data_6900 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6900 _Entry.Title ; 15N, 13C and 1H resonance assignments for the C-terminal MA-3 domain of the tumour suppressor protein Pdcd4 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2005-11-14 _Entry.Accession_date 2005-11-14 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details 'Chemical Shift Assignments for mPdcd4 (319-449)' _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Lorna Waters . C. . 6900 2 Maret Bohm . . . 6900 3 Vaclav Veverka . . . 6900 4 Fred Muskett . W. . 6900 5 Thomas Frenkiel . . . 6900 6 Geoff Kelly . . . 6900 7 Andrew Prescott . . . 6900 8 Nuvjeevan Dosanjh . . . 6900 9 Karl-Heinz Klempnauer . . . 6900 10 Mark Carr . D. . 6900 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6900 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 435 6900 '15N chemical shifts' 130 6900 '1H chemical shifts' 985 6900 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2007-02-08 2005-11-14 update BMRB 'complete entry citation' 6900 1 . . 2006-03-10 2005-11-14 original author 'original release' 6900 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6900 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16518566 _Citation.Full_citation . _Citation.Title ; NMR Assignment and Secondary Structure Determination of the C-terminal MA-3 Domain of the Tumour Suppressor Protein Pdcd4 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 36 _Citation.Journal_issue 'Suppl. 5' _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 18 _Citation.Page_last 18 _Citation.Year 2006 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Lorna Waters . C. . 6900 1 2 Maret Bohm . . . 6900 1 3 Vaclav Veverka . . . 6900 1 4 Frederick Muskett . W. . 6900 1 5 Thomas Frenkiel . A. . 6900 1 6 Geoffrey Kelly . P. . 6900 1 7 Andrew Prescott . . . 6900 1 8 Nuvjeevan Dosanjh . S. . 6900 1 9 Karl-Heinz Klempnauer . . . 6900 1 10 Mark Carr . D. . 6900 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6900 _Assembly.ID 1 _Assembly.Name 'Pdcd4 C-terminal MA-3 (319-449)' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _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 'Pdcd4 C-terminal MA-3 domain' 1 $Pdcd4_C-terminal_MA-3_domain . . yes native no no . . . 6900 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Pdcd4_C-terminal_MA-3_domain _Entity.Sf_category entity _Entity.Sf_framecode Pdcd4_C-terminal_MA-3_domain _Entity.Entry_ID 6900 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Pdcd4 MA-3' _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 ; GPLGSGGQQPVNHLVKEIDM LLKEYLLSGDISEAEHCLKE LEVPHFHHELVYEAIVMVLE STGESAFKMILDLLKSLWKS STITIDQMKRGYERIYNEIP DINLDVPHSYSVLERFVEEC FQAGIISKQLRDLCPS ; _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 136 _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 'The N-terminal 5 residues G314-S318 are cloning artifacts and not part of the Pdcd4 sequence' _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2HM8 . "Solution Structure Of The C-Terminal Ma-3 Domain Of Pdcd4" . . . . . 100.00 136 100.00 100.00 1.64e-93 . . . . 6900 1 2 no PDB 2IOL . "Crystal Structure Of The C-Terminal Ma3 Domain Of Pdcd4 (Mouse); Form 1" . . . . . 95.59 150 96.92 96.92 2.40e-84 . . . . 6900 1 3 no PDB 2ION . "Crystal Structure Of The C-terminal Ma3 Domain Of Pdcd4 (mouse); Form2" . . . . . 95.59 152 100.00 100.00 3.37e-88 . . . . 6900 1 4 no PDB 2IOS . "Crystal Structure Of The C-Terminal Ma3 Domain Of Pdcd4 (Mouse); Form 3" . . . . . 95.59 150 98.46 98.46 1.55e-85 . . . . 6900 1 5 no PDB 2KZT . "Structure Of The Tandem Ma-3 Region Of Pdcd4" . . . . . 96.32 131 100.00 100.00 1.66e-89 . . . . 6900 1 6 no PDB 2NSZ . "1.15 Angstrom Crystal Structure Of The Ma3 Domain Of Pdcd4" . . . . . 94.12 129 100.00 100.00 7.96e-87 . . . . 6900 1 7 no DBJ BAK63524 . "programmed cell death 4 isoform 1 [Pan troglodytes]" . . . . . 96.32 285 96.95 98.47 1.83e-86 . . . . 6900 1 8 no REF XP_005269759 . "PREDICTED: programmed cell death protein 4 isoform X1 [Homo sapiens]" . . . . . 96.32 283 96.95 98.47 2.28e-86 . . . . 6900 1 9 no REF XP_006717830 . "PREDICTED: programmed cell death protein 4 isoform X2 [Homo sapiens]" . . . . . 96.32 283 96.95 98.47 2.28e-86 . . . . 6900 1 10 no REF XP_008949157 . "PREDICTED: programmed cell death protein 4 isoform X3 [Pan paniscus]" . . . . . 96.32 283 96.95 98.47 2.28e-86 . . . . 6900 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 314 GLY . 6900 1 2 315 PRO . 6900 1 3 316 LEU . 6900 1 4 317 GLY . 6900 1 5 318 SER . 6900 1 6 319 GLY . 6900 1 7 320 GLY . 6900 1 8 321 GLN . 6900 1 9 322 GLN . 6900 1 10 323 PRO . 6900 1 11 324 VAL . 6900 1 12 325 ASN . 6900 1 13 326 HIS . 6900 1 14 327 LEU . 6900 1 15 328 VAL . 6900 1 16 329 LYS . 6900 1 17 330 GLU . 6900 1 18 331 ILE . 6900 1 19 332 ASP . 6900 1 20 333 MET . 6900 1 21 334 LEU . 6900 1 22 335 LEU . 6900 1 23 336 LYS . 6900 1 24 337 GLU . 6900 1 25 338 TYR . 6900 1 26 339 LEU . 6900 1 27 340 LEU . 6900 1 28 341 SER . 6900 1 29 342 GLY . 6900 1 30 343 ASP . 6900 1 31 344 ILE . 6900 1 32 345 SER . 6900 1 33 346 GLU . 6900 1 34 347 ALA . 6900 1 35 348 GLU . 6900 1 36 349 HIS . 6900 1 37 350 CYS . 6900 1 38 351 LEU . 6900 1 39 352 LYS . 6900 1 40 353 GLU . 6900 1 41 354 LEU . 6900 1 42 355 GLU . 6900 1 43 356 VAL . 6900 1 44 357 PRO . 6900 1 45 358 HIS . 6900 1 46 359 PHE . 6900 1 47 360 HIS . 6900 1 48 361 HIS . 6900 1 49 362 GLU . 6900 1 50 363 LEU . 6900 1 51 364 VAL . 6900 1 52 365 TYR . 6900 1 53 366 GLU . 6900 1 54 367 ALA . 6900 1 55 368 ILE . 6900 1 56 369 VAL . 6900 1 57 370 MET . 6900 1 58 371 VAL . 6900 1 59 372 LEU . 6900 1 60 373 GLU . 6900 1 61 374 SER . 6900 1 62 375 THR . 6900 1 63 376 GLY . 6900 1 64 377 GLU . 6900 1 65 378 SER . 6900 1 66 379 ALA . 6900 1 67 380 PHE . 6900 1 68 381 LYS . 6900 1 69 382 MET . 6900 1 70 383 ILE . 6900 1 71 384 LEU . 6900 1 72 385 ASP . 6900 1 73 386 LEU . 6900 1 74 387 LEU . 6900 1 75 388 LYS . 6900 1 76 389 SER . 6900 1 77 390 LEU . 6900 1 78 391 TRP . 6900 1 79 392 LYS . 6900 1 80 393 SER . 6900 1 81 394 SER . 6900 1 82 395 THR . 6900 1 83 396 ILE . 6900 1 84 397 THR . 6900 1 85 398 ILE . 6900 1 86 399 ASP . 6900 1 87 400 GLN . 6900 1 88 401 MET . 6900 1 89 402 LYS . 6900 1 90 403 ARG . 6900 1 91 404 GLY . 6900 1 92 405 TYR . 6900 1 93 406 GLU . 6900 1 94 407 ARG . 6900 1 95 408 ILE . 6900 1 96 409 TYR . 6900 1 97 410 ASN . 6900 1 98 411 GLU . 6900 1 99 412 ILE . 6900 1 100 413 PRO . 6900 1 101 414 ASP . 6900 1 102 415 ILE . 6900 1 103 416 ASN . 6900 1 104 417 LEU . 6900 1 105 418 ASP . 6900 1 106 419 VAL . 6900 1 107 420 PRO . 6900 1 108 421 HIS . 6900 1 109 422 SER . 6900 1 110 423 TYR . 6900 1 111 424 SER . 6900 1 112 425 VAL . 6900 1 113 426 LEU . 6900 1 114 427 GLU . 6900 1 115 428 ARG . 6900 1 116 429 PHE . 6900 1 117 430 VAL . 6900 1 118 431 GLU . 6900 1 119 432 GLU . 6900 1 120 433 CYS . 6900 1 121 434 PHE . 6900 1 122 435 GLN . 6900 1 123 436 ALA . 6900 1 124 437 GLY . 6900 1 125 438 ILE . 6900 1 126 439 ILE . 6900 1 127 440 SER . 6900 1 128 441 LYS . 6900 1 129 442 GLN . 6900 1 130 443 LEU . 6900 1 131 444 ARG . 6900 1 132 445 ASP . 6900 1 133 446 LEU . 6900 1 134 447 CYS . 6900 1 135 448 PRO . 6900 1 136 449 SER . 6900 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 6900 1 . PRO 2 2 6900 1 . LEU 3 3 6900 1 . GLY 4 4 6900 1 . SER 5 5 6900 1 . GLY 6 6 6900 1 . GLY 7 7 6900 1 . GLN 8 8 6900 1 . GLN 9 9 6900 1 . PRO 10 10 6900 1 . VAL 11 11 6900 1 . ASN 12 12 6900 1 . HIS 13 13 6900 1 . LEU 14 14 6900 1 . VAL 15 15 6900 1 . LYS 16 16 6900 1 . GLU 17 17 6900 1 . ILE 18 18 6900 1 . ASP 19 19 6900 1 . MET 20 20 6900 1 . LEU 21 21 6900 1 . LEU 22 22 6900 1 . LYS 23 23 6900 1 . GLU 24 24 6900 1 . TYR 25 25 6900 1 . LEU 26 26 6900 1 . LEU 27 27 6900 1 . SER 28 28 6900 1 . GLY 29 29 6900 1 . ASP 30 30 6900 1 . ILE 31 31 6900 1 . SER 32 32 6900 1 . GLU 33 33 6900 1 . ALA 34 34 6900 1 . GLU 35 35 6900 1 . HIS 36 36 6900 1 . CYS 37 37 6900 1 . LEU 38 38 6900 1 . LYS 39 39 6900 1 . GLU 40 40 6900 1 . LEU 41 41 6900 1 . GLU 42 42 6900 1 . VAL 43 43 6900 1 . PRO 44 44 6900 1 . HIS 45 45 6900 1 . PHE 46 46 6900 1 . HIS 47 47 6900 1 . HIS 48 48 6900 1 . GLU 49 49 6900 1 . LEU 50 50 6900 1 . VAL 51 51 6900 1 . TYR 52 52 6900 1 . GLU 53 53 6900 1 . ALA 54 54 6900 1 . ILE 55 55 6900 1 . VAL 56 56 6900 1 . MET 57 57 6900 1 . VAL 58 58 6900 1 . LEU 59 59 6900 1 . GLU 60 60 6900 1 . SER 61 61 6900 1 . THR 62 62 6900 1 . GLY 63 63 6900 1 . GLU 64 64 6900 1 . SER 65 65 6900 1 . ALA 66 66 6900 1 . PHE 67 67 6900 1 . LYS 68 68 6900 1 . MET 69 69 6900 1 . ILE 70 70 6900 1 . LEU 71 71 6900 1 . ASP 72 72 6900 1 . LEU 73 73 6900 1 . LEU 74 74 6900 1 . LYS 75 75 6900 1 . SER 76 76 6900 1 . LEU 77 77 6900 1 . TRP 78 78 6900 1 . LYS 79 79 6900 1 . SER 80 80 6900 1 . SER 81 81 6900 1 . THR 82 82 6900 1 . ILE 83 83 6900 1 . THR 84 84 6900 1 . ILE 85 85 6900 1 . ASP 86 86 6900 1 . GLN 87 87 6900 1 . MET 88 88 6900 1 . LYS 89 89 6900 1 . ARG 90 90 6900 1 . GLY 91 91 6900 1 . TYR 92 92 6900 1 . GLU 93 93 6900 1 . ARG 94 94 6900 1 . ILE 95 95 6900 1 . TYR 96 96 6900 1 . ASN 97 97 6900 1 . GLU 98 98 6900 1 . ILE 99 99 6900 1 . PRO 100 100 6900 1 . ASP 101 101 6900 1 . ILE 102 102 6900 1 . ASN 103 103 6900 1 . LEU 104 104 6900 1 . ASP 105 105 6900 1 . VAL 106 106 6900 1 . PRO 107 107 6900 1 . HIS 108 108 6900 1 . SER 109 109 6900 1 . TYR 110 110 6900 1 . SER 111 111 6900 1 . VAL 112 112 6900 1 . LEU 113 113 6900 1 . GLU 114 114 6900 1 . ARG 115 115 6900 1 . PHE 116 116 6900 1 . VAL 117 117 6900 1 . GLU 118 118 6900 1 . GLU 119 119 6900 1 . CYS 120 120 6900 1 . PHE 121 121 6900 1 . GLN 122 122 6900 1 . ALA 123 123 6900 1 . GLY 124 124 6900 1 . ILE 125 125 6900 1 . ILE 126 126 6900 1 . SER 127 127 6900 1 . LYS 128 128 6900 1 . GLN 129 129 6900 1 . LEU 130 130 6900 1 . ARG 131 131 6900 1 . ASP 132 132 6900 1 . LEU 133 133 6900 1 . CYS 134 134 6900 1 . PRO 135 135 6900 1 . SER 136 136 6900 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 6900 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Pdcd4_C-terminal_MA-3_domain . 10090 organism no 'Mus musculus' Mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 6900 1 stop_ loop_ _Natural_source_db.Entity_natural_src_ID _Natural_source_db.Entity_ID _Natural_source_db.Entity_label _Natural_source_db.Entity_chimera_segment_ID _Natural_source_db.Database_code _Natural_source_db.Database_type _Natural_source_db.Entry_code _Natural_source_db.Entry_type _Natural_source_db.ORF_code _Natural_source_db.Gene_locus_code _Natural_source_db.Gene_cDNA_code _Natural_source_db.Entry_ID _Natural_source_db.Entity_natural_src_list_ID . 1 $Pdcd4_C-terminal_MA-3_domain . 'UniProtKB/TrEMBL entry' . Q61823 . . . . 6900 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 6900 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Pdcd4_C-terminal_MA-3_domain . 'recombinant technology' . E.coli . . . . . . . . . . . . . . . . . . . . . . . . . . . 6900 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6900 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '15N labeled sample' _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'Pdcd4 MA-3' [U-15N] . . 1 $Pdcd4_C-terminal_MA-3_domain . protein 0.6 . . mM . . . . 6900 1 2 'sodium chloride' . . . . . . salt 100 . . mM . . . . 6900 1 3 'sodium phosphate' . . . . . . buffer 25 . . mM . . . . 6900 1 4 DTT . . . . . . 'reducing agent' 0.5 . . mM . . . . 6900 1 5 EDTA . . . . . . 'chelating agent' 10 . . uM . . . . 6900 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 6900 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details '15N/13C labeled sample' _Sample.Aggregate_sample_number 1 _Sample.Solvent_system . _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 'Pdcd4 MA-3' '[U-15N; U-13C]' . . 1 $Pdcd4_C-terminal_MA-3_domain . protein 0.7 . . mM . . . . 6900 2 2 'sodium chloride' . . . . . . salt 100 . . mM . . . . 6900 2 3 'sodium phosphate' . . . . . . buffer 25 . . mM . . . . 6900 2 4 DTT . . . . . . 'reducing agent' 0.5 . . mM . . . . 6900 2 5 EDTA . . . . . . 'chelating agent' 10 . . uM . . . . 6900 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 6900 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details '13C sample' _Sample.Aggregate_sample_number 1 _Sample.Solvent_system . _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 'Pdcd4 MA-3' [U-13C] . . 1 $Pdcd4_C-terminal_MA-3_domain . protein 0.9 . . mM . . . . 6900 3 2 'sodium chloride' . . . . . . salt 100 . . mM . . . . 6900 3 3 'sodium phosphate' . . . . . . buffer 25 . . mM . . . . 6900 3 4 DTT . . . . . . 'reducing agent' 0.5 . . mM . . . . 6900 3 5 EDTA . . . . . . 'chelating agent' 10 . . uM . . . . 6900 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 6900 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'unlabeled sample' _Sample.Aggregate_sample_number 1 _Sample.Solvent_system . _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 'Pdcd4 MA-3' . . . 1 $Pdcd4_C-terminal_MA-3_domain . protein 1 . . mM . . . . 6900 4 2 'sodium chloride' . . . . . . salt 100 . . mM . . . . 6900 4 3 'sodium phosphate' . . . . . . buffer 25 . . mM . . . . 6900 4 4 DTT . . . . . . 'reducing agent' 0.5 . . mM . . . . 6900 4 5 EDTA . . . . . . 'chelating agent' 10 . . uM . . . . 6900 4 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 6900 _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 pH 6.5 0.1 pH 6900 1 temperature 298 0.5 K 6900 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 6900 _Software.ID 1 _Software.Name TOPSPIN _Software.Version 1.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker BioSpin Ltd' . . 6900 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Acquistion and Processing of NMR data' 6900 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 6900 _Software.ID 2 _Software.Name SPARKY _Software.Version 3.110 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'T. D. Goddard and D. G. Kneller' ; T. D. Goddard and D. G. Kneller, SPARKY 3, University of California, San Francisco ; . 6900 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 6900 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600MHz_Avance _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600MHz_Avance _NMR_spectrometer.Entry_ID 6900 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_600MHz_DRX _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600MHz_DRX _NMR_spectrometer.Entry_ID 6900 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_800MHz_Inova _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 800MHz_Inova _NMR_spectrometer.Entry_ID 6900 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 6900 _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 1H15N_HSQC no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 3 $800MHz_Inova . . . . . . . . . . . . . . . . 