53.828 0.3 . 1 . . . A 224 LEU CA . 11457 1 844 . 1 1 69 69 LEU CB C 13 44.504 0.3 . 1 . . . A 224 LEU CB . 11457 1 845 . 1 1 69 69 LEU CG C 13 27.24 0.3 . 1 . . . A 224 LEU CG . 11457 1 846 . 1 1 69 69 LEU CD1 C 13 22.134 0.3 . 2 . . . A 224 LEU CD1 . 11457 1 847 . 1 1 69 69 LEU CD2 C 13 26.341 0.3 . 2 . . . A 224 LEU CD2 . 11457 1 848 . 1 1 69 69 LEU N N 15 113.298 0.3 . 1 . . . A 224 LEU N . 11457 1 849 . 1 1 70 70 GLY H H 1 7.904 0.03 . 1 . . . A 225 GLY H . 11457 1 850 . 1 1 70 70 GLY HA2 H 1 3.854 0.03 . 2 . . . A 225 GLY HA2 . 11457 1 851 . 1 1 70 70 GLY HA3 H 1 3.939 0.03 . 2 . . . A 225 GLY HA3 . 11457 1 852 . 1 1 70 70 GLY C C 13 173.847 0.3 . 1 . . . A 225 GLY C . 11457 1 853 . 1 1 70 70 GLY CA C 13 46.562 0.3 . 1 . . . A 225 GLY CA . 11457 1 854 . 1 1 70 70 GLY N N 15 109.179 0.3 . 1 . . . A 225 GLY N . 11457 1 855 . 1 1 71 71 ARG H H 1 6.763 0.03 . 1 . . . A 226 ARG H . 11457 1 856 . 1 1 71 71 ARG HA H 1 4.759 0.03 . 1 . . . A 226 ARG HA . 11457 1 857 . 1 1 71 71 ARG HB2 H 1 1.612 0.03 . 2 . . . A 226 ARG HB2 . 11457 1 858 . 1 1 71 71 ARG HB3 H 1 1.745 0.03 . 2 . . . A 226 ARG HB3 . 11457 1 859 . 1 1 71 71 ARG HG2 H 1 1.391 0.03 . 2 . . . A 226 ARG HG2 . 11457 1 860 . 1 1 71 71 ARG HG3 H 1 1.31 0.03 . 2 . . . A 226 ARG HG3 . 11457 1 861 . 1 1 71 71 ARG HD2 H 1 3.098 0.03 . 1 . . . A 226 ARG HD2 . 11457 1 862 . 1 1 71 71 ARG HD3 H 1 3.098 0.03 . 1 . . . A 226 ARG HD3 . 11457 1 863 . 1 1 71 71 ARG HE H 1 7.14 0.03 . 1 . . . A 226 ARG HE . 11457 1 864 . 1 1 71 71 ARG C C 13 173.117 0.3 . 1 . . . A 226 ARG C . 11457 1 865 . 1 1 71 71 ARG CA C 13 53.97 0.3 . 1 . . . A 226 ARG CA . 11457 1 866 . 1 1 71 71 ARG CB C 13 33.906 0.3 . 1 . . . A 226 ARG CB . 11457 1 867 . 1 1 71 71 ARG CG C 13 25.982 0.3 . 1 . . . A 226 ARG CG . 11457 1 868 . 1 1 71 71 ARG CD C 13 43.349 0.3 . 1 . . . A 226 ARG CD . 11457 1 869 . 1 1 71 71 ARG CZ C 13 159.63 0.3 . 1 . . . A 226 ARG CZ . 11457 1 870 . 1 1 71 71 ARG N N 15 113.484 0.3 . 1 . . . A 226 ARG N . 11457 1 871 . 1 1 71 71 ARG NE N 15 83.428 0.3 . 1 . . . A 226 ARG NE . 11457 1 872 . 1 1 72 72 ARG H H 1 8.663 0.03 . 1 . . . A 227 ARG H . 11457 1 873 . 1 1 72 72 ARG HA H 1 5.233 0.03 . 1 . . . A 227 ARG HA . 11457 1 874 . 1 1 72 72 ARG HB2 H 1 1.623 0.03 . 2 . . . A 227 ARG HB2 . 11457 1 875 . 1 1 72 72 ARG HB3 H 1 1.69 0.03 . 2 . . . A 227 ARG HB3 . 11457 1 876 . 1 1 72 72 ARG HG2 H 1 1.329 0.03 . 2 . . . A 227 ARG HG2 . 11457 1 877 . 1 1 72 72 ARG HG3 H 1 1.634 0.03 . 2 . . . A 227 ARG HG3 . 11457 1 878 . 1 1 72 72 ARG HD2 H 1 3.096 0.03 . 1 . . . A 227 ARG HD2 . 11457 1 879 . 1 1 72 72 ARG HD3 H 1 3.096 0.03 . 1 . . . A 227 ARG HD3 . 11457 1 880 . 1 1 72 72 ARG C C 13 176.299 0.3 . 1 . . . A 227 ARG C . 11457 1 881 . 1 1 72 72 ARG CA C 13 54.906 0.3 . 1 . . . A 227 ARG CA . 11457 1 882 . 1 1 72 72 ARG CB C 13 32.45 0.3 . 1 . . . A 227 ARG CB . 11457 1 883 . 1 1 72 72 ARG CG C 13 28.497 0.3 . 1 . . . A 227 ARG CG . 11457 1 884 . 1 1 72 72 ARG CD C 13 43.275 0.3 . 1 . . . A 227 ARG CD . 11457 1 885 . 1 1 72 72 ARG N N 15 121.439 0.3 . 1 . . . A 227 ARG N . 11457 1 886 . 1 1 73 73 ILE H H 1 8.737 0.03 . 1 . . . A 228 ILE H . 11457 1 887 . 1 1 73 73 ILE HA H 1 4.703 0.03 . 1 . . . A 228 ILE HA . 11457 1 888 . 1 1 73 73 ILE HB H 1 1.802 0.03 . 1 . . . A 228 ILE HB . 11457 1 889 . 1 1 73 73 ILE HG12 H 1 0.918 0.03 . 2 . . . A 228 ILE HG12 . 11457 1 890 . 1 1 73 73 ILE HG13 H 1 1.174 0.03 . 2 . . . A 228 ILE HG13 . 11457 1 891 . 1 1 73 73 ILE HG21 H 1 0.69 0.03 . 1 . . . A 228 ILE HG21 . 11457 1 892 . 1 1 73 73 ILE HG22 H 1 0.69 0.03 . 1 . . . A 228 ILE HG22 . 11457 1 893 . 1 1 73 73 ILE HG23 H 1 0.69 0.03 . 1 . . . A 228 ILE HG23 . 11457 1 894 . 1 1 73 73 ILE HD11 H 1 0.576 0.03 . 1 . . . A 228 ILE HD11 . 11457 1 895 . 1 1 73 73 ILE HD12 H 1 0.576 0.03 . 1 . . . A 228 ILE HD12 . 11457 1 896 . 1 1 73 73 ILE HD13 H 1 0.576 0.03 . 1 . . . A 228 ILE HD13 . 11457 1 897 . 1 1 73 73 ILE C C 13 173.69 0.3 . 1 . . . A 228 ILE C . 11457 1 898 . 1 1 73 73 ILE CA C 13 59.894 0.3 . 1 . . . A 228 ILE CA . 11457 1 899 . 1 1 73 73 ILE CB C 13 40.838 0.3 . 1 . . . A 228 ILE CB . 11457 1 900 . 1 1 73 73 ILE CG1 C 13 25.443 0.3 . 1 . . . A 228 ILE CG1 . 11457 1 901 . 1 1 73 73 ILE CG2 C 13 17.32 0.3 . 1 . . . A 228 ILE CG2 . 11457 1 902 . 1 1 73 73 ILE CD1 C 13 14.721 0.3 . 1 . . . A 228 ILE CD1 . 11457 1 903 . 1 1 73 73 ILE N N 15 116.96 0.3 . 1 . . . A 228 ILE N . 11457 1 904 . 1 1 74 74 PHE H H 1 8.773 0.03 . 1 . . . A 229 PHE H . 11457 1 905 . 1 1 74 74 PHE HA H 1 5.44 0.03 . 1 . . . A 229 PHE HA . 11457 1 906 . 1 1 74 74 PHE HB2 H 1 2.902 0.03 . 2 . . . A 229 PHE HB2 . 11457 1 907 . 1 1 74 74 PHE HB3 H 1 3.003 0.03 . 2 . . . A 229 PHE HB3 . 11457 1 908 . 1 1 74 74 PHE HD1 H 1 7.148 0.03 . 1 . . . A 229 PHE HD1 . 11457 1 909 . 1 1 74 74 PHE HD2 H 1 7.148 0.03 . 1 . . . A 229 PHE HD2 . 11457 1 910 . 1 1 74 74 PHE HE1 H 1 7.217 0.03 . 1 . . . A 229 PHE HE1 . 11457 1 911 . 1 1 74 74 PHE HE2 H 1 7.217 0.03 . 