data_18580 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18580 _Entry.Title ; 1H, 13C, and 15N backbone and side chain resonance assignments of the C-terminal DNA binding and dimerization domain of v-Myc ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2012-07-09 _Entry.Accession_date 2012-07-09 _Entry.Last_release_date 2016-06-09 _Entry.Original_release_date 2016-06-09 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Gonul Kizilsavas . . . . 18580 2 Saurabh Saxena . . . . 18580 3 Szymon Zerko . . . . 18580 4 Wiktor Kozminski . . . . 18580 5 Klaus Bister . . . . 18580 6 Robert Konrat . . . . 18580 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18580 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 418 18580 '15N chemical shifts' 120 18580 '1H chemical shifts' 629 18580 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 3 . . 2016-06-09 2012-07-09 update author 'update residue sequence, etc.' 18580 2 . . 2014-02-19 2012-07-09 update BMRB 'update entry citation' 18580 1 . . 2013-02-08 2012-07-09 original author 'original release' 18580 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18580 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 23179058 _Citation.Full_citation . _Citation.Title ; 1H, 13C, and 15N backbone and side chain resonance assignments of the C-terminal DNA binding and dimerization domain of v-Myc. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 7 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 321 _Citation.Page_last 324 _Citation.Year 2013 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Gonul Kzlsava . . . . 18580 1 2 Saurabh Saxena . . . . 18580 1 3 Szymon erko . . . . 18580 1 4 Wiktor Komiski . . . . 18580 1 5 Klaus Bister . . . . 18580 1 6 Robert Konrat . . . . 18580 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18580 _Assembly.ID 1 _Assembly.Name H6-vMycCterm _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'c-Terminal v-Myc' 1 $c-Terminal_v-Myc A . yes native no no . . . 18580 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_c-Terminal_v-Myc _Entity.Sf_category entity _Entity.Sf_framecode c-Terminal_v-Myc _Entity.Entry_ID 18580 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name c-Terminal_v-Myc _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MKHHHHHHPMSDYDIPTTEN LYFQGAMVSNNRKCSSPRTL DSEENDKRRTHNVLERQRRN ELKLRFFALRDQIPEVANNE KAPKVVILKKATEYVLSLQS DEHKLIAEKEQLRRRREQLK HNLEQLRNSRA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 131 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 -26 MET . 18580 1 2 -25 LYS . 18580 1 3 -24 HIS . 18580 1 4 -23 HIS . 18580 1 5 -22 HIS . 18580 1 6 -21 HIS . 18580 1 7 -20 HIS . 18580 1 8 -19 HIS . 18580 1 9 -18 PRO . 18580 1 10 -17 MET . 18580 1 11 -16 SER . 18580 1 12 -15 ASP . 18580 1 13 -14 TYR . 18580 1 14 -13 ASP . 18580 1 15 -12 ILE . 18580 1 16 -11 PRO . 18580 1 17 -10 THR . 18580 1 18 -9 THR . 18580 1 19 -8 GLU . 18580 1 20 -7 ASN . 18580 1 21 -6 LEU . 18580 1 22 -5 TYR . 18580 1 23 -4 PHE . 18580 1 24 -3 GLN . 18580 1 25 -2 GLY . 18580 1 26 -1 ALA . 18580 1 27 0 MET . 18580 1 28 1 VAL . 18580 1 29 314 SER . 18580 1 30 315 ASN . 18580 1 31 316 ASN . 18580 1 32 317 ARG . 18580 1 33 318 LYS . 18580 1 34 319 CYS . 18580 1 35 320 SER . 18580 1 36 321 SER . 18580 1 37 322 PRO . 18580 1 38 323 ARG . 18580 1 39 324 THR . 18580 1 40 325 LEU . 18580 1 41 326 ASP . 18580 1 42 327 SER . 18580 1 43 328 GLU . 18580 1 44 329 GLU . 18580 1 45 330 ASN . 18580 1 46 331 ASP . 18580 1 47 332 LYS . 18580 1 48 333 ARG . 18580 1 49 334 ARG . 18580 1 50 335 THR . 18580 1 51 336 HIS . 18580 1 52 337 ASN . 18580 1 53 338 VAL . 18580 1 54 339 LEU . 18580 1 55 340 GLU . 18580 1 56 341 ARG . 18580 1 57 342 GLN . 18580 1 58 343 ARG . 18580 1 59 344 ARG . 18580 1 60 345 ASN . 18580 1 61 346 GLU . 18580 1 62 347 LEU . 18580 1 63 348 LYS . 18580 1 64 349 LEU . 18580 1 65 350 ARG . 18580 1 66 351 PHE . 18580 1 67 352 PHE . 18580 1 68 353 ALA . 18580 1 69 354 LEU . 18580 1 70 355 ARG . 18580 1 71 356 ASP . 18580 1 72 357 GLN . 18580 1 73 358 ILE . 18580 1 74 359 PRO . 18580 1 75 360 GLU . 18580 1 76 361 VAL . 18580 1 77 362 ALA . 18580 1 78 363 ASN . 18580 1 79 364 ASN . 18580 1 80 365 GLU . 18580 1 81 366 LYS . 18580 1 82 367 ALA . 18580 1 83 368 PRO . 18580 1 84 369 LYS . 18580 1 85 370 VAL . 18580 1 86 371 VAL . 18580 1 87 372 ILE . 18580 1 88 373 LEU . 18580 1 89 374 LYS . 18580 1 90 375 LYS . 18580 1 91 376 ALA . 18580 1 92 377 THR . 18580 1 93 378 GLU . 18580 1 94 379 TYR . 18580 1 95 380 VAL . 18580 1 96 381 LEU . 18580 1 97 382 SER . 18580 1 98 383 LEU . 18580 1 99 384 GLN . 18580 1 100 385 SER . 18580 1 101 386 ASP . 18580 1 102 387 GLU . 18580 1 103 388 HIS . 18580 1 104 389 LYS . 18580 1 105 390 LEU . 18580 1 106 391 ILE . 18580 1 107 392 ALA . 18580 1 108 393 GLU . 18580 1 109 394 LYS . 18580 1 110 395 GLU . 18580 1 111 396 GLN . 18580 1 112 397 LEU . 18580 1 113 398 ARG . 18580 1 114 399 ARG . 18580 1 115 400 ARG . 18580 1 116 401 ARG . 18580 1 117 402 GLU . 18580 1 118 403 GLN . 18580 1 119 404 LEU . 18580 1 120 405 LYS . 18580 1 121 406 HIS . 18580 1 122 407 ASN . 18580 1 123 408 LEU . 18580 1 124 409 GLU . 18580 1 125 410 GLN . 18580 1 126 411 LEU . 18580 1 127 412 ARG . 18580 1 128 413 ASN . 18580 1 129 414 SER . 18580 1 130 415 ARG . 18580 1 131 416 ALA . 18580 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 18580 1 . LYS 2 2 18580 1 . HIS 3 3 18580 1 . HIS 4 4 18580 1 . HIS 5 5 18580 1 . HIS 6 6 18580 1 . HIS 7 7 18580 1 . HIS 8 8 18580 1 . PRO 9 9 18580 1 . MET 10 10 18580 1 . SER 11 11 18580 1 . ASP 12 12 18580 1 . TYR 13 13 18580 1 . ASP 14 14 18580 1 . ILE 15 15 18580 1 . PRO 16 16 18580 1 . THR 17 17 18580 1 . THR 18 18 18580 1 . GLU 19 19 18580 1 . ASN 20 20 18580 1 . LEU 21 21 18580 1 . TYR 22 22 18580 1 . PHE 23 23 18580 1 . GLN 24 24 18580 1 . GLY 25 25 18580 1 . ALA 26 26 18580 1 . MET 27 27 18580 1 . VAL 28 28 18580 1 . SER 29 29 18580 1 . ASN 30 30 18580 1 . ASN 31 31 18580 1 . ARG 32 32 18580 1 . LYS 33 33 18580 1 . CYS 34 34 18580 1 . SER 35 35 18580 1 . SER 36 36 18580 1 . PRO 37 37 18580 1 . ARG 38 38 18580 1 . THR 39 39 18580 1 . LEU 40 40 18580 1 . ASP 41 41 18580 1 . SER 42 42 18580 1 . GLU 43 43 18580 1 . GLU 44 44 18580 1 . ASN 45 45 18580 1 . ASP 46 46 18580 1 . LYS 47 47 18580 1 . ARG 48 48 18580 1 . ARG 49 49 18580 1 . THR 50 50 18580 1 . HIS 51 51 18580 1 . ASN 52 52 18580 1 . VAL 53 53 18580 1 . LEU 54 54 18580 1 . GLU 55 55 18580 1 . ARG 56 56 18580 1 . GLN 57 57 18580 1 . ARG 58 58 18580 1 . ARG 59 59 18580 1 . ASN 60 60 18580 1 . GLU 61 61 18580 1 . LEU 62 62 18580 1 . LYS 63 63 18580 1 . LEU 64 64 18580 1 . ARG 65 65 18580 1 . PHE 66 66 18580 1 . PHE 67 67 18580 1 . ALA 68 68 18580 1 . LEU 69 69 18580 1 . ARG 70 70 18580 1 . ASP 71 71 18580 1 . GLN 72 72 18580 1 . ILE 73 73 18580 1 . PRO 74 74 18580 1 . GLU 75 75 18580 1 . VAL 76 76 18580 1 . ALA 77 77 18580 1 . ASN 78 78 18580 1 . ASN 79 79 18580 1 . GLU 80 80 18580 1 . LYS 81 81 18580 1 . ALA 82 82 18580 1 . PRO 83 83 18580 1 . LYS 84 84 18580 1 . VAL 85 85 18580 1 . VAL 86 86 18580 1 . ILE 87 87 18580 1 . LEU 88 88 18580 1 . LYS 89 89 18580 1 . LYS 90 90 18580 1 . ALA 91 91 18580 1 . THR 92 92 18580 1 . GLU 93 93 18580 1 . TYR 94 94 18580 1 . VAL 95 95 18580 1 . LEU 96 96 18580 1 . SER 97 97 18580 1 . LEU 98 98 18580 1 . GLN 99 99 18580 1 . SER 100 100 18580 1 . ASP 101 101 18580 1 . GLU 102 102 18580 1 . HIS 103 103 18580 1 . LYS 104 104 18580 1 . LEU 105 105 18580 1 . ILE 106 106 18580 1 . ALA 107 107 18580 1 . GLU 108 108 18580 1 . LYS 109 109 18580 1 . GLU 110 110 18580 1 . GLN 111 111 18580 1 . LEU 112 112 18580 1 . ARG 113 113 18580 1 . ARG 114 114 18580 1 . ARG 115 115 18580 1 . ARG 116 116 18580 1 . GLU 117 117 18580 1 . GLN 118 118 18580 1 . LEU 119 119 18580 1 . LYS 120 120 18580 1 . HIS 121 121 18580 1 . ASN 122 122 18580 1 . LEU 123 123 18580 1 . GLU 124 124 18580 1 . GLN 125 125 18580 1 . LEU 126 126 18580 1 . ARG 127 127 18580 1 . ASN 128 128 18580 1 . SER 129 129 18580 1 . ARG 130 130 18580 1 . ALA 131 131 18580 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 18580 _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 $c-Terminal_v-Myc . . virus . 'Myelocytomatosis virus' . . . . . Myelocytomatosis virus . . . . . . . . . . . . . 18580 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 18580 _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 $c-Terminal_v-Myc . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . petM11 . . . 18580 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18580 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'c-Terminal v-Myc' '[U-95% 13C; U-90% 15N]' . . 1 $c-Terminal_v-Myc . . 0.7 . . mM . . . . 18580 1 2 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 18580 1 3 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 18580 1 4 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 18580 1 5 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 18580 1 6 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18580 1 7 D2O 'natural abundance' . . . . . . 10 . . % . . . . 18580 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 18580 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 120 . mM 18580 1 pH 6.6 . pH 18580 1 pressure 1 . atm 18580 1 temperature 273 . K 18580 1 stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 18580 _Software.ID 1 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 18580 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 18580 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 18580 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Agilent _NMR_spectrometer.Model 'Direct Drive' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 18580 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Agilent 'Direct Drive' . 700 . . . 18580 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 18580 _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 '5D HN(CA)CONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18580 1 2 '5D (HACA)CON(CA)CONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18580 1 3 '5D (H)NCO(NCA)CONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18580 1 4 '5D HNCACOCB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18580 1 5 '5D HabCabCONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18580 1 6 '5D H(CC-tocsy)CONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18580 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 18580 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 18580 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 18580 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 18580 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 18580 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '5D HN(CA)CONH' . . . 18580 1 2 '5D (HACA)CON(CA)CONH' . . . 18580 1 3 '5D (H)NCO(NCA)CONH' . . . 18580 1 4 '5D HNCACOCB' . . . 18580 1 5 '5D HabCabCONH' . . . 18580 1 6 '5D H(CC-tocsy)CONH' . . . 18580 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 8 8 HIS C C 13 172.92 0.3 . 1 . . . . -19 HIS CO . 18580 1 2 . 1 1 9 9 PRO HA H 1 4.391 0.02 . 1 . . . . -18 PRO HA . 18580 1 3 . 1 1 9 9 PRO HB2 H 1 2.288 0.02 . 2 . . . . -18 PRO HB2 . 18580 1 4 . 1 1 9 9 PRO HB3 H 1 1.935 0.02 . 2 . . . . -18 PRO HB3 . 18580 1 5 . 1 1 9 9 PRO HG2 H 1 1.954 0.02 . 1 . . . . -18 PRO HG . 18580 1 6 . 1 1 9 9 PRO HG3 H 1 1.954 0.02 . 1 . . . . -18 PRO HG . 18580 1 7 . 1 1 9 9 PRO C C 13 177.04 0.3 . 1 . . . . -18 PRO CO . 18580 1 8 . 1 1 9 9 PRO CA C 13 63.44 0.3 . 1 . . . . -18 PRO CA . 18580 1 9 . 1 1 9 9 PRO CB C 13 32.19 0.3 . 1 . . . . -18 PRO CB . 18580 1 10 . 1 1 9 9 PRO CG C 13 27.489 0.3 . 1 . . . . -18 PRO CG . 18580 1 11 . 1 1 9 9 PRO N N 15 108.89 0.3 . 1 . . . . -18 PRO N . 18580 1 12 . 1 1 10 10 MET H H 1 8.71 0.02 . 1 . . . . -17 MET H . 18580 1 13 . 1 1 10 10 MET HA H 1 4.495 0.02 . 1 . . . . -17 MET HA . 18580 1 14 . 1 1 10 10 MET HB2 H 1 2.584 0.02 . 