data_27634 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27634 _Entry.Title ; 1H, 13C, and 15N Chemical Shift Assignments of the C-terminal region of the Menangle virus Phosphoprotein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-10-01 _Entry.Accession_date 2018-10-01 _Entry.Last_release_date 2018-10-01 _Entry.Original_release_date 2018-10-01 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.1.32 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Richard Kingston . L. . . 27634 2 Nicole Herr . . . . 27634 3 Melissa Webby . N. . . 27634 4 Esther Bulloch . M.M. . . 27634 5 Michael Schmitz . . . . 27634 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 27634 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27634 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 513 27634 '15N chemical shifts' 127 27634 '1H chemical shifts' 855 27634 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 . . 2019-09-12 . original BMRB . 27634 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27634 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 30680534 _Citation.Full_citation . _Citation.Title ; NMR chemical shift assignment of the C-terminal region of the Menangle virus phosphoprotein ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 13 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1874-270X _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 195 _Citation.Page_last 199 _Citation.Year 2019 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Nicole Herr . . . . 27634 1 2 Melissa Webby . N. . . 27634 1 3 Esther Bulloch . M.M. . . 27634 1 4 Michael Schmitz . . . . 27634 1 5 Richard Kingston . L. . . 27634 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27634 _Assembly.ID 1 _Assembly.Name 'Menangle virus Phosphoprotein, C-terminal region' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass 13137.174 _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 'Menangle virus Phosphoprotein, C-terminal region' 1 $MenV_P_267_388 A . yes native no no . . 'MenV P amino acids 267 - 388' 27634 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_MenV_P_267_388 _Entity.Sf_category entity _Entity.Sf_framecode MenV_P_267_388 _Entity.Entry_ID 27634 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name MenV_P_267_388 _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 ; TTIKIMDPGVGDGATAAKSK RLFKEAPVVVSGPVIGDNPI VDADTIQLDELARPSLPKTK SQKSSAASPAALSGYKMTLL ALIKESIPNQAKRQKFEMQV GGIRNEQDFKNLRREIIRSA AQ ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq ; 267Thr 268Thr 269Ile ...... 386Ala 387Ala 388Gln ; _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 122 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment 267_388 _Entity.Mutation C352S _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13137.174 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'MenV P amino acids 267 - 388' _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . yes GenBank AF326114 . . . . . . . . . . . . . . . . 27634 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'viral protein' 27634 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 1 267 THR . 27634 1 2 268 THR . 27634 1 3 269 ILE . 27634 1 4 270 LYS . 27634 1 5 271 ILE . 27634 1 6 272 MET . 27634 1 7 273 ASP . 27634 1 8 274 PRO . 27634 1 9 275 GLY . 27634 1 10 276 VAL . 27634 1 11 277 GLY . 27634 1 12 278 ASP . 27634 1 13 279 GLY . 27634 1 14 280 ALA . 27634 1 15 281 THR . 27634 1 16 282 ALA . 27634 1 17 283 ALA . 27634 1 18 284 LYS . 27634 1 19 285 SER . 27634 1 20 286 LYS . 27634 1 21 287 ARG . 27634 1 22 288 LEU . 27634 1 23 289 PHE . 27634 1 24 290 LYS . 27634 1 25 291 GLU . 27634 1 26 292 ALA . 27634 1 27 293 PRO . 27634 1 28 294 VAL . 27634 1 29 295 VAL . 27634 1 30 296 VAL . 27634 1 31 297 SER . 27634 1 32 298 GLY . 27634 1 33 299 PRO . 27634 1 34 300 VAL . 27634 1 35 301 ILE . 27634 1 36 302 GLY . 27634 1 37 303 ASP . 27634 1 38 304 ASN . 27634 1 39 305 PRO . 27634 1 40 306 ILE . 27634 1 41 307 VAL . 27634 1 42 308 ASP . 27634 1 43 309 ALA . 27634 1 44 310 ASP . 27634 1 45 311 THR . 27634 1 46 312 ILE . 27634 1 47 313 GLN . 27634 1 48 314 LEU . 27634 1 49 315 ASP . 27634 1 50 316 GLU . 27634 1 51 317 LEU . 27634 1 52 318 ALA . 27634 1 53 319 ARG . 27634 1 54 320 PRO . 27634 1 55 321 SER . 27634 1 56 322 LEU . 27634 1 57 323 PRO . 27634 1 58 324 LYS . 27634 1 59 325 THR . 27634 1 60 326 LYS . 27634 1 61 327 SER . 27634 1 62 328 GLN . 27634 1 63 329 LYS . 27634 1 64 330 SER . 27634 1 65 331 SER . 27634 1 66 332 ALA . 27634 1 67 333 ALA . 27634 1 68 334 SER . 27634 1 69 335 PRO . 27634 1 70 336 ALA . 27634 1 71 337 ALA . 27634 1 72 338 LEU . 27634 1 73 339 SER . 27634 1 74 340 GLY . 27634 1 75 341 TYR . 27634 1 76 342 LYS . 27634 1 77 343 MET . 27634 1 78 344 THR . 27634 1 79 345 LEU . 27634 1 80 346 LEU . 27634 1 81 347 ALA . 27634 1 82 348 LEU . 27634 1 83 349 ILE . 27634 1 84 350 LYS . 27634 1 85 351 GLU . 27634 1 86 352 SER . 27634 1 87 353 ILE . 27634 1 88 354 PRO . 27634 1 89 355 ASN . 27634 1 90 356 GLN . 27634 1 91 357 ALA . 27634 1 92 358 LYS . 27634 1 93 359 ARG . 27634 1 94 360 GLN . 27634 1 95 361 LYS . 27634 1 96 362 PHE . 27634 1 97 363 GLU . 27634 1 98 364 MET . 27634 1 99 365 GLN . 27634 1 100 366 VAL . 27634 1 101 367 GLY . 27634 1 102 368 GLY . 27634 1 103 369 ILE . 27634 1 104 370 ARG . 27634 1 105 371 ASN . 27634 1 106 372 GLU . 27634 1 107 373 GLN . 27634 1 108 374 ASP . 27634 1 109 375 PHE . 27634 1 110 376 LYS . 27634 1 111 377 ASN . 27634 1 112 378 LEU . 27634 1 113 379 ARG . 27634 1 114 380 ARG . 27634 1 115 381 GLU . 27634 1 116 382 ILE . 27634 1 117 383 ILE . 27634 1 118 384 ARG . 27634 1 119 385 SER . 27634 1 120 386 ALA . 27634 1 121 387 ALA . 27634 1 122 388 GLN . 27634 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 . THR 1 1 27634 1 . THR 2 2 27634 1 . ILE 3 3 27634 1 . LYS 4 4 27634 1 . ILE 5 5 27634 1 . MET 6 6 27634 1 . ASP 7 7 27634 1 . PRO 8 8 27634 1 . GLY 9 9 27634 1 . VAL 10 10 27634 1 . GLY 11 11 27634 1 . ASP 12 12 27634 1 . GLY 13 13 27634 1 . ALA 14 14 27634 1 . THR 15 15 27634 1 . ALA 16 16 27634 1 . ALA 17 17 27634 1 . LYS 18 18 27634 1 . SER 19 19 27634 1 . LYS 20 20 27634 1 . ARG 21 21 27634 1 . LEU 22 22 27634 1 . PHE 23 23 27634 1 . LYS 24 24 27634 1 . GLU 25 25 27634 1 . ALA 26 26 27634 1 . PRO 27 27 27634 1 . VAL 28 28 27634 1 . VAL 29 29 27634 1 . VAL 30 30 27634 1 . SER 31 31 27634 1 . GLY 32 32 27634 1 . PRO 33 33 27634 1 . VAL 34 34 27634 1 . ILE 35 35 27634 1 . GLY 36 36 27634 1 . ASP 37 37 27634 1 . ASN 38 38 27634 1 . PRO 39 39 27634 1 . ILE 40 40 27634 1 . VAL 41 41 27634 1 . ASP 42 42 27634 1 . ALA 43 43 27634 1 . ASP 44 44 27634 1 . THR 45 45 27634 1 . ILE 46 46 27634 1 . GLN 47 47 27634 1 . LEU 48 48 27634 1 . ASP 49 49 27634 1 . GLU 50 50 27634 1 . LEU 51 51 27634 1 . ALA 52 52 27634 1 . ARG 53 53 27634 1 . PRO 54 54 27634 1 . SER 55 55 27634 1 . LEU 56 56 27634 1 . PRO 57 57 27634 1 . LYS 58 58 27634 1 . THR 59 59 27634 1 . LYS 60 60 27634 1 . SER 61 61 27634 1 . GLN 62 62 27634 1 . LYS 63 63 27634 1 . SER 64 64 27634 1 . SER 65 65 27634 1 . ALA 66 66 27634 1 . ALA 67 67 27634 1 . SER 68 68 27634 1 . PRO 69 69 27634 1 . ALA 70 70 27634 1 . ALA 71 71 27634 1 . LEU 72 72 27634 1 . SER 73 73 27634 1 . GLY 74 74 27634 1 . TYR 75 75 27634 1 . LYS 76 76 27634 1 . MET 77 77 27634 1 . THR 78 78 27634 1 . LEU 79 79 27634 1 . LEU 80 80 27634 1 . ALA 81 81 27634 1 . LEU 82 82 27634 1 . ILE 83 83 27634 1 . LYS 84 84 27634 1 . GLU 85 85 27634 1 . SER 86 86 27634 1 . ILE 87 87 27634 1 . PRO 88 88 27634 1 . ASN 89 89 27634 1 . GLN 90 90 27634 1 . ALA 91 91 27634 1 . LYS 92 92 27634 1 . ARG 93 93 27634 1 . GLN 94 94 27634 1 . LYS 95 95 27634 1 . PHE 96 96 27634 1 . GLU 97 97 27634 1 . MET 98 98 27634 1 . GLN 99 99 27634 1 . VAL 100 100 27634 1 . GLY 101 101 27634 1 . GLY 102 102 27634 1 . ILE 103 103 27634 1 . ARG 104 104 27634 1 . ASN 105 105 27634 1 . GLU 106 106 27634 1 . GLN 107 107 27634 1 . ASP 108 108 27634 1 . PHE 109 109 27634 1 . LYS 110 110 27634 1 . ASN 111 111 27634 1 . LEU 112 112 27634 1 . ARG 113 113 27634 1 . ARG 114 114 27634 1 . GLU 115 115 27634 1 . ILE 116 116 27634 1 . ILE 117 117 27634 1 . ARG 118 118 27634 1 . SER 119 119 27634 1 . ALA 120 120 27634 1 . ALA 121 121 27634 1 . GLN 122 122 27634 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 27634 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $MenV_P_267_388 . 1979164 organism . 'Rubulavirus, Menangle virus' 'Menangle rubulavirus' . . Viruses . Menangle rubulavirus . . . . . . . . . . . . . 27634 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 27634 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $MenV_P_267_388 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pMW591 . . . 27634 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27634 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '17.1 mM sodium phosphate, pH 7.0, 42.8 mM sodium chloride 0.43 mM sodium azide, 0.1 mM DSS' _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 MenV_P_267_388 '[U-100% 13C; U-100% 15N]' . . 1 $MenV_P_267_388 . . . 0.7 1.2 mM . . . . 27634 1 2 'sodium phosphate' 'natural abundance' . . . . . . 17.1 . . mM . . . . 27634 1 3 'sodium chloride' 'natural abundance' . . . . . . 42.8 . . mM . . . . 27634 1 4 'sodium azide' 'natural abundance' . . . . . . 0.43 . . mM . . . . 27634 1 5 DSS 'natural abundance' . . . . . . 0.1 . . mM . . . . 27634 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 27634 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _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' 42.8 . mM 27634 1 pH 7.0 . pH 27634 1 pressure 1 . atm 27634 1 temperature 283.15 . K 27634 1 stop_ save_ ############################ # Computer software used # ############################ save_CcpNmr_Analysis _Software.Sf_category software _Software.Sf_framecode CcpNmr_Analysis _Software.Entry_ID 27634 _Software.ID 1 _Software.Type . _Software.Name CcpNmr_Analysis _Software.Version 2.4 _Software.DOI . _Software.Details 'The CCPN NMR assignment and data analysis application' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN 'Department of Biochemistry, Cambridge CB2 1GA, UK' http://www.ccpn.ac.uk 27634 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 27634 1 . collection 27634 1 stop_ save_ save_Biospin _Software.Sf_category software _Software.Sf_framecode Biospin _Software.Entry_ID 27634 _Software.ID 2 _Software.Type . _Software.Name Biospin _Software.Version 2.4 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 27634 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 27634 2 . collection 27634 2 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 27634 _Software.ID 3 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 27634 3 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . processing 27634 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 27634 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _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 27634 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 27634 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 27634 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 2 '2D (CT) HC-HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 3 '2D fHSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 4 '3D 15N-edited NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 5 '3D 15N-edited TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 6 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 7 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 8 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 9 '3D HNCACO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 10 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 11 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 12 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 13 '3D (C)(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 14 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 15 '3D HBHACONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 16 '3D (H)N(COCA)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 17 '3D HHC-NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 18 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 19 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 20 '2D (HB)CB(CGCD)HD' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 21 '2D (HB)CB(CGCDCE)HE' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 22 '2D H2(C)N' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 23 '3D HNHA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 1 24 '3D HNHB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27634 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 27634 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 27634 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27634 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27634 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 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list _Assigned_chem_shift_list.Entry_ID 27634 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 27634 1 2 '2D (CT) HC-HSQC' . . . 27634 1 3 '2D fHSQC' . . . 27634 1 4 '3D 15N-edited NOESY' . . . 27634 1 5 '3D 15N-edited TOCSY' . . . 27634 1 6 '3D HNCO' . . . 27634 1 7 '3D HNCA' . . . 27634 1 8 '3D HNCACB' . . . 27634 1 9 '3D HNCACO' . . . 27634 1 10 '3D HN(CA)CO' . . . 27634 1 11 '3D HN(CO)CA' . . . 27634 1 12 '3D CBCA(CO)NH' . . . 27634 1 13 '3D (C)(CO)NH' . . . 27634 1 14 '3D H(CCO)NH' . . . 27634 1 15 '3D HBHACONH' . . . 27634 1 16 '3D (H)N(COCA)NH' . . . 27634 1 17 '3D HHC-NOESY' . . . 27634 1 18 '3D HCCH-TOCSY' . . . 27634 1 19 '3D HCCH-COSY' . . . 27634 1 20 '2D (HB)CB(CGCD)HD' . . . 27634 1 21 '2D (HB)CB(CGCDCE)HE' . . . 27634 1 22 '2D H2(C)N' . . . 27634 1 23 '3D HNHA' . . . 27634 1 24 '3D HNHB' . . . 27634 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $CcpNmr_Analysis . . 27634 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 THR HA H 1 4.385 0.002 . 1 . . . . . 268 THR HA . 27634 1 2 . 1 1 2 2 THR HB H 1 4.13 . . 1 . . . . . 268 THR HB . 27634 1 3 . 1 1 2 2 THR HG21 H 1 1.202 . . 1 . . . . . 268 THR HG21 . 27634 1 4 . 1 1 2 2 THR HG22 H 1 1.202 . . 1 . . . . . 268 THR HG22 . 27634 1 5 . 1 1 2 2 THR HG23 H 1 1.202 . . 1 . . . . . 268 THR HG23 . 27634 1 6 . 1 1 2 2 THR C C 13 174.103 . . 1 . . . . . 268 THR C . 27634 1 7 . 1 1 2 2 THR CA C 13 62.16 0.039 . 1 . . . . . 268 THR CA . 27634 1 8 . 1 1 2 2 THR CB C 13 69.892 . . 1 . . . . . 268 THR CB . 27634 1 9 . 1 1 2 2 THR CG2 C 13 21.791 . . 1 . . . . . 268 THR CG2 . 27634 1 10 . 1 1 3 3 ILE H H 1 8.466 0.011 . 1 . . . . . 269 ILE H . 27634 1 11 . 1 1 3 3 ILE HA H 1 4.137 0.006 . 1 . . . . . 269 ILE HA . 27634 1 12 . 1 1 3 3 ILE HB H 1 1.821 0.006 . 1 . . . . . 269 ILE HB . 27634 1 13 . 1 1 3 3 ILE HG12 H 1 1.182 0.005 . 2 . . . . . 269 ILE HG12 . 27634 1 14 . 1 1 3 3 ILE HG13 H 1 1.489 0.007 . 2 . . . . . 269 ILE HG13 . 27634 1 15 . 1 1 3 3 ILE HG21 H 1 0.876 0.009 . 1 . . . . . 269 ILE HG21 . 27634 1 16 . 1 1 3 3 ILE HG22 H 1 0.876 0.009 . 1 . . . . . 269 ILE HG22 . 27634 1 17 . 1 1 3 3 ILE HG23 H 1 0.876 0.009 . 1 . . . . . 269 ILE HG23 . 27634 1 18 . 1 1 3 3 ILE HD11 H 1 0.878 0.01 . 1 . . . . . 269 ILE HD11 . 27634 1 19 . 1 1 3 3 ILE HD12 H 1 0.878 0.01 . 1 . . . . . 269 ILE HD12 . 27634 1 20 . 1 1 3 3 ILE HD13 H 1 0.878 0.01 . 1 . . . . . 269 ILE HD13 . 27634 1 21 . 1 1 3 3 ILE C C 13 175.777 0.002 . 1 . . . . . 269 ILE C . 27634 1 22 . 1 1 3 3 ILE CA C 13 61.043 0.007 . 1 . . . . . 269 ILE CA . 27634 1 23 . 1 1 3 3 ILE CB C 13 38.527 0.013 . 1 . . . . . 269 ILE CB . 27634 1 24 . 1 1 3 3 ILE CG1 C 13 27.286 . . 1 . . . . . 269 ILE CG1 . 27634 1 25 . 1 1 3 3 ILE CG2 C 13 17.404 . . 1 . . . . . 269 ILE CG2 . 27634 1 26 . 1 1 3 3 ILE CD1 C 13 12.645 . . 1 . . . . . 269 ILE CD1 . 27634 1 27 . 1 1 3 3 ILE N N 15 125.571 0.005 . 