1 . . . A 229 PHE HE2 . 11457 1 912 . 1 1 74 74 PHE HZ H 1 7.16 0.03 . 1 . . . A 229 PHE HZ . 11457 1 913 . 1 1 74 74 PHE C C 13 174.17 0.3 . 1 . . . A 229 PHE C . 11457 1 914 . 1 1 74 74 PHE CA C 13 56.276 0.3 . 1 . . . A 229 PHE CA . 11457 1 915 . 1 1 74 74 PHE CB C 13 43.76 0.3 . 1 . . . A 229 PHE CB . 11457 1 916 . 1 1 74 74 PHE CD1 C 13 132.18 0.3 . 1 . . . A 229 PHE CD1 . 11457 1 917 . 1 1 74 74 PHE CD2 C 13 132.18 0.3 . 1 . . . A 229 PHE CD2 . 11457 1 918 . 1 1 74 74 PHE CE1 C 13 131.26 0.3 . 1 . . . A 229 PHE CE1 . 11457 1 919 . 1 1 74 74 PHE CE2 C 13 131.26 0.3 . 1 . . . A 229 PHE CE2 . 11457 1 920 . 1 1 74 74 PHE CZ C 13 133.26 0.3 . 1 . . . A 229 PHE CZ . 11457 1 921 . 1 1 74 74 PHE N N 15 120.859 0.3 . 1 . . . A 229 PHE N . 11457 1 922 . 1 1 75 75 ALA H H 1 8.19 0.03 . 1 . . . A 230 ALA H . 11457 1 923 . 1 1 75 75 ALA HA H 1 4.464 0.03 . 1 . . . A 230 ALA HA . 11457 1 924 . 1 1 75 75 ALA HB1 H 1 1.396 0.03 . 1 . . . A 230 ALA HB1 . 11457 1 925 . 1 1 75 75 ALA HB2 H 1 1.396 0.03 . 1 . . . A 230 ALA HB2 . 11457 1 926 . 1 1 75 75 ALA HB3 H 1 1.396 0.03 . 1 . . . A 230 ALA HB3 . 11457 1 927 . 1 1 75 75 ALA C C 13 174.726 0.3 . 1 . . . A 230 ALA C . 11457 1 928 . 1 1 75 75 ALA CA C 13 51.493 0.3 . 1 . . . A 230 ALA CA . 11457 1 929 . 1 1 75 75 ALA CB C 13 25.921 0.3 . 1 . . . A 230 ALA CB . 11457 1 930 . 1 1 75 75 ALA N N 15 124.689 0.3 . 1 . . . A 230 ALA N . 11457 1 931 . 1 1 76 76 ARG H H 1 8.475 0.03 . 1 . . . A 231 ARG H . 11457 1 932 . 1 1 76 76 ARG HA H 1 5.014 0.03 . 1 . . . A 231 ARG HA . 11457 1 933 . 1 1 76 76 ARG HB2 H 1 1.68 0.03 . 1 . . . A 231 ARG HB2 . 11457 1 934 . 1 1 76 76 ARG HB3 H 1 1.68 0.03 . 1 . . . A 231 ARG HB3 . 11457 1 935 . 1 1 76 76 ARG HG2 H 1 1.233 0.03 . 2 . . . A 231 ARG HG2 . 11457 1 936 . 1 1 76 76 ARG HG3 H 1 1.331 0.03 . 2 . . . A 231 ARG HG3 . 11457 1 937 . 1 1 76 76 ARG HD2 H 1 3.185 0.03 . 2 . . . A 231 ARG HD2 . 11457 1 938 . 1 1 76 76 ARG HD3 H 1 3.185 0.03 . 2 . . . A 231 ARG HD3 . 11457 1 939 . 1 1 76 76 ARG C C 13 174.733 0.3 . 1 . . . A 231 ARG C . 11457 1 940 . 1 1 76 76 ARG CA C 13 55.769 0.3 . 1 . . . A 231 ARG CA . 11457 1 941 . 1 1 76 76 ARG CB C 13 32.629 0.3 . 1 . . . A 231 ARG CB . 11457 1 942 . 1 1 76 76 ARG CG C 13 27.958 0.3 . 1 . . . A 231 ARG CG . 11457 1 943 . 1 1 76 76 ARG CD C 13 43.726 0.3 . 1 . . . A 231 ARG CD . 11457 1 944 . 1 1 76 76 ARG N N 15 122.757 0.3 . 1 . . . A 231 ARG N . 11457 1 945 . 1 1 77 77 GLU H H 1 8.783 0.03 . 1 . . . A 232 GLU H . 11457 1 946 . 1 1 77 77 GLU HA H 1 5.009 0.03 . 1 . . . A 232 GLU HA . 11457 1 947 . 1 1 77 77 GLU HB2 H 1 1.359 0.03 . 2 . . . A 232 GLU HB2 . 11457 1 948 . 1 1 77 77 GLU HB3 H 1 2.345 0.03 . 2 . . . A 232 GLU HB3 . 11457 1 949 . 1 1 77 77 GLU HG2 H 1 2.23 0.03 . 2 . . . A 232 GLU HG2 . 11457 1 950 . 1 1 77 77 GLU HG3 H 1 2.015 0.03 . 2 . . . A 232 GLU HG3 . 11457 1 951 . 1 1 77 77 GLU C C 13 174.09 0.3 . 1 . . . A 232 GLU C . 11457 1 952 . 1 1 77 77 GLU CA C 13 53.853 0.3 . 1 . . . A 232 GLU CA . 11457 1 953 . 1 1 77 77 GLU CB C 13 35.144 0.3 . 1 . . . A 232 GLU CB . 11457 1 954 . 1 1 77 77 GLU CG C 13 34.995 0.3 . 1 . . . A 232 GLU CG . 11457 1 955 . 1 1 77 77 GLU N N 15 123.263 0.3 . 1 . . . A 232 GLU N . 11457 1 956 . 1 1 78 78 HIS H H 1 9.03 0.03 . 1 . . . A 233 HIS H . 11457 1 957 . 1 1 78 78 HIS HA H 1 5.607 0.03 . 1 . . . A 233 HIS HA . 11457 1 958 . 1 1 78 78 HIS HB2 H 1 3.105 0.03 . 1 . . . A 233 HIS HB2 . 11457 1 959 . 1 1 78 78 HIS HB3 H 1 3.105 0.03 . 1 . . . A 233 HIS HB3 . 11457 1 960 . 1 1 78 78 HIS HD2 H 1 7.021 0.03 . 1 . . . A 233 HIS HD2 . 11457 1 961 . 1 1 78 78 HIS HE1 H 1 8.105 0.03 . 1 . . . A 233 HIS HE1 . 11457 1 962 . 1 1 78 78 HIS C C 13 175.469 0.3 . 1 . . . A 233 HIS C . 11457 1 963 . 1 1 78 78 HIS CA C 13 54.908 0.3 . 1 . . . A 233 HIS CA . 11457 1 964 . 1 1 78 78 HIS CB C 13 32.214 0.3 . 1 . . . A 233 HIS CB . 11457 1 965 . 1 1 78 78 HIS CD2 C 13 120.455 0.3 . 1 . . . A 233 HIS CD2 . 11457 1 966 . 1 1 78 78 HIS CE1 C 13 138.625 0.3 . 1 . . . A 233 HIS CE1 . 11457 1 967 . 1 1 78 78 HIS N N 15 119.205 0.3 . 1 . . . A 233 HIS N . 11457 1 968 . 1 1 79 79 GLY H H 1 8.908 0.03 . 1 . . . A 234 GLY H . 11457 1 969 . 1 1 79 79 GLY HA2 H 1 3.58 0.03 . 2 . . . A 234 GLY HA2 . 11457 1 970 . 1 1 79 79 GLY HA3 H 1 4.481 0.03 . 2 . . . A 234 GLY HA3 . 11457 1 971 . 1 1 79 79 GLY C C 13 172.91 0.3 . 1 . . . A 234 GLY C . 11457 1 972 . 1 1 79 79 GLY CA C 13 45.241 0.3 . 1 . . . A 234 GLY CA . 11457 1 973 . 1 1 79 79 GLY N N 15 106.851 0.3 . 1 . . . A 234 GLY N . 11457 1 974 . 1 1 80 80 SER H H 1 8.83 0.03 . 1 . . . A 235 SER H . 11457 1 975 . 1 1 80 80 SER HA H 1 4.265 0.03 . 1 . . . A 235 SER HA . 11457 1 976 . 1 1 80 80 SER HB2 H 1 3.968 0.03 . 1 . . . A 235 SER HB2 . 11457 1 977 . 1 1 80 80 SER HB3 H 1 3.968 0.03 . 1 . . . A 235 SER HB3 . 11457 1 978 . 1 1 80 80 SER C C 13 173.355 0.3 . 1 . . . A 235 SER C . 11457 1 979 . 1 1 80 80 SER CA C 13 61.194 0.3 . 1 . . . A 235 SER CA . 11457 1 980 . 