1 . . . . -17 MET HB . 18580 1 15 . 1 1 10 10 MET HB3 H 1 2.584 0.02 . 1 . . . . -17 MET HB . 18580 1 16 . 1 1 10 10 MET C C 13 176.42 0.3 . 1 . . . . -17 MET CO . 18580 1 17 . 1 1 10 10 MET CA C 13 55.72 0.3 . 1 . . . . -17 MET CA . 18580 1 18 . 1 1 10 10 MET CB C 13 32.86 0.3 . 1 . . . . -17 MET CB . 18580 1 19 . 1 1 10 10 MET N N 15 120.45 0.3 . 1 . . . . -17 MET N . 18580 1 20 . 1 1 11 11 SER H H 1 8.27 0.02 . 1 . . . . -16 SER H . 18580 1 21 . 1 1 11 11 SER HA H 1 4.431 0.02 . 1 . . . . -16 SER HA . 18580 1 22 . 1 1 11 11 SER HB2 H 1 3.846 0.02 . 2 . . . . -16 SER HB2 . 18580 1 23 . 1 1 11 11 SER HB3 H 1 3.767 0.02 . 2 . . . . -16 SER HB3 . 18580 1 24 . 1 1 11 11 SER C C 13 174.33 0.3 . 1 . . . . -16 SER CO . 18580 1 25 . 1 1 11 11 SER CA C 13 58.41 0.3 . 1 . . . . -16 SER CA . 18580 1 26 . 1 1 11 11 SER CB C 13 64.07 0.3 . 1 . . . . -16 SER CB . 18580 1 27 . 1 1 11 11 SER N N 15 116.16 0.3 . 1 . . . . -16 SER N . 18580 1 28 . 1 1 12 12 ASP H H 1 8.32 0.02 . 1 . . . . -15 ASP H . 18580 1 29 . 1 1 12 12 ASP HA H 1 4.521 0.02 . 1 . . . . -15 ASP HA . 18580 1 30 . 1 1 12 12 ASP HB2 H 1 2.566 0.02 . 2 . . . . -15 ASP HB2 . 18580 1 31 . 1 1 12 12 ASP HB3 H 1 2.46 0.02 . 2 . . . . -15 ASP HB3 . 18580 1 32 . 1 1 12 12 ASP C C 13 175.87 0.3 . 1 . . . . -15 ASP CO . 18580 1 33 . 1 1 12 12 ASP CA C 13 54.83 0.3 . 1 . . . . -15 ASP CA . 18580 1 34 . 1 1 12 12 ASP CB C 13 40.9 0.3 . 1 . . . . -15 ASP CB . 18580 1 35 . 1 1 12 12 ASP N N 15 121.93 0.3 . 1 . . . . -15 ASP N . 18580 1 36 . 1 1 13 13 TYR H H 1 7.9 0.02 . 1 . . . . -14 TYR H . 18580 1 37 . 1 1 13 13 TYR HA H 1 4.528 0.02 . 1 . . . . -14 TYR HA . 18580 1 38 . 1 1 13 13 TYR HB2 H 1 3.057 0.02 . 2 . . . . -14 TYR HB2 . 18580 1 39 . 1 1 13 13 TYR HB3 H 1 2.87 0.02 . 2 . . . . -14 TYR HB3 . 18580 1 40 . 1 1 13 13 TYR C C 13 175.3 0.3 . 1 . . . . -14 TYR CO . 18580 1 41 . 1 1 13 13 TYR CA C 13 57.69 0.3 . 1 . . . . -14 TYR CA . 18580 1 42 . 1 1 13 13 TYR CB C 13 38.89 0.3 . 1 . . . . -14 TYR CB . 18580 1 43 . 1 1 13 13 TYR N N 15 118.81 0.3 . 1 . . . . -14 TYR N . 18580 1 44 . 1 1 14 14 ASP H H 1 8.13 0.02 . 1 . . . . -13 ASP H . 18580 1 45 . 1 1 14 14 ASP HA H 1 4.598 0.02 . 1 . . . . -13 ASP HA . 18580 1 46 . 1 1 14 14 ASP HB2 H 1 2.648 0.02 . 2 . . . . -13 ASP HB2 . 18580 1 47 . 1 1 14 14 ASP HB3 H 1 2.549 0.02 . 2 . . . . -13 ASP HB3 . 18580 1 48 . 1 1 14 14 ASP C C 13 175.45 0.3 . 1 . . . . -13 ASP CO . 18580 1 49 . 1 1 14 14 ASP CA C 13 54.22 0.3 . 1 . . . . -13 ASP CA . 18580 1 50 . 1 1 14 14 ASP CB C 13 41.32 0.3 . 1 . . . . -13 ASP CB . 18580 1 51 . 1 1 14 14 ASP N N 15 121.61 0.3 . 1 . . . . -13 ASP N . 18580 1 52 . 1 1 15 15 ILE H H 1 7.92 0.02 . 1 . . . . -12 ILE H . 18580 1 53 . 1 1 15 15 ILE C C 13 174.61 0.3 . 1 . . . . -12 ILE CO . 18580 1 54 . 1 1 15 15 ILE N N 15 122.18 0.3 . 1 . . . . -12 ILE N . 18580 1 55 . 1 1 16 16 PRO HA H 1 4.493 0.02 . 1 . . . . -11 PRO HA . 18580 1 56 . 1 1 16 16 PRO HB2 H 1 2.272 0.02 . 2 . . . . -11 PRO HB2 . 18580 1 57 . 1 1 16 16 PRO HB3 H 1 1.914 0.02 . 2 . . . . -11 PRO HB3 . 18580 1 58 . 1 1 16 16 PRO HG2 H 1 1.979 0.02 . 1 . . . . -11 PRO HG . 18580 1 59 . 1 1 16 16 PRO HG3 H 1 1.979 0.02 . 1 . . . . -11 PRO HG . 18580 1 60 . 1 1 16 16 PRO C C 13 177.16 0.3 . 1 . . . . -11 PRO CO . 18580 1 61 . 1 1 16 16 PRO CA C 13 63.31 0.3 . 1 . . . . -11 PRO CA . 18580 1 62 . 1 1 16 16 PRO CB C 13 32.19 0.3 . 1 . . . . -11 PRO CB . 18580 1 63 . 1 1 16 16 PRO CG C 13 27.534 0.3 . 1 . . . . -11 PRO CG . 18580 1 64 . 1 1 16 16 PRO N N 15 111.5 0.3 . 1 . . . . -11 PRO N . 18580 1 65 . 1 1 17 17 THR H H 1 8.28 0.02 . 1 . . . . -10 THR H . 18580 1 66 . 1 1 17 17 THR HA H 1 4.386 0.02 . 1 . . . . -10 THR HA . 18580 1 67 . 1 1 17 17 THR HB H 1 4.287 0.02 . 1 . . . . -10 THR HB . 18580 1 68 . 1 1 17 17 THR HG21 H 1 1.22 0.02 . 1 . . . . -10 THR HG2 . 18580 1 69 . 1 1 17 17 THR HG22 H 1 1.22 0.02 . 1 . . . . -10 THR HG2 . 18580 1 70 . 1 1 17 17 THR HG23 H 1 1.22 0.02 . 1 . . . . -10 THR HG2 . 18580 1 71 . 1 1 17 17 THR C C 13 175.0 0.3 . 1 . . . . -10 THR CO . 18580 1 72 . 1 1 17 17 THR CA C 13 61.89 0.3 . 1 . . . . -10 THR CA . 18580 1 73 . 1 1 17 17 THR CB C 13 69.87 0.3 . 1 . . . . -10 THR CB . 18580 1 74 . 1 1 17 17 THR CG2 C 13 21.56 0.3 . 1 . . . . -10 THR CG . 18580 1 75 . 1 1 17 17 THR N N 15 114.44 0.3 . 1 . . . . -10 THR N . 18580 1 76 . 1 1 18 18 THR H H 1 8.09 0.02 . 1 . . . . -9 THR H . 18580 1 77 . 1 1 18 18 THR HA H 1 4.284 0.02 . 1 . . . . -9 THR HA . 18580 1 78 . 1 1 18 18 THR HB H 1 4.255 0.02 . 1 . . . . -9 THR HB . 18580 1 79 . 1 1 18 18 THR HG21 H 1 1.206 0.02 . 1 . . . . -9 THR HG2 . 18580 1 80 . 1 1 18 18 THR HG22 H 1 1.206 0.02 . 1 . . . . -9 THR HG2 . 18580 1 81 . 1 1 18 18 THR HG23 H 1 1.206 0.02 . 1 . . . . -9 THR HG2 . 18580 1 82 . 1 1 18 18 THR C C 13 174.78 0.3 . 1 . . . . -9 THR CO . 18580 1 83 . 1 1 18 18 THR CA C 13 62.29 0.3 . 1 . . . . -9 THR CA . 18580 1 84 . 1 1 18 18 THR CB C 13 69.67 0.3 . 1 . . . . -9 THR CB . 18580 1 85 . 1 1 18 18 THR CG2 C 13 21.794 0.3 . 1 . . . . -9 THR CG . 18580 1 86 . 1 1 18 18 THR N N 15 115.18 0.3 . 1 . . . . -9 THR N . 18580 1 87 . 1 1 19 19 GLU H H 1 8.38 0.02 . 1 . . . . -8 GLU H . 18580 1 88 . 1 1 19 19 GLU HA H 1 4.236 0.02 . 1 . . . . -8 GLU HA . 18580 1 89 . 1 1 19 19 GLU HB2 H 1 2.031 0.02 . 2 . . . . -8 GLU HB2 . 18580 1 90 . 1 1 19 19 GLU HB3 H 1 1.92 0.02 . 2 . . . . -8 GLU HB3 . 18580 1 91 . 1 1 19 19 GLU HG2 H 1 2.235 0.02 . 1 . . . . -8 GLU HG . 18580 1 92 . 1 1 19 19 GLU HG3 H 1 2.235 0.02 . 1 . . . . -8 GLU HG . 18580 1 93 . 1 1 19 19 GLU C C 13 176.19 0.3 . 1 . . . . -8 GLU CO . 18580 1 94 . 1 1 19 19 GLU CA C 13 57.06 0.3 . 1 . . . . -8 GLU CA . 18580 1 95 . 1 1 19 19 GLU CB C 13 30.29 0.3 . 1 . . . . -8 GLU CB . 18580 1 96 . 1 1 19 19 GLU CG C 13 36.357 0.3 . 1 . . . . -8 GLU CG . 18580 1 97 . 1 1 19 19 GLU N N 15 122.54 0.3 . 1 . . . . -8 GLU N . 18580 1 98 . 1 1 20 20 ASN H H 1 8.34 0.02 . 1 . . . . -7 ASN H . 18580 1 99 . 1 1 20 20 ASN HA H 1 4.641 0.02 . 1 . . . . -7 ASN HA . 18580 1 100 . 1 1 20 20 ASN HB2 H 1 2.757 0.02 . 1 . . . . -7 ASN HB . 18580 1 101 . 1 1 20 20 ASN HB3 H 1 2.757 0.02 . 1 . . . . -7 ASN HB . 18580 1 102 . 1 1 20 20 ASN C C 13 175.19 0.3 . 1 . . . . -7 ASN CO . 18580 1 103 . 1 1 20 20 ASN CA C 13 53.48 0.3 . 1 . . . . -7 ASN CA . 18580 1 104 . 1 1 20 20 ASN CB C 13 38.82 0.3 . 1 . . . . -7 ASN CB . 18580 1 105 . 1 1 20 20 ASN N N 15 119.23 0.3 . 1 . . . . -7 ASN N . 18580 1 106 . 1 1 21 21 LEU H H 1 8.09 0.02 . 1 . . . . -6 LEU H . 18580 1 107 . 1 1 21 21 LEU HA H 1 4.197 0.02 . 1 . . . . -6 LEU HA . 18580 1 108 . 1 1 21 21 LEU HB2 H 1 1.471 0.02 . 2 . . . . -6 LEU HB2 . 18580 1 109 . 1 1 21 21 LEU HB3 H 1 1.337 0.02 . 2 . . . . -6 LEU HB3 . 18580 1 110 . 1 1 21 21 LEU HD11 H 1 0.851 0.02 . 2 . . . . -6 LEU HD1 . 18580 1 111 . 1 1 21 21 LEU HD12 H 1 0.851 0.02 . 2 . . . . -6 LEU HD1 . 18580 1 112 . 1 1 21 21 LEU HD13 H 1 0.851 0.02 . 2 . . . . -6 LEU HD1 . 18580 1 113 . 1 1 21 21 LEU HD21 H 1 0.783 0.02 . 2 . . . . -6 LEU HD2 . 18580 1 114 . 1 1 21 21 LEU HD22 H 1 0.783 0.02 . 2 . . . . -6 LEU HD2 . 18580 1 115 . 1 1 21 21 LEU HD23 H 1 0.783 0.02 . 2 . . . . -6 LEU HD2 . 18580 1 116 . 1 1 21 21 LEU C C 13 177.07 0.3 . 1 . . . . -6 LEU CO . 18580 1 117 . 1 1 21 21 LEU CA C 13 55.66 0.3 . 1 . . . . -6 LEU CA . 18580 1 118 . 1 1 21 21 LEU CB C 13 42.35 0.3 . 1 . . . . -6 LEU CB . 18580 1 119 . 1 1 21 21 LEU CD1 C 13 24.909 0.3 . 2 . . . . -6 LEU CD1 . 18580 1 120 . 1 1 21 21 LEU CD2 C 13 23.418 0.3 . 2 . . . . -6 LEU CD2 . 18580 1 121 . 1 1 21 21 LEU N N 15 122.11 0.3 . 1 . . . . -6 LEU N . 18580 1 122 . 1 1 22 22 TYR H H 1 8.04 0.02 . 1 . . . . -5 TYR H . 18580 1 123 . 1 1 22 22 TYR HA H 1 4.508 0.02 . 1 . . . . -5 TYR HA . 18580 1 124 . 1 1 22 22 TYR HB2 H 1 2.933 0.02 . 2 . . . . -5 TYR HB2 . 18580 1 125 . 1 1 22 22 TYR HB3 H 1 2.848 0.02 . 2 . . . . -5 TYR HB3 . 18580 1 126 . 1 1 22 22 TYR C C 13 175.7 0.3 . 1 . . . . -5 TYR CO . 18580 1 127 . 1 1 22 22 TYR CA C 13 58.03 0.3 . 1 . . . . -5 TYR CA . 18580 1 128 . 1 1 22 22 TYR CB C 13 38.74 0.3 . 1 . . . . -5 TYR CB . 18580 1 129 . 1 1 22 22 TYR N N 15 119.5 0.3 . 1 . . . . -5 TYR N . 18580 1 130 . 1 1 23 23 PHE H H 1 8.03 0.02 . 1 . . . . -4 PHE H . 18580 1 131 . 1 1 23 23 PHE HA H 1 4.551 0.02 . 1 . . . . -4 PHE HA . 18580 1 132 . 1 1 23 23 PHE HB2 H 1 3.078 0.02 . 2 . . . . -4 PHE HB2 . 18580 1 133 . 1 1 23 23 PHE HB3 H 1 3.003 0.02 . 2 . . . . -4 PHE HB3 . 18580 1 134 . 1 1 23 23 PHE C C 13 175.53 0.3 . 1 . . . . -4 PHE CO . 18580 1 135 . 1 1 23 23 PHE CA C 13 57.87 0.3 . 1 . . . . -4 PHE CA . 18580 1 136 . 1 1 23 23 PHE CB C 13 39.7 0.3 . 1 . . . . -4 PHE CB . 18580 1 137 . 1 1 23 23 PHE N N 15 121.15 0.3 . 1 . . . . -4 PHE N . 18580 1 138 . 1 1 24 24 GLN H H 1 8.28 0.02 . 1 . . . . -3 GLN H . 18580 1 139 . 1 1 24 24 GLN HA H 1 4.183 0.02 . 1 . . . . -3 GLN HA . 18580 1 140 . 1 1 24 24 GLN HB2 H 1 2.069 0.02 . 2 . . . . -3 GLN HB2 . 18580 1 141 . 1 1 24 24 GLN HB3 H 1 1.904 0.02 . 2 . . . . -3 GLN HB3 . 18580 1 142 . 1 1 24 24 GLN HG2 H 1 2.236 0.02 . 1 . . . . -3 GLN HG . 18580 1 143 . 1 1 24 24 GLN HG3 H 1 2.236 0.02 . 1 . . . . -3 GLN HG . 18580 1 144 . 1 1 24 24 GLN C C 13 176.19 0.3 . 1 . . . . -3 GLN CO . 18580 1 145 . 1 1 24 24 GLN CA C 13 56.21 0.3 . 1 . . . . -3 GLN CA . 18580 1 146 . 1 1 24 24 GLN CB C 13 29.18 0.3 . 1 . . . . -3 GLN CB . 18580 1 147 . 1 1 24 24 GLN CG C 13 33.833 0.3 . 1 . . . . -3 GLN CG . 18580 1 148 . 1 1 24 24 GLN N N 15 122.22 0.3 . 1 . . . . -3 GLN N . 18580 1 149 . 1 1 25 25 GLY H H 1 7.93 0.02 . 1 . . . . -2 GLY H . 18580 1 150 . 1 1 25 25 GLY HA2 H 1 3.913 0.02 . 2 . . . . -2 GLY HA2 . 18580 1 151 . 1 1 25 25 GLY HA3 H 1 3.832 0.02 . 2 . . . . -2 GLY HA3 . 18580 1 152 . 1 1 25 25 GLY C C 13 173.77 0.3 . 1 . . . . -2 GLY CO . 18580 1 153 . 1 1 25 25 GLY CA C 13 45.44 0.3 . 1 . . . . -2 GLY CA . 18580 1 154 . 1 1 25 25 GLY N N 15 108.94 0.3 . 1 . . . . -2 GLY N . 18580 1 155 . 1 1 26 26 ALA H H 1 8.07 0.02 . 1 . . . . -1 ALA H . 18580 1 156 . 1 1 26 26 ALA HA H 1 4.321 0.02 . 1 . . . . -1 ALA HA . 18580 1 157 . 1 1 26 26 ALA HB1 H 1 1.363 0.02 . 1 . . . . -1 ALA HB . 18580 1 158 . 1 1 26 26 ALA HB2 H 1 1.363 0.02 . 1 . . . . -1 ALA HB . 18580 1 159 . 1 1 26 26 ALA HB3 H 1 1.363 0.02 . 1 . . . . -1 ALA HB . 18580 1 160 . 1 1 26 26 ALA C C 13 177.65 0.3 . 1 . . . . -1 ALA CO . 18580 1 161 . 1 1 26 26 ALA CA C 13 52.51 0.3 . 1 . . . . -1 ALA CA . 18580 1 162 . 1 1 26 26 ALA CB C 13 19.51 0.3 . 1 . . . . -1 ALA CB . 18580 1 163 . 1 1 26 26 ALA N N 15 123.33 0.3 . 1 . . . . -1 ALA N . 18580 1 164 . 1 1 27 27 MET H H 1 8.3 0.02 . 1 . . . . 0 MET H . 18580 1 165 . 1 1 27 27 MET HA H 1 4.437 0.02 . 1 . . . . 0 MET HA . 18580 1 166 . 1 1 27 27 MET HB2 H 1 2.038 0.02 . 1 . . . . 0 MET HB . 18580 1 167 . 1 1 27 27 MET HB3 H 1 2.038 0.02 . 1 . . . . 0 MET HB . 18580 1 168 . 1 1 27 27 MET C C 13 176.31 0.3 . 1 . . . . 0 MET CO . 18580 1 169 . 1 1 27 27 MET CA C 13 55.67 0.3 . 1 . . . . 0 MET CA . 18580 1 170 . 1 1 27 27 MET CB C 13 32.83 0.3 . 1 . . . . 0 MET CB . 18580 1 171 . 1 1 27 27 MET N N 15 119.3 0.3 . 1 . . . . 0 MET N . 18580 1 172 . 1 1 28 28 VAL H H 1 8.07 0.02 . 1 . . . . 1 VAL H . 18580 1 173 . 1 1 28 28 VAL HA H 1 4.133 0.02 . 1 . . . . 1 VAL HA . 18580 1 174 . 1 1 28 28 VAL HB H 1 2.062 0.02 . 1 . . . . 1 VAL HB . 18580 1 175 . 1 1 28 28 VAL HG11 H 1 0.922 0.02 . 1 . . . . 1 VAL HG . 18580 1 176 . 1 1 28 28 VAL HG12 H 1 0.922 0.02 . 1 . . . . 1 VAL HG . 18580 1 177 . 1 1 28 28 VAL HG13 H 1 0.922 0.02 . 1 . . . . 1 VAL HG . 18580 1 178 . 1 1 28 28 VAL HG21 H 1 0.922 0.02 . 1 . . . . 1 VAL HG . 18580 1 179 . 1 1 28 28 VAL HG22 H 1 0.922 0.02 . 1 . . . . 1 VAL HG . 18580 1 180 . 1 1 28 28 VAL HG23 H 1 0.922 0.02 . 1 . . . . 1 VAL HG . 18580 1 181 . 1 1 28 28 VAL C C 13 176.14 0.3 . 1 . . . . 1 VAL CO . 18580 1 182 . 1 1 28 28 VAL CA C 13 62.33 0.3 . 1 . . . . 1 VAL CA . 18580 1 183 . 1 1 28 28 VAL CB C 13 32.84 0.3 . 1 . . . . 