1 . . . . . 269 ILE N . 27634 1 28 . 1 1 4 4 LYS H H 1 8.528 0.004 . 1 . . . . . 270 LYS H . 27634 1 29 . 1 1 4 4 LYS HA H 1 4.341 0.005 . 1 . . . . . 270 LYS HA . 27634 1 30 . 1 1 4 4 LYS HB2 H 1 1.732 0.011 . 2 . . . . . 270 LYS HB2 . 27634 1 31 . 1 1 4 4 LYS HB3 H 1 1.732 0.011 . 2 . . . . . 270 LYS HB3 . 27634 1 32 . 1 1 4 4 LYS HG2 H 1 1.38 0.008 . 2 . . . . . 270 LYS HG2 . 27634 1 33 . 1 1 4 4 LYS HG3 H 1 1.38 0.008 . 2 . . . . . 270 LYS HG3 . 27634 1 34 . 1 1 4 4 LYS HD2 H 1 1.69 . . 2 . . . . . 270 LYS HD2 . 27634 1 35 . 1 1 4 4 LYS HD3 H 1 1.69 . . 2 . . . . . 270 LYS HD3 . 27634 1 36 . 1 1 4 4 LYS HE2 H 1 2.988 0.005 . 2 . . . . . 270 LYS HE2 . 27634 1 37 . 1 1 4 4 LYS HE3 H 1 2.988 0.005 . 2 . . . . . 270 LYS HE3 . 27634 1 38 . 1 1 4 4 LYS C C 13 176.004 0.003 . 1 . . . . . 270 LYS C . 27634 1 39 . 1 1 4 4 LYS CA C 13 55.997 0.005 . 1 . . . . . 270 LYS CA . 27634 1 40 . 1 1 4 4 LYS CB C 13 33.238 0.02 . 1 . . . . . 270 LYS CB . 27634 1 41 . 1 1 4 4 LYS CG C 13 24.741 . . 1 . . . . . 270 LYS CG . 27634 1 42 . 1 1 4 4 LYS CD C 13 29.055 . . 1 . . . . . 270 LYS CD . 27634 1 43 . 1 1 4 4 LYS CE C 13 42.159 . . 1 . . . . . 270 LYS CE . 27634 1 44 . 1 1 4 4 LYS N N 15 127.372 0.002 . 1 . . . . . 270 LYS N . 27634 1 45 . 1 1 5 5 ILE H H 1 8.409 0.003 . 1 . . . . . 271 ILE H . 27634 1 46 . 1 1 5 5 ILE HA H 1 4.116 0.003 . 1 . . . . . 271 ILE HA . 27634 1 47 . 1 1 5 5 ILE HB H 1 1.829 0.001 . 1 . . . . . 271 ILE HB . 27634 1 48 . 1 1 5 5 ILE HG12 H 1 1.497 0.011 . 2 . . . . . 271 ILE HG12 . 27634 1 49 . 1 1 5 5 ILE HG13 H 1 1.194 . . 2 . . . . . 271 ILE HG13 . 27634 1 50 . 1 1 5 5 ILE HG21 H 1 0.889 0.01 . 1 . . . . . 271 ILE HG21 . 27634 1 51 . 1 1 5 5 ILE HG22 H 1 0.889 0.01 . 1 . . . . . 271 ILE HG22 . 27634 1 52 . 1 1 5 5 ILE HG23 H 1 0.889 0.01 . 1 . . . . . 271 ILE HG23 . 27634 1 53 . 1 1 5 5 ILE HD11 H 1 0.889 0.011 . 1 . . . . . 271 ILE HD11 . 27634 1 54 . 1 1 5 5 ILE HD12 H 1 0.889 0.011 . 1 . . . . . 271 ILE HD12 . 27634 1 55 . 1 1 5 5 ILE HD13 H 1 0.889 0.011 . 1 . . . . . 271 ILE HD13 . 27634 1 56 . 1 1 5 5 ILE C C 13 176.164 0.005 . 1 . . . . . 271 ILE C . 27634 1 57 . 1 1 5 5 ILE CA C 13 60.842 0.005 . 1 . . . . . 271 ILE CA . 27634 1 58 . 1 1 5 5 ILE CB C 13 38.516 0.011 . 1 . . . . . 271 ILE CB . 27634 1 59 . 1 1 5 5 ILE CG1 C 13 27.235 . . 1 . . . . . 271 ILE CG1 . 27634 1 60 . 1 1 5 5 ILE CG2 C 13 17.501 . . 1 . . . . . 271 ILE CG2 . 27634 1 61 . 1 1 5 5 ILE CD1 C 13 12.545 . . 1 . . . . . 271 ILE CD1 . 27634 1 62 . 1 1 5 5 ILE N N 15 124.48 0.002 . 1 . . . . . 271 ILE N . 27634 1 63 . 1 1 6 6 MET H H 1 8.597 0.002 . 1 . . . . . 272 MET H . 27634 1 64 . 1 1 6 6 MET HA H 1 4.478 0.007 . 1 . . . . . 272 MET HA . 27634 1 65 . 1 1 6 6 MET HB2 H 1 2.009 0.008 . 1 . . . . . 272 MET HB2 . 27634 1 66 . 1 1 6 6 MET HB3 H 1 2.009 0.008 . 1 . . . . . 272 MET HB3 . 27634 1 67 . 1 1 6 6 MET HG2 H 1 2.55 0.009 . 1 . . . . . 272 MET HG2 . 27634 1 68 . 1 1 6 6 MET HG3 H 1 2.55 0.009 . 1 . . . . . 272 MET HG3 . 27634 1 69 . 1 1 6 6 MET C C 13 175.488 0.004 . 1 . . . . . 272 MET C . 27634 1 70 . 1 1 6 6 MET CA C 13 54.959 0.006 . 1 . . . . . 272 MET CA . 27634 1 71 . 1 1 6 6 MET CB C 13 32.829 0.077 . 1 . . . . . 272 MET CB . 27634 1 72 . 1 1 6 6 MET CG C 13 31.852 . . 1 . . . . . 272 MET CG . 27634 1 73 . 1 1 6 6 MET N N 15 125.809 0.013 . 1 . . . . . 272 MET N . 27634 1 74 . 1 1 7 7 ASP H H 1 8.488 0.002 . 1 . . . . . 273 ASP H . 27634 1 75 . 1 1 7 7 ASP HA H 1 4.864 0.003 . 1 . . . . . 273 ASP HA . 27634 1 76 . 1 1 7 7 ASP HB2 H 1 2.761 0.009 . 2 . . . . . 273 ASP HB2 . 27634 1 77 . 1 1 7 7 ASP HB3 H 1 2.538 0.009 . 2 . . . . . 273 ASP HB3 . 27634 1 78 . 1 1 7 7 ASP C C 13 174.724 . . 1 . . . . . 273 ASP C . 27634 1 79 . 1 1 7 7 ASP CA C 13 52.173 . . 1 . . . . . 273 ASP CA . 27634 1 80 . 1 1 7 7 ASP CB C 13 41.291 . . 1 . . . . . 273 ASP CB . 27634 1 81 . 1 1 7 7 ASP N N 15 123.964 0.073 . 1 . . . . . 273 ASP N . 27634 1 82 . 1 1 8 8 PRO HA H 1 4.425 . . 1 . . . . . 274 PRO HA . 27634 1 83 . 1 1 8 8 PRO HB2 H 1 2.278 0.005 . 2 . . . . . 274 PRO HB2 . 27634 1 84 . 1 1 8 8 PRO HB3 H 1 2.013 0.014 . 2 . . . . . 274 PRO HB3 . 27634 1 85 . 1 1 8 8 PRO HG2 H 1 1.997 0.001 . 2 . . . . . 274 PRO HG2 . 27634 1 86 . 1 1 8 8 PRO HG3 H 1 2.031 0.002 . 2 . . . . . 274 PRO HG3 . 27634 1 87 . 1 1 8 8 PRO HD2 H 1 3.843 . . 2 . . . . . 274 PRO HD2 . 27634 1 88 . 1 1 8 8 PRO HD3 H 1 3.843 . . 2 . . . . . 274 PRO HD3 . 27634 1 89 . 1 1 8 8 PRO C C 13 177.64 . . 1 . . . . . 274 PRO C . 27634 1 90 . 1 1 8 8 PRO CA C 13 63.601 0 . 1 . . . . . 274 PRO CA . 27634 1 91 . 1 1 8 8 PRO CB C 13 32.097 . . 1 . . . . . 274 PRO CB . 27634 1 92 . 1 1 8 8 PRO CG C 13 27.04 0 . 1 . . . . . 274 PRO CG . 27634 1 93 . 1 1 8 8 PRO CD C 13 50.815 . . 1 . . . . . 274 PRO CD . 27634 1 94 . 1 1 9 9 GLY H H 1 8.632 0.001 . 1 . . . . . 275 GLY H . 27634 1 95 . 1 1 9 9 GLY HA2 H 1 3.947 0.009 . 1 . . . . . 275 GLY HA2 . 27634 1 96 . 1 1 9 9 GLY HA3 H 1 3.947 0.009 . 1 . . . . . 275 GLY HA3 . 27634 1 97 . 1 1 9 9 GLY C C 13 174.453 0.011 . 1 . . . . . 275 GLY C . 27634 1 98 . 1 1 9 9 GLY CA C 13 45.332 0.005 . 1 . . . . . 275 GLY CA . 27634 1 99 . 1 1 9 9 GLY N N 15 109.017 0.017 . 1 . . . . . 275 GLY N . 27634 1 100 . 1 1 10 10 VAL H H 1 7.99 0.004 . 1 . . . . . 276 VAL H . 27634 1 101 . 1 1 10 10 VAL HA H 1 4.159 0.002 . 1 . . . . . 276 VAL HA . 27634 1 102 . 1 1 10 10 VAL HB H 1 2.142 0.007 . 1 . . . . . 276 VAL HB . 27634 1 103 . 1 1 10 10 VAL HG11 H 1 0.948 0.003 . 2 . . . . . 276 VAL HG11 . 27634 1 104 . 1 1 10 10 VAL HG12 H 1 0.948 0.003 . 2 . . . . . 276 VAL HG12 . 27634 1 105 . 1 1 10 10 VAL HG13 H 1 0.948 0.003 . 2 . . . . . 276 VAL HG13 . 27634 1 106 . 1 1 10 10 VAL HG21 H 1 0.948 0.003 . 2 . . . . . 276 VAL HG21 . 27634 1 107 . 1 1 10 10 VAL HG22 H 1 0.948 0.003 . 2 . . . . . 276 VAL HG22 . 27634 1 108 . 1 1 10 10 VAL HG23 H 1 0.948 0.003 . 2 . . . . . 276 VAL HG23 . 27634 1 109 . 1 1 10 10 VAL C C 13 176.961 0.006 . 1 . . . . . 276 VAL C . 27634 1 110 . 1 1 10 10 VAL CA C 13 62.493 0.016 . 1 . . . . . 276 VAL CA . 27634 1 111 . 1 1 10 10 VAL CB C 13 32.621 0.006 . 1 . . . . . 276 VAL CB . 27634 1 112 . 1 1 10 10 VAL CG1 C 13 20.316 . . 2 . . . . . 276 VAL CG1 . 27634 1 113 . 1 1 10 10 VAL CG2 C 13 21.167 . . 2 . . . . . 276 VAL CG2 . 27634 1 114 . 1 1 10 10 VAL N N 15 118.729 0.002 . 1 . . . . . 276 VAL N . 27634 1 115 . 1 1 11 11 GLY H H 1 8.56 0.001 . 1 . . . . . 277 GLY H . 27634 1 116 . 1 1 11 11 GLY HA2 H 1 3.987 0.002 . 2 . . . . . 277 GLY HA2 . 27634 1 117 . 1 1 11 11 GLY HA3 H 1 3.987 0.002 . 2 . . . . . 277 GLY HA3 . 27634 1 118 . 1 1 11 11 GLY C C 13 174.194 0.008 . 1 . . . . . 277 GLY C . 27634 1 119 . 1 1 11 11 GLY CA C 13 45.288 0.003 . 1 . . . . . 277 GLY CA . 27634 1 120 . 1 1 11 11 GLY N N 15 112.169 0.002 . 1 . . . . . 277 GLY N . 27634 1 121 . 1 1 12 12 ASP H H 1 8.372 0.002 . 1 . . . . . 278 ASP H . 27634 1 122 . 1 1 12 12 ASP HA H 1 4.604 0.009 . 1 . . . . . 278 ASP HA . 27634 1 123 . 1 1 12 12 ASP HB2 H 1 2.699 0.003 . 2 . . . . . 278 ASP HB2 . 27634 1 124 . 1 1 12 12 ASP HB3 H 1 2.699 0.003 . 2 . . . . . 278 ASP HB3 . 27634 1 125 . 1 1 12 12 ASP C C 13 177.229 0.007 . 1 . . . . . 278 ASP C . 27634 1 126 . 1 1 12 12 ASP CA C 13 54.498 0.015 . 1 . . . . . 278 ASP CA . 27634 1 127 . 1 1 12 12 ASP CB C 13 41.156 0.039 . 1 . . . . . 278 ASP CB . 27634 1 128 . 1 1 12 12 ASP N N 15 120.873 0.007 . 1 . . . . . 278 ASP N . 27634 1 129 . 1 1 13 13 GLY H H 1 8.58 0.003 . 1 . . . . . 279 GLY H . 27634 1 130 . 1 1 13 13 GLY HA2 H 1 3.948 0.007 . 1 . . . . . 279 GLY HA2 . 27634 1 131 . 1 1 13 13 GLY HA3 H 1 3.948 0.007 . 1 . . . . . 279 GLY HA3 . 27634 1 132 . 1 1 13 13 GLY C C 13 174.617 0.001 . 1 . . . . . 279 GLY C . 27634 1 133 . 1 1 13 13 GLY CA C 13 45.681 0.021 . 1 . . . . . 279 GLY CA . 27634 1 134 . 1 1 13 13 GLY N N 15 109.676 0.005 . 1 . . . . . 279 GLY N . 27634 1 135 . 1 1 14 14 ALA H H 1 8.277 0.002 . 1 . . . . . 280 ALA H . 27634 1 136 . 1 1 14 14 ALA HA H 1 4.343 0.009 . 1 . . . . . 280 ALA HA . 27634 1 137 . 1 1 14 14 ALA HB1 H 1 1.417 0.007 . 1 . . . . . 280 ALA HB1 . 27634 1 138 . 1 1 14 14 ALA HB2 H 1 1.417 0.007 . 1 . . . . . 280 ALA HB2 . 27634 1 139 . 1 1 14 14 ALA HB3 H 1 1.417 0.007 . 1 . . . . . 280 ALA HB3 . 27634 1 140 . 1 1 14 14 ALA C C 13 178.62 0.004 . 1 . . . . . 280 ALA C . 27634 1 141 . 1 1 14 14 ALA CA C 13 53.135 0.011 . 1 . . . . . 280 ALA CA . 27634 1 142 . 1 1 14 14 ALA CB C 13 19.178 0.011 . 1 . . . . . 280 ALA CB . 27634 1 143 . 1 1 14 14 ALA N N 15 123.887 0.001 . 1 . . . . . 280 ALA N . 27634 1 144 . 1 1 15 15 THR H H 1 8.191 0.008 . 1 . . . . . 281 THR H . 27634 1 145 . 1 1 15 15 THR HA H 1 4.255 0.01 . 1 . . . . . 281 THR HA . 27634 1 146 . 1 1 15 15 THR HB H 1 4.259 . . 1 . . . . . 281 THR HB . 27634 1 147 . 1 1 15 15 THR HG21 H 1 1.227 0.007 . 1 . . . . . 281 THR HG21 . 27634 1 148 . 1 1 15 15 THR HG22 H 1 1.227 0.007 . 1 . . . . . 281 THR HG22 . 27634 1 149 . 1 1 15 15 THR HG23 H 1 1.227 0.007 . 1 . . . . . 281 THR HG23 . 27634 1 150 . 1 1 15 15 THR C C 13 174.861 0.003 . 1 . . . . . 281 THR C . 27634 1 151 . 1 1 15 15 THR CA C 13 62.488 0.01 . 1 . . . . . 281 THR CA . 27634 1 152 . 1 1 15 15 THR CB C 13 69.471 0.011 . 1 . . . . . 281 THR CB . 27634 1 153 . 1 1 15 15 THR CG2 C 13 21.713 . . 1 . . . . . 281 THR CG2 . 27634 1 154 . 1 1 15 15 THR N N 15 113.481 0.042 . 1 . . . . . 281 THR N . 27634 1 155 . 1 1 16 16 ALA H H 1 8.317 0.008 . 1 . . . . . 282 ALA H . 27634 1 156 . 1 1 16 16 ALA HA H 1 4.269 0.011 . 1 . . . . . 282 ALA HA . 27634 1 157 . 1 1 16 16 ALA HB1 H 1 1.397 0.007 . 1 . . . . . 282 ALA HB1 . 27634 1 158 . 1 1 16 16 ALA HB2 H 1 1.397 0.007 . 1 . . . . . 282 ALA HB2 . 27634 1 159 . 1 1 16 16 ALA HB3 H 1 1.397 0.007 . 1 . . . . . 282 ALA HB3 . 27634 1 160 . 1 1 16 16 ALA C C 13 177.984 0.008 . 1 . . . . . 282 ALA C . 27634 1 161 . 1 1 16 16 ALA CA C 13 52.931 0.009 . 1 . . . . . 282 ALA CA . 27634 1 162 . 1 1 16 16 ALA CB C 13 19.018 0.024 . 1 . . . . . 282 ALA CB . 27634 1 163 . 1 1 16 16 ALA N N 15 126.514 0.009 . 1 . . . . . 282 ALA N . 27634 1 164 . 1 1 17 17 ALA H H 1 8.3 0.003 . 1 . . . . . 283 ALA H . 27634 1 165 . 1 1 17 17 ALA HA H 1 4.248 0.015 . 1 . . . . . 283 ALA HA . 27634 1 166 . 1 1 17 17 ALA HB1 H 1 1.4 0.002 . 1 . . . . . 283 ALA HB1 . 27634 1 167 . 1 1 17 17 ALA HB2 H 1 1.4 0.002 . 1 . . . . . 283 ALA HB2 . 27634 1 168 . 1 1 17 17 ALA HB3 H 1 1.4 0.002 . 1 . . . . . 283 ALA HB3 . 27634 1 169 . 1 1 17 17 ALA C C 13 178.388 0.001 . 1 . . . . . 283 ALA C . 27634 1 170 . 1 1 17 17 ALA CA C 13 52.95 0.032 . 1 . . . . . 283 ALA CA . 27634 1 171 . 1 1 17 17 ALA CB C 13 18.97 0.02 . 1 . . . . . 283 ALA CB . 27634 1 172 . 1 1 17 17 ALA N N 15 123.026 0.002 . 1 . . . . . 283 ALA N . 27634 1 173 . 1 1 18 18 LYS H H 1 8.295 0.011 . 1 . . . . . 284 LYS H . 27634 1 174 . 1 1 18 18 LYS HA H 1 4.265 0.007 . 1 . . . . . 284 LYS HA . 27634 1 175 . 1 1 18 18 LYS HB2 H 1 1.853 0.007 . 2 . . . . . 284 LYS HB2 . 27634 1 176 . 1 1 18 18 LYS HB3 H 1 1.853 0.007 . 2 . . . . . 284 LYS HB3 . 27634 1 177 . 1 1 18 18 LYS HG2 H 1 1.456 0 . 2 . . . . . 284 LYS HG2 . 27634 1 178 . 1 1 18 18 LYS HG3 H 1 0.92 . . 2 . . . . . 284 LYS HG3 . 27634 1 179 . 1 1 18 18 LYS HD2 H 1 1.694 . . 2 . . . . . 284 LYS HD2 . 27634 1 180 . 1 1 18 18 LYS HD3 H 1 1.694 . . 2 . . . . . 284 LYS HD3 . 27634 1 181 . 1 1 18 18 LYS HE2 H 1 2.998 0.01 . 2 . . . . . 284 LYS HE2 . 27634 1 182 . 1 1 18 18 LYS HE3 H 1 2.998 0.01 . 2 . . . . . 284 LYS HE3 . 27634 1 183 . 1 1 18 18 LYS C C 13 177.093 0.006 . 1 . . . . . 284 LYS C . 27634 1 184 . 1 1 18 18 LYS CA C 13 56.758 0.01 . 1 . . . . . 284 LYS CA . 27634 1 185 . 1 1 18 18 LYS CB C 13 32.909 0.013 . 1 . . . . . 284 LYS CB . 27634 1 186 . 1 1 18 18 LYS CG C 13 24.846 . . 1 . . . . . 284 LYS CG . 27634 1 187 . 1 1 18 18 LYS CD C 13 29.109 . . 1 . . . . . 284 LYS CD . 27634 1 188 . 1 1 18 18 LYS CE C 13 42.135 . . 1 . . . . . 284 LYS CE . 27634 1 189 . 1 1 18 18 LYS N N 15 120.318 0.002 . 1 . . . . . 284 LYS N . 27634 1 190 . 1 1 19 19 SER H H 1 8.293 0.002 . 1 . . . . . 285 SER H . 27634 1 191 . 1 1 19 19 SER HA H 1 4.325 0.009 . 1 . . . . . 285 SER HA . 27634 1 192 . 1 1 19 19 SER HB2 H 1 3.887 . . 2 . . . . . 285 SER HB2 . 27634 1 193 . 1 1 19 19 SER HB3 H 1 3.887 . . 2 . . . . . 285 SER HB3 . 27634 1 194 . 1 1 19 19 SER C C 13 174.805 0.003 . 1 . . . . . 285 SER C . 27634 1 195 . 1 1 19 19 SER CA C 13 58.729 0.022 . 1 . . . . . 285 SER CA . 27634 1 196 . 1 1 19 19 SER CB C 13 63.631 0.068 . 1 . . . . . 285 SER CB . 27634 1 197 . 1 1 19 19 SER N N 15 116.578 0.004 . 1 . . . . . 285 SER N . 27634 1 198 . 1 1 20 20 LYS H H 1 8.399 0.005 . 1 . . . . . 286 LYS H . 27634 1 199 . 1 1 20 20 LYS HA H 1 4.272 0.018 . 1 . . . . . 286 LYS HA . 27634 1 200 . 1 1 20 20 LYS HB2 H 1 1.773 . . 2 . . . . . 286 LYS HB2 . 27634 1 201 . 1 1 20 20 LYS HB3 H 1 1.849 . . 2 . . . . . 286 LYS HB3 . 27634 1 202 . 1 1 20 20 LYS HG2 H 1 1.448 . . 2 . . . . . 286 LYS HG2 . 27634 1 203 . 1 1 20 20 LYS HG3 H 1 1.448 . . 2 . . . . . 286 LYS HG3 . 27634 1 204 . 1 1 20 20 LYS HD2 H 1 1.695 . . 2 . . . . . 286 LYS HD2 . 27634 1 205 . 1 1 20 20 LYS HD3 H 1 1.695 . . 2 . . . . . 286 LYS HD3 . 27634 1 206 . 1 1 20 20 LYS HE2 H 1 2.975 . . 2 . . . . . 286 LYS HE2 . 27634 1 207 . 1 1 20 20 LYS HE3 H 1 2.975 . . 2 . . . . . 286 LYS HE3 . 27634 1 208 . 1 1 20 20 LYS C C 13 176.632 0.002 . 1 . . . . . 286 LYS C . 27634 1 209 . 1 1 20 20 LYS CA C 13 56.61 0.014 . 1 . . . . . 286 LYS CA . 27634 1 210 . 1 1 20 20 LYS CB C 13 32.903 0.007 . 1 . . . . . 286 LYS CB . 27634 1 211 . 1 1 20 20 LYS CG C 13 24.839 . . 1 . . . . . 286 LYS CG . 27634 1 212 . 1 1 20 20 LYS CD C 13 29.096 . . 1 . . . . . 286 LYS CD . 27634 1 213 . 1 1 20 20 LYS CE C 13 42.082 . . 1 . . . . . 286 LYS CE . 27634 1 214 . 1 1 20 20 LYS N N 15 123.566 0.001 . 1 . . . . . 286 LYS N . 27634 1 215 . 1 1 21 21 ARG H H 1 8.316 0.016 . 1 . . . . . 287 ARG H . 27634 1 216 . 1 1 21 21 ARG HA H 1 4.254 0.01 . 1 . . . . . 287 ARG HA . 27634 1 217 . 1 1 21 21 ARG HB2 H 1 1.773 0.04 . 2 . . . . . 287 ARG HB2 . 27634 1 218 . 1 1 21 21 ARG HB3 H 1 1.773 0.04 . 2 . . . . . 287 ARG HB3 . 27634 1 219 . 1 1 21 21 ARG HG2 H 1 1.564 0.005 . 2 . . . . . 287 ARG HG2 . 27634 1 220 . 1 1 21 21 ARG HG3 H 1 1.564 0.005 . 2 . . . . . 287 ARG HG3 . 27634 1 221 . 1 1 21 21 ARG HD2 H 1 3.175 0.009 . 2 . . . . . 287 ARG HD2 . 27634 1 222 . 1 1 21 21 ARG HD3 H 1 3.175 0.009 . 2 . . . . . 287 ARG HD3 . 27634 1 223 . 1 1 21 21 ARG HE H 1 7.508 . . 1 . . . . . 287 ARG HE . 27634 1 224 . 1 1 21 21 ARG C C 13 176.07 0.002 . 1 . . . . . 287 ARG C . 27634 1 225 . 1 1 21 21 ARG CA C 13 56.318 0.038 . 1 . . . . . 287 ARG CA . 27634 1 226 . 1 1 21 21 ARG CB C 13 30.683 0.029 . 1 . . . . . 287 ARG CB . 27634 1 227 . 1 1 21 21 ARG CG C 13 27.092 . . 1 . . . . . 287 ARG CG . 27634 1 228 . 1 1 21 21 ARG CD C 13 43.374 . . 1 . . . . . 287 ARG CD . 27634 1 229 . 1 1 21 21 ARG N N 15 122.162 0.023 . 1 . . . . . 287 ARG N . 27634 1 230 . 1 1 21 21 ARG NE N 15 84.495 . . 1 . . . . . 287 ARG NE . 27634 1 231 . 1 1 22 22 LEU H H 1 8.298 0.006 . 1 . . . . . 288 LEU H . 27634 1 232 . 1 1 22 22 LEU HA H 1 4.288 0.016 . 1 . . . . . 288 LEU HA . 27634 1 233 . 1 1 22 22 LEU HB2 H 1 1.425 0.018 . 2 . . . . . 288 LEU HB2 . 27634 1 234 . 1 1 22 22 LEU HB3 H 1 1.566 0.005 . 2 . . . . . 288 LEU HB3 . 27634 1 235 . 1 1 22 22 LEU HD11 H 1 0.865 0.002 . 2 . . . . . 288 LEU HD11 . 27634 1 236 . 1 1 22 22 LEU HD12 H 1 0.865 0.002 . 2 . . . . . 288 LEU HD12 . 27634 1 237 . 1 1 22 22 LEU HD13 H 1 0.865 0.002 . 2 . . . . . 288 LEU HD13 . 27634 1 238 . 1 1 22 22 LEU HD21 H 1 0.865 0.002 . 2 . . . . . 288 LEU HD21 . 27634 1 239 . 1 1 22 22 LEU HD22 H 1 0.865 0.002 . 2 . . . . . 288 LEU HD22 . 27634 1 240 . 1 1 22 22 LEU HD23 H 1 0.865 0.002 . 2 . . . . . 288 LEU HD23 . 27634 1 241 . 1 1 22 22 LEU C C 13 176.899 0.005 . 1 . . . . . 288 LEU C . 