1 1 80 80 SER CB C 13 63.084 0.3 . 1 . . . A 235 SER CB . 11457 1 981 . 1 1 80 80 SER N N 15 115.082 0.3 . 1 . . . A 235 SER N . 11457 1 982 . 1 1 81 81 ASN H H 1 7.507 0.03 . 1 . . . A 236 ASN H . 11457 1 983 . 1 1 81 81 ASN HA H 1 4.692 0.03 . 1 . . . A 236 ASN HA . 11457 1 984 . 1 1 81 81 ASN HB2 H 1 2.943 0.03 . 2 . . . A 236 ASN HB2 . 11457 1 985 . 1 1 81 81 ASN HB3 H 1 3.081 0.03 . 2 . . . A 236 ASN HB3 . 11457 1 986 . 1 1 81 81 ASN HD21 H 1 6.782 0.03 . 2 . . . A 236 ASN HD21 . 11457 1 987 . 1 1 81 81 ASN HD22 H 1 7.482 0.03 . 2 . . . A 236 ASN HD22 . 11457 1 988 . 1 1 81 81 ASN C C 13 174.378 0.3 . 1 . . . A 236 ASN C . 11457 1 989 . 1 1 81 81 ASN CA C 13 51.334 0.3 . 1 . . . A 236 ASN CA . 11457 1 990 . 1 1 81 81 ASN CB C 13 40.268 0.3 . 1 . . . A 236 ASN CB . 11457 1 991 . 1 1 81 81 ASN N N 15 112.34 0.3 . 1 . . . A 236 ASN N . 11457 1 992 . 1 1 81 81 ASN ND2 N 15 112.973 0.3 . 1 . . . A 236 ASN ND2 . 11457 1 993 . 1 1 82 82 LYS H H 1 8.232 0.03 . 1 . . . A 237 LYS H . 11457 1 994 . 1 1 82 82 LYS HA H 1 3.128 0.03 . 1 . . . A 237 LYS HA . 11457 1 995 . 1 1 82 82 LYS HB2 H 1 0.864 0.03 . 2 . . . A 237 LYS HB2 . 11457 1 996 . 1 1 82 82 LYS HB3 H 1 0.943 0.03 . 2 . . . A 237 LYS HB3 . 11457 1 997 . 1 1 82 82 LYS HG2 H 1 -0.278 0.03 . 2 . . . A 237 LYS HG2 . 11457 1 998 . 1 1 82 82 LYS HG3 H 1 -0.029 0.03 . 2 . . . A 237 LYS HG3 . 11457 1 999 . 1 1 82 82 LYS HD2 H 1 0.543 0.03 . 2 . . . A 237 LYS HD2 . 11457 1 1000 . 1 1 82 82 LYS HD3 H 1 0.746 0.03 . 2 . . . A 237 LYS HD3 . 11457 1 1001 . 1 1 82 82 LYS HE2 H 1 2.002 0.03 . 2 . . . A 237 LYS HE2 . 11457 1 1002 . 1 1 82 82 LYS HE3 H 1 2.002 0.03 . 2 . . . A 237 LYS HE3 . 11457 1 1003 . 1 1 82 82 LYS C C 13 177.315 0.3 . 1 . . . A 237 LYS C . 11457 1 1004 . 1 1 82 82 LYS CA C 13 61.438 0.3 . 1 . . . A 237 LYS CA . 11457 1 1005 . 1 1 82 82 LYS CB C 13 32.018 0.3 . 1 . . . A 237 LYS CB . 11457 1 1006 . 1 1 82 82 LYS CG C 13 25.657 0.3 . 1 . . . A 237 LYS CG . 11457 1 1007 . 1 1 82 82 LYS CD C 13 28.995 0.3 . 1 . . . A 237 LYS CD . 11457 1 1008 . 1 1 82 82 LYS CE C 13 41.241 0.3 . 1 . . . A 237 LYS CE . 11457 1 1009 . 1 1 82 82 LYS N N 15 119.416 0.3 . 1 . . . A 237 LYS N . 11457 1 1010 . 1 1 83 83 LYS H H 1 7.717 0.03 . 1 . . . A 238 LYS H . 11457 1 1011 . 1 1 83 83 LYS HA H 1 3.916 0.03 . 1 . . . A 238 LYS HA . 11457 1 1012 . 1 1 83 83 LYS HB2 H 1 1.683 0.03 . 2 . . . A 238 LYS HB2 . 11457 1 1013 . 1 1 83 83 LYS HB3 H 1 1.73 0.03 . 2 . . . A 238 LYS HB3 . 11457 1 1014 . 1 1 83 83 LYS HG2 H 1 1.195 0.03 . 2 . . . A 238 LYS HG2 . 11457 1 1015 . 1 1 83 83 LYS HG3 H 1 1.393 0.03 . 2 . . . A 238 LYS HG3 . 11457 1 1016 . 1 1 83 83 LYS HD2 H 1 1.58 0.03 . 2 . . . A 238 LYS HD2 . 11457 1 1017 . 1 1 83 83 LYS HD3 H 1 1.577 0.03 . 2 . . . A 238 LYS HD3 . 11457 1 1018 . 1 1 83 83 LYS HE2 H 1 2.889 0.03 . 1 . . . A 238 LYS HE2 . 11457 1 1019 . 1 1 83 83 LYS HE3 H 1 2.889 0.03 . 1 . . . A 238 LYS HE3 . 11457 1 1020 . 1 1 83 83 LYS C C 13 179.859 0.3 . 1 . . . A 238 LYS C . 11457 1 1021 . 1 1 83 83 LYS CA C 13 59.577 0.3 . 1 . . . A 238 LYS CA . 11457 1 1022 . 1 1 83 83 LYS CB C 13 32.09 0.3 . 1 . . . A 238 LYS CB . 11457 1 1023 . 1 1 83 83 LYS CG C 13 25.084 0.3 . 1 . . . A 238 LYS CG . 11457 1 1024 . 1 1 83 83 LYS CD C 13 29.575 0.3 . 1 . . . A 238 LYS CD . 11457 1 1025 . 1 1 83 83 LYS CE C 13 42.014 0.3 . 1 . . . A 238 LYS CE . 11457 1 1026 . 1 1 83 83 LYS N N 15 119.618 0.3 . 1 . . . A 238 LYS N . 11457 1 1027 . 1 1 84 84 LEU H H 1 8.638 0.03 . 1 . . . A 239 LEU H . 11457 1 1028 . 1 1 84 84 LEU HA H 1 4.109 0.03 . 1 . . . A 239 LEU HA . 11457 1 1029 . 1 1 84 84 LEU HB2 H 1 1.573 0.03 . 2 . . . A 239 LEU HB2 . 11457 1 1030 . 1 1 84 84 LEU HB3 H 1 1.636 0.03 . 2 . . . A 239 LEU HB3 . 11457 1 1031 . 1 1 84 84 LEU HG H 1 1.811 0.03 . 1 . . . A 239 LEU HG . 11457 1 1032 . 1 1 84 84 LEU HD11 H 1 0.898 0.03 . 1 . . . A 239 LEU HD11 . 11457 1 1033 . 1 1 84 84 LEU HD12 H 1 0.898 0.03 . 1 . . . A 239 LEU HD12 . 11457 1 1034 . 1 1 84 84 LEU HD13 H 1 0.898 0.03 . 1 . . . A 239 LEU HD13 . 11457 1 1035 . 1 1 84 84 LEU HD21 H 1 0.955 0.03 . 1 . . . A 239 LEU HD21 . 11457 1 1036 . 1 1 84 84 LEU HD22 H 1 0.955 0.03 . 1 . . . A 239 LEU HD22 . 11457 1 1037 . 1 1 84 84 LEU HD23 H 1 0.955 0.03 . 1 . . . A 239 LEU HD23 . 11457 1 1038 . 1 1 84 84 LEU C C 13 180.192 0.3 . 1 . . . A 239 LEU C . 11457 1 1039 . 1 1 84 84 LEU CA C 13 57.422 0.3 . 1 . . . A 239 LEU CA . 11457 1 1040 . 1 1 84 84 LEU CB C 13 42.151 0.3 . 1 . . . A 239 LEU CB . 11457 1 1041 . 1 1 84 84 LEU CG C 13 27.452 0.3 . 1 . . . A 239 LEU CG . 11457 1 1042 . 1 1 84 84 LEU CD1 C 13 22.86 0.3 . 2 . . . A 239 LEU CD1 . 11457 1 1043 . 1 1 84 84 LEU CD2 C 13 25.384 0.3 . 2 . . . A 239 LEU CD2 . 11457 1 1044 . 1 1 84 84 LEU N N 15 120.356 0.3 . 1 . . . A 239 LEU N . 11457 1 1045 . 1 1 85 85 ALA H H 1 8.143 0.03 . 1 . . . A 240 ALA H . 11457 1 1046 . 1 1 85 85 ALA HA H 1 3.813 0.03 . 1 . . . A 240 ALA HA . 11457 1 1047 . 1 1 85 85 ALA HB1 H 1 1.398 0.03 . 