1 VAL CB . 18580 1 184 . 1 1 28 28 VAL CG1 C 13 21.213 0.3 . 2 . . . . 1 VAL CG1 . 18580 1 185 . 1 1 28 28 VAL N N 15 121.05 0.3 . 1 . . . . 1 VAL N . 18580 1 186 . 1 1 29 29 SER H H 1 8.33 0.02 . 1 . . . . 314 SER H . 18580 1 187 . 1 1 29 29 SER C C 13 174.44 0.3 . 1 . . . . 314 SER CO . 18580 1 188 . 1 1 29 29 SER N N 15 118.8 0.3 . 1 . . . . 314 SER N . 18580 1 189 . 1 1 30 30 ASN HA H 1 4.701 0.02 . 1 . . . . 315 ASN HA . 18580 1 190 . 1 1 30 30 ASN HB2 H 1 2.798 0.02 . 1 . . . . 315 ASN HB . 18580 1 191 . 1 1 30 30 ASN HB3 H 1 2.798 0.02 . 1 . . . . 315 ASN HB . 18580 1 192 . 1 1 30 30 ASN C C 13 175.02 0.3 . 1 . . . . 315 ASN CO . 18580 1 193 . 1 1 30 30 ASN CA C 13 53.42 0.3 . 1 . . . . 315 ASN CA . 18580 1 194 . 1 1 30 30 ASN CB C 13 38.81 0.3 . 1 . . . . 315 ASN CB . 18580 1 195 . 1 1 30 30 ASN N N 15 120.95 0.3 . 1 . . . . 315 ASN N . 18580 1 196 . 1 1 31 31 ASN H H 1 8.36 0.02 . 1 . . . . 316 ASN H . 18580 1 197 . 1 1 31 31 ASN HA H 1 4.671 0.02 . 1 . . . . 316 ASN HA . 18580 1 198 . 1 1 31 31 ASN HB2 H 1 2.83 0.02 . 2 . . . . 316 ASN HB2 . 18580 1 199 . 1 1 31 31 ASN HB3 H 1 2.755 0.02 . 2 . . . . 316 ASN HB3 . 18580 1 200 . 1 1 31 31 ASN C C 13 175.21 0.3 . 1 . . . . 316 ASN CO . 18580 1 201 . 1 1 31 31 ASN CA C 13 53.44 0.3 . 1 . . . . 316 ASN CA . 18580 1 202 . 1 1 31 31 ASN CB C 13 38.72 0.3 . 1 . . . . 316 ASN CB . 18580 1 203 . 1 1 31 31 ASN N N 15 118.86 0.3 . 1 . . . . 316 ASN N . 18580 1 204 . 1 1 32 32 ARG H H 1 8.2 0.02 . 1 . . . . 317 ARG H . 18580 1 205 . 1 1 32 32 ARG HA H 1 4.299 0.02 . 1 . . . . 317 ARG HA . 18580 1 206 . 1 1 32 32 ARG HB2 H 1 1.856 0.02 . 2 . . . . 317 ARG HB2 . 18580 1 207 . 1 1 32 32 ARG HB3 H 1 1.756 0.02 . 2 . . . . 317 ARG HB3 . 18580 1 208 . 1 1 32 32 ARG HG2 H 1 1.604 0.02 . 1 . . . . 317 ARG HG . 18580 1 209 . 1 1 32 32 ARG HG3 H 1 1.604 0.02 . 1 . . . . 317 ARG HG . 18580 1 210 . 1 1 32 32 ARG C C 13 176.31 0.3 . 1 . . . . 317 ARG CO . 18580 1 211 . 1 1 32 32 ARG CA C 13 56.36 0.3 . 1 . . . . 317 ARG CA . 18580 1 212 . 1 1 32 32 ARG CB C 13 30.7 0.3 . 1 . . . . 317 ARG CB . 18580 1 213 . 1 1 32 32 ARG CG C 13 27.251 0.3 . 1 . . . . 317 ARG CG . 18580 1 214 . 1 1 32 32 ARG N N 15 121.01 0.3 . 1 . . . . 317 ARG N . 18580 1 215 . 1 1 33 33 LYS H H 1 8.32 0.02 . 1 . . . . 318 LYS H . 18580 1 216 . 1 1 33 33 LYS N N 15 122.3 0.3 . 1 . . . . 318 LYS N . 18580 1 217 . 1 1 34 34 CYS H H 1 8.0 0.02 . 1 . . . . 319 CYS H . 18580 1 218 . 1 1 34 34 CYS C C 13 177.11 0.3 . 1 . . . . 319 CYS CO . 18580 1 219 . 1 1 34 34 CYS CA C 13 57.38 0.3 . 1 . . . . 319 CYS CA . 18580 1 220 . 1 1 34 34 CYS CB C 13 32.58 0.3 . 1 . . . . 319 CYS CB . 18580 1 221 . 1 1 34 34 CYS N N 15 120.45 0.3 . 1 . . . . 319 CYS N . 18580 1 222 . 1 1 35 35 SER H H 1 7.94 0.02 . 1 . . . . 320 SER H . 18580 1 223 . 1 1 35 35 SER N N 15 120.81 0.3 . 1 . . . . 320 SER N . 18580 1 224 . 1 1 36 36 SER HA H 1 4.496 0.02 . 1 . . . . 321 SER HA . 18580 1 225 . 1 1 36 36 SER HB2 H 1 3.865 0.02 . 1 . . . . 321 SER HB . 18580 1 226 . 1 1 36 36 SER HB3 H 1 3.865 0.02 . 1 . . . . 321 SER HB . 18580 1 227 . 1 1 36 36 SER C C 13 172.54 0.3 . 1 . . . . 321 SER CO . 18580 1 228 . 1 1 36 36 SER CA C 13 58.354 0.3 . 1 . . . . 321 SER CA . 18580 1 229 . 1 1 36 36 SER CB C 13 63.975 0.3 . 1 . . . . 321 SER CB . 18580 1 230 . 1 1 37 37 PRO HA H 1 4.432 0.02 . 1 . . . . 322 PRO HA . 18580 1 231 . 1 1 37 37 PRO HB2 H 1 2.279 0.02 . 2 . . . . 322 PRO HB2 . 18580 1 232 . 1 1 37 37 PRO HB3 H 1 1.912 0.02 . 2 . . . . 322 PRO HB3 . 18580 1 233 . 1 1 37 37 PRO HG2 H 1 2.007 0.02 . 1 . . . . 322 PRO HG . 18580 1 234 . 1 1 37 37 PRO HG3 H 1 2.007 0.02 . 1 . . . . 322 PRO HG . 18580 1 235 . 1 1 37 37 PRO C C 13 176.85 0.3 . 1 . . . . 322 PRO CO . 18580 1 236 . 1 1 37 37 PRO CA C 13 63.4 0.3 . 1 . . . . 322 PRO CA . 18580 1 237 . 1 1 37 37 PRO CB C 13 32.13 0.3 . 1 . . . . 322 PRO CB . 18580 1 238 . 1 1 37 37 PRO CG C 13 27.374 0.3 . 1 . . . . 322 PRO CG . 18580 1 239 . 1 1 37 37 PRO N N 15 109.76 0.3 . 1 . . . . 322 PRO N . 18580 1 240 . 1 1 38 38 ARG H H 1 8.41 0.02 . 1 . . . . 323 ARG H . 18580 1 241 . 1 1 38 38 ARG HA H 1 4.368 0.02 . 1 . . . . 323 ARG HA . 18580 1 242 . 1 1 38 38 ARG HB2 H 1 1.853 0.02 . 2 . . . . 323 ARG HB2 . 18580 1 243 . 1 1 38 38 ARG HB3 H 1 1.761 0.02 . 2 . . . . 323 ARG HB3 . 18580 1 244 . 1 1 38 38 ARG HG2 H 1 1.65 0.02 . 1 . . . . 323 ARG HG . 18580 1 245 . 1 1 38 38 ARG HG3 H 1 1.65 0.02 . 1 . . . . 323 ARG HG . 18580 1 246 . 1 1 38 38 ARG C C 13 176.56 0.3 . 1 . . . . 323 ARG CO . 18580 1 247 . 1 1 38 38 ARG CA C 13 56.21 0.3 . 1 . . . . 323 ARG CA . 18580 1 248 . 1 1 38 38 ARG CB C 13 30.9 0.3 . 1 . . . . 323 ARG CB . 18580 1 249 . 1 1 38 38 ARG CG C 13 27.105 0.3 . 1 . . . . 323 ARG CG . 18580 1 250 . 1 1 38 38 ARG N N 15 121.21 0.3 . 1 . . . . 323 ARG N . 18580 1 251 . 1 1 39 39 THR H H 1 8.19 0.02 . 1 . . . . 324 THR H . 18580 1 252 . 1 1 39 39 THR HA H 1 4.33 0.02 . 1 . . . . 324 THR HA . 18580 1 253 . 1 1 39 39 THR HB H 1 4.222 0.02 . 1 . . . . 324 THR HB . 18580 1 254 . 1 1 39 39 THR HG21 H 1 1.207 0.02 . 1 . . . . 324 THR HG2 . 18580 1 255 . 1 1 39 39 THR HG22 H 1 1.207 0.02 . 1 . . . . 324 THR HG2 . 18580 1 256 . 1 1 39 39 THR HG23 H 1 1.207 0.02 . 1 . . . . 324 THR HG2 . 18580 1 257 . 1 1 39 39 THR C C 13 174.61 0.3 . 1 . . . . 324 THR CO . 18580 1 258 . 1 1 39 39 THR CA C 13 61.81 0.3 . 1 . . . . 324 THR CA . 18580 1 259 . 1 1 39 39 THR CB C 13 69.93 0.3 . 1 . . . . 324 THR CB . 18580 1 260 . 1 1 39 39 THR CG2 C 13 21.802 0.3 . 1 . . . . 324 THR CG . 18580 1 261 . 1 1 39 39 THR N N 15 115.75 0.3 . 1 . . . . 324 THR N . 18580 1 262 . 1 1 40 40 LEU H H 1 8.35 0.02 . 1 . . . . 325 LEU H . 18580 1 263 . 1 1 40 40 LEU HA H 1 4.348 0.02 . 1 . . . . 325 LEU HA . 18580 1 264 . 1 1 40 40 LEU HB2 H 1 1.613 0.02 . 1 . . . . 325 LEU HB . 18580 1 265 . 1 1 40 40 LEU HB3 H 1 1.613 0.02 . 1 . . . . 325 LEU HB . 18580 1 266 . 1 1 40 40 LEU C C 13 177.27 0.3 . 1 . . . . 325 LEU CO . 18580 1 267 . 1 1 40 40 LEU CA C 13 55.47 0.3 . 1 . . . . 325 LEU CA . 18580 1 268 . 1 1 40 40 LEU CB C 13 42.36 0.3 . 1 . . . . 325 LEU CB . 18580 1 269 . 1 1 40 40 LEU N N 15 124.33 0.3 . 1 . . . . 325 LEU N . 18580 1 270 . 1 1 41 41 ASP H H 1 8.34 0.02 . 1 . . . . 326 ASP H . 18580 1 271 . 1 1 41 41 ASP HA H 1 4.595 0.02 . 1 . . . . 326 ASP HA . 18580 1 272 . 1 1 41 41 ASP HB2 H 1 2.714 0.02 . 2 . . . . 326 ASP HB2 . 18580 1 273 . 1 1 41 41 ASP HB3 H 1 2.635 0.02 . 2 . . . . 326 ASP HB3 . 18580 1 274 . 1 1 41 41 ASP C C 13 176.53 0.3 . 1 . . . . 326 ASP CO . 18580 1 275 . 1 1 41 41 ASP CA C 13 54.7 0.3 . 1 . . . . 326 ASP CA . 18580 1 276 . 1 1 41 41 ASP CB C 13 41.21 0.3 . 1 . . . . 326 ASP CB . 18580 1 277 . 1 1 41 41 ASP N N 15 121.09 0.3 . 1 . . . . 326 ASP N . 18580 1 278 . 1 1 42 42 SER H H 1 8.21 0.02 . 1 . . . . 327 SER H . 18580 1 279 . 1 1 42 42 SER HA H 1 4.377 0.02 . 1 . . . . 327 SER HA . 18580 1 280 . 1 1 42 42 SER HB2 H 1 3.954 0.02 . 2 . . . . 327 SER HB2 . 18580 1 281 . 1 1 42 42 SER HB3 H 1 3.855 0.02 . 2 . . . . 327 SER HB3 . 18580 1 282 . 1 1 42 42 SER C C 13 175.1 0.3 . 1 . . . . 327 SER CO . 18580 1 283 . 1 1 42 42 SER CA C 13 59.04 0.3 . 1 . . . . 327 SER CA . 18580 1 284 . 1 1 42 42 SER CB C 13 63.8 0.3 . 1 . . . . 327 SER CB . 18580 1 285 . 1 1 42 42 SER N N 15 115.89 0.3 . 1 . . . . 327 SER N . 18580 1 286 . 1 1 43 43 GLU H H 1 8.42 0.02 . 1 . . . . 328 GLU H . 18580 1 287 . 1 1 43 43 GLU HA H 1 4.257 0.02 . 1 . . . . 328 GLU HA . 18580 1 288 . 1 1 43 43 GLU HB2 H 1 2.089 0.02 . 2 . . . . 328 GLU HB2 . 18580 1 289 . 1 1 43 43 GLU HB3 H 1 2.001 0.02 . 2 . . . . 328 GLU HB3 . 18580 1 290 . 1 1 43 43 GLU HG2 H 1 2.274 0.02 . 1 . . . . 328 GLU HG . 18580 1 291 . 1 1 43 43 GLU HG3 H 1 2.274 0.02 . 1 . . . . 328 GLU HG . 18580 1 292 . 1 1 43 43 GLU C C 13 177.26 0.3 . 1 . . . . 328 GLU CO . 18580 1 293 . 1 1 43 43 GLU CA C 13 57.44 0.3 . 1 . . . . 328 GLU CA . 18580 1 294 . 1 1 43 43 GLU CB C 13 30.06 0.3 . 1 . . . . 328 GLU CB . 18580 1 295 . 1 1 43 43 GLU CG C 13 36.469 0.3 . 1 . . . . 328 GLU CG . 18580 1 296 . 1 1 43 43 GLU N N 15 122.66 0.3 . 1 . . . . 328 GLU N . 18580 1 297 . 1 1 44 44 GLU H H 1 8.34 0.02 . 1 . . . . 329 GLU H . 18580 1 298 . 1 1 44 44 GLU HA H 1 4.172 0.02 . 1 . . . . 329 GLU HA . 18580 1 299 . 1 1 44 44 GLU HB2 H 1 2.003 0.02 . 1 . . . . 329 GLU HB . 18580 1 300 . 1 1 44 44 GLU HB3 H 1 2.003 0.02 . 1 . . . . 329 GLU HB . 18580 1 301 . 1 1 44 44 GLU HG2 H 1 2.265 0.02 . 1 . . . . 329 GLU HG . 18580 1 302 . 1 1 44 44 GLU HG3 H 1 2.265 0.02 . 1 . . . . 329 GLU HG . 18580 1 303 . 1 1 44 44 GLU C C 13 177.13 0.3 . 1 . . . . 329 GLU CO . 18580 1 304 . 1 1 44 44 GLU CA C 13 57.48 0.3 . 1 . . . . 329 GLU CA . 18580 1 305 . 1 1 44 44 GLU CB C 13 29.9 0.3 . 1 . . . . 329 GLU CB . 18580 1 306 . 1 1 44 44 GLU CG C 13 36.209 0.3 . 1 . . . . 329 GLU CG . 18580 1 307 . 1 1 44 44 GLU N N 15 120.72 0.3 . 1 . . . . 329 GLU N . 18580 1 308 . 1 1 45 45 ASN H H 1 8.31 0.02 . 1 . . . . 330 ASN H . 18580 1 309 . 1 1 45 45 ASN HA H 1 4.601 0.02 . 1 . . . . 330 ASN HA . 18580 1 310 . 1 1 45 45 ASN HB2 H 1 2.81 0.02 . 1 . . . . 330 ASN HB . 18580 1 311 . 1 1 45 45 ASN HB3 H 1 2.81 0.02 . 1 . . . . 330 ASN HB . 18580 1 312 . 1 1 45 45 ASN C C 13 175.81 0.3 . 1 . . . . 330 ASN CO . 18580 1 313 . 1 1 45 45 ASN CA C 13 54.31 0.3 . 1 . . . . 330 ASN CA . 18580 1 314 . 1 1 45 45 ASN CB C 13 38.9 0.3 . 1 . . . . 330 ASN CB . 18580 1 315 . 1 1 45 45 ASN N N 15 118.84 0.3 . 1 . . . . 330 ASN N . 18580 1 316 . 1 1 46 46 ASP H H 1 8.28 0.02 . 1 . . . . 331 ASP H . 18580 1 317 . 1 1 46 46 ASP HA H 1 4.53 0.02 . 1 . . . . 331 ASP HA . 18580 1 318 . 1 1 46 46 ASP HB2 H 1 2.723 0.02 . 1 . . . . 331 ASP HB . 18580 1 319 . 1 1 46 46 ASP HB3 H 1 2.723 0.02 . 1 . . . . 331 ASP HB . 18580 1 320 . 1 1 46 46 ASP C C 13 177.23 0.3 . 1 . . . . 331 ASP CO . 18580 1 321 . 1 1 46 46 ASP CA C 13 55.36 0.3 . 1 . . . . 331 ASP CA . 18580 1 322 . 1 1 46 46 ASP CB C 13 41.0 0.3 . 1 . . . . 331 ASP CB . 18580 1 323 . 1 1 46 46 ASP N N 15 120.55 0.3 . 1 . . . . 331 ASP N . 18580 1 324 . 1 1 47 47 LYS H H 1 8.17 0.02 . 1 . . . . 332 LYS H . 18580 1 325 . 1 1 47 47 LYS HA H 1 4.202 0.02 . 1 . . . . 332 LYS HA . 18580 1 326 . 1 1 47 47 LYS HB2 H 1 1.861 0.02 . 1 . . . . 332 LYS HB . 18580 1 327 . 1 1 47 47 LYS HB3 H 1 1.861 0.02 . 1 . . . . 332 LYS HB . 18580 1 328 . 1 1 47 47 LYS C C 13 177.54 0.3 . 1 . . . . 332 LYS CO . 18580 1 329 . 1 1 47 47 LYS CA C 13 57.48 0.3 . 1 . . . . 332 LYS CA . 18580 1 330 . 1 1 47 47 LYS CB C 13 32.45 0.3 . 1 . . . . 332 LYS CB . 18580 1 331 . 1 1 47 47 LYS N N 15 121.21 0.3 . 1 . . . . 332 LYS N . 18580 1 332 . 1 1 48 48 ARG H H 1 8.11 0.02 . 1 . . . . 333 ARG H . 18580 1 333 . 1 1 48 48 ARG HA H 1 4.225 0.02 . 1 . . . . 333 ARG HA . 18580 1 334 . 1 1 48 48 ARG HB2 H 1 1.871 0.02 . 1 . . . . 333 ARG HB . 18580 1 335 . 1 1 48 48 ARG HB3 H 1 1.871 0.02 . 1 . . . . 333 ARG HB . 18580 1 336 . 1 1 48 48 ARG C C 13 177.0 0.3 . 1 . . . . 333 ARG CO . 18580 1 337 . 1 1 48 48 ARG CA C 13 57.1 0.3 . 1 . . . . 333 ARG CA . 18580 1 338 . 1 1 48 48 ARG CB C 13 30.4 0.3 . 1 . . . . 333 ARG CB . 18580 1 339 . 1 1 48 48 ARG N N 15 119.75 0.3 . 1 . . . . 333 ARG N . 18580 1 340 . 1 1 49 49 ARG H H 1 8.1 0.02 . 1 . . . . 334 ARG H . 18580 1 341 . 1 1 49 49 ARG HA H 1 4.319 0.02 . 1 . . . . 334 ARG HA . 18580 1 342 . 1 1 49 49 ARG HB2 H 1 1.885 0.02 . 2 . . . . 334 ARG HB2 . 18580 1 343 . 1 1 49 49 ARG HB3 H 1 1.859 0.02 . 2 . . . . 334 ARG HB3 . 18580 1 344 . 1 1 49 49 ARG C C 13 176.92 0.3 . 1 . . . . 334 ARG CO . 18580 1 345 . 1 1 49 49 ARG CA C 13 56.92 0.3 . 1 . . . . 334 ARG CA . 18580 1 346 . 1 1 49 49 ARG CB C 13 30.63 0.3 . 1 . . . . 334 ARG CB . 18580 1 347 . 1 1 49 49 ARG N N 15 120.54 0.3 . 1 . . . . 334 ARG N . 18580 1 348 . 1 1 50 50 THR H H 1 8.08 0.02 . 1 . . . . 335 THR H . 18580 1 349 . 1 1 50 50 THR N N 15 114.15 0.3 . 1 . . . . 335 THR N . 18580 1 350 . 1 1 51 51 HIS C C 13 175.2 0.3 . 1 . . . . 336 HIS CO . 