27634 1 242 . 1 1 22 22 LEU CA C 13 55.028 0.02 . 1 . . . . . 288 LEU CA . 27634 1 243 . 1 1 22 22 LEU CB C 13 42.309 0.019 . 1 . . . . . 288 LEU CB . 27634 1 244 . 1 1 22 22 LEU CG C 13 26.9 . . 1 . . . . . 288 LEU CG . 27634 1 245 . 1 1 22 22 LEU CD1 C 13 24.82 . . 2 . . . . . 288 LEU CD1 . 27634 1 246 . 1 1 22 22 LEU CD2 C 13 23.326 . . 2 . . . . . 288 LEU CD2 . 27634 1 247 . 1 1 22 22 LEU N N 15 123.4 0.004 . 1 . . . . . 288 LEU N . 27634 1 248 . 1 1 23 23 PHE H H 1 8.26 0.003 . 1 . . . . . 289 PHE H . 27634 1 249 . 1 1 23 23 PHE HA H 1 4.6 0.012 . 1 . . . . . 289 PHE HA . 27634 1 250 . 1 1 23 23 PHE HB2 H 1 3.05 0.001 . 2 . . . . . 289 PHE HB2 . 27634 1 251 . 1 1 23 23 PHE HB3 H 1 3.048 . . 2 . . . . . 289 PHE HB3 . 27634 1 252 . 1 1 23 23 PHE HD1 H 1 7.229 0.002 . 3 . . . . . 289 PHE HD1 . 27634 1 253 . 1 1 23 23 PHE HD2 H 1 7.229 0.002 . 3 . . . . . 289 PHE HD2 . 27634 1 254 . 1 1 23 23 PHE HE1 H 1 7.331 0 . 3 . . . . . 289 PHE HE1 . 27634 1 255 . 1 1 23 23 PHE HE2 H 1 7.331 0 . 3 . . . . . 289 PHE HE2 . 27634 1 256 . 1 1 23 23 PHE C C 13 175.308 0 . 1 . . . . . 289 PHE C . 27634 1 257 . 1 1 23 23 PHE CA C 13 57.648 . . 1 . . . . . 289 PHE CA . 27634 1 258 . 1 1 23 23 PHE CB C 13 39.775 0.011 . 1 . . . . . 289 PHE CB . 27634 1 259 . 1 1 23 23 PHE CD1 C 13 131.906 . . 3 . . . . . 289 PHE CD1 . 27634 1 260 . 1 1 23 23 PHE CD2 C 13 131.906 . . 3 . . . . . 289 PHE CD2 . 27634 1 261 . 1 1 23 23 PHE CE1 C 13 131.431 . . 3 . . . . . 289 PHE CE1 . 27634 1 262 . 1 1 23 23 PHE CE2 C 13 131.431 . . 3 . . . . . 289 PHE CE2 . 27634 1 263 . 1 1 23 23 PHE N N 15 121.272 0.007 . 1 . . . . . 289 PHE N . 27634 1 264 . 1 1 24 24 LYS H H 1 8.262 0.008 . 1 . . . . . 290 LYS H . 27634 1 265 . 1 1 24 24 LYS HA H 1 4.328 0.015 . 1 . . . . . 290 LYS HA . 27634 1 266 . 1 1 24 24 LYS HB2 H 1 1.702 0.014 . 2 . . . . . 290 LYS HB2 . 27634 1 267 . 1 1 24 24 LYS HB3 H 1 1.702 0.014 . 2 . . . . . 290 LYS HB3 . 27634 1 268 . 1 1 24 24 LYS HG2 H 1 1.388 0.023 . 2 . . . . . 290 LYS HG2 . 27634 1 269 . 1 1 24 24 LYS HG3 H 1 1.388 0.023 . 2 . . . . . 290 LYS HG3 . 27634 1 270 . 1 1 24 24 LYS HD2 H 1 1.697 0.012 . 2 . . . . . 290 LYS HD2 . 27634 1 271 . 1 1 24 24 LYS HD3 H 1 1.697 0.012 . 2 . . . . . 290 LYS HD3 . 27634 1 272 . 1 1 24 24 LYS HE2 H 1 2.98 0.007 . 2 . . . . . 290 LYS HE2 . 27634 1 273 . 1 1 24 24 LYS HE3 H 1 2.98 0.007 . 2 . . . . . 290 LYS HE3 . 27634 1 274 . 1 1 24 24 LYS C C 13 175.849 0.008 . 1 . . . . . 290 LYS C . 27634 1 275 . 1 1 24 24 LYS CA C 13 56.083 0.036 . 1 . . . . . 290 LYS CA . 27634 1 276 . 1 1 24 24 LYS CB C 13 33.345 0.02 . 1 . . . . . 290 LYS CB . 27634 1 277 . 1 1 24 24 LYS CG C 13 24.642 . . 1 . . . . . 290 LYS CG . 27634 1 278 . 1 1 24 24 LYS CD C 13 29.092 . . 1 . . . . . 290 LYS CD . 27634 1 279 . 1 1 24 24 LYS CE C 13 42.078 . . 1 . . . . . 290 LYS CE . 27634 1 280 . 1 1 24 24 LYS N N 15 123.722 0.005 . 1 . . . . . 290 LYS N . 27634 1 281 . 1 1 25 25 GLU H H 1 8.439 0.005 . 1 . . . . . 291 GLU H . 27634 1 282 . 1 1 25 25 GLU HA H 1 4.217 0.012 . 1 . . . . . 291 GLU HA . 27634 1 283 . 1 1 25 25 GLU HB2 H 1 1.918 0.001 . 2 . . . . . 291 GLU HB2 . 27634 1 284 . 1 1 25 25 GLU HB3 H 1 2.065 0.009 . 2 . . . . . 291 GLU HB3 . 27634 1 285 . 1 1 25 25 GLU HG2 H 1 2.291 0.015 . 2 . . . . . 291 GLU HG2 . 27634 1 286 . 1 1 25 25 GLU HG3 H 1 2.291 0.015 . 2 . . . . . 291 GLU HG3 . 27634 1 287 . 1 1 25 25 GLU C C 13 175.733 0.001 . 1 . . . . . 291 GLU C . 27634 1 288 . 1 1 25 25 GLU CA C 13 56.218 0 . 1 . . . . . 291 GLU CA . 27634 1 289 . 1 1 25 25 GLU CB C 13 30.428 . . 1 . . . . . 291 GLU CB . 27634 1 290 . 1 1 25 25 GLU N N 15 122.706 0.002 . 1 . . . . . 291 GLU N . 27634 1 291 . 1 1 26 26 ALA H H 1 8.473 0.002 . 1 . . . . . 292 ALA H . 27634 1 292 . 1 1 26 26 ALA HA H 1 4.561 0.007 . 1 . . . . . 292 ALA HA . 27634 1 293 . 1 1 26 26 ALA HB1 H 1 1.36 0.009 . 1 . . . . . 292 ALA HB1 . 27634 1 294 . 1 1 26 26 ALA HB2 H 1 1.36 0.009 . 1 . . . . . 292 ALA HB2 . 27634 1 295 . 1 1 26 26 ALA HB3 H 1 1.36 0.009 . 1 . . . . . 292 ALA HB3 . 27634 1 296 . 1 1 26 26 ALA C C 13 175.407 . . 1 . . . . . 292 ALA C . 27634 1 297 . 1 1 26 26 ALA CA C 13 50.441 0.022 . 1 . . . . . 292 ALA CA . 27634 1 298 . 1 1 26 26 ALA CB C 13 18.132 . . 1 . . . . . 292 ALA CB . 27634 1 299 . 1 1 26 26 ALA N N 15 127.196 0.008 . 1 . . . . . 292 ALA N . 27634 1 300 . 1 1 27 27 PRO HA H 1 4.434 0 . 1 . . . . . 293 PRO HA . 27634 1 301 . 1 1 27 27 PRO HB2 H 1 1.835 0.004 . 2 . . . . . 293 PRO HB2 . 27634 1 302 . 1 1 27 27 PRO HB3 H 1 2.259 0.013 . 2 . . . . . 293 PRO HB3 . 27634 1 303 . 1 1 27 27 PRO HG2 H 1 2.004 . . 2 . . . . . 293 PRO HG2 . 27634 1 304 . 1 1 27 27 PRO HG3 H 1 2.004 . . 2 . . . . . 293 PRO HG3 . 27634 1 305 . 1 1 27 27 PRO HD2 H 1 3.629 . . 2 . . . . . 293 PRO HD2 . 27634 1 306 . 1 1 27 27 PRO HD3 H 1 3.783 . . 2 . . . . . 293 PRO HD3 . 27634 1 307 . 1 1 27 27 PRO C C 13 176.742 . . 1 . . . . . 293 PRO C . 27634 1 308 . 1 1 27 27 PRO CA C 13 62.819 0.046 . 1 . . . . . 293 PRO CA . 27634 1 309 . 1 1 27 27 PRO CB C 13 32.131 0 . 1 . . . . . 293 PRO CB . 27634 1 310 . 1 1 27 27 PRO CG C 13 27.331 . . 1 . . . . . 293 PRO CG . 27634 1 311 . 1 1 27 27 PRO CD C 13 50.491 . . 1 . . . . . 293 PRO CD . 27634 1 312 . 1 1 28 28 VAL H H 1 8.378 0.002 . 1 . . . . . 294 VAL H . 27634 1 313 . 1 1 28 28 VAL HA H 1 4.059 0.003 . 1 . . . . . 294 VAL HA . 27634 1 314 . 1 1 28 28 VAL HB H 1 2.012 0.003 . 1 . . . . . 294 VAL HB . 27634 1 315 . 1 1 28 28 VAL HG11 H 1 0.933 0.015 . 2 . . . . . 294 VAL HG11 . 27634 1 316 . 1 1 28 28 VAL HG12 H 1 0.933 0.015 . 2 . . . . . 294 VAL HG12 . 27634 1 317 . 1 1 28 28 VAL HG13 H 1 0.933 0.015 . 2 . . . . . 294 VAL HG13 . 27634 1 318 . 1 1 28 28 VAL HG21 H 1 0.933 0.015 . 2 . . . . . 294 VAL HG21 . 27634 1 319 . 1 1 28 28 VAL HG22 H 1 0.933 0.015 . 2 . . . . . 294 VAL HG22 . 27634 1 320 . 1 1 28 28 VAL HG23 H 1 0.933 0.015 . 2 . . . . . 294 VAL HG23 . 27634 1 321 . 1 1 28 28 VAL C C 13 176.234 0.008 . 1 . . . . . 294 VAL C . 27634 1 322 . 1 1 28 28 VAL CA C 13 62.314 0.064 . 1 . . . . . 294 VAL CA . 27634 1 323 . 1 1 28 28 VAL CB C 13 32.729 0 . 1 . . . . . 294 VAL CB . 27634 1 324 . 1 1 28 28 VAL CG1 C 13 20.988 . . 1 . . . . . 294 VAL CG1 . 27634 1 325 . 1 1 28 28 VAL CG2 C 13 20.988 . . 1 . . . . . 294 VAL CG2 . 27634 1 326 . 1 1 28 28 VAL N N 15 121.799 0.001 . 1 . . . . . 294 VAL N . 27634 1 327 . 1 1 29 29 VAL H H 1 8.454 0.003 . 1 . . . . . 295 VAL H . 27634 1 328 . 1 1 29 29 VAL HA H 1 4.127 0.008 . 1 . . . . . 295 VAL HA . 27634 1 329 . 1 1 29 29 VAL HB H 1 1.996 0.006 . 1 . . . . . 295 VAL HB . 27634 1 330 . 1 1 29 29 VAL HG11 H 1 0.926 0.019 . 2 . . . . . 295 VAL HG11 . 27634 1 331 . 1 1 29 29 VAL HG12 H 1 0.926 0.019 . 2 . . . . . 295 VAL HG12 . 27634 1 332 . 1 1 29 29 VAL HG13 H 1 0.926 0.019 . 2 . . . . . 295 VAL HG13 . 27634 1 333 . 1 1 29 29 VAL HG21 H 1 0.926 0.019 . 2 . . . . . 295 VAL HG21 . 27634 1 334 . 1 1 29 29 VAL HG22 H 1 0.926 0.019 . 2 . . . . . 295 VAL HG22 . 27634 1 335 . 1 1 29 29 VAL HG23 H 1 0.926 0.019 . 2 . . . . . 295 VAL HG23 . 27634 1 336 . 1 1 29 29 VAL C C 13 176.053 0.003 . 1 . . . . . 295 VAL C . 27634 1 337 . 1 1 29 29 VAL CA C 13 62.129 . . 1 . . . . . 295 VAL CA . 27634 1 338 . 1 1 29 29 VAL CB C 13 32.88 0 . 1 . . . . . 295 VAL CB . 27634 1 339 . 1 1 29 29 VAL CG1 C 13 20.974 . . 1 . . . . . 295 VAL CG1 . 27634 1 340 . 1 1 29 29 VAL CG2 C 13 20.974 . . 1 . . . . . 295 VAL CG2 . 27634 1 341 . 1 1 29 29 VAL N N 15 126.238 0.001 . 1 . . . . . 295 VAL N . 27634 1 342 . 1 1 30 30 VAL H H 1 8.512 0.003 . 1 . . . . . 296 VAL H . 27634 1 343 . 1 1 30 30 VAL HA H 1 4.161 0.015 . 1 . . . . . 296 VAL HA . 27634 1 344 . 1 1 30 30 VAL HB H 1 2.06 0.012 . 1 . . . . . 296 VAL HB . 27634 1 345 . 1 1 30 30 VAL HG11 H 1 0.925 0.016 . 2 . . . . . 296 VAL HG11 . 27634 1 346 . 1 1 30 30 VAL HG12 H 1 0.925 0.016 . 2 . . . . . 296 VAL HG12 . 27634 1 347 . 1 1 30 30 VAL HG13 H 1 0.925 0.016 . 2 . . . . . 296 VAL HG13 . 27634 1 348 . 1 1 30 30 VAL HG21 H 1 0.925 0.016 . 2 . . . . . 296 VAL HG21 . 27634 1 349 . 1 1 30 30 VAL HG22 H 1 0.925 0.016 . 2 . . . . . 296 VAL HG22 . 27634 1 350 . 1 1 30 30 VAL HG23 H 1 0.925 0.016 . 2 . . . . . 296 VAL HG23 . 27634 1 351 . 1 1 30 30 VAL C C 13 176.072 . . 1 . . . . . 296 VAL C . 27634 1 352 . 1 1 30 30 VAL CA C 13 62.106 0.047 . 1 . . . . . 296 VAL CA . 27634 1 353 . 1 1 30 30 VAL CB C 13 32.829 . . 1 . . . . . 296 VAL CB . 27634 1 354 . 1 1 30 30 VAL CG1 C 13 20.828 . . 1 . . . . . 296 VAL CG1 . 27634 1 355 . 1 1 30 30 VAL CG2 C 13 20.828 . . 1 . . . . . 296 VAL CG2 . 27634 1 356 . 1 1 30 30 VAL N N 15 126.206 0.008 . 1 . . . . . 296 VAL N . 27634 1 357 . 1 1 31 31 SER H H 1 8.558 0.002 . 1 . . . . . 297 SER H . 27634 1 358 . 1 1 31 31 SER HA H 1 4.496 0.007 . 1 . . . . . 297 SER HA . 27634 1 359 . 1 1 31 31 SER HB2 H 1 3.856 0.005 . 2 . . . . . 297 SER HB2 . 27634 1 360 . 1 1 31 31 SER HB3 H 1 3.856 0.005 . 2 . . . . . 297 SER HB3 . 27634 1 361 . 1 1 31 31 SER HG H 1 4.954 0.011 . 1 . . . . . 297 SER HG . 27634 1 362 . 1 1 31 31 SER C C 13 174.435 0.001 . 1 . . . . . 297 SER C . 27634 1 363 . 1 1 31 31 SER CA C 13 58.219 0.004 . 1 . . . . . 297 SER CA . 27634 1 364 . 1 1 31 31 SER CB C 13 63.927 0.068 . 1 . . . . . 297 SER CB . 27634 1 365 . 1 1 31 31 SER N N 15 120.825 0.007 . 1 . . . . . 297 SER N . 27634 1 366 . 1 1 32 32 GLY H H 1 8.359 0.002 . 1 . . . . . 298 GLY H . 27634 1 367 . 1 1 32 32 GLY HA2 H 1 4.189 0.004 . 2 . . . . . 298 GLY HA2 . 27634 1 368 . 1 1 32 32 GLY HA3 H 1 4.07 0.005 . 2 . . . . . 298 GLY HA3 . 27634 1 369 . 1 1 32 32 GLY C C 13 171.43 . . 1 . . . . . 298 GLY C . 27634 1 370 . 1 1 32 32 GLY CA C 13 44.539 0.034 . 1 . . . . . 298 GLY CA . 27634 1 371 . 1 1 32 32 GLY N N 15 111.297 0.018 . 1 . . . . . 298 GLY N . 27634 1 372 . 1 1 33 33 PRO HA H 1 4.458 0.022 . 1 . . . . . 299 PRO HA . 27634 1 373 . 1 1 33 33 PRO HB2 H 1 2.262 . . 2 . . . . . 299 PRO HB2 . 27634 1 374 . 1 1 33 33 PRO HB3 H 1 1.858 0 . 2 . . . . . 299 PRO HB3 . 27634 1 375 . 1 1 33 33 PRO HG2 H 1 1.998 . . 2 . . . . . 299 PRO HG2 . 27634 1 376 . 1 1 33 33 PRO HG3 H 1 1.998 . . 2 . . . . . 299 PRO HG3 . 27634 1 377 . 1 1 33 33 PRO HD2 H 1 3.611 0.003 . 2 . . . . . 299 PRO HD2 . 27634 1 378 . 1 1 33 33 PRO HD3 H 1 3.611 0.003 . 2 . . . . . 299 PRO HD3 . 27634 1 379 . 1 1 33 33 PRO C C 13 176.868 . . 1 . . . . . 299 PRO C . 27634 1 380 . 1 1 33 33 PRO CA C 13 62.949 0.059 . 1 . . . . . 299 PRO CA . 27634 1 381 . 1 1 33 33 PRO CB C 13 32.231 0.022 . 1 . . . . . 299 PRO CB . 27634 1 382 . 1 1 33 33 PRO CG C 13 27.154 . . 1 . . . . . 299 PRO CG . 27634 1 383 . 1 1 33 33 PRO CD C 13 49.748 . . 1 . . . . . 299 PRO CD . 27634 1 384 . 1 1 34 34 VAL H H 1 8.458 0.002 . 1 . . . . . 300 VAL H . 27634 1 385 . 1 1 34 34 VAL HA H 1 4.087 0.007 . 1 . . . . . 300 VAL HA . 27634 1 386 . 1 1 34 34 VAL HB H 1 2.018 0.012 . 1 . . . . . 300 VAL HB . 27634 1 387 . 1 1 34 34 VAL HG11 H 1 0.927 0.015 . 2 . . . . . 300 VAL HG11 . 27634 1 388 . 1 1 34 34 VAL HG12 H 1 0.927 0.015 . 2 . . . . . 300 VAL HG12 . 27634 1 389 . 1 1 34 34 VAL HG13 H 1 0.927 0.015 . 2 . . . . . 300 VAL HG13 . 27634 1 390 . 1 1 34 34 VAL HG21 H 1 0.927 0.015 . 2 . . . . . 300 VAL HG21 . 27634 1 391 . 1 1 34 34 VAL HG22 H 1 0.927 0.015 . 2 . . . . . 300 VAL HG22 . 27634 1 392 . 1 1 34 34 VAL HG23 H 1 0.927 0.015 . 2 . . . . . 300 VAL HG23 . 27634 1 393 . 1 1 34 34 VAL C C 13 176.472 . . 1 . . . . . 300 VAL C . 27634 1 394 . 1 1 34 34 VAL CA C 13 62.335 . . 1 . . . . . 300 VAL CA . 27634 1 395 . 1 1 34 34 VAL CB C 13 32.588 . . 1 . . . . . 300 VAL CB . 27634 1 396 . 1 1 34 34 VAL CG1 C 13 20.986 . . 1 . . . . . 300 VAL CG1 . 27634 1 397 . 1 1 34 34 VAL CG2 C 13 20.986 . . 1 . . . . . 300 VAL CG2 . 27634 1 398 . 1 1 34 34 VAL N N 15 121.551 0.001 . 1 . . . . . 300 VAL N . 27634 1 399 . 1 1 35 35 ILE H H 1 8.458 0.002 . 1 . . . . . 301 ILE H . 27634 1 400 . 1 1 35 35 ILE HA H 1 4.141 0.028 . 1 . . . . . 301 ILE HA . 27634 1 401 . 1 1 35 35 ILE HB H 1 1.859 0.006 . 1 . . . . . 301 ILE HB . 27634 1 402 . 1 1 35 35 ILE HG12 H 1 1.218 0.006 . 2 . . . . . 301 ILE HG12 . 27634 1 403 . 1 1 35 35 ILE HG13 H 1 1.491 0.006 . 2 . . . . . 301 ILE HG13 . 27634 1 404 . 1 1 35 35 ILE HG21 H 1 0.91 0.011 . 1 . . . . . 301 ILE HG21 . 27634 1 405 . 1 1 35 35 ILE HG22 H 1 0.91 0.011 . 1 . . . . . 301 ILE HG22 . 27634 1 406 . 1 1 35 35 ILE HG23 H 1 0.91 0.011 . 1 . . . . . 301 ILE HG23 . 27634 1 407 . 1 1 35 35 ILE HD11 H 1 0.915 0.007 . 1 . . . . . 301 ILE HD11 . 27634 1 408 . 1 1 35 35 ILE HD12 H 1 0.915 0.007 . 1 . . . . . 301 ILE HD12 . 27634 1 409 . 1 1 35 35 ILE HD13 H 1 0.915 0.007 . 1 . . . . . 301 ILE HD13 . 27634 1 410 . 1 1 35 35 ILE C C 13 176.7 0 . 1 . . . . . 301 ILE C . 27634 1 411 . 1 1 35 35 ILE CA C 13 61.156 0.017 . 1 . . . . . 301 ILE CA . 27634 1 412 . 1 1 35 35 ILE CB C 13 38.458 0.048 . 1 . . . . . 301 ILE CB . 27634 1 413 . 1 1 35 35 ILE CG1 C 13 27.244 . . 1 . . . . . 301 ILE CG1 . 27634 1 414 . 1 1 35 35 ILE CG2 C 13 17.39 . . 1 . . . . . 301 ILE CG2 . 27634 1 415 . 1 1 35 35 ILE CD1 C 13 12.571 . . 1 . . . . . 301 ILE CD1 . 27634 1 416 . 1 1 35 35 ILE N N 15 126.534 0.018 . 1 . . . . . 301 ILE N . 27634 1 417 . 1 1 36 36 GLY H H 1 8.561 0.002 . 1 . . . . . 302 GLY H . 27634 1 418 . 1 1 36 36 GLY HA2 H 1 3.961 0.001 . 2 . . . . . 302 GLY HA2 . 27634 1 419 . 1 1 36 36 GLY HA3 H 1 3.961 0.001 . 2 . . . . . 302 GLY HA3 . 27634 1 420 . 1 1 36 36 GLY C C 13 173.582 0 . 1 . . . . . 302 GLY C . 27634 1 421 . 1 1 36 36 GLY CA C 13 44.984 0.039 . 1 . . . . . 302 GLY CA . 27634 1 422 . 1 1 36 36 GLY N N 15 113.735 0.008 . 1 . . . . . 302 GLY N . 27634 1 423 . 1 1 37 37 ASP H H 1 8.306 0.003 . 1 . . . . . 303 ASP H . 27634 1 424 . 1 1 37 37 ASP HA H 1 4.589 0.004 . 1 . . . . . 303 ASP HA . 27634 1 425 . 1 1 37 37 ASP HB2 H 1 2.605 0.017 . 2 . . . . . 303 ASP HB2 . 27634 1 426 . 1 1 37 37 ASP HB3 H 1 2.605 0.017 . 2 . . . . . 303 ASP HB3 . 27634 1 427 . 1 1 37 37 ASP C C 13 175.814 . . 1 . . . . . 303 ASP C . 27634 1 428 . 1 1 37 37 ASP CA C 13 54.21 0.024 . 1 . . . . . 303 ASP CA . 27634 1 429 . 1 1 37 37 ASP CB C 13 41.309 0.002 . 1 . . . . . 303 ASP CB . 27634 1 430 . 1 1 37 37 ASP N N 15 120.446 0.011 . 1 . . . . . 303 ASP N . 27634 1 431 . 1 1 38 38 ASN H H 1 8.494 0.002 . 1 . . . . . 304 ASN H . 27634 1 432 . 1 1 38 38 ASN HA H 1 4.968 0.005 . 1 . . . . . 304 ASN HA . 27634 1 433 . 1 1 38 38 ASN HB2 H 1 2.654 0 . 2 . . . . . 304 ASN HB2 . 27634 1 434 . 1 1 38 38 ASN HB3 H 1 2.805 0.011 . 2 . . . . . 304 ASN HB3 . 27634 1 435 . 1 1 38 38 ASN HD21 H 1 7.706 . . 1 . . . . . 304 ASN HD21 . 27634 1 436 . 1 1 38 38 ASN HD22 H 1 6.987 . . 1 . . . . . 304 ASN HD22 . 27634 1 437 . 1 1 38 38 ASN C C 13 172.952 . . 1 . . . . . 304 ASN C . 27634 1 438 . 1 1 38 38 ASN CA C 13 51.427 . . 1 . . . . . 304 ASN CA . 27634 1 439 . 1 1 38 38 ASN CB C 13 38.846 . . 1 . . . . . 304 ASN CB . 27634 1 440 . 1 1 38 38 ASN N N 15 119.909 0.008 . 1 . . . . . 304 ASN N . 27634 1 441 . 1 1 38 38 ASN ND2 N 15 113.672 0.005 . 1 . . . . . 304 ASN ND2 . 27634 1 442 . 1 1 39 39 PRO HA H 1 4.415 0 . 1 . . . . . 305 PRO HA . 27634 1 443 . 1 1 39 39 PRO HB2 H 1 2.259 0 . 2 . . . . . 305 PRO HB2 . 27634 1 444 . 1 1 39 39 PRO HB3 H 1 1.869 0 . 2 . . . . . 305 PRO HB3 . 27634 1 445 . 1 1 39 39 PRO HG2 H 1 1.995 . . 2 . . . . . 305 PRO HG2 . 27634 1 446 . 1 1 39 39 PRO HG3 H 1 1.995 . . 2 . . . . . 305 PRO HG3 . 27634 1 447 . 1 1 39 39 PRO HD2 H 1 3.731 0.007 . 2 . . . . . 305 PRO HD2 . 27634 1 448 . 1 1 39 39 PRO HD3 H 1 3.731 0.007 . 2 . . . . . 305 PRO HD3 . 27634 1 449 . 1 1 39 39 PRO C C 13 176.708 . . 1 . . . . . 305 PRO C . 27634 1 450 . 1 1 39 39 PRO CA C 13 63.131 0.031 . 1 . . . . . 305 PRO CA . 27634 1 451 . 1 1 39 39 PRO CB C 13 32.124 0.009 . 1 . . . . . 305 PRO CB . 27634 1 452 . 1 1 39 39 PRO CG C 13 27.329 . . 1 . . . . . 305 PRO CG . 27634 1 453 . 1 1 39 39 PRO CD C 13 50.64 . . 1 . . . . . 