6900 1 2 1H13C_HSQC no . . . . . . . . . . 3 $sample_3 . . . 1 $conditions_1 . . . 2 $600MHz_DRX . . . . . . . . . . . . . . . . 6900 1 3 1H15N13C_HNCACB no . . . . . . . . . . 2 $sample_2 . . . 1 $conditions_1 . . . 1 $600MHz_Avance . . . . . . . . . . . . . . . . 6900 1 4 1H15N13C_CBCA(CO)NH no . . . . . . . . . . 2 $sample_2 . . . 1 $conditions_1 . . . 1 $600MHz_Avance . . . . . . . . . . . . . . . . 6900 1 5 1H15N_NOESYHSQC no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 3 $800MHz_Inova . . . . . . . . . . . . . . . . 6900 1 6 1H15N_TOCSYHSQC no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $600MHz_Avance . . . . . . . . . . . . . . . . 6900 1 7 1H13C_HCCHTOCSY no . . . . . . . . . . 2 $sample_2 . . . 1 $conditions_1 . . . 1 $600MHz_Avance . . . . . . . . . . . . . . . . 6900 1 8 1H13C_NOESYHSQC no . . . . . . . . . . 3 $sample_3 . . . 1 $conditions_1 . . . 2 $600MHz_DRX . . . . . . . . . . . . . . . . 6900 1 9 1H_NOESY no . . . . . . . . . . 4 $sample_4 . . . 1 $conditions_1 . . . 2 $600MHz_DRX . . . . . . . . . . . . . . . . 6900 1 10 1H_TOCSY no . . . . . . . . . . 4 $sample_4 . . . 1 $conditions_1 . . . 2 $600MHz_DRX . . . . . . . . . . . . . . . . 6900 1 stop_ save_ save_1H15N_HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H15N_HSQC _NMR_spec_expt.Entry_ID 6900 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name 1H15N_HSQC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 3 _NMR_spec_expt.NMR_spectrometer_label $800MHz_Inova _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details '90% water / 10% D2O sample used' save_ save_1H15N_NOESYHSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H15N_NOESYHSQC _NMR_spec_expt.Entry_ID 6900 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name 1H15N_NOESYHSQC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 3 _NMR_spec_expt.NMR_spectrometer_label $800MHz_Inova _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details '90% water / 10% D2O sample used' save_ save_1H15N_TOCSYHSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H15N_TOCSYHSQC _NMR_spec_expt.Entry_ID 6900 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name 1H15N_TOCSYHSQC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $600MHz_Avance _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details '90% water / 10% D2O sample used' save_ save_1H15N13C_HNCACB _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H15N13C_HNCACB _NMR_spec_expt.Entry_ID 6900 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name 1H15N13C_HNCACB _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $600MHz_Avance _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details '90% water / 10% D2O sample used' save_ save_1H15N13C_CBCA(CO)NH _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H15N13C_CBCA(CO)NH _NMR_spec_expt.Entry_ID 6900 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name 1H15N13C_CBCA(CO)NH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $600MHz_Avance _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details '90% water / 10% D2O sample used' save_ save_1H13C_HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H13C_HSQC _NMR_spec_expt.Entry_ID 6900 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name 1H13C_HSQC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 2 _NMR_spec_expt.NMR_spectrometer_label $600MHz_DRX _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details '100% D2O sample used' save_ save_1H13C_HCCHTOCSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H13C_HCCHTOCSY _NMR_spec_expt.Entry_ID 6900 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name 1H13C_HCCHTOCSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $600MHz_Avance _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details '100% D2O sample used' save_ save_1H13C_NOESYHSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H13C_NOESYHSQC _NMR_spec_expt.Entry_ID 6900 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name 1H13C_NOESYHSQC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 2 _NMR_spec_expt.NMR_spectrometer_label $600MHz_DRX _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details '100% D2O sample used' save_ save_1H_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H_NOESY _NMR_spec_expt.Entry_ID 6900 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name 1H_NOESY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 2 _NMR_spec_expt.NMR_spectrometer_label $600MHz_DRX _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details '100% D2O sample used' save_ save_1H_TOCSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H_TOCSY _NMR_spec_expt.Entry_ID 6900 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name 1H_TOCSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 2 _NMR_spec_expt.NMR_spectrometer_label $600MHz_DRX _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details '100% D2O sample used' save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 6900 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 6900 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . 1 $entry_citation . . 1 $entry_citation 6900 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 6900 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 6900 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err 0.05 _Assigned_chem_shift_list.Chem_shift_13C_err 0.1 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _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 1H15N_HSQC 1 $sample_1 isotropic 6900 1 2 1H15N_NOESYHSQC 1 $sample_1 isotropic 6900 1 3 1H15N_TOCSYHSQC 1 $sample_1 isotropic 6900 1 4 1H15N13C_HNCACB 2 $sample_2 isotropic 6900 1 5 1H15N13C_CBCA(CO)NH 2 $sample_2 isotropic 6900 1 6 1H13C_HSQC 3 $sample_3 isotropic 6900 1 7 1H13C_HCCHTOCSY 3 $sample_3 isotropic 6900 1 8 1H13C_NOESYHSQC 3 $sample_3 isotropic 6900 1 9 1H_NOESY 4 $sample_4 isotropic 6900 1 10 1H_TOCSY 4 $sample_4 isotropic 6900 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 6900 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 2 2 PRO HA H 1 4.468 0.020 . 1 . . . . 315 PRO HA . 6900 1 2 . 1 1 2 2 PRO HB2 H 1 2.306 0.020 . 2 . . . . 315 PRO HB2 . 6900 1 3 . 1 1 2 2 PRO HB3 H 1 1.935 0.020 . 2 . . . . 315 PRO HB3 . 6900 1 4 . 1 1 2 2 PRO HG2 H 1 2.000 0.020 . 1 . . . . 315 PRO HG2 . 6900 1 5 . 1 1 2 2 PRO HG3 H 1 2.000 0.020 . 1 . . . . 315 PRO HG3 . 6900 1 6 . 1 1 2 2 PRO HD2 H 1 3.571 0.020 . 1 . . . . 315 PRO HD2 . 6900 1 7 . 1 1 2 2 PRO HD3 H 1 3.571 0.020 . 1 . . . . 315 PRO HD3 . 6900 1 8 . 1 1 2 2 PRO CA C 13 63.172 0.400 . 1 . . . . 315 PRO CA . 6900 1 9 . 1 1 2 2 PRO CB C 13 32.287 0.400 . 1 . . . . 315 PRO CB . 6900 1 10 . 1 1 2 2 PRO CG C 13 27.087 0.400 . 1 . . . . 315 PRO CG . 6900 1 11 . 1 1 2 2 PRO CD C 13 49.666 0.400 . 1 . . . . 315 PRO CD . 6900 1 12 . 1 1 3 3 LEU H H 1 8.559 0.020 . 1 . . . . 316 LEU H . 6900 1 13 . 1 1 3 3 LEU HA H 1 4.346 0.020 . 1 . . . . 316 LEU HA . 6900 1 14 . 1 1 3 3 LEU HB2 H 1 1.660 0.020 . 2 . . . . 316 LEU HB2 . 6900 1 15 . 1 1 3 3 LEU HB3 H 1 1.590 0.020 . 2 . . . . 316 LEU HB3 . 6900 1 16 . 1 1 3 3 LEU HG H 1 1.645 0.020 . 1 . . . . 316 LEU HG . 6900 1 17 . 1 1 3 3 LEU HD11 H 1 0.915 0.020 . 2 . . . . 316 LEU HD1 . 6900 1 18 . 1 1 3 3 LEU HD12 H 1 0.915 0.020 . 2 . . . . 316 LEU HD1 . 6900 1 19 . 1 1 3 3 LEU HD13 H 1 0.915 0.020 . 2 . . . . 316 LEU HD1 . 6900 1 20 . 1 1 3 3 LEU HD21 H 1 0.871 0.020 . 2 . . . . 316 LEU HD2 . 6900 1 21 . 1 1 3 3 LEU HD22 H 1 0.871 0.020 . 2 . . . . 316 LEU HD2 . 6900 1 22 . 1 1 3 3 LEU HD23 H 1 0.871 0.020 . 2 . . . . 316 LEU HD2 . 6900 1 23 . 1 1 3 3 LEU CA C 13 55.421 0.400 . 1 . . . . 316 LEU CA . 6900 1 24 . 1 1 3 3 LEU CB C 13 42.281 0.400 . 1 . . . . 316 LEU CB . 6900 1 25 . 1 1 3 3 LEU CG C 13 27.085 0.400 . 1 . . . . 316 LEU CG . 6900 1 26 . 1 1 3 3 LEU CD1 C 13 24.764 0.400 . 1 . . . . 316 LEU CD1 . 6900 1 27 . 1 1 3 3 LEU CD2 C 13 23.410 0.400 . 1 . . . . 316 LEU CD2 . 6900 1 28 . 1 1 3 3 LEU N N 15 122.366 0.400 . 1 . . . . 316 LEU N . 6900 1 29 . 1 1 4 4 GLY H H 1 8.432 0.020 . 1 . . . . 317 GLY H . 6900 1 30 . 1 1 4 4 GLY HA2 H 1 4.005 0.020 . 1 . . . . 317 GLY HA2 . 6900 1 31 . 1 1 4 4 GLY HA3 H 1 4.005 0.020 . 1 . . . . 317 GLY HA3 . 6900 1 32 . 1 1 4 4 GLY CA C 13 45.383 0.400 . 1 . . . . 317 GLY CA . 6900 1 33 . 1 1 4 4 GLY N N 15 109.908 0.400 . 1 . . . . 317 GLY N . 6900 1 34 . 1 1 5 5 SER H H 1 8.327 0.020 . 1 . . . . 318 SER H . 6900 1 35 . 1 1 5 5 SER HA H 1 4.464 0.020 . 1 . . . . 318 SER HA . 6900 1 36 . 1 1 5 5 SER HB2 H 1 3.911 0.020 . 2 . . . . 318 SER HB2 . 6900 1 37 . 1 1 5 5 SER HB3 H 1 3.857 0.020 . 2 . . . . 318 SER HB3 . 6900 1 38 . 1 1 5 5 SER CA C 13 58.564 0.400 . 1 . . . . 318 SER CA . 6900 1 39 . 1 1 5 5 SER CB C 13 63.874 0.400 . 1 . . . . 318 SER CB . 6900 1 40 . 1 1 5 5 SER N N 15 115.905 0.400 . 1 . . . . 318 SER N . 6900 1 41 . 1 1 6 6 GLY H H 1 8.570 0.020 . 1 . . . . 319 GLY H . 6900 1 42 . 1 1 6 6 GLY HA2 H 1 4.000 0.020 . 1 . . . . 319 GLY HA2 . 6900 1 43 . 1 1 6 6 GLY HA3 H 1 4.000 0.020 . 1 . . . . 319 GLY HA3 . 6900 1 44 . 1 1 6 6 GLY CA C 13 45.626 0.400 . 1 . . . . 319 GLY CA . 6900 1 45 . 1 1 6 6 GLY N N 15 111.063 0.400 . 1 . . . . 319 GLY N . 6900 1 46 . 1 1 7 7 GLY H H 1 8.292 0.020 . 1 . . . . 320 GLY H . 6900 1 47 . 1 1 7 7 GLY HA2 H 1 3.974 0.020 . 1 . . . . 320 GLY HA2 . 6900 1 48 . 1 1 7 7 GLY HA3 H 1 3.974 0.020 . 1 . . . . 320 GLY HA3 . 6900 1 49 . 1 1 7 7 GLY CA C 13 45.344 0.400 . 1 . . . . 320 GLY CA . 6900 1 50 . 1 1 7 7 GLY N N 15 108.652 0.400 . 1 . . . . 320 GLY N . 6900 1 51 . 1 1 8 8 GLN H H 1 8.272 0.020 . 1 . . . . 321 GLN H . 6900 1 52 . 1 1 8 8 GLN HA H 1 4.339 0.020 . 1 . . . . 321 GLN HA . 6900 1 53 . 1 1 8 8 GLN HB2 H 1 2.098 0.020 . 2 . . . . 321 GLN HB2 . 6900 1 54 . 1 1 8 8 GLN HB3 H 1 1.964 0.020 . 2 . . . . 321 GLN HB3 . 6900 1 55 . 1 1 8 8 GLN HG2 H 1 2.337 0.020 . 1 . . . . 321 GLN HG2 . 6900 1 56 . 1 1 8 8 GLN HG3 H 1 2.337 0.020 . 1 . . . . 321 GLN HG3 . 6900 1 57 . 1 1 8 8 GLN HE21 H 1 7.546 0.020 . 2 . . . . 321 GLN HE21 . 6900 1 58 . 1 1 8 8 GLN HE22 H 1 6.854 0.020 . 2 . . . . 321 GLN HE22 . 6900 1 59 . 1 1 8 8 GLN CA C 13 55.691 0.400 . 1 . . . . 321 GLN CA . 6900 1 60 . 1 1 8 8 GLN CB C 13 29.443 0.400 . 1 . . . . 321 GLN CB . 6900 1 61 . 1 1 8 8 GLN CG C 13 33.704 0.400 . 1 . . . . 321 GLN CG . 6900 1 62 . 1 1 8 8 GLN N N 15 119.781 0.400 . 1 . . . . 321 GLN N . 6900 1 63 . 1 1 8 8 GLN NE2 N 15 112.612 0.400 . 1 . . . . 321 GLN NE2 . 6900 1 64 . 1 1 9 9 GLN H H 1 8.450 0.020 . 1 . . . . 322 GLN H . 6900 1 65 . 1 1 9 9 GLN HA H 1 4.597 0.020 . 1 . . . . 322 GLN HA . 6900 1 66 . 1 1 9 9 GLN HB2 H 1 2.073 0.020 . 2 . . . . 322 GLN HB2 . 6900 1 67 . 1 1 9 9 GLN HB3 H 1 1.909 0.020 . 2 . . . . 322 GLN HB3 . 6900 1 68 . 1 1 9 9 GLN HG2 H 1 2.375 0.020 . 1 . . . . 322 GLN HG2 . 6900 1 69 . 1 1 9 9 GLN HG3 H 1 2.375 0.020 . 1 . . . . 322 GLN HG3 . 6900 1 70 . 1 1 9 9 GLN HE21 H 1 7.516 0.020 . 2 . . . . 322 GLN HE21 . 6900 1 71 . 1 1 9 9 GLN HE22 H 1 6.858 0.020 . 2 . . . . 322 GLN HE22 . 6900 1 72 . 1 1 9 9 GLN CA C 13 53.822 0.400 . 1 . . . . 322 GLN CA . 6900 1 73 . 1 1 9 9 GLN CB C 13 28.747 0.400 . 1 . . . . 322 GLN CB . 6900 1 74 . 1 1 9 9 GLN CG C 13 33.353 0.400 . 1 . . . . 322 GLN CG . 6900 1 75 . 1 1 9 9 GLN N N 15 122.781 0.400 . 1 . . . . 322 GLN N . 6900 1 76 . 1 1 9 9 GLN NE2 N 15 112.492 0.400 . 1 . . . . 322 GLN NE2 . 6900 1 77 . 1 1 10 10 PRO HA H 1 4.452 0.020 . 1 . . . . 323 PRO HA . 6900 1 78 . 1 1 10 10 PRO HB2 H 1 2.264 0.020 . 2 . . . . 323 PRO HB2 . 6900 1 79 . 1 1 10 10 PRO HB3 H 1 1.895 0.020 . 2 . . . . 323 PRO HB3 . 6900 1 80 . 1 1 10 10 PRO HG2 H 1 1.990 0.020 . 1 . . . . 323 PRO HG2 . 6900 1 81 . 1 1 10 10 PRO HG3 H 1 1.990 0.020 . 1 . . . . 323 PRO HG3 . 6900 1 82 . 1 1 10 10 PRO HD2 H 1 3.780 0.020 . 2 . . . . 323 PRO HD2 . 6900 1 83 . 1 1 10 10 PRO HD3 H 1 3.631 0.020 . 2 . . . . 323 PRO HD3 . 6900 1 84 . 1 1 10 10 PRO CA C 13 62.999 0.400 . 1 . . . . 323 PRO CA . 6900 1 85 . 1 1 10 10 PRO CB C 13 32.045 0.400 . 1 . . . . 323 PRO CB . 6900 1 86 . 1 1 10 10 PRO CG C 13 27.410 0.400 . 1 . . . . 323 PRO CG . 6900 1 87 . 1 1 10 10 PRO CD C 13 50.604 0.400 . 1 . . . . 323 PRO CD . 6900 1 88 . 1 1 11 11 VAL H H 1 8.276 0.020 . 1 . . . . 324 VAL H . 6900 1 89 . 1 1 11 11 VAL HA H 1 3.966 0.020 . 1 . . . . 324 VAL HA . 6900 1 90 . 1 1 11 11 VAL HB H 1 2.001 0.020 . 1 . . . . 324 VAL HB . 6900 1 91 . 1 1 11 11 VAL HG11 H 1 0.915 0.020 . 2 . . . . 324 VAL HG1 . 6900 1 92 . 1 1 11 11 VAL HG12 H 1 0.915 0.020 . 2 . . . . 324 VAL HG1 . 6900 1 93 . 1 1 11 11 VAL HG13 H 1 0.915 0.020 . 2 . . . . 324 VAL HG1 . 6900 1 94 . 1 1 11 11 VAL HG21 H 1 0.868 0.020 . 2 . . . . 324 VAL HG2 . 6900 1 95 . 1 1 11 11 VAL HG22 H 1 0.868 0.020 . 2 . . . . 324 VAL HG2 . 6900 1 96 . 1 1 11 11 VAL HG23 H 1 0.868 0.020 . 2 . . . . 324 VAL HG2 . 6900 1 97 . 1 1 11 11 VAL CA C 13 62.834 0.400 . 1 . . . . 324 VAL CA . 6900 1 98 . 1 1 11 11 VAL CB C 13 32.546 0.400 . 1 . . . . 324 VAL CB . 6900 1 99 . 1 1 11 11 VAL CG1 C 13 20.620 0.400 . 1 . . . . 324 VAL CG1 . 6900 1 100 . 1 1 11 11 VAL CG2 C 13 20.996 0.400 . 1 . . . . 324 VAL CG2 . 6900 1 101 . 1 1 11 11 VAL N N 15 120.248 0.400 . 1 . . . . 324 VAL N . 6900 1 102 . 1 1 12 12 ASN H H 1 8.408 0.020 . 1 . . . . 325 ASN H . 6900 1 103 . 1 1 12 12 ASN HA H 1 4.595 0.020 . 1 . . . . 325 ASN HA . 6900 1 104 . 1 1 12 12 ASN HB2 H 1 2.791 0.020 . 1 . . . . 325 ASN HB2 . 6900 1 105 . 1 1 12 12 ASN HB3 H 1 2.791 0.020 . 1 . . . . 325 ASN HB3 . 6900 1 106 . 1 1 12 12 ASN HD21 H 1 7.688 0.020 . 2 . . . . 325 ASN HD21 . 6900 1 107 . 1 1 12 12 ASN HD22 H 1 6.730 0.020 . 2 . . . . 325 ASN HD22 . 6900 1 108 . 1 1 12 12 ASN CA C 13 53.739 0.400 . 1 . . . . 325 ASN CA . 6900 1 109 . 1 1 12 12 ASN CB C 13 38.553 0.400 . 1 . . . . 325 ASN CB . 6900 1 110 . 1 1 12 12 ASN N N 15 121.425 0.400 . 1 . . . . 325 ASN N . 6900 1 111 . 1 1 12 12 ASN ND2 N 15 112.544 0.400 . 1 . . . . 325 ASN ND2 . 6900 1 112 . 1 1 13 13 HIS HA H 1 4.429 0.020 . 1 . . . . 326 HIS HA . 6900 1 113 . 1 1 13 13 HIS HB2 H 1 3.142 0.020 . 1 . . . . 326 HIS HB2 . 6900 1 114 . 1 1 13 13 HIS HB3 H 1 3.142 0.020 . 1 . . . . 326 HIS HB3 . 6900 1 115 . 1 1 13 13 HIS HD2 H 1 7.045 0.020 . 1 . . . . 326 HIS HD2 . 6900 1 116 . 1 1 13 13 HIS HE1 H 1 7.929 0.020 . 1 . . . . 326 HIS HE1 . 6900 1 117 . 1 1 13 13 HIS CA C 13 57.763 0.400 . 1 . . . . 326 HIS CA . 6900 1 118 . 1 1 13 13 HIS CB C 13 29.940 0.400 . 1 . . . . 326 HIS CB . 6900 1 119 . 1 1 14 14 LEU H H 1 7.832 0.020 . 1 . . . . 327 LEU H . 6900 1 120 . 1 1 14 14 LEU HA H 1 4.094 0.020 . 1 . . . . 327 LEU HA . 6900 1 121 . 1 1 14 14 LEU HB2 H 1 1.517 0.020 . 