18580 1 351 . 1 1 52 52 ASN H H 1 8.41 0.02 . 1 . . . . 337 ASN H . 18580 1 352 . 1 1 52 52 ASN HA H 1 4.651 0.02 . 1 . . . . 337 ASN HA . 18580 1 353 . 1 1 52 52 ASN HB2 H 1 2.82 0.02 . 2 . . . . 337 ASN HB2 . 18580 1 354 . 1 1 52 52 ASN HB3 H 1 2.528 0.02 . 2 . . . . 337 ASN HB3 . 18580 1 355 . 1 1 52 52 ASN C C 13 175.9 0.3 . 1 . . . . 337 ASN CO . 18580 1 356 . 1 1 52 52 ASN CA C 13 53.9 0.3 . 1 . . . . 337 ASN CA . 18580 1 357 . 1 1 52 52 ASN CB C 13 38.74 0.3 . 1 . . . . 337 ASN CB . 18580 1 358 . 1 1 52 52 ASN N N 15 119.93 0.3 . 1 . . . . 337 ASN N . 18580 1 359 . 1 1 53 53 VAL H H 1 8.15 0.02 . 1 . . . . 338 VAL H . 18580 1 360 . 1 1 53 53 VAL HA H 1 3.905 0.02 . 1 . . . . 338 VAL HA . 18580 1 361 . 1 1 53 53 VAL HB H 1 2.125 0.02 . 1 . . . . 338 VAL HB . 18580 1 362 . 1 1 53 53 VAL HG11 H 1 0.952 0.02 . 1 . . . . 338 VAL HG . 18580 1 363 . 1 1 53 53 VAL HG12 H 1 0.952 0.02 . 1 . . . . 338 VAL HG . 18580 1 364 . 1 1 53 53 VAL HG13 H 1 0.952 0.02 . 1 . . . . 338 VAL HG . 18580 1 365 . 1 1 53 53 VAL HG21 H 1 0.952 0.02 . 1 . . . . 338 VAL HG . 18580 1 366 . 1 1 53 53 VAL HG22 H 1 0.952 0.02 . 1 . . . . 338 VAL HG . 18580 1 367 . 1 1 53 53 VAL HG23 H 1 0.952 0.02 . 1 . . . . 338 VAL HG . 18580 1 368 . 1 1 53 53 VAL C C 13 176.96 0.3 . 1 . . . . 338 VAL CO . 18580 1 369 . 1 1 53 53 VAL CA C 13 64.187 0.3 . 1 . . . . 338 VAL CA . 18580 1 370 . 1 1 53 53 VAL CB C 13 32.334 0.3 . 1 . . . . 338 VAL CB . 18580 1 371 . 1 1 53 53 VAL CG1 C 13 21.178 0.3 . 2 . . . . 338 VAL CG1 . 18580 1 372 . 1 1 53 53 VAL N N 15 120.97 0.3 . 1 . . . . 338 VAL N . 18580 1 373 . 1 1 54 54 LEU H H 1 8.14 0.02 . 1 . . . . 339 LEU H . 18580 1 374 . 1 1 54 54 LEU HA H 1 4.232 0.02 . 1 . . . . 339 LEU HA . 18580 1 375 . 1 1 54 54 LEU HB2 H 1 1.712 0.02 . 2 . . . . 339 LEU HB2 . 18580 1 376 . 1 1 54 54 LEU HB3 H 1 1.565 0.02 . 2 . . . . 339 LEU HB3 . 18580 1 377 . 1 1 54 54 LEU C C 13 178.47 0.3 . 1 . . . . 339 LEU CO . 18580 1 378 . 1 1 54 54 LEU CA C 13 56.43 0.3 . 1 . . . . 339 LEU CA . 18580 1 379 . 1 1 54 54 LEU CB C 13 41.89 0.3 . 1 . . . . 339 LEU CB . 18580 1 380 . 1 1 54 54 LEU N N 15 123.32 0.3 . 1 . . . . 339 LEU N . 18580 1 381 . 1 1 55 55 GLU H H 1 8.22 0.02 . 1 . . . . 340 GLU H . 18580 1 382 . 1 1 55 55 GLU HA H 1 4.152 0.02 . 1 . . . . 340 GLU HA . 18580 1 383 . 1 1 55 55 GLU HB2 H 1 2.01 0.02 . 1 . . . . 340 GLU HB . 18580 1 384 . 1 1 55 55 GLU HB3 H 1 2.01 0.02 . 1 . . . . 340 GLU HB . 18580 1 385 . 1 1 55 55 GLU HG2 H 1 2.248 0.02 . 1 . . . . 340 GLU HG . 18580 1 386 . 1 1 55 55 GLU HG3 H 1 2.248 0.02 . 1 . . . . 340 GLU HG . 18580 1 387 . 1 1 55 55 GLU C C 13 177.68 0.3 . 1 . . . . 340 GLU CO . 18580 1 388 . 1 1 55 55 GLU CA C 13 57.88 0.3 . 1 . . . . 340 GLU CA . 18580 1 389 . 1 1 55 55 GLU CB C 13 29.87 0.3 . 1 . . . . 340 GLU CB . 18580 1 390 . 1 1 55 55 GLU CG C 13 36.154 0.3 . 1 . . . . 340 GLU CG . 18580 1 391 . 1 1 55 55 GLU N N 15 120.87 0.3 . 1 . . . . 340 GLU N . 18580 1 392 . 1 1 56 56 ARG H H 1 8.12 0.02 . 1 . . . . 341 ARG H . 18580 1 393 . 1 1 56 56 ARG HA H 1 4.124 0.02 . 1 . . . . 341 ARG HA . 18580 1 394 . 1 1 56 56 ARG HB2 H 1 1.868 0.02 . 1 . . . . 341 ARG HB . 18580 1 395 . 1 1 56 56 ARG HB3 H 1 1.868 0.02 . 1 . . . . 341 ARG HB . 18580 1 396 . 1 1 56 56 ARG C C 13 177.47 0.3 . 1 . . . . 341 ARG CO . 18580 1 397 . 1 1 56 56 ARG CA C 13 57.91 0.3 . 1 . . . . 341 ARG CA . 18580 1 398 . 1 1 56 56 ARG CB C 13 30.41 0.3 . 1 . . . . 341 ARG CB . 18580 1 399 . 1 1 56 56 ARG N N 15 120.55 0.3 . 1 . . . . 341 ARG N . 18580 1 400 . 1 1 57 57 GLN H H 1 8.22 0.02 . 1 . . . . 342 GLN H . 18580 1 401 . 1 1 57 57 GLN HA H 1 4.212 0.02 . 1 . . . . 342 GLN HA . 18580 1 402 . 1 1 57 57 GLN HB2 H 1 2.116 0.02 . 1 . . . . 342 GLN HB . 18580 1 403 . 1 1 57 57 GLN HB3 H 1 2.116 0.02 . 1 . . . . 342 GLN HB . 18580 1 404 . 1 1 57 57 GLN HG2 H 1 2.399 0.02 . 1 . . . . 342 GLN HG . 18580 1 405 . 1 1 57 57 GLN HG3 H 1 2.399 0.02 . 1 . . . . 342 GLN HG . 18580 1 406 . 1 1 57 57 GLN C C 13 177.21 0.3 . 1 . . . . 342 GLN CO . 18580 1 407 . 1 1 57 57 GLN CA C 13 57.38 0.3 . 1 . . . . 342 GLN CA . 18580 1 408 . 1 1 57 57 GLN CB C 13 28.86 0.3 . 1 . . . . 342 GLN CB . 18580 1 409 . 1 1 57 57 GLN CG C 13 33.89 0.3 . 1 . . . . 342 GLN CG . 18580 1 410 . 1 1 57 57 GLN N N 15 119.9 0.3 . 1 . . . . 342 GLN N . 18580 1 411 . 1 1 58 58 ARG H H 1 8.25 0.02 . 1 . . . . 343 ARG H . 18580 1 412 . 1 1 58 58 ARG HA H 1 4.215 0.02 . 1 . . . . 343 ARG HA . 18580 1 413 . 1 1 58 58 ARG HB2 H 1 1.857 0.02 . 1 . . . . 343 ARG HB . 18580 1 414 . 1 1 58 58 ARG HB3 H 1 1.857 0.02 . 1 . . . . 343 ARG HB . 18580 1 415 . 1 1 58 58 ARG C C 13 177.541 0.3 . 1 . . . . 343 ARG CO . 18580 1 416 . 1 1 58 58 ARG CA C 13 57.458 0.3 . 1 . . . . 343 ARG CA . 18580 1 417 . 1 1 58 58 ARG CB C 13 30.517 0.3 . 1 . . . . 343 ARG CB . 18580 1 418 . 1 1 58 58 ARG N N 15 121.2 0.3 . 1 . . . . 343 ARG N . 18580 1 419 . 1 1 60 60 ASN H H 1 8.34 0.02 . 1 . . . . 345 ASN H . 18580 1 420 . 1 1 60 60 ASN HA H 1 4.599 0.02 . 1 . . . . 345 ASN HA . 18580 1 421 . 1 1 60 60 ASN HB2 H 1 2.839 0.02 . 1 . . . . 345 ASN HB . 18580 1 422 . 1 1 60 60 ASN HB3 H 1 2.839 0.02 . 1 . . . . 345 ASN HB . 18580 1 423 . 1 1 60 60 ASN C C 13 176.18 0.3 . 1 . . . . 345 ASN CO . 18580 1 424 . 1 1 60 60 ASN CA C 13 54.48 0.3 . 1 . . . . 345 ASN CA . 18580 1 425 . 1 1 60 60 ASN CB C 13 38.52 0.3 . 1 . . . . 345 ASN CB . 18580 1 426 . 1 1 60 60 ASN N N 15 119.24 0.3 . 1 . . . . 345 ASN N . 18580 1 427 . 1 1 61 61 GLU H H 1 8.3 0.02 . 1 . . . . 346 GLU H . 18580 1 428 . 1 1 61 61 GLU HA H 1 4.159 0.02 . 1 . . . . 346 GLU HA . 18580 1 429 . 1 1 61 61 GLU HB2 H 1 2.07 0.02 . 1 . . . . 346 GLU HB . 18580 1 430 . 1 1 61 61 GLU HB3 H 1 2.07 0.02 . 1 . . . . 346 GLU HB . 18580 1 431 . 1 1 61 61 GLU HG2 H 1 2.317 0.02 . 1 . . . . 346 GLU HG . 18580 1 432 . 1 1 61 61 GLU HG3 H 1 2.317 0.02 . 1 . . . . 346 GLU HG . 18580 1 433 . 1 1 61 61 GLU C C 13 177.51 0.3 . 1 . . . . 346 GLU CO . 18580 1 434 . 1 1 61 61 GLU CA C 13 57.92 0.3 . 1 . . . . 346 GLU CA . 18580 1 435 . 1 1 61 61 GLU CB C 13 29.91 0.3 . 1 . . . . 346 GLU CB . 18580 1 436 . 1 1 61 61 GLU CG C 13 36.279 0.3 . 1 . . . . 346 GLU CG . 18580 1 437 . 1 1 61 61 GLU N N 15 120.96 0.3 . 1 . . . . 346 GLU N . 18580 1 438 . 1 1 62 62 LEU H H 1 8.04 0.02 . 1 . . . . 347 LEU H . 18580 1 439 . 1 1 62 62 LEU HA H 1 4.203 0.02 . 1 . . . . 347 LEU HA . 18580 1 440 . 1 1 62 62 LEU HB2 H 1 1.735 0.02 . 2 . . . . 347 LEU HB2 . 18580 1 441 . 1 1 62 62 LEU HB3 H 1 1.585 0.02 . 2 . . . . 347 LEU HB3 . 18580 1 442 . 1 1 62 62 LEU HD11 H 1 0.914 0.02 . 2 . . . . 347 LEU HD1 . 18580 1 443 . 1 1 62 62 LEU HD12 H 1 0.914 0.02 . 2 . . . . 347 LEU HD1 . 18580 1 444 . 1 1 62 62 LEU HD13 H 1 0.914 0.02 . 2 . . . . 347 LEU HD1 . 18580 1 445 . 1 1 62 62 LEU HD21 H 1 0.854 0.02 . 2 . . . . 347 LEU HD2 . 18580 1 446 . 1 1 62 62 LEU HD22 H 1 0.854 0.02 . 2 . . . . 347 LEU HD2 . 18580 1 447 . 1 1 62 62 LEU HD23 H 1 0.854 0.02 . 2 . . . . 347 LEU HD2 . 18580 1 448 . 1 1 62 62 LEU C C 13 178.044 0.3 . 1 . . . . 347 LEU CO . 18580 1 449 . 1 1 62 62 LEU CA C 13 56.347 0.3 . 1 . . . . 347 LEU CA . 18580 1 450 . 1 1 62 62 LEU CB C 13 42.1 0.3 . 1 . . . . 347 LEU CB . 18580 1 451 . 1 1 62 62 LEU CD1 C 13 25.104 0.3 . 2 . . . . 347 LEU CD1 . 18580 1 452 . 1 1 62 62 LEU CD2 C 13 23.572 0.3 . 2 . . . . 347 LEU CD2 . 18580 1 453 . 1 1 62 62 LEU N N 15 121.31 0.3 . 1 . . . . 347 LEU N . 18580 1 454 . 1 1 63 63 LYS H H 1 7.998 0.02 . 1 . . . . 348 LYS H . 18580 1 455 . 1 1 63 63 LYS HA H 1 4.185 0.02 . 1 . . . . 348 LYS HA . 18580 1 456 . 1 1 63 63 LYS HB2 H 1 1.835 0.02 . 1 . . . . 348 LYS HB . 18580 1 457 . 1 1 63 63 LYS HB3 H 1 1.835 0.02 . 1 . . . . 348 LYS HB . 18580 1 458 . 1 1 63 63 LYS C C 13 177.112 0.3 . 1 . . . . 348 LYS CO . 18580 1 459 . 1 1 63 63 LYS CA C 13 57.317 0.3 . 1 . . . . 348 LYS CA . 18580 1 460 . 1 1 63 63 LYS CB C 13 32.718 0.3 . 1 . . . . 348 LYS CB . 18580 1 461 . 1 1 63 63 LYS N N 15 120.427 0.3 . 1 . . . . 348 LYS N . 18580 1 462 . 1 1 64 64 LEU H H 1 7.94 0.02 . 1 . . . . 349 LEU H . 18580 1 463 . 1 1 64 64 LEU HA H 1 4.247 0.02 . 1 . . . . 349 LEU HA . 18580 1 464 . 1 1 64 64 LEU HB2 H 1 1.697 0.02 . 1 . . . . 349 LEU HB . 18580 1 465 . 1 1 64 64 LEU HB3 H 1 1.697 0.02 . 1 . . . . 349 LEU HB . 18580 1 466 . 1 1 64 64 LEU HD11 H 1 0.928 0.02 . 1 . . . . 349 LEU HD . 18580 1 467 . 1 1 64 64 LEU HD12 H 1 0.928 0.02 . 1 . . . . 349 LEU HD . 18580 1 468 . 1 1 64 64 LEU HD13 H 1 0.928 0.02 . 1 . . . . 349 LEU HD . 18580 1 469 . 1 1 64 64 LEU HD21 H 1 0.928 0.02 . 1 . . . . 349 LEU HD . 18580 1 470 . 1 1 64 64 LEU HD22 H 1 0.928 0.02 . 1 . . . . 349 LEU HD . 18580 1 471 . 1 1 64 64 LEU HD23 H 1 0.928 0.02 . 1 . . . . 349 LEU HD . 18580 1 472 . 1 1 64 64 LEU C C 13 177.93 0.3 . 1 . . . . 349 LEU CO . 18580 1 473 . 1 1 64 64 LEU CA C 13 55.96 0.3 . 1 . . . . 349 LEU CA . 18580 1 474 . 1 1 64 64 LEU CB C 13 42.19 0.3 . 1 . . . . 349 LEU CB . 18580 1 475 . 1 1 64 64 LEU CD1 C 13 25.071 0.3 . 1 . . . . 349 LEU CD . 18580 1 476 . 1 1 64 64 LEU CD2 C 13 25.071 0.3 . 1 . . . . 349 LEU CD . 18580 1 477 . 1 1 64 64 LEU N N 15 120.83 0.3 . 1 . . . . 349 LEU N . 18580 1 478 . 1 1 65 65 ARG H H 1 8.03 0.02 . 1 . . . . 350 ARG H . 18580 1 479 . 1 1 65 65 ARG HA H 1 4.176 0.02 . 1 . . . . 350 ARG HA . 18580 1 480 . 1 1 65 65 ARG HB2 H 1 1.658 0.02 . 1 . . . . 350 ARG HB . 18580 1 481 . 1 1 65 65 ARG HB3 H 1 1.658 0.02 . 1 . . . . 350 ARG HB . 18580 1 482 . 1 1 65 65 ARG C C 13 176.29 0.3 . 1 . . . . 350 ARG CO . 18580 1 483 . 1 1 65 65 ARG CA C 13 56.85 0.3 . 1 . . . . 350 ARG CA . 18580 1 484 . 1 1 65 65 ARG CB C 13 30.67 0.3 . 1 . . . . 350 ARG CB . 18580 1 485 . 1 1 65 65 ARG N N 15 120.24 0.3 . 1 . . . . 350 ARG N . 18580 1 486 . 1 1 66 66 PHE H H 1 8.03 0.02 . 1 . . . . 351 PHE H . 18580 1 487 . 1 1 66 66 PHE HA H 1 4.495 0.02 . 1 . . . . 351 PHE HA . 18580 1 488 . 1 1 66 66 PHE HB2 H 1 3.04 0.02 . 2 . . . . 351 PHE HB2 . 18580 1 489 . 1 1 66 66 PHE HB3 H 1 2.951 0.02 . 2 . . . . 351 PHE HB3 . 18580 1 490 . 1 1 66 66 PHE C C 13 175.85 0.3 . 1 . . . . 351 PHE CO . 18580 1 491 . 1 1 66 66 PHE CA C 13 58.39 0.3 . 1 . . . . 351 PHE CA . 18580 1 492 . 1 1 66 66 PHE CB C 13 39.49 0.3 . 1 . . . . 351 PHE CB . 18580 1 493 . 1 1 66 66 PHE N N 15 119.8 0.3 . 1 . . . . 351 PHE N . 18580 1 494 . 1 1 67 67 PHE H H 1 8.05 0.02 . 1 . . . . 352 PHE H . 18580 1 495 . 1 1 67 67 PHE HA H 1 4.484 0.02 . 1 . . . . 352 PHE HA . 18580 1 496 . 1 1 67 67 PHE HB2 H 1 3.135 0.02 . 2 . . . . 352 PHE HB2 . 18580 1 497 . 1 1 67 67 PHE HB3 H 1 2.999 0.02 . 2 . . . . 352 PHE HB3 . 18580 1 498 . 1 1 67 67 PHE C C 13 175.52 0.3 . 1 . . . . 352 PHE CO . 18580 1 499 . 1 1 67 67 PHE CA C 13 58.22 0.3 . 1 . . . . 352 PHE CA . 18580 1 500 . 1 1 67 67 PHE CB C 13 39.57 0.3 . 1 . . . . 352 PHE CB . 18580 1 501 . 1 1 67 67 PHE N N 15 120.8 0.3 . 1 . . . . 352 PHE N . 18580 1 502 . 1 1 68 68 ALA H H 1 8.07 0.02 . 1 . . . . 353 ALA H . 18580 1 503 . 1 1 68 68 ALA HA H 1 4.242 0.02 . 1 . . . . 353 ALA HA . 18580 1 504 . 1 1 68 68 ALA HB1 H 1 1.376 0.02 . 1 . . . . 353 ALA HB . 18580 1 505 . 1 1 68 68 ALA HB2 H 1 1.376 0.02 . 1 . . . . 353 ALA HB . 18580 1 506 . 1 1 68 68 ALA HB3 H 1 1.376 0.02 . 1 . . . . 353 ALA HB . 18580 1 507 . 1 1 68 68 ALA C C 13 177.73 0.3 . 1 . . . . 353 ALA CO . 18580 1 508 . 1 1 68 68 ALA CA C 13 52.78 0.3 . 1 . . . . 353 ALA CA . 18580 1 509 . 1 1 68 68 ALA CB C 13 19.26 0.3 . 1 . . . . 353 ALA CB . 18580 1 510 . 1 1 68 68 ALA N N 15 124.29 0.3 . 1 . . . . 353 ALA N . 18580 1 511 . 1 1 69 69 LEU H H 1 7.99 0.02 . 1 . . . . 354 LEU H . 18580 1 512 . 1 1 69 69 LEU HA H 1 4.262 0.02 . 1 . . . . 354 LEU HA . 18580 1 513 . 1 1 69 69 LEU HB2 H 1 1.596 0.02 . 1 . . . . 354 LEU HB . 18580 1 514 . 1 1 69 69 LEU HB3 H 1 1.596 0.02 . 1 . . . . 354 LEU HB . 18580 1 515 . 1 1 69 69 LEU HD11 H 1 0.917 0.02 . 2 . . . . 354 LEU HD1 . 18580 1 516 . 1 1 69 69 LEU HD12 H 1 0.917 0.02 . 2 . . . . 354 LEU HD1 . 18580 1 517 . 