305 PRO CD . 27634 1 454 . 1 1 40 40 ILE H H 1 8.356 0.003 . 1 . . . . . 306 ILE H . 27634 1 455 . 1 1 40 40 ILE HA H 1 4.115 0.008 . 1 . . . . . 306 ILE HA . 27634 1 456 . 1 1 40 40 ILE HB H 1 1.836 0.007 . 1 . . . . . 306 ILE HB . 27634 1 457 . 1 1 40 40 ILE HG12 H 1 1.22 0.004 . 2 . . . . . 306 ILE HG12 . 27634 1 458 . 1 1 40 40 ILE HG13 H 1 1.531 0.002 . 2 . . . . . 306 ILE HG13 . 27634 1 459 . 1 1 40 40 ILE HG21 H 1 0.888 0.009 . 1 . . . . . 306 ILE HG21 . 27634 1 460 . 1 1 40 40 ILE HG22 H 1 0.888 0.009 . 1 . . . . . 306 ILE HG22 . 27634 1 461 . 1 1 40 40 ILE HG23 H 1 0.888 0.009 . 1 . . . . . 306 ILE HG23 . 27634 1 462 . 1 1 40 40 ILE HD11 H 1 0.888 0.009 . 1 . . . . . 306 ILE HD11 . 27634 1 463 . 1 1 40 40 ILE HD12 H 1 0.888 0.009 . 1 . . . . . 306 ILE HD12 . 27634 1 464 . 1 1 40 40 ILE HD13 H 1 0.888 0.009 . 1 . . . . . 306 ILE HD13 . 27634 1 465 . 1 1 40 40 ILE C C 13 176.442 0.003 . 1 . . . . . 306 ILE C . 27634 1 466 . 1 1 40 40 ILE CA C 13 61.163 0.036 . 1 . . . . . 306 ILE CA . 27634 1 467 . 1 1 40 40 ILE CB C 13 38.253 0.011 . 1 . . . . . 306 ILE CB . 27634 1 468 . 1 1 40 40 ILE CG1 C 13 27.405 . . 1 . . . . . 306 ILE CG1 . 27634 1 469 . 1 1 40 40 ILE CG2 C 13 17.507 . . 1 . . . . . 306 ILE CG2 . 27634 1 470 . 1 1 40 40 ILE CD1 C 13 12.662 . . 1 . . . . . 306 ILE CD1 . 27634 1 471 . 1 1 40 40 ILE N N 15 121.874 0.014 . 1 . . . . . 306 ILE N . 27634 1 472 . 1 1 41 41 VAL H H 1 8.313 0.004 . 1 . . . . . 307 VAL H . 27634 1 473 . 1 1 41 41 VAL HA H 1 4.132 0.011 . 1 . . . . . 307 VAL HA . 27634 1 474 . 1 1 41 41 VAL HB H 1 2.037 0.008 . 1 . . . . . 307 VAL HB . 27634 1 475 . 1 1 41 41 VAL HG11 H 1 0.901 0.011 . 2 . . . . . 307 VAL HG11 . 27634 1 476 . 1 1 41 41 VAL HG12 H 1 0.901 0.011 . 2 . . . . . 307 VAL HG12 . 27634 1 477 . 1 1 41 41 VAL HG13 H 1 0.901 0.011 . 2 . . . . . 307 VAL HG13 . 27634 1 478 . 1 1 41 41 VAL HG21 H 1 0.901 0.011 . 2 . . . . . 307 VAL HG21 . 27634 1 479 . 1 1 41 41 VAL HG22 H 1 0.901 0.011 . 2 . . . . . 307 VAL HG22 . 27634 1 480 . 1 1 41 41 VAL HG23 H 1 0.901 0.011 . 2 . . . . . 307 VAL HG23 . 27634 1 481 . 1 1 41 41 VAL C C 13 175.711 0 . 1 . . . . . 307 VAL C . 27634 1 482 . 1 1 41 41 VAL CA C 13 61.926 0.031 . 1 . . . . . 307 VAL CA . 27634 1 483 . 1 1 41 41 VAL CB C 13 33.024 0.007 . 1 . . . . . 307 VAL CB . 27634 1 484 . 1 1 41 41 VAL CG1 C 13 20.837 . . 1 . . . . . 307 VAL CG1 . 27634 1 485 . 1 1 41 41 VAL CG2 C 13 20.837 . . 1 . . . . . 307 VAL CG2 . 27634 1 486 . 1 1 41 41 VAL N N 15 125.537 0.008 . 1 . . . . . 307 VAL N . 27634 1 487 . 1 1 42 42 ASP H H 1 8.527 0.004 . 1 . . . . . 308 ASP H . 27634 1 488 . 1 1 42 42 ASP HA H 1 4.577 0.006 . 1 . . . . . 308 ASP HA . 27634 1 489 . 1 1 42 42 ASP HB2 H 1 2.725 0.008 . 2 . . . . . 308 ASP HB2 . 27634 1 490 . 1 1 42 42 ASP HB3 H 1 2.613 0.008 . 2 . . . . . 308 ASP HB3 . 27634 1 491 . 1 1 42 42 ASP C C 13 176.176 0.002 . 1 . . . . . 308 ASP C . 27634 1 492 . 1 1 42 42 ASP CA C 13 54.333 0.058 . 1 . . . . . 308 ASP CA . 27634 1 493 . 1 1 42 42 ASP CB C 13 41.141 0.005 . 1 . . . . . 308 ASP CB . 27634 1 494 . 1 1 42 42 ASP N N 15 125.157 0.012 . 1 . . . . . 308 ASP N . 27634 1 495 . 1 1 43 43 ALA H H 1 8.448 0.003 . 1 . . . . . 309 ALA H . 27634 1 496 . 1 1 43 43 ALA HA H 1 4.238 0.009 . 1 . . . . . 309 ALA HA . 27634 1 497 . 1 1 43 43 ALA HB1 H 1 1.398 0.006 . 1 . . . . . 309 ALA HB1 . 27634 1 498 . 1 1 43 43 ALA HB2 H 1 1.398 0.006 . 1 . . . . . 309 ALA HB2 . 27634 1 499 . 1 1 43 43 ALA HB3 H 1 1.398 0.006 . 1 . . . . . 309 ALA HB3 . 27634 1 500 . 1 1 43 43 ALA C C 13 177.885 0.003 . 1 . . . . . 309 ALA C . 27634 1 501 . 1 1 43 43 ALA CA C 13 53.168 0.004 . 1 . . . . . 309 ALA CA . 27634 1 502 . 1 1 43 43 ALA CB C 13 19.327 0.044 . 1 . . . . . 309 ALA CB . 27634 1 503 . 1 1 43 43 ALA N N 15 124.944 0.002 . 1 . . . . . 309 ALA N . 27634 1 504 . 1 1 44 44 ASP H H 1 8.442 0.001 . 1 . . . . . 310 ASP H . 27634 1 505 . 1 1 44 44 ASP HA H 1 4.629 0.006 . 1 . . . . . 310 ASP HA . 27634 1 506 . 1 1 44 44 ASP HB2 H 1 2.696 0.004 . 2 . . . . . 310 ASP HB2 . 27634 1 507 . 1 1 44 44 ASP HB3 H 1 2.696 0.004 . 2 . . . . . 310 ASP HB3 . 27634 1 508 . 1 1 44 44 ASP C C 13 176.735 0.005 . 1 . . . . . 310 ASP C . 27634 1 509 . 1 1 44 44 ASP CA C 13 54.771 0.011 . 1 . . . . . 310 ASP CA . 27634 1 510 . 1 1 44 44 ASP CB C 13 40.99 0.016 . 1 . . . . . 310 ASP CB . 27634 1 511 . 1 1 44 44 ASP N N 15 118.743 0.003 . 1 . . . . . 310 ASP N . 27634 1 512 . 1 1 45 45 THR H H 1 8.033 0.004 . 1 . . . . . 311 THR H . 27634 1 513 . 1 1 45 45 THR HA H 1 4.258 0.019 . 1 . . . . . 311 THR HA . 27634 1 514 . 1 1 45 45 THR HB H 1 4.256 0.014 . 1 . . . . . 311 THR HB . 27634 1 515 . 1 1 45 45 THR HG21 H 1 1.196 0.005 . 1 . . . . . 311 THR HG21 . 27634 1 516 . 1 1 45 45 THR HG22 H 1 1.196 0.005 . 1 . . . . . 311 THR HG22 . 27634 1 517 . 1 1 45 45 THR HG23 H 1 1.196 0.005 . 1 . . . . . 311 THR HG23 . 27634 1 518 . 1 1 45 45 THR C C 13 174.675 0.001 . 1 . . . . . 311 THR C . 27634 1 519 . 1 1 45 45 THR CA C 13 62.498 0.007 . 1 . . . . . 311 THR CA . 27634 1 520 . 1 1 45 45 THR CB C 13 69.626 0.103 . 1 . . . . . 311 THR CB . 27634 1 521 . 1 1 45 45 THR CG2 C 13 21.746 . . 1 . . . . . 311 THR CG2 . 27634 1 522 . 1 1 45 45 THR N N 15 114.639 0.004 . 1 . . . . . 311 THR N . 27634 1 523 . 1 1 46 46 ILE H H 1 8.152 0.003 . 1 . . . . . 312 ILE H . 27634 1 524 . 1 1 46 46 ILE HA H 1 4.108 0.004 . 1 . . . . . 312 ILE HA . 27634 1 525 . 1 1 46 46 ILE HB H 1 1.85 0.004 . 1 . . . . . 312 ILE HB . 27634 1 526 . 1 1 46 46 ILE HG12 H 1 1.502 0.011 . 2 . . . . . 312 ILE HG12 . 27634 1 527 . 1 1 46 46 ILE HG13 H 1 1.188 0.003 . 2 . . . . . 312 ILE HG13 . 27634 1 528 . 1 1 46 46 ILE HG21 H 1 0.886 0.003 . 1 . . . . . 312 ILE HG21 . 27634 1 529 . 1 1 46 46 ILE HG22 H 1 0.886 0.003 . 1 . . . . . 312 ILE HG22 . 27634 1 530 . 1 1 46 46 ILE HG23 H 1 0.886 0.003 . 1 . . . . . 312 ILE HG23 . 27634 1 531 . 1 1 46 46 ILE HD11 H 1 0.886 0.004 . 1 . . . . . 312 ILE HD11 . 27634 1 532 . 1 1 46 46 ILE HD12 H 1 0.886 0.004 . 1 . . . . . 312 ILE HD12 . 27634 1 533 . 1 1 46 46 ILE HD13 H 1 0.886 0.004 . 1 . . . . . 312 ILE HD13 . 27634 1 534 . 1 1 46 46 ILE C C 13 176.157 0.001 . 1 . . . . . 312 ILE C . 27634 1 535 . 1 1 46 46 ILE CA C 13 61.522 0.029 . 1 . . . . . 312 ILE CA . 27634 1 536 . 1 1 46 46 ILE CB C 13 38.502 0.005 . 1 . . . . . 312 ILE CB . 27634 1 537 . 1 1 46 46 ILE CG1 C 13 27.548 . . 1 . . . . . 312 ILE CG1 . 27634 1 538 . 1 1 46 46 ILE CG2 C 13 17.353 . . 1 . . . . . 312 ILE CG2 . 27634 1 539 . 1 1 46 46 ILE CD1 C 13 12.852 . . 1 . . . . . 312 ILE CD1 . 27634 1 540 . 1 1 46 46 ILE N N 15 124.102 0.023 . 1 . . . . . 312 ILE N . 27634 1 541 . 1 1 47 47 GLN H H 1 8.543 0.003 . 1 . . . . . 313 GLN H . 27634 1 542 . 1 1 47 47 GLN HA H 1 4.341 0.005 . 1 . . . . . 313 GLN HA . 27634 1 543 . 1 1 47 47 GLN HB2 H 1 1.978 0.007 . 2 . . . . . 313 GLN HB2 . 27634 1 544 . 1 1 47 47 GLN HB3 H 1 2.092 0.004 . 2 . . . . . 313 GLN HB3 . 27634 1 545 . 1 1 47 47 GLN HG2 H 1 2.37 0.006 . 2 . . . . . 313 GLN HG2 . 27634 1 546 . 1 1 47 47 GLN HG3 H 1 2.37 0.006 . 2 . . . . . 313 GLN HG3 . 27634 1 547 . 1 1 47 47 GLN HE21 H 1 7.593 . . 2 . . . . . 313 GLN HE21 . 27634 1 548 . 1 1 47 47 GLN HE22 H 1 7.201 . . 2 . . . . . 313 GLN HE22 . 27634 1 549 . 1 1 47 47 GLN C C 13 175.967 0.004 . 1 . . . . . 313 GLN C . 27634 1 550 . 1 1 47 47 GLN CA C 13 55.577 0.063 . 1 . . . . . 313 GLN CA . 27634 1 551 . 1 1 47 47 GLN CB C 13 29.282 . . 1 . . . . . 313 GLN CB . 27634 1 552 . 1 1 47 47 GLN CG C 13 33.822 . . 1 . . . . . 313 GLN CG . 27634 1 553 . 1 1 47 47 GLN N N 15 125.067 0.006 . 1 . . . . . 313 GLN N . 27634 1 554 . 1 1 47 47 GLN NE2 N 15 114.914 0.008 . 1 . . . . . 313 GLN NE2 . 27634 1 555 . 1 1 48 48 LEU H H 1 8.435 0.002 . 1 . . . . . 314 LEU H . 27634 1 556 . 1 1 48 48 LEU HA H 1 4.317 0.01 . 1 . . . . . 314 LEU HA . 27634 1 557 . 1 1 48 48 LEU HB2 H 1 1.548 0.001 . 2 . . . . . 314 LEU HB2 . 27634 1 558 . 1 1 48 48 LEU HB3 H 1 1.666 0.001 . 2 . . . . . 314 LEU HB3 . 27634 1 559 . 1 1 48 48 LEU HG H 1 1.549 0.001 . 1 . . . . . 314 LEU HG . 27634 1 560 . 1 1 48 48 LEU HD11 H 1 0.883 0.009 . 2 . . . . . 314 LEU HD11 . 27634 1 561 . 1 1 48 48 LEU HD12 H 1 0.883 0.009 . 2 . . . . . 314 LEU HD12 . 27634 1 562 . 1 1 48 48 LEU HD13 H 1 0.883 0.009 . 2 . . . . . 314 LEU HD13 . 27634 1 563 . 1 1 48 48 LEU HD21 H 1 0.883 0.009 . 2 . . . . . 314 LEU HD21 . 27634 1 564 . 1 1 48 48 LEU HD22 H 1 0.883 0.009 . 2 . . . . . 314 LEU HD22 . 27634 1 565 . 1 1 48 48 LEU HD23 H 1 0.883 0.009 . 2 . . . . . 314 LEU HD23 . 27634 1 566 . 1 1 48 48 LEU C C 13 177.453 0.004 . 1 . . . . . 314 LEU C . 27634 1 567 . 1 1 48 48 LEU CA C 13 55.473 0.037 . 1 . . . . . 314 LEU CA . 27634 1 568 . 1 1 48 48 LEU CB C 13 42.447 0.006 . 1 . . . . . 314 LEU CB . 27634 1 569 . 1 1 48 48 LEU CG C 13 27.058 . . 1 . . . . . 314 LEU CG . 27634 1 570 . 1 1 48 48 LEU CD1 C 13 24.961 . . 2 . . . . . 314 LEU CD1 . 27634 1 571 . 1 1 48 48 LEU CD2 C 13 23.295 . . 2 . . . . . 314 LEU CD2 . 27634 1 572 . 1 1 48 48 LEU N N 15 124.385 0.008 . 1 . . . . . 314 LEU N . 27634 1 573 . 1 1 49 49 ASP H H 1 8.449 0.001 . 1 . . . . . 315 ASP H . 27634 1 574 . 1 1 49 49 ASP HA H 1 4.562 0.006 . 1 . . . . . 315 ASP HA . 27634 1 575 . 1 1 49 49 ASP HB2 H 1 2.684 0.002 . 2 . . . . . 315 ASP HB2 . 27634 1 576 . 1 1 49 49 ASP HB3 H 1 2.684 0.002 . 2 . . . . . 315 ASP HB3 . 27634 1 577 . 1 1 49 49 ASP C C 13 176.755 0.003 . 1 . . . . . 315 ASP C . 27634 1 578 . 1 1 49 49 ASP CA C 13 54.517 0.026 . 1 . . . . . 315 ASP CA . 27634 1 579 . 1 1 49 49 ASP CB C 13 41.06 0.006 . 1 . . . . . 315 ASP CB . 27634 1 580 . 1 1 49 49 ASP N N 15 121.264 0.011 . 1 . . . . . 315 ASP N . 27634 1 581 . 1 1 50 50 GLU H H 1 8.489 0.006 . 1 . . . . . 316 GLU H . 27634 1 582 . 1 1 50 50 GLU HA H 1 4.174 0.004 . 1 . . . . . 316 GLU HA . 27634 1 583 . 1 1 50 50 GLU HB2 H 1 2.019 0.014 . 2 . . . . . 316 GLU HB2 . 27634 1 584 . 1 1 50 50 GLU HB3 H 1 2.019 0.014 . 2 . . . . . 316 GLU HB3 . 27634 1 585 . 1 1 50 50 GLU HG2 H 1 2.269 0.012 . 2 . . . . . 316 GLU HG2 . 27634 1 586 . 1 1 50 50 GLU HG3 H 1 2.269 0.012 . 2 . . . . . 316 GLU HG3 . 27634 1 587 . 1 1 50 50 GLU C C 13 176.976 0.004 . 1 . . . . . 316 GLU C . 27634 1 588 . 1 1 50 50 GLU CA C 13 57.329 0.011 . 1 . . . . . 316 GLU CA . 27634 1 589 . 1 1 50 50 GLU CB C 13 30.083 0.015 . 1 . . . . . 316 GLU CB . 27634 1 590 . 1 1 50 50 GLU CG C 13 36.301 . . 1 . . . . . 316 GLU CG . 27634 1 591 . 1 1 50 50 GLU N N 15 121.367 0.006 . 1 . . . . . 316 GLU N . 27634 1 592 . 1 1 51 51 LEU H H 1 8.188 0.004 . 1 . . . . . 317 LEU H . 27634 1 593 . 1 1 51 51 LEU HA H 1 4.284 0.006 . 1 . . . . . 317 LEU HA . 27634 1 594 . 1 1 51 51 LEU HB2 H 1 1.575 0 . 2 . . . . . 317 LEU HB2 . 27634 1 595 . 1 1 51 51 LEU HB3 H 1 1.71 0.004 . 2 . . . . . 317 LEU HB3 . 27634 1 596 . 1 1 51 51 LEU HG H 1 1.614 0 . 1 . . . . . 317 LEU HG . 27634 1 597 . 1 1 51 51 LEU HD11 H 1 0.908 . . 2 . . . . . 317 LEU HD11 . 27634 1 598 . 1 1 51 51 LEU HD12 H 1 0.908 . . 2 . . . . . 317 LEU HD12 . 27634 1 599 . 1 1 51 51 LEU HD13 H 1 0.908 . . 2 . . . . . 317 LEU HD13 . 27634 1 600 . 1 1 51 51 LEU HD21 H 1 0.908 . . 2 . . . . . 317 LEU HD21 . 27634 1 601 . 1 1 51 51 LEU HD22 H 1 0.908 . . 2 . . . . . 317 LEU HD22 . 27634 1 602 . 1 1 51 51 LEU HD23 H 1 0.908 . . 2 . . . . . 317 LEU HD23 . 27634 1 603 . 1 1 51 51 LEU C C 13 177.338 0.003 . 1 . . . . . 317 LEU C . 27634 1 604 . 1 1 51 51 LEU CA C 13 55.373 0.037 . 1 . . . . . 317 LEU CA . 27634 1 605 . 1 1 51 51 LEU CB C 13 41.977 0.01 . 1 . . . . . 317 LEU CB . 27634 1 606 . 1 1 51 51 LEU CG C 13 26.974 . . 1 . . . . . 317 LEU CG . 27634 1 607 . 1 1 51 51 LEU CD1 C 13 24.912 . . 2 . . . . . 317 LEU CD1 . 27634 1 608 . 1 1 51 51 LEU CD2 C 13 23.205 . . 2 . . . . . 317 LEU CD2 . 27634 1 609 . 1 1 51 51 LEU N N 15 121.283 0.005 . 1 . . . . . 317 LEU N . 27634 1 610 . 1 1 52 52 ALA H H 1 8.053 0.002 . 1 . . . . . 318 ALA H . 27634 1 611 . 1 1 52 52 ALA HA H 1 4.278 0.004 . 1 . . . . . 318 ALA HA . 27634 1 612 . 1 1 52 52 ALA HB1 H 1 1.393 0.004 . 1 . . . . . 318 ALA HB1 . 27634 1 613 . 1 1 52 52 ALA HB2 H 1 1.393 0.004 . 1 . . . . . 318 ALA HB2 . 27634 1 614 . 1 1 52 52 ALA HB3 H 1 1.393 0.004 . 1 . . . . . 318 ALA HB3 . 27634 1 615 . 1 1 52 52 ALA C C 13 177.451 0.001 . 1 . . . . . 318 ALA C . 27634 1 616 . 1 1 52 52 ALA CA C 13 52.423 0.005 . 1 . . . . . 318 ALA CA . 27634 1 617 . 1 1 52 52 ALA CB C 13 19.154 . . 1 . . . . . 318 ALA CB . 27634 1 618 . 1 1 52 52 ALA N N 15 123.489 0.001 . 1 . . . . . 318 ALA N . 27634 1 619 . 1 1 53 53 ARG H H 1 8.197 0.007 . 1 . . . . . 319 ARG H . 27634 1 620 . 1 1 53 53 ARG HA H 1 4.288 0.004 . 1 . . . . . 319 ARG HA . 27634 1 621 . 1 1 53 53 ARG HB2 H 1 1.566 . . 2 . . . . . 319 ARG HB2 . 27634 1 622 . 1 1 53 53 ARG HB3 H 1 1.566 . . 2 . . . . . 319 ARG HB3 . 27634 1 623 . 1 1 53 53 ARG HD2 H 1 3.229 . . 2 . . . . . 319 ARG HD2 . 27634 1 624 . 1 1 53 53 ARG HD3 H 1 3.229 . . 2 . . . . . 319 ARG HD3 . 27634 1 625 . 1 1 53 53 ARG C C 13 174.18 . . 1 . . . . . 319 ARG C . 27634 1 626 . 1 1 53 53 ARG CA C 13 53.971 . . 1 . . . . . 319 ARG CA . 27634 1 627 . 1 1 53 53 ARG CB C 13 30.107 . . 1 . . . . . 319 ARG CB . 27634 1 628 . 1 1 53 53 ARG N N 15 121.439 0.006 . 1 . . . . . 319 ARG N . 27634 1 629 . 1 1 54 54 PRO HA H 1 4.46 0.003 . 1 . . . . . 320 PRO HA . 27634 1 630 . 1 1 54 54 PRO HB2 H 1 1.873 0.015 . 2 . . . . . 320 PRO HB2 . 27634 1 631 . 1 1 54 54 PRO HB3 H 1 2.313 0.001 . 2 . . . . . 320 PRO HB3 . 27634 1 632 . 1 1 54 54 PRO HG2 H 1 1.995 0.02 . 2 . . . . . 320 PRO HG2 . 27634 1 633 . 1 1 54 54 PRO HG3 H 1 1.995 0.02 . 2 . . . . . 320 PRO HG3 . 27634 1 634 . 1 1 54 54 PRO HD2 H 1 3.778 . . 2 . . . . . 320 PRO HD2 . 27634 1 635 . 1 1 54 54 PRO HD3 H 1 3.629 . . 2 . . . . . 320 PRO HD3 . 27634 1 636 . 1 1 54 54 PRO C C 13 176.971 . . 1 . . . . . 320 PRO C . 27634 1 637 . 1 1 54 54 PRO CA C 13 63.204 0.039 . 1 . . . . . 320 PRO CA . 27634 1 638 . 1 1 54 54 PRO CB C 13 32.156 . . 1 . . . . . 320 PRO CB . 27634 1 639 . 1 1 54 54 PRO CG C 13 27.489 . . 1 . . . . . 320 PRO CG . 27634 1 640 . 1 1 54 54 PRO CD C 13 50.62 . . 1 . . . . . 320 PRO CD . 27634 1 641 . 1 1 55 55 SER H H 1 8.562 0.002 . 1 . . . . . 321 SER H . 27634 1 642 . 1 1 55 55 SER HA H 1 4.439 0.009 . 1 . . . . . 321 SER HA . 27634 1 643 . 1 1 55 55 SER HB2 H 1 3.846 0.003 . 2 . . . . . 321 SER HB2 . 27634 1 644 . 1 1 55 55 SER HB3 H 1 3.846 0.003 . 2 . . . . . 321 SER HB3 . 27634 1 645 . 1 1 55 55 SER HG H 1 4.952 0.013 . 1 . . . . . 321 SER HG . 27634 1 646 . 1 1 55 55 SER C C 13 174.256 . . 1 . . . . . 321 SER C . 27634 1 647 . 1 1 55 55 SER CA C 13 58.175 0.016 . 1 . . . . . 321 SER CA . 27634 1 648 . 1 1 55 55 SER CB C 13 63.776 0.079 . 1 . . . . . 321 SER CB . 27634 1 649 . 1 1 55 55 SER N N 15 116.842 0.004 . 1 . . . . . 321 SER N . 27634 1 650 . 1 1 56 56 LEU H H 1 8.391 0.007 . 1 . . . . . 322 LEU H . 27634 1 651 . 1 1 56 56 LEU HA H 1 4.652 0.001 . 1 . . . . . 322 LEU HA . 27634 1 652 . 1 1 56 56 LEU HB2 H 1 1.584 0.017 . 2 . . . . . 322 LEU HB2 . 27634 1 653 . 1 1 56 56 LEU HB3 H 1 1.584 0.017 . 2 . . . . . 322 LEU HB3 . 27634 1 654 . 1 1 56 56 LEU HD11 H 1 0.943 0.011 . 2 . . . . . 322 LEU HD11 . 27634 1 655 . 1 1 56 56 LEU HD12 H 1 0.943 0.011 . 2 . . . . . 322 LEU HD12 . 27634 1 656 . 1 1 56 56 LEU HD13 H 1 0.943 0.011 . 2 . . . . . 322 LEU HD13 . 27634 1 657 . 1 1 56 56 LEU HD21 H 1 0.943 0.011 . 2 . . . . . 322 LEU HD21 . 27634 1 658 . 1 1 56 56 LEU HD22 H 1 0.943 0.011 . 2 . . . . . 322 LEU HD22 . 27634 1 659 . 1 1 56 56 LEU HD23 H 1 0.943 0.011 . 2 . . . . . 322 LEU HD23 . 27634 1 660 . 1 1 56 56 LEU C C 13 175.241 . . 1 . . . . . 322 LEU C . 27634 1 661 . 1 1 56 56 LEU CA C 13 53.136 . . 1 . . . . . 322 LEU CA . 27634 1 662 . 1 1 56 56 LEU CB C 13 41.655 . . 1 . . . . . 322 LEU CB . 27634 1 663 . 1 1 56 56 LEU CD2 C 13 24.203 . . 2 . . . . . 322 LEU CD2 . 27634 1 664 . 