2 . . . . 327 LEU HB2 . 6900 1 122 . 1 1 14 14 LEU HB3 H 1 1.324 0.020 . 2 . . . . 327 LEU HB3 . 6900 1 123 . 1 1 14 14 LEU HG H 1 1.308 0.020 . 1 . . . . 327 LEU HG . 6900 1 124 . 1 1 14 14 LEU HD11 H 1 0.725 0.020 . 2 . . . . 327 LEU HD1 . 6900 1 125 . 1 1 14 14 LEU HD12 H 1 0.725 0.020 . 2 . . . . 327 LEU HD1 . 6900 1 126 . 1 1 14 14 LEU HD13 H 1 0.725 0.020 . 2 . . . . 327 LEU HD1 . 6900 1 127 . 1 1 14 14 LEU HD21 H 1 0.717 0.020 . 2 . . . . 327 LEU HD2 . 6900 1 128 . 1 1 14 14 LEU HD22 H 1 0.717 0.020 . 2 . . . . 327 LEU HD2 . 6900 1 129 . 1 1 14 14 LEU HD23 H 1 0.717 0.020 . 2 . . . . 327 LEU HD2 . 6900 1 130 . 1 1 14 14 LEU CA C 13 56.617 0.400 . 1 . . . . 327 LEU CA . 6900 1 131 . 1 1 14 14 LEU CB C 13 42.019 0.400 . 1 . . . . 327 LEU CB . 6900 1 132 . 1 1 14 14 LEU CG C 13 26.847 0.400 . 1 . . . . 327 LEU CG . 6900 1 133 . 1 1 14 14 LEU CD1 C 13 24.847 0.400 . 1 . . . . 327 LEU CD1 . 6900 1 134 . 1 1 14 14 LEU CD2 C 13 23.699 0.400 . 1 . . . . 327 LEU CD2 . 6900 1 135 . 1 1 14 14 LEU N N 15 120.913 0.400 . 1 . . . . 327 LEU N . 6900 1 136 . 1 1 15 15 VAL H H 1 7.890 0.020 . 1 . . . . 328 VAL H . 6900 1 137 . 1 1 15 15 VAL HA H 1 3.687 0.020 . 1 . . . . 328 VAL HA . 6900 1 138 . 1 1 15 15 VAL HB H 1 2.010 0.020 . 1 . . . . 328 VAL HB . 6900 1 139 . 1 1 15 15 VAL HG11 H 1 0.874 0.020 . 2 . . . . 328 VAL HG1 . 6900 1 140 . 1 1 15 15 VAL HG12 H 1 0.874 0.020 . 2 . . . . 328 VAL HG1 . 6900 1 141 . 1 1 15 15 VAL HG13 H 1 0.874 0.020 . 2 . . . . 328 VAL HG1 . 6900 1 142 . 1 1 15 15 VAL HG21 H 1 0.834 0.020 . 2 . . . . 328 VAL HG2 . 6900 1 143 . 1 1 15 15 VAL HG22 H 1 0.834 0.020 . 2 . . . . 328 VAL HG2 . 6900 1 144 . 1 1 15 15 VAL HG23 H 1 0.834 0.020 . 2 . . . . 328 VAL HG2 . 6900 1 145 . 1 1 15 15 VAL CA C 13 65.206 0.400 . 1 . . . . 328 VAL CA . 6900 1 146 . 1 1 15 15 VAL CB C 13 31.424 0.400 . 1 . . . . 328 VAL CB . 6900 1 147 . 1 1 15 15 VAL CG1 C 13 21.053 0.400 . 1 . . . . 328 VAL CG1 . 6900 1 148 . 1 1 15 15 VAL CG2 C 13 21.862 0.400 . 1 . . . . 328 VAL CG2 . 6900 1 149 . 1 1 15 15 VAL N N 15 119.608 0.400 . 1 . . . . 328 VAL N . 6900 1 150 . 1 1 16 16 LYS HA H 1 4.042 0.020 . 1 . . . . 329 LYS HA . 6900 1 151 . 1 1 16 16 LYS HB2 H 1 1.888 0.020 . 1 . . . . 329 LYS HB2 . 6900 1 152 . 1 1 16 16 LYS HB3 H 1 1.888 0.020 . 1 . . . . 329 LYS HB3 . 6900 1 153 . 1 1 16 16 LYS HG2 H 1 1.501 0.020 . 2 . . . . 329 LYS HG2 . 6900 1 154 . 1 1 16 16 LYS HG3 H 1 1.408 0.020 . 2 . . . . 329 LYS HG3 . 6900 1 155 . 1 1 16 16 LYS HD2 H 1 1.654 0.020 . 1 . . . . 329 LYS HD2 . 6900 1 156 . 1 1 16 16 LYS HD3 H 1 1.654 0.020 . 1 . . . . 329 LYS HD3 . 6900 1 157 . 1 1 16 16 LYS HE2 H 1 2.972 0.020 . 1 . . . . 329 LYS HE2 . 6900 1 158 . 1 1 16 16 LYS HE3 H 1 2.972 0.020 . 1 . . . . 329 LYS HE3 . 6900 1 159 . 1 1 16 16 LYS CA C 13 59.363 0.400 . 1 . . . . 329 LYS CA . 6900 1 160 . 1 1 16 16 LYS CB C 13 31.928 0.400 . 1 . . . . 329 LYS CB . 6900 1 161 . 1 1 16 16 LYS CG C 13 24.740 0.400 . 1 . . . . 329 LYS CG . 6900 1 162 . 1 1 16 16 LYS CD C 13 29.014 0.400 . 1 . . . . 329 LYS CD . 6900 1 163 . 1 1 17 17 GLU HA H 1 4.067 0.020 . 1 . . . . 330 GLU HA . 6900 1 164 . 1 1 17 17 GLU HB2 H 1 2.050 0.020 . 1 . . . . 330 GLU HB2 . 6900 1 165 . 1 1 17 17 GLU HB3 H 1 2.050 0.020 . 1 . . . . 330 GLU HB3 . 6900 1 166 . 1 1 17 17 GLU HG2 H 1 2.351 0.020 . 2 . . . . 330 GLU HG2 . 6900 1 167 . 1 1 17 17 GLU HG3 H 1 2.272 0.020 . 2 . . . . 330 GLU HG3 . 6900 1 168 . 1 1 17 17 GLU CA C 13 59.767 0.400 . 1 . . . . 330 GLU CA . 6900 1 169 . 1 1 17 17 GLU CB C 13 29.107 0.400 . 1 . . . . 330 GLU CB . 6900 1 170 . 1 1 17 17 GLU CG C 13 36.300 0.400 . 1 . . . . 330 GLU CG . 6900 1 171 . 1 1 18 18 ILE H H 1 7.958 0.020 . 1 . . . . 331 ILE H . 6900 1 172 . 1 1 18 18 ILE HA H 1 3.593 0.020 . 1 . . . . 331 ILE HA . 6900 1 173 . 1 1 18 18 ILE HB H 1 2.075 0.020 . 1 . . . . 331 ILE HB . 6900 1 174 . 1 1 18 18 ILE HG12 H 1 1.565 0.020 . 2 . . . . 331 ILE HG12 . 6900 1 175 . 1 1 18 18 ILE HG13 H 1 1.014 0.020 . 2 . . . . 331 ILE HG13 . 6900 1 176 . 1 1 18 18 ILE HG21 H 1 0.757 0.020 . 1 . . . . 331 ILE HG2 . 6900 1 177 . 1 1 18 18 ILE HG22 H 1 0.757 0.020 . 1 . . . . 331 ILE HG2 . 6900 1 178 . 1 1 18 18 ILE HG23 H 1 0.757 0.020 . 1 . . . . 331 ILE HG2 . 6900 1 179 . 1 1 18 18 ILE HD11 H 1 0.674 0.020 . 1 . . . . 331 ILE HD1 . 6900 1 180 . 1 1 18 18 ILE HD12 H 1 0.674 0.020 . 1 . . . . 331 ILE HD1 . 6900 1 181 . 1 1 18 18 ILE HD13 H 1 0.674 0.020 . 1 . . . . 331 ILE HD1 . 6900 1 182 . 1 1 18 18 ILE CA C 13 64.177 0.400 . 1 . . . . 331 ILE CA . 6900 1 183 . 1 1 18 18 ILE CB C 13 36.837 0.400 . 1 . . . . 331 ILE CB . 6900 1 184 . 1 1 18 18 ILE CG1 C 13 29.610 0.400 . 1 . . . . 331 ILE CG1 . 6900 1 185 . 1 1 18 18 ILE CG2 C 13 17.522 0.400 . 1 . . . . 331 ILE CG2 . 6900 1 186 . 1 1 18 18 ILE CD1 C 13 11.852 0.400 . 1 . . . . 331 ILE CD1 . 6900 1 187 . 1 1 18 18 ILE N N 15 121.590 0.400 . 1 . . . . 331 ILE N . 6900 1 188 . 1 1 19 19 ASP H H 1 8.332 0.020 . 1 . . . . 332 ASP H . 6900 1 189 . 1 1 19 19 ASP HA H 1 4.325 0.020 . 1 . . . . 332 ASP HA . 6900 1 190 . 1 1 19 19 ASP HB2 H 1 2.811 0.020 . 2 . . . . 332 ASP HB2 . 6900 1 191 . 1 1 19 19 ASP HB3 H 1 2.688 0.020 . 2 . . . . 332 ASP HB3 . 6900 1 192 . 1 1 19 19 ASP CA C 13 57.979 0.400 . 1 . . . . 332 ASP CA . 6900 1 193 . 1 1 19 19 ASP CB C 13 41.591 0.400 . 1 . . . . 332 ASP CB . 6900 1 194 . 1 1 19 19 ASP N N 15 121.222 0.400 . 1 . . . . 332 ASP N . 6900 1 195 . 1 1 20 20 MET H H 1 8.092 0.020 . 1 . . . . 333 MET H . 6900 1 196 . 1 1 20 20 MET HA H 1 4.089 0.020 . 1 . . . . 333 MET HA . 6900 1 197 . 1 1 20 20 MET HB2 H 1 2.161 0.020 . 1 . . . . 333 MET HB2 . 6900 1 198 . 1 1 20 20 MET HB3 H 1 2.161 0.020 . 1 . . . . 333 MET HB3 . 6900 1 199 . 1 1 20 20 MET HG2 H 1 2.761 0.020 . 2 . . . . 333 MET HG2 . 6900 1 200 . 1 1 20 20 MET HG3 H 1 2.610 0.020 . 2 . . . . 333 MET HG3 . 6900 1 201 . 1 1 20 20 MET HE1 H 1 2.082 0.020 . 1 . . . . 333 MET HE . 6900 1 202 . 1 1 20 20 MET HE2 H 1 2.082 0.020 . 1 . . . . 333 MET HE . 6900 1 203 . 1 1 20 20 MET HE3 H 1 2.082 0.020 . 1 . . . . 333 MET HE . 6900 1 204 . 1 1 20 20 MET CA C 13 58.819 0.400 . 1 . . . . 333 MET CA . 6900 1 205 . 1 1 20 20 MET CB C 13 32.459 0.400 . 1 . . . . 333 MET CB . 6900 1 206 . 1 1 20 20 MET CG C 13 32.006 0.400 . 1 . . . . 333 MET CG . 6900 1 207 . 1 1 20 20 MET CE C 13 16.785 0.400 . 1 . . . . 333 MET CE . 6900 1 208 . 1 1 20 20 MET N N 15 116.015 0.400 . 1 . . . . 333 MET N . 6900 1 209 . 1 1 21 21 LEU H H 1 7.804 0.020 . 1 . . . . 334 LEU H . 6900 1 210 . 1 1 21 21 LEU HA H 1 4.126 0.020 . 1 . . . . 334 LEU HA . 6900 1 211 . 1 1 21 21 LEU HB2 H 1 1.930 0.020 . 1 . . . . 334 LEU HB2 . 6900 1 212 . 1 1 21 21 LEU HB3 H 1 1.930 0.020 . 1 . . . . 334 LEU HB3 . 6900 1 213 . 1 1 21 21 LEU HG H 1 2.075 0.020 . 1 . . . . 334 LEU HG . 6900 1 214 . 1 1 21 21 LEU HD11 H 1 0.800 0.020 . 2 . . . . 334 LEU HD1 . 6900 1 215 . 1 1 21 21 LEU HD12 H 1 0.800 0.020 . 2 . . . . 334 LEU HD1 . 6900 1 216 . 1 1 21 21 LEU HD13 H 1 0.800 0.020 . 2 . . . . 334 LEU HD1 . 6900 1 217 . 1 1 21 21 LEU HD21 H 1 0.731 0.020 . 2 . . . . 334 LEU HD2 . 6900 1 218 . 1 1 21 21 LEU HD22 H 1 0.731 0.020 . 2 . . . . 334 LEU HD2 . 6900 1 219 . 1 1 21 21 LEU HD23 H 1 0.731 0.020 . 2 . . . . 334 LEU HD2 . 6900 1 220 . 1 1 21 21 LEU CA C 13 58.930 0.400 . 1 . . . . 334 LEU CA . 6900 1 221 . 1 1 21 21 LEU CB C 13 42.058 0.400 . 1 . . . . 334 LEU CB . 6900 1 222 . 1 1 21 21 LEU CG C 13 26.709 0.400 . 1 . . . . 334 LEU CG . 6900 1 223 . 1 1 21 21 LEU CD1 C 13 26.872 0.400 . 1 . . . . 334 LEU CD1 . 6900 1 224 . 1 1 21 21 LEU CD2 C 13 24.892 0.400 . 1 . . . . 334 LEU CD2 . 6900 1 225 . 1 1 21 21 LEU N N 15 122.040 0.400 . 1 . . . . 334 LEU N . 6900 1 226 . 1 1 22 22 LEU H H 1 8.329 0.020 . 1 . . . . 335 LEU H . 6900 1 227 . 1 1 22 22 LEU HA H 1 3.991 0.020 . 1 . . . . 335 LEU HA . 6900 1 228 . 1 1 22 22 LEU HB2 H 1 2.104 0.020 . 2 . . . . 335 LEU HB2 . 6900 1 229 . 1 1 22 22 LEU HB3 H 1 1.457 0.020 . 2 . . . . 335 LEU HB3 . 6900 1 230 . 1 1 22 22 LEU HG H 1 1.725 0.020 . 1 . . . . 335 LEU HG . 6900 1 231 . 1 1 22 22 LEU HD11 H 1 0.876 0.020 . 2 . . . . 335 LEU HD1 . 6900 1 232 . 1 1 22 22 LEU HD12 H 1 0.876 0.020 . 2 . . . . 335 LEU HD1 . 6900 1 233 . 1 1 22 22 LEU HD13 H 1 0.876 0.020 . 2 . . . . 335 LEU HD1 . 6900 1 234 . 1 1 22 22 LEU HD21 H 1 0.644 0.020 . 2 . . . . 335 LEU HD2 . 6900 1 235 . 1 1 22 22 LEU HD22 H 1 0.644 0.020 . 2 . . . . 335 LEU HD2 . 6900 1 236 . 1 1 22 22 LEU HD23 H 1 0.644 0.020 . 2 . . . . 335 LEU HD2 . 6900 1 237 . 1 1 22 22 LEU CA C 13 58.051 0.400 . 1 . . . . 335 LEU CA . 6900 1 238 . 1 1 22 22 LEU CB C 13 42.018 0.400 . 1 . . . . 335 LEU CB . 6900 1 239 . 1 1 22 22 LEU CG C 13 27.078 0.400 . 1 . . . . 335 LEU CG . 6900 1 240 . 1 1 22 22 LEU CD1 C 13 25.817 0.400 . 1 . . . . 335 LEU CD1 . 6900 1 241 . 1 1 22 22 LEU CD2 C 13 22.380 0.400 . 1 . . . . 335 LEU CD2 . 6900 1 242 . 1 1 22 22 LEU N N 15 122.792 0.400 . 1 . . . . 335 LEU N . 6900 1 243 . 1 1 23 23 LYS H H 1 8.508 0.020 . 1 . . . . 336 LYS H . 6900 1 244 . 1 1 23 23 LYS HA H 1 3.854 0.020 . 1 . . . . 336 LYS HA . 6900 1 245 . 1 1 23 23 LYS HB2 H 1 1.929 0.020 . 2 . . . . 336 LYS HB2 . 6900 1 246 . 1 1 23 23 LYS HB3 H 1 1.809 0.020 . 2 . . . . 336 LYS HB3 . 6900 1 247 . 1 1 23 23 LYS HG2 H 1 1.614 0.020 . 2 . . . . 336 LYS HG2 . 6900 1 248 . 1 1 23 23 LYS HG3 H 1 1.356 0.020 . 2 . . . . 336 LYS HG3 . 6900 1 249 . 1 1 23 23 LYS HD2 H 1 1.574 0.020 . 1 . . . . 336 LYS HD2 . 6900 1 250 . 1 1 23 23 LYS HD3 H 1 1.574 0.020 . 1 . . . . 336 LYS HD3 . 6900 1 251 . 1 1 23 23 LYS HE2 H 1 2.943 0.020 . 1 . . . . 336 LYS HE2 . 6900 1 252 . 1 1 23 23 LYS HE3 H 1 2.943 0.020 . 1 . . . . 336 LYS HE3 . 6900 1 253 . 1 1 23 23 LYS CA C 13 60.480 0.400 . 1 . . . . 336 LYS CA . 6900 1 254 . 1 1 23 23 LYS CB C 13 32.367 0.400 . 1 . . . . 336 LYS CB . 6900 1 255 . 1 1 23 23 LYS CG C 13 26.765 0.400 . 1 . . . . 336 LYS CG . 6900 1 256 . 1 1 23 23 LYS CD C 13 29.011 0.400 . 1 . . . . 336 LYS CD . 6900 1 257 . 1 1 23 23 LYS CE C 13 41.775 0.400 . 1 . . . . 336 LYS CE . 6900 1 258 . 1 1 23 23 LYS N N 15 119.557 0.400 . 1 . . . . 336 LYS N . 6900 1 259 . 1 1 24 24 GLU H H 1 8.373 0.020 . 1 . . . . 337 GLU H . 6900 1 260 . 1 1 24 24 GLU HA H 1 4.104 0.020 . 1 . . . . 337 GLU HA . 6900 1 261 . 1 1 24 24 GLU HB2 H 1 2.151 0.020 . 2 . . . . 337 GLU HB2 . 6900 1 262 . 1 1 24 24 GLU HB3 H 1 2.067 0.020 . 2 . . . . 337 GLU HB3 . 6900 1 263 . 1 1 24 24 GLU HG2 H 1 2.386 0.020 . 1 . . . . 337 GLU HG2 . 6900 1 264 . 1 1 24 24 GLU HG3 H 1 2.386 0.020 . 1 . . . . 337 GLU HG3 . 6900 1 265 . 1 1 24 24 GLU CA C 13 58.963 0.400 . 1 . . . . 337 GLU CA . 6900 1 266 . 1 1 24 24 GLU CB C 13 28.716 0.400 . 1 . . . . 337 GLU CB . 6900 1 267 . 1 1 24 24 GLU CG C 13 36.089 0.400 . 1 . . . . 337 GLU CG . 6900 1 268 . 1 1 24 24 GLU N N 15 118.889 0.400 . 1 . . . . 337 GLU N . 6900 1 269 . 1 1 25 25 TYR H H 1 8.110 0.020 . 1 . . . . 338 TYR H . 6900 1 270 . 1 1 25 25 TYR HA H 1 4.657 0.020 . 1 . . . . 338 TYR HA . 6900 1 271 . 1 1 25 25 TYR HB2 H 1 3.192 0.020 . 2 . . . . 338 TYR HB2 . 6900 1 272 . 1 1 25 25 TYR HB3 H 1 3.136 0.020 . 2 . . . . 338 TYR HB3 . 6900 1 273 . 1 1 25 25 TYR HD1 H 1 6.846 0.020 . 1 . . . . 338 TYR HD1 . 6900 1 274 . 1 1 25 25 TYR HD2 H 1 6.846 0.020 . 1 . . . . 338 TYR HD2 . 6900 1 275 . 1 1 25 25 TYR HE1 H 1 6.379 0.020 . 1 . . . . 338 TYR HE1 . 6900 1 276 . 1 1 25 25 TYR HE2 H 1 6.379 0.020 . 1 . . . . 338 TYR HE2 . 6900 1 277 . 1 1 25 25 TYR CA C 13 60.359 0.400 . 1 . . . . 338 TYR CA . 6900 1 278 . 1 1 25 25 TYR CB C 13 37.525 0.400 . 1 . . . . 338 TYR CB . 6900 1 279 . 1 1 25 25 TYR N N 15 122.064 0.400 . 1 . . . . 338 TYR N . 6900 1 280 . 1 1 26 26 LEU H H 1 8.262 0.020 . 1 . . . . 339 LEU H . 6900 1 281 . 1 1 26 26 LEU HA H 1 3.700 0.020 . 1 . . . . 339 LEU HA . 6900 1 282 . 1 1 26 26 LEU HB2 H 1 1.800 0.020 . 2 . . . . 339 LEU HB2 . 6900 1 283 . 1 1 26 26 LEU HB3 H 1 1.372 0.020 . 2 . . . . 339 LEU HB3 . 6900 1 284 . 1 1 26 26 LEU HG H 1 1.913 0.020 . 1 . . . . 339 LEU HG . 6900 1 285 . 1 1 26 26 LEU HD11 H 1 0.900 0.020 . 2 . . . . 339 LEU HD1 . 6900 1 286 . 1 1 26 26 LEU HD12 H 1 0.900 0.020 . 2 . . . . 339 LEU HD1 . 6900 1 287 . 1 1 26 26 LEU HD13 H 1 0.900 0.020 . 2 . . . . 339 LEU HD1 . 6900 1 288 . 1 1 26 26 LEU HD21 H 1 0.868 0.020 . 2 . . . . 339 LEU HD2 . 6900 1 289 . 1 1 26 26 LEU HD22 H 1 0.868 0.020 . 2 . . . . 339 LEU HD2 . 6900 1 290 . 1 1 26 26 LEU HD23 H 1 0.868 0.020 . 2 . . . . 339 LEU HD2 . 6900 1 291 . 1 1 26 26 LEU CA C 13 57.104 0.400 . 1 . . . . 339 LEU CA . 6900 1 292 . 1 1 26 26 LEU CB C 13 41.088 0.400 . 1 . . . . 339 LEU CB . 6900 1 293 . 1 1 26 26 LEU CG C 13 27.341 0.400 . 1 . . . . 339 LEU CG . 6900 1 294 . 1 1 26 26 LEU CD1 C 13 26.100 0.400 . 1 . . . . 339 LEU CD1 . 6900 1 295 . 1 1 26 26 LEU CD2 C 13 23.389 0.400 . 1 . . . . 339 LEU CD2 . 6900 1 296 . 1 1 26 26 LEU N N 15 119.236 0.400 . 1 . . . . 339 LEU N . 6900 1 297 . 1 1 27 27 LEU H H 1 7.235 0.020 . 1 . . . . 340 LEU H . 6900 1 298 . 1 1 27 27 LEU HA H 1 4.218 0.020 . 1 . . . . 340 LEU HA . 6900 1 299 . 1 1 27 27 LEU HB2 H 1 1.833 0.020 . 2 . . . . 340 LEU HB2 . 6900 1 300 . 1 1 27 27 LEU HB3 H 1 1.571 0.020 . 2 . . . . 340 LEU HB3 . 6900 1 301 . 1 1 27 27 LEU HG H 1 1.705 0.020 . 1 . . . . 340 LEU HG . 6900 1 302 . 1 1 27 27 LEU HD11 H 1 0.873 0.020 . 2 . . . . 340 LEU HD1 . 6900 1 303 . 1 1 27 27 LEU HD12 H 1 0.873 0.020 . 2 . . . . 340 LEU HD1 . 6900 1 304 . 1 1 27 27 LEU HD13 H 1 0.873 0.020 . 2 . . . . 340 LEU HD1 . 6900 1 305 . 1 1 27 27 LEU HD21 H 1 0.859 0.020 . 2 . . . . 340 LEU HD2 . 6900 1 306 . 1 1 27 27 LEU HD22 H 1 0.859 0.020 . 2 . . . . 340 LEU HD2 . 6900 1 307 . 1 1 27 27 LEU HD23 H 1 0.859 0.020 . 2 . . . . 340 LEU HD2 . 6900 1 308 . 1 1 27 27 LEU CA C 13 56.549 0.400 . 1 . . . . 340 LEU CA . 6900 1 309 . 1 1 27 27 LEU CB C 13 42.775 0.400 . 1 . . . . 340 LEU CB . 6900 1 310 . 1 1 27 27 LEU CG C 13 26.581 0.400 . 1 . . . . 340 LEU CG . 6900 1 311 . 1 1 27 27 LEU CD1 C 13 24.771 0.400 . 1 . . . . 340 LEU CD1 . 6900 1 312 . 1 1 27 27 LEU CD2 C 13 24.751 0.400 . 1 . . . . 340 LEU CD2 . 6900 1 313 . 1 1 27 27 LEU N N 15 116.672 0.400 . 1 . . . . 340 LEU N . 6900 1 314 . 1 1 28 28 SER H H 1 8.195 0.020 . 1 . . . . 341 SER H . 6900 1 315 . 1 1 28 28 SER HA H 1 4.447 0.020 . 1 . . . . 341 SER HA . 6900 1 316 . 1 1 28 28 SER HB2 H 1 3.978 0.020 . 1 . . . . 341 SER HB2 . 6900 1 317 . 1 1 28 28 SER HB3 H 1 3.978 0.020 . 1 . . . . 341 SER HB3 . 6900 1 318 . 1 1 28 28 SER CA C 13 59.242 0.400 . 1 . . . . 341 SER CA . 6900 1 319 . 1 1 28 28 SER CB C 13 65.198 0.400 . 1 . . . . 341 SER CB . 6900 1 320 . 1 1 28 28 SER N N 15 113.996 0.400 . 1 . . . . 341 SER N . 6900 1 321 . 1 1 29 29 GLY H H 1 9.443 0.020 . 1 . . . . 342 GLY H . 6900 1 322 . 