1 1 69 69 LEU HD13 H 1 0.917 0.02 . 2 . . . . 354 LEU HD1 . 18580 1 518 . 1 1 69 69 LEU HD21 H 1 0.857 0.02 . 2 . . . . 354 LEU HD2 . 18580 1 519 . 1 1 69 69 LEU HD22 H 1 0.857 0.02 . 2 . . . . 354 LEU HD2 . 18580 1 520 . 1 1 69 69 LEU HD23 H 1 0.857 0.02 . 2 . . . . 354 LEU HD2 . 18580 1 521 . 1 1 69 69 LEU C C 13 177.72 0.3 . 1 . . . . 354 LEU CO . 18580 1 522 . 1 1 69 69 LEU CA C 13 55.55 0.3 . 1 . . . . 354 LEU CA . 18580 1 523 . 1 1 69 69 LEU CB C 13 42.22 0.3 . 1 . . . . 354 LEU CB . 18580 1 524 . 1 1 69 69 LEU CD1 C 13 25.073 0.3 . 2 . . . . 354 LEU CD1 . 18580 1 525 . 1 1 69 69 LEU CD2 C 13 23.545 0.3 . 2 . . . . 354 LEU CD2 . 18580 1 526 . 1 1 69 69 LEU N N 15 120.41 0.3 . 1 . . . . 354 LEU N . 18580 1 527 . 1 1 70 70 ARG H H 1 8.11 0.02 . 1 . . . . 355 ARG H . 18580 1 528 . 1 1 70 70 ARG HA H 1 4.232 0.02 . 1 . . . . 355 ARG HA . 18580 1 529 . 1 1 70 70 ARG HB2 H 1 1.822 0.02 . 2 . . . . 355 ARG HB2 . 18580 1 530 . 1 1 70 70 ARG HB3 H 1 1.736 0.02 . 2 . . . . 355 ARG HB3 . 18580 1 531 . 1 1 70 70 ARG HG2 H 1 1.608 0.02 . 1 . . . . 355 ARG HG . 18580 1 532 . 1 1 70 70 ARG HG3 H 1 1.608 0.02 . 1 . . . . 355 ARG HG . 18580 1 533 . 1 1 70 70 ARG C C 13 176.15 0.3 . 1 . . . . 355 ARG CO . 18580 1 534 . 1 1 70 70 ARG CA C 13 56.64 0.3 . 1 . . . . 355 ARG CA . 18580 1 535 . 1 1 70 70 ARG CB C 13 30.7 0.3 . 1 . . . . 355 ARG CB . 18580 1 536 . 1 1 70 70 ARG CG C 13 26.856 0.3 . 1 . . . . 355 ARG CG . 18580 1 537 . 1 1 70 70 ARG N N 15 120.5 0.3 . 1 . . . . 355 ARG N . 18580 1 538 . 1 1 71 71 ASP H H 1 8.21 0.02 . 1 . . . . 356 ASP H . 18580 1 539 . 1 1 71 71 ASP HA H 1 4.561 0.02 . 1 . . . . 356 ASP HA . 18580 1 540 . 1 1 71 71 ASP HB2 H 1 2.691 0.02 . 2 . . . . 356 ASP HB2 . 18580 1 541 . 1 1 71 71 ASP HB3 H 1 2.595 0.02 . 2 . . . . 356 ASP HB3 . 18580 1 542 . 1 1 71 71 ASP C C 13 175.93 0.3 . 1 . . . . 356 ASP CO . 18580 1 543 . 1 1 71 71 ASP CA C 13 54.67 0.3 . 1 . . . . 356 ASP CA . 18580 1 544 . 1 1 71 71 ASP CB C 13 41.08 0.3 . 1 . . . . 356 ASP CB . 18580 1 545 . 1 1 71 71 ASP N N 15 119.86 0.3 . 1 . . . . 356 ASP N . 18580 1 546 . 1 1 72 72 GLN H H 1 8.09 0.02 . 1 . . . . 357 GLN H . 18580 1 547 . 1 1 72 72 GLN HA H 1 4.303 0.02 . 1 . . . . 357 GLN HA . 18580 1 548 . 1 1 72 72 GLN HB2 H 1 2.078 0.02 . 2 . . . . 357 GLN HB2 . 18580 1 549 . 1 1 72 72 GLN HB3 H 1 2.957 0.02 . 2 . . . . 357 GLN HB3 . 18580 1 550 . 1 1 72 72 GLN HG2 H 1 2.314 0.02 . 1 . . . . 357 GLN HG . 18580 1 551 . 1 1 72 72 GLN HG3 H 1 2.314 0.02 . 1 . . . . 357 GLN HG . 18580 1 552 . 1 1 72 72 GLN C C 13 175.59 0.3 . 1 . . . . 357 GLN CO . 18580 1 553 . 1 1 72 72 GLN CA C 13 55.64 0.3 . 1 . . . . 357 GLN CA . 18580 1 554 . 1 1 72 72 GLN CB C 13 29.61 0.3 . 1 . . . . 357 GLN CB . 18580 1 555 . 1 1 72 72 GLN CG C 13 33.886 0.3 . 1 . . . . 357 GLN CG . 18580 1 556 . 1 1 72 72 GLN N N 15 119.43 0.3 . 1 . . . . 357 GLN N . 18580 1 557 . 1 1 73 73 ILE H H 1 8.17 0.02 . 1 . . . . 358 ILE H . 18580 1 558 . 1 1 73 73 ILE C C 13 174.59 0.3 . 1 . . . . 358 ILE CO . 18580 1 559 . 1 1 73 73 ILE N N 15 123.63 0.3 . 1 . . . . 358 ILE N . 18580 1 560 . 1 1 74 74 PRO HA H 1 4.385 0.02 . 1 . . . . 359 PRO HA . 18580 1 561 . 1 1 74 74 PRO HB2 H 1 2.269 0.02 . 2 . . . . 359 PRO HB2 . 18580 1 562 . 1 1 74 74 PRO HB3 H 1 1.873 0.02 . 2 . . . . 359 PRO HB3 . 18580 1 563 . 1 1 74 74 PRO HG2 H 1 1.985 0.02 . 1 . . . . 359 PRO HG . 18580 1 564 . 1 1 74 74 PRO HG3 H 1 1.985 0.02 . 1 . . . . 359 PRO HG . 18580 1 565 . 1 1 74 74 PRO C C 13 176.82 0.3 . 1 . . . . 359 PRO CO . 18580 1 566 . 1 1 74 74 PRO CA C 13 63.37 0.3 . 1 . . . . 359 PRO CA . 18580 1 567 . 1 1 74 74 PRO CB C 13 32.15 0.3 . 1 . . . . 359 PRO CB . 18580 1 568 . 1 1 74 74 PRO CG C 13 27.448 0.3 . 1 . . . . 359 PRO CG . 18580 1 569 . 1 1 74 74 PRO N N 15 111.66 0.3 . 1 . . . . 359 PRO N . 18580 1 570 . 1 1 75 75 GLU H H 1 8.48 0.02 . 1 . . . . 360 GLU H . 18580 1 571 . 1 1 75 75 GLU HA H 1 4.242 0.02 . 1 . . . . 360 GLU HA . 18580 1 572 . 1 1 75 75 GLU HB2 H 1 2.003 0.02 . 2 . . . . 360 GLU HB2 . 18580 1 573 . 1 1 75 75 GLU HB3 H 1 1.95 0.02 . 2 . . . . 360 GLU HB3 . 18580 1 574 . 1 1 75 75 GLU HG2 H 1 2.259 0.02 . 1 . . . . 360 GLU HG . 18580 1 575 . 1 1 75 75 GLU HG3 H 1 2.259 0.02 . 1 . . . . 360 GLU HG . 18580 1 576 . 1 1 75 75 GLU C C 13 176.64 0.3 . 1 . . . . 360 GLU CO . 18580 1 577 . 1 1 75 75 GLU CA C 13 56.82 0.3 . 1 . . . . 360 GLU CA . 18580 1 578 . 1 1 75 75 GLU CB C 13 30.37 0.3 . 1 . . . . 360 GLU CB . 18580 1 579 . 1 1 75 75 GLU CG C 13 36.431 0.3 . 1 . . . . 360 GLU CG . 18580 1 580 . 1 1 75 75 GLU N N 15 121.32 0.3 . 1 . . . . 360 GLU N . 18580 1 581 . 1 1 76 76 VAL H H 1 8.12 0.02 . 1 . . . . 361 VAL H . 18580 1 582 . 1 1 76 76 VAL HA H 1 4.131 0.02 . 1 . . . . 361 VAL HA . 18580 1 583 . 1 1 76 76 VAL HB H 1 2.059 0.02 . 1 . . . . 361 VAL HB . 18580 1 584 . 1 1 76 76 VAL HG11 H 1 0.92 0.02 . 2 . . . . 361 VAL HG1 . 18580 1 585 . 1 1 76 76 VAL HG12 H 1 0.92 0.02 . 2 . . . . 361 VAL HG1 . 18580 1 586 . 1 1 76 76 VAL HG13 H 1 0.92 0.02 . 2 . . . . 361 VAL HG1 . 18580 1 587 . 1 1 76 76 VAL HG21 H 1 0.919 0.02 . 2 . . . . 361 VAL HG2 . 18580 1 588 . 1 1 76 76 VAL HG22 H 1 0.919 0.02 . 2 . . . . 361 VAL HG2 . 18580 1 589 . 1 1 76 76 VAL HG23 H 1 0.919 0.02 . 2 . . . . 361 VAL HG2 . 18580 1 590 . 1 1 76 76 VAL C C 13 175.83 0.3 . 1 . . . . 361 VAL CO . 18580 1 591 . 1 1 76 76 VAL CA C 13 62.22 0.3 . 1 . . . . 361 VAL CA . 18580 1 592 . 1 1 76 76 VAL CB C 13 32.87 0.3 . 1 . . . . 361 VAL CB . 18580 1 593 . 1 1 76 76 VAL CG1 C 13 21.227 0.3 . 2 . . . . 361 VAL CG1 . 18580 1 594 . 1 1 76 76 VAL CG2 C 13 20.584 0.3 . 2 . . . . 361 VAL CG2 . 18580 1 595 . 1 1 76 76 VAL N N 15 121.18 0.3 . 1 . . . . 361 VAL N . 18580 1 596 . 1 1 77 77 ALA H H 1 8.38 0.02 . 1 . . . . 362 ALA H . 18580 1 597 . 1 1 77 77 ALA HA H 1 4.302 0.02 . 1 . . . . 362 ALA HA . 18580 1 598 . 1 1 77 77 ALA HB1 H 1 1.371 0.02 . 1 . . . . 362 ALA HB . 18580 1 599 . 1 1 77 77 ALA HB2 H 1 1.371 0.02 . 1 . . . . 362 ALA HB . 18580 1 600 . 1 1 77 77 ALA HB3 H 1 1.371 0.02 . 1 . . . . 362 ALA HB . 18580 1 601 . 1 1 77 77 ALA C C 13 177.44 0.3 . 1 . . . . 362 ALA CO . 18580 1 602 . 1 1 77 77 ALA CA C 13 52.492 0.3 . 1 . . . . 362 ALA CA . 18580 1 603 . 1 1 77 77 ALA CB C 13 19.475 0.3 . 1 . . . . 362 ALA CB . 18580 1 604 . 1 1 77 77 ALA N N 15 127.56 0.3 . 1 . . . . 362 ALA N . 18580 1 605 . 1 1 78 78 ASN H H 1 8.4 0.02 . 1 . . . . 363 ASN H . 18580 1 606 . 1 1 78 78 ASN HA H 1 4.66 0.02 . 1 . . . . 363 ASN HA . 18580 1 607 . 1 1 78 78 ASN HB2 H 1 2.802 0.02 . 1 . . . . 363 ASN HB . 18580 1 608 . 1 1 78 78 ASN HB3 H 1 2.802 0.02 . 1 . . . . 363 ASN HB . 18580 1 609 . 1 1 78 78 ASN C C 13 175.14 0.3 . 1 . . . . 363 ASN CO . 18580 1 610 . 1 1 78 78 ASN CA C 13 53.38 0.3 . 1 . . . . 363 ASN CA . 18580 1 611 . 1 1 78 78 ASN CB C 13 38.92 0.3 . 1 . . . . 363 ASN CB . 18580 1 612 . 1 1 78 78 ASN N N 15 118.12 0.3 . 1 . . . . 363 ASN N . 18580 1 613 . 1 1 79 79 ASN H H 1 8.41 0.02 . 1 . . . . 364 ASN H . 18580 1 614 . 1 1 79 79 ASN HA H 1 4.685 0.02 . 1 . . . . 364 ASN HA . 18580 1 615 . 1 1 79 79 ASN HB2 H 1 2.844 0.02 . 2 . . . . 364 ASN HB2 . 18580 1 616 . 1 1 79 79 ASN HB3 H 1 2.761 0.02 . 2 . . . . 364 ASN HB3 . 18580 1 617 . 1 1 79 79 ASN C C 13 175.39 0.3 . 1 . . . . 364 ASN CO . 18580 1 618 . 1 1 79 79 ASN CA C 13 53.41 0.3 . 1 . . . . 364 ASN CA . 18580 1 619 . 1 1 79 79 ASN CB C 13 38.84 0.3 . 1 . . . . 364 ASN CB . 18580 1 620 . 1 1 79 79 ASN N N 15 119.29 0.3 . 1 . . . . 364 ASN N . 18580 1 621 . 1 1 80 80 GLU H H 1 8.37 0.02 . 1 . . . . 365 GLU H . 18580 1 622 . 1 1 80 80 GLU HA H 1 4.234 0.02 . 1 . . . . 365 GLU HA . 18580 1 623 . 1 1 80 80 GLU HB2 H 1 2.057 0.02 . 2 . . . . 365 GLU HB2 . 18580 1 624 . 1 1 80 80 GLU HB3 H 1 1.96 0.02 . 2 . . . . 365 GLU HB3 . 18580 1 625 . 1 1 80 80 GLU HG2 H 1 2.252 0.02 . 1 . . . . 365 GLU HG . 18580 1 626 . 1 1 80 80 GLU HG3 H 1 2.252 0.02 . 1 . . . . 365 GLU HG . 18580 1 627 . 1 1 80 80 GLU C C 13 176.5 0.3 . 1 . . . . 365 GLU CO . 18580 1 628 . 1 1 80 80 GLU CA C 13 57.03 0.3 . 1 . . . . 365 GLU CA . 18580 1 629 . 1 1 80 80 GLU CB C 13 30.12 0.3 . 1 . . . . 365 GLU CB . 18580 1 630 . 1 1 80 80 GLU CG C 13 36.305 0.3 . 1 . . . . 365 GLU CG . 18580 1 631 . 1 1 80 80 GLU N N 15 121.08 0.3 . 1 . . . . 365 GLU N . 18580 1 632 . 1 1 81 81 LYS H H 1 8.21 0.02 . 1 . . . . 366 LYS H . 18580 1 633 . 1 1 81 81 LYS HA H 1 4.286 0.02 . 1 . . . . 366 LYS HA . 18580 1 634 . 1 1 81 81 LYS HB2 H 1 1.841 0.02 . 2 . . . . 366 LYS HB2 . 18580 1 635 . 1 1 81 81 LYS HB3 H 1 1.732 0.02 . 2 . . . . 366 LYS HB3 . 18580 1 636 . 1 1 81 81 LYS HG2 H 1 1.413 0.02 . 1 . . . . 366 LYS HG . 18580 1 637 . 1 1 81 81 LYS HG3 H 1 1.413 0.02 . 1 . . . . 366 LYS HG . 18580 1 638 . 1 1 81 81 LYS HD2 H 1 1.656 0.02 . 1 . . . . 366 LYS HD . 18580 1 639 . 1 1 81 81 LYS HD3 H 1 1.656 0.02 . 1 . . . . 366 LYS HD . 18580 1 640 . 1 1 81 81 LYS C C 13 176.0 0.3 . 1 . . . . 366 LYS CO . 18580 1 641 . 1 1 81 81 LYS CA C 13 56.0 0.3 . 1 . . . . 366 LYS CA . 18580 1 642 . 1 1 81 81 LYS CB C 13 32.89 0.3 . 1 . . . . 366 LYS CB . 18580 1 643 . 1 1 81 81 LYS CG C 13 24.901 0.3 . 1 . . . . 366 LYS CG . 18580 1 644 . 1 1 81 81 LYS CD C 13 29.035 0.3 . 1 . . . . 366 LYS CD . 18580 1 645 . 1 1 81 81 LYS N N 15 121.36 0.3 . 1 . . . . 366 LYS N . 18580 1 646 . 1 1 82 82 ALA H H 1 8.11 0.02 . 1 . . . . 367 ALA H . 18580 1 647 . 1 1 82 82 ALA C C 13 175.28 0.3 . 1 . . . . 367 ALA CO . 18580 1 648 . 1 1 82 82 ALA N N 15 125.86 0.3 . 1 . . . . 367 ALA N . 18580 1 649 . 1 1 83 83 PRO HA H 1 4.409 0.02 . 1 . . . . 368 PRO HA . 18580 1 650 . 1 1 83 83 PRO HB2 H 1 2.275 0.02 . 2 . . . . 368 PRO HB2 . 18580 1 651 . 1 1 83 83 PRO HB3 H 1 2.186 0.02 . 2 . . . . 368 PRO HB3 . 18580 1 652 . 1 1 83 83 PRO HG2 H 1 2.016 0.02 . 1 . . . . 368 PRO HG . 18580 1 653 . 1 1 83 83 PRO HG3 H 1 2.016 0.02 . 1 . . . . 368 PRO HG . 18580 1 654 . 1 1 83 83 PRO C C 13 176.8 0.3 . 1 . . . . 368 PRO CO . 18580 1 655 . 1 1 83 83 PRO CA C 13 62.94 0.3 . 1 . . . . 368 PRO CA . 18580 1 656 . 1 1 83 83 PRO CB C 13 32.14 0.3 . 1 . . . . 368 PRO CB . 18580 1 657 . 1 1 83 83 PRO CG C 13 27.353 0.3 . 1 . . . . 368 PRO CG . 18580 1 658 . 1 1 83 83 PRO N N 15 107.46 0.3 . 1 . . . . 368 PRO N . 18580 1 659 . 1 1 84 84 LYS H H 1 8.38 0.02 . 1 . . . . 369 LYS H . 18580 1 660 . 1 1 84 84 LYS HA H 1 4.279 0.02 . 1 . . . . 369 LYS HA . 18580 1 661 . 1 1 84 84 LYS HB2 H 1 1.767 0.02 . 1 . . . . 369 LYS HB . 18580 1 662 . 1 1 84 84 LYS HB3 H 1 1.767 0.02 . 1 . . . . 369 LYS HB . 18580 1 663 . 1 1 84 84 LYS HG2 H 1 1.416 0.02 . 1 . . . . 369 LYS HG . 18580 1 664 . 1 1 84 84 LYS HG3 H 1 1.416 0.02 . 1 . . . . 369 LYS HG . 18580 1 665 . 1 1 84 84 LYS C C 13 176.54 0.3 . 1 . . . . 369 LYS CO . 18580 1 666 . 1 1 84 84 LYS CA C 13 56.37 0.3 . 1 . . . . 369 LYS CA . 18580 1 667 . 1 1 84 84 LYS CB C 13 33.05 0.3 . 1 . . . . 369 LYS CB . 18580 1 668 . 1 1 84 84 LYS CG C 13 24.864 0.3 . 1 . . . . 369 LYS CG . 18580 1 669 . 1 1 84 84 LYS N N 15 121.81 0.3 . 1 . . . . 369 LYS N . 18580 1 670 . 1 1 85 85 VAL H H 1 8.14 0.02 . 1 . . . . 370 VAL H . 18580 1 671 . 1 1 85 85 VAL HA H 1 4.096 0.02 . 1 . . . . 370 VAL HA . 18580 1 672 . 1 1 85 85 VAL HB H 1 1.996 0.02 . 1 . . . . 370 VAL HB . 18580 1 673 . 1 1 85 85 VAL HG11 H 1 0.901 0.02 . 1 . . . . 370 VAL HG . 18580 1 674 . 1 1 85 85 VAL HG12 H 1 0.901 0.02 . 1 . . . . 370 VAL HG . 18580 1 675 . 1 1 85 85 VAL HG13 H 1 0.901 0.02 . 1 . . . . 370 VAL HG . 18580 1 676 . 1 1 85 85 VAL HG21 H 1 0.901 0.02 . 1 . . . . 370 VAL HG . 18580 1 677 . 1 1 85 85 VAL HG22 H 1 0.901 0.02 . 1 . . . . 370 VAL HG . 18580 1 678 . 1 1 85 85 VAL HG23 H 1 0.901 0.02 . 1 . . . . 370 VAL HG . 18580 1 679 . 1 1 85 85 VAL C C 13 175.76 0.3 . 1 . . . . 370 VAL CO . 18580 1 680 . 1 1 85 85 VAL CA C 13 62.32 0.3 . 1 . . . . 370 VAL CA . 18580 1 681 . 1 1 85 85 VAL CB C 13 32.93 0.3 . 1 . . . . 370 VAL CB . 18580 1 682 . 1 1 85 85 VAL CG1 C 13 20.942 0.3 . 2 . . . . 370 VAL CG1 . 