1 1 56 56 LEU N N 15 125.7 0.007 . 1 . . . . . 322 LEU N . 27634 1 665 . 1 1 57 57 PRO HA H 1 4.407 . . 1 . . . . . 323 PRO HA . 27634 1 666 . 1 1 57 57 PRO HB2 H 1 1.885 . . 2 . . . . . 323 PRO HB2 . 27634 1 667 . 1 1 57 57 PRO HB3 H 1 2.309 0.003 . 2 . . . . . 323 PRO HB3 . 27634 1 668 . 1 1 57 57 PRO HG2 H 1 2.035 . . 2 . . . . . 323 PRO HG2 . 27634 1 669 . 1 1 57 57 PRO HG3 H 1 2.035 . . 2 . . . . . 323 PRO HG3 . 27634 1 670 . 1 1 57 57 PRO HD2 H 1 3.631 . . 2 . . . . . 323 PRO HD2 . 27634 1 671 . 1 1 57 57 PRO HD3 H 1 3.861 . . 2 . . . . . 323 PRO HD3 . 27634 1 672 . 1 1 57 57 PRO C C 13 176.987 . . 1 . . . . . 323 PRO C . 27634 1 673 . 1 1 57 57 PRO CA C 13 63.029 0.09 . 1 . . . . . 323 PRO CA . 27634 1 674 . 1 1 57 57 PRO CB C 13 32.143 . . 1 . . . . . 323 PRO CB . 27634 1 675 . 1 1 57 57 PRO CG C 13 27.474 . . 1 . . . . . 323 PRO CG . 27634 1 676 . 1 1 57 57 PRO CD C 13 50.628 . . 1 . . . . . 323 PRO CD . 27634 1 677 . 1 1 58 58 LYS H H 1 8.612 0.008 . 1 . . . . . 324 LYS H . 27634 1 678 . 1 1 58 58 LYS HA H 1 4.366 0.027 . 1 . . . . . 324 LYS HA . 27634 1 679 . 1 1 58 58 LYS HB2 H 1 1.846 0.005 . 2 . . . . . 324 LYS HB2 . 27634 1 680 . 1 1 58 58 LYS HB3 H 1 1.846 0.005 . 2 . . . . . 324 LYS HB3 . 27634 1 681 . 1 1 58 58 LYS HG2 H 1 1.495 0.007 . 2 . . . . . 324 LYS HG2 . 27634 1 682 . 1 1 58 58 LYS HG3 H 1 1.495 0.007 . 2 . . . . . 324 LYS HG3 . 27634 1 683 . 1 1 58 58 LYS HD2 H 1 1.742 0.02 . 2 . . . . . 324 LYS HD2 . 27634 1 684 . 1 1 58 58 LYS HD3 H 1 1.742 0.02 . 2 . . . . . 324 LYS HD3 . 27634 1 685 . 1 1 58 58 LYS C C 13 177.116 0.005 . 1 . . . . . 324 LYS C . 27634 1 686 . 1 1 58 58 LYS CA C 13 56.363 0.014 . 1 . . . . . 324 LYS CA . 27634 1 687 . 1 1 58 58 LYS CB C 13 33.024 0.011 . 1 . . . . . 324 LYS CB . 27634 1 688 . 1 1 58 58 LYS CG C 13 24.865 . . 1 . . . . . 324 LYS CG . 27634 1 689 . 1 1 58 58 LYS CD C 13 29.106 . . 1 . . . . . 324 LYS CD . 27634 1 690 . 1 1 58 58 LYS CE C 13 42.179 . . 1 . . . . . 324 LYS CE . 27634 1 691 . 1 1 58 58 LYS N N 15 122.173 0.007 . 1 . . . . . 324 LYS N . 27634 1 692 . 1 1 59 59 THR H H 1 8.275 0.013 . 1 . . . . . 325 THR H . 27634 1 693 . 1 1 59 59 THR HA H 1 4.321 0.015 . 1 . . . . . 325 THR HA . 27634 1 694 . 1 1 59 59 THR HB H 1 4.223 0.014 . 1 . . . . . 325 THR HB . 27634 1 695 . 1 1 59 59 THR HG1 H 1 4.954 0.018 . 1 . . . . . 325 THR HG1 . 27634 1 696 . 1 1 59 59 THR HG21 H 1 1.212 0.012 . 1 . . . . . 325 THR HG21 . 27634 1 697 . 1 1 59 59 THR HG22 H 1 1.212 0.012 . 1 . . . . . 325 THR HG22 . 27634 1 698 . 1 1 59 59 THR HG23 H 1 1.212 0.012 . 1 . . . . . 325 THR HG23 . 27634 1 699 . 1 1 59 59 THR C C 13 174.587 0.007 . 1 . . . . . 325 THR C . 27634 1 700 . 1 1 59 59 THR CA C 13 61.787 0.033 . 1 . . . . . 325 THR CA . 27634 1 701 . 1 1 59 59 THR CB C 13 69.801 0.066 . 1 . . . . . 325 THR CB . 27634 1 702 . 1 1 59 59 THR CG2 C 13 21.72 . . 1 . . . . . 325 THR CG2 . 27634 1 703 . 1 1 59 59 THR N N 15 116.019 0.001 . 1 . . . . . 325 THR N . 27634 1 704 . 1 1 60 60 LYS H H 1 8.564 0.012 . 1 . . . . . 326 LYS H . 27634 1 705 . 1 1 60 60 LYS HA H 1 4.333 0.02 . 1 . . . . . 326 LYS HA . 27634 1 706 . 1 1 60 60 LYS HB2 H 1 1.773 0.002 . 2 . . . . . 326 LYS HB2 . 27634 1 707 . 1 1 60 60 LYS HB3 H 1 1.773 0.002 . 2 . . . . . 326 LYS HB3 . 27634 1 708 . 1 1 60 60 LYS HG2 H 1 1.471 . . 2 . . . . . 326 LYS HG2 . 27634 1 709 . 1 1 60 60 LYS HG3 H 1 1.471 . . 2 . . . . . 326 LYS HG3 . 27634 1 710 . 1 1 60 60 LYS HD2 H 1 1.686 . . 2 . . . . . 326 LYS HD2 . 27634 1 711 . 1 1 60 60 LYS HD3 H 1 1.686 . . 2 . . . . . 326 LYS HD3 . 27634 1 712 . 1 1 60 60 LYS HE2 H 1 2.989 . . 2 . . . . . 326 LYS HE2 . 27634 1 713 . 1 1 60 60 LYS HE3 H 1 2.989 . . 2 . . . . . 326 LYS HE3 . 27634 1 714 . 1 1 60 60 LYS C C 13 176.809 . . 1 . . . . . 326 LYS C . 27634 1 715 . 1 1 60 60 LYS CA C 13 56.557 . . 1 . . . . . 326 LYS CA . 27634 1 716 . 1 1 60 60 LYS CB C 13 33.02 . . 1 . . . . . 326 LYS CB . 27634 1 717 . 1 1 60 60 LYS CG C 13 24.703 . . 1 . . . . . 326 LYS CG . 27634 1 718 . 1 1 60 60 LYS N N 15 124.237 0.004 . 1 . . . . . 326 LYS N . 27634 1 719 . 1 1 61 61 SER H H 1 8.297 0.012 . 1 . . . . . 327 SER H . 27634 1 720 . 1 1 61 61 SER HA H 1 4.398 0.021 . 1 . . . . . 327 SER HA . 27634 1 721 . 1 1 61 61 SER HB2 H 1 3.881 0.007 . 2 . . . . . 327 SER HB2 . 27634 1 722 . 1 1 61 61 SER HB3 H 1 3.881 0.007 . 2 . . . . . 327 SER HB3 . 27634 1 723 . 1 1 61 61 SER HG H 1 4.928 0.005 . 1 . . . . . 327 SER HG . 27634 1 724 . 1 1 61 61 SER C C 13 174.751 . . 1 . . . . . 327 SER C . 27634 1 725 . 1 1 61 61 SER CA C 13 58.569 . . 1 . . . . . 327 SER CA . 27634 1 726 . 1 1 61 61 SER CB C 13 63.654 0.058 . 1 . . . . . 327 SER CB . 27634 1 727 . 1 1 61 61 SER N N 15 117.273 0.002 . 1 . . . . . 327 SER N . 27634 1 728 . 1 1 62 62 GLN H H 1 8.595 0.002 . 1 . . . . . 328 GLN H . 27634 1 729 . 1 1 62 62 GLN HA H 1 4.373 0.003 . 1 . . . . . 328 GLN HA . 27634 1 730 . 1 1 62 62 GLN HB2 H 1 1.992 . . 2 . . . . . 328 GLN HB2 . 27634 1 731 . 1 1 62 62 GLN HB3 H 1 2.135 . . 2 . . . . . 328 GLN HB3 . 27634 1 732 . 1 1 62 62 GLN HG2 H 1 2.393 . . 2 . . . . . 328 GLN HG2 . 27634 1 733 . 1 1 62 62 GLN HG3 H 1 2.393 . . 2 . . . . . 328 GLN HG3 . 27634 1 734 . 1 1 62 62 GLN C C 13 176.209 0.007 . 1 . . . . . 328 GLN C . 27634 1 735 . 1 1 62 62 GLN CA C 13 55.934 0.018 . 1 . . . . . 328 GLN CA . 27634 1 736 . 1 1 62 62 GLN CB C 13 29.527 . . 1 . . . . . 328 GLN CB . 27634 1 737 . 1 1 62 62 GLN CG C 13 33.865 . . 1 . . . . . 328 GLN CG . 27634 1 738 . 1 1 62 62 GLN N N 15 123.003 0.007 . 1 . . . . . 328 GLN N . 27634 1 739 . 1 1 63 63 LYS H H 1 8.525 0.003 . 1 . . . . . 329 LYS H . 27634 1 740 . 1 1 63 63 LYS HA H 1 4.339 . . 1 . . . . . 329 LYS HA . 27634 1 741 . 1 1 63 63 LYS HB2 H 1 1.818 . . 2 . . . . . 329 LYS HB2 . 27634 1 742 . 1 1 63 63 LYS HB3 H 1 1.818 . . 2 . . . . . 329 LYS HB3 . 27634 1 743 . 1 1 63 63 LYS HG2 H 1 1.458 . . 2 . . . . . 329 LYS HG2 . 27634 1 744 . 1 1 63 63 LYS HG3 H 1 1.458 . . 2 . . . . . 329 LYS HG3 . 27634 1 745 . 1 1 63 63 LYS HD2 H 1 1.714 . . 2 . . . . . 329 LYS HD2 . 27634 1 746 . 1 1 63 63 LYS HD3 H 1 1.714 . . 2 . . . . . 329 LYS HD3 . 27634 1 747 . 1 1 63 63 LYS HE2 H 1 2.995 . . 2 . . . . . 329 LYS HE2 . 27634 1 748 . 1 1 63 63 LYS HE3 H 1 2.995 . . 2 . . . . . 329 LYS HE3 . 27634 1 749 . 1 1 63 63 LYS C C 13 176.836 0.01 . 1 . . . . . 329 LYS C . 27634 1 750 . 1 1 63 63 LYS CA C 13 56.64 0.019 . 1 . . . . . 329 LYS CA . 27634 1 751 . 1 1 63 63 LYS CB C 13 33.031 0.031 . 1 . . . . . 329 LYS CB . 27634 1 752 . 1 1 63 63 LYS CG C 13 24.744 . . 1 . . . . . 329 LYS CG . 27634 1 753 . 1 1 63 63 LYS CD C 13 29.217 . . 1 . . . . . 329 LYS CD . 27634 1 754 . 1 1 63 63 LYS CE C 13 42.004 . . 1 . . . . . 329 LYS CE . 27634 1 755 . 1 1 63 63 LYS N N 15 123.088 0.006 . 1 . . . . . 329 LYS N . 27634 1 756 . 1 1 64 64 SER H H 1 8.535 0.003 . 1 . . . . . 330 SER H . 27634 1 757 . 1 1 64 64 SER HA H 1 4.518 0.013 . 1 . . . . . 330 SER HA . 27634 1 758 . 1 1 64 64 SER HB2 H 1 3.912 0.002 . 2 . . . . . 330 SER HB2 . 27634 1 759 . 1 1 64 64 SER HB3 H 1 3.912 0.002 . 2 . . . . . 330 SER HB3 . 27634 1 760 . 1 1 64 64 SER C C 13 174.819 . . 1 . . . . . 330 SER C . 27634 1 761 . 1 1 64 64 SER CA C 13 58.375 0.083 . 1 . . . . . 330 SER CA . 27634 1 762 . 1 1 64 64 SER CB C 13 63.748 0.144 . 1 . . . . . 330 SER CB . 27634 1 763 . 1 1 64 64 SER N N 15 117.666 0.006 . 1 . . . . . 330 SER N . 27634 1 764 . 1 1 65 65 SER H H 1 8.593 0.003 . 1 . . . . . 331 SER H . 27634 1 765 . 1 1 65 65 SER HA H 1 4.504 0.003 . 1 . . . . . 331 SER HA . 27634 1 766 . 1 1 65 65 SER HB2 H 1 3.934 . . 2 . . . . . 331 SER HB2 . 27634 1 767 . 1 1 65 65 SER HB3 H 1 3.934 . . 2 . . . . . 331 SER HB3 . 27634 1 768 . 1 1 65 65 SER C C 13 174.227 . . 1 . . . . . 331 SER C . 27634 1 769 . 1 1 65 65 SER CA C 13 58.492 . . 1 . . . . . 331 SER CA . 27634 1 770 . 1 1 65 65 SER CB C 13 63.872 0.045 . 1 . . . . . 331 SER CB . 27634 1 771 . 1 1 65 65 SER N N 15 118.852 0.007 . 1 . . . . . 331 SER N . 27634 1 772 . 1 1 66 66 ALA H H 1 8.457 0.007 . 1 . . . . . 332 ALA H . 27634 1 773 . 1 1 66 66 ALA HA H 1 4.472 0.011 . 1 . . . . . 332 ALA HA . 27634 1 774 . 1 1 66 66 ALA HB1 H 1 1.467 0.016 . 1 . . . . . 332 ALA HB1 . 27634 1 775 . 1 1 66 66 ALA HB2 H 1 1.467 0.016 . 1 . . . . . 332 ALA HB2 . 27634 1 776 . 1 1 66 66 ALA HB3 H 1 1.467 0.016 . 1 . . . . . 332 ALA HB3 . 27634 1 777 . 1 1 66 66 ALA C C 13 177.601 0.007 . 1 . . . . . 332 ALA C . 27634 1 778 . 1 1 66 66 ALA CA C 13 52.4 0.003 . 1 . . . . . 332 ALA CA . 27634 1 779 . 1 1 66 66 ALA CB C 13 19.755 0.029 . 1 . . . . . 332 ALA CB . 27634 1 780 . 1 1 66 66 ALA N N 15 126.241 0.002 . 1 . . . . . 332 ALA N . 27634 1 781 . 1 1 67 67 ALA H H 1 8.404 0.005 . 1 . . . . . 333 ALA H . 27634 1 782 . 1 1 67 67 ALA HA H 1 4.507 0.006 . 1 . . . . . 333 ALA HA . 27634 1 783 . 1 1 67 67 ALA HB1 H 1 1.518 0.009 . 1 . . . . . 333 ALA HB1 . 27634 1 784 . 1 1 67 67 ALA HB2 H 1 1.518 0.009 . 1 . . . . . 333 ALA HB2 . 27634 1 785 . 1 1 67 67 ALA HB3 H 1 1.518 0.009 . 1 . . . . . 333 ALA HB3 . 27634 1 786 . 1 1 67 67 ALA C C 13 176.964 0.003 . 1 . . . . . 333 ALA C . 27634 1 787 . 1 1 67 67 ALA CA C 13 51.677 0.002 . 1 . . . . . 333 ALA CA . 27634 1 788 . 1 1 67 67 ALA CB C 13 20.079 0.014 . 1 . . . . . 333 ALA CB . 27634 1 789 . 1 1 67 67 ALA N N 15 123.636 0.004 . 1 . . . . . 333 ALA N . 27634 1 790 . 1 1 68 68 SER H H 1 8.599 0.007 . 1 . . . . . 334 SER H . 27634 1 791 . 1 1 68 68 SER HA H 1 4.716 0.005 . 1 . . . . . 334 SER HA . 27634 1 792 . 1 1 68 68 SER HB2 H 1 4.016 0.005 . 2 . . . . . 334 SER HB2 . 27634 1 793 . 1 1 68 68 SER HB3 H 1 4.204 0 . 2 . . . . . 334 SER HB3 . 27634 1 794 . 1 1 68 68 SER HG H 1 4.934 0.002 . 1 . . . . . 334 SER HG . 27634 1 795 . 1 1 68 68 SER C C 13 172.927 . . 1 . . . . . 334 SER C . 27634 1 796 . 1 1 68 68 SER CA C 13 56.706 . . 1 . . . . . 334 SER CA . 27634 1 797 . 1 1 68 68 SER CB C 13 62.712 . . 1 . . . . . 334 SER CB . 27634 1 798 . 1 1 68 68 SER N N 15 117.939 0.003 . 1 . . . . . 334 SER N . 27634 1 799 . 1 1 69 69 PRO HA H 1 4.264 0.005 . 1 . . . . . 335 PRO HA . 27634 1 800 . 1 1 69 69 PRO HB2 H 1 2.392 0.006 . 2 . . . . . 335 PRO HB2 . 27634 1 801 . 1 1 69 69 PRO HB3 H 1 1.966 0.008 . 2 . . . . . 335 PRO HB3 . 27634 1 802 . 1 1 69 69 PRO HD2 H 1 3.976 . . 2 . . . . . 335 PRO HD2 . 27634 1 803 . 1 1 69 69 PRO HD3 H 1 3.976 . . 2 . . . . . 335 PRO HD3 . 27634 1 804 . 1 1 69 69 PRO C C 13 179.184 . . 1 . . . . . 335 PRO C . 27634 1 805 . 1 1 69 69 PRO CA C 13 65.463 0.064 . 1 . . . . . 335 PRO CA . 27634 1 806 . 1 1 69 69 PRO CB C 13 31.8 0.014 . 1 . . . . . 335 PRO CB . 27634 1 807 . 1 1 69 69 PRO CG C 13 27.808 . . 1 . . . . . 335 PRO CG . 27634 1 808 . 1 1 69 69 PRO CD C 13 50.341 . . 1 . . . . . 335 PRO CD . 27634 1 809 . 1 1 70 70 ALA H H 1 8.357 0.007 . 1 . . . . . 336 ALA H . 27634 1 810 . 1 1 70 70 ALA HA H 1 4.121 0.006 . 1 . . . . . 336 ALA HA . 27634 1 811 . 1 1 70 70 ALA HB1 H 1 1.348 0.006 . 1 . . . . . 336 ALA HB1 . 27634 1 812 . 1 1 70 70 ALA HB2 H 1 1.348 0.006 . 1 . . . . . 336 ALA HB2 . 27634 1 813 . 1 1 70 70 ALA HB3 H 1 1.348 0.006 . 1 . . . . . 336 ALA HB3 . 27634 1 814 . 1 1 70 70 ALA C C 13 180.295 0.005 . 1 . . . . . 336 ALA C . 27634 1 815 . 1 1 70 70 ALA CA C 13 54.583 0.07 . 1 . . . . . 336 ALA CA . 27634 1 816 . 1 1 70 70 ALA CB C 13 18.344 0.043 . 1 . . . . . 336 ALA CB . 27634 1 817 . 1 1 70 70 ALA N N 15 120.5 0.007 . 1 . . . . . 336 ALA N . 27634 1 818 . 1 1 71 71 ALA H H 1 7.898 0.004 . 1 . . . . . 337 ALA H . 27634 1 819 . 1 1 71 71 ALA HA H 1 3.762 0.008 . 1 . . . . . 337 ALA HA . 27634 1 820 . 1 1 71 71 ALA HB1 H 1 1.22 0.004 . 1 . . . . . 337 ALA HB1 . 27634 1 821 . 1 1 71 71 ALA HB2 H 1 1.22 0.004 . 1 . . . . . 337 ALA HB2 . 27634 1 822 . 1 1 71 71 ALA HB3 H 1 1.22 0.004 . 1 . . . . . 337 ALA HB3 . 27634 1 823 . 1 1 71 71 ALA C C 13 179.666 0.009 . 1 . . . . . 337 ALA C . 27634 1 824 . 1 1 71 71 ALA CA C 13 54.093 0.061 . 1 . . . . . 337 ALA CA . 27634 1 825 . 1 1 71 71 ALA CB C 13 17.999 0.09 . 1 . . . . . 337 ALA CB . 27634 1 826 . 1 1 71 71 ALA N N 15 122.926 0.006 . 1 . . . . . 337 ALA N . 27634 1 827 . 1 1 72 72 LEU H H 1 8.315 0.011 . 1 . . . . . 338 LEU H . 27634 1 828 . 1 1 72 72 LEU HA H 1 3.889 0.009 . 1 . . . . . 338 LEU HA . 27634 1 829 . 1 1 72 72 LEU HB2 H 1 1.569 0.01 . 2 . . . . . 338 LEU HB2 . 27634 1 830 . 1 1 72 72 LEU HB3 H 1 1.719 0.006 . 2 . . . . . 338 LEU HB3 . 27634 1 831 . 1 1 72 72 LEU HG H 1 1.578 0.003 . 1 . . . . . 338 LEU HG . 27634 1 832 . 1 1 72 72 LEU HD11 H 1 0.942 0.005 . 2 . . . . . 338 LEU HD11 . 27634 1 833 . 1 1 72 72 LEU HD12 H 1 0.942 0.005 . 2 . . . . . 338 LEU HD12 . 27634 1 834 . 1 1 72 72 LEU HD13 H 1 0.942 0.005 . 2 . . . . . 338 LEU HD13 . 27634 1 835 . 1 1 72 72 LEU HD21 H 1 0.942 0.005 . 2 . . . . . 338 LEU HD21 . 27634 1 836 . 1 1 72 72 LEU HD22 H 1 0.942 0.005 . 2 . . . . . 338 LEU HD22 . 27634 1 837 . 1 1 72 72 LEU HD23 H 1 0.942 0.005 . 2 . . . . . 338 LEU HD23 . 27634 1 838 . 1 1 72 72 LEU C C 13 178.661 0.003 . 1 . . . . . 338 LEU C . 27634 1 839 . 1 1 72 72 LEU CA C 13 57.644 . . 1 . . . . . 338 LEU CA . 27634 1 840 . 1 1 72 72 LEU CB C 13 41.892 0.041 . 1 . . . . . 338 LEU CB . 27634 1 841 . 1 1 72 72 LEU CG C 13 26.924 . . 1 . . . . . 338 LEU CG . 27634 1 842 . 1 1 72 72 LEU CD1 C 13 23.855 . . 2 . . . . . 338 LEU CD1 . 27634 1 843 . 1 1 72 72 LEU CD2 C 13 23.855 . . 2 . . . . . 338 LEU CD2 . 27634 1 844 . 1 1 72 72 LEU N N 15 118.033 0.005 . 1 . . . . . 338 LEU N . 27634 1 845 . 1 1 73 73 SER H H 1 8.104 0.002 . 1 . . . . . 339 SER H . 27634 1 846 . 1 1 73 73 SER HA H 1 4.103 0.007 . 1 . . . . . 339 SER HA . 27634 1 847 . 1 1 73 73 SER HB2 H 1 3.907 0.011 . 2 . . . . . 339 SER HB2 . 27634 1 848 . 1 1 73 73 SER HB3 H 1 3.907 0.011 . 2 . . . . . 339 SER HB3 . 27634 1 849 . 1 1 73 73 SER C C 13 177.356 . . 1 . . . . . 339 SER C . 27634 1 850 . 1 1 73 73 SER CA C 13 61.765 0.083 . 1 . . . . . 339 SER CA . 27634 1 851 . 1 1 73 73 SER CB C 13 62.387 . . 1 . . . . . 339 SER CB . 27634 1 852 . 1 1 73 73 SER N N 15 113.446 0.002 . 1 . . . . . 339 SER N . 27634 1 853 . 1 1 74 74 GLY H H 1 7.643 0.005 . 1 . . . . . 340 GLY H . 27634 1 854 . 1 1 74 74 GLY HA2 H 1 3.747 0.011 . 2 . . . . . 340 GLY HA2 . 27634 1 855 . 1 1 74 74 GLY HA3 H 1 3.872 0.018 . 2 . . . . . 340 GLY HA3 . 27634 1 856 . 1 1 74 74 GLY C C 13 176.694 . . 1 . . . . . 340 GLY C . 27634 1 857 . 1 1 74 74 GLY CA C 13 47.162 0.044 . 1 . . . . . 340 GLY CA . 27634 1 858 . 1 1 74 74 GLY N N 15 108.888 0.01 . 1 . . . . . 340 GLY N . 27634 1 859 . 1 1 75 75 TYR H H 1 7.973 0.004 . 1 . . . . . 341 TYR H . 27634 1 860 . 1 1 75 75 TYR HA H 1 4.112 0.009 . 1 . . . . . 341 TYR HA . 27634 1 861 . 1 1 75 75 TYR HB2 H 1 2.889 0.007 . 2 . . . . . 341 TYR HB2 . 27634 1 862 . 1 1 75 75 TYR HB3 H 1 3.12 0.006 . 2 . . . . . 341 TYR HB3 . 27634 1 863 . 1 1 75 75 TYR HD1 H 1 6.902 . . 1 . . . . . 341 TYR HD1 . 27634 1 864 . 1 1 75 75 TYR HD2 H 1 6.902 . . 1 . . . . . 341 TYR HD2 . 27634 1 865 . 1 1 75 75 TYR HE1 H 1 6.223 0 . 1 . . . . . 341 TYR HE1 . 27634 1 866 . 1 1 75 75 TYR HE2 H 1 6.223 0 . 1 . . . . . 341 TYR HE2 . 27634 1 867 . 1 1 75 75 TYR C C 13 178.869 0.001 . 1 . . . . . 341 TYR C . 27634 1 868 . 1 1 75 75 TYR CA C 13 57.993 0.042 . 1 . . . . . 341 TYR CA . 27634 1 869 . 1 1 75 75 TYR CB C 13 37.72 0.1 . 1 . . . . . 341 TYR CB . 27634 1 870 . 1 1 75 75 TYR CD1 C 13 132.293 . . 1 . . . . . 341 TYR CD1 . 27634 1 871 . 1 1 75 75 TYR CD2 C 13 132.293 . . 1 . . . . . 341 TYR CD2 . 27634 1 872 . 1 1 75 75 TYR CE1 C 13 116.772 0.001 . 1 . . . . . 341 TYR CE1 . 27634 1 873 . 1 1 75 75 TYR CE2 C 13 116.772 0.001 . 1 . . . . . 341 TYR CE2 . 27634 1 874 . 1 1 75 75 TYR N N 15 122.912 0.022 . 1 . . . . . 341 TYR N . 27634 1 875 . 1 1 76 76 LYS H H 1 8.246 0.006 . 1 . . . . . 342 LYS H . 27634 1 876 . 1 1 76 76 LYS HA H 1 3.904 0.007 . 1 . . . . . 342 LYS HA . 27634 1 877 . 