1 1 29 29 GLY HA2 H 1 3.966 0.020 . 2 . . . . 342 GLY HA2 . 6900 1 323 . 1 1 29 29 GLY HA3 H 1 3.168 0.020 . 2 . . . . 342 GLY HA3 . 6900 1 324 . 1 1 29 29 GLY CA C 13 46.343 0.400 . 1 . . . . 342 GLY CA . 6900 1 325 . 1 1 29 29 GLY N N 15 114.436 0.400 . 1 . . . . 342 GLY N . 6900 1 326 . 1 1 30 30 ASP H H 1 8.218 0.020 . 1 . . . . 343 ASP H . 6900 1 327 . 1 1 30 30 ASP HA H 1 4.800 0.020 . 1 . . . . 343 ASP HA . 6900 1 328 . 1 1 30 30 ASP HB2 H 1 3.119 0.020 . 2 . . . . 343 ASP HB2 . 6900 1 329 . 1 1 30 30 ASP HB3 H 1 2.399 0.020 . 2 . . . . 343 ASP HB3 . 6900 1 330 . 1 1 30 30 ASP CA C 13 53.762 0.400 . 1 . . . . 343 ASP CA . 6900 1 331 . 1 1 30 30 ASP CB C 13 40.520 0.400 . 1 . . . . 343 ASP CB . 6900 1 332 . 1 1 30 30 ASP N N 15 119.067 0.400 . 1 . . . . 343 ASP N . 6900 1 333 . 1 1 31 31 ILE H H 1 8.634 0.020 . 1 . . . . 344 ILE H . 6900 1 334 . 1 1 31 31 ILE HA H 1 3.570 0.020 . 1 . . . . 344 ILE HA . 6900 1 335 . 1 1 31 31 ILE HB H 1 1.918 0.020 . 1 . . . . 344 ILE HB . 6900 1 336 . 1 1 31 31 ILE HG12 H 1 2.041 0.020 . 2 . . . . 344 ILE HG12 . 6900 1 337 . 1 1 31 31 ILE HG13 H 1 1.082 0.020 . 2 . . . . 344 ILE HG13 . 6900 1 338 . 1 1 31 31 ILE HG21 H 1 0.944 0.020 . 1 . . . . 344 ILE HG2 . 6900 1 339 . 1 1 31 31 ILE HG22 H 1 0.944 0.020 . 1 . . . . 344 ILE HG2 . 6900 1 340 . 1 1 31 31 ILE HG23 H 1 0.944 0.020 . 1 . . . . 344 ILE HG2 . 6900 1 341 . 1 1 31 31 ILE HD11 H 1 0.995 0.020 . 1 . . . . 344 ILE HD1 . 6900 1 342 . 1 1 31 31 ILE HD12 H 1 0.995 0.020 . 1 . . . . 344 ILE HD1 . 6900 1 343 . 1 1 31 31 ILE HD13 H 1 0.995 0.020 . 1 . . . . 344 ILE HD1 . 6900 1 344 . 1 1 31 31 ILE CA C 13 65.450 0.400 . 1 . . . . 344 ILE CA . 6900 1 345 . 1 1 31 31 ILE CB C 13 38.604 0.400 . 1 . . . . 344 ILE CB . 6900 1 346 . 1 1 31 31 ILE CG1 C 13 30.619 0.400 . 1 . . . . 344 ILE CG1 . 6900 1 347 . 1 1 31 31 ILE CG2 C 13 16.836 0.400 . 1 . . . . 344 ILE CG2 . 6900 1 348 . 1 1 31 31 ILE CD1 C 13 13.541 0.400 . 1 . . . . 344 ILE CD1 . 6900 1 349 . 1 1 31 31 ILE N N 15 130.014 0.400 . 1 . . . . 344 ILE N . 6900 1 350 . 1 1 32 32 SER H H 1 8.208 0.020 . 1 . . . . 345 SER H . 6900 1 351 . 1 1 32 32 SER HA H 1 4.308 0.020 . 1 . . . . 345 SER HA . 6900 1 352 . 1 1 32 32 SER HB2 H 1 3.997 0.020 . 1 . . . . 345 SER HB2 . 6900 1 353 . 1 1 32 32 SER HB3 H 1 3.997 0.020 . 1 . . . . 345 SER HB3 . 6900 1 354 . 1 1 32 32 SER CA C 13 61.683 0.400 . 1 . . . . 345 SER CA . 6900 1 355 . 1 1 32 32 SER CB C 13 62.476 0.400 . 1 . . . . 345 SER CB . 6900 1 356 . 1 1 32 32 SER N N 15 115.991 0.400 . 1 . . . . 345 SER N . 6900 1 357 . 1 1 33 33 GLU H H 1 8.077 0.020 . 1 . . . . 346 GLU H . 6900 1 358 . 1 1 33 33 GLU HA H 1 4.278 0.020 . 1 . . . . 346 GLU HA . 6900 1 359 . 1 1 33 33 GLU HB2 H 1 1.986 0.020 . 2 . . . . 346 GLU HB2 . 6900 1 360 . 1 1 33 33 GLU HB3 H 1 1.890 0.020 . 2 . . . . 346 GLU HB3 . 6900 1 361 . 1 1 33 33 GLU HG2 H 1 2.360 0.020 . 2 . . . . 346 GLU HG2 . 6900 1 362 . 1 1 33 33 GLU HG3 H 1 2.255 0.020 . 2 . . . . 346 GLU HG3 . 6900 1 363 . 1 1 33 33 GLU CA C 13 58.274 0.400 . 1 . . . . 346 GLU CA . 6900 1 364 . 1 1 33 33 GLU CB C 13 29.208 0.400 . 1 . . . . 346 GLU CB . 6900 1 365 . 1 1 33 33 GLU CG C 13 35.393 0.400 . 1 . . . . 346 GLU CG . 6900 1 366 . 1 1 33 33 GLU N N 15 123.897 0.400 . 1 . . . . 346 GLU N . 6900 1 367 . 1 1 34 34 ALA H H 1 7.510 0.020 . 1 . . . . 347 ALA H . 6900 1 368 . 1 1 34 34 ALA HA H 1 4.234 0.020 . 1 . . . . 347 ALA HA . 6900 1 369 . 1 1 34 34 ALA HB1 H 1 1.241 0.020 . 1 . . . . 347 ALA HB . 6900 1 370 . 1 1 34 34 ALA HB2 H 1 1.241 0.020 . 1 . . . . 347 ALA HB . 6900 1 371 . 1 1 34 34 ALA HB3 H 1 1.241 0.020 . 1 . . . . 347 ALA HB . 6900 1 372 . 1 1 34 34 ALA CA C 13 55.569 0.400 . 1 . . . . 347 ALA CA . 6900 1 373 . 1 1 34 34 ALA CB C 13 18.345 0.400 . 1 . . . . 347 ALA CB . 6900 1 374 . 1 1 34 34 ALA N N 15 123.273 0.400 . 1 . . . . 347 ALA N . 6900 1 375 . 1 1 35 35 GLU H H 1 8.502 0.020 . 1 . . . . 348 GLU H . 6900 1 376 . 1 1 35 35 GLU HA H 1 3.591 0.020 . 1 . . . . 348 GLU HA . 6900 1 377 . 1 1 35 35 GLU HB2 H 1 2.050 0.020 . 1 . . . . 348 GLU HB2 . 6900 1 378 . 1 1 35 35 GLU HB3 H 1 2.050 0.020 . 1 . . . . 348 GLU HB3 . 6900 1 379 . 1 1 35 35 GLU HG2 H 1 2.092 0.020 . 1 . . . . 348 GLU HG2 . 6900 1 380 . 1 1 35 35 GLU HG3 H 1 2.092 0.020 . 1 . . . . 348 GLU HG3 . 6900 1 381 . 1 1 35 35 GLU CA C 13 60.345 0.400 . 1 . . . . 348 GLU CA . 6900 1 382 . 1 1 35 35 GLU CB C 13 29.853 0.400 . 1 . . . . 348 GLU CB . 6900 1 383 . 1 1 35 35 GLU CG C 13 36.777 0.400 . 1 . . . . 348 GLU CG . 6900 1 384 . 1 1 35 35 GLU N N 15 116.873 0.400 . 1 . . . . 348 GLU N . 6900 1 385 . 1 1 36 36 HIS H H 1 8.304 0.020 . 1 . . . . 349 HIS H . 6900 1 386 . 1 1 36 36 HIS HA H 1 4.264 0.020 . 1 . . . . 349 HIS HA . 6900 1 387 . 1 1 36 36 HIS HB2 H 1 3.352 0.020 . 1 . . . . 349 HIS HB2 . 6900 1 388 . 1 1 36 36 HIS HB3 H 1 3.352 0.020 . 1 . . . . 349 HIS HB3 . 6900 1 389 . 1 1 36 36 HIS HD2 H 1 7.275 0.020 . 1 . . . . 349 HIS HD2 . 6900 1 390 . 1 1 36 36 HIS HE1 H 1 8.311 0.020 . 1 . . . . 349 HIS HE1 . 6900 1 391 . 1 1 36 36 HIS CA C 13 59.474 0.400 . 1 . . . . 349 HIS CA . 6900 1 392 . 1 1 36 36 HIS CB C 13 28.775 0.400 . 1 . . . . 349 HIS CB . 6900 1 393 . 1 1 36 36 HIS N N 15 117.859 0.400 . 1 . . . . 349 HIS N . 6900 1 394 . 1 1 37 37 CYS H H 1 8.682 0.020 . 1 . . . . 350 CYS H . 6900 1 395 . 1 1 37 37 CYS HA H 1 3.950 0.020 . 1 . . . . 350 CYS HA . 6900 1 396 . 1 1 37 37 CYS HB2 H 1 3.121 0.020 . 2 . . . . 350 CYS HB2 . 6900 1 397 . 1 1 37 37 CYS HB3 H 1 2.844 0.020 . 2 . . . . 350 CYS HB3 . 6900 1 398 . 1 1 37 37 CYS CA C 13 62.949 0.400 . 1 . . . . 350 CYS CA . 6900 1 399 . 1 1 37 37 CYS CB C 13 26.588 0.400 . 1 . . . . 350 CYS CB . 6900 1 400 . 1 1 37 37 CYS N N 15 118.375 0.400 . 1 . . . . 350 CYS N . 6900 1 401 . 1 1 38 38 LEU H H 1 8.243 0.020 . 1 . . . . 351 LEU H . 6900 1 402 . 1 1 38 38 LEU HA H 1 3.886 0.020 . 1 . . . . 351 LEU HA . 6900 1 403 . 1 1 38 38 LEU HB2 H 1 1.867 0.020 . 2 . . . . 351 LEU HB2 . 6900 1 404 . 1 1 38 38 LEU HB3 H 1 1.352 0.020 . 2 . . . . 351 LEU HB3 . 6900 1 405 . 1 1 38 38 LEU HG H 1 1.299 0.020 . 1 . . . . 351 LEU HG . 6900 1 406 . 1 1 38 38 LEU HD11 H 1 0.690 0.020 . 2 . . . . 351 LEU HD1 . 6900 1 407 . 1 1 38 38 LEU HD12 H 1 0.690 0.020 . 2 . . . . 351 LEU HD1 . 6900 1 408 . 1 1 38 38 LEU HD13 H 1 0.690 0.020 . 2 . . . . 351 LEU HD1 . 6900 1 409 . 1 1 38 38 LEU HD21 H 1 0.261 0.020 . 2 . . . . 351 LEU HD2 . 6900 1 410 . 1 1 38 38 LEU HD22 H 1 0.261 0.020 . 2 . . . . 351 LEU HD2 . 6900 1 411 . 1 1 38 38 LEU HD23 H 1 0.261 0.020 . 2 . . . . 351 LEU HD2 . 6900 1 412 . 1 1 38 38 LEU CA C 13 57.746 0.400 . 1 . . . . 351 LEU CA . 6900 1 413 . 1 1 38 38 LEU CB C 13 42.009 0.400 . 1 . . . . 351 LEU CB . 6900 1 414 . 1 1 38 38 LEU CG C 13 26.632 0.400 . 1 . . . . 351 LEU CG . 6900 1 415 . 1 1 38 38 LEU CD1 C 13 22.322 0.400 . 1 . . . . 351 LEU CD1 . 6900 1 416 . 1 1 38 38 LEU CD2 C 13 26.026 0.400 . 1 . . . . 351 LEU CD2 . 6900 1 417 . 1 1 38 38 LEU N N 15 119.679 0.400 . 1 . . . . 351 LEU N . 6900 1 418 . 1 1 39 39 LYS H H 1 8.450 0.020 . 1 . . . . 352 LYS H . 6900 1 419 . 1 1 39 39 LYS HA H 1 4.045 0.020 . 1 . . . . 352 LYS HA . 6900 1 420 . 1 1 39 39 LYS HB2 H 1 1.931 0.020 . 1 . . . . 352 LYS HB2 . 6900 1 421 . 1 1 39 39 LYS HB3 H 1 1.931 0.020 . 1 . . . . 352 LYS HB3 . 6900 1 422 . 1 1 39 39 LYS HG2 H 1 1.704 0.020 . 2 . . . . 352 LYS HG2 . 6900 1 423 . 1 1 39 39 LYS HG3 H 1 1.472 0.020 . 2 . . . . 352 LYS HG3 . 6900 1 424 . 1 1 39 39 LYS HD2 H 1 1.700 0.020 . 1 . . . . 352 LYS HD2 . 6900 1 425 . 1 1 39 39 LYS HD3 H 1 1.700 0.020 . 1 . . . . 352 LYS HD3 . 6900 1 426 . 1 1 39 39 LYS HE2 H 1 2.987 0.020 . 1 . . . . 352 LYS HE2 . 6900 1 427 . 1 1 39 39 LYS HE3 H 1 2.987 0.020 . 1 . . . . 352 LYS HE3 . 6900 1 428 . 1 1 39 39 LYS CA C 13 60.199 0.400 . 1 . . . . 352 LYS CA . 6900 1 429 . 1 1 39 39 LYS CB C 13 31.880 0.400 . 1 . . . . 352 LYS CB . 6900 1 430 . 1 1 39 39 LYS CG C 13 26.020 0.400 . 1 . . . . 352 LYS CG . 6900 1 431 . 1 1 39 39 LYS CD C 13 29.258 0.400 . 1 . . . . 352 LYS CD . 6900 1 432 . 1 1 39 39 LYS CE C 13 41.765 0.400 . 1 . . . . 352 LYS CE . 6900 1 433 . 1 1 39 39 LYS N N 15 120.489 0.400 . 1 . . . . 352 LYS N . 6900 1 434 . 1 1 40 40 GLU H H 1 8.001 0.020 . 1 . . . . 353 GLU H . 6900 1 435 . 1 1 40 40 GLU HA H 1 4.044 0.020 . 1 . . . . 353 GLU HA . 6900 1 436 . 1 1 40 40 GLU HB2 H 1 2.037 0.020 . 2 . . . . 353 GLU HB2 . 6900 1 437 . 1 1 40 40 GLU HB3 H 1 1.966 0.020 . 2 . . . . 353 GLU HB3 . 6900 1 438 . 1 1 40 40 GLU HG2 H 1 2.120 0.020 . 1 . . . . 353 GLU HG2 . 6900 1 439 . 1 1 40 40 GLU HG3 H 1 2.120 0.020 . 1 . . . . 353 GLU HG3 . 6900 1 440 . 1 1 40 40 GLU CA C 13 58.379 0.400 . 1 . . . . 353 GLU CA . 6900 1 441 . 1 1 40 40 GLU CB C 13 29.529 0.400 . 1 . . . . 353 GLU CB . 6900 1 442 . 1 1 40 40 GLU CG C 13 36.748 0.400 . 1 . . . . 353 GLU CG . 6900 1 443 . 1 1 40 40 GLU N N 15 118.884 0.400 . 1 . . . . 353 GLU N . 6900 1 444 . 1 1 41 41 LEU H H 1 7.482 0.020 . 1 . . . . 354 LEU H . 6900 1 445 . 1 1 41 41 LEU HA H 1 4.081 0.020 . 1 . . . . 354 LEU HA . 6900 1 446 . 1 1 41 41 LEU HB2 H 1 2.076 0.020 . 2 . . . . 354 LEU HB2 . 6900 1 447 . 1 1 41 41 LEU HB3 H 1 1.472 0.020 . 2 . . . . 354 LEU HB3 . 6900 1 448 . 1 1 41 41 LEU HG H 1 2.041 0.020 . 1 . . . . 354 LEU HG . 6900 1 449 . 1 1 41 41 LEU HD11 H 1 0.810 0.020 . 2 . . . . 354 LEU HD1 . 6900 1 450 . 1 1 41 41 LEU HD12 H 1 0.810 0.020 . 2 . . . . 354 LEU HD1 . 6900 1 451 . 1 1 41 41 LEU HD13 H 1 0.810 0.020 . 2 . . . . 354 LEU HD1 . 6900 1 452 . 1 1 41 41 LEU HD21 H 1 0.767 0.020 . 2 . . . . 354 LEU HD2 . 6900 1 453 . 1 1 41 41 LEU HD22 H 1 0.767 0.020 . 2 . . . . 354 LEU HD2 . 6900 1 454 . 1 1 41 41 LEU HD23 H 1 0.767 0.020 . 2 . . . . 354 LEU HD2 . 6900 1 455 . 1 1 41 41 LEU CA C 13 56.681 0.400 . 1 . . . . 354 LEU CA . 6900 1 456 . 1 1 41 41 LEU CB C 13 43.125 0.400 . 1 . . . . 354 LEU CB . 6900 1 457 . 1 1 41 41 LEU CG C 13 26.133 0.400 . 1 . . . . 354 LEU CG . 6900 1 458 . 1 1 41 41 LEU CD1 C 13 22.580 0.400 . 1 . . . . 354 LEU CD1 . 6900 1 459 . 1 1 41 41 LEU CD2 C 13 25.498 0.400 . 1 . . . . 354 LEU CD2 . 6900 1 460 . 1 1 41 41 LEU N N 15 117.940 0.400 . 1 . . . . 354 LEU N . 6900 1 461 . 1 1 42 42 GLU H H 1 7.534 0.020 . 1 . . . . 355 GLU H . 6900 1 462 . 1 1 42 42 GLU HA H 1 3.883 0.020 . 1 . . . . 355 GLU HA . 6900 1 463 . 1 1 42 42 GLU HB2 H 1 2.254 0.020 . 2 . . . . 355 GLU HB2 . 6900 1 464 . 1 1 42 42 GLU HB3 H 1 2.097 0.020 . 2 . . . . 355 GLU HB3 . 6900 1 465 . 1 1 42 42 GLU HG2 H 1 2.291 0.020 . 1 . . . . 355 GLU HG2 . 6900 1 466 . 1 1 42 42 GLU HG3 H 1 2.291 0.020 . 1 . . . . 355 GLU HG3 . 6900 1 467 . 1 1 42 42 GLU CA C 13 56.996 0.400 . 1 . . . . 355 GLU CA . 6900 1 468 . 1 1 42 42 GLU CB C 13 27.932 0.400 . 1 . . . . 355 GLU CB . 6900 1 469 . 1 1 42 42 GLU CG C 13 36.754 0.400 . 1 . . . . 355 GLU CG . 6900 1 470 . 1 1 42 42 GLU N N 15 113.005 0.400 . 1 . . . . 355 GLU N . 6900 1 471 . 1 1 43 43 VAL HA H 1 4.778 0.020 . 1 . . . . 356 VAL HA . 6900 1 472 . 1 1 43 43 VAL HB H 1 1.959 0.020 . 1 . . . . 356 VAL HB . 6900 1 473 . 1 1 43 43 VAL HG11 H 1 0.966 0.020 . 2 . . . . 356 VAL HG1 . 6900 1 474 . 1 1 43 43 VAL HG12 H 1 0.966 0.020 . 2 . . . . 356 VAL HG1 . 6900 1 475 . 1 1 43 43 VAL HG13 H 1 0.966 0.020 . 2 . . . . 356 VAL HG1 . 6900 1 476 . 1 1 43 43 VAL HG21 H 1 0.939 0.020 . 2 . . . . 356 VAL HG2 . 6900 1 477 . 1 1 43 43 VAL HG22 H 1 0.939 0.020 . 2 . . . . 356 VAL HG2 . 6900 1 478 . 1 1 43 43 VAL HG23 H 1 0.939 0.020 . 2 . . . . 356 VAL HG2 . 6900 1 479 . 1 1 43 43 VAL CA C 13 57.350 0.400 . 1 . . . . 356 VAL CA . 6900 1 480 . 1 1 43 43 VAL CB C 13 32.440 0.400 . 1 . . . . 356 VAL CB . 6900 1 481 . 1 1 43 43 VAL CG1 C 13 18.680 0.400 . 1 . . . . 356 VAL CG1 . 6900 1 482 . 1 1 43 43 VAL CG2 C 13 21.612 0.400 . 1 . . . . 356 VAL CG2 . 6900 1 483 . 1 1 44 44 PRO HA H 1 2.388 0.020 . 1 . . . . 357 PRO HA . 6900 1 484 . 1 1 44 44 PRO HB2 H 1 1.846 0.020 . 2 . . . . 357 PRO HB2 . 6900 1 485 . 1 1 44 44 PRO HB3 H 1 1.820 0.020 . 2 . . . . 357 PRO HB3 . 6900 1 486 . 1 1 44 44 PRO HG2 H 1 2.031 0.020 . 1 . . . . 357 PRO HG2 . 6900 1 487 . 1 1 44 44 PRO HG3 H 1 2.031 0.020 . 1 . . . . 357 PRO HG3 . 6900 1 488 . 1 1 44 44 PRO HD2 H 1 3.669 0.020 . 2 . . . . 357 PRO HD2 . 6900 1 489 . 1 1 44 44 PRO HD3 H 1 3.351 0.020 . 2 . . . . 357 PRO HD3 . 6900 1 490 . 1 1 44 44 PRO CA C 13 64.522 0.400 . 1 . . . . 357 PRO CA . 6900 1 491 . 1 1 44 44 PRO CB C 13 30.527 0.400 . 1 . . . . 357 PRO CB . 6900 1 492 . 1 1 44 44 PRO CG C 13 27.710 0.400 . 1 . . . . 357 PRO CG . 6900 1 493 . 1 1 44 44 PRO CD C 13 49.680 0.400 . 1 . . . . 357 PRO CD . 6900 1 494 . 1 1 45 45 HIS H H 1 8.110 0.020 . 1 . . . . 358 HIS H . 6900 1 495 . 1 1 45 45 HIS HA H 1 4.532 0.020 . 1 . . . . 358 HIS HA . 6900 1 496 . 1 1 45 45 HIS HB2 H 1 3.114 0.020 . 2 . . . . 358 HIS HB2 . 6900 1 497 . 1 1 45 45 HIS HB3 H 1 2.942 0.020 . 2 . . . . 358 HIS HB3 . 6900 1 498 . 1 1 45 45 HIS CA C 13 56.969 0.400 . 1 . . . . 358 HIS CA . 6900 1 499 . 1 1 45 45 HIS CB C 13 29.221 0.400 . 1 . . . . 358 HIS CB . 6900 1 500 . 1 1 45 45 HIS N N 15 114.265 0.400 . 1 . . . . 358 HIS N . 6900 1 501 . 1 1 46 46 PHE H H 1 8.292 0.020 . 1 . . . . 359 PHE H . 6900 1 502 . 1 1 46 46 PHE HA H 1 4.957 0.020 . 1 . . . . 359 PHE HA . 6900 1 503 . 1 1 46 46 PHE HB2 H 1 3.239 0.020 . 2 . . . . 359 PHE HB2 . 6900 1 504 . 1 1 46 46 PHE HB3 H 1 2.513 0.020 . 2 . . . . 359 PHE HB3 . 6900 1 505 . 1 1 46 46 PHE HD1 H 1 6.990 0.020 . 1 . . . . 359 PHE HD1 . 6900 1 506 . 1 1 46 46 PHE HD2 H 1 6.990 0.020 . 1 . . . . 359 PHE HD2 . 6900 1 507 . 1 1 46 46 PHE HE1 H 1 7.348 0.020 . 1 . . . . 359 PHE HE1 . 6900 1 508 . 1 1 46 46 PHE HE2 H 1 7.348 0.020 . 1 . . . . 359 PHE HE2 . 6900 1 509 . 1 1 46 46 PHE HZ H 1 7.290 0.020 . 1 . . . . 359 PHE HZ . 6900 1 510 . 1 1 46 46 PHE CA C 13 55.665 0.400 . 1 . . . . 359 PHE CA . 6900 1 511 . 1 1 46 46 PHE CB C 13 40.827 0.400 . 1 . . . . 359 PHE CB . 6900 1 512 . 1 1 46 46 PHE N N 15 119.466 0.400 . 1 . . . . 359 PHE N . 6900 1 513 . 1 1 47 47 HIS HA H 1 4.381 0.020 . 1 . . . . 360 HIS HA . 6900 1 514 . 1 1 47 47 HIS HB2 H 1 3.305 0.020 . 2 . . . . 360 HIS HB2 . 6900 1 515 . 1 1 47 47 HIS HB3 H 1 3.078 0.020 . 2 . . . . 360 HIS HB3 . 6900 1 516 . 1 1 47 47 HIS HD2 H 1 6.452 0.020 . 1 . . . . 360 HIS HD2 . 6900 1 517 . 1 1 47 47 HIS HE1 H 1 7.759 0.020 . 1 . . . . 360 HIS HE1 . 6900 1 518 . 1 1 47 47 HIS CA C 13 58.495 0.400 . 1 . . . . 360 HIS CA . 6900 1 519 . 1 1 47 47 HIS CB C 13 28.599 0.400 . 1 . . . . 360 HIS CB . 6900 1 520 . 1 1 48 48 HIS H H 1 9.270 0.020 . 1 . . . . 361 HIS H . 6900 1 521 . 1 1 48 48 HIS HA H 1 4.284 0.020 . 1 . . . . 361 HIS HA . 6900 1 522 . 1 1 48 48 HIS HB2 H 1 3.180 0.020 . 2 . . . . 361 HIS HB2 . 6900 1 523 . 1 1 48 48 HIS HB3 H 1 2.924 0.020 . 