18580 1 683 . 1 1 85 85 VAL N N 15 122.21 0.3 . 1 . . . . 370 VAL N . 18580 1 684 . 1 1 86 86 VAL H H 1 8.29 0.02 . 1 . . . . 371 VAL H . 18580 1 685 . 1 1 86 86 VAL HA H 1 4.074 0.02 . 1 . . . . 371 VAL HA . 18580 1 686 . 1 1 86 86 VAL HB H 1 1.958 0.02 . 1 . . . . 371 VAL HB . 18580 1 687 . 1 1 86 86 VAL HG11 H 1 0.889 0.02 . 2 . . . . 371 VAL HG1 . 18580 1 688 . 1 1 86 86 VAL HG12 H 1 0.889 0.02 . 2 . . . . 371 VAL HG1 . 18580 1 689 . 1 1 86 86 VAL HG13 H 1 0.889 0.02 . 2 . . . . 371 VAL HG1 . 18580 1 690 . 1 1 86 86 VAL C C 13 175.66 0.3 . 1 . . . . 371 VAL CO . 18580 1 691 . 1 1 86 86 VAL CA C 13 62.35 0.3 . 1 . . . . 371 VAL CA . 18580 1 692 . 1 1 86 86 VAL CB C 13 32.91 0.3 . 1 . . . . 371 VAL CB . 18580 1 693 . 1 1 86 86 VAL CG1 C 13 20.95 0.3 . 2 . . . . 371 VAL CG1 . 18580 1 694 . 1 1 86 86 VAL N N 15 125.76 0.3 . 1 . . . . 371 VAL N . 18580 1 695 . 1 1 87 87 ILE H H 1 8.3 0.02 . 1 . . . . 372 ILE H . 18580 1 696 . 1 1 87 87 ILE HA H 1 4.138 0.02 . 1 . . . . 372 ILE HA . 18580 1 697 . 1 1 87 87 ILE HB H 1 1.81 0.02 . 1 . . . . 372 ILE HB . 18580 1 698 . 1 1 87 87 ILE HG21 H 1 0.857 0.02 . 1 . . . . 372 ILE HG2 . 18580 1 699 . 1 1 87 87 ILE HG22 H 1 0.857 0.02 . 1 . . . . 372 ILE HG2 . 18580 1 700 . 1 1 87 87 ILE HG23 H 1 0.857 0.02 . 1 . . . . 372 ILE HG2 . 18580 1 701 . 1 1 87 87 ILE C C 13 175.94 0.3 . 1 . . . . 372 ILE CO . 18580 1 702 . 1 1 87 87 ILE CA C 13 60.7 0.3 . 1 . . . . 372 ILE CA . 18580 1 703 . 1 1 87 87 ILE CB C 13 38.43 0.3 . 1 . . . . 372 ILE CB . 18580 1 704 . 1 1 87 87 ILE CG2 C 13 17.502 0.3 . 1 . . . . 372 ILE CG2 . 18580 1 705 . 1 1 87 87 ILE N N 15 126.39 0.3 . 1 . . . . 372 ILE N . 18580 1 706 . 1 1 88 88 LEU H H 1 8.37 0.02 . 1 . . . . 373 LEU H . 18580 1 707 . 1 1 88 88 LEU HA H 1 4.371 0.02 . 1 . . . . 373 LEU HA . 18580 1 708 . 1 1 88 88 LEU HB2 H 1 1.573 0.02 . 2 . . . . 373 LEU HB2 . 18580 1 709 . 1 1 88 88 LEU HB3 H 1 1.549 0.02 . 2 . . . . 373 LEU HB3 . 18580 1 710 . 1 1 88 88 LEU C C 13 176.96 0.3 . 1 . . . . 373 LEU CO . 18580 1 711 . 1 1 88 88 LEU CA C 13 54.95 0.3 . 1 . . . . 373 LEU CA . 18580 1 712 . 1 1 88 88 LEU CB C 13 42.48 0.3 . 1 . . . . 373 LEU CB . 18580 1 713 . 1 1 88 88 LEU N N 15 127.59 0.3 . 1 . . . . 373 LEU N . 18580 1 714 . 1 1 89 89 LYS H H 1 8.29 0.02 . 1 . . . . 374 LYS H . 18580 1 715 . 1 1 89 89 LYS HA H 1 4.28 0.02 . 1 . . . . 374 LYS HA . 18580 1 716 . 1 1 89 89 LYS HB2 H 1 1.792 0.02 . 2 . . . . 374 LYS HB2 . 18580 1 717 . 1 1 89 89 LYS HB3 H 1 1.715 0.02 . 2 . . . . 374 LYS HB3 . 18580 1 718 . 1 1 89 89 LYS C C 13 176.37 0.3 . 1 . . . . 374 LYS CO . 18580 1 719 . 1 1 89 89 LYS CA C 13 56.32 0.3 . 1 . . . . 374 LYS CA . 18580 1 720 . 1 1 89 89 LYS CB C 13 33.19 0.3 . 1 . . . . 374 LYS CB . 18580 1 721 . 1 1 89 89 LYS N N 15 123.06 0.3 . 1 . . . . 374 LYS N . 18580 1 722 . 1 1 90 90 LYS H H 1 8.35 0.02 . 1 . . . . 375 LYS H . 18580 1 723 . 1 1 90 90 LYS HA H 1 4.278 0.02 . 1 . . . . 375 LYS HA . 18580 1 724 . 1 1 90 90 LYS HB2 H 1 1.819 0.02 . 2 . . . . 375 LYS HB2 . 18580 1 725 . 1 1 90 90 LYS HB3 H 1 1.72 0.02 . 2 . . . . 375 LYS HB3 . 18580 1 726 . 1 1 90 90 LYS C C 13 176.48 0.3 . 1 . . . . 375 LYS CO . 18580 1 727 . 1 1 90 90 LYS CA C 13 56.32 0.3 . 1 . . . . 375 LYS CA . 18580 1 728 . 1 1 90 90 LYS CB C 13 33.27 0.3 . 1 . . . . 375 LYS CB . 18580 1 729 . 1 1 90 90 LYS N N 15 123.16 0.3 . 1 . . . . 375 LYS N . 18580 1 730 . 1 1 91 91 ALA H H 1 8.43 0.02 . 1 . . . . 376 ALA H . 18580 1 731 . 1 1 91 91 ALA HA H 1 4.317 0.02 . 1 . . . . 376 ALA HA . 18580 1 732 . 1 1 91 91 ALA HB1 H 1 1.427 0.02 . 1 . . . . 376 ALA HB . 18580 1 733 . 1 1 91 91 ALA HB2 H 1 1.427 0.02 . 1 . . . . 376 ALA HB . 18580 1 734 . 1 1 91 91 ALA HB3 H 1 1.427 0.02 . 1 . . . . 376 ALA HB . 18580 1 735 . 1 1 91 91 ALA C C 13 178.04 0.3 . 1 . . . . 376 ALA CO . 18580 1 736 . 1 1 91 91 ALA CA C 13 52.98 0.3 . 1 . . . . 376 ALA CA . 18580 1 737 . 1 1 91 91 ALA CB C 13 19.18 0.3 . 1 . . . . 376 ALA CB . 18580 1 738 . 1 1 91 91 ALA N N 15 125.65 0.3 . 1 . . . . 376 ALA N . 18580 1 739 . 1 1 92 92 THR H H 1 8.03 0.02 . 1 . . . . 377 THR H . 18580 1 740 . 1 1 92 92 THR HA H 1 4.229 0.02 . 1 . . . . 377 THR HA . 18580 1 741 . 1 1 92 92 THR HB H 1 4.182 0.02 . 1 . . . . 377 THR HB . 18580 1 742 . 1 1 92 92 THR HG21 H 1 1.161 0.02 . 1 . . . . 377 THR HG2 . 18580 1 743 . 1 1 92 92 THR HG22 H 1 1.161 0.02 . 1 . . . . 377 THR HG2 . 18580 1 744 . 1 1 92 92 THR HG23 H 1 1.161 0.02 . 1 . . . . 377 THR HG2 . 18580 1 745 . 1 1 92 92 THR C C 13 174.58 0.3 . 1 . . . . 377 THR CO . 18580 1 746 . 1 1 92 92 THR CA C 13 62.38 0.3 . 1 . . . . 377 THR CA . 18580 1 747 . 1 1 92 92 THR CB C 13 69.7 0.3 . 1 . . . . 377 THR CB . 18580 1 748 . 1 1 92 92 THR CG2 C 13 21.865 0.3 . 1 . . . . 377 THR CG . 18580 1 749 . 1 1 92 92 THR N N 15 112.96 0.3 . 1 . . . . 377 THR N . 18580 1 750 . 1 1 93 93 GLU H H 1 8.33 0.02 . 1 . . . . 378 GLU H . 18580 1 751 . 1 1 93 93 GLU HA H 1 4.23 0.02 . 1 . . . . 378 GLU HA . 18580 1 752 . 1 1 93 93 GLU HB2 H 1 1.972 0.02 . 2 . . . . 378 GLU HB2 . 18580 1 753 . 1 1 93 93 GLU HB3 H 1 1.892 0.02 . 2 . . . . 378 GLU HB3 . 18580 1 754 . 1 1 93 93 GLU HG2 H 1 2.175 0.02 . 1 . . . . 378 GLU HG . 18580 1 755 . 1 1 93 93 GLU HG3 H 1 2.175 0.02 . 1 . . . . 378 GLU HG . 18580 1 756 . 1 1 93 93 GLU C C 13 176.25 0.3 . 1 . . . . 378 GLU CO . 18580 1 757 . 1 1 93 93 GLU CA C 13 56.9 0.3 . 1 . . . . 378 GLU CA . 18580 1 758 . 1 1 93 93 GLU CB C 13 30.35 0.3 . 1 . . . . 378 GLU CB . 18580 1 759 . 1 1 93 93 GLU CG C 13 36.35 0.3 . 1 . . . . 378 GLU CG . 18580 1 760 . 1 1 93 93 GLU N N 15 122.63 0.3 . 1 . . . . 378 GLU N . 18580 1 761 . 1 1 94 94 TYR H H 1 8.16 0.02 . 1 . . . . 379 TYR H . 18580 1 762 . 1 1 94 94 TYR HA H 1 4.541 0.02 . 1 . . . . 379 TYR HA . 18580 1 763 . 1 1 94 94 TYR HB2 H 1 2.982 0.02 . 1 . . . . 379 TYR HB . 18580 1 764 . 1 1 94 94 TYR HB3 H 1 2.982 0.02 . 1 . . . . 379 TYR HB . 18580 1 765 . 1 1 94 94 TYR C C 13 175.85 0.3 . 1 . . . . 379 TYR CO . 18580 1 766 . 1 1 94 94 TYR CA C 13 58.35 0.3 . 1 . . . . 379 TYR CA . 18580 1 767 . 1 1 94 94 TYR CB C 13 38.81 0.3 . 1 . . . . 379 TYR CB . 18580 1 768 . 1 1 94 94 TYR N N 15 121.3 0.3 . 1 . . . . 379 TYR N . 18580 1 769 . 1 1 95 95 VAL H H 1 8.0 0.02 . 1 . . . . 380 VAL H . 18580 1 770 . 1 1 95 95 VAL HA H 1 3.968 0.02 . 1 . . . . 380 VAL HA . 18580 1 771 . 1 1 95 95 VAL HB H 1 2.016 0.02 . 1 . . . . 380 VAL HB . 18580 1 772 . 1 1 95 95 VAL HG11 H 1 0.903 0.02 . 2 . . . . 380 VAL HG1 . 18580 1 773 . 1 1 95 95 VAL HG12 H 1 0.903 0.02 . 2 . . . . 380 VAL HG1 . 18580 1 774 . 1 1 95 95 VAL HG13 H 1 0.903 0.02 . 2 . . . . 380 VAL HG1 . 18580 1 775 . 1 1 95 95 VAL C C 13 176.14 0.3 . 1 . . . . 380 VAL CO . 18580 1 776 . 1 1 95 95 VAL CA C 13 62.79 0.3 . 1 . . . . 380 VAL CA . 18580 1 777 . 1 1 95 95 VAL CB C 13 32.83 0.3 . 1 . . . . 380 VAL CB . 18580 1 778 . 1 1 95 95 VAL CG1 C 13 21.053 0.3 . 2 . . . . 380 VAL CG1 . 18580 1 779 . 1 1 95 95 VAL N N 15 122.09 0.3 . 1 . . . . 380 VAL N . 18580 1 780 . 1 1 96 96 LEU H H 1 8.21 0.02 . 1 . . . . 381 LEU H . 18580 1 781 . 1 1 96 96 LEU HA H 1 4.281 0.02 . 1 . . . . 381 LEU HA . 18580 1 782 . 1 1 96 96 LEU HB2 H 1 1.634 0.02 . 2 . . . . 381 LEU HB2 . 18580 1 783 . 1 1 96 96 LEU HB3 H 1 1.561 0.02 . 2 . . . . 381 LEU HB3 . 18580 1 784 . 1 1 96 96 LEU HD11 H 1 0.942 0.02 . 2 . . . . 381 LEU HD1 . 18580 1 785 . 1 1 96 96 LEU HD12 H 1 0.942 0.02 . 2 . . . . 381 LEU HD1 . 18580 1 786 . 1 1 96 96 LEU HD13 H 1 0.942 0.02 . 2 . . . . 381 LEU HD1 . 18580 1 787 . 1 1 96 96 LEU HD21 H 1 0.874 0.02 . 2 . . . . 381 LEU HD2 . 18580 1 788 . 1 1 96 96 LEU HD22 H 1 0.874 0.02 . 2 . . . . 381 LEU HD2 . 18580 1 789 . 1 1 96 96 LEU HD23 H 1 0.874 0.02 . 2 . . . . 381 LEU HD2 . 18580 1 790 . 1 1 96 96 LEU C C 13 177.57 0.3 . 1 . . . . 381 LEU CO . 18580 1 791 . 1 1 96 96 LEU CA C 13 55.65 0.3 . 1 . . . . 381 LEU CA . 18580 1 792 . 1 1 96 96 LEU CB C 13 42.31 0.3 . 1 . . . . 381 LEU CB . 18580 1 793 . 1 1 96 96 LEU CD1 C 13 24.97 0.3 . 2 . . . . 381 LEU CD1 . 18580 1 794 . 1 1 96 96 LEU CD2 C 13 23.721 0.3 . 2 . . . . 381 LEU CD2 . 18580 1 795 . 1 1 96 96 LEU N N 15 125.21 0.3 . 1 . . . . 381 LEU N . 18580 1 796 . 1 1 97 97 SER H H 1 8.22 0.02 . 1 . . . . 382 SER H . 18580 1 797 . 1 1 97 97 SER HA H 1 4.413 0.02 . 1 . . . . 382 SER HA . 18580 1 798 . 1 1 97 97 SER HB2 H 1 3.86 0.02 . 1 . . . . 382 SER HB . 18580 1 799 . 1 1 97 97 SER HB3 H 1 3.86 0.02 . 1 . . . . 382 SER HB . 18580 1 800 . 1 1 97 97 SER C C 13 174.64 0.3 . 1 . . . . 382 SER CO . 18580 1 801 . 1 1 97 97 SER CA C 13 58.51 0.3 . 1 . . . . 382 SER CA . 18580 1 802 . 1 1 97 97 SER CB C 13 63.69 0.3 . 1 . . . . 382 SER CB . 18580 1 803 . 1 1 97 97 SER N N 15 116.79 0.3 . 1 . . . . 382 SER N . 18580 1 804 . 1 1 98 98 LEU H H 1 8.13 0.02 . 1 . . . . 383 LEU H . 18580 1 805 . 1 1 98 98 LEU HA H 1 4.317 0.02 . 1 . . . . 383 LEU HA . 18580 1 806 . 1 1 98 98 LEU HB2 H 1 1.635 0.02 . 2 . . . . 383 LEU HB2 . 18580 1 807 . 1 1 98 98 LEU HB3 H 1 1.575 0.02 . 2 . . . . 383 LEU HB3 . 18580 1 808 . 1 1 98 98 LEU HD11 H 1 0.861 0.02 . 1 . . . . 383 LEU HD . 18580 1 809 . 1 1 98 98 LEU HD12 H 1 0.861 0.02 . 1 . . . . 383 LEU HD . 18580 1 810 . 1 1 98 98 LEU HD13 H 1 0.861 0.02 . 1 . . . . 383 LEU HD . 18580 1 811 . 1 1 98 98 LEU HD21 H 1 0.861 0.02 . 1 . . . . 383 LEU HD . 18580 1 812 . 1 1 98 98 LEU HD22 H 1 0.861 0.02 . 1 . . . . 383 LEU HD . 18580 1 813 . 1 1 98 98 LEU HD23 H 1 0.861 0.02 . 1 . . . . 383 LEU HD . 18580 1 814 . 1 1 98 98 LEU C C 13 177.57 0.3 . 1 . . . . 383 LEU CO . 18580 1 815 . 1 1 98 98 LEU CA C 13 55.45 0.3 . 1 . . . . 383 LEU CA . 18580 1 816 . 1 1 98 98 LEU CB C 13 42.26 0.3 . 1 . . . . 383 LEU CB . 18580 1 817 . 1 1 98 98 LEU CD1 C 13 25.009 0.3 . 1 . . . . 383 LEU CD . 18580 1 818 . 1 1 98 98 LEU CD2 C 13 25.009 0.3 . 1 . . . . 383 LEU CD . 18580 1 819 . 1 1 98 98 LEU N N 15 123.92 0.3 . 1 . . . . 383 LEU N . 18580 1 820 . 1 1 99 99 GLN H H 1 8.27 0.02 . 1 . . . . 384 GLN H . 18580 1 821 . 1 1 99 99 GLN HA H 1 4.34 0.02 . 1 . . . . 384 GLN HA . 18580 1 822 . 1 1 99 99 GLN HB2 H 1 2.131 0.02 . 2 . . . . 384 GLN HB2 . 18580 1 823 . 1 1 99 99 GLN HB3 H 1 1.986 0.02 . 2 . . . . 384 GLN HB3 . 18580 1 824 . 1 1 99 99 GLN HG2 H 1 2.362 0.02 . 2 . . . . 384 GLN HG2 . 18580 1 825 . 1 1 99 99 GLN C C 13 176.18 0.3 . 1 . . . . 384 GLN CO . 18580 1 826 . 1 1 99 99 GLN CA C 13 56.07 0.3 . 1 . . . . 384 GLN CA . 18580 1 827 . 1 1 99 99 GLN CB C 13 29.41 0.3 . 1 . . . . 384 GLN CB . 18580 1 828 . 1 1 99 99 GLN CG C 13 33.945 0.3 . 1 . . . . 384 GLN CG . 18580 1 829 . 1 1 99 99 GLN N N 15 120.3 0.3 . 1 . . . . 384 GLN N . 18580 1 830 . 1 1 100 100 SER H H 1 8.29 0.02 . 1 . . . . 385 SER H . 18580 1 831 . 1 1 100 100 SER HA H 1 4.427 0.02 . 1 . . . . 385 SER HA . 18580 1 832 . 1 1 100 100 SER HB2 H 1 3.982 0.02 . 2 . . . . 385 SER HB2 . 18580 1 833 . 1 1 100 100 SER HB3 H 1 3.873 0.02 . 2 . . . . 385 SER HB3 . 18580 1 834 . 1 1 100 100 SER C C 13 174.74 0.3 . 1 . . . . 385 SER CO . 18580 1 835 . 1 1 100 100 SER CA C 13 58.58 0.3 . 1 . . . . 385 SER CA . 18580 1 836 . 1 1 100 100 SER CB C 13 63.99 0.3 . 1 . . . . 385 SER CB . 18580 1 837 . 1 1 100 100 SER N N 15 116.86 0.3 . 1 . . . . 385 SER N . 18580 1 838 . 1 1 101 101 ASP H H 1 8.48 0.02 . 1 . . . . 386 ASP H . 18580 1 839 . 1 1 101 101 ASP HA H 1 4.583 0.02 . 1 . . . . 386 ASP HA . 18580 1 840 . 1 1 101 101 ASP HB2 H 1 2.697 0.02 . 1 . . . . 386 ASP HB . 18580 1 841 . 1 1 101 101 ASP HB3 H 1 2.697 0.02 . 1 . . . . 386 ASP HB . 18580 1 842 . 1 1 101 101 ASP C C 13 177.15 0.3 . 1 . . . . 386 ASP CO . 18580 1 843 . 1 1 101 101 ASP CA C 13 55.25 0.3 . 1 . . . . 386 ASP CA . 18580 1 844 . 1 1 101 101 ASP CB C 13 40.97 0.3 . 1 . . . . 386 ASP CB . 18580 1 845 . 1 1 101 101 ASP N N 15 122.68 0.3 . 1 . . . . 386 ASP N . 18580 1 846 . 1 1 102 102 GLU H H 1 8.44 0.02 . 1 . . . . 387 GLU H . 18580 1 847 . 1 1 102 102 GLU HA H 1 4.102 0.02 . 1 . . . . 387 GLU HA . 18580 1 848 . 1 1 102 102 GLU HB2 H 1 1.963 0.02 . 