1 . . . A 240 ALA HB1 . 11457 1 1048 . 1 1 85 85 ALA HB2 H 1 1.398 0.03 . 1 . . . A 240 ALA HB2 . 11457 1 1049 . 1 1 85 85 ALA HB3 H 1 1.398 0.03 . 1 . . . A 240 ALA HB3 . 11457 1 1050 . 1 1 85 85 ALA C C 13 178.89 0.3 . 1 . . . A 240 ALA C . 11457 1 1051 . 1 1 85 85 ALA CA C 13 55.565 0.3 . 1 . . . A 240 ALA CA . 11457 1 1052 . 1 1 85 85 ALA CB C 13 18.257 0.3 . 1 . . . A 240 ALA CB . 11457 1 1053 . 1 1 85 85 ALA N N 15 123.08 0.3 . 1 . . . A 240 ALA N . 11457 1 1054 . 1 1 86 86 ALA H H 1 8.293 0.03 . 1 . . . A 241 ALA H . 11457 1 1055 . 1 1 86 86 ALA HA H 1 3.352 0.03 . 1 . . . A 241 ALA HA . 11457 1 1056 . 1 1 86 86 ALA HB1 H 1 0.871 0.03 . 1 . . . A 241 ALA HB1 . 11457 1 1057 . 1 1 86 86 ALA HB2 H 1 0.871 0.03 . 1 . . . A 241 ALA HB2 . 11457 1 1058 . 1 1 86 86 ALA HB3 H 1 0.871 0.03 . 1 . . . A 241 ALA HB3 . 11457 1 1059 . 1 1 86 86 ALA C C 13 179.49 0.3 . 1 . . . A 241 ALA C . 11457 1 1060 . 1 1 86 86 ALA CA C 13 55.474 0.3 . 1 . . . A 241 ALA CA . 11457 1 1061 . 1 1 86 86 ALA CB C 13 17.179 0.3 . 1 . . . A 241 ALA CB . 11457 1 1062 . 1 1 86 86 ALA N N 15 120.038 0.3 . 1 . . . A 241 ALA N . 11457 1 1063 . 1 1 87 87 GLN H H 1 8.173 0.03 . 1 . . . A 242 GLN H . 11457 1 1064 . 1 1 87 87 GLN HA H 1 3.805 0.03 . 1 . . . A 242 GLN HA . 11457 1 1065 . 1 1 87 87 GLN HB2 H 1 2.184 0.03 . 2 . . . A 242 GLN HB2 . 11457 1 1066 . 1 1 87 87 GLN HB3 H 1 2.279 0.03 . 2 . . . A 242 GLN HB3 . 11457 1 1067 . 1 1 87 87 GLN HG2 H 1 2.367 0.03 . 2 . . . A 242 GLN HG2 . 11457 1 1068 . 1 1 87 87 GLN HG3 H 1 2.498 0.03 . 2 . . . A 242 GLN HG3 . 11457 1 1069 . 1 1 87 87 GLN HE21 H 1 6.842 0.03 . 2 . . . A 242 GLN HE21 . 11457 1 1070 . 1 1 87 87 GLN HE22 H 1 7.23 0.03 . 2 . . . A 242 GLN HE22 . 11457 1 1071 . 1 1 87 87 GLN C C 13 178.779 0.3 . 1 . . . A 242 GLN C . 11457 1 1072 . 1 1 87 87 GLN CA C 13 59.802 0.3 . 1 . . . A 242 GLN CA . 11457 1 1073 . 1 1 87 87 GLN CB C 13 29.246 0.3 . 1 . . . A 242 GLN CB . 11457 1 1074 . 1 1 87 87 GLN CG C 13 34.922 0.3 . 1 . . . A 242 GLN CG . 11457 1 1075 . 1 1 87 87 GLN N N 15 117.942 0.3 . 1 . . . A 242 GLN N . 11457 1 1076 . 1 1 87 87 GLN NE2 N 15 109.915 0.3 . 1 . . . A 242 GLN NE2 . 11457 1 1077 . 1 1 88 88 SER H H 1 8.085 0.03 . 1 . . . A 243 SER H . 11457 1 1078 . 1 1 88 88 SER HA H 1 4.076 0.03 . 1 . . . A 243 SER HA . 11457 1 1079 . 1 1 88 88 SER HB2 H 1 3.886 0.03 . 2 . . . A 243 SER HB2 . 11457 1 1080 . 1 1 88 88 SER HB3 H 1 3.978 0.03 . 2 . . . A 243 SER HB3 . 11457 1 1081 . 1 1 88 88 SER C C 13 176.583 0.3 . 1 . . . A 243 SER C . 11457 1 1082 . 1 1 88 88 SER CA C 13 62.061 0.3 . 1 . . . A 243 SER CA . 11457 1 1083 . 1 1 88 88 SER CB C 13 62.991 0.3 . 1 . . . A 243 SER CB . 11457 1 1084 . 1 1 88 88 SER N N 15 115.966 0.3 . 1 . . . A 243 SER N . 11457 1 1085 . 1 1 89 89 CYS H H 1 8.466 0.03 . 1 . . . A 244 CYS H . 11457 1 1086 . 1 1 89 89 CYS HA H 1 3.746 0.03 . 1 . . . A 244 CYS HA . 11457 1 1087 . 1 1 89 89 CYS HB2 H 1 2.908 0.03 . 2 . . . A 244 CYS HB2 . 11457 1 1088 . 1 1 89 89 CYS HB3 H 1 3.071 0.03 . 2 . . . A 244 CYS HB3 . 11457 1 1089 . 1 1 89 89 CYS C C 13 175.297 0.3 . 1 . . . A 244 CYS C . 11457 1 1090 . 1 1 89 89 CYS CA C 13 63.544 0.3 . 1 . . . A 244 CYS CA . 11457 1 1091 . 1 1 89 89 CYS CB C 13 27.187 0.3 . 1 . . . A 244 CYS CB . 11457 1 1092 . 1 1 89 89 CYS N N 15 124.36 0.3 . 1 . . . A 244 CYS N . 11457 1 1093 . 1 1 90 90 ALA H H 1 8.746 0.03 . 1 . . . A 245 ALA H . 11457 1 1094 . 1 1 90 90 ALA HA H 1 3.955 0.03 . 1 . . . A 245 ALA HA . 11457 1 1095 . 1 1 90 90 ALA HB1 H 1 1.445 0.03 . 1 . . . A 245 ALA HB1 . 11457 1 1096 . 1 1 90 90 ALA HB2 H 1 1.445 0.03 . 1 . . . A 245 ALA HB2 . 11457 1 1097 . 1 1 90 90 ALA HB3 H 1 1.445 0.03 . 1 . . . A 245 ALA HB3 . 11457 1 1098 . 1 1 90 90 ALA C C 13 178.922 0.3 . 1 . . . A 245 ALA C . 11457 1 1099 . 1 1 90 90 ALA CA C 13 55.31 0.3 . 1 . . . A 245 ALA CA . 11457 1 1100 . 1 1 90 90 ALA CB C 13 17.51 0.3 . 1 . . . A 245 ALA CB . 11457 1 1101 . 1 1 90 90 ALA N N 15 119.934 0.3 . 1 . . . A 245 ALA N . 11457 1 1102 . 1 1 91 91 LEU H H 1 7.791 0.03 . 1 . . . A 246 LEU H . 11457 1 1103 . 1 1 91 91 LEU HA H 1 3.773 0.03 . 1 . . . A 246 LEU HA . 11457 1 1104 . 1 1 91 91 LEU HB2 H 1 1.319 0.03 . 2 . . . A 246 LEU HB2 . 11457 1 1105 . 1 1 91 91 LEU HB3 H 1 2.13 0.03 . 2 . . . A 246 LEU HB3 . 11457 1 1106 . 1 1 91 91 LEU HG H 1 1.32 0.03 . 1 . . . A 246 LEU HG . 11457 1 1107 . 1 1 91 91 LEU HD11 H 1 0.746 0.03 . 1 . . . A 246 LEU HD11 . 11457 1 1108 . 1 1 91 91 LEU HD12 H 1 0.746 0.03 . 1 . . . A 246 LEU HD12 . 11457 1 1109 . 1 1 91 91 LEU HD13 H 1 0.746 0.03 . 1 . . . A 246 LEU HD13 . 11457 1 1110 . 1 1 91 91 LEU HD21 H 1 0.85 0.03 . 1 . . . A 246 LEU HD21 . 11457 1 1111 . 1 1 91 91 LEU HD22 H 1 0.85 0.03 . 1 . . . A 246 LEU HD22 . 11457 1 1112 . 1 1 91 91 LEU HD23 H 1 0.85 0.03 . 1 . . . A 246 LEU HD23 . 11457 1 1113 . 1 1 91 91 LEU C C 13 177.495 0.3 . 1 . . . A 246 LEU C . 11457 1 1114 . 1 1 91 91 LEU CA C 13 58.035 0.3 . 1 . . . A 246 LEU CA . 