2 . . . . 361 HIS HB3 . 6900 1 524 . 1 1 48 48 HIS CA C 13 59.128 0.400 . 1 . . . . 361 HIS CA . 6900 1 525 . 1 1 48 48 HIS CB C 13 31.446 0.400 . 1 . . . . 361 HIS CB . 6900 1 526 . 1 1 48 48 HIS N N 15 118.689 0.400 . 1 . . . . 361 HIS N . 6900 1 527 . 1 1 49 49 GLU H H 1 6.717 0.020 . 1 . . . . 362 GLU H . 6900 1 528 . 1 1 49 49 GLU HA H 1 4.125 0.020 . 1 . . . . 362 GLU HA . 6900 1 529 . 1 1 49 49 GLU HB2 H 1 1.708 0.020 . 2 . . . . 362 GLU HB2 . 6900 1 530 . 1 1 49 49 GLU HB3 H 1 1.403 0.020 . 2 . . . . 362 GLU HB3 . 6900 1 531 . 1 1 49 49 GLU CA C 13 57.799 0.400 . 1 . . . . 362 GLU CA . 6900 1 532 . 1 1 49 49 GLU CB C 13 28.094 0.400 . 1 . . . . 362 GLU CB . 6900 1 533 . 1 1 49 49 GLU N N 15 121.647 0.400 . 1 . . . . 362 GLU N . 6900 1 534 . 1 1 50 50 LEU H H 1 7.048 0.020 . 1 . . . . 363 LEU H . 6900 1 535 . 1 1 50 50 LEU HA H 1 3.906 0.020 . 1 . . . . 363 LEU HA . 6900 1 536 . 1 1 50 50 LEU HB2 H 1 2.111 0.020 . 2 . . . . 363 LEU HB2 . 6900 1 537 . 1 1 50 50 LEU HB3 H 1 1.413 0.020 . 2 . . . . 363 LEU HB3 . 6900 1 538 . 1 1 50 50 LEU HG H 1 1.574 0.020 . 1 . . . . 363 LEU HG . 6900 1 539 . 1 1 50 50 LEU HD11 H 1 0.766 0.020 . 2 . . . . 363 LEU HD1 . 6900 1 540 . 1 1 50 50 LEU HD12 H 1 0.766 0.020 . 2 . . . . 363 LEU HD1 . 6900 1 541 . 1 1 50 50 LEU HD13 H 1 0.766 0.020 . 2 . . . . 363 LEU HD1 . 6900 1 542 . 1 1 50 50 LEU HD21 H 1 0.624 0.020 . 2 . . . . 363 LEU HD2 . 6900 1 543 . 1 1 50 50 LEU HD22 H 1 0.624 0.020 . 2 . . . . 363 LEU HD2 . 6900 1 544 . 1 1 50 50 LEU HD23 H 1 0.624 0.020 . 2 . . . . 363 LEU HD2 . 6900 1 545 . 1 1 50 50 LEU CA C 13 58.571 0.400 . 1 . . . . 363 LEU CA . 6900 1 546 . 1 1 50 50 LEU CB C 13 40.411 0.400 . 1 . . . . 363 LEU CB . 6900 1 547 . 1 1 50 50 LEU CG C 13 27.518 0.400 . 1 . . . . 363 LEU CG . 6900 1 548 . 1 1 50 50 LEU CD1 C 13 26.548 0.400 . 1 . . . . 363 LEU CD1 . 6900 1 549 . 1 1 50 50 LEU CD2 C 13 24.818 0.400 . 1 . . . . 363 LEU CD2 . 6900 1 550 . 1 1 50 50 LEU N N 15 119.847 0.400 . 1 . . . . 363 LEU N . 6900 1 551 . 1 1 51 51 VAL H H 1 7.401 0.020 . 1 . . . . 364 VAL H . 6900 1 552 . 1 1 51 51 VAL HA H 1 3.159 0.020 . 1 . . . . 364 VAL HA . 6900 1 553 . 1 1 51 51 VAL HB H 1 2.220 0.020 . 1 . . . . 364 VAL HB . 6900 1 554 . 1 1 51 51 VAL HG11 H 1 1.145 0.020 . 2 . . . . 364 VAL HG1 . 6900 1 555 . 1 1 51 51 VAL HG12 H 1 1.145 0.020 . 2 . . . . 364 VAL HG1 . 6900 1 556 . 1 1 51 51 VAL HG13 H 1 1.145 0.020 . 2 . . . . 364 VAL HG1 . 6900 1 557 . 1 1 51 51 VAL HG21 H 1 0.975 0.020 . 2 . . . . 364 VAL HG2 . 6900 1 558 . 1 1 51 51 VAL HG22 H 1 0.975 0.020 . 2 . . . . 364 VAL HG2 . 6900 1 559 . 1 1 51 51 VAL HG23 H 1 0.975 0.020 . 2 . . . . 364 VAL HG2 . 6900 1 560 . 1 1 51 51 VAL CA C 13 67.638 0.400 . 1 . . . . 364 VAL CA . 6900 1 561 . 1 1 51 51 VAL CB C 13 32.251 0.400 . 1 . . . . 364 VAL CB . 6900 1 562 . 1 1 51 51 VAL CG1 C 13 23.279 0.400 . 1 . . . . 364 VAL CG1 . 6900 1 563 . 1 1 51 51 VAL CG2 C 13 21.740 0.400 . 1 . . . . 364 VAL CG2 . 6900 1 564 . 1 1 51 51 VAL N N 15 118.163 0.400 . 1 . . . . 364 VAL N . 6900 1 565 . 1 1 52 52 TYR H H 1 7.919 0.020 . 1 . . . . 365 TYR H . 6900 1 566 . 1 1 52 52 TYR HA H 1 3.733 0.020 . 1 . . . . 365 TYR HA . 6900 1 567 . 1 1 52 52 TYR HB2 H 1 3.117 0.020 . 2 . . . . 365 TYR HB2 . 6900 1 568 . 1 1 52 52 TYR HB3 H 1 2.937 0.020 . 2 . . . . 365 TYR HB3 . 6900 1 569 . 1 1 52 52 TYR HD1 H 1 6.893 0.020 . 1 . . . . 365 TYR HD1 . 6900 1 570 . 1 1 52 52 TYR HD2 H 1 6.893 0.020 . 1 . . . . 365 TYR HD2 . 6900 1 571 . 1 1 52 52 TYR HE1 H 1 6.513 0.020 . 1 . . . . 365 TYR HE1 . 6900 1 572 . 1 1 52 52 TYR HE2 H 1 6.513 0.020 . 1 . . . . 365 TYR HE2 . 6900 1 573 . 1 1 52 52 TYR CA C 13 61.738 0.400 . 1 . . . . 365 TYR CA . 6900 1 574 . 1 1 52 52 TYR CB C 13 39.389 0.400 . 1 . . . . 365 TYR CB . 6900 1 575 . 1 1 52 52 TYR N N 15 116.813 0.400 . 1 . . . . 365 TYR N . 6900 1 576 . 1 1 53 53 GLU H H 1 8.522 0.020 . 1 . . . . 366 GLU H . 6900 1 577 . 1 1 53 53 GLU HA H 1 3.460 0.020 . 1 . . . . 366 GLU HA . 6900 1 578 . 1 1 53 53 GLU HB2 H 1 1.983 0.020 . 2 . . . . 366 GLU HB2 . 6900 1 579 . 1 1 53 53 GLU HB3 H 1 1.847 0.020 . 2 . . . . 366 GLU HB3 . 6900 1 580 . 1 1 53 53 GLU HG2 H 1 2.827 0.020 . 2 . . . . 366 GLU HG2 . 6900 1 581 . 1 1 53 53 GLU HG3 H 1 2.501 0.020 . 2 . . . . 366 GLU HG3 . 6900 1 582 . 1 1 53 53 GLU CA C 13 59.155 0.400 . 1 . . . . 366 GLU CA . 6900 1 583 . 1 1 53 53 GLU CB C 13 28.590 0.400 . 1 . . . . 366 GLU CB . 6900 1 584 . 1 1 53 53 GLU CG C 13 35.270 0.400 . 1 . . . . 366 GLU CG . 6900 1 585 . 1 1 53 53 GLU N N 15 116.307 0.400 . 1 . . . . 366 GLU N . 6900 1 586 . 1 1 54 54 ALA H H 1 8.559 0.020 . 1 . . . . 367 ALA H . 6900 1 587 . 1 1 54 54 ALA HA H 1 3.842 0.020 . 1 . . . . 367 ALA HA . 6900 1 588 . 1 1 54 54 ALA HB1 H 1 1.402 0.020 . 1 . . . . 367 ALA HB . 6900 1 589 . 1 1 54 54 ALA HB2 H 1 1.402 0.020 . 1 . . . . 367 ALA HB . 6900 1 590 . 1 1 54 54 ALA HB3 H 1 1.402 0.020 . 1 . . . . 367 ALA HB . 6900 1 591 . 1 1 54 54 ALA CA C 13 55.245 0.400 . 1 . . . . 367 ALA CA . 6900 1 592 . 1 1 54 54 ALA CB C 13 17.436 0.400 . 1 . . . . 367 ALA CB . 6900 1 593 . 1 1 54 54 ALA N N 15 121.411 0.400 . 1 . . . . 367 ALA N . 6900 1 594 . 1 1 55 55 ILE H H 1 7.670 0.020 . 1 . . . . 368 ILE H . 6900 1 595 . 1 1 55 55 ILE HA H 1 2.910 0.020 . 1 . . . . 368 ILE HA . 6900 1 596 . 1 1 55 55 ILE HB H 1 1.391 0.020 . 1 . . . . 368 ILE HB . 6900 1 597 . 1 1 55 55 ILE HG12 H 1 1.717 0.020 . 2 . . . . 368 ILE HG12 . 6900 1 598 . 1 1 55 55 ILE HG13 H 1 0.263 0.020 . 2 . . . . 368 ILE HG13 . 6900 1 599 . 1 1 55 55 ILE HG21 H 1 0.393 0.020 . 1 . . . . 368 ILE HG2 . 6900 1 600 . 1 1 55 55 ILE HG22 H 1 0.393 0.020 . 1 . . . . 368 ILE HG2 . 6900 1 601 . 1 1 55 55 ILE HG23 H 1 0.393 0.020 . 1 . . . . 368 ILE HG2 . 6900 1 602 . 1 1 55 55 ILE HD11 H 1 -0.051 0.020 . 1 . . . . 368 ILE HD1 . 6900 1 603 . 1 1 55 55 ILE HD12 H 1 -0.051 0.020 . 1 . . . . 368 ILE HD1 . 6900 1 604 . 1 1 55 55 ILE HD13 H 1 -0.051 0.020 . 1 . . . . 368 ILE HD1 . 6900 1 605 . 1 1 55 55 ILE CA C 13 65.936 0.400 . 1 . . . . 368 ILE CA . 6900 1 606 . 1 1 55 55 ILE CB C 13 36.816 0.400 . 1 . . . . 368 ILE CB . 6900 1 607 . 1 1 55 55 ILE CG1 C 13 28.877 0.400 . 1 . . . . 368 ILE CG1 . 6900 1 608 . 1 1 55 55 ILE CG2 C 13 17.330 0.400 . 1 . . . . 368 ILE CG2 . 6900 1 609 . 1 1 55 55 ILE CD1 C 13 12.833 0.400 . 1 . . . . 368 ILE CD1 . 6900 1 610 . 1 1 55 55 ILE N N 15 117.152 0.400 . 1 . . . . 368 ILE N . 6900 1 611 . 1 1 56 56 VAL H H 1 8.028 0.020 . 1 . . . . 369 VAL H . 6900 1 612 . 1 1 56 56 VAL HA H 1 3.055 0.020 . 1 . . . . 369 VAL HA . 6900 1 613 . 1 1 56 56 VAL HB H 1 1.722 0.020 . 1 . . . . 369 VAL HB . 6900 1 614 . 1 1 56 56 VAL HG11 H 1 0.661 0.020 . 2 . . . . 369 VAL HG1 . 6900 1 615 . 1 1 56 56 VAL HG12 H 1 0.661 0.020 . 2 . . . . 369 VAL HG1 . 6900 1 616 . 1 1 56 56 VAL HG13 H 1 0.661 0.020 . 2 . . . . 369 VAL HG1 . 6900 1 617 . 1 1 56 56 VAL HG21 H 1 0.285 0.020 . 2 . . . . 369 VAL HG2 . 6900 1 618 . 1 1 56 56 VAL HG22 H 1 0.285 0.020 . 2 . . . . 369 VAL HG2 . 6900 1 619 . 1 1 56 56 VAL HG23 H 1 0.285 0.020 . 2 . . . . 369 VAL HG2 . 6900 1 620 . 1 1 56 56 VAL CA C 13 68.434 0.400 . 1 . . . . 369 VAL CA . 6900 1 621 . 1 1 56 56 VAL CB C 13 30.765 0.400 . 1 . . . . 369 VAL CB . 6900 1 622 . 1 1 56 56 VAL CG1 C 13 21.604 0.400 . 1 . . . . 369 VAL CG1 . 6900 1 623 . 1 1 56 56 VAL CG2 C 13 23.181 0.400 . 1 . . . . 369 VAL CG2 . 6900 1 624 . 1 1 56 56 VAL N N 15 121.353 0.400 . 1 . . . . 369 VAL N . 6900 1 625 . 1 1 57 57 MET H H 1 7.706 0.020 . 1 . . . . 370 MET H . 6900 1 626 . 1 1 57 57 MET HA H 1 3.959 0.020 . 1 . . . . 370 MET HA . 6900 1 627 . 1 1 57 57 MET HB2 H 1 2.252 0.020 . 2 . . . . 370 MET HB2 . 6900 1 628 . 1 1 57 57 MET HB3 H 1 1.784 0.020 . 2 . . . . 370 MET HB3 . 6900 1 629 . 1 1 57 57 MET HG2 H 1 2.807 0.020 . 2 . . . . 370 MET HG2 . 6900 1 630 . 1 1 57 57 MET HG3 H 1 2.420 0.020 . 2 . . . . 370 MET HG3 . 6900 1 631 . 1 1 57 57 MET HE1 H 1 2.066 0.020 . 1 . . . . 370 MET HE . 6900 1 632 . 1 1 57 57 MET HE2 H 1 2.066 0.020 . 1 . . . . 370 MET HE . 6900 1 633 . 1 1 57 57 MET HE3 H 1 2.066 0.020 . 1 . . . . 370 MET HE . 6900 1 634 . 1 1 57 57 MET CA C 13 59.847 0.400 . 1 . . . . 370 MET CA . 6900 1 635 . 1 1 57 57 MET CB C 13 31.705 0.400 . 1 . . . . 370 MET CB . 6900 1 636 . 1 1 57 57 MET CG C 13 33.779 0.400 . 1 . . . . 370 MET CG . 6900 1 637 . 1 1 57 57 MET CE C 13 18.858 0.400 . 1 . . . . 370 MET CE . 6900 1 638 . 1 1 57 57 MET N N 15 116.313 0.400 . 1 . . . . 370 MET N . 6900 1 639 . 1 1 58 58 VAL H H 1 7.409 0.020 . 1 . . . . 371 VAL H . 6900 1 640 . 1 1 58 58 VAL HA H 1 3.215 0.020 . 1 . . . . 371 VAL HA . 6900 1 641 . 1 1 58 58 VAL HB H 1 1.946 0.020 . 1 . . . . 371 VAL HB . 6900 1 642 . 1 1 58 58 VAL HG11 H 1 0.548 0.020 . 2 . . . . 371 VAL HG1 . 6900 1 643 . 1 1 58 58 VAL HG12 H 1 0.548 0.020 . 2 . . . . 371 VAL HG1 . 6900 1 644 . 1 1 58 58 VAL HG13 H 1 0.548 0.020 . 2 . . . . 371 VAL HG1 . 6900 1 645 . 1 1 58 58 VAL HG21 H 1 0.528 0.020 . 2 . . . . 371 VAL HG2 . 6900 1 646 . 1 1 58 58 VAL HG22 H 1 0.528 0.020 . 2 . . . . 371 VAL HG2 . 6900 1 647 . 1 1 58 58 VAL HG23 H 1 0.528 0.020 . 2 . . . . 371 VAL HG2 . 6900 1 648 . 1 1 58 58 VAL CA C 13 67.129 0.400 . 1 . . . . 371 VAL CA . 6900 1 649 . 1 1 58 58 VAL CB C 13 31.098 0.400 . 1 . . . . 371 VAL CB . 6900 1 650 . 1 1 58 58 VAL CG1 C 13 22.995 0.400 . 1 . . . . 371 VAL CG1 . 6900 1 651 . 1 1 58 58 VAL CG2 C 13 21.300 0.400 . 1 . . . . 371 VAL CG2 . 6900 1 652 . 1 1 58 58 VAL N N 15 119.525 0.400 . 1 . . . . 371 VAL N . 6900 1 653 . 1 1 59 59 LEU H H 1 8.106 0.020 . 1 . . . . 372 LEU H . 6900 1 654 . 1 1 59 59 LEU HA H 1 3.889 0.020 . 1 . . . . 372 LEU HA . 6900 1 655 . 1 1 59 59 LEU HB2 H 1 1.948 0.020 . 2 . . . . 372 LEU HB2 . 6900 1 656 . 1 1 59 59 LEU HB3 H 1 1.284 0.020 . 2 . . . . 372 LEU HB3 . 6900 1 657 . 1 1 59 59 LEU HD11 H 1 0.734 0.020 . 2 . . . . 372 LEU HD1 . 6900 1 658 . 1 1 59 59 LEU HD12 H 1 0.734 0.020 . 2 . . . . 372 LEU HD1 . 6900 1 659 . 1 1 59 59 LEU HD13 H 1 0.734 0.020 . 2 . . . . 372 LEU HD1 . 6900 1 660 . 1 1 59 59 LEU HD21 H 1 0.739 0.020 . 2 . . . . 372 LEU HD2 . 6900 1 661 . 1 1 59 59 LEU HD22 H 1 0.739 0.020 . 2 . . . . 372 LEU HD2 . 6900 1 662 . 1 1 59 59 LEU HD23 H 1 0.739 0.020 . 2 . . . . 372 LEU HD2 . 6900 1 663 . 1 1 59 59 LEU CA C 13 57.827 0.400 . 1 . . . . 372 LEU CA . 6900 1 664 . 1 1 59 59 LEU CB C 13 40.818 0.400 . 1 . . . . 372 LEU CB . 6900 1 665 . 1 1 59 59 LEU CD1 C 13 26.068 0.400 . 1 . . . . 372 LEU CD1 . 6900 1 666 . 1 1 59 59 LEU CD2 C 13 22.100 0.400 . 1 . . . . 372 LEU CD2 . 6900 1 667 . 1 1 59 59 LEU N N 15 119.500 0.400 . 1 . . . . 372 LEU N . 6900 1 668 . 1 1 60 60 GLU H H 1 8.087 0.020 . 1 . . . . 373 GLU H . 6900 1 669 . 1 1 60 60 GLU HA H 1 4.161 0.020 . 1 . . . . 373 GLU HA . 6900 1 670 . 1 1 60 60 GLU HB2 H 1 2.042 0.020 . 2 . . . . 373 GLU HB2 . 6900 1 671 . 1 1 60 60 GLU HB3 H 1 1.899 0.020 . 2 . . . . 373 GLU HB3 . 6900 1 672 . 1 1 60 60 GLU HG2 H 1 2.412 0.020 . 2 . . . . 373 GLU HG2 . 6900 1 673 . 1 1 60 60 GLU HG3 H 1 2.117 0.020 . 2 . . . . 373 GLU HG3 . 6900 1 674 . 1 1 60 60 GLU CA C 13 56.877 0.400 . 1 . . . . 373 GLU CA . 6900 1 675 . 1 1 60 60 GLU CB C 13 30.333 0.400 . 1 . . . . 373 GLU CB . 6900 1 676 . 1 1 60 60 GLU CG C 13 36.463 0.400 . 1 . . . . 373 GLU CG . 6900 1 677 . 1 1 60 60 GLU N N 15 113.927 0.400 . 1 . . . . 373 GLU N . 6900 1 678 . 1 1 61 61 SER H H 1 7.415 0.020 . 1 . . . . 374 SER H . 6900 1 679 . 1 1 61 61 SER HA H 1 4.460 0.020 . 1 . . . . 374 SER HA . 6900 1 680 . 1 1 61 61 SER HB2 H 1 4.080 0.020 . 1 . . . . 374 SER HB2 . 6900 1 681 . 1 1 61 61 SER HB3 H 1 4.080 0.020 . 1 . . . . 374 SER HB3 . 6900 1 682 . 1 1 61 61 SER CA C 13 59.168 0.400 . 1 . . . . 374 SER CA . 6900 1 683 . 1 1 61 61 SER CB C 13 64.544 0.400 . 1 . . . . 374 SER CB . 6900 1 684 . 1 1 61 61 SER N N 15 115.281 0.400 . 1 . . . . 374 SER N . 6900 1 685 . 1 1 62 62 THR H H 1 8.522 0.020 . 1 . . . . 375 THR H . 6900 1 686 . 1 1 62 62 THR HA H 1 4.566 0.020 . 1 . . . . 375 THR HA . 6900 1 687 . 1 1 62 62 THR HB H 1 4.282 0.020 . 1 . . . . 375 THR HB . 6900 1 688 . 1 1 62 62 THR HG21 H 1 1.249 0.020 . 1 . . . . 375 THR HG2 . 6900 1 689 . 1 1 62 62 THR HG22 H 1 1.249 0.020 . 1 . . . . 375 THR HG2 . 6900 1 690 . 1 1 62 62 THR HG23 H 1 1.249 0.020 . 1 . . . . 375 THR HG2 . 6900 1 691 . 1 1 62 62 THR CA C 13 61.677 0.400 . 1 . . . . 375 THR CA . 6900 1 692 . 1 1 62 62 THR CB C 13 70.165 0.400 . 1 . . . . 375 THR CB . 6900 1 693 . 1 1 62 62 THR CG2 C 13 21.328 0.400 . 1 . . . . 375 THR CG2 . 6900 1 694 . 1 1 62 62 THR N N 15 114.974 0.400 . 1 . . . . 375 THR N . 6900 1 695 . 1 1 63 63 GLY H H 1 8.498 0.020 . 1 . . . . 376 GLY H . 6900 1 696 . 1 1 63 63 GLY HA2 H 1 4.150 0.020 . 1 . . . . 376 GLY HA2 . 6900 1 697 . 1 1 63 63 GLY HA3 H 1 4.150 0.020 . 1 . . . . 376 GLY HA3 . 6900 1 698 . 1 1 63 63 GLY CA C 13 45.076 0.400 . 1 . . . . 376 GLY CA . 6900 1 699 . 1 1 63 63 GLY N N 15 111.420 0.400 . 1 . . . . 376 GLY N . 6900 1 700 . 1 1 64 64 GLU H H 1 8.653 0.020 . 1 . . . . 377 GLU H . 6900 1 701 . 1 1 64 64 GLU HA H 1 4.442 0.020 . 1 . . . . 377 GLU HA . 6900 1 702 . 1 1 64 64 GLU HB2 H 1 2.141 0.020 . 2 . . . . 377 GLU HB2 . 6900 1 703 . 1 1 64 64 GLU HB3 H 1 1.949 0.020 . 2 . . . . 377 GLU HB3 . 6900 1 704 . 1 1 64 64 GLU HG2 H 1 2.228 0.020 . 1 . . . . 377 GLU HG2 . 6900 1 705 . 1 1 64 64 GLU HG3 H 1 2.228 0.020 . 1 . . . . 377 GLU HG3 . 6900 1 706 . 1 1 64 64 GLU CA C 13 57.209 0.400 . 1 . . . . 377 GLU CA . 6900 1 707 . 1 1 64 64 GLU CB C 13 31.059 0.400 . 1 . . . . 377 GLU CB . 6900 1 708 . 1 1 64 64 GLU CG C 13 36.209 0.400 . 1 . . . . 377 GLU CG . 6900 1 709 . 1 1 64 64 GLU N N 15 119.080 0.400 . 1 . . . . 377 GLU N . 6900 1 710 . 1 1 65 65 SER H H 1 8.269 0.020 . 1 . . . . 378 SER H . 6900 1 711 . 1 1 65 65 SER HA H 1 4.318 0.020 . 1 . . . . 378 SER HA . 6900 1 712 . 1 1 65 65 SER HB2 H 1 4.040 0.020 . 1 . . . . 378 SER HB2 . 6900 1 713 . 1 1 65 65 SER HB3 H 1 4.040 0.020 . 1 . . . . 378 SER HB3 . 6900 1 714 . 1 1 65 65 SER CA C 13 61.618 0.400 . 1 . . . . 378 SER CA . 6900 1 715 . 1 1 65 65 SER CB C 13 63.004 0.400 . 1 . . . . 378 SER CB . 6900 1 716 . 1 1 65 65 SER N N 15 115.510 0.400 . 1 . . . . 378 SER N . 6900 1 717 . 1 1 66 66 ALA H H 1 8.554 0.020 . 1 . . . . 379 ALA H . 6900 1 718 . 1 1 66 66 ALA HA H 1 3.994 0.020 . 1 . . . . 379 ALA HA . 6900 1 719 . 1 1 66 66 ALA HB1 H 1 1.428 0.020 . 1 . . . . 379 ALA HB . 6900 1 720 . 1 1 66 66 ALA HB2 H 1 1.428 0.020 . 1 . . . . 379 ALA HB . 6900 1 721 . 1 1 66 66 ALA HB3 H 1 1.428 0.020 . 1 . . . . 379 ALA HB . 6900 1 722 . 1 1 66 66 ALA CA C 13 55.922 0.400 . 1 . . . . 379 ALA CA . 6900 1 723 . 1 1 66 66 ALA CB C 13 17.478 0.400 . 1 . . . . 379 ALA CB . 6900 1 724 . 1 1 66 66 ALA N N 15 124.522 0.400 . 