1 1 76 76 LYS HB2 H 1 1.756 . . 2 . . . . . 342 LYS HB2 . 27634 1 878 . 1 1 76 76 LYS HB3 H 1 1.756 . . 2 . . . . . 342 LYS HB3 . 27634 1 879 . 1 1 76 76 LYS HG2 H 1 1.462 0.015 . 2 . . . . . 342 LYS HG2 . 27634 1 880 . 1 1 76 76 LYS HG3 H 1 1.462 0.015 . 2 . . . . . 342 LYS HG3 . 27634 1 881 . 1 1 76 76 LYS HD2 H 1 1.756 . . 2 . . . . . 342 LYS HD2 . 27634 1 882 . 1 1 76 76 LYS HD3 H 1 1.756 . . 2 . . . . . 342 LYS HD3 . 27634 1 883 . 1 1 76 76 LYS HE2 H 1 2.976 . . 2 . . . . . 342 LYS HE2 . 27634 1 884 . 1 1 76 76 LYS HE3 H 1 2.976 . . 2 . . . . . 342 LYS HE3 . 27634 1 885 . 1 1 76 76 LYS C C 13 178.275 0.003 . 1 . . . . . 342 LYS C . 27634 1 886 . 1 1 76 76 LYS CA C 13 60.988 0.013 . 1 . . . . . 342 LYS CA . 27634 1 887 . 1 1 76 76 LYS CB C 13 32.614 0.04 . 1 . . . . . 342 LYS CB . 27634 1 888 . 1 1 76 76 LYS CG C 13 26.701 . . 1 . . . . . 342 LYS CG . 27634 1 889 . 1 1 76 76 LYS CD C 13 30.359 . . 1 . . . . . 342 LYS CD . 27634 1 890 . 1 1 76 76 LYS N N 15 117.757 0.004 . 1 . . . . . 342 LYS N . 27634 1 891 . 1 1 77 77 MET H H 1 8.281 0.005 . 1 . . . . . 343 MET H . 27634 1 892 . 1 1 77 77 MET HA H 1 4.156 0.011 . 1 . . . . . 343 MET HA . 27634 1 893 . 1 1 77 77 MET HB2 H 1 2.272 0.006 . 1 . . . . . 343 MET HB2 . 27634 1 894 . 1 1 77 77 MET HB3 H 1 2.272 0.006 . 1 . . . . . 343 MET HB3 . 27634 1 895 . 1 1 77 77 MET HG2 H 1 2.697 0.014 . 2 . . . . . 343 MET HG2 . 27634 1 896 . 1 1 77 77 MET HG3 H 1 2.769 0.001 . 2 . . . . . 343 MET HG3 . 27634 1 897 . 1 1 77 77 MET HE1 H 1 2.074 . . 1 . . . . . 343 MET HE1 . 27634 1 898 . 1 1 77 77 MET HE2 H 1 2.074 . . 1 . . . . . 343 MET HE2 . 27634 1 899 . 1 1 77 77 MET HE3 H 1 2.074 . . 1 . . . . . 343 MET HE3 . 27634 1 900 . 1 1 77 77 MET C C 13 180.136 0.01 . 1 . . . . . 343 MET C . 27634 1 901 . 1 1 77 77 MET CA C 13 59.156 0.032 . 1 . . . . . 343 MET CA . 27634 1 902 . 1 1 77 77 MET CB C 13 32.107 0.103 . 1 . . . . . 343 MET CB . 27634 1 903 . 1 1 77 77 MET CE C 13 16.888 . . 1 . . . . . 343 MET CE . 27634 1 904 . 1 1 77 77 MET N N 15 117.27 0.007 . 1 . . . . . 343 MET N . 27634 1 905 . 1 1 78 78 THR H H 1 8.556 0.003 . 1 . . . . . 344 THR H . 27634 1 906 . 1 1 78 78 THR HA H 1 4.014 0.035 . 1 . . . . . 344 THR HA . 27634 1 907 . 1 1 78 78 THR HB H 1 4.195 0.048 . 1 . . . . . 344 THR HB . 27634 1 908 . 1 1 78 78 THR HG1 H 1 4.615 0.005 . 1 . . . . . 344 THR HG1 . 27634 1 909 . 1 1 78 78 THR HG21 H 1 1.478 0.008 . 1 . . . . . 344 THR HG21 . 27634 1 910 . 1 1 78 78 THR HG22 H 1 1.478 0.008 . 1 . . . . . 344 THR HG22 . 27634 1 911 . 1 1 78 78 THR HG23 H 1 1.478 0.008 . 1 . . . . . 344 THR HG23 . 27634 1 912 . 1 1 78 78 THR C C 13 177.549 . . 1 . . . . . 344 THR C . 27634 1 913 . 1 1 78 78 THR CA C 13 66.971 0.043 . 1 . . . . . 344 THR CA . 27634 1 914 . 1 1 78 78 THR CB C 13 68.655 0.12 . 1 . . . . . 344 THR CB . 27634 1 915 . 1 1 78 78 THR CG2 C 13 21.537 . . 1 . . . . . 344 THR CG2 . 27634 1 916 . 1 1 78 78 THR N N 15 118.463 0.002 . 1 . . . . . 344 THR N . 27634 1 917 . 1 1 79 79 LEU H H 1 8.35 0.01 . 1 . . . . . 345 LEU H . 27634 1 918 . 1 1 79 79 LEU HA H 1 4.159 0.009 . 1 . . . . . 345 LEU HA . 27634 1 919 . 1 1 79 79 LEU HB2 H 1 1.204 0.013 . 2 . . . . . 345 LEU HB2 . 27634 1 920 . 1 1 79 79 LEU HB3 H 1 1.204 0.013 . 2 . . . . . 345 LEU HB3 . 27634 1 921 . 1 1 79 79 LEU HG H 1 1.19 0.002 . 1 . . . . . 345 LEU HG . 27634 1 922 . 1 1 79 79 LEU HD11 H 1 0.681 0.007 . 2 . . . . . 345 LEU HD11 . 27634 1 923 . 1 1 79 79 LEU HD12 H 1 0.681 0.007 . 2 . . . . . 345 LEU HD12 . 27634 1 924 . 1 1 79 79 LEU HD13 H 1 0.681 0.007 . 2 . . . . . 345 LEU HD13 . 27634 1 925 . 1 1 79 79 LEU HD21 H 1 0.681 0.007 . 2 . . . . . 345 LEU HD21 . 27634 1 926 . 1 1 79 79 LEU HD22 H 1 0.681 0.007 . 2 . . . . . 345 LEU HD22 . 27634 1 927 . 1 1 79 79 LEU HD23 H 1 0.681 0.007 . 2 . . . . . 345 LEU HD23 . 27634 1 928 . 1 1 79 79 LEU C C 13 178.687 0.005 . 1 . . . . . 345 LEU C . 27634 1 929 . 1 1 79 79 LEU CA C 13 58.04 0.012 . 1 . . . . . 345 LEU CA . 27634 1 930 . 1 1 79 79 LEU CB C 13 42.331 0.036 . 1 . . . . . 345 LEU CB . 27634 1 931 . 1 1 79 79 LEU CG C 13 27.976 . . 1 . . . . . 345 LEU CG . 27634 1 932 . 1 1 79 79 LEU CD2 C 13 21.738 . . 2 . . . . . 345 LEU CD2 . 27634 1 933 . 1 1 79 79 LEU N N 15 121.068 0.012 . 1 . . . . . 345 LEU N . 27634 1 934 . 1 1 80 80 LEU H H 1 8.828 0.002 . 1 . . . . . 346 LEU H . 27634 1 935 . 1 1 80 80 LEU HA H 1 4.113 0.025 . 1 . . . . . 346 LEU HA . 27634 1 936 . 1 1 80 80 LEU HB2 H 1 1.552 0.003 . 2 . . . . . 346 LEU HB2 . 27634 1 937 . 1 1 80 80 LEU HB3 H 1 1.986 0.022 . 2 . . . . . 346 LEU HB3 . 27634 1 938 . 1 1 80 80 LEU HG H 1 0.96 0.004 . 1 . . . . . 346 LEU HG . 27634 1 939 . 1 1 80 80 LEU HD11 H 1 0.96 0.004 . 2 . . . . . 346 LEU HD11 . 27634 1 940 . 1 1 80 80 LEU HD12 H 1 0.96 0.004 . 2 . . . . . 346 LEU HD12 . 27634 1 941 . 1 1 80 80 LEU HD13 H 1 0.96 0.004 . 2 . . . . . 346 LEU HD13 . 27634 1 942 . 1 1 80 80 LEU HD21 H 1 1.155 0.001 . 2 . . . . . 346 LEU HD21 . 27634 1 943 . 1 1 80 80 LEU HD22 H 1 1.155 0.001 . 2 . . . . . 346 LEU HD22 . 27634 1 944 . 1 1 80 80 LEU HD23 H 1 1.155 0.001 . 2 . . . . . 346 LEU HD23 . 27634 1 945 . 1 1 80 80 LEU C C 13 179.833 0.003 . 1 . . . . . 346 LEU C . 27634 1 946 . 1 1 80 80 LEU CA C 13 58.897 0.017 . 1 . . . . . 346 LEU CA . 27634 1 947 . 1 1 80 80 LEU CB C 13 40.817 0.028 . 1 . . . . . 346 LEU CB . 27634 1 948 . 1 1 80 80 LEU CG C 13 25.102 . . 1 . . . . . 346 LEU CG . 27634 1 949 . 1 1 80 80 LEU CD1 C 13 22.506 . . 2 . . . . . 346 LEU CD1 . 27634 1 950 . 1 1 80 80 LEU CD2 C 13 22.506 . . 2 . . . . . 346 LEU CD2 . 27634 1 951 . 1 1 80 80 LEU N N 15 119.759 0.008 . 1 . . . . . 346 LEU N . 27634 1 952 . 1 1 81 81 ALA H H 1 7.836 0.004 . 1 . . . . . 347 ALA H . 27634 1 953 . 1 1 81 81 ALA HA H 1 4.211 0.012 . 1 . . . . . 347 ALA HA . 27634 1 954 . 1 1 81 81 ALA HB1 H 1 1.542 0.009 . 1 . . . . . 347 ALA HB1 . 27634 1 955 . 1 1 81 81 ALA HB2 H 1 1.542 0.009 . 1 . . . . . 347 ALA HB2 . 27634 1 956 . 1 1 81 81 ALA HB3 H 1 1.542 0.009 . 1 . . . . . 347 ALA HB3 . 27634 1 957 . 1 1 81 81 ALA C C 13 179.706 0.003 . 1 . . . . . 347 ALA C . 27634 1 958 . 1 1 81 81 ALA CA C 13 55.124 0.038 . 1 . . . . . 347 ALA CA . 27634 1 959 . 1 1 81 81 ALA CB C 13 17.865 0.025 . 1 . . . . . 347 ALA CB . 27634 1 960 . 1 1 81 81 ALA N N 15 121.81 0.011 . 1 . . . . . 347 ALA N . 27634 1 961 . 1 1 82 82 LEU H H 1 7.829 0.004 . 1 . . . . . 348 LEU H . 27634 1 962 . 1 1 82 82 LEU HA H 1 4.253 0.018 . 1 . . . . . 348 LEU HA . 27634 1 963 . 1 1 82 82 LEU HB2 H 1 1.729 0.003 . 2 . . . . . 348 LEU HB2 . 27634 1 964 . 1 1 82 82 LEU HB3 H 1 2.004 0.017 . 2 . . . . . 348 LEU HB3 . 27634 1 965 . 1 1 82 82 LEU HD11 H 1 0.842 0.01 . 2 . . . . . 348 LEU HD11 . 27634 1 966 . 1 1 82 82 LEU HD12 H 1 0.842 0.01 . 2 . . . . . 348 LEU HD12 . 27634 1 967 . 1 1 82 82 LEU HD13 H 1 0.842 0.01 . 2 . . . . . 348 LEU HD13 . 27634 1 968 . 1 1 82 82 LEU HD21 H 1 0.842 0.01 . 2 . . . . . 348 LEU HD21 . 27634 1 969 . 1 1 82 82 LEU HD22 H 1 0.842 0.01 . 2 . . . . . 348 LEU HD22 . 27634 1 970 . 1 1 82 82 LEU HD23 H 1 0.842 0.01 . 2 . . . . . 348 LEU HD23 . 27634 1 971 . 1 1 82 82 LEU C C 13 180.469 0.003 . 1 . . . . . 348 LEU C . 27634 1 972 . 1 1 82 82 LEU CA C 13 57.648 0.04 . 1 . . . . . 348 LEU CA . 27634 1 973 . 1 1 82 82 LEU CB C 13 42.517 0.059 . 1 . . . . . 348 LEU CB . 27634 1 974 . 1 1 82 82 LEU CG C 13 26.319 . . 1 . . . . . 348 LEU CG . 27634 1 975 . 1 1 82 82 LEU CD1 C 13 22.607 . . 2 . . . . . 348 LEU CD1 . 27634 1 976 . 1 1 82 82 LEU CD2 C 13 22.607 . . 2 . . . . . 348 LEU CD2 . 27634 1 977 . 1 1 82 82 LEU N N 15 120.739 0.005 . 1 . . . . . 348 LEU N . 27634 1 978 . 1 1 83 83 ILE H H 1 8.759 0.002 . 1 . . . . . 349 ILE H . 27634 1 979 . 1 1 83 83 ILE HA H 1 3.357 0.005 . 1 . . . . . 349 ILE HA . 27634 1 980 . 1 1 83 83 ILE HB H 1 1.961 0.012 . 1 . . . . . 349 ILE HB . 27634 1 981 . 1 1 83 83 ILE HG12 H 1 1.088 . . 1 . . . . . 349 ILE HG12 . 27634 1 982 . 1 1 83 83 ILE HG13 H 1 1.088 . . 1 . . . . . 349 ILE HG13 . 27634 1 983 . 1 1 83 83 ILE HG21 H 1 1.084 0.005 . 1 . . . . . 349 ILE HG21 . 27634 1 984 . 1 1 83 83 ILE HG22 H 1 1.084 0.005 . 1 . . . . . 349 ILE HG22 . 27634 1 985 . 1 1 83 83 ILE HG23 H 1 1.084 0.005 . 1 . . . . . 349 ILE HG23 . 27634 1 986 . 1 1 83 83 ILE HD11 H 1 0.818 0.007 . 1 . . . . . 349 ILE HD11 . 27634 1 987 . 1 1 83 83 ILE HD12 H 1 0.818 0.007 . 1 . . . . . 349 ILE HD12 . 27634 1 988 . 1 1 83 83 ILE HD13 H 1 0.818 0.007 . 1 . . . . . 349 ILE HD13 . 27634 1 989 . 1 1 83 83 ILE C C 13 176.588 0.007 . 1 . . . . . 349 ILE C . 27634 1 990 . 1 1 83 83 ILE CA C 13 65.835 0.026 . 1 . . . . . 349 ILE CA . 27634 1 991 . 1 1 83 83 ILE CB C 13 38.865 0.027 . 1 . . . . . 349 ILE CB . 27634 1 992 . 1 1 83 83 ILE CG2 C 13 19.082 . . 1 . . . . . 349 ILE CG2 . 27634 1 993 . 1 1 83 83 ILE CD1 C 13 16.338 . . 1 . . . . . 349 ILE CD1 . 27634 1 994 . 1 1 83 83 ILE N N 15 121.522 0.003 . 1 . . . . . 349 ILE N . 27634 1 995 . 1 1 84 84 LYS H H 1 7.627 0.002 . 1 . . . . . 350 LYS H . 27634 1 996 . 1 1 84 84 LYS HA H 1 3.822 0.006 . 1 . . . . . 350 LYS HA . 27634 1 997 . 1 1 84 84 LYS HB2 H 1 1.973 0.006 . 2 . . . . . 350 LYS HB2 . 27634 1 998 . 1 1 84 84 LYS HB3 H 1 1.973 0.006 . 2 . . . . . 350 LYS HB3 . 27634 1 999 . 1 1 84 84 LYS HG2 H 1 1.423 0.003 . 2 . . . . . 350 LYS HG2 . 27634 1 1000 . 1 1 84 84 LYS HG3 H 1 1.541 0.005 . 2 . . . . . 350 LYS HG3 . 27634 1 1001 . 1 1 84 84 LYS HD2 H 1 1.706 0.003 . 2 . . . . . 350 LYS HD2 . 27634 1 1002 . 1 1 84 84 LYS HD3 H 1 1.706 0.003 . 2 . . . . . 350 LYS HD3 . 27634 1 1003 . 1 1 84 84 LYS HE2 H 1 3.004 0.008 . 2 . . . . . 350 LYS HE2 . 27634 1 1004 . 1 1 84 84 LYS HE3 H 1 3.004 0.008 . 2 . . . . . 350 LYS HE3 . 27634 1 1005 . 1 1 84 84 LYS C C 13 178.719 0.004 . 1 . . . . . 350 LYS C . 27634 1 1006 . 1 1 84 84 LYS CA C 13 59.562 0.028 . 1 . . . . . 350 LYS CA . 27634 1 1007 . 1 1 84 84 LYS CB C 13 32.299 0.019 . 1 . . . . . 350 LYS CB . 27634 1 1008 . 1 1 84 84 LYS CG C 13 25.137 . . 1 . . . . . 350 LYS CG . 27634 1 1009 . 1 1 84 84 LYS CD C 13 29.383 . . 1 . . . . . 350 LYS CD . 27634 1 1010 . 1 1 84 84 LYS CE C 13 42.148 . . 1 . . . . . 350 LYS CE . 27634 1 1011 . 1 1 84 84 LYS N N 15 117.669 0.003 . 1 . . . . . 350 LYS N . 27634 1 1012 . 1 1 85 85 GLU H H 1 7.783 0.002 . 1 . . . . . 351 GLU H . 27634 1 1013 . 1 1 85 85 GLU HA H 1 4.178 0.01 . 1 . . . . . 351 GLU HA . 27634 1 1014 . 1 1 85 85 GLU HB2 H 1 2.085 0.005 . 2 . . . . . 351 GLU HB2 . 27634 1 1015 . 1 1 85 85 GLU HB3 H 1 2.085 0.005 . 2 . . . . . 351 GLU HB3 . 27634 1 1016 . 1 1 85 85 GLU HG2 H 1 2.339 0.004 . 2 . . . . . 351 GLU HG2 . 27634 1 1017 . 1 1 85 85 GLU HG3 H 1 2.339 0.004 . 2 . . . . . 351 GLU HG3 . 27634 1 1018 . 1 1 85 85 GLU C C 13 178.432 0.003 . 1 . . . . . 351 GLU C . 27634 1 1019 . 1 1 85 85 GLU CA C 13 57.898 0.011 . 1 . . . . . 351 GLU CA . 27634 1 1020 . 1 1 85 85 GLU CB C 13 30.593 0.02 . 1 . . . . . 351 GLU CB . 27634 1 1021 . 1 1 85 85 GLU CG C 13 35.974 . . 1 . . . . . 351 GLU CG . 27634 1 1022 . 1 1 85 85 GLU N N 15 114.8 0.011 . 1 . . . . . 351 GLU N . 27634 1 1023 . 1 1 86 86 SER H H 1 7.863 0.005 . 1 . . . . . 352 SER H . 27634 1 1024 . 1 1 86 86 SER HA H 1 4.659 0.005 . 1 . . . . . 352 SER HA . 27634 1 1025 . 1 1 86 86 SER HB2 H 1 3.771 0.003 . 2 . . . . . 352 SER HB2 . 27634 1 1026 . 1 1 86 86 SER HB3 H 1 3.771 0.003 . 2 . . . . . 352 SER HB3 . 27634 1 1027 . 1 1 86 86 SER C C 13 173.238 0.005 . 1 . . . . . 352 SER C . 27634 1 1028 . 1 1 86 86 SER CA C 13 60.404 0.032 . 1 . . . . . 352 SER CA . 27634 1 1029 . 1 1 86 86 SER CB C 13 65.67 0.072 . 1 . . . . . 352 SER CB . 27634 1 1030 . 1 1 86 86 SER N N 15 110.695 0.002 . 1 . . . . . 352 SER N . 27634 1 1031 . 1 1 87 87 ILE H H 1 7.918 0.003 . 1 . . . . . 353 ILE H . 27634 1 1032 . 1 1 87 87 ILE HA H 1 4.831 0.012 . 1 . . . . . 353 ILE HA . 27634 1 1033 . 1 1 87 87 ILE HB H 1 2.445 0.008 . 1 . . . . . 353 ILE HB . 27634 1 1034 . 1 1 87 87 ILE HG12 H 1 1.038 0.002 . 2 . . . . . 353 ILE HG12 . 27634 1 1035 . 1 1 87 87 ILE HG13 H 1 1.038 0.002 . 2 . . . . . 353 ILE HG13 . 27634 1 1036 . 1 1 87 87 ILE HG21 H 1 0.841 0.002 . 1 . . . . . 353 ILE HG21 . 27634 1 1037 . 1 1 87 87 ILE HG22 H 1 0.841 0.002 . 1 . . . . . 353 ILE HG22 . 27634 1 1038 . 1 1 87 87 ILE HG23 H 1 0.841 0.002 . 1 . . . . . 353 ILE HG23 . 27634 1 1039 . 1 1 87 87 ILE C C 13 174.258 . . 1 . . . . . 353 ILE C . 27634 1 1040 . 1 1 87 87 ILE CA C 13 56.6 . . 1 . . . . . 353 ILE CA . 27634 1 1041 . 1 1 87 87 ILE CB C 13 36.362 . . 1 . . . . . 353 ILE CB . 27634 1 1042 . 1 1 87 87 ILE N N 15 121.057 0.006 . 1 . . . . . 353 ILE N . 27634 1 1043 . 1 1 88 88 PRO HA H 1 4.454 0.001 . 1 . . . . . 354 PRO HA . 27634 1 1044 . 1 1 88 88 PRO HB2 H 1 2.034 0.006 . 2 . . . . . 354 PRO HB2 . 27634 1 1045 . 1 1 88 88 PRO HB3 H 1 2.286 0.009 . 2 . . . . . 354 PRO HB3 . 27634 1 1046 . 1 1 88 88 PRO HG2 H 1 2.037 0.003 . 2 . . . . . 354 PRO HG2 . 27634 1 1047 . 1 1 88 88 PRO HG3 H 1 2.037 0.003 . 2 . . . . . 354 PRO HG3 . 27634 1 1048 . 1 1 88 88 PRO C C 13 177.403 . . 1 . . . . . 354 PRO C . 27634 1 1049 . 1 1 88 88 PRO CA C 13 64.103 0.033 . 1 . . . . . 354 PRO CA . 27634 1 1050 . 1 1 88 88 PRO CB C 13 32.256 . . 1 . . . . . 354 PRO CB . 27634 1 1051 . 1 1 88 88 PRO CG C 13 26.916 . . 1 . . . . . 354 PRO CG . 27634 1 1052 . 1 1 88 88 PRO CD C 13 51.446 . . 1 . . . . . 354 PRO CD . 27634 1 1053 . 1 1 89 89 ASN H H 1 7.676 0.002 . 1 . . . . . 355 ASN H . 27634 1 1054 . 1 1 89 89 ASN HA H 1 4.685 0.003 . 1 . . . . . 355 ASN HA . 27634 1 1055 . 1 1 89 89 ASN HB2 H 1 2.727 0.005 . 2 . . . . . 355 ASN HB2 . 27634 1 1056 . 1 1 89 89 ASN HB3 H 1 2.891 0.001 . 2 . . . . . 355 ASN HB3 . 27634 1 1057 . 1 1 89 89 ASN HD21 H 1 8.022 . . 1 . . . . . 355 ASN HD21 . 27634 1 1058 . 1 1 89 89 ASN HD22 H 1 7.219 . . 1 . . . . . 355 ASN HD22 . 27634 1 1059 . 1 1 89 89 ASN C C 13 175.291 . . 1 . . . . . 355 ASN C . 27634 1 1060 . 1 1 89 89 ASN CA C 13 53.902 0.008 . 1 . . . . . 355 ASN CA . 27634 1 1061 . 1 1 89 89 ASN CB C 13 40.347 0.015 . 1 . . . . . 355 ASN CB . 27634 1 1062 . 1 1 89 89 ASN N N 15 118.317 0.01 . 1 . . . . . 355 ASN N . 27634 1 1063 . 1 1 89 89 ASN ND2 N 15 114.101 0 . 1 . . . . . 355 ASN ND2 . 27634 1 1064 . 1 1 90 90 GLN H H 1 9.182 0.008 . 1 . . . . . 356 GLN H . 27634 1 1065 . 1 1 90 90 GLN HA H 1 3.804 0.001 . 1 . . . . . 356 GLN HA . 27634 1 1066 . 1 1 90 90 GLN HB2 H 1 2.117 0.008 . 2 . . . . . 356 GLN HB2 . 27634 1 1067 . 1 1 90 90 GLN HB3 H 1 2.117 0.008 . 2 . . . . . 356 GLN HB3 . 27634 1 1068 . 1 1 90 90 GLN HG2 H 1 2.426 0.007 . 2 . . . . . 356 GLN HG2 . 27634 1 1069 . 1 1 90 90 GLN HG3 H 1 2.426 0.007 . 2 . . . . . 356 GLN HG3 . 27634 1 1070 . 1 1 90 90 GLN C C 13 177.129 . . 1 . . . . . 356 GLN C . 27634 1 1071 . 1 1 90 90 GLN CA C 13 59.819 0.032 . 1 . . . . . 356 GLN CA . 27634 1 1072 . 1 1 90 90 GLN CB C 13 28.444 0.025 . 1 . . . . . 356 GLN CB . 27634 1 1073 . 1 1 90 90 GLN CG C 13 33.659 . . 1 . . . . . 356 GLN CG . 27634 1 1074 . 1 1 90 90 GLN N N 15 128.129 0.003 . 1 . . . . . 356 GLN N . 27634 1 1075 . 1 1 91 91 ALA H H 1 8.234 0.004 . 1 . . . . . 357 ALA H . 27634 1 1076 . 1 1 91 91 ALA HA H 1 4.179 0.013 . 1 . . . . . 357 ALA HA . 27634 1 1077 . 1 1 91 91 ALA HB1 H 1 1.46 0.007 . 1 . . . . . 357 ALA HB1 . 27634 1 1078 . 1 1 91 91 ALA HB2 H 1 1.46 0.007 . 1 . . . . . 357 ALA HB2 . 27634 1 1079 . 1 1 91 91 ALA HB3 H 1 1.46 0.007 . 1 . . . . . 357 ALA HB3 . 27634 1 1080 . 1 1 91 91 ALA C C 13 181.127 0.005 . 1 . . . . . 357 ALA C . 27634 1 1081 . 1 1 91 91 ALA CA C 13 55.203 0.051 . 1 . . . . . 357 ALA CA . 27634 1 1082 . 1 1 91 91 ALA CB C 13 17.752 0.028 . 1 . . . . . 357 ALA CB . 27634 1 1083 . 1 1 91 91 ALA N N 15 122.293 0.003 . 1 . . . . . 357 ALA N . 27634 1 1084 . 1 1 92 92 LYS H H 1 8.092 0.007 . 1 . . . . . 358 LYS H . 27634 1 1085 . 1 1 92 92 LYS HA H 1 3.94 0.018 . 1 . . . . . 358 LYS HA . 27634 1 1086 . 1 1 92 92 LYS HB2 H 1 1.773 0.017 . 2 . . . . . 