11457 1 1115 . 1 1 91 91 LEU CB C 13 41.276 0.3 . 1 . . . A 246 LEU CB . 11457 1 1116 . 1 1 91 91 LEU CG C 13 26.88 0.3 . 1 . . . A 246 LEU CG . 11457 1 1117 . 1 1 91 91 LEU CD1 C 13 23.287 0.3 . 2 . . . A 246 LEU CD1 . 11457 1 1118 . 1 1 91 91 LEU CD2 C 13 25.786 0.3 . 2 . . . A 246 LEU CD2 . 11457 1 1119 . 1 1 91 91 LEU N N 15 116.952 0.3 . 1 . . . A 246 LEU N . 11457 1 1120 . 1 1 92 92 SER H H 1 7.669 0.03 . 1 . . . A 247 SER H . 11457 1 1121 . 1 1 92 92 SER HA H 1 4.18 0.03 . 1 . . . A 247 SER HA . 11457 1 1122 . 1 1 92 92 SER HB2 H 1 4.074 0.03 . 2 . . . A 247 SER HB2 . 11457 1 1123 . 1 1 92 92 SER HB3 H 1 4.074 0.03 . 2 . . . A 247 SER HB3 . 11457 1 1124 . 1 1 92 92 SER C C 13 178.428 0.3 . 1 . . . A 247 SER C . 11457 1 1125 . 1 1 92 92 SER CA C 13 60.603 0.3 . 1 . . . A 247 SER CA . 11457 1 1126 . 1 1 92 92 SER CB C 13 62.87 0.3 . 1 . . . A 247 SER CB . 11457 1 1127 . 1 1 92 92 SER N N 15 112.551 0.3 . 1 . . . A 247 SER N . 11457 1 1128 . 1 1 93 93 LEU H H 1 7.93 0.03 . 1 . . . A 248 LEU H . 11457 1 1129 . 1 1 93 93 LEU HA H 1 3.834 0.03 . 1 . . . A 248 LEU HA . 11457 1 1130 . 1 1 93 93 LEU HB2 H 1 1.005 0.03 . 2 . . . A 248 LEU HB2 . 11457 1 1131 . 1 1 93 93 LEU HB3 H 1 1.931 0.03 . 2 . . . A 248 LEU HB3 . 11457 1 1132 . 1 1 93 93 LEU HG H 1 1.745 0.03 . 1 . . . A 248 LEU HG . 11457 1 1133 . 1 1 93 93 LEU HD11 H 1 0.526 0.03 . 1 . . . A 248 LEU HD11 . 11457 1 1134 . 1 1 93 93 LEU HD12 H 1 0.526 0.03 . 1 . . . A 248 LEU HD12 . 11457 1 1135 . 1 1 93 93 LEU HD13 H 1 0.526 0.03 . 1 . . . A 248 LEU HD13 . 11457 1 1136 . 1 1 93 93 LEU HD21 H 1 0.773 0.03 . 1 . . . A 248 LEU HD21 . 11457 1 1137 . 1 1 93 93 LEU HD22 H 1 0.773 0.03 . 1 . . . A 248 LEU HD22 . 11457 1 1138 . 1 1 93 93 LEU HD23 H 1 0.773 0.03 . 1 . . . A 248 LEU HD23 . 11457 1 1139 . 1 1 93 93 LEU C C 13 178.096 0.3 . 1 . . . A 248 LEU C . 11457 1 1140 . 1 1 93 93 LEU CA C 13 58.427 0.3 . 1 . . . A 248 LEU CA . 11457 1 1141 . 1 1 93 93 LEU CB C 13 42.069 0.3 . 1 . . . A 248 LEU CB . 11457 1 1142 . 1 1 93 93 LEU CG C 13 26.162 0.3 . 1 . . . A 248 LEU CG . 11457 1 1143 . 1 1 93 93 LEU CD1 C 13 22.548 0.3 . 2 . . . A 248 LEU CD1 . 11457 1 1144 . 1 1 93 93 LEU CD2 C 13 27.934 0.3 . 2 . . . A 248 LEU CD2 . 11457 1 1145 . 1 1 93 93 LEU N N 15 119.516 0.3 . 1 . . . A 248 LEU N . 11457 1 1146 . 1 1 94 94 VAL H H 1 8.656 0.03 . 1 . . . A 249 VAL H . 11457 1 1147 . 1 1 94 94 VAL HA H 1 3.029 0.03 . 1 . . . A 249 VAL HA . 11457 1 1148 . 1 1 94 94 VAL HB H 1 1.713 0.03 . 1 . . . A 249 VAL HB . 11457 1 1149 . 1 1 94 94 VAL HG11 H 1 -0.158 0.03 . 1 . . . A 249 VAL HG11 . 11457 1 1150 . 1 1 94 94 VAL HG12 H 1 -0.158 0.03 . 1 . . . A 249 VAL HG12 . 11457 1 1151 . 1 1 94 94 VAL HG13 H 1 -0.158 0.03 . 1 . . . A 249 VAL HG13 . 11457 1 1152 . 1 1 94 94 VAL HG21 H 1 0.635 0.03 . 1 . . . A 249 VAL HG21 . 11457 1 1153 . 1 1 94 94 VAL HG22 H 1 0.635 0.03 . 1 . . . A 249 VAL HG22 . 11457 1 1154 . 1 1 94 94 VAL HG23 H 1 0.635 0.03 . 1 . . . A 249 VAL HG23 . 11457 1 1155 . 1 1 94 94 VAL C C 13 177.565 0.3 . 1 . . . A 249 VAL C . 11457 1 1156 . 1 1 94 94 VAL CA C 13 67.437 0.3 . 1 . . . A 249 VAL CA . 11457 1 1157 . 1 1 94 94 VAL CB C 13 31.551 0.3 . 1 . . . A 249 VAL CB . 11457 1 1158 . 1 1 94 94 VAL CG1 C 13 20.071 0.3 . 2 . . . A 249 VAL CG1 . 11457 1 1159 . 1 1 94 94 VAL CG2 C 13 25.261 0.3 . 2 . . . A 249 VAL CG2 . 11457 1 1160 . 1 1 94 94 VAL N N 15 119.562 0.3 . 1 . . . A 249 VAL N . 11457 1 1161 . 1 1 95 95 ARG H H 1 8.685 0.03 . 1 . . . A 250 ARG H . 11457 1 1162 . 1 1 95 95 ARG HA H 1 3.963 0.03 . 1 . . . A 250 ARG HA . 11457 1 1163 . 1 1 95 95 ARG HB2 H 1 1.958 0.03 . 2 . . . A 250 ARG HB2 . 11457 1 1164 . 1 1 95 95 ARG HB3 H 1 2.041 0.03 . 2 . . . A 250 ARG HB3 . 11457 1 1165 . 1 1 95 95 ARG HG2 H 1 1.72 0.03 . 2 . . . A 250 ARG HG2 . 11457 1 1166 . 1 1 95 95 ARG HG3 H 1 2.136 0.03 . 2 . . . A 250 ARG HG3 . 11457 1 1167 . 1 1 95 95 ARG HD2 H 1 2.96 0.03 . 2 . . . A 250 ARG HD2 . 11457 1 1168 . 1 1 95 95 ARG HD3 H 1 2.578 0.03 . 2 . . . A 250 ARG HD3 . 11457 1 1169 . 1 1 95 95 ARG HE H 1 7.165 0.03 . 1 . . . A 250 ARG HE . 11457 1 1170 . 1 1 95 95 ARG C C 13 178.553 0.3 . 1 . . . A 250 ARG C . 11457 1 1171 . 1 1 95 95 ARG CA C 13 61.476 0.3 . 1 . . . A 250 ARG CA . 11457 1 1172 . 1 1 95 95 ARG CB C 13 30.064 0.3 . 1 . . . A 250 ARG CB . 11457 1 1173 . 1 1 95 95 ARG CG C 13 30.114 0.3 . 1 . . . A 250 ARG CG . 11457 1 1174 . 1 1 95 95 ARG CD C 13 44.064 0.3 . 1 . . . A 250 ARG CD . 11457 1 1175 . 1 1 95 95 ARG N N 15 117.825 0.3 . 1 . . . A 250 ARG N . 11457 1 1176 . 1 1 96 96 GLN H H 1 7.996 0.03 . 1 . . . A 251 GLN H . 11457 1 1177 . 1 1 96 96 GLN HA H 1 4.179 0.03 . 1 . . . A 251 GLN HA . 11457 1 1178 . 1 1 96 96 GLN HB2 H 1 1.967 0.03 . 2 . . . A 251 GLN HB2 . 11457 1 1179 . 1 1 96 96 GLN HB3 H 1 2.208 0.03 . 2 . . . A 251 GLN HB3 . 11457 1 1180 . 1 1 96 96 GLN HG2 H 1 2.138 0.03 . 2 . . . A 251 GLN HG2 . 11457 1 1181 . 1 1 96 96 GLN HG3 H 1 2.839 0.03 . 2 . . . A 251 GLN HG3 . 