1 . . . . 379 ALA N . 6900 1 725 . 1 1 67 67 PHE H H 1 8.278 0.020 . 1 . . . . 380 PHE H . 6900 1 726 . 1 1 67 67 PHE HA H 1 3.970 0.020 . 1 . . . . 380 PHE HA . 6900 1 727 . 1 1 67 67 PHE HB2 H 1 3.483 0.020 . 2 . . . . 380 PHE HB2 . 6900 1 728 . 1 1 67 67 PHE HB3 H 1 3.172 0.020 . 2 . . . . 380 PHE HB3 . 6900 1 729 . 1 1 67 67 PHE HD1 H 1 7.177 0.020 . 1 . . . . 380 PHE HD1 . 6900 1 730 . 1 1 67 67 PHE HD2 H 1 7.177 0.020 . 1 . . . . 380 PHE HD2 . 6900 1 731 . 1 1 67 67 PHE HE1 H 1 7.436 0.020 . 1 . . . . 380 PHE HE1 . 6900 1 732 . 1 1 67 67 PHE HE2 H 1 7.436 0.020 . 1 . . . . 380 PHE HE2 . 6900 1 733 . 1 1 67 67 PHE HZ H 1 7.100 0.020 . 1 . . . . 380 PHE HZ . 6900 1 734 . 1 1 67 67 PHE CA C 13 61.383 0.400 . 1 . . . . 380 PHE CA . 6900 1 735 . 1 1 67 67 PHE CB C 13 39.201 0.400 . 1 . . . . 380 PHE CB . 6900 1 736 . 1 1 67 67 PHE N N 15 118.168 0.400 . 1 . . . . 380 PHE N . 6900 1 737 . 1 1 68 68 LYS H H 1 8.020 0.020 . 1 . . . . 381 LYS H . 6900 1 738 . 1 1 68 68 LYS HA H 1 4.167 0.020 . 1 . . . . 381 LYS HA . 6900 1 739 . 1 1 68 68 LYS HB2 H 1 2.075 0.020 . 1 . . . . 381 LYS HB2 . 6900 1 740 . 1 1 68 68 LYS HB3 H 1 2.075 0.020 . 1 . . . . 381 LYS HB3 . 6900 1 741 . 1 1 68 68 LYS HG2 H 1 1.674 0.020 . 2 . . . . 381 LYS HG2 . 6900 1 742 . 1 1 68 68 LYS HG3 H 1 1.587 0.020 . 2 . . . . 381 LYS HG3 . 6900 1 743 . 1 1 68 68 LYS HD2 H 1 1.809 0.020 . 1 . . . . 381 LYS HD2 . 6900 1 744 . 1 1 68 68 LYS HD3 H 1 1.809 0.020 . 1 . . . . 381 LYS HD3 . 6900 1 745 . 1 1 68 68 LYS HE2 H 1 3.033 0.020 . 1 . . . . 381 LYS HE2 . 6900 1 746 . 1 1 68 68 LYS HE3 H 1 3.033 0.020 . 1 . . . . 381 LYS HE3 . 6900 1 747 . 1 1 68 68 LYS CA C 13 59.429 0.400 . 1 . . . . 381 LYS CA . 6900 1 748 . 1 1 68 68 LYS CB C 13 32.683 0.400 . 1 . . . . 381 LYS CB . 6900 1 749 . 1 1 68 68 LYS CG C 13 25.268 0.400 . 1 . . . . 381 LYS CG . 6900 1 750 . 1 1 68 68 LYS CD C 13 28.865 0.400 . 1 . . . . 381 LYS CD . 6900 1 751 . 1 1 68 68 LYS CE C 13 42.033 0.400 . 1 . . . . 381 LYS CE . 6900 1 752 . 1 1 68 68 LYS N N 15 117.428 0.400 . 1 . . . . 381 LYS N . 6900 1 753 . 1 1 69 69 MET H H 1 8.680 0.020 . 1 . . . . 382 MET H . 6900 1 754 . 1 1 69 69 MET HA H 1 4.399 0.020 . 1 . . . . 382 MET HA . 6900 1 755 . 1 1 69 69 MET HB2 H 1 2.026 0.020 . 1 . . . . 382 MET HB2 . 6900 1 756 . 1 1 69 69 MET HB3 H 1 2.026 0.020 . 1 . . . . 382 MET HB3 . 6900 1 757 . 1 1 69 69 MET HG2 H 1 2.954 0.020 . 2 . . . . 382 MET HG2 . 6900 1 758 . 1 1 69 69 MET HG3 H 1 2.506 0.020 . 2 . . . . 382 MET HG3 . 6900 1 759 . 1 1 69 69 MET HE1 H 1 1.797 0.020 . 1 . . . . 382 MET HE . 6900 1 760 . 1 1 69 69 MET HE2 H 1 1.797 0.020 . 1 . . . . 382 MET HE . 6900 1 761 . 1 1 69 69 MET HE3 H 1 1.797 0.020 . 1 . . . . 382 MET HE . 6900 1 762 . 1 1 69 69 MET CA C 13 59.698 0.400 . 1 . . . . 382 MET CA . 6900 1 763 . 1 1 69 69 MET CB C 13 33.146 0.400 . 1 . . . . 382 MET CB . 6900 1 764 . 1 1 69 69 MET CG C 13 33.067 0.400 . 1 . . . . 382 MET CG . 6900 1 765 . 1 1 69 69 MET CE C 13 17.450 0.400 . 1 . . . . 382 MET CE . 6900 1 766 . 1 1 69 69 MET N N 15 116.528 0.400 . 1 . . . . 382 MET N . 6900 1 767 . 1 1 70 70 ILE H H 1 9.379 0.020 . 1 . . . . 383 ILE H . 6900 1 768 . 1 1 70 70 ILE HA H 1 4.048 0.020 . 1 . . . . 383 ILE HA . 6900 1 769 . 1 1 70 70 ILE HB H 1 2.119 0.020 . 1 . . . . 383 ILE HB . 6900 1 770 . 1 1 70 70 ILE HG12 H 1 1.718 0.020 . 2 . . . . 383 ILE HG12 . 6900 1 771 . 1 1 70 70 ILE HG13 H 1 1.506 0.020 . 2 . . . . 383 ILE HG13 . 6900 1 772 . 1 1 70 70 ILE HG21 H 1 0.741 0.020 . 1 . . . . 383 ILE HG2 . 6900 1 773 . 1 1 70 70 ILE HG22 H 1 0.741 0.020 . 1 . . . . 383 ILE HG2 . 6900 1 774 . 1 1 70 70 ILE HG23 H 1 0.741 0.020 . 1 . . . . 383 ILE HG2 . 6900 1 775 . 1 1 70 70 ILE HD11 H 1 0.826 0.020 . 1 . . . . 383 ILE HD1 . 6900 1 776 . 1 1 70 70 ILE HD12 H 1 0.826 0.020 . 1 . . . . 383 ILE HD1 . 6900 1 777 . 1 1 70 70 ILE HD13 H 1 0.826 0.020 . 1 . . . . 383 ILE HD1 . 6900 1 778 . 1 1 70 70 ILE CA C 13 62.598 0.400 . 1 . . . . 383 ILE CA . 6900 1 779 . 1 1 70 70 ILE CB C 13 34.103 0.400 . 1 . . . . 383 ILE CB . 6900 1 780 . 1 1 70 70 ILE CG2 C 13 18.586 0.400 . 1 . . . . 383 ILE CG2 . 6900 1 781 . 1 1 70 70 ILE CD1 C 13 9.286 0.400 . 1 . . . . 383 ILE CD1 . 6900 1 782 . 1 1 70 70 ILE N N 15 124.678 0.400 . 1 . . . . 383 ILE N . 6900 1 783 . 1 1 71 71 LEU H H 1 8.258 0.020 . 1 . . . . 384 LEU H . 6900 1 784 . 1 1 71 71 LEU HA H 1 3.947 0.020 . 1 . . . . 384 LEU HA . 6900 1 785 . 1 1 71 71 LEU HB2 H 1 2.070 0.020 . 2 . . . . 384 LEU HB2 . 6900 1 786 . 1 1 71 71 LEU HB3 H 1 1.617 0.020 . 2 . . . . 384 LEU HB3 . 6900 1 787 . 1 1 71 71 LEU HG H 1 1.464 0.020 . 1 . . . . 384 LEU HG . 6900 1 788 . 1 1 71 71 LEU HD11 H 1 0.840 0.020 . 2 . . . . 384 LEU HD1 . 6900 1 789 . 1 1 71 71 LEU HD12 H 1 0.840 0.020 . 2 . . . . 384 LEU HD1 . 6900 1 790 . 1 1 71 71 LEU HD13 H 1 0.840 0.020 . 2 . . . . 384 LEU HD1 . 6900 1 791 . 1 1 71 71 LEU HD21 H 1 0.549 0.020 . 2 . . . . 384 LEU HD2 . 6900 1 792 . 1 1 71 71 LEU HD22 H 1 0.549 0.020 . 2 . . . . 384 LEU HD2 . 6900 1 793 . 1 1 71 71 LEU HD23 H 1 0.549 0.020 . 2 . . . . 384 LEU HD2 . 6900 1 794 . 1 1 71 71 LEU CA C 13 59.793 0.400 . 1 . . . . 384 LEU CA . 6900 1 795 . 1 1 71 71 LEU CB C 13 41.538 0.400 . 1 . . . . 384 LEU CB . 6900 1 796 . 1 1 71 71 LEU CG C 13 27.622 0.400 . 1 . . . . 384 LEU CG . 6900 1 797 . 1 1 71 71 LEU CD1 C 13 26.373 0.400 . 1 . . . . 384 LEU CD1 . 6900 1 798 . 1 1 71 71 LEU CD2 C 13 24.640 0.400 . 1 . . . . 384 LEU CD2 . 6900 1 799 . 1 1 71 71 LEU N N 15 123.885 0.400 . 1 . . . . 384 LEU N . 6900 1 800 . 1 1 72 72 ASP H H 1 8.364 0.020 . 1 . . . . 385 ASP H . 6900 1 801 . 1 1 72 72 ASP HA H 1 4.427 0.020 . 1 . . . . 385 ASP HA . 6900 1 802 . 1 1 72 72 ASP HB2 H 1 2.831 0.020 . 2 . . . . 385 ASP HB2 . 6900 1 803 . 1 1 72 72 ASP HB3 H 1 2.605 0.020 . 2 . . . . 385 ASP HB3 . 6900 1 804 . 1 1 72 72 ASP CA C 13 57.833 0.400 . 1 . . . . 385 ASP CA . 6900 1 805 . 1 1 72 72 ASP CB C 13 39.981 0.400 . 1 . . . . 385 ASP CB . 6900 1 806 . 1 1 72 72 ASP N N 15 117.008 0.400 . 1 . . . . 385 ASP N . 6900 1 807 . 1 1 73 73 LEU H H 1 7.847 0.020 . 1 . . . . 386 LEU H . 6900 1 808 . 1 1 73 73 LEU HA H 1 3.915 0.020 . 1 . . . . 386 LEU HA . 6900 1 809 . 1 1 73 73 LEU HB2 H 1 1.961 0.020 . 2 . . . . 386 LEU HB2 . 6900 1 810 . 1 1 73 73 LEU HB3 H 1 1.251 0.020 . 2 . . . . 386 LEU HB3 . 6900 1 811 . 1 1 73 73 LEU HG H 1 1.154 0.020 . 1 . . . . 386 LEU HG . 6900 1 812 . 1 1 73 73 LEU HD11 H 1 0.319 0.020 . 2 . . . . 386 LEU HD1 . 6900 1 813 . 1 1 73 73 LEU HD12 H 1 0.319 0.020 . 2 . . . . 386 LEU HD1 . 6900 1 814 . 1 1 73 73 LEU HD13 H 1 0.319 0.020 . 2 . . . . 386 LEU HD1 . 6900 1 815 . 1 1 73 73 LEU HD21 H 1 0.234 0.020 . 2 . . . . 386 LEU HD2 . 6900 1 816 . 1 1 73 73 LEU HD22 H 1 0.234 0.020 . 2 . . . . 386 LEU HD2 . 6900 1 817 . 1 1 73 73 LEU HD23 H 1 0.234 0.020 . 2 . . . . 386 LEU HD2 . 6900 1 818 . 1 1 73 73 LEU CA C 13 58.535 0.400 . 1 . . . . 386 LEU CA . 6900 1 819 . 1 1 73 73 LEU CB C 13 41.434 0.400 . 1 . . . . 386 LEU CB . 6900 1 820 . 1 1 73 73 LEU CG C 13 26.603 0.400 . 1 . . . . 386 LEU CG . 6900 1 821 . 1 1 73 73 LEU CD1 C 13 25.141 0.400 . 1 . . . . 386 LEU CD1 . 6900 1 822 . 1 1 73 73 LEU CD2 C 13 22.807 0.400 . 1 . . . . 386 LEU CD2 . 6900 1 823 . 1 1 73 73 LEU N N 15 122.200 0.400 . 1 . . . . 386 LEU N . 6900 1 824 . 1 1 74 74 LEU H H 1 8.628 0.020 . 1 . . . . 387 LEU H . 6900 1 825 . 1 1 74 74 LEU HA H 1 3.870 0.020 . 1 . . . . 387 LEU HA . 6900 1 826 . 1 1 74 74 LEU HB2 H 1 1.952 0.020 . 2 . . . . 387 LEU HB2 . 6900 1 827 . 1 1 74 74 LEU HB3 H 1 1.282 0.020 . 2 . . . . 387 LEU HB3 . 6900 1 828 . 1 1 74 74 LEU HG H 1 1.937 0.020 . 1 . . . . 387 LEU HG . 6900 1 829 . 1 1 74 74 LEU HD11 H 1 0.961 0.020 . 2 . . . . 387 LEU HD1 . 6900 1 830 . 1 1 74 74 LEU HD12 H 1 0.961 0.020 . 2 . . . . 387 LEU HD1 . 6900 1 831 . 1 1 74 74 LEU HD13 H 1 0.961 0.020 . 2 . . . . 387 LEU HD1 . 6900 1 832 . 1 1 74 74 LEU HD21 H 1 0.695 0.020 . 2 . . . . 387 LEU HD2 . 6900 1 833 . 1 1 74 74 LEU HD22 H 1 0.695 0.020 . 2 . . . . 387 LEU HD2 . 6900 1 834 . 1 1 74 74 LEU HD23 H 1 0.695 0.020 . 2 . . . . 387 LEU HD2 . 6900 1 835 . 1 1 74 74 LEU CA C 13 58.545 0.400 . 1 . . . . 387 LEU CA . 6900 1 836 . 1 1 74 74 LEU CB C 13 41.230 0.400 . 1 . . . . 387 LEU CB . 6900 1 837 . 1 1 74 74 LEU CG C 13 26.791 0.400 . 1 . . . . 387 LEU CG . 6900 1 838 . 1 1 74 74 LEU CD1 C 13 25.785 0.400 . 1 . . . . 387 LEU CD1 . 6900 1 839 . 1 1 74 74 LEU CD2 C 13 21.980 0.400 . 1 . . . . 387 LEU CD2 . 6900 1 840 . 1 1 74 74 LEU N N 15 117.624 0.400 . 1 . . . . 387 LEU N . 6900 1 841 . 1 1 75 75 LYS H H 1 8.743 0.020 . 1 . . . . 388 LYS H . 6900 1 842 . 1 1 75 75 LYS HA H 1 4.028 0.020 . 1 . . . . 388 LYS HA . 6900 1 843 . 1 1 75 75 LYS HB2 H 1 2.007 0.020 . 2 . . . . 388 LYS HB2 . 6900 1 844 . 1 1 75 75 LYS HB3 H 1 1.929 0.020 . 2 . . . . 388 LYS HB3 . 6900 1 845 . 1 1 75 75 LYS HG2 H 1 1.680 0.020 . 2 . . . . 388 LYS HG2 . 6900 1 846 . 1 1 75 75 LYS HG3 H 1 1.415 0.020 . 2 . . . . 388 LYS HG3 . 6900 1 847 . 1 1 75 75 LYS HD2 H 1 1.714 0.020 . 1 . . . . 388 LYS HD2 . 6900 1 848 . 1 1 75 75 LYS HD3 H 1 1.714 0.020 . 1 . . . . 388 LYS HD3 . 6900 1 849 . 1 1 75 75 LYS HE2 H 1 2.973 0.020 . 1 . . . . 388 LYS HE2 . 6900 1 850 . 1 1 75 75 LYS HE3 H 1 2.973 0.020 . 1 . . . . 388 LYS HE3 . 6900 1 851 . 1 1 75 75 LYS CA C 13 60.671 0.400 . 1 . . . . 388 LYS CA . 6900 1 852 . 1 1 75 75 LYS CB C 13 32.723 0.400 . 1 . . . . 388 LYS CB . 6900 1 853 . 1 1 75 75 LYS CG C 13 25.414 0.400 . 1 . . . . 388 LYS CG . 6900 1 854 . 1 1 75 75 LYS CD C 13 29.772 0.400 . 1 . . . . 388 LYS CD . 6900 1 855 . 1 1 75 75 LYS CE C 13 41.316 0.400 . 1 . . . . 388 LYS CE . 6900 1 856 . 1 1 75 75 LYS N N 15 117.223 0.400 . 1 . . . . 388 LYS N . 6900 1 857 . 1 1 76 76 SER H H 1 7.851 0.020 . 1 . . . . 389 SER H . 6900 1 858 . 1 1 76 76 SER HA H 1 4.251 0.020 . 1 . . . . 389 SER HA . 6900 1 859 . 1 1 76 76 SER HB2 H 1 4.026 0.020 . 1 . . . . 389 SER HB2 . 6900 1 860 . 1 1 76 76 SER HB3 H 1 4.026 0.020 . 1 . . . . 389 SER HB3 . 6900 1 861 . 1 1 76 76 SER CA C 13 62.370 0.400 . 1 . . . . 389 SER CA . 6900 1 862 . 1 1 76 76 SER CB C 13 63.419 0.400 . 1 . . . . 389 SER CB . 6900 1 863 . 1 1 76 76 SER N N 15 114.183 0.400 . 1 . . . . 389 SER N . 6900 1 864 . 1 1 77 77 LEU H H 1 8.589 0.020 . 1 . . . . 390 LEU H . 6900 1 865 . 1 1 77 77 LEU HA H 1 4.180 0.020 . 1 . . . . 390 LEU HA . 6900 1 866 . 1 1 77 77 LEU HB2 H 1 1.825 0.020 . 2 . . . . 390 LEU HB2 . 6900 1 867 . 1 1 77 77 LEU HB3 H 1 1.209 0.020 . 2 . . . . 390 LEU HB3 . 6900 1 868 . 1 1 77 77 LEU HG H 1 1.938 0.020 . 1 . . . . 390 LEU HG . 6900 1 869 . 1 1 77 77 LEU HD11 H 1 0.691 0.020 . 2 . . . . 390 LEU HD1 . 6900 1 870 . 1 1 77 77 LEU HD12 H 1 0.691 0.020 . 2 . . . . 390 LEU HD1 . 6900 1 871 . 1 1 77 77 LEU HD13 H 1 0.691 0.020 . 2 . . . . 390 LEU HD1 . 6900 1 872 . 1 1 77 77 LEU HD21 H 1 0.555 0.020 . 2 . . . . 390 LEU HD2 . 6900 1 873 . 1 1 77 77 LEU HD22 H 1 0.555 0.020 . 2 . . . . 390 LEU HD2 . 6900 1 874 . 1 1 77 77 LEU HD23 H 1 0.555 0.020 . 2 . . . . 390 LEU HD2 . 6900 1 875 . 1 1 77 77 LEU CA C 13 57.314 0.400 . 1 . . . . 390 LEU CA . 6900 1 876 . 1 1 77 77 LEU CB C 13 41.691 0.400 . 1 . . . . 390 LEU CB . 6900 1 877 . 1 1 77 77 LEU CG C 13 26.782 0.400 . 1 . . . . 390 LEU CG . 6900 1 878 . 1 1 77 77 LEU CD1 C 13 22.525 0.400 . 1 . . . . 390 LEU CD1 . 6900 1 879 . 1 1 77 77 LEU CD2 C 13 26.001 0.400 . 1 . . . . 390 LEU CD2 . 6900 1 880 . 1 1 77 77 LEU N N 15 119.661 0.400 . 1 . . . . 390 LEU N . 6900 1 881 . 1 1 78 78 TRP H H 1 8.515 0.020 . 1 . . . . 391 TRP H . 6900 1 882 . 1 1 78 78 TRP HA H 1 4.728 0.020 . 1 . . . . 391 TRP HA . 6900 1 883 . 1 1 78 78 TRP HB2 H 1 3.542 0.020 . 2 . . . . 391 TRP HB2 . 6900 1 884 . 1 1 78 78 TRP HB3 H 1 3.238 0.020 . 2 . . . . 391 TRP HB3 . 6900 1 885 . 1 1 78 78 TRP HD1 H 1 7.119 0.020 . 1 . . . . 391 TRP HD1 . 6900 1 886 . 1 1 78 78 TRP HE1 H 1 9.735 0.020 . 1 . . . . 391 TRP HE1 . 6900 1 887 . 1 1 78 78 TRP HE3 H 1 7.562 0.020 . 1 . . . . 391 TRP HE3 . 6900 1 888 . 1 1 78 78 TRP HZ2 H 1 7.441 0.020 . 1 . . . . 391 TRP HZ2 . 6900 1 889 . 1 1 78 78 TRP HZ3 H 1 6.958 0.020 . 1 . . . . 391 TRP HZ3 . 6900 1 890 . 1 1 78 78 TRP HH2 H 1 7.169 0.020 . 1 . . . . 391 TRP HH2 . 6900 1 891 . 1 1 78 78 TRP CA C 13 60.108 0.400 . 1 . . . . 391 TRP CA . 6900 1 892 . 1 1 78 78 TRP CB C 13 29.494 0.400 . 1 . . . . 391 TRP CB . 6900 1 893 . 1 1 78 78 TRP N N 15 120.675 0.400 . 1 . . . . 391 TRP N . 6900 1 894 . 1 1 78 78 TRP NE1 N 15 128.819 0.400 . 1 . . . . 391 TRP NE1 . 6900 1 895 . 1 1 79 79 LYS H H 1 8.555 0.020 . 1 . . . . 392 LYS H . 6900 1 896 . 1 1 79 79 LYS HA H 1 3.746 0.020 . 1 . . . . 392 LYS HA . 6900 1 897 . 1 1 79 79 LYS HB2 H 1 2.140 0.020 . 2 . . . . 392 LYS HB2 . 6900 1 898 . 1 1 79 79 LYS HB3 H 1 2.068 0.020 . 2 . . . . 392 LYS HB3 . 6900 1 899 . 1 1 79 79 LYS HG2 H 1 1.743 0.020 . 2 . . . . 392 LYS HG2 . 6900 1 900 . 1 1 79 79 LYS HG3 H 1 1.596 0.020 . 2 . . . . 392 LYS HG3 . 6900 1 901 . 1 1 79 79 LYS HD2 H 1 1.763 0.020 . 1 . . . . 392 LYS HD2 . 6900 1 902 . 1 1 79 79 LYS HD3 H 1 1.763 0.020 . 1 . . . . 392 LYS HD3 . 6900 1 903 . 1 1 79 79 LYS HE2 H 1 3.020 0.020 . 1 . . . . 392 LYS HE2 . 6900 1 904 . 1 1 79 79 LYS HE3 H 1 3.020 0.020 . 1 . . . . 392 LYS HE3 . 6900 1 905 . 1 1 79 79 LYS CA C 13 59.467 0.400 . 1 . . . . 392 LYS CA . 6900 1 906 . 1 1 79 79 LYS CB C 13 32.105 0.400 . 1 . . . . 392 LYS CB . 6900 1 907 . 1 1 79 79 LYS CG C 13 25.443 0.400 . 1 . . . . 392 LYS CG . 6900 1 908 . 1 1 79 79 LYS CD C 13 28.979 0.400 . 1 . . . . 392 LYS CD . 6900 1 909 . 1 1 79 79 LYS CE C 13 41.857 0.400 . 1 . . . . 392 LYS CE . 6900 1 910 . 1 1 79 79 LYS N N 15 122.230 0.400 . 1 . . . . 392 LYS N . 6900 1 911 . 1 1 80 80 SER H H 1 8.097 0.020 . 1 . . . . 393 SER H . 6900 1 912 . 1 1 80 80 SER HA H 1 4.425 0.020 . 1 . . . . 393 SER HA . 6900 1 913 . 1 1 80 80 SER HB2 H 1 4.176 0.020 . 1 . . . . 393 SER HB2 . 6900 1 914 . 1 1 80 80 SER HB3 H 1 4.176 0.020 . 1 . . . . 393 SER HB3 . 6900 1 915 . 1 1 80 80 SER CA C 13 58.003 0.400 . 1 . . . . 393 SER CA . 6900 1 916 . 1 1 80 80 SER CB C 13 63.724 0.400 . 1 . . . . 393 SER CB . 6900 1 917 . 1 1 80 80 SER N N 15 111.741 0.400 . 1 . . . . 393 SER N . 6900 1 918 . 1 1 81 81 SER H H 1 7.794 0.020 . 1 . . . . 394 SER H . 6900 1 919 . 1 1 81 81 SER HA H 1 4.074 0.020 . 1 . . . . 394 SER HA . 6900 1 920 . 1 1 81 81 SER HB2 H 1 4.035 0.020 . 1 . . . . 394 SER HB2 . 6900 1 921 . 1 1 81 81 SER HB3 H 1 4.035 0.020 . 1 . . . . 394 SER HB3 . 6900 1 922 . 1 1 81 81 SER CA C 13 59.485 0.400 . 1 . . . . 394 SER CA . 6900 1 923 . 1 1 81 81 SER CB C 13 61.378 0.400 . 1 . . . . 394 SER CB . 6900 1 924 . 1 1 81 81 SER N N 15 114.091 0.400 . 1 . . . . 394 SER N . 6900 1 925 . 1 1 82 82 THR H H 1 8.280 0.020 . 1 . . . . 