1 . . . . 387 GLU HB . 18580 1 849 . 1 1 102 102 GLU HB3 H 1 1.963 0.02 . 1 . . . . 387 GLU HB . 18580 1 850 . 1 1 102 102 GLU HG2 H 1 2.184 0.02 . 1 . . . . 387 GLU HG . 18580 1 851 . 1 1 102 102 GLU HG3 H 1 2.184 0.02 . 1 . . . . 387 GLU HG . 18580 1 852 . 1 1 102 102 GLU C C 13 177.5 0.3 . 1 . . . . 387 GLU CO . 18580 1 853 . 1 1 102 102 GLU CA C 13 58.32 0.3 . 1 . . . . 387 GLU CA . 18580 1 854 . 1 1 102 102 GLU CB C 13 29.78 0.3 . 1 . . . . 387 GLU CB . 18580 1 855 . 1 1 102 102 GLU CG C 13 36.198 0.3 . 1 . . . . 387 GLU CG . 18580 1 856 . 1 1 102 102 GLU N N 15 121.2 0.3 . 1 . . . . 387 GLU N . 18580 1 857 . 1 1 103 103 HIS H H 1 8.27 0.02 . 1 . . . . 388 HIS H . 18580 1 858 . 1 1 103 103 HIS HA H 1 4.457 0.02 . 1 . . . . 388 HIS HA . 18580 1 859 . 1 1 103 103 HIS HB2 H 1 3.217 0.02 . 1 . . . . 388 HIS HB . 18580 1 860 . 1 1 103 103 HIS HB3 H 1 3.217 0.02 . 1 . . . . 388 HIS HB . 18580 1 861 . 1 1 103 103 HIS C C 13 176.51 0.3 . 1 . . . . 388 HIS CO . 18580 1 862 . 1 1 103 103 HIS CA C 13 57.74 0.3 . 1 . . . . 388 HIS CA . 18580 1 863 . 1 1 103 103 HIS CB C 13 29.68 0.3 . 1 . . . . 388 HIS CB . 18580 1 864 . 1 1 103 103 HIS N N 15 118.6 0.3 . 1 . . . . 388 HIS N . 18580 1 865 . 1 1 104 104 LYS H H 1 8.05 0.02 . 1 . . . . 389 LYS H . 18580 1 866 . 1 1 104 104 LYS HA H 1 4.159 0.02 . 1 . . . . 389 LYS HA . 18580 1 867 . 1 1 104 104 LYS HB2 H 1 1.846 0.02 . 1 . . . . 389 LYS HB . 18580 1 868 . 1 1 104 104 LYS HB3 H 1 1.846 0.02 . 1 . . . . 389 LYS HB . 18580 1 869 . 1 1 104 104 LYS C C 13 177.5 0.3 . 1 . . . . 389 LYS CO . 18580 1 870 . 1 1 104 104 LYS CA C 13 58.07 0.3 . 1 . . . . 389 LYS CA . 18580 1 871 . 1 1 104 104 LYS CB C 13 32.8 0.3 . 1 . . . . 389 LYS CB . 18580 1 872 . 1 1 104 104 LYS N N 15 121.1 0.3 . 1 . . . . 389 LYS N . 18580 1 873 . 1 1 105 105 LEU H H 1 8.01 0.02 . 1 . . . . 390 LEU H . 18580 1 874 . 1 1 105 105 LEU HA H 1 4.253 0.02 . 1 . . . . 390 LEU HA . 18580 1 875 . 1 1 105 105 LEU HB2 H 1 1.752 0.02 . 2 . . . . 390 LEU HB2 . 18580 1 876 . 1 1 105 105 LEU HB3 H 1 1.623 0.02 . 2 . . . . 390 LEU HB3 . 18580 1 877 . 1 1 105 105 LEU HD11 H 1 0.916 0.02 . 2 . . . . 390 LEU HD1 . 18580 1 878 . 1 1 105 105 LEU HD12 H 1 0.916 0.02 . 2 . . . . 390 LEU HD1 . 18580 1 879 . 1 1 105 105 LEU HD13 H 1 0.916 0.02 . 2 . . . . 390 LEU HD1 . 18580 1 880 . 1 1 105 105 LEU HD21 H 1 0.881 0.02 . 2 . . . . 390 LEU HD2 . 18580 1 881 . 1 1 105 105 LEU HD22 H 1 0.881 0.02 . 2 . . . . 390 LEU HD2 . 18580 1 882 . 1 1 105 105 LEU HD23 H 1 0.881 0.02 . 2 . . . . 390 LEU HD2 . 18580 1 883 . 1 1 105 105 LEU C C 13 178.565 0.3 . 1 . . . . 390 LEU CO . 18580 1 884 . 1 1 105 105 LEU CA C 13 56.617 0.3 . 1 . . . . 390 LEU CA . 18580 1 885 . 1 1 105 105 LEU CB C 13 41.986 0.3 . 1 . . . . 390 LEU CB . 18580 1 886 . 1 1 105 105 LEU CD1 C 13 24.918 0.3 . 2 . . . . 390 LEU CD1 . 18580 1 887 . 1 1 105 105 LEU CD2 C 13 23.623 0.3 . 2 . . . . 390 LEU CD2 . 18580 1 888 . 1 1 105 105 LEU N N 15 121.23 0.3 . 1 . . . . 390 LEU N . 18580 1 889 . 1 1 106 106 ILE H H 1 7.95 0.02 . 1 . . . . 391 ILE H . 18580 1 890 . 1 1 106 106 ILE HA H 1 3.899 0.02 . 1 . . . . 391 ILE HA . 18580 1 891 . 1 1 106 106 ILE HB H 1 1.877 0.02 . 1 . . . . 391 ILE HB . 18580 1 892 . 1 1 106 106 ILE C C 13 177.38 0.3 . 1 . . . . 391 ILE CO . 18580 1 893 . 1 1 106 106 ILE CA C 13 63.08 0.3 . 1 . . . . 391 ILE CA . 18580 1 894 . 1 1 106 106 ILE CB C 13 38.29 0.3 . 1 . . . . 391 ILE CB . 18580 1 895 . 1 1 106 106 ILE N N 15 120.88 0.3 . 1 . . . . 391 ILE N . 18580 1 896 . 1 1 107 107 ALA H H 1 8.16 0.02 . 1 . . . . 392 ALA H . 18580 1 897 . 1 1 107 107 ALA HA H 1 4.233 0.02 . 1 . . . . 392 ALA HA . 18580 1 898 . 1 1 107 107 ALA HB1 H 1 1.453 0.02 . 1 . . . . 392 ALA HB . 18580 1 899 . 1 1 107 107 ALA HB2 H 1 1.453 0.02 . 1 . . . . 392 ALA HB . 18580 1 900 . 1 1 107 107 ALA HB3 H 1 1.453 0.02 . 1 . . . . 392 ALA HB . 18580 1 901 . 1 1 107 107 ALA C C 13 179.62 0.3 . 1 . . . . 392 ALA CO . 18580 1 902 . 1 1 107 107 ALA CA C 13 54.08 0.3 . 1 . . . . 392 ALA CA . 18580 1 903 . 1 1 107 107 ALA CB C 13 18.56 0.3 . 1 . . . . 392 ALA CB . 18580 1 904 . 1 1 107 107 ALA N N 15 125.12 0.3 . 1 . . . . 392 ALA N . 18580 1 905 . 1 1 108 108 GLU H H 1 8.33 0.02 . 1 . . . . 393 GLU H . 18580 1 906 . 1 1 108 108 GLU HA H 1 4.117 0.02 . 1 . . . . 393 GLU HA . 18580 1 907 . 1 1 108 108 GLU HB2 H 1 2.102 0.02 . 1 . . . . 393 GLU HB . 18580 1 908 . 1 1 108 108 GLU HB3 H 1 2.102 0.02 . 1 . . . . 393 GLU HB . 18580 1 909 . 1 1 108 108 GLU HG2 H 1 2.373 0.02 . 2 . . . . 393 GLU HG2 . 18580 1 910 . 1 1 108 108 GLU HG3 H 1 2.277 0.02 . 2 . . . . 393 GLU HG3 . 18580 1 911 . 1 1 108 108 GLU C C 13 178.492 0.3 . 1 . . . . 393 GLU CO . 18580 1 912 . 1 1 108 108 GLU CA C 13 58.751 0.3 . 1 . . . . 393 GLU CA . 18580 1 913 . 1 1 108 108 GLU CB C 13 29.797 0.3 . 1 . . . . 393 GLU CB . 18580 1 914 . 1 1 108 108 GLU CG C 13 36.385 0.3 . 1 . . . . 393 GLU CG . 18580 1 915 . 1 1 108 108 GLU N N 15 120.01 0.3 . 1 . . . . 393 GLU N . 18580 1 916 . 1 1 109 109 LYS H H 1 8.216 0.02 . 1 . . . . 394 LYS H . 18580 1 917 . 1 1 109 109 LYS HA H 1 4.09 0.02 . 1 . . . . 394 LYS HA . 18580 1 918 . 1 1 109 109 LYS HB2 H 1 1.925 0.02 . 1 . . . . 394 LYS HB . 18580 1 919 . 1 1 109 109 LYS HB3 H 1 1.925 0.02 . 1 . . . . 394 LYS HB . 18580 1 920 . 1 1 109 109 LYS C C 13 178.965 0.3 . 1 . . . . 394 LYS CO . 18580 1 921 . 1 1 109 109 LYS CA C 13 59.122 0.3 . 1 . . . . 394 LYS CA . 18580 1 922 . 1 1 109 109 LYS CB C 13 32.464 0.3 . 1 . . . . 394 LYS CB . 18580 1 923 . 1 1 109 109 LYS N N 15 120.219 0.3 . 1 . . . . 394 LYS N . 18580 1 924 . 1 1 110 110 GLU H H 1 8.18 0.02 . 1 . . . . 395 GLU H . 18580 1 925 . 1 1 110 110 GLU HA H 1 4.252 0.02 . 1 . . . . 395 GLU HA . 18580 1 926 . 1 1 110 110 GLU HB2 H 1 2.121 0.02 . 2 . . . . 395 GLU HB2 . 18580 1 927 . 1 1 110 110 GLU HB3 H 1 2.058 0.02 . 2 . . . . 395 GLU HB3 . 18580 1 928 . 1 1 110 110 GLU HG2 H 1 2.323 0.02 . 1 . . . . 395 GLU HG . 18580 1 929 . 1 1 110 110 GLU HG3 H 1 2.323 0.02 . 1 . . . . 395 GLU HG . 18580 1 930 . 1 1 110 110 GLU C C 13 178.242 0.3 . 1 . . . . 395 GLU CO . 18580 1 931 . 1 1 110 110 GLU CA C 13 58.386 0.3 . 1 . . . . 395 GLU CA . 18580 1 932 . 1 1 110 110 GLU CB C 13 29.283 0.3 . 1 . . . . 395 GLU CB . 18580 1 933 . 1 1 110 110 GLU CG C 13 35.877 0.3 . 1 . . . . 395 GLU CG . 18580 1 934 . 1 1 110 110 GLU N N 15 120.775 0.3 . 1 . . . . 395 GLU N . 18580 1 935 . 1 1 111 111 GLN H H 1 8.173 0.02 . 1 . . . . 396 GLN H . 18580 1 936 . 1 1 111 111 GLN HA H 1 4.087 0.02 . 1 . . . . 396 GLN HA . 18580 1 937 . 1 1 111 111 GLN HB2 H 1 2.567 0.02 . 1 . . . . 396 GLN HB . 18580 1 938 . 1 1 111 111 GLN HB3 H 1 2.567 0.02 . 1 . . . . 396 GLN HB . 18580 1 939 . 1 1 111 111 GLN HG2 H 1 2.43 0.02 . 1 . . . . 396 GLN HG . 18580 1 940 . 1 1 111 111 GLN HG3 H 1 2.43 0.02 . 1 . . . . 396 GLN HG . 18580 1 941 . 1 1 111 111 GLN C C 13 178.381 0.3 . 1 . . . . 396 GLN CO . 18580 1 942 . 1 1 111 111 GLN CA C 13 58.45 0.3 . 1 . . . . 396 GLN CA . 18580 1 943 . 1 1 111 111 GLN CB C 13 28.453 0.3 . 1 . . . . 396 GLN CB . 18580 1 944 . 1 1 111 111 GLN CG C 13 33.86 0.3 . 1 . . . . 396 GLN CG . 18580 1 945 . 1 1 111 111 GLN N N 15 119.749 0.3 . 1 . . . . 396 GLN N . 18580 1 946 . 1 1 112 112 LEU H H 1 8.017 0.02 . 1 . . . . 397 LEU H . 18580 1 947 . 1 1 112 112 LEU HA H 1 4.125 0.02 . 1 . . . . 397 LEU HA . 18580 1 948 . 1 1 112 112 LEU HB2 H 1 1.789 0.02 . 2 . . . . 397 LEU HB2 . 18580 1 949 . 1 1 112 112 LEU HB3 H 1 1.649 0.02 . 2 . . . . 397 LEU HB3 . 18580 1 950 . 1 1 112 112 LEU HG H 1 1.713 0.02 . 1 . . . . 397 LEU HG . 18580 1 951 . 1 1 112 112 LEU HD11 H 1 0.953 0.02 . 2 . . . . 397 LEU HD1 . 18580 1 952 . 1 1 112 112 LEU HD12 H 1 0.953 0.02 . 2 . . . . 397 LEU HD1 . 18580 1 953 . 1 1 112 112 LEU HD13 H 1 0.953 0.02 . 2 . . . . 397 LEU HD1 . 18580 1 954 . 1 1 112 112 LEU HD21 H 1 0.886 0.02 . 2 . . . . 397 LEU HD2 . 18580 1 955 . 1 1 112 112 LEU HD22 H 1 0.886 0.02 . 2 . . . . 397 LEU HD2 . 18580 1 956 . 1 1 112 112 LEU HD23 H 1 0.886 0.02 . 2 . . . . 397 LEU HD2 . 18580 1 957 . 1 1 112 112 LEU C C 13 178.812 0.3 . 1 . . . . 397 LEU CO . 18580 1 958 . 1 1 112 112 LEU CA C 13 57.476 0.3 . 1 . . . . 397 LEU CA . 18580 1 959 . 1 1 112 112 LEU CB C 13 41.778 0.3 . 1 . . . . 397 LEU CB . 18580 1 960 . 1 1 112 112 LEU CG C 13 27.008 0.3 . 1 . . . . 397 LEU CG . 18580 1 961 . 1 1 112 112 LEU CD1 C 13 24.79 0.3 . 2 . . . . 397 LEU CD1 . 18580 1 962 . 1 1 112 112 LEU CD2 C 13 23.749 0.3 . 2 . . . . 397 LEU CD2 . 18580 1 963 . 1 1 112 112 LEU N N 15 120.626 0.3 . 1 . . . . 397 LEU N . 18580 1 964 . 1 1 113 113 ARG H H 1 7.97 0.02 . 1 . . . . 398 ARG H . 18580 1 965 . 1 1 113 113 ARG HA H 1 4.039 0.02 . 1 . . . . 398 ARG HA . 18580 1 966 . 1 1 113 113 ARG HB2 H 1 1.935 0.02 . 1 . . . . 398 ARG HB . 18580 1 967 . 1 1 113 113 ARG HB3 H 1 1.935 0.02 . 1 . . . . 398 ARG HB . 18580 1 968 . 1 1 113 113 ARG HD2 H 1 3.209 0.02 . 1 . . . . 398 ARG HD . 18580 1 969 . 1 1 113 113 ARG HD3 H 1 3.209 0.02 . 1 . . . . 398 ARG HD . 18580 1 970 . 1 1 113 113 ARG C C 13 178.369 0.3 . 1 . . . . 398 ARG CO . 18580 1 971 . 1 1 113 113 ARG CA C 13 58.991 0.3 . 1 . . . . 398 ARG CA . 18580 1 972 . 1 1 113 113 ARG CB C 13 30.08 0.3 . 1 . . . . 398 ARG CB . 18580 1 973 . 1 1 113 113 ARG CD C 13 43.223 0.3 . 1 . . . . 398 ARG CD . 18580 1 974 . 1 1 113 113 ARG N N 15 120.549 0.3 . 1 . . . . 398 ARG N . 18580 1 975 . 1 1 114 114 ARG H H 1 8.179 0.02 . 1 . . . . 399 ARG H . 18580 1 976 . 1 1 114 114 ARG HA H 1 4.095 0.02 . 1 . . . . 399 ARG HA . 18580 1 977 . 1 1 114 114 ARG HB2 H 1 1.889 0.02 . 1 . . . . 399 ARG HB . 18580 1 978 . 1 1 114 114 ARG HB3 H 1 1.889 0.02 . 1 . . . . 399 ARG HB . 18580 1 979 . 1 1 114 114 ARG HD2 H 1 3.214 0.02 . 1 . . . . 399 ARG HD . 18580 1 980 . 1 1 114 114 ARG HD3 H 1 3.214 0.02 . 1 . . . . 399 ARG HD . 18580 1 981 . 1 1 114 114 ARG C C 13 178.451 0.3 . 1 . . . . 399 ARG CO . 18580 1 982 . 1 1 114 114 ARG CA C 13 58.567 0.3 . 1 . . . . 399 ARG CA . 18580 1 983 . 1 1 114 114 ARG CB C 13 30.247 0.3 . 1 . . . . 399 ARG CB . 18580 1 984 . 1 1 114 114 ARG CD C 13 43.526 0.3 . 1 . . . . 399 ARG CD . 18580 1 985 . 1 1 114 114 ARG N N 15 119.136 0.3 . 1 . . . . 399 ARG N . 18580 1 986 . 1 1 115 115 ARG H H 1 8.096 0.02 . 1 . . . . 400 ARG H . 18580 1 987 . 1 1 115 115 ARG HA H 1 4.17 0.02 . 1 . . . . 400 ARG HA . 18580 1 988 . 1 1 115 115 ARG HB2 H 1 1.945 0.02 . 1 . . . . 400 ARG HB . 18580 1 989 . 1 1 115 115 ARG HB3 H 1 1.945 0.02 . 1 . . . . 400 ARG HB . 18580 1 990 . 1 1 115 115 ARG HD2 H 1 3.204 0.02 . 1 . . . . 400 ARG HD . 18580 1 991 . 1 1 115 115 ARG HD3 H 1 3.204 0.02 . 1 . . . . 400 ARG HD . 18580 1 992 . 1 1 115 115 ARG C C 13 178.174 0.3 . 1 . . . . 400 ARG CO . 18580 1 993 . 1 1 115 115 ARG CA C 13 58.415 0.3 . 1 . . . . 400 ARG CA . 18580 1 994 . 1 1 115 115 ARG CB C 13 30.28 0.3 . 1 . . . . 400 ARG CB . 18580 1 995 . 1 1 115 115 ARG CD C 13 43.564 0.3 . 1 . . . . 400 ARG CD . 18580 1 996 . 1 1 115 115 ARG N N 15 120.279 0.3 . 1 . . . . 400 ARG N . 18580 1 997 . 1 1 116 116 ARG H H 1 8.191 0.02 . 1 . . . . 401 ARG H . 18580 1 998 . 1 1 116 116 ARG HA H 1 4.116 0.02 . 1 . . . . 401 ARG HA . 18580 1 999 . 1 1 116 116 ARG HB2 H 1 1.931 0.02 . 1 . . . . 401 ARG HB . 18580 1 1000 . 1 1 116 116 ARG HB3 H 1 1.931 0.02 . 1 . . . . 401 ARG HB . 18580 1 1001 . 1 1 116 116 ARG HD2 H 1 3.213 0.02 . 1 . . . . 401 ARG HD . 18580 1 1002 . 1 1 116 116 ARG HD3 H 1 3.213 0.02 . 1 . . . . 401 ARG HD . 18580 1 1003 . 1 1 116 116 ARG C C 13 178.435 0.3 . 1 . . . . 401 ARG CO . 18580 1 1004 . 1 1 116 116 ARG CA C 13 58.667 0.3 . 1 . . . . 401 ARG CA . 18580 1 1005 . 1 1 116 116 ARG CB C 13 30.241 0.3 . 1 . . . . 401 ARG CB . 18580 1 1006 . 1 1 116 116 ARG CD C 13 43.503 0.3 . 1 . . . . 401 ARG CD . 18580 1 1007 . 1 1 116 116 ARG N N 15 120.053 0.3 . 1 . . . . 401 ARG N . 18580 1 1008 . 1 1 117 117 GLU H H 1 8.225 0.02 . 1 . . . . 402 GLU H . 18580 1 1009 . 1 1 117 117 GLU HA H 1 4.119 0.02 . 