358 LYS HB2 . 27634 1 1087 . 1 1 92 92 LYS HB3 H 1 1.773 0.017 . 2 . . . . . 358 LYS HB3 . 27634 1 1088 . 1 1 92 92 LYS HG2 H 1 1.458 0.011 . 2 . . . . . 358 LYS HG2 . 27634 1 1089 . 1 1 92 92 LYS HG3 H 1 1.458 0.011 . 2 . . . . . 358 LYS HG3 . 27634 1 1090 . 1 1 92 92 LYS HD2 H 1 1.679 . . 2 . . . . . 358 LYS HD2 . 27634 1 1091 . 1 1 92 92 LYS HD3 H 1 1.679 . . 2 . . . . . 358 LYS HD3 . 27634 1 1092 . 1 1 92 92 LYS HE2 H 1 2.929 0.022 . 2 . . . . . 358 LYS HE2 . 27634 1 1093 . 1 1 92 92 LYS HE3 H 1 2.929 0.022 . 2 . . . . . 358 LYS HE3 . 27634 1 1094 . 1 1 92 92 LYS C C 13 178.477 0.002 . 1 . . . . . 358 LYS C . 27634 1 1095 . 1 1 92 92 LYS CA C 13 58.776 0.043 . 1 . . . . . 358 LYS CA . 27634 1 1096 . 1 1 92 92 LYS CB C 13 32.541 0.046 . 1 . . . . . 358 LYS CB . 27634 1 1097 . 1 1 92 92 LYS CG C 13 25.429 . . 1 . . . . . 358 LYS CG . 27634 1 1098 . 1 1 92 92 LYS CD C 13 29.32 . . 1 . . . . . 358 LYS CD . 27634 1 1099 . 1 1 92 92 LYS N N 15 119.442 0.002 . 1 . . . . . 358 LYS N . 27634 1 1100 . 1 1 93 93 ARG H H 1 8.481 0.002 . 1 . . . . . 359 ARG H . 27634 1 1101 . 1 1 93 93 ARG HA H 1 3.906 0.007 . 1 . . . . . 359 ARG HA . 27634 1 1102 . 1 1 93 93 ARG HB2 H 1 1.903 0.019 . 2 . . . . . 359 ARG HB2 . 27634 1 1103 . 1 1 93 93 ARG HB3 H 1 2.081 0 . 2 . . . . . 359 ARG HB3 . 27634 1 1104 . 1 1 93 93 ARG HG2 H 1 1.44 0.002 . 2 . . . . . 359 ARG HG2 . 27634 1 1105 . 1 1 93 93 ARG HG3 H 1 1.44 0.002 . 2 . . . . . 359 ARG HG3 . 27634 1 1106 . 1 1 93 93 ARG HD2 H 1 3.381 0.008 . 2 . . . . . 359 ARG HD2 . 27634 1 1107 . 1 1 93 93 ARG HD3 H 1 3.381 0.008 . 2 . . . . . 359 ARG HD3 . 27634 1 1108 . 1 1 93 93 ARG HE H 1 7.683 . . 1 . . . . . 359 ARG HE . 27634 1 1109 . 1 1 93 93 ARG C C 13 178.151 0.002 . 1 . . . . . 359 ARG C . 27634 1 1110 . 1 1 93 93 ARG CA C 13 60.774 0.029 . 1 . . . . . 359 ARG CA . 27634 1 1111 . 1 1 93 93 ARG CB C 13 30.059 0.042 . 1 . . . . . 359 ARG CB . 27634 1 1112 . 1 1 93 93 ARG CG C 13 27.258 . . 1 . . . . . 359 ARG CG . 27634 1 1113 . 1 1 93 93 ARG CD C 13 44.442 . . 1 . . . . . 359 ARG CD . 27634 1 1114 . 1 1 93 93 ARG N N 15 119.632 0.021 . 1 . . . . . 359 ARG N . 27634 1 1115 . 1 1 93 93 ARG NE N 15 83.718 . . 1 . . . . . 359 ARG NE . 27634 1 1116 . 1 1 94 94 GLN H H 1 8.232 0.002 . 1 . . . . . 360 GLN H . 27634 1 1117 . 1 1 94 94 GLN HA H 1 4.088 0.022 . 1 . . . . . 360 GLN HA . 27634 1 1118 . 1 1 94 94 GLN HB2 H 1 2.155 0.014 . 2 . . . . . 360 GLN HB2 . 27634 1 1119 . 1 1 94 94 GLN HB3 H 1 2.155 0.014 . 2 . . . . . 360 GLN HB3 . 27634 1 1120 . 1 1 94 94 GLN HG2 H 1 2.425 0.004 . 2 . . . . . 360 GLN HG2 . 27634 1 1121 . 1 1 94 94 GLN HG3 H 1 2.601 0.009 . 2 . . . . . 360 GLN HG3 . 27634 1 1122 . 1 1 94 94 GLN HE21 H 1 7.62 . . 2 . . . . . 360 GLN HE21 . 27634 1 1123 . 1 1 94 94 GLN HE22 H 1 6.941 . . 2 . . . . . 360 GLN HE22 . 27634 1 1124 . 1 1 94 94 GLN C C 13 178.528 0.009 . 1 . . . . . 360 GLN C . 27634 1 1125 . 1 1 94 94 GLN CA C 13 59.372 0.07 . 1 . . . . . 360 GLN CA . 27634 1 1126 . 1 1 94 94 GLN CB C 13 28.237 0.009 . 1 . . . . . 360 GLN CB . 27634 1 1127 . 1 1 94 94 GLN CG C 13 34.271 . . 1 . . . . . 360 GLN CG . 27634 1 1128 . 1 1 94 94 GLN N N 15 117.626 0.026 . 1 . . . . . 360 GLN N . 27634 1 1129 . 1 1 94 94 GLN NE2 N 15 112.933 0.003 . 1 . . . . . 360 GLN NE2 . 27634 1 1130 . 1 1 95 95 LYS H H 1 7.568 0.002 . 1 . . . . . 361 LYS H . 27634 1 1131 . 1 1 95 95 LYS HA H 1 4.057 0.006 . 1 . . . . . 361 LYS HA . 27634 1 1132 . 1 1 95 95 LYS HB2 H 1 1.733 0.014 . 2 . . . . . 361 LYS HB2 . 27634 1 1133 . 1 1 95 95 LYS HB3 H 1 1.733 0.014 . 2 . . . . . 361 LYS HB3 . 27634 1 1134 . 1 1 95 95 LYS HG2 H 1 1.36 0.013 . 2 . . . . . 361 LYS HG2 . 27634 1 1135 . 1 1 95 95 LYS HG3 H 1 1.36 0.013 . 2 . . . . . 361 LYS HG3 . 27634 1 1136 . 1 1 95 95 LYS HD2 H 1 1.452 0.016 . 2 . . . . . 361 LYS HD2 . 27634 1 1137 . 1 1 95 95 LYS HD3 H 1 1.452 0.016 . 2 . . . . . 361 LYS HD3 . 27634 1 1138 . 1 1 95 95 LYS HE2 H 1 2.732 . . 2 . . . . . 361 LYS HE2 . 27634 1 1139 . 1 1 95 95 LYS HE3 H 1 2.732 . . 2 . . . . . 361 LYS HE3 . 27634 1 1140 . 1 1 95 95 LYS C C 13 179.703 0.002 . 1 . . . . . 361 LYS C . 27634 1 1141 . 1 1 95 95 LYS CA C 13 59.465 0.026 . 1 . . . . . 361 LYS CA . 27634 1 1142 . 1 1 95 95 LYS CB C 13 31.81 0.064 . 1 . . . . . 361 LYS CB . 27634 1 1143 . 1 1 95 95 LYS CG C 13 24.619 . . 1 . . . . . 361 LYS CG . 27634 1 1144 . 1 1 95 95 LYS CD C 13 29.085 . . 1 . . . . . 361 LYS CD . 27634 1 1145 . 1 1 95 95 LYS CE C 13 41.917 . . 1 . . . . . 361 LYS CE . 27634 1 1146 . 1 1 95 95 LYS N N 15 119.398 0.009 . 1 . . . . . 361 LYS N . 27634 1 1147 . 1 1 96 96 PHE H H 1 7.977 0.006 . 1 . . . . . 362 PHE H . 27634 1 1148 . 1 1 96 96 PHE HA H 1 4.671 0.002 . 1 . . . . . 362 PHE HA . 27634 1 1149 . 1 1 96 96 PHE HB2 H 1 3.009 0.003 . 2 . . . . . 362 PHE HB2 . 27634 1 1150 . 1 1 96 96 PHE HB3 H 1 3.009 0.003 . 2 . . . . . 362 PHE HB3 . 27634 1 1151 . 1 1 96 96 PHE HD1 H 1 7.223 0.001 . 3 . . . . . 362 PHE HD1 . 27634 1 1152 . 1 1 96 96 PHE HD2 H 1 7.223 0.001 . 3 . . . . . 362 PHE HD2 . 27634 1 1153 . 1 1 96 96 PHE HE1 H 1 7.297 . . 3 . . . . . 362 PHE HE1 . 27634 1 1154 . 1 1 96 96 PHE HE2 H 1 7.297 . . 3 . . . . . 362 PHE HE2 . 27634 1 1155 . 1 1 96 96 PHE C C 13 178.803 0 . 1 . . . . . 362 PHE C . 27634 1 1156 . 1 1 96 96 PHE CA C 13 61.026 0.036 . 1 . . . . . 362 PHE CA . 27634 1 1157 . 1 1 96 96 PHE CB C 13 39.219 0.064 . 1 . . . . . 362 PHE CB . 27634 1 1158 . 1 1 96 96 PHE CD1 C 13 129.698 . . 3 . . . . . 362 PHE CD1 . 27634 1 1159 . 1 1 96 96 PHE CD2 C 13 129.698 . . 3 . . . . . 362 PHE CD2 . 27634 1 1160 . 1 1 96 96 PHE CE1 C 13 131.276 . . 3 . . . . . 362 PHE CE1 . 27634 1 1161 . 1 1 96 96 PHE CE2 C 13 131.276 . . 3 . . . . . 362 PHE CE2 . 27634 1 1162 . 1 1 96 96 PHE N N 15 117.502 0.007 . 1 . . . . . 362 PHE N . 27634 1 1163 . 1 1 97 97 GLU H H 1 9.205 0.006 . 1 . . . . . 363 GLU H . 27634 1 1164 . 1 1 97 97 GLU HA H 1 3.747 0.006 . 1 . . . . . 363 GLU HA . 27634 1 1165 . 1 1 97 97 GLU HB2 H 1 1.986 0.002 . 2 . . . . . 363 GLU HB2 . 27634 1 1166 . 1 1 97 97 GLU HB3 H 1 2.26 0 . 2 . . . . . 363 GLU HB3 . 27634 1 1167 . 1 1 97 97 GLU HG2 H 1 2.148 0.02 . 2 . . . . . 363 GLU HG2 . 27634 1 1168 . 1 1 97 97 GLU HG3 H 1 2.148 0.02 . 2 . . . . . 363 GLU HG3 . 27634 1 1169 . 1 1 97 97 GLU C C 13 179.975 0.005 . 1 . . . . . 363 GLU C . 27634 1 1170 . 1 1 97 97 GLU CA C 13 60.7 0.037 . 1 . . . . . 363 GLU CA . 27634 1 1171 . 1 1 97 97 GLU CB C 13 29.171 0.014 . 1 . . . . . 363 GLU CB . 27634 1 1172 . 1 1 97 97 GLU CG C 13 37.85 . . 1 . . . . . 363 GLU CG . 27634 1 1173 . 1 1 97 97 GLU N N 15 120.256 0.019 . 1 . . . . . 363 GLU N . 27634 1 1174 . 1 1 98 98 MET H H 1 7.98 0.003 . 1 . . . . . 364 MET H . 27634 1 1175 . 1 1 98 98 MET HA H 1 4.293 0.004 . 1 . . . . . 364 MET HA . 27634 1 1176 . 1 1 98 98 MET HB2 H 1 2.27 0.009 . 1 . . . . . 364 MET HB2 . 27634 1 1177 . 1 1 98 98 MET HB3 H 1 2.27 0.009 . 1 . . . . . 364 MET HB3 . 27634 1 1178 . 1 1 98 98 MET HG2 H 1 2.65 0.003 . 2 . . . . . 364 MET HG2 . 27634 1 1179 . 1 1 98 98 MET HG3 H 1 2.762 0.014 . 2 . . . . . 364 MET HG3 . 27634 1 1180 . 1 1 98 98 MET HE1 H 1 2.098 . . 1 . . . . . 364 MET HE1 . 27634 1 1181 . 1 1 98 98 MET HE2 H 1 2.098 . . 1 . . . . . 364 MET HE2 . 27634 1 1182 . 1 1 98 98 MET HE3 H 1 2.098 . . 1 . . . . . 364 MET HE3 . 27634 1 1183 . 1 1 98 98 MET C C 13 179.413 0.003 . 1 . . . . . 364 MET C . 27634 1 1184 . 1 1 98 98 MET CA C 13 58.419 0.038 . 1 . . . . . 364 MET CA . 27634 1 1185 . 1 1 98 98 MET CB C 13 31.968 . . 1 . . . . . 364 MET CB . 27634 1 1186 . 1 1 98 98 MET CG C 13 31.968 . . 1 . . . . . 364 MET CG . 27634 1 1187 . 1 1 98 98 MET CE C 13 16.85 . . 1 . . . . . 364 MET CE . 27634 1 1188 . 1 1 98 98 MET N N 15 118.334 0.013 . 1 . . . . . 364 MET N . 27634 1 1189 . 1 1 99 99 GLN H H 1 7.781 0.002 . 1 . . . . . 365 GLN H . 27634 1 1190 . 1 1 99 99 GLN HA H 1 4.152 0.006 . 1 . . . . . 365 GLN HA . 27634 1 1191 . 1 1 99 99 GLN HB2 H 1 2.519 0.011 . 2 . . . . . 365 GLN HB2 . 27634 1 1192 . 1 1 99 99 GLN HB3 H 1 2.242 0.013 . 2 . . . . . 365 GLN HB3 . 27634 1 1193 . 1 1 99 99 GLN HG2 H 1 2.369 0.006 . 2 . . . . . 365 GLN HG2 . 27634 1 1194 . 1 1 99 99 GLN HG3 H 1 2.638 0.009 . 2 . . . . . 365 GLN HG3 . 27634 1 1195 . 1 1 99 99 GLN HE21 H 1 7.201 . . 2 . . . . . 365 GLN HE21 . 27634 1 1196 . 1 1 99 99 GLN HE22 H 1 6.789 . . 2 . . . . . 365 GLN HE22 . 27634 1 1197 . 1 1 99 99 GLN C C 13 179.441 0.018 . 1 . . . . . 365 GLN C . 27634 1 1198 . 1 1 99 99 GLN CA C 13 58.822 0.011 . 1 . . . . . 365 GLN CA . 27634 1 1199 . 1 1 99 99 GLN CB C 13 29.845 0.02 . 1 . . . . . 365 GLN CB . 27634 1 1200 . 1 1 99 99 GLN CG C 13 35.321 . . 1 . . . . . 365 GLN CG . 27634 1 1201 . 1 1 99 99 GLN N N 15 119.375 0.004 . 1 . . . . . 365 GLN N . 27634 1 1202 . 1 1 99 99 GLN NE2 N 15 110.038 0.004 . 1 . . . . . 365 GLN NE2 . 27634 1 1203 . 1 1 100 100 VAL H H 1 8.279 0.001 . 1 . . . . . 366 VAL H . 27634 1 1204 . 1 1 100 100 VAL HA H 1 3.433 0.006 . 1 . . . . . 366 VAL HA . 27634 1 1205 . 1 1 100 100 VAL HB H 1 2.373 0.004 . 1 . . . . . 366 VAL HB . 27634 1 1206 . 1 1 100 100 VAL HG11 H 1 1.141 0.007 . 2 . . . . . 366 VAL HG11 . 27634 1 1207 . 1 1 100 100 VAL HG12 H 1 1.141 0.007 . 2 . . . . . 366 VAL HG12 . 27634 1 1208 . 1 1 100 100 VAL HG13 H 1 1.141 0.007 . 2 . . . . . 366 VAL HG13 . 27634 1 1209 . 1 1 100 100 VAL HG21 H 1 1.141 0.007 . 2 . . . . . 366 VAL HG21 . 27634 1 1210 . 1 1 100 100 VAL HG22 H 1 1.141 0.007 . 2 . . . . . 366 VAL HG22 . 27634 1 1211 . 1 1 100 100 VAL HG23 H 1 1.141 0.007 . 2 . . . . . 366 VAL HG23 . 27634 1 1212 . 1 1 100 100 VAL C C 13 177.062 0.002 . 1 . . . . . 366 VAL C . 27634 1 1213 . 1 1 100 100 VAL CA C 13 66.88 0.065 . 1 . . . . . 366 VAL CA . 27634 1 1214 . 1 1 100 100 VAL CB C 13 31.625 0.072 . 1 . . . . . 366 VAL CB . 27634 1 1215 . 1 1 100 100 VAL CG1 C 13 25.385 . . 2 . . . . . 366 VAL CG1 . 27634 1 1216 . 1 1 100 100 VAL CG2 C 13 22.866 . . 2 . . . . . 366 VAL CG2 . 27634 1 1217 . 1 1 100 100 VAL N N 15 122.217 0.009 . 1 . . . . . 366 VAL N . 27634 1 1218 . 1 1 101 101 GLY H H 1 7.494 0.003 . 1 . . . . . 367 GLY H . 27634 1 1219 . 1 1 101 101 GLY HA2 H 1 3.943 0.013 . 1 . . . . . 367 GLY HA2 . 27634 1 1220 . 1 1 101 101 GLY HA3 H 1 3.943 0.013 . 1 . . . . . 367 GLY HA3 . 27634 1 1221 . 1 1 101 101 GLY C C 13 174.587 0.003 . 1 . . . . . 367 GLY C . 27634 1 1222 . 1 1 101 101 GLY CA C 13 46.745 0.062 . 1 . . . . . 367 GLY CA . 27634 1 1223 . 1 1 101 101 GLY N N 15 101.884 0.006 . 1 . . . . . 367 GLY N . 27634 1 1224 . 1 1 102 102 GLY H H 1 7.492 0.002 . 1 . . . . . 368 GLY H . 27634 1 1225 . 1 1 102 102 GLY HA2 H 1 4.424 0.011 . 2 . . . . . 368 GLY HA2 . 27634 1 1226 . 1 1 102 102 GLY HA3 H 1 3.746 0.008 . 2 . . . . . 368 GLY HA3 . 27634 1 1227 . 1 1 102 102 GLY C C 13 175.376 0.002 . 1 . . . . . 368 GLY C . 27634 1 1228 . 1 1 102 102 GLY CA C 13 44.53 0.043 . 1 . . . . . 368 GLY CA . 27634 1 1229 . 1 1 102 102 GLY N N 15 104.68 0.002 . 1 . . . . . 368 GLY N . 27634 1 1230 . 1 1 103 103 ILE H H 1 7.326 0.004 . 1 . . . . . 369 ILE H . 27634 1 1231 . 1 1 103 103 ILE HA H 1 4.222 0.026 . 1 . . . . . 369 ILE HA . 27634 1 1232 . 1 1 103 103 ILE HB H 1 1.991 0.018 . 1 . . . . . 369 ILE HB . 27634 1 1233 . 1 1 103 103 ILE HG12 H 1 1.121 0.009 . 2 . . . . . 369 ILE HG12 . 27634 1 1234 . 1 1 103 103 ILE HG13 H 1 1.133 0.018 . 2 . . . . . 369 ILE HG13 . 27634 1 1235 . 1 1 103 103 ILE C C 13 176.658 0 . 1 . . . . . 369 ILE C . 27634 1 1236 . 1 1 103 103 ILE CA C 13 62.936 0.048 . 1 . . . . . 369 ILE CA . 27634 1 1237 . 1 1 103 103 ILE CB C 13 39.979 0.08 . 1 . . . . . 369 ILE CB . 27634 1 1238 . 1 1 103 103 ILE CG2 C 13 18.352 . . 1 . . . . . 369 ILE CG2 . 27634 1 1239 . 1 1 103 103 ILE N N 15 116.162 0.006 . 1 . . . . . 369 ILE N . 27634 1 1240 . 1 1 104 104 ARG H H 1 9.974 0.003 . 1 . . . . . 370 ARG H . 27634 1 1241 . 1 1 104 104 ARG HA H 1 4.709 0.007 . 1 . . . . . 370 ARG HA . 27634 1 1242 . 1 1 104 104 ARG HB2 H 1 1.84 0.011 . 2 . . . . . 370 ARG HB2 . 27634 1 1243 . 1 1 104 104 ARG HB3 H 1 2.018 0.011 . 2 . . . . . 370 ARG HB3 . 27634 1 1244 . 1 1 104 104 ARG HG2 H 1 1.689 0.009 . 2 . . . . . 370 ARG HG2 . 27634 1 1245 . 1 1 104 104 ARG HG3 H 1 1.689 0.009 . 2 . . . . . 370 ARG HG3 . 27634 1 1246 . 1 1 104 104 ARG HD2 H 1 3.256 0.018 . 2 . . . . . 370 ARG HD2 . 27634 1 1247 . 1 1 104 104 ARG HD3 H 1 3.256 0.018 . 2 . . . . . 370 ARG HD3 . 27634 1 1248 . 1 1 104 104 ARG HE H 1 7.69 . . 1 . . . . . 370 ARG HE . 27634 1 1249 . 1 1 104 104 ARG C C 13 176.565 . . 1 . . . . . 370 ARG C . 27634 1 1250 . 1 1 104 104 ARG CA C 13 56.101 0.019 . 1 . . . . . 370 ARG CA . 27634 1 1251 . 1 1 104 104 ARG CB C 13 33.225 0.051 . 1 . . . . . 370 ARG CB . 27634 1 1252 . 1 1 104 104 ARG CG C 13 26.616 . . 1 . . . . . 370 ARG CG . 27634 1 1253 . 1 1 104 104 ARG CD C 13 43.164 . . 1 . . . . . 370 ARG CD . 27634 1 1254 . 1 1 104 104 ARG N N 15 119.936 0.017 . 1 . . . . . 370 ARG N . 27634 1 1255 . 1 1 104 104 ARG NE N 15 85.088 . . 1 . . . . . 370 ARG NE . 27634 1 1256 . 1 1 105 105 ASN H H 1 7.56 0.002 . 1 . . . . . 371 ASN H . 27634 1 1257 . 1 1 105 105 ASN HA H 1 4.712 0.005 . 1 . . . . . 371 ASN HA . 27634 1 1258 . 1 1 105 105 ASN HB2 H 1 3.243 0.006 . 2 . . . . . 371 ASN HB2 . 27634 1 1259 . 1 1 105 105 ASN HB3 H 1 3.243 0.006 . 2 . . . . . 371 ASN HB3 . 27634 1 1260 . 1 1 105 105 ASN HD21 H 1 7.504 . . 1 . . . . . 371 ASN HD21 . 27634 1 1261 . 1 1 105 105 ASN HD22 H 1 6.874 . . 1 . . . . . 371 ASN HD22 . 27634 1 1262 . 1 1 105 105 ASN C C 13 174.004 0.005 . 1 . . . . . 371 ASN C . 27634 1 1263 . 1 1 105 105 ASN CA C 13 52.096 0.052 . 1 . . . . . 371 ASN CA . 27634 1 1264 . 1 1 105 105 ASN CB C 13 39.699 0.029 . 1 . . . . . 371 ASN CB . 27634 1 1265 . 1 1 105 105 ASN N N 15 113.157 0.008 . 1 . . . . . 371 ASN N . 27634 1 1266 . 1 1 105 105 ASN ND2 N 15 113.46 0.001 . 1 . . . . . 371 ASN ND2 . 27634 1 1267 . 1 1 106 106 GLU H H 1 9.192 0.006 . 1 . . . . . 372 GLU H . 27634 1 1268 . 1 1 106 106 GLU HA H 1 3.489 0.006 . 1 . . . . . 372 GLU HA . 27634 1 1269 . 1 1 106 106 GLU HB2 H 1 2.066 0.003 . 2 . . . . . 372 GLU HB2 . 27634 1 1270 . 1 1 106 106 GLU HB3 H 1 2.066 0.003 . 2 . . . . . 372 GLU HB3 . 27634 1 1271 . 1 1 106 106 GLU HG2 H 1 2.215 0.003 . 2 . . . . . 372 GLU HG2 . 27634 1 1272 . 1 1 106 106 GLU HG3 H 1 2.215 0.003 . 2 . . . . . 372 GLU HG3 . 27634 1 1273 . 1 1 106 106 GLU C C 13 177.418 0.007 . 1 . . . . . 372 GLU C . 27634 1 1274 . 1 1 106 106 GLU CA C 13 59.391 0.058 . 1 . . . . . 372 GLU CA . 27634 1 1275 . 1 1 106 106 GLU CB C 13 29.912 0.078 . 1 . . . . . 372 GLU CB . 27634 1 1276 . 1 1 106 106 GLU CG C 13 36.504 . . 1 . . . . . 372 GLU CG . 27634 1 1277 . 1 1 106 106 GLU N N 15 119.216 0.009 . 1 . . . . . 372 GLU N . 27634 1 1278 . 1 1 107 107 GLN H H 1 8.375 0.001 . 1 . . . . . 373 GLN H . 27634 1 1279 . 1 1 107 107 GLN HA H 1 3.939 0.004 . 1 . . . . . 373 GLN HA . 27634 1 1280 . 1 1 107 107 GLN HB2 H 1 2.129 0.004 . 2 . . . . . 373 GLN HB2 . 27634 1 1281 . 1 1 107 107 GLN HB3 H 1 2.129 0.004 . 2 . . . . . 373 GLN HB3 . 27634 1 1282 . 1 1 107 107 GLN HG2 H 1 2.404 0.005 . 2 . . . . . 373 GLN HG2 . 27634 1 1283 . 1 1 107 107 GLN HG3 H 1 2.404 0.005 . 2 . . . . . 373 GLN HG3 . 27634 1 1284 . 1 1 107 107 GLN HE21 H 1 7.584 . . 2 . . . . . 373 GLN HE21 . 27634 1 1285 . 1 1 107 107 GLN HE22 H 1 6.903 . . 2 . . . . . 373 GLN HE22 . 27634 1 1286 . 1 1 107 107 GLN C C 13 178.291 0.002 . 1 . . . . . 373 GLN C . 27634 1 1287 . 1 1 107 107 GLN CA C 13 59.321 0.042 . 1 . . . . . 373 GLN CA . 27634 1 1288 . 1 1 107 107 GLN CB C 13 27.874 0.02 . 1 . . . . . 373 GLN CB . 27634 1 1289 . 1 1 107 107 GLN CG C 13 34.251 . . 1 . . . . . 373 GLN CG . 27634 1 1290 . 1 1 107 107 GLN N N 15 121.343 0.004 . 1 . . . . . 373 GLN N . 27634 1 1291 . 1 1 107 107 GLN NE2 N 15 111.88 0.004 . 1 . . . . . 373 GLN NE2 . 27634 1 1292 . 1 1 108 108 ASP H H 1 8.854 0.002 . 1 . . . . . 374 ASP H . 27634 1 1293 . 