395 THR H . 6900 1 926 . 1 1 82 82 THR HA H 1 4.044 0.020 . 1 . . . . 395 THR HA . 6900 1 927 . 1 1 82 82 THR HB H 1 4.058 0.020 . 1 . . . . 395 THR HB . 6900 1 928 . 1 1 82 82 THR HG21 H 1 1.155 0.020 . 1 . . . . 395 THR HG2 . 6900 1 929 . 1 1 82 82 THR HG22 H 1 1.155 0.020 . 1 . . . . 395 THR HG2 . 6900 1 930 . 1 1 82 82 THR HG23 H 1 1.155 0.020 . 1 . . . . 395 THR HG2 . 6900 1 931 . 1 1 82 82 THR CA C 13 66.032 0.400 . 1 . . . . 395 THR CA . 6900 1 932 . 1 1 82 82 THR CB C 13 68.171 0.400 . 1 . . . . 395 THR CB . 6900 1 933 . 1 1 82 82 THR CG2 C 13 23.131 0.400 . 1 . . . . 395 THR CG2 . 6900 1 934 . 1 1 82 82 THR N N 15 117.790 0.400 . 1 . . . . 395 THR N . 6900 1 935 . 1 1 83 83 ILE H H 1 7.058 0.020 . 1 . . . . 396 ILE H . 6900 1 936 . 1 1 83 83 ILE HA H 1 4.984 0.020 . 1 . . . . 396 ILE HA . 6900 1 937 . 1 1 83 83 ILE HB H 1 1.599 0.020 . 1 . . . . 396 ILE HB . 6900 1 938 . 1 1 83 83 ILE HG12 H 1 1.395 0.020 . 2 . . . . 396 ILE HG12 . 6900 1 939 . 1 1 83 83 ILE HG13 H 1 0.885 0.020 . 2 . . . . 396 ILE HG13 . 6900 1 940 . 1 1 83 83 ILE HG21 H 1 1.060 0.020 . 1 . . . . 396 ILE HG2 . 6900 1 941 . 1 1 83 83 ILE HG22 H 1 1.060 0.020 . 1 . . . . 396 ILE HG2 . 6900 1 942 . 1 1 83 83 ILE HG23 H 1 1.060 0.020 . 1 . . . . 396 ILE HG2 . 6900 1 943 . 1 1 83 83 ILE HD11 H 1 0.732 0.020 . 1 . . . . 396 ILE HD1 . 6900 1 944 . 1 1 83 83 ILE HD12 H 1 0.732 0.020 . 1 . . . . 396 ILE HD1 . 6900 1 945 . 1 1 83 83 ILE HD13 H 1 0.732 0.020 . 1 . . . . 396 ILE HD1 . 6900 1 946 . 1 1 83 83 ILE CA C 13 59.260 0.400 . 1 . . . . 396 ILE CA . 6900 1 947 . 1 1 83 83 ILE CB C 13 39.564 0.400 . 1 . . . . 396 ILE CB . 6900 1 948 . 1 1 83 83 ILE CG1 C 13 27.360 0.400 . 1 . . . . 396 ILE CG1 . 6900 1 949 . 1 1 83 83 ILE CG2 C 13 18.152 0.400 . 1 . . . . 396 ILE CG2 . 6900 1 950 . 1 1 83 83 ILE CD1 C 13 13.860 0.400 . 1 . . . . 396 ILE CD1 . 6900 1 951 . 1 1 83 83 ILE N N 15 117.100 0.400 . 1 . . . . 396 ILE N . 6900 1 952 . 1 1 84 84 THR HA H 1 4.481 0.020 . 1 . . . . 397 THR HA . 6900 1 953 . 1 1 84 84 THR HB H 1 4.734 0.020 . 1 . . . . 397 THR HB . 6900 1 954 . 1 1 84 84 THR HG21 H 1 1.275 0.020 . 1 . . . . 397 THR HG2 . 6900 1 955 . 1 1 84 84 THR HG22 H 1 1.275 0.020 . 1 . . . . 397 THR HG2 . 6900 1 956 . 1 1 84 84 THR HG23 H 1 1.275 0.020 . 1 . . . . 397 THR HG2 . 6900 1 957 . 1 1 84 84 THR CA C 13 60.591 0.400 . 1 . . . . 397 THR CA . 6900 1 958 . 1 1 84 84 THR CB C 13 71.451 0.400 . 1 . . . . 397 THR CB . 6900 1 959 . 1 1 84 84 THR CG2 C 13 21.795 0.400 . 1 . . . . 397 THR CG2 . 6900 1 960 . 1 1 85 85 ILE H H 1 9.022 0.020 . 1 . . . . 398 ILE H . 6900 1 961 . 1 1 85 85 ILE HA H 1 4.119 0.020 . 1 . . . . 398 ILE HA . 6900 1 962 . 1 1 85 85 ILE HB H 1 2.108 0.020 . 1 . . . . 398 ILE HB . 6900 1 963 . 1 1 85 85 ILE HG12 H 1 1.767 0.020 . 2 . . . . 398 ILE HG12 . 6900 1 964 . 1 1 85 85 ILE HG13 H 1 1.484 0.020 . 2 . . . . 398 ILE HG13 . 6900 1 965 . 1 1 85 85 ILE HG21 H 1 1.134 0.020 . 1 . . . . 398 ILE HG2 . 6900 1 966 . 1 1 85 85 ILE HG22 H 1 1.134 0.020 . 1 . . . . 398 ILE HG2 . 6900 1 967 . 1 1 85 85 ILE HG23 H 1 1.134 0.020 . 1 . . . . 398 ILE HG2 . 6900 1 968 . 1 1 85 85 ILE HD11 H 1 1.064 0.020 . 1 . . . . 398 ILE HD1 . 6900 1 969 . 1 1 85 85 ILE HD12 H 1 1.064 0.020 . 1 . . . . 398 ILE HD1 . 6900 1 970 . 1 1 85 85 ILE HD13 H 1 1.064 0.020 . 1 . . . . 398 ILE HD1 . 6900 1 971 . 1 1 85 85 ILE CA C 13 64.980 0.400 . 1 . . . . 398 ILE CA . 6900 1 972 . 1 1 85 85 ILE CB C 13 38.307 0.400 . 1 . . . . 398 ILE CB . 6900 1 973 . 1 1 85 85 ILE CG1 C 13 29.150 0.400 . 1 . . . . 398 ILE CG1 . 6900 1 974 . 1 1 85 85 ILE CG2 C 13 16.987 0.400 . 1 . . . . 398 ILE CG2 . 6900 1 975 . 1 1 85 85 ILE CD1 C 13 13.746 0.400 . 1 . . . . 398 ILE CD1 . 6900 1 976 . 1 1 85 85 ILE N N 15 120.837 0.400 . 1 . . . . 398 ILE N . 6900 1 977 . 1 1 86 86 ASP H H 1 8.411 0.020 . 1 . . . . 399 ASP H . 6900 1 978 . 1 1 86 86 ASP HA H 1 4.468 0.020 . 1 . . . . 399 ASP HA . 6900 1 979 . 1 1 86 86 ASP HB2 H 1 2.653 0.020 . 1 . . . . 399 ASP HB2 . 6900 1 980 . 1 1 86 86 ASP HB3 H 1 2.653 0.020 . 1 . . . . 399 ASP HB3 . 6900 1 981 . 1 1 86 86 ASP CA C 13 57.365 0.400 . 1 . . . . 399 ASP CA . 6900 1 982 . 1 1 86 86 ASP CB C 13 41.121 0.400 . 1 . . . . 399 ASP CB . 6900 1 983 . 1 1 86 86 ASP N N 15 118.925 0.400 . 1 . . . . 399 ASP N . 6900 1 984 . 1 1 87 87 GLN H H 1 7.510 0.020 . 1 . . . . 400 GLN H . 6900 1 985 . 1 1 87 87 GLN HA H 1 4.051 0.020 . 1 . . . . 400 GLN HA . 6900 1 986 . 1 1 87 87 GLN HB2 H 1 2.495 0.020 . 1 . . . . 400 GLN HB2 . 6900 1 987 . 1 1 87 87 GLN HB3 H 1 2.495 0.020 . 1 . . . . 400 GLN HB3 . 6900 1 988 . 1 1 87 87 GLN CA C 13 58.674 0.400 . 1 . . . . 400 GLN CA . 6900 1 989 . 1 1 87 87 GLN CB C 13 28.735 0.400 . 1 . . . . 400 GLN CB . 6900 1 990 . 1 1 87 87 GLN N N 15 119.722 0.400 . 1 . . . . 400 GLN N . 6900 1 991 . 1 1 88 88 MET H H 1 8.354 0.020 . 1 . . . . 401 MET H . 6900 1 992 . 1 1 88 88 MET HA H 1 4.309 0.020 . 1 . . . . 401 MET HA . 6900 1 993 . 1 1 88 88 MET HB2 H 1 2.286 0.020 . 1 . . . . 401 MET HB2 . 6900 1 994 . 1 1 88 88 MET HB3 H 1 2.286 0.020 . 1 . . . . 401 MET HB3 . 6900 1 995 . 1 1 88 88 MET HG2 H 1 2.659 0.020 . 2 . . . . 401 MET HG2 . 6900 1 996 . 1 1 88 88 MET HG3 H 1 2.602 0.020 . 2 . . . . 401 MET HG3 . 6900 1 997 . 1 1 88 88 MET HE1 H 1 1.984 0.020 . 1 . . . . 401 MET HE . 6900 1 998 . 1 1 88 88 MET HE2 H 1 1.984 0.020 . 1 . . . . 401 MET HE . 6900 1 999 . 1 1 88 88 MET HE3 H 1 1.984 0.020 . 1 . . . . 401 MET HE . 6900 1 1000 . 1 1 88 88 MET CA C 13 58.398 0.400 . 1 . . . . 401 MET CA . 6900 1 1001 . 1 1 88 88 MET CB C 13 32.844 0.400 . 1 . . . . 401 MET CB . 6900 1 1002 . 1 1 88 88 MET CG C 13 32.538 0.400 . 1 . . . . 401 MET CG . 6900 1 1003 . 1 1 88 88 MET CE C 13 17.900 0.400 . 1 . . . . 401 MET CE . 6900 1 1004 . 1 1 88 88 MET N N 15 118.784 0.400 . 1 . . . . 401 MET N . 6900 1 1005 . 1 1 89 89 LYS H H 1 8.454 0.020 . 1 . . . . 402 LYS H . 6900 1 1006 . 1 1 89 89 LYS HA H 1 3.950 0.020 . 1 . . . . 402 LYS HA . 6900 1 1007 . 1 1 89 89 LYS HB2 H 1 1.976 0.020 . 1 . . . . 402 LYS HB2 . 6900 1 1008 . 1 1 89 89 LYS HB3 H 1 1.976 0.020 . 1 . . . . 402 LYS HB3 . 6900 1 1009 . 1 1 89 89 LYS HG2 H 1 1.458 0.020 . 2 . . . . 402 LYS HG2 . 6900 1 1010 . 1 1 89 89 LYS HG3 H 1 1.331 0.020 . 2 . . . . 402 LYS HG3 . 6900 1 1011 . 1 1 89 89 LYS HD2 H 1 1.708 0.020 . 1 . . . . 402 LYS HD2 . 6900 1 1012 . 1 1 89 89 LYS HD3 H 1 1.708 0.020 . 1 . . . . 402 LYS HD3 . 6900 1 1013 . 1 1 89 89 LYS HE2 H 1 2.965 0.020 . 1 . . . . 402 LYS HE2 . 6900 1 1014 . 1 1 89 89 LYS HE3 H 1 2.965 0.020 . 1 . . . . 402 LYS HE3 . 6900 1 1015 . 1 1 89 89 LYS CA C 13 59.946 0.400 . 1 . . . . 402 LYS CA . 6900 1 1016 . 1 1 89 89 LYS CB C 13 32.816 0.400 . 1 . . . . 402 LYS CB . 6900 1 1017 . 1 1 89 89 LYS CG C 13 24.595 0.400 . 1 . . . . 402 LYS CG . 6900 1 1018 . 1 1 89 89 LYS CD C 13 29.779 0.400 . 1 . . . . 402 LYS CD . 6900 1 1019 . 1 1 89 89 LYS CE C 13 41.717 0.400 . 1 . . . . 402 LYS CE . 6900 1 1020 . 1 1 89 89 LYS N N 15 118.389 0.400 . 1 . . . . 402 LYS N . 6900 1 1021 . 1 1 90 90 ARG H H 1 7.708 0.020 . 1 . . . . 403 ARG H . 6900 1 1022 . 1 1 90 90 ARG HA H 1 4.177 0.020 . 1 . . . . 403 ARG HA . 6900 1 1023 . 1 1 90 90 ARG HB2 H 1 1.824 0.020 . 1 . . . . 403 ARG HB2 . 6900 1 1024 . 1 1 90 90 ARG HB3 H 1 1.824 0.020 . 1 . . . . 403 ARG HB3 . 6900 1 1025 . 1 1 90 90 ARG HG2 H 1 1.649 0.020 . 2 . . . . 403 ARG HG2 . 6900 1 1026 . 1 1 90 90 ARG HG3 H 1 1.402 0.020 . 2 . . . . 403 ARG HG3 . 6900 1 1027 . 1 1 90 90 ARG HD2 H 1 2.964 0.020 . 2 . . . . 403 ARG HD2 . 6900 1 1028 . 1 1 90 90 ARG HD3 H 1 2.764 0.020 . 2 . . . . 403 ARG HD3 . 6900 1 1029 . 1 1 90 90 ARG CA C 13 58.999 0.400 . 1 . . . . 403 ARG CA . 6900 1 1030 . 1 1 90 90 ARG CB C 13 30.325 0.400 . 1 . . . . 403 ARG CB . 6900 1 1031 . 1 1 90 90 ARG CG C 13 27.446 0.400 . 1 . . . . 403 ARG CG . 6900 1 1032 . 1 1 90 90 ARG CD C 13 43.289 0.400 . 1 . . . . 403 ARG CD . 6900 1 1033 . 1 1 90 90 ARG N N 15 116.318 0.400 . 1 . . . . 403 ARG N . 6900 1 1034 . 1 1 91 91 GLY H H 1 8.160 0.020 . 1 . . . . 404 GLY H . 6900 1 1035 . 1 1 91 91 GLY HA2 H 1 3.985 0.020 . 2 . . . . 404 GLY HA2 . 6900 1 1036 . 1 1 91 91 GLY HA3 H 1 3.750 0.020 . 2 . . . . 404 GLY HA3 . 6900 1 1037 . 1 1 91 91 GLY CA C 13 48.188 0.400 . 1 . . . . 404 GLY CA . 6900 1 1038 . 1 1 91 91 GLY N N 15 106.298 0.400 . 1 . . . . 404 GLY N . 6900 1 1039 . 1 1 92 92 TYR H H 1 8.185 0.020 . 1 . . . . 405 TYR H . 6900 1 1040 . 1 1 92 92 TYR HA H 1 3.673 0.020 . 1 . . . . 405 TYR HA . 6900 1 1041 . 1 1 92 92 TYR HB2 H 1 2.923 0.020 . 2 . . . . 405 TYR HB2 . 6900 1 1042 . 1 1 92 92 TYR HB3 H 1 2.172 0.020 . 2 . . . . 405 TYR HB3 . 6900 1 1043 . 1 1 92 92 TYR HD1 H 1 7.182 0.020 . 1 . . . . 405 TYR HD1 . 6900 1 1044 . 1 1 92 92 TYR HD2 H 1 7.182 0.020 . 1 . . . . 405 TYR HD2 . 6900 1 1045 . 1 1 92 92 TYR HE1 H 1 6.598 0.020 . 1 . . . . 405 TYR HE1 . 6900 1 1046 . 1 1 92 92 TYR HE2 H 1 6.598 0.020 . 1 . . . . 405 TYR HE2 . 6900 1 1047 . 1 1 92 92 TYR CA C 13 62.604 0.400 . 1 . . . . 405 TYR CA . 6900 1 1048 . 1 1 92 92 TYR CB C 13 38.423 0.400 . 1 . . . . 405 TYR CB . 6900 1 1049 . 1 1 92 92 TYR N N 15 119.756 0.400 . 1 . . . . 405 TYR N . 6900 1 1050 . 1 1 93 93 GLU H H 1 8.635 0.020 . 1 . . . . 406 GLU H . 6900 1 1051 . 1 1 93 93 GLU HA H 1 3.667 0.020 . 1 . . . . 406 GLU HA . 6900 1 1052 . 1 1 93 93 GLU HB2 H 1 2.163 0.020 . 2 . . . . 406 GLU HB2 . 6900 1 1053 . 1 1 93 93 GLU HB3 H 1 1.929 0.020 . 2 . . . . 406 GLU HB3 . 6900 1 1054 . 1 1 93 93 GLU HG2 H 1 2.549 0.020 . 2 . . . . 406 GLU HG2 . 6900 1 1055 . 1 1 93 93 GLU HG3 H 1 2.138 0.020 . 2 . . . . 406 GLU HG3 . 6900 1 1056 . 1 1 93 93 GLU CA C 13 60.155 0.400 . 1 . . . . 406 GLU CA . 6900 1 1057 . 1 1 93 93 GLU CB C 13 29.458 0.400 . 1 . . . . 406 GLU CB . 6900 1 1058 . 1 1 93 93 GLU CG C 13 37.622 0.400 . 1 . . . . 406 GLU CG . 6900 1 1059 . 1 1 93 93 GLU N N 15 116.301 0.400 . 1 . . . . 406 GLU N . 6900 1 1060 . 1 1 94 94 ARG H H 1 7.666 0.020 . 1 . . . . 407 ARG H . 6900 1 1061 . 1 1 94 94 ARG HA H 1 4.147 0.020 . 1 . . . . 407 ARG HA . 6900 1 1062 . 1 1 94 94 ARG HB2 H 1 1.952 0.020 . 1 . . . . 407 ARG HB2 . 6900 1 1063 . 1 1 94 94 ARG HB3 H 1 1.952 0.020 . 1 . . . . 407 ARG HB3 . 6900 1 1064 . 1 1 94 94 ARG HG2 H 1 1.353 0.020 . 1 . . . . 407 ARG HG2 . 6900 1 1065 . 1 1 94 94 ARG HG3 H 1 1.353 0.020 . 1 . . . . 407 ARG HG3 . 6900 1 1066 . 1 1 94 94 ARG HD2 H 1 2.943 0.020 . 2 . . . . 407 ARG HD2 . 6900 1 1067 . 1 1 94 94 ARG HD3 H 1 2.474 0.020 . 2 . . . . 407 ARG HD3 . 6900 1 1068 . 1 1 94 94 ARG HE H 1 6.708 0.020 . 1 . . . . 407 ARG HE . 6900 1 1069 . 1 1 94 94 ARG CA C 13 60.046 0.400 . 1 . . . . 407 ARG CA . 6900 1 1070 . 1 1 94 94 ARG CB C 13 30.694 0.400 . 1 . . . . 407 ARG CB . 6900 1 1071 . 1 1 94 94 ARG CG C 13 27.097 0.400 . 1 . . . . 407 ARG CG . 6900 1 1072 . 1 1 94 94 ARG CD C 13 44.008 0.400 . 1 . . . . 407 ARG CD . 6900 1 1073 . 1 1 94 94 ARG N N 15 117.933 0.400 . 1 . . . . 407 ARG N . 6900 1 1074 . 1 1 94 94 ARG NE N 15 83.844 0.400 . 1 . . . . 407 ARG NE . 6900 1 1075 . 1 1 95 95 ILE H H 1 7.429 0.020 . 1 . . . . 408 ILE H . 6900 1 1076 . 1 1 95 95 ILE HA H 1 4.019 0.020 . 1 . . . . 408 ILE HA . 6900 1 1077 . 1 1 95 95 ILE HB H 1 2.210 0.020 . 1 . . . . 408 ILE HB . 6900 1 1078 . 1 1 95 95 ILE HG12 H 1 1.579 0.020 . 2 . . . . 408 ILE HG12 . 6900 1 1079 . 1 1 95 95 ILE HG13 H 1 1.178 0.020 . 2 . . . . 408 ILE HG13 . 6900 1 1080 . 1 1 95 95 ILE HG21 H 1 0.942 0.020 . 1 . . . . 408 ILE HG2 . 6900 1 1081 . 1 1 95 95 ILE HG22 H 1 0.942 0.020 . 1 . . . . 408 ILE HG2 . 6900 1 1082 . 1 1 95 95 ILE HG23 H 1 0.942 0.020 . 1 . . . . 408 ILE HG2 . 6900 1 1083 . 1 1 95 95 ILE HD11 H 1 0.502 0.020 . 1 . . . . 408 ILE HD1 . 6900 1 1084 . 1 1 95 95 ILE HD12 H 1 0.502 0.020 . 1 . . . . 408 ILE HD1 . 6900 1 1085 . 1 1 95 95 ILE HD13 H 1 0.502 0.020 . 1 . . . . 408 ILE HD1 . 6900 1 1086 . 1 1 95 95 ILE CA C 13 61.992 0.400 . 1 . . . . 408 ILE CA . 6900 1 1087 . 1 1 95 95 ILE CB C 13 35.720 0.400 . 1 . . . . 408 ILE CB . 6900 1 1088 . 1 1 95 95 ILE CG1 C 13 27.518 0.400 . 1 . . . . 408 ILE CG1 . 6900 1 1089 . 1 1 95 95 ILE CG2 C 13 18.823 0.400 . 1 . . . . 408 ILE CG2 . 6900 1 1090 . 1 1 95 95 ILE CD1 C 13 10.940 0.400 . 1 . . . . 408 ILE CD1 . 6900 1 1091 . 1 1 95 95 ILE N N 15 119.770 0.400 . 1 . . . . 408 ILE N . 6900 1 1092 . 1 1 96 96 TYR H H 1 8.851 0.020 . 1 . . . . 409 TYR H . 6900 1 1093 . 1 1 96 96 TYR HA H 1 4.381 0.020 . 1 . . . . 409 TYR HA . 6900 1 1094 . 1 1 96 96 TYR HB2 H 1 3.417 0.020 . 2 . . . . 409 TYR HB2 . 6900 1 1095 . 1 1 96 96 TYR HB3 H 1 3.231 0.020 . 2 . . . . 409 TYR HB3 . 6900 1 1096 . 1 1 96 96 TYR HD1 H 1 6.996 0.020 . 1 . . . . 409 TYR HD1 . 6900 1 1097 . 1 1 96 96 TYR HD2 H 1 6.996 0.020 . 1 . . . . 409 TYR HD2 . 6900 1 1098 . 1 1 96 96 TYR HE1 H 1 6.865 0.020 . 1 . . . . 409 TYR HE1 . 6900 1 1099 . 1 1 96 96 TYR HE2 H 1 6.865 0.020 . 1 . . . . 409 TYR HE2 . 6900 1 1100 . 1 1 96 96 TYR CA C 13 57.538 0.400 . 1 . . . . 409 TYR CA . 6900 1 1101 . 1 1 96 96 TYR CB C 13 35.761 0.400 . 1 . . . . 409 TYR CB . 6900 1 1102 . 1 1 96 96 TYR N N 15 119.656 0.400 . 1 . . . . 409 TYR N . 6900 1 1103 . 1 1 97 97 ASN H H 1 7.944 0.020 . 1 . . . . 410 ASN H . 6900 1 1104 . 1 1 97 97 ASN HA H 1 4.652 0.020 . 1 . . . . 410 ASN HA . 6900 1 1105 . 1 1 97 97 ASN HB2 H 1 3.020 0.020 . 2 . . . . 410 ASN HB2 . 6900 1 1106 . 1 1 97 97 ASN HB3 H 1 2.971 0.020 . 2 . . . . 410 ASN HB3 . 6900 1 1107 . 1 1 97 97 ASN HD21 H 1 7.693 0.020 . 2 . . . . 410 ASN HD21 . 6900 1 1108 . 1 1 97 97 ASN HD22 H 1 7.019 0.020 . 2 . . . . 410 ASN HD22 . 6900 1 1109 . 1 1 97 97 ASN CA C 13 55.540 0.400 . 1 . . . . 410 ASN CA . 6900 1 1110 . 1 1 97 97 ASN CB C 13 39.508 0.400 . 1 . . . . 410 ASN CB . 6900 1 1111 . 1 1 97 97 ASN N N 15 115.056 0.400 . 1 . . . . 410 ASN N . 6900 1 1112 . 1 1 97 97 ASN ND2 N 15 113.114 0.400 . 1 . . . . 410 ASN ND2 . 6900 1 1113 . 1 1 98 98 GLU H H 1 7.959 0.020 . 1 . . . . 411 GLU H . 6900 1 1114 . 1 1 98 98 GLU HA H 1 4.567 0.020 . 1 . . . . 411 GLU HA . 6900 1 1115 . 1 1 98 98 GLU HB2 H 1 2.423 0.020 . 2 . . . . 411 GLU HB2 . 6900 1 1116 . 1 1 98 98 GLU HB3 H 1 2.045 0.020 . 2 . . . . 411 GLU HB3 . 6900 1 1117 . 1 1 98 98 GLU HG2 H 1 2.696 0.020 . 2 . . . . 411 GLU HG2 . 6900 1 1118 . 1 1 98 98 GLU HG3 H 1 2.434 0.020 . 2 . . . . 411 GLU HG3 . 6900 1 1119 . 1 1 98 98 GLU CA C 13 57.012 0.400 . 1 . . . . 411 GLU CA . 6900 1 1120 . 1 1 98 98 GLU CB C 13 31.333 0.400 . 1 . . . . 411 GLU CB . 6900 1 1121 . 1 1 98 98 GLU CG C 13 36.612 0.400 . 1 . . . . 411 GLU CG . 6900 1 1122 . 1 1 98 98 GLU N N 15 117.539 0.400 . 1 . . . . 411 GLU N . 6900 1 1123 . 1 1 99 99 ILE H H 1 8.272 0.020 . 1 . . . . 412 ILE H . 6900 1 1124 . 1 1 99 99 ILE HA H 1 4.260 0.020 . 1 . . . . 412 ILE HA . 6900 1 1125 . 