1 . . . . 402 GLU HA . 18580 1 1010 . 1 1 117 117 GLU HB2 H 1 2.086 0.02 . 1 . . . . 402 GLU HB . 18580 1 1011 . 1 1 117 117 GLU HB3 H 1 2.086 0.02 . 1 . . . . 402 GLU HB . 18580 1 1012 . 1 1 117 117 GLU HG2 H 1 2.335 0.02 . 1 . . . . 402 GLU HG . 18580 1 1013 . 1 1 117 117 GLU HG3 H 1 2.335 0.02 . 1 . . . . 402 GLU HG . 18580 1 1014 . 1 1 117 117 GLU C C 13 177.988 0.3 . 1 . . . . 402 GLU CO . 18580 1 1015 . 1 1 117 117 GLU CA C 13 58.281 0.3 . 1 . . . . 402 GLU CA . 18580 1 1016 . 1 1 117 117 GLU CB C 13 29.8 0.3 . 1 . . . . 402 GLU CB . 18580 1 1017 . 1 1 117 117 GLU CG C 13 36.404 0.3 . 1 . . . . 402 GLU CG . 18580 1 1018 . 1 1 117 117 GLU N N 15 120.012 0.3 . 1 . . . . 402 GLU N . 18580 1 1019 . 1 1 118 118 GLN H H 1 8.118 0.02 . 1 . . . . 403 GLN H . 18580 1 1020 . 1 1 118 118 GLN HA H 1 4.183 0.02 . 1 . . . . 403 GLN HA . 18580 1 1021 . 1 1 118 118 GLN HB2 H 1 2.157 0.02 . 1 . . . . 403 GLN HB . 18580 1 1022 . 1 1 118 118 GLN HB3 H 1 2.157 0.02 . 1 . . . . 403 GLN HB . 18580 1 1023 . 1 1 118 118 GLN HG2 H 1 2.451 0.02 . 1 . . . . 403 GLN HG . 18580 1 1024 . 1 1 118 118 GLN HG3 H 1 2.451 0.02 . 1 . . . . 403 GLN HG . 18580 1 1025 . 1 1 118 118 GLN C C 13 177.374 0.3 . 1 . . . . 403 GLN CO . 18580 1 1026 . 1 1 118 118 GLN CA C 13 57.545 0.3 . 1 . . . . 403 GLN CA . 18580 1 1027 . 1 1 118 118 GLN CB C 13 28.901 0.3 . 1 . . . . 403 GLN CB . 18580 1 1028 . 1 1 118 118 GLN CG C 13 33.962 0.3 . 1 . . . . 403 GLN CG . 18580 1 1029 . 1 1 118 118 GLN N N 15 119.827 0.3 . 1 . . . . 403 GLN N . 18580 1 1030 . 1 1 119 119 LEU H H 1 7.997 0.02 . 1 . . . . 404 LEU H . 18580 1 1031 . 1 1 119 119 LEU HA H 1 4.222 0.02 . 1 . . . . 404 LEU HA . 18580 1 1032 . 1 1 119 119 LEU HB2 H 1 1.736 0.02 . 2 . . . . 404 LEU HB2 . 18580 1 1033 . 1 1 119 119 LEU HB3 H 1 1.603 0.02 . 2 . . . . 404 LEU HB3 . 18580 1 1034 . 1 1 119 119 LEU HD11 H 1 0.943 0.02 . 2 . . . . 404 LEU HD1 . 18580 1 1035 . 1 1 119 119 LEU HD12 H 1 0.943 0.02 . 2 . . . . 404 LEU HD1 . 18580 1 1036 . 1 1 119 119 LEU HD13 H 1 0.943 0.02 . 2 . . . . 404 LEU HD1 . 18580 1 1037 . 1 1 119 119 LEU HD21 H 1 0.862 0.02 . 2 . . . . 404 LEU HD2 . 18580 1 1038 . 1 1 119 119 LEU HD22 H 1 0.862 0.02 . 2 . . . . 404 LEU HD2 . 18580 1 1039 . 1 1 119 119 LEU HD23 H 1 0.862 0.02 . 2 . . . . 404 LEU HD2 . 18580 1 1040 . 1 1 119 119 LEU C C 13 178.254 0.3 . 1 . . . . 404 LEU CO . 18580 1 1041 . 1 1 119 119 LEU CA C 13 56.702 0.3 . 1 . . . . 404 LEU CA . 18580 1 1042 . 1 1 119 119 LEU CB C 13 42.038 0.3 . 1 . . . . 404 LEU CB . 18580 1 1043 . 1 1 119 119 LEU CD1 C 13 25.008 0.3 . 2 . . . . 404 LEU CD1 . 18580 1 1044 . 1 1 119 119 LEU CD2 C 13 23.539 0.3 . 2 . . . . 404 LEU CD2 . 18580 1 1045 . 1 1 119 119 LEU N N 15 121.012 0.3 . 1 . . . . 404 LEU N . 18580 1 1046 . 1 1 120 120 LYS H H 1 7.928 0.02 . 1 . . . . 405 LYS H . 18580 1 1047 . 1 1 120 120 LYS HA H 1 4.126 0.02 . 1 . . . . 405 LYS HA . 18580 1 1048 . 1 1 120 120 LYS HB2 H 1 1.817 0.02 . 1 . . . . 405 LYS HB . 18580 1 1049 . 1 1 120 120 LYS HB3 H 1 1.817 0.02 . 1 . . . . 405 LYS HB . 18580 1 1050 . 1 1 120 120 LYS C C 13 177.474 0.3 . 1 . . . . 405 LYS CO . 18580 1 1051 . 1 1 120 120 LYS CA C 13 57.952 0.3 . 1 . . . . 405 LYS CA . 18580 1 1052 . 1 1 120 120 LYS CB C 13 32.615 0.3 . 1 . . . . 405 LYS CB . 18580 1 1053 . 1 1 120 120 LYS N N 15 119.894 0.3 . 1 . . . . 405 LYS N . 18580 1 1054 . 1 1 121 121 HIS H H 1 8.134 0.02 . 1 . . . . 406 HIS H . 18580 1 1055 . 1 1 121 121 HIS HA H 1 4.57 0.02 . 1 . . . . 406 HIS HA . 18580 1 1056 . 1 1 121 121 HIS HB2 H 1 3.192 0.02 . 1 . . . . 406 HIS HB . 18580 1 1057 . 1 1 121 121 HIS HB3 H 1 3.192 0.02 . 1 . . . . 406 HIS HB . 18580 1 1058 . 1 1 121 121 HIS C C 13 175.914 0.3 . 1 . . . . 406 HIS CO . 18580 1 1059 . 1 1 121 121 HIS CA C 13 57.139 0.3 . 1 . . . . 406 HIS CA . 18580 1 1060 . 1 1 121 121 HIS CB C 13 29.952 0.3 . 1 . . . . 406 HIS CB . 18580 1 1061 . 1 1 121 121 HIS N N 15 118.585 0.3 . 1 . . . . 406 HIS N . 18580 1 1062 . 1 1 122 122 ASN H H 1 8.377 0.02 . 1 . . . . 407 ASN H . 18580 1 1063 . 1 1 122 122 ASN HA H 1 4.598 0.02 . 1 . . . . 407 ASN HA . 18580 1 1064 . 1 1 122 122 ASN HB2 H 1 2.861 0.02 . 1 . . . . 407 ASN HB . 18580 1 1065 . 1 1 122 122 ASN HB3 H 1 2.861 0.02 . 1 . . . . 407 ASN HB . 18580 1 1066 . 1 1 122 122 ASN C C 13 176.306 0.3 . 1 . . . . 407 ASN CO . 18580 1 1067 . 1 1 122 122 ASN CA C 13 54.399 0.3 . 1 . . . . 407 ASN CA . 18580 1 1068 . 1 1 122 122 ASN CB C 13 38.546 0.3 . 1 . . . . 407 ASN CB . 18580 1 1069 . 1 1 122 122 ASN N N 15 119.324 0.3 . 1 . . . . 407 ASN N . 18580 1 1070 . 1 1 123 123 LEU H H 1 8.241 0.02 . 1 . . . . 408 LEU H . 18580 1 1071 . 1 1 123 123 LEU HA H 1 4.213 0.02 . 1 . . . . 408 LEU HA . 18580 1 1072 . 1 1 123 123 LEU HB2 H 1 1.762 0.02 . 2 . . . . 408 LEU HB2 . 18580 1 1073 . 1 1 123 123 LEU HB3 H 1 1.606 0.02 . 2 . . . . 408 LEU HB3 . 18580 1 1074 . 1 1 123 123 LEU HG H 1 1.689 0.02 . 1 . . . . 408 LEU HG . 18580 1 1075 . 1 1 123 123 LEU HD11 H 1 0.921 0.02 . 2 . . . . 408 LEU HD1 . 18580 1 1076 . 1 1 123 123 LEU HD12 H 1 0.921 0.02 . 2 . . . . 408 LEU HD1 . 18580 1 1077 . 1 1 123 123 LEU HD13 H 1 0.921 0.02 . 2 . . . . 408 LEU HD1 . 18580 1 1078 . 1 1 123 123 LEU HD21 H 1 0.866 0.02 . 2 . . . . 408 LEU HD2 . 18580 1 1079 . 1 1 123 123 LEU HD22 H 1 0.866 0.02 . 2 . . . . 408 LEU HD2 . 18580 1 1080 . 1 1 123 123 LEU HD23 H 1 0.866 0.02 . 2 . . . . 408 LEU HD2 . 18580 1 1081 . 1 1 123 123 LEU C C 13 178.558 0.3 . 1 . . . . 408 LEU CO . 18580 1 1082 . 1 1 123 123 LEU CA C 13 56.6 0.3 . 1 . . . . 408 LEU CA . 18580 1 1083 . 1 1 123 123 LEU CB C 13 42.003 0.3 . 1 . . . . 408 LEU CB . 18580 1 1084 . 1 1 123 123 LEU CG C 13 27.052 0.3 . 1 . . . . 408 LEU CG . 18580 1 1085 . 1 1 123 123 LEU CD1 C 13 24.997 0.3 . 2 . . . . 408 LEU CD1 . 18580 1 1086 . 1 1 123 123 LEU CD2 C 13 23.429 0.3 . 2 . . . . 408 LEU CD2 . 18580 1 1087 . 1 1 123 123 LEU N N 15 121.622 0.3 . 1 . . . . 408 LEU N . 18580 1 1088 . 1 1 124 124 GLU H H 1 8.22 0.02 . 1 . . . . 409 GLU H . 18580 1 1089 . 1 1 124 124 GLU HA H 1 4.127 0.02 . 1 . . . . 409 GLU HA . 18580 1 1090 . 1 1 124 124 GLU HB2 H 1 2.049 0.02 . 1 . . . . 409 GLU HB . 18580 1 1091 . 1 1 124 124 GLU HB3 H 1 2.049 0.02 . 1 . . . . 409 GLU HB . 18580 1 1092 . 1 1 124 124 GLU HG2 H 1 2.304 0.02 . 1 . . . . 409 GLU HG . 18580 1 1093 . 1 1 124 124 GLU HG3 H 1 2.304 0.02 . 1 . . . . 409 GLU HG . 18580 1 1094 . 1 1 124 124 GLU C C 13 177.57 0.3 . 1 . . . . 409 GLU CO . 18580 1 1095 . 1 1 124 124 GLU CA C 13 57.97 0.3 . 1 . . . . 409 GLU CA . 18580 1 1096 . 1 1 124 124 GLU CB C 13 29.73 0.3 . 1 . . . . 409 GLU CB . 18580 1 1097 . 1 1 124 124 GLU CG C 13 36.349 0.3 . 1 . . . . 409 GLU CG . 18580 1 1098 . 1 1 124 124 GLU N N 15 120.3 0.3 . 1 . . . . 409 GLU N . 18580 1 1099 . 1 1 125 125 GLN H H 1 8.09 0.02 . 1 . . . . 410 GLN H . 18580 1 1100 . 1 1 125 125 GLN HA H 1 4.208 0.02 . 1 . . . . 410 GLN HA . 18580 1 1101 . 1 1 125 125 GLN HB2 H 1 2.024 0.02 . 2 . . . . 410 GLN HB2 . 18580 1 1102 . 1 1 125 125 GLN HB3 H 1 2.105 0.02 . 2 . . . . 410 GLN HB3 . 18580 1 1103 . 1 1 125 125 GLN HG2 H 1 2.345 0.02 . 1 . . . . 410 GLN HG . 18580 1 1104 . 1 1 125 125 GLN HG3 H 1 2.345 0.02 . 1 . . . . 410 GLN HG . 18580 1 1105 . 1 1 125 125 GLN C C 13 177.01 0.3 . 1 . . . . 410 GLN CO . 18580 1 1106 . 1 1 125 125 GLN CA C 13 56.82 0.3 . 1 . . . . 410 GLN CA . 18580 1 1107 . 1 1 125 125 GLN CB C 13 28.96 0.3 . 1 . . . . 410 GLN CB . 18580 1 1108 . 1 1 125 125 GLN CG C 13 33.846 0.3 . 1 . . . . 410 GLN CG . 18580 1 1109 . 1 1 125 125 GLN N N 15 119.21 0.3 . 1 . . . . 410 GLN N . 18580 1 1110 . 1 1 126 126 LEU H H 1 7.98 0.02 . 1 . . . . 411 LEU H . 18580 1 1111 . 1 1 126 126 LEU HA H 1 4.26 0.02 . 1 . . . . 411 LEU HA . 18580 1 1112 . 1 1 126 126 LEU HB2 H 1 1.721 0.02 . 2 . . . . 411 LEU HB2 . 18580 1 1113 . 1 1 126 126 LEU HB3 H 1 1.609 0.02 . 2 . . . . 411 LEU HB3 . 18580 1 1114 . 1 1 126 126 LEU HG H 1 1.663 0.02 . 1 . . . . 411 LEU HG . 18580 1 1115 . 1 1 126 126 LEU HD11 H 1 0.908 0.02 . 2 . . . . 411 LEU HD1 . 18580 1 1116 . 1 1 126 126 LEU HD12 H 1 0.908 0.02 . 2 . . . . 411 LEU HD1 . 18580 1 1117 . 1 1 126 126 LEU HD13 H 1 0.908 0.02 . 2 . . . . 411 LEU HD1 . 18580 1 1118 . 1 1 126 126 LEU HD21 H 1 0.863 0.02 . 2 . . . . 411 LEU HD2 . 18580 1 1119 . 1 1 126 126 LEU HD22 H 1 0.863 0.02 . 2 . . . . 411 LEU HD2 . 18580 1 1120 . 1 1 126 126 LEU HD23 H 1 0.863 0.02 . 2 . . . . 411 LEU HD2 . 18580 1 1121 . 1 1 126 126 LEU C C 13 178.11 0.3 . 1 . . . . 411 LEU CO . 18580 1 1122 . 1 1 126 126 LEU CA C 13 56.02 0.3 . 1 . . . . 411 LEU CA . 18580 1 1123 . 1 1 126 126 LEU CB C 13 42.13 0.3 . 1 . . . . 411 LEU CB . 18580 1 1124 . 1 1 126 126 LEU CG C 13 27.018 0.3 . 1 . . . . 411 LEU CG . 18580 1 1125 . 1 1 126 126 LEU CD1 C 13 25.011 0.3 . 2 . . . . 411 LEU CD1 . 18580 1 1126 . 1 1 126 126 LEU CD2 C 13 23.453 0.3 . 2 . . . . 411 LEU CD2 . 18580 1 1127 . 1 1 126 126 LEU N N 15 121.56 0.3 . 1 . . . . 411 LEU N . 18580 1 1128 . 1 1 127 127 ARG H H 1 8.11 0.02 . 1 . . . . 412 ARG H . 18580 1 1129 . 1 1 127 127 ARG HA H 1 4.249 0.02 . 1 . . . . 412 ARG HA . 18580 1 1130 . 1 1 127 127 ARG HB2 H 1 1.837 0.02 . 1 . . . . 412 ARG HB . 18580 1 1131 . 1 1 127 127 ARG HB3 H 1 1.837 0.02 . 1 . . . . 412 ARG HB . 18580 1 1132 . 1 1 127 127 ARG HG2 H 1 1.636 0.02 . 1 . . . . 412 ARG HG . 18580 1 1133 . 1 1 127 127 ARG HG3 H 1 1.636 0.02 . 1 . . . . 412 ARG HG . 18580 1 1134 . 1 1 127 127 ARG C C 13 176.59 0.3 . 1 . . . . 412 ARG CO . 18580 1 1135 . 1 1 127 127 ARG CA C 13 56.96 0.3 . 1 . . . . 412 ARG CA . 18580 1 1136 . 1 1 127 127 ARG CB C 13 30.61 0.3 . 1 . . . . 412 ARG CB . 18580 1 1137 . 1 1 127 127 ARG CG C 13 27.192 0.3 . 1 . . . . 412 ARG CG . 18580 1 1138 . 1 1 127 127 ARG N N 15 120.45 0.3 . 1 . . . . 412 ARG N . 18580 1 1139 . 1 1 128 128 ASN H H 1 8.26 0.02 . 1 . . . . 413 ASN H . 18580 1 1140 . 1 1 128 128 ASN HA H 1 4.718 0.02 . 1 . . . . 413 ASN HA . 18580 1 1141 . 1 1 128 128 ASN HB2 H 1 2.877 0.02 . 2 . . . . 413 ASN HB2 . 18580 1 1142 . 1 1 128 128 ASN HB3 H 1 2.781 0.02 . 2 . . . . 413 ASN HB3 . 18580 1 1143 . 1 1 128 128 ASN C C 13 175.36 0.3 . 1 . . . . 413 ASN CO . 18580 1 1144 . 1 1 128 128 ASN CA C 13 53.46 0.3 . 1 . . . . 413 ASN CA . 18580 1 1145 . 1 1 128 128 ASN CB C 13 38.92 0.3 . 1 . . . . 413 ASN CB . 18580 1 1146 . 1 1 128 128 ASN N N 15 118.72 0.3 . 1 . . . . 413 ASN N . 18580 1 1147 . 1 1 129 129 SER H H 1 8.14 0.02 . 1 . . . . 414 SER H . 18580 1 1148 . 1 1 129 129 SER HA H 1 4.431 0.02 . 1 . . . . 414 SER HA . 18580 1 1149 . 1 1 129 129 SER HB2 H 1 3.908 0.02 . 1 . . . . 414 SER HB . 18580 1 1150 . 1 1 129 129 SER HB3 H 1 3.908 0.02 . 1 . . . . 414 SER HB . 18580 1 1151 . 1 1 129 129 SER C C 13 174.33 0.3 . 1 . . . . 414 SER CO . 18580 1 1152 . 1 1 129 129 SER CA C 13 58.74 0.3 . 1 . . . . 414 SER CA . 18580 1 1153 . 1 1 129 129 SER CB C 13 63.86 0.3 . 1 . . . . 414 SER CB . 18580 1 1154 . 1 1 129 129 SER N N 15 116.02 0.3 . 1 . . . . 414 SER N . 18580 1 1155 . 1 1 130 130 ARG H H 1 8.23 0.02 . 1 . . . . 415 ARG H . 18580 1 1156 . 1 1 130 130 ARG HA H 1 4.38 0.02 . 1 . . . . 415 ARG HA . 18580 1 1157 . 1 1 130 130 ARG HB2 H 1 1.923 0.02 . 2 . . . . 415 ARG HB2 . 18580 1 1158 . 1 1 130 130 ARG HB3 H 1 1.758 0.02 . 2 . . . . 415 ARG HB3 . 18580 1 1159 . 1 1 130 130 ARG HG2 H 1 1.651 0.02 . 1 . . . . 415 ARG HG . 18580 1 1160 . 1 1 130 130 ARG HG3 H 1 1.651 0.02 . 1 . . . . 415 ARG HG . 18580 1 1161 . 1 1 130 130 ARG C C 13 175.01 0.3 . 1 . . . . 415 ARG CO . 18580 1 1162 . 1 1 130 130 ARG CA C 13 56.01 0.3 . 1 . . . . 415 ARG CA . 18580 1 1163 . 1 1 130 130 ARG CB C 13 30.81 0.3 . 1 . . . . 415 ARG CB . 18580 1 1164 . 1 1 130 130 ARG CG C 13 26.993 0.3 . 1 . . . . 415 ARG CG . 18580 1 1165 . 1 1 130 130 ARG N N 15 122.94 0.3 . 1 . . . . 415 ARG N . 18580 1 1166 . 1 1 131 131 ALA H H 1 7.92 0.02 . 1 . . . . 416 ALA H . 18580 1 1167 . 1 1 131 131 ALA N N 15 130.76 0.3 . 1 . . . . 416 ALA N . 18580 1 stop_ save_