1 1 108 108 ASP HA H 1 4.45 0.006 . 1 . . . . . 374 ASP HA . 27634 1 1294 . 1 1 108 108 ASP HB2 H 1 2.946 0.026 . 2 . . . . . 374 ASP HB2 . 27634 1 1295 . 1 1 108 108 ASP HB3 H 1 2.946 0.026 . 2 . . . . . 374 ASP HB3 . 27634 1 1296 . 1 1 108 108 ASP C C 13 179.793 0.002 . 1 . . . . . 374 ASP C . 27634 1 1297 . 1 1 108 108 ASP CA C 13 57.067 0.059 . 1 . . . . . 374 ASP CA . 27634 1 1298 . 1 1 108 108 ASP CB C 13 41.351 0.088 . 1 . . . . . 374 ASP CB . 27634 1 1299 . 1 1 108 108 ASP N N 15 119.936 0.004 . 1 . . . . . 374 ASP N . 27634 1 1300 . 1 1 109 109 PHE H H 1 7.716 0.002 . 1 . . . . . 375 PHE H . 27634 1 1301 . 1 1 109 109 PHE HA H 1 4.164 0.012 . 1 . . . . . 375 PHE HA . 27634 1 1302 . 1 1 109 109 PHE HB2 H 1 2.629 0.009 . 2 . . . . . 375 PHE HB2 . 27634 1 1303 . 1 1 109 109 PHE HB3 H 1 3.006 0.006 . 2 . . . . . 375 PHE HB3 . 27634 1 1304 . 1 1 109 109 PHE HD1 H 1 6.901 . . 3 . . . . . 375 PHE HD1 . 27634 1 1305 . 1 1 109 109 PHE HD2 H 1 6.901 . . 3 . . . . . 375 PHE HD2 . 27634 1 1306 . 1 1 109 109 PHE HE1 H 1 7.251 0.003 . 3 . . . . . 375 PHE HE1 . 27634 1 1307 . 1 1 109 109 PHE HE2 H 1 7.251 0.003 . 3 . . . . . 375 PHE HE2 . 27634 1 1308 . 1 1 109 109 PHE C C 13 175.074 0.004 . 1 . . . . . 375 PHE C . 27634 1 1309 . 1 1 109 109 PHE CA C 13 60.616 0.035 . 1 . . . . . 375 PHE CA . 27634 1 1310 . 1 1 109 109 PHE CB C 13 38.109 0.038 . 1 . . . . . 375 PHE CB . 27634 1 1311 . 1 1 109 109 PHE CD1 C 13 132.293 . . 3 . . . . . 375 PHE CD1 . 27634 1 1312 . 1 1 109 109 PHE CD2 C 13 132.293 . . 3 . . . . . 375 PHE CD2 . 27634 1 1313 . 1 1 109 109 PHE CE1 C 13 130.761 . . 3 . . . . . 375 PHE CE1 . 27634 1 1314 . 1 1 109 109 PHE CE2 C 13 130.761 . . 3 . . . . . 375 PHE CE2 . 27634 1 1315 . 1 1 109 109 PHE N N 15 120.465 0.012 . 1 . . . . . 375 PHE N . 27634 1 1316 . 1 1 110 110 LYS H H 1 8.61 0.005 . 1 . . . . . 376 LYS H . 27634 1 1317 . 1 1 110 110 LYS HA H 1 3.249 0.005 . 1 . . . . . 376 LYS HA . 27634 1 1318 . 1 1 110 110 LYS HB2 H 1 1.732 0.002 . 2 . . . . . 376 LYS HB2 . 27634 1 1319 . 1 1 110 110 LYS HB3 H 1 1.846 0.024 . 2 . . . . . 376 LYS HB3 . 27634 1 1320 . 1 1 110 110 LYS HG2 H 1 1.295 0.002 . 2 . . . . . 376 LYS HG2 . 27634 1 1321 . 1 1 110 110 LYS HG3 H 1 1.295 0.002 . 2 . . . . . 376 LYS HG3 . 27634 1 1322 . 1 1 110 110 LYS HD2 H 1 1.663 . . 2 . . . . . 376 LYS HD2 . 27634 1 1323 . 1 1 110 110 LYS HD3 H 1 1.663 . . 2 . . . . . 376 LYS HD3 . 27634 1 1324 . 1 1 110 110 LYS HE2 H 1 2.929 . . 2 . . . . . 376 LYS HE2 . 27634 1 1325 . 1 1 110 110 LYS HE3 H 1 2.929 . . 2 . . . . . 376 LYS HE3 . 27634 1 1326 . 1 1 110 110 LYS C C 13 180.092 0.003 . 1 . . . . . 376 LYS C . 27634 1 1327 . 1 1 110 110 LYS CA C 13 60.075 0.034 . 1 . . . . . 376 LYS CA . 27634 1 1328 . 1 1 110 110 LYS CB C 13 32.379 0.035 . 1 . . . . . 376 LYS CB . 27634 1 1329 . 1 1 110 110 LYS CG C 13 26.618 . . 1 . . . . . 376 LYS CG . 27634 1 1330 . 1 1 110 110 LYS CD C 13 29.974 . . 1 . . . . . 376 LYS CD . 27634 1 1331 . 1 1 110 110 LYS CE C 13 41.938 . . 1 . . . . . 376 LYS CE . 27634 1 1332 . 1 1 110 110 LYS N N 15 120.334 0.012 . 1 . . . . . 376 LYS N . 27634 1 1333 . 1 1 111 111 ASN H H 1 8.634 0.002 . 1 . . . . . 377 ASN H . 27634 1 1334 . 1 1 111 111 ASN HA H 1 4.42 0.014 . 1 . . . . . 377 ASN HA . 27634 1 1335 . 1 1 111 111 ASN HB2 H 1 2.899 0.008 . 2 . . . . . 377 ASN HB2 . 27634 1 1336 . 1 1 111 111 ASN HB3 H 1 2.899 0.008 . 2 . . . . . 377 ASN HB3 . 27634 1 1337 . 1 1 111 111 ASN HD21 H 1 7.956 . . 1 . . . . . 377 ASN HD21 . 27634 1 1338 . 1 1 111 111 ASN HD22 H 1 7.135 . . 1 . . . . . 377 ASN HD22 . 27634 1 1339 . 1 1 111 111 ASN C C 13 177.574 0.006 . 1 . . . . . 377 ASN C . 27634 1 1340 . 1 1 111 111 ASN CA C 13 55.69 0.03 . 1 . . . . . 377 ASN CA . 27634 1 1341 . 1 1 111 111 ASN CB C 13 37.655 0.017 . 1 . . . . . 377 ASN CB . 27634 1 1342 . 1 1 111 111 ASN N N 15 118.694 0.004 . 1 . . . . . 377 ASN N . 27634 1 1343 . 1 1 111 111 ASN ND2 N 15 112.655 0.005 . 1 . . . . . 377 ASN ND2 . 27634 1 1344 . 1 1 112 112 LEU H H 1 8.101 0.008 . 1 . . . . . 378 LEU H . 27634 1 1345 . 1 1 112 112 LEU HA H 1 4.318 0.003 . 1 . . . . . 378 LEU HA . 27634 1 1346 . 1 1 112 112 LEU HB2 H 1 1.587 0.02 . 2 . . . . . 378 LEU HB2 . 27634 1 1347 . 1 1 112 112 LEU HB3 H 1 1.738 0.01 . 2 . . . . . 378 LEU HB3 . 27634 1 1348 . 1 1 112 112 LEU HG H 1 1.558 0.021 . 1 . . . . . 378 LEU HG . 27634 1 1349 . 1 1 112 112 LEU HD11 H 1 0.901 0.013 . 2 . . . . . 378 LEU HD11 . 27634 1 1350 . 1 1 112 112 LEU HD12 H 1 0.901 0.013 . 2 . . . . . 378 LEU HD12 . 27634 1 1351 . 1 1 112 112 LEU HD13 H 1 0.901 0.013 . 2 . . . . . 378 LEU HD13 . 27634 1 1352 . 1 1 112 112 LEU HD21 H 1 1.11 0.022 . 2 . . . . . 378 LEU HD21 . 27634 1 1353 . 1 1 112 112 LEU HD22 H 1 1.11 0.022 . 2 . . . . . 378 LEU HD22 . 27634 1 1354 . 1 1 112 112 LEU HD23 H 1 1.11 0.022 . 2 . . . . . 378 LEU HD23 . 27634 1 1355 . 1 1 112 112 LEU C C 13 178.168 0.005 . 1 . . . . . 378 LEU C . 27634 1 1356 . 1 1 112 112 LEU CA C 13 57.274 0.032 . 1 . . . . . 378 LEU CA . 27634 1 1357 . 1 1 112 112 LEU CB C 13 40.979 0.026 . 1 . . . . . 378 LEU CB . 27634 1 1358 . 1 1 112 112 LEU CG C 13 26.903 . . 1 . . . . . 378 LEU CG . 27634 1 1359 . 1 1 112 112 LEU CD1 C 13 23.461 . . 2 . . . . . 378 LEU CD1 . 27634 1 1360 . 1 1 112 112 LEU CD2 C 13 23.461 . . 2 . . . . . 378 LEU CD2 . 27634 1 1361 . 1 1 112 112 LEU N N 15 122.651 0.003 . 1 . . . . . 378 LEU N . 27634 1 1362 . 1 1 113 113 ARG H H 1 8.549 0.004 . 1 . . . . . 379 ARG H . 27634 1 1363 . 1 1 113 113 ARG HA H 1 3.391 0.006 . 1 . . . . . 379 ARG HA . 27634 1 1364 . 1 1 113 113 ARG HB2 H 1 1.573 0.005 . 2 . . . . . 379 ARG HB2 . 27634 1 1365 . 1 1 113 113 ARG HB3 H 1 1.573 0.005 . 2 . . . . . 379 ARG HB3 . 27634 1 1366 . 1 1 113 113 ARG HG2 H 1 1.108 . . 2 . . . . . 379 ARG HG2 . 27634 1 1367 . 1 1 113 113 ARG HG3 H 1 1.108 . . 2 . . . . . 379 ARG HG3 . 27634 1 1368 . 1 1 113 113 ARG HD2 H 1 2.922 0.005 . 2 . . . . . 379 ARG HD2 . 27634 1 1369 . 1 1 113 113 ARG HD3 H 1 2.922 0.005 . 2 . . . . . 379 ARG HD3 . 27634 1 1370 . 1 1 113 113 ARG HE H 1 7.259 . . 1 . . . . . 379 ARG HE . 27634 1 1371 . 1 1 113 113 ARG C C 13 177.013 0.002 . 1 . . . . . 379 ARG C . 27634 1 1372 . 1 1 113 113 ARG CA C 13 60.442 0.025 . 1 . . . . . 379 ARG CA . 27634 1 1373 . 1 1 113 113 ARG CB C 13 30.009 0.1 . 1 . . . . . 379 ARG CB . 27634 1 1374 . 1 1 113 113 ARG CG C 13 26.607 . . 1 . . . . . 379 ARG CG . 27634 1 1375 . 1 1 113 113 ARG CD C 13 43.573 . . 1 . . . . . 379 ARG CD . 27634 1 1376 . 1 1 113 113 ARG N N 15 119.677 0.01 . 1 . . . . . 379 ARG N . 27634 1 1377 . 1 1 113 113 ARG NE N 15 83.319 . . 1 . . . . . 379 ARG NE . 27634 1 1378 . 1 1 114 114 ARG H H 1 7.403 0.007 . 1 . . . . . 380 ARG H . 27634 1 1379 . 1 1 114 114 ARG HA H 1 3.853 0.015 . 1 . . . . . 380 ARG HA . 27634 1 1380 . 1 1 114 114 ARG HB2 H 1 1.934 0.014 . 2 . . . . . 380 ARG HB2 . 27634 1 1381 . 1 1 114 114 ARG HB3 H 1 1.934 0.014 . 2 . . . . . 380 ARG HB3 . 27634 1 1382 . 1 1 114 114 ARG HG2 H 1 1.743 0.011 . 2 . . . . . 380 ARG HG2 . 27634 1 1383 . 1 1 114 114 ARG HG3 H 1 1.543 0.017 . 2 . . . . . 380 ARG HG3 . 27634 1 1384 . 1 1 114 114 ARG HD2 H 1 3.228 0.011 . 2 . . . . . 380 ARG HD2 . 27634 1 1385 . 1 1 114 114 ARG HD3 H 1 3.228 0.011 . 2 . . . . . 380 ARG HD3 . 27634 1 1386 . 1 1 114 114 ARG HE H 1 7.316 . . 1 . . . . . 380 ARG HE . 27634 1 1387 . 1 1 114 114 ARG C C 13 178.782 0.004 . 1 . . . . . 380 ARG C . 27634 1 1388 . 1 1 114 114 ARG CA C 13 59.495 0.03 . 1 . . . . . 380 ARG CA . 27634 1 1389 . 1 1 114 114 ARG CB C 13 30.052 0.029 . 1 . . . . . 380 ARG CB . 27634 1 1390 . 1 1 114 114 ARG CG C 13 27.591 . . 1 . . . . . 380 ARG CG . 27634 1 1391 . 1 1 114 114 ARG CD C 13 43.477 . . 1 . . . . . 380 ARG CD . 27634 1 1392 . 1 1 114 114 ARG N N 15 115.658 0.004 . 1 . . . . . 380 ARG N . 27634 1 1393 . 1 1 114 114 ARG NE N 15 84.572 . . 1 . . . . . 380 ARG NE . 27634 1 1394 . 1 1 115 115 GLU H H 1 7.516 0.006 . 1 . . . . . 381 GLU H . 27634 1 1395 . 1 1 115 115 GLU HA H 1 4.1 0.006 . 1 . . . . . 381 GLU HA . 27634 1 1396 . 1 1 115 115 GLU HB2 H 1 2.262 0.006 . 2 . . . . . 381 GLU HB2 . 27634 1 1397 . 1 1 115 115 GLU HB3 H 1 2.262 0.006 . 2 . . . . . 381 GLU HB3 . 27634 1 1398 . 1 1 115 115 GLU HG2 H 1 2.499 0.004 . 1 . . . . . 381 GLU HG2 . 27634 1 1399 . 1 1 115 115 GLU HG3 H 1 2.499 0.004 . 1 . . . . . 381 GLU HG3 . 27634 1 1400 . 1 1 115 115 GLU C C 13 179.194 0.002 . 1 . . . . . 381 GLU C . 27634 1 1401 . 1 1 115 115 GLU CA C 13 59.069 0.058 . 1 . . . . . 381 GLU CA . 27634 1 1402 . 1 1 115 115 GLU CB C 13 29.7 0.028 . 1 . . . . . 381 GLU CB . 27634 1 1403 . 1 1 115 115 GLU CG C 13 35.88 . . 1 . . . . . 381 GLU CG . 27634 1 1404 . 1 1 115 115 GLU N N 15 119.267 0.002 . 1 . . . . . 381 GLU N . 27634 1 1405 . 1 1 116 116 ILE H H 1 8.336 0.014 . 1 . . . . . 382 ILE H . 27634 1 1406 . 1 1 116 116 ILE HA H 1 4.28 0.018 . 1 . . . . . 382 ILE HA . 27634 1 1407 . 1 1 116 116 ILE HB H 1 1.817 0.009 . 1 . . . . . 382 ILE HB . 27634 1 1408 . 1 1 116 116 ILE HG12 H 1 0.867 0.016 . 2 . . . . . 382 ILE HG12 . 27634 1 1409 . 1 1 116 116 ILE HG13 H 1 0.867 0.016 . 2 . . . . . 382 ILE HG13 . 27634 1 1410 . 1 1 116 116 ILE HG21 H 1 0.752 0.012 . 1 . . . . . 382 ILE HG21 . 27634 1 1411 . 1 1 116 116 ILE HG22 H 1 0.752 0.012 . 1 . . . . . 382 ILE HG22 . 27634 1 1412 . 1 1 116 116 ILE HG23 H 1 0.752 0.012 . 1 . . . . . 382 ILE HG23 . 27634 1 1413 . 1 1 116 116 ILE HD11 H 1 0.443 0.004 . 1 . . . . . 382 ILE HD11 . 27634 1 1414 . 1 1 116 116 ILE HD12 H 1 0.443 0.004 . 1 . . . . . 382 ILE HD12 . 27634 1 1415 . 1 1 116 116 ILE HD13 H 1 0.443 0.004 . 1 . . . . . 382 ILE HD11 . 27634 1 1416 . 1 1 116 116 ILE C C 13 177.894 0.002 . 1 . . . . . 382 ILE C . 27634 1 1417 . 1 1 116 116 ILE CA C 13 65.361 0.041 . 1 . . . . . 382 ILE CA . 27634 1 1418 . 1 1 116 116 ILE CB C 13 38.051 0.119 . 1 . . . . . 382 ILE CB . 27634 1 1419 . 1 1 116 116 ILE CG1 C 13 28.889 . . 1 . . . . . 382 ILE CG1 . 27634 1 1420 . 1 1 116 116 ILE CG2 C 13 16.888 . . 1 . . . . . 382 ILE CG2 . 27634 1 1421 . 1 1 116 116 ILE CD1 C 13 15.96 . . 1 . . . . . 382 ILE CD1 . 27634 1 1422 . 1 1 116 116 ILE N N 15 122.496 0.014 . 1 . . . . . 382 ILE N . 27634 1 1423 . 1 1 117 117 ILE H H 1 8.059 0.007 . 1 . . . . . 383 ILE H . 27634 1 1424 . 1 1 117 117 ILE HA H 1 3.612 0.005 . 1 . . . . . 383 ILE HA . 27634 1 1425 . 1 1 117 117 ILE HB H 1 1.807 0.022 . 1 . . . . . 383 ILE HB . 27634 1 1426 . 1 1 117 117 ILE HG12 H 1 0.879 . . 2 . . . . . 383 ILE HG12 . 27634 1 1427 . 1 1 117 117 ILE HG13 H 1 0.882 0.004 . 2 . . . . . 383 ILE HG13 . 27634 1 1428 . 1 1 117 117 ILE HG21 H 1 0.863 . . 1 . . . . . 383 ILE HG21 . 27634 1 1429 . 1 1 117 117 ILE HG22 H 1 0.863 . . 1 . . . . . 383 ILE HG22 . 27634 1 1430 . 1 1 117 117 ILE HG23 H 1 0.863 . . 1 . . . . . 383 ILE HG23 . 27634 1 1431 . 1 1 117 117 ILE HD11 H 1 0.879 . . 1 . . . . . 383 ILE HD11 . 27634 1 1432 . 1 1 117 117 ILE HD12 H 1 0.879 . . 1 . . . . . 383 ILE HD12 . 27634 1 1433 . 1 1 117 117 ILE HD13 H 1 0.879 . . 1 . . . . . 383 ILE HD13 . 27634 1 1434 . 1 1 117 117 ILE C C 13 179.389 0 . 1 . . . . . 383 ILE C . 27634 1 1435 . 1 1 117 117 ILE CA C 13 64.892 0.088 . 1 . . . . . 383 ILE CA . 27634 1 1436 . 1 1 117 117 ILE CB C 13 37.781 0.029 . 1 . . . . . 383 ILE CB . 27634 1 1437 . 1 1 117 117 ILE CG1 C 13 28.889 . . 1 . . . . . 383 ILE CG1 . 27634 1 1438 . 1 1 117 117 ILE CG2 C 13 17.703 . . 1 . . . . . 383 ILE CG2 . 27634 1 1439 . 1 1 117 117 ILE CD1 C 13 12.835 . . 1 . . . . . 383 ILE CD1 . 27634 1 1440 . 1 1 117 117 ILE N N 15 119.536 0.002 . 1 . . . . . 383 ILE N . 27634 1 1441 . 1 1 118 118 ARG H H 1 8.07 0.007 . 1 . . . . . 384 ARG H . 27634 1 1442 . 1 1 118 118 ARG HA H 1 4.112 0.009 . 1 . . . . . 384 ARG HA . 27634 1 1443 . 1 1 118 118 ARG HB2 H 1 1.927 0.007 . 2 . . . . . 384 ARG HB2 . 27634 1 1444 . 1 1 118 118 ARG HB3 H 1 1.927 0.007 . 2 . . . . . 384 ARG HB3 . 27634 1 1445 . 1 1 118 118 ARG HG2 H 1 1.765 0.005 . 2 . . . . . 384 ARG HG2 . 27634 1 1446 . 1 1 118 118 ARG HG3 H 1 1.678 0.017 . 2 . . . . . 384 ARG HG3 . 27634 1 1447 . 1 1 118 118 ARG HD2 H 1 3.197 0.011 . 2 . . . . . 384 ARG HD2 . 27634 1 1448 . 1 1 118 118 ARG HD3 H 1 3.197 0.011 . 2 . . . . . 384 ARG HD3 . 27634 1 1449 . 1 1 118 118 ARG HE H 1 7.545 . . 1 . . . . . 384 ARG HE . 27634 1 1450 . 1 1 118 118 ARG C C 13 178.855 0.003 . 1 . . . . . 384 ARG C . 27634 1 1451 . 1 1 118 118 ARG CA C 13 58.973 0.065 . 1 . . . . . 384 ARG CA . 27634 1 1452 . 1 1 118 118 ARG CB C 13 30.258 0.04 . 1 . . . . . 384 ARG CB . 27634 1 1453 . 1 1 118 118 ARG CG C 13 27.304 . . 1 . . . . . 384 ARG CG . 27634 1 1454 . 1 1 118 118 ARG CD C 13 43.513 . . 1 . . . . . 384 ARG CD . 27634 1 1455 . 1 1 118 118 ARG N N 15 119.49 0.011 . 1 . . . . . 384 ARG N . 27634 1 1456 . 1 1 118 118 ARG NE N 15 83.811 . . 1 . . . . . 384 ARG NE . 27634 1 1457 . 1 1 119 119 SER H H 1 7.894 0.003 . 1 . . . . . 385 SER H . 27634 1 1458 . 1 1 119 119 SER HA H 1 4.346 0.01 . 1 . . . . . 385 SER HA . 27634 1 1459 . 1 1 119 119 SER HB2 H 1 4.131 0.012 . 2 . . . . . 385 SER HB2 . 27634 1 1460 . 1 1 119 119 SER HB3 H 1 4.131 0.012 . 2 . . . . . 385 SER HB3 . 27634 1 1461 . 1 1 119 119 SER C C 13 175.641 . . 1 . . . . . 385 SER C . 27634 1 1462 . 1 1 119 119 SER CA C 13 60.68 0.03 . 1 . . . . . 385 SER CA . 27634 1 1463 . 1 1 119 119 SER CB C 13 63.88 0.042 . 1 . . . . . 385 SER CB . 27634 1 1464 . 1 1 119 119 SER N N 15 114.279 0.001 . 1 . . . . . 385 SER N . 27634 1 1465 . 1 1 120 120 ALA H H 1 7.813 0.002 . 1 . . . . . 386 ALA H . 27634 1 1466 . 1 1 120 120 ALA HA H 1 4.311 0.009 . 1 . . . . . 386 ALA HA . 27634 1 1467 . 1 1 120 120 ALA HB1 H 1 1.509 0.012 . 1 . . . . . 386 ALA HB1 . 27634 1 1468 . 1 1 120 120 ALA HB2 H 1 1.509 0.012 . 1 . . . . . 386 ALA HB2 . 27634 1 1469 . 1 1 120 120 ALA HB3 H 1 1.509 0.012 . 1 . . . . . 386 ALA HB3 . 27634 1 1470 . 1 1 120 120 ALA C C 13 177.698 0.01 . 1 . . . . . 386 ALA C . 27634 1 1471 . 1 1 120 120 ALA CA C 13 53.222 0.018 . 1 . . . . . 386 ALA CA . 27634 1 1472 . 1 1 120 120 ALA CB C 13 19.337 0.073 . 1 . . . . . 386 ALA CB . 27634 1 1473 . 1 1 120 120 ALA N N 15 122.574 0.003 . 1 . . . . . 386 ALA N . 27634 1 1474 . 1 1 121 121 ALA H H 1 7.685 0.002 . 1 . . . . . 387 ALA H . 27634 1 1475 . 1 1 121 121 ALA HA H 1 4.408 0.007 . 1 . . . . . 387 ALA HA . 27634 1 1476 . 1 1 121 121 ALA HB1 H 1 1.493 0.012 . 1 . . . . . 387 ALA HB1 . 27634 1 1477 . 1 1 121 121 ALA HB2 H 1 1.493 0.012 . 1 . . . . . 387 ALA HB2 . 27634 1 1478 . 1 1 121 121 ALA HB3 H 1 1.493 0.012 . 1 . . . . . 387 ALA HB3 . 27634 1 1479 . 1 1 121 121 ALA C C 13 176.899 0.001 . 1 . . . . . 387 ALA C . 27634 1 1480 . 1 1 121 121 ALA CA C 13 52.503 0.027 . 1 . . . . . 387 ALA CA . 27634 1 1481 . 1 1 121 121 ALA CB C 13 19.282 0.005 . 1 . . . . . 387 ALA CB . 27634 1 1482 . 1 1 121 121 ALA N N 15 121.047 0.006 . 1 . . . . . 387 ALA N . 27634 1 1483 . 1 1 122 122 GLN H H 1 7.804 0.002 . 1 . . . . . 388 GLN H . 27634 1 1484 . 1 1 122 122 GLN HA H 1 4.174 0.005 . 1 . . . . . 388 GLN HA . 27634 1 1485 . 1 1 122 122 GLN HB2 H 1 2.013 0.017 . 2 . . . . . 388 GLN HB2 . 27634 1 1486 . 1 1 122 122 GLN HB3 H 1 2.174 0.008 . 2 . . . . . 388 GLN HB3 . 27634 1 1487 . 1 1 122 122 GLN HG2 H 1 2.423 0.007 . 2 . . . . . 388 GLN HG2 . 27634 1 1488 . 1 1 122 122 GLN HG3 H 1 2.423 0.007 . 2 . . . . . 388 GLN HG3 . 27634 1 1489 . 1 1 122 122 GLN HE21 H 1 7.626 . . 2 . . . . . 388 GLN HE21 . 27634 1 1490 . 1 1 122 122 GLN HE22 H 1 7.012 . . 2 . . . . . 388 GLN HE22 . 27634 1 1491 . 1 1 122 122 GLN C C 13 180.882 . . 1 . . . . . 388 GLN C . 27634 1 1492 . 1 1 122 122 GLN CA C 13 57.49 0.012 . 1 . . . . . 388 GLN CA . 27634 1 1493 . 1 1 122 122 GLN CB C 13 30.384 . . 1 . . . . . 388 GLN CB . 27634 1 1494 . 1 1 122 122 GLN N N 15 124.25 0.002 . 1 . . . . . 388 GLN N . 27634 1 1495 . 1 1 122 122 GLN NE2 N 15 112.849 0.006 . 1 . . . . . 388 GLN NE2 . 27634 1 stop_ save_