1 1 99 99 ILE HB H 1 2.010 0.020 . 1 . . . . 412 ILE HB . 6900 1 1126 . 1 1 99 99 ILE HG12 H 1 1.115 0.020 . 1 . . . . 412 ILE HG12 . 6900 1 1127 . 1 1 99 99 ILE HG13 H 1 1.115 0.020 . 1 . . . . 412 ILE HG13 . 6900 1 1128 . 1 1 99 99 ILE HG21 H 1 1.035 0.020 . 1 . . . . 412 ILE HG2 . 6900 1 1129 . 1 1 99 99 ILE HG22 H 1 1.035 0.020 . 1 . . . . 412 ILE HG2 . 6900 1 1130 . 1 1 99 99 ILE HG23 H 1 1.035 0.020 . 1 . . . . 412 ILE HG2 . 6900 1 1131 . 1 1 99 99 ILE HD11 H 1 0.676 0.020 . 1 . . . . 412 ILE HD1 . 6900 1 1132 . 1 1 99 99 ILE HD12 H 1 0.676 0.020 . 1 . . . . 412 ILE HD1 . 6900 1 1133 . 1 1 99 99 ILE HD13 H 1 0.676 0.020 . 1 . . . . 412 ILE HD1 . 6900 1 1134 . 1 1 99 99 ILE CA C 13 62.986 0.400 . 1 . . . . 412 ILE CA . 6900 1 1135 . 1 1 99 99 ILE CB C 13 38.773 0.400 . 1 . . . . 412 ILE CB . 6900 1 1136 . 1 1 99 99 ILE CG1 C 13 28.986 0.400 . 1 . . . . 412 ILE CG1 . 6900 1 1137 . 1 1 99 99 ILE CG2 C 13 18.842 0.400 . 1 . . . . 412 ILE CG2 . 6900 1 1138 . 1 1 99 99 ILE CD1 C 13 15.100 0.400 . 1 . . . . 412 ILE CD1 . 6900 1 1139 . 1 1 99 99 ILE N N 15 122.133 0.400 . 1 . . . . 412 ILE N . 6900 1 1140 . 1 1 100 100 PRO HA H 1 4.435 0.020 . 1 . . . . 413 PRO HA . 6900 1 1141 . 1 1 100 100 PRO HB2 H 1 2.378 0.020 . 2 . . . . 413 PRO HB2 . 6900 1 1142 . 1 1 100 100 PRO HB3 H 1 1.842 0.020 . 2 . . . . 413 PRO HB3 . 6900 1 1143 . 1 1 100 100 PRO HG2 H 1 2.085 0.020 . 2 . . . . 413 PRO HG2 . 6900 1 1144 . 1 1 100 100 PRO HG3 H 1 1.990 0.020 . 2 . . . . 413 PRO HG3 . 6900 1 1145 . 1 1 100 100 PRO HD2 H 1 3.815 0.020 . 2 . . . . 413 PRO HD2 . 6900 1 1146 . 1 1 100 100 PRO HD3 H 1 3.514 0.020 . 2 . . . . 413 PRO HD3 . 6900 1 1147 . 1 1 100 100 PRO CA C 13 66.156 0.400 . 1 . . . . 413 PRO CA . 6900 1 1148 . 1 1 100 100 PRO CB C 13 30.864 0.400 . 1 . . . . 413 PRO CB . 6900 1 1149 . 1 1 100 100 PRO CG C 13 28.341 0.400 . 1 . . . . 413 PRO CG . 6900 1 1150 . 1 1 100 100 PRO CD C 13 51.195 0.400 . 1 . . . . 413 PRO CD . 6900 1 1151 . 1 1 101 101 ASP H H 1 7.583 0.020 . 1 . . . . 414 ASP H . 6900 1 1152 . 1 1 101 101 ASP HA H 1 4.645 0.020 . 1 . . . . 414 ASP HA . 6900 1 1153 . 1 1 101 101 ASP HB2 H 1 2.806 0.020 . 2 . . . . 414 ASP HB2 . 6900 1 1154 . 1 1 101 101 ASP HB3 H 1 2.771 0.020 . 2 . . . . 414 ASP HB3 . 6900 1 1155 . 1 1 101 101 ASP CA C 13 56.000 0.400 . 1 . . . . 414 ASP CA . 6900 1 1156 . 1 1 101 101 ASP CB C 13 41.234 0.400 . 1 . . . . 414 ASP CB . 6900 1 1157 . 1 1 101 101 ASP N N 15 115.880 0.400 . 1 . . . . 414 ASP N . 6900 1 1158 . 1 1 102 102 ILE H H 1 8.004 0.020 . 1 . . . . 415 ILE H . 6900 1 1159 . 1 1 102 102 ILE HA H 1 3.926 0.020 . 1 . . . . 415 ILE HA . 6900 1 1160 . 1 1 102 102 ILE HB H 1 1.794 0.020 . 1 . . . . 415 ILE HB . 6900 1 1161 . 1 1 102 102 ILE HG12 H 1 1.684 0.020 . 2 . . . . 415 ILE HG12 . 6900 1 1162 . 1 1 102 102 ILE HG13 H 1 1.152 0.020 . 2 . . . . 415 ILE HG13 . 6900 1 1163 . 1 1 102 102 ILE HG21 H 1 0.906 0.020 . 1 . . . . 415 ILE HG2 . 6900 1 1164 . 1 1 102 102 ILE HG22 H 1 0.906 0.020 . 1 . . . . 415 ILE HG2 . 6900 1 1165 . 1 1 102 102 ILE HG23 H 1 0.906 0.020 . 1 . . . . 415 ILE HG2 . 6900 1 1166 . 1 1 102 102 ILE HD11 H 1 0.778 0.020 . 1 . . . . 415 ILE HD1 . 6900 1 1167 . 1 1 102 102 ILE HD12 H 1 0.778 0.020 . 1 . . . . 415 ILE HD1 . 6900 1 1168 . 1 1 102 102 ILE HD13 H 1 0.778 0.020 . 1 . . . . 415 ILE HD1 . 6900 1 1169 . 1 1 102 102 ILE CA C 13 64.244 0.400 . 1 . . . . 415 ILE CA . 6900 1 1170 . 1 1 102 102 ILE CB C 13 38.943 0.400 . 1 . . . . 415 ILE CB . 6900 1 1171 . 1 1 102 102 ILE CG1 C 13 28.360 0.400 . 1 . . . . 415 ILE CG1 . 6900 1 1172 . 1 1 102 102 ILE CG2 C 13 16.123 0.400 . 1 . . . . 415 ILE CG2 . 6900 1 1173 . 1 1 102 102 ILE CD1 C 13 13.523 0.400 . 1 . . . . 415 ILE CD1 . 6900 1 1174 . 1 1 102 102 ILE N N 15 122.943 0.400 . 1 . . . . 415 ILE N . 6900 1 1175 . 1 1 103 103 ASN H H 1 8.577 0.020 . 1 . . . . 416 ASN H . 6900 1 1176 . 1 1 103 103 ASN HA H 1 4.627 0.020 . 1 . . . . 416 ASN HA . 6900 1 1177 . 1 1 103 103 ASN HB2 H 1 2.770 0.020 . 2 . . . . 416 ASN HB2 . 6900 1 1178 . 1 1 103 103 ASN HB3 H 1 2.619 0.020 . 2 . . . . 416 ASN HB3 . 6900 1 1179 . 1 1 103 103 ASN HD21 H 1 7.660 0.020 . 2 . . . . 416 ASN HD21 . 6900 1 1180 . 1 1 103 103 ASN HD22 H 1 6.914 0.020 . 2 . . . . 416 ASN HD22 . 6900 1 1181 . 1 1 103 103 ASN CA C 13 54.673 0.400 . 1 . . . . 416 ASN CA . 6900 1 1182 . 1 1 103 103 ASN CB C 13 39.875 0.400 . 1 . . . . 416 ASN CB . 6900 1 1183 . 1 1 103 103 ASN N N 15 117.570 0.400 . 1 . . . . 416 ASN N . 6900 1 1184 . 1 1 103 103 ASN ND2 N 15 113.974 0.400 . 1 . . . . 416 ASN ND2 . 6900 1 1185 . 1 1 104 104 LEU H H 1 7.401 0.020 . 1 . . . . 417 LEU H . 6900 1 1186 . 1 1 104 104 LEU HA H 1 4.208 0.020 . 1 . . . . 417 LEU HA . 6900 1 1187 . 1 1 104 104 LEU HB2 H 1 1.830 0.020 . 2 . . . . 417 LEU HB2 . 6900 1 1188 . 1 1 104 104 LEU HB3 H 1 1.558 0.020 . 2 . . . . 417 LEU HB3 . 6900 1 1189 . 1 1 104 104 LEU HG H 1 1.903 0.020 . 1 . . . . 417 LEU HG . 6900 1 1190 . 1 1 104 104 LEU HD11 H 1 0.982 0.020 . 2 . . . . 417 LEU HD1 . 6900 1 1191 . 1 1 104 104 LEU HD12 H 1 0.982 0.020 . 2 . . . . 417 LEU HD1 . 6900 1 1192 . 1 1 104 104 LEU HD13 H 1 0.982 0.020 . 2 . . . . 417 LEU HD1 . 6900 1 1193 . 1 1 104 104 LEU HD21 H 1 0.910 0.020 . 2 . . . . 417 LEU HD2 . 6900 1 1194 . 1 1 104 104 LEU HD22 H 1 0.910 0.020 . 2 . . . . 417 LEU HD2 . 6900 1 1195 . 1 1 104 104 LEU HD23 H 1 0.910 0.020 . 2 . . . . 417 LEU HD2 . 6900 1 1196 . 1 1 104 104 LEU CA C 13 56.329 0.400 . 1 . . . . 417 LEU CA . 6900 1 1197 . 1 1 104 104 LEU CB C 13 42.037 0.400 . 1 . . . . 417 LEU CB . 6900 1 1198 . 1 1 104 104 LEU CG C 13 26.580 0.400 . 1 . . . . 417 LEU CG . 6900 1 1199 . 1 1 104 104 LEU CD1 C 13 25.265 0.400 . 1 . . . . 417 LEU CD1 . 6900 1 1200 . 1 1 104 104 LEU CD2 C 13 22.754 0.400 . 1 . . . . 417 LEU CD2 . 6900 1 1201 . 1 1 104 104 LEU N N 15 117.599 0.400 . 1 . . . . 417 LEU N . 6900 1 1202 . 1 1 105 105 ASP HA H 1 4.732 0.020 . 1 . . . . 418 ASP HA . 6900 1 1203 . 1 1 105 105 ASP HB2 H 1 2.780 0.020 . 2 . . . . 418 ASP HB2 . 6900 1 1204 . 1 1 105 105 ASP HB3 H 1 2.636 0.020 . 2 . . . . 418 ASP HB3 . 6900 1 1205 . 1 1 105 105 ASP CA C 13 55.057 0.400 . 1 . . . . 418 ASP CA . 6900 1 1206 . 1 1 105 105 ASP CB C 13 42.246 0.400 . 1 . . . . 418 ASP CB . 6900 1 1207 . 1 1 106 106 VAL HA H 1 4.119 0.020 . 1 . . . . 419 VAL HA . 6900 1 1208 . 1 1 106 106 VAL HB H 1 2.093 0.020 . 1 . . . . 419 VAL HB . 6900 1 1209 . 1 1 106 106 VAL HG11 H 1 0.949 0.020 . 2 . . . . 419 VAL HG1 . 6900 1 1210 . 1 1 106 106 VAL HG12 H 1 0.949 0.020 . 2 . . . . 419 VAL HG1 . 6900 1 1211 . 1 1 106 106 VAL HG13 H 1 0.949 0.020 . 2 . . . . 419 VAL HG1 . 6900 1 1212 . 1 1 106 106 VAL HG21 H 1 0.952 0.020 . 2 . . . . 419 VAL HG2 . 6900 1 1213 . 1 1 106 106 VAL HG22 H 1 0.952 0.020 . 2 . . . . 419 VAL HG2 . 6900 1 1214 . 1 1 106 106 VAL HG23 H 1 0.952 0.020 . 2 . . . . 419 VAL HG2 . 6900 1 1215 . 1 1 106 106 VAL CA C 13 62.148 0.400 . 1 . . . . 419 VAL CA . 6900 1 1216 . 1 1 106 106 VAL CB C 13 32.795 0.400 . 1 . . . . 419 VAL CB . 6900 1 1217 . 1 1 106 106 VAL CG1 C 13 21.228 0.400 . 1 . . . . 419 VAL CG1 . 6900 1 1218 . 1 1 106 106 VAL CG2 C 13 20.291 0.400 . 1 . . . . 419 VAL CG2 . 6900 1 1219 . 1 1 107 107 PRO HA H 1 4.557 0.020 . 1 . . . . 420 PRO HA . 6900 1 1220 . 1 1 107 107 PRO HB2 H 1 2.389 0.020 . 2 . . . . 420 PRO HB2 . 6900 1 1221 . 1 1 107 107 PRO HB3 H 1 2.138 0.020 . 2 . . . . 420 PRO HB3 . 6900 1 1222 . 1 1 107 107 PRO HG2 H 1 1.942 0.020 . 2 . . . . 420 PRO HG2 . 6900 1 1223 . 1 1 107 107 PRO HG3 H 1 1.816 0.020 . 2 . . . . 420 PRO HG3 . 6900 1 1224 . 1 1 107 107 PRO HD2 H 1 3.580 0.020 . 1 . . . . 420 PRO HD2 . 6900 1 1225 . 1 1 107 107 PRO HD3 H 1 3.580 0.020 . 1 . . . . 420 PRO HD3 . 6900 1 1226 . 1 1 107 107 PRO CA C 13 62.339 0.400 . 1 . . . . 420 PRO CA . 6900 1 1227 . 1 1 107 107 PRO CB C 13 34.662 0.400 . 1 . . . . 420 PRO CB . 6900 1 1228 . 1 1 107 107 PRO CG C 13 24.713 0.400 . 1 . . . . 420 PRO CG . 6900 1 1229 . 1 1 107 107 PRO CD C 13 50.300 0.400 . 1 . . . . 420 PRO CD . 6900 1 1230 . 1 1 108 108 HIS H H 1 8.654 0.020 . 1 . . . . 421 HIS H . 6900 1 1231 . 1 1 108 108 HIS HA H 1 4.803 0.020 . 1 . . . . 421 HIS HA . 6900 1 1232 . 1 1 108 108 HIS HB2 H 1 3.475 0.020 . 2 . . . . 421 HIS HB2 . 6900 1 1233 . 1 1 108 108 HIS HB3 H 1 3.268 0.020 . 2 . . . . 421 HIS HB3 . 6900 1 1234 . 1 1 108 108 HIS HD2 H 1 7.092 0.020 . 1 . . . . 421 HIS HD2 . 6900 1 1235 . 1 1 108 108 HIS HE1 H 1 8.136 0.020 . 1 . . . . 421 HIS HE1 . 6900 1 1236 . 1 1 108 108 HIS CA C 13 56.972 0.400 . 1 . . . . 421 HIS CA . 6900 1 1237 . 1 1 108 108 HIS CB C 13 28.715 0.400 . 1 . . . . 421 HIS CB . 6900 1 1238 . 1 1 108 108 HIS N N 15 123.084 0.400 . 1 . . . . 421 HIS N . 6900 1 1239 . 1 1 109 109 SER HA H 1 4.133 0.020 . 1 . . . . 422 SER HA . 6900 1 1240 . 1 1 109 109 SER HB2 H 1 3.859 0.020 . 1 . . . . 422 SER HB2 . 6900 1 1241 . 1 1 109 109 SER HB3 H 1 3.859 0.020 . 1 . . . . 422 SER HB3 . 6900 1 1242 . 1 1 109 109 SER CA C 13 62.654 0.400 . 1 . . . . 422 SER CA . 6900 1 1243 . 1 1 109 109 SER CB C 13 63.026 0.400 . 1 . . . . 422 SER CB . 6900 1 1244 . 1 1 110 110 TYR H H 1 8.323 0.020 . 1 . . . . 423 TYR H . 6900 1 1245 . 1 1 110 110 TYR HA H 1 4.089 0.020 . 1 . . . . 423 TYR HA . 6900 1 1246 . 1 1 110 110 TYR HB2 H 1 3.013 0.020 . 1 . . . . 423 TYR HB2 . 6900 1 1247 . 1 1 110 110 TYR HB3 H 1 3.013 0.020 . 1 . . . . 423 TYR HB3 . 6900 1 1248 . 1 1 110 110 TYR HD1 H 1 7.110 0.020 . 1 . . . . 423 TYR HD1 . 6900 1 1249 . 1 1 110 110 TYR HD2 H 1 7.110 0.020 . 1 . . . . 423 TYR HD2 . 6900 1 1250 . 1 1 110 110 TYR HE1 H 1 6.695 0.020 . 1 . . . . 423 TYR HE1 . 6900 1 1251 . 1 1 110 110 TYR HE2 H 1 6.695 0.020 . 1 . . . . 423 TYR HE2 . 6900 1 1252 . 1 1 110 110 TYR CA C 13 62.665 0.400 . 1 . . . . 423 TYR CA . 6900 1 1253 . 1 1 110 110 TYR CB C 13 37.507 0.400 . 1 . . . . 423 TYR CB . 6900 1 1254 . 1 1 110 110 TYR N N 15 121.059 0.400 . 1 . . . . 423 TYR N . 6900 1 1255 . 1 1 111 111 SER H H 1 7.833 0.020 . 1 . . . . 424 SER H . 6900 1 1256 . 1 1 111 111 SER HA H 1 4.299 0.020 . 1 . . . . 424 SER HA . 6900 1 1257 . 1 1 111 111 SER HB2 H 1 3.977 0.020 . 1 . . . . 424 SER HB2 . 6900 1 1258 . 1 1 111 111 SER HB3 H 1 3.977 0.020 . 1 . . . . 424 SER HB3 . 6900 1 1259 . 1 1 111 111 SER CA C 13 61.578 0.400 . 1 . . . . 424 SER CA . 6900 1 1260 . 1 1 111 111 SER CB C 13 62.817 0.400 . 1 . . . . 424 SER CB . 6900 1 1261 . 1 1 111 111 SER N N 15 113.961 0.400 . 1 . . . . 424 SER N . 6900 1 1262 . 1 1 112 112 VAL H H 1 7.787 0.020 . 1 . . . . 425 VAL H . 6900 1 1263 . 1 1 112 112 VAL HA H 1 3.815 0.020 . 1 . . . . 425 VAL HA . 6900 1 1264 . 1 1 112 112 VAL HB H 1 2.107 0.020 . 1 . . . . 425 VAL HB . 6900 1 1265 . 1 1 112 112 VAL HG11 H 1 1.116 0.020 . 2 . . . . 425 VAL HG1 . 6900 1 1266 . 1 1 112 112 VAL HG12 H 1 1.116 0.020 . 2 . . . . 425 VAL HG1 . 6900 1 1267 . 1 1 112 112 VAL HG13 H 1 1.116 0.020 . 2 . . . . 425 VAL HG1 . 6900 1 1268 . 1 1 112 112 VAL HG21 H 1 1.103 0.020 . 2 . . . . 425 VAL HG2 . 6900 1 1269 . 1 1 112 112 VAL HG22 H 1 1.103 0.020 . 2 . . . . 425 VAL HG2 . 6900 1 1270 . 1 1 112 112 VAL HG23 H 1 1.103 0.020 . 2 . . . . 425 VAL HG2 . 6900 1 1271 . 1 1 112 112 VAL CA C 13 66.719 0.400 . 1 . . . . 425 VAL CA . 6900 1 1272 . 1 1 112 112 VAL CB C 13 31.622 0.400 . 1 . . . . 425 VAL CB . 6900 1 1273 . 1 1 112 112 VAL CG1 C 13 22.292 0.400 . 1 . . . . 425 VAL CG1 . 6900 1 1274 . 1 1 112 112 VAL CG2 C 13 22.204 0.400 . 1 . . . . 425 VAL CG2 . 6900 1 1275 . 1 1 112 112 VAL N N 15 122.939 0.400 . 1 . . . . 425 VAL N . 6900 1 1276 . 1 1 113 113 LEU H H 1 8.412 0.020 . 1 . . . . 426 LEU H . 6900 1 1277 . 1 1 113 113 LEU HA H 1 4.028 0.020 . 1 . . . . 426 LEU HA . 6900 1 1278 . 1 1 113 113 LEU HB2 H 1 2.095 0.020 . 2 . . . . 426 LEU HB2 . 6900 1 1279 . 1 1 113 113 LEU HB3 H 1 1.526 0.020 . 2 . . . . 426 LEU HB3 . 6900 1 1280 . 1 1 113 113 LEU HG H 1 1.996 0.020 . 1 . . . . 426 LEU HG . 6900 1 1281 . 1 1 113 113 LEU HD11 H 1 1.052 0.020 . 2 . . . . 426 LEU HD1 . 6900 1 1282 . 1 1 113 113 LEU HD12 H 1 1.052 0.020 . 2 . . . . 426 LEU HD1 . 6900 1 1283 . 1 1 113 113 LEU HD13 H 1 1.052 0.020 . 2 . . . . 426 LEU HD1 . 6900 1 1284 . 1 1 113 113 LEU HD21 H 1 1.050 0.020 . 2 . . . . 426 LEU HD2 . 6900 1 1285 . 1 1 113 113 LEU HD22 H 1 1.050 0.020 . 2 . . . . 426 LEU HD2 . 6900 1 1286 . 1 1 113 113 LEU HD23 H 1 1.050 0.020 . 2 . . . . 426 LEU HD2 . 6900 1 1287 . 1 1 113 113 LEU CA C 13 58.538 0.400 . 1 . . . . 426 LEU CA . 6900 1 1288 . 1 1 113 113 LEU CB C 13 41.145 0.400 . 1 . . . . 426 LEU CB . 6900 1 1289 . 1 1 113 113 LEU CG C 13 26.963 0.400 . 1 . . . . 426 LEU CG . 6900 1 1290 . 1 1 113 113 LEU CD1 C 13 27.041 0.400 . 1 . . . . 426 LEU CD1 . 6900 1 1291 . 1 1 113 113 LEU CD2 C 13 23.652 0.400 . 1 . . . . 426 LEU CD2 . 6900 1 1292 . 1 1 113 113 LEU N N 15 120.284 0.400 . 1 . . . . 426 LEU N . 6900 1 1293 . 1 1 114 114 GLU H H 1 8.455 0.020 . 1 . . . . 427 GLU H . 6900 1 1294 . 1 1 114 114 GLU HA H 1 4.190 0.020 . 1 . . . . 427 GLU HA . 6900 1 1295 . 1 1 114 114 GLU HB2 H 1 2.241 0.020 . 2 . . . . 427 GLU HB2 . 6900 1 1296 . 1 1 114 114 GLU HB3 H 1 2.071 0.020 . 2 . . . . 427 GLU HB3 . 6900 1 1297 . 1 1 114 114 GLU HG2 H 1 2.498 0.020 . 1 . . . . 427 GLU HG2 . 6900 1 1298 . 1 1 114 114 GLU HG3 H 1 2.498 0.020 . 1 . . . . 427 GLU HG3 . 6900 1 1299 . 1 1 114 114 GLU CA C 13 59.527 0.400 . 1 . . . . 427 GLU CA . 6900 1 1300 . 1 1 114 114 GLU CB C 13 28.352 0.400 . 1 . . . . 427 GLU CB . 6900 1 1301 . 1 1 114 114 GLU CG C 13 35.928 0.400 . 1 . . . . 427 GLU CG . 6900 1 1302 . 1 1 114 114 GLU N N 15 116.844 0.400 . 1 . . . . 427 GLU N . 6900 1 1303 . 1 1 115 115 ARG H H 1 7.854 0.020 . 1 . . . . 428 ARG H . 6900 1 1304 . 1 1 115 115 ARG HA H 1 4.280 0.020 . 1 . . . . 428 ARG HA . 6900 1 1305 . 1 1 115 115 ARG HB2 H 1 2.215 0.020 . 1 . . . . 428 ARG HB2 . 6900 1 1306 . 1 1 115 115 ARG HB3 H 1 2.215 0.020 . 1 . . . . 428 ARG HB3 . 6900 1 1307 . 1 1 115 115 ARG HG2 H 1 2.000 0.020 . 2 . . . . 428 ARG HG2 . 6900 1 1308 . 1 1 115 115 ARG HG3 H 1 1.808 0.020 . 2 . . . . 428 ARG HG3 . 6900 1 1309 . 1 1 115 115 ARG HD2 H 1 3.236 0.020 . 2 . . . . 428 ARG HD2 . 6900 1 1310 . 1 1 115 115 ARG HD3 H 1 3.161 0.020 . 2 . . . . 428 ARG HD3 . 6900 1 1311 . 1 1 115 115 ARG HE H 1 7.128 0.020 . 1 . . . . 428 ARG HE . 6900 1 1312 . 1 1 115 115 ARG CA C 13 59.608 0.400 . 1 . . . . 428 ARG CA . 6900 1 1313 . 1 1 115 115 ARG CB C 13 30.854 0.400 . 1 . . . . 428 ARG CB . 6900 1 1314 . 1 1 115 115 ARG CG C 13 28.212 0.400 . 1 . . . . 428 ARG CG . 6900 1 1315 . 1 1 115 115 ARG CD C 13 43.632 0.400 . 1 . . . . 428 ARG CD . 6900 1 1316 . 1 1 115 115 ARG N N 15 119.601 0.400 . 1 . . . . 428 ARG N . 6900 1 1317 . 1 1 115 115 ARG NE N 15 83.928 0.400 . 1 . . . . 428 ARG NE . 6900 1 1318 . 1 1