11457 1 1182 . 1 1 96 96 GLN HE21 H 1 6.428 0.03 . 2 . . . A 251 GLN HE21 . 11457 1 1183 . 1 1 96 96 GLN HE22 H 1 7.029 0.03 . 2 . . . A 251 GLN HE22 . 11457 1 1184 . 1 1 96 96 GLN C C 13 178.912 0.3 . 1 . . . A 251 GLN C . 11457 1 1185 . 1 1 96 96 GLN CA C 13 60.353 0.3 . 1 . . . A 251 GLN CA . 11457 1 1186 . 1 1 96 96 GLN CB C 13 30.747 0.3 . 1 . . . A 251 GLN CB . 11457 1 1187 . 1 1 96 96 GLN CG C 13 36.222 0.3 . 1 . . . A 251 GLN CG . 11457 1 1188 . 1 1 96 96 GLN N N 15 117.831 0.3 . 1 . . . A 251 GLN N . 11457 1 1189 . 1 1 96 96 GLN NE2 N 15 108.965 0.3 . 1 . . . A 251 GLN NE2 . 11457 1 1190 . 1 1 97 97 LEU H H 1 8.416 0.03 . 1 . . . A 252 LEU H . 11457 1 1191 . 1 1 97 97 LEU HA H 1 3.689 0.03 . 1 . . . A 252 LEU HA . 11457 1 1192 . 1 1 97 97 LEU HB2 H 1 0.802 0.03 . 2 . . . A 252 LEU HB2 . 11457 1 1193 . 1 1 97 97 LEU HB3 H 1 1.729 0.03 . 2 . . . A 252 LEU HB3 . 11457 1 1194 . 1 1 97 97 LEU HG H 1 1.509 0.03 . 1 . . . A 252 LEU HG . 11457 1 1195 . 1 1 97 97 LEU HD11 H 1 -0.098 0.03 . 1 . . . A 252 LEU HD11 . 11457 1 1196 . 1 1 97 97 LEU HD12 H 1 -0.098 0.03 . 1 . . . A 252 LEU HD12 . 11457 1 1197 . 1 1 97 97 LEU HD13 H 1 -0.098 0.03 . 1 . . . A 252 LEU HD13 . 11457 1 1198 . 1 1 97 97 LEU HD21 H 1 0.379 0.03 . 1 . . . A 252 LEU HD21 . 11457 1 1199 . 1 1 97 97 LEU HD22 H 1 0.379 0.03 . 1 . . . A 252 LEU HD22 . 11457 1 1200 . 1 1 97 97 LEU HD23 H 1 0.379 0.03 . 1 . . . A 252 LEU HD23 . 11457 1 1201 . 1 1 97 97 LEU C C 13 179.06 0.3 . 1 . . . A 252 LEU C . 11457 1 1202 . 1 1 97 97 LEU CA C 13 58.14 0.3 . 1 . . . A 252 LEU CA . 11457 1 1203 . 1 1 97 97 LEU CB C 13 41.432 0.3 . 1 . . . A 252 LEU CB . 11457 1 1204 . 1 1 97 97 LEU CG C 13 26.162 0.3 . 1 . . . A 252 LEU CG . 11457 1 1205 . 1 1 97 97 LEU CD1 C 13 24.105 0.3 . 2 . . . A 252 LEU CD1 . 11457 1 1206 . 1 1 97 97 LEU CD2 C 13 22.748 0.3 . 2 . . . A 252 LEU CD2 . 11457 1 1207 . 1 1 97 97 LEU N N 15 119.405 0.3 . 1 . . . A 252 LEU N . 11457 1 1208 . 1 1 98 98 TYR H H 1 8.686 0.03 . 1 . . . A 253 TYR H . 11457 1 1209 . 1 1 98 98 TYR HA H 1 4.596 0.03 . 1 . . . A 253 TYR HA . 11457 1 1210 . 1 1 98 98 TYR HB2 H 1 2.92 0.03 . 2 . . . A 253 TYR HB2 . 11457 1 1211 . 1 1 98 98 TYR HB3 H 1 3.055 0.03 . 2 . . . A 253 TYR HB3 . 11457 1 1212 . 1 1 98 98 TYR HD1 H 1 6.888 0.03 . 1 . . . A 253 TYR HD1 . 11457 1 1213 . 1 1 98 98 TYR HD2 H 1 6.888 0.03 . 1 . . . A 253 TYR HD2 . 11457 1 1214 . 1 1 98 98 TYR HE1 H 1 6.658 0.03 . 1 . . . A 253 TYR HE1 . 11457 1 1215 . 1 1 98 98 TYR HE2 H 1 6.658 0.03 . 1 . . . A 253 TYR HE2 . 11457 1 1216 . 1 1 98 98 TYR C C 13 179.458 0.3 . 1 . . . A 253 TYR C . 11457 1 1217 . 1 1 98 98 TYR CA C 13 60.662 0.3 . 1 . . . A 253 TYR CA . 11457 1 1218 . 1 1 98 98 TYR CB C 13 37.763 0.3 . 1 . . . A 253 TYR CB . 11457 1 1219 . 1 1 98 98 TYR N N 15 122.037 0.3 . 1 . . . A 253 TYR N . 11457 1 1220 . 1 1 99 99 HIS H H 1 8.604 0.03 . 1 . . . A 254 HIS H . 11457 1 1221 . 1 1 99 99 HIS HA H 1 4.049 0.03 . 1 . . . A 254 HIS HA . 11457 1 1222 . 1 1 99 99 HIS HB2 H 1 3.288 0.03 . 2 . . . A 254 HIS HB2 . 11457 1 1223 . 1 1 99 99 HIS HB3 H 1 3.288 0.03 . 2 . . . A 254 HIS HB3 . 11457 1 1224 . 1 1 99 99 HIS HD2 H 1 7.397 0.03 . 1 . . . A 254 HIS HD2 . 11457 1 1225 . 1 1 99 99 HIS HE1 H 1 8.105 0.03 . 1 . . . A 254 HIS HE1 . 11457 1 1226 . 1 1 99 99 HIS C C 13 176.784 0.3 . 1 . . . A 254 HIS C . 11457 1 1227 . 1 1 99 99 HIS CA C 13 59.578 0.3 . 1 . . . A 254 HIS CA . 11457 1 1228 . 1 1 99 99 HIS CB C 13 28.236 0.3 . 1 . . . A 254 HIS CB . 11457 1 1229 . 1 1 99 99 HIS CD2 C 13 123.768 0.3 . 1 . . . A 254 HIS CD2 . 11457 1 1230 . 1 1 99 99 HIS CE1 C 13 136.649 0.3 . 1 . . . A 254 HIS CE1 . 11457 1 1231 . 1 1 99 99 HIS N N 15 120.686 0.3 . 1 . . . A 254 HIS N . 11457 1 1232 . 1 1 100 100 LEU H H 1 7.906 0.03 . 1 . . . A 255 LEU H . 11457 1 1233 . 1 1 100 100 LEU HA H 1 4.287 0.03 . 1 . . . A 255 LEU HA . 11457 1 1234 . 1 1 100 100 LEU HB2 H 1 1.589 0.03 . 2 . . . A 255 LEU HB2 . 11457 1 1235 . 1 1 100 100 LEU HB3 H 1 1.709 0.03 . 2 . . . A 255 LEU HB3 . 11457 1 1236 . 1 1 100 100 LEU HG H 1 1.809 0.03 . 1 . . . A 255 LEU HG . 11457 1 1237 . 1 1 100 100 LEU HD11 H 1 0.833 0.03 . 1 . . . A 255 LEU HD11 . 11457 1 1238 . 1 1 100 100 LEU HD12 H 1 0.833 0.03 . 1 . . . A 255 LEU HD12 . 11457 1 1239 . 1 1 100 100 LEU HD13 H 1 0.833 0.03 . 1 . . . A 255 LEU HD13 . 11457 1 1240 . 1 1 100 100 LEU HD21 H 1 0.671 0.03 . 1 . . . A 255 LEU HD21 . 11457 1 1241 . 1 1 100 100 LEU HD22 H 1 0.671 0.03 . 1 . . . A 255 LEU HD22 . 11457 1 1242 . 1 1 100 100 LEU HD23 H 1 0.671 0.03 . 1 . . . A 255 LEU HD23 . 11457 1 1243 . 1 1 100 100 LEU C C 13 177.098 0.3 . 1 . . . A 255 LEU C . 11457 1 1244 . 1 1 100 100 LEU CA C 13 55.296 0.3 . 1 . . . A 255 LEU CA . 11457 1 1245 . 1 1 100 100 LEU CB C 13 43.08 0.3 . 1 . . . A 255 LEU CB . 11457 1 1246 . 1 1 100 100 LEU CG C 13 26.715 0.3 . 1 . . . A 255 LEU CG . 11457 1 1247 . 1 1 100 100 LEU CD1 C 13 22.402 0.3 . 2 . . . A 255 LEU CD1 . 11457 1 1248 . 1 1 100 100 LEU CD2 C 13 25.623 0.3 . 2 . . . A 255 LEU CD2 . 11457 1 1249 . 1 1 100 100 LEU N N 15 117.721 0.3 . 1 . . . A 255 LEU N . 11457 1 1250 . 1 1 101 101 GLY H H 1 7.775 0.03 . 1 . . . A 256 GLY H . 11457 1 1251 . 1 1 101 101 GLY HA2 H 1 4.006 0.03 . 2 . . . A 256 GLY HA2 . 11457 1 1252 . 1 1 101 101 GLY HA3 H 1 3.873 0.03 . 2 . . . A 256 GLY HA3 . 11457 1 1253 . 1 1 101 101 GLY C C 13 174.577 0.3 . 1 . . . A 256 GLY C . 11457 1 1254 . 1 1 101 101 GLY CA C 13 45.521 0.3 . 1 . . . A 256 GLY CA . 11457 1 1255 . 1 1 101 101 GLY N N 15 107.93 0.3 . 1 . . . A 256 GLY N . 11457 1 1256 . 1 1 102 102 VAL H H 1 7.964 0.03 . 1 . . . A 257 VAL H . 11457 1 1257 . 1 1 102 102 VAL HA H 1 3.861 0.03 . 1 . . . A 257 VAL HA . 11457 1 1258 . 1 1 102 102 VAL HB H 1 1.901 0.03 . 1 . . . A 257 VAL HB . 11457 1 1259 . 1 1 102 102 VAL HG11 H 1 0.77 0.03 . 1 . . . A 257 VAL HG11 . 11457 1 1260 . 1 1 102 102 VAL HG12 H 1 0.77 0.03 . 1 . . . A 257 VAL HG12 . 11457 1 1261 . 1 1 102 102 VAL HG13 H 1 0.77 0.03 . 1 . . . A 257 VAL HG13 . 11457 1 1262 . 1 1 102 102 VAL HG21 H 1 0.876 0.03 . 1 . . . A 257 VAL HG21 . 11457 1 1263 . 1 1 102 102 VAL HG22 H 1 0.876 0.03 . 1 . . . A 257 VAL HG22 . 11457 1 1264 . 1 1 102 102 VAL HG23 H 1 0.876 0.03 . 1 . . . A 257 VAL HG23 . 11457 1 1265 . 1 1 102 102 VAL C C 13 175.537 0.3 . 1 . . . A 257 VAL C . 11457 1 1266 . 1 1 102 102 VAL CA C 13 63.522 0.3 . 1 . . . A 257 VAL CA . 11457 1 1267 . 1 1 102 102 VAL CB C 13 32.605 0.3 . 1 . . . A 257 VAL CB . 11457 1 1268 . 1 1 102 102 VAL CG1 C 13 22.209 0.3 . 1 . . . A 257 VAL CG1 . 11457 1 1269 . 1 1 102 102 VAL CG2 C 13 22.209 0.3 . 1 . . . A 257 VAL CG2 . 11457 1 1270 . 1 1 102 102 VAL N N 15 117.728 0.3 . 1 . . . A 257 VAL N . 11457 1 1271 . 1 1 103 103 ILE H H 1 6.669 0.03 . 1 . . . A 258 ILE H . 11457 1 1272 . 1 1 103 103 ILE HA H 1 4.374 0.03 . 1 . . . A 258 ILE HA . 11457 1 1273 . 1 1 103 103 ILE HB H 1 1.482 0.03 . 1 . . . A 258 ILE HB . 11457 1 1274 . 1 1 103 103 ILE HG12 H 1 0.547 0.03 . 2 . . . A 258 ILE HG12 . 11457 1 1275 . 1 1 103 103 ILE HG13 H 1 1.338 0.03 . 2 . . . A 258 ILE HG13 . 11457 1 1276 . 1 1 103 103 ILE HG21 H 1 0.732 0.03 . 1 . . . A 258 ILE HG21 . 11457 1 1277 . 1 1 103 103 ILE HG22 H 1 0.732 0.03 . 1 . . . A 258 ILE HG22 . 11457 1 1278 . 1 1 103 103 ILE HG23 H 1 0.732 0.03 . 1 . . . A 258 ILE HG23 . 11457 1 1279 . 1 1 103 103 ILE HD11 H 1 0.255 0.03 . 1 . . . A 258 ILE HD11 . 11457 1 1280 . 1 1 103 103 ILE HD12 H 1 0.255 0.03 . 1 . . . A 258 ILE HD12 . 11457 1 1281 . 1 1 103 103 ILE HD13 H 1 0.255 0.03 . 1 . . . A 258 ILE HD13 . 11457 1 1282 . 1 1 103 103 ILE C C 13 173.616 0.3 . 1 . . . A 258 ILE C . 11457 1 1283 . 1 1 103 103 ILE CA C 13 59.681 0.3 . 1 . . . A 258 ILE CA . 11457 1 1284 . 1 1 103 103 ILE CB C 13 41.466 0.3 . 1 . . . A 258 ILE CB . 11457 1 1285 . 1 1 103 103 ILE CG1 C 13 26.329 0.3 . 1 . . . A 258 ILE CG1 . 11457 1 1286 . 1 1 103 103 ILE CG2 C 13 17.179 0.3 . 1 . . . A 258 ILE CG2 . 11457 1 1287 . 1 1 103 103 ILE CD1 C 13 14.127 0.3 . 1 . . . A 258 ILE CD1 . 11457 1 1288 . 1 1 103 103 ILE N N 15 112.868 0.3 . 1 . . . A 258 ILE N . 11457 1 1289 . 1 1 104 104 GLU H H 1 9.174 0.03 . 1 . . . A 259 GLU H . 11457 1 1290 . 1 1 104 104 GLU HA H 1 4.584 0.03 . 1 . . . A 259 GLU HA . 11457 1 1291 . 1 1 104 104 GLU HB2 H 1 2.197 0.03 . 2 . . . A 259 GLU HB2 . 11457 1 1292 . 1 1 104 104 GLU HB3 H 1 2.343 0.03 . 2 . . . A 259 GLU HB3 . 11457 1 1293 . 1 1 104 104 GLU HG2 H 1 2.548 0.03 . 1 . . . A 259 GLU HG2 . 11457 1 1294 . 1 1 104 104 GLU HG3 H 1 2.548 0.03 . 1 . . . A 259 GLU HG3 . 11457 1 1295 . 1 1 104 104 GLU C C 13 175.597 0.3 . 1 . . . A 259 GLU C . 11457 1 1296 . 1 1 104 104 GLU CA C 13 56.037 0.3 . 1 . . . A 259 GLU CA . 11457 1 1297 . 1 1 104 104 GLU CB C 13 29.952 0.3 . 1 . . . A 259 GLU CB . 11457 1 1298 . 1 1 104 104 GLU CG C 13 35.736 0.3 . 1 . . . A 259 GLU CG . 11457 1 1299 . 1 1 104 104 GLU N N 15 123.424 0.3 . 1 . . . A 259 GLU N . 11457 1 1300 . 1 1 105 105 ALA H H 1 8.46 0.03 . 1 . . . A 260 ALA H . 11457 1 1301 . 1 1 105 105 ALA HA H 1 4.097 0.03 . 1 . . . A 260 ALA HA . 11457 1 1302 . 1 1 105 105 ALA HB1 H 1 1.259 0.03 . 1 . . . A 260 ALA HB1 . 11457 1 1303 . 1 1 105 105 ALA HB2 H 1 1.259 0.03 . 1 . . . A 260 ALA HB2 . 11457 1 1304 . 1 1 105 105 ALA HB3 H 1 1.259 0.03 . 1 . . . A 260 ALA HB3 . 11457 1 1305 . 1 1 105 105 ALA C C 13 177.255 0.3 . 1 . . . A 260 ALA C . 11457 1 1306 . 1 1 105 105 ALA CA C 13 52.428 0.3 . 1 . . . A 260 ALA CA . 11457 1 1307 . 1 1 105 105 ALA CB C 13 18.976 0.3 . 1 . . . A 260 ALA CB . 11457 1 1308 . 1 1 105 105 ALA N N 15 120.34 0.3 . 1 . . . A 260 ALA N . 11457 1 1309 . 1 1 106 106 TYR H H 1 7.862 0.03 . 1 . . . A 261 TYR H . 11457 1 1310 . 1 1 106 106 TYR HA H 1 3.648 0.03 . 1 . . . A 261 TYR HA . 11457 1 1311 . 1 1 106 106 TYR HB2 H 1 0.099 0.03 . 2 . . . A 261 TYR HB2 . 11457 1 1312 . 1 1 106 106 TYR HB3 H 1 1.52 0.03 . 2 . . . A 261 TYR HB3 . 11457 1 1313 . 1 1 106 106 TYR HD1 H 1 6.664 0.03 . 1 . . . A 261 TYR HD1 . 11457 1 1314 . 1 1 106 106 TYR HD2 H 1 6.664 0.03 . 1 . . . A 261 TYR HD2 . 11457 1 1315 . 1 1 106 106 TYR HE1 H 1 6.678 0.03 . 1 . . . A 261 TYR HE1 . 11457 1 1316 . 1 1 106 106 TYR HE2 H 1 6.678 0.03 . 1 . . . A 261 TYR HE2 . 11457 1 1317 . 1 1 106 106 TYR C C 13 175.685 0.3 . 1 . . . A 261 TYR C . 11457 1 1318 . 1 1 106 106 TYR CA C 13 59.432 0.3 . 1 . . . A 261 TYR CA . 11457 1 1319 . 1 1 106 106 TYR CB C 13 35.882 0.3 . 1 . . . A 261 TYR CB . 11457 1 1320 . 1 1 106 106 TYR CD1 C 13 133.409 0.3 . 1 . . . A 261 TYR CD1 . 11457 1 1321 . 1 1 106 106 TYR CD2 C 13 133.409 0.3 . 1 . . . A 261 TYR CD2 . 11457 1 1322 . 1 1 106 106 TYR CE1 C 13 117.706 0.3 . 1 . . . A 261 TYR CE1 . 11457 1 1323 . 1 1 106 106 TYR CE2 C 13 117.706 0.3 . 1 . . . A 261 TYR CE2 . 11457 1 1324 . 1 1 106 106 TYR N N 15 123.923 0.3 . 1 . . . A 261 TYR N . 11457 1 1325 . 1 1 107 107 SER H H 1 7.186 0.03 . 1 . . . A 262 SER H . 11457 1 1326 . 1 1 107 107 SER HA H 1 4.067 0.03 . 1 . . . A 262 SER HA . 11457 1 1327 . 1 1 107 107 SER HB2 H 1 3.47 0.03 . 2 . . . A 262 SER HB2 . 11457 1 1328 . 1 1 107 107 SER HB3 H 1 3.543 0.03 . 2 . . . A 262 SER HB3 . 11457 1 1329 . 1 1 107 107 SER C C 13 173.141 0.3 . 1 . . . A 262 SER C . 11457 1 1330 . 1 1 107 107 SER CA C 13 56.873 0.3 . 1 . . . A 262 SER CA . 11457 1 1331 . 1 1 107 107 SER CB C 13 64.357 0.3 . 1 . . . A 262 SER CB . 11457 1 1332 . 1 1 107 107 SER N N 15 120.04 0.3 . 1 . . . A 262 SER N . 11457 1 1333 . 1 1 108 108 SER H H 1 7.907 0.03 . 1 . . . A 263 SER H . 11457 1 1334 . 1 1 108 108 SER HA H 1 4.215 0.03 . 1 . . . A 263 SER HA . 11457 1 1335 . 1 1 108 108 SER HB2 H 1 3.806 0.03 . 2 . . . A 263 SER HB2 . 11457 1 1336 . 1 1 108 108 SER HB3 H 1 3.74 0.03 . 2 . . . A 263 SER HB3 . 11457 1 1337 . 1 1 108 108 SER C C 13 174.387 0.3 . 1 . . . A 263 SER C . 11457 1 1338 . 1 1 108 108 SER CA C 13 58.193 0.3 . 1 . . . A 263 SER CA . 11457 1 1339 . 1 1 108 108 SER CB C 13 63.836 0.3 . 1 . . . A 263 SER CB . 11457 1 1340 . 1 1 108 108 SER N N 15 117.614 0.3 . 1 . . . A 263 SER N . 11457 1 1341 . 1 1 109 109 GLY H H 1 8.057 0.03 . 1 . . . A 264 GLY H . 11457 1 1342 . 1 1 109 109 GLY HA2 H 1 4.033 0.03 . 2 . . . A 264 GLY HA2 . 11457 1 1343 . 1 1 109 109 GLY HA3 H 1 4.058 0.03 . 2 . . . A 264 GLY HA3 . 11457 1 1344 . 1 1 109 109 GLY C C 13 171.63 0.3 . 1 . . . A 264 GLY C . 11457 1 1345 . 1 1 109 109 GLY CA C 13 44.622 0.3 . 1 . . . A 264 GLY CA . 11457 1 1346 . 1 1 109 109 GLY N N 15 110.485 0.3 . 1 . . . A 264 GLY N . 11457 1 1347 . 1 1 110 110 PRO HA H 1 4.429 0.03 . 1 . . . A 265 PRO HA . 11457 1 1348 . 1 1 110 110 PRO HB2 H 1 2.253 0.03 . 2 . . . A 265 PRO HB2 . 11457 1 1349 . 1 1 110 110 PRO HB3 H 1 1.926 0.03 . 2 . . . A 265 PRO HB3 . 11457 1 1350 . 1 1 110 110 PRO HG2 H 1 1.977 0.03 . 2 . . . A 265 PRO HG2 . 11457 1 1351 . 1 1 110 110 PRO HG3 H 1 1.977 0.03 . 2 . . . A 265 PRO HG3 . 11457 1 1352 . 1 1 110 110 PRO HD2 H 1 3.57 0.03 . 1 . . . A 265 PRO HD2 . 11457 1 1353 . 1 1 110 110 PRO HD3 H 1 3.57 0.03 . 1 . . . A 265 PRO HD3 . 11457 1 1354 . 1 1 110 110 PRO C C 13 177.33 0.3 . 1 . . . A 265 PRO C . 11457 1 1355 . 1 1 110 110 PRO CA C 13 63.167 0.3 . 1 . . . A 265 PRO CA . 11457 1 1356 . 1 1 110 110 PRO CB C 13 32.142 0.3 . 1 . . . A 265 PRO CB . 11457 1 1357 . 1 1 110 110 PRO CG C 13 27.108 0.3 . 1 . . . A 265 PRO CG . 11457 1 1358 . 1 1 110 110 PRO CD C 13 49.753 0.3 . 1 . . . A 265 PRO CD . 11457 1 1359 . 1 1 111 111 SER H H 1 8.482 0.03 . 1 . . . A 266 SER H . 11457 1 1360 . 1 1 111 111 SER HA H 1 4.455 0.03 . 1 . . . A 266 SER HA . 11457 1 1361 . 1 1 111 111 SER HB2 H 1 3.857 0.03 . 1 . . . A 266 SER HB2 . 11457 1 1362 . 1 1 111 111 SER HB3 H 1 3.857 0.03 . 1 . . . A 266 SER HB3 . 11457 1 1363 . 1 1 111 111 SER C C 13 174.632 0.3 . 1 . . . A 266 SER C . 11457 1 1364 . 1 1 111 111 SER CA C 13 58.291 0.3 . 1 . . . A 266 SER CA . 11457 1 1365 . 1 1 111 111 SER CB C 13 63.779 0.3 . 1 . . . A 266 SER CB . 11457 1 1366 . 1 1 111 111 SER N N 15 116.513 0.3 . 1 . . . A 266 SER N . 11457 1 1367 . 1 1 112 112 SER H H 1 8.299 0.03 . 1 . . . A 267 SER H . 11457 1 1368 . 1 1 112 112 SER HA H 1 4.455 0.03 . 1 . . . A 267 SER HA . 11457 1 1369 . 1 1 112 112 SER HB2 H 1 3.86 0.03 . 1 . . . A 267 SER HB2 . 11457 1 1370 . 1 1 112 112 SER HB3 H 1 3.86 0.03 . 1 . . . A 267 SER HB3 . 11457 1 1371 . 1 1 112 112 SER C C 13 173.899 0.3 . 1 . . . A 267 SER C . 11457 1 1372 . 1 1 112 112 SER CA C 13 58.351 0.3 . 1 . . . A 267 SER CA . 11457 1 1373 . 1 1 112 112 SER CB C 13 64.032 0.3 . 1 . . . A 267 SER CB . 11457 1 1374 . 1 1 112 112 SER N N 15 117.868 0.3 . 1 . . . A 267 SER N . 11457 1 1375 . 1 1 113 113 GLY H H 1 8.013 0.03 . 1 . . . A 268 GLY H . 11457 1 1376 . 1 1 113 113 GLY C C 13 178.946 0.3 . 1 . . . A 268 GLY C . 11457 1 1377 . 1 1 113 113 GLY CA C 13 46.264 0.3 . 1 . . . A 268 GLY CA . 11457 1 1378 . 1 1 113 113 GLY N N 15 116.851 0.3 . 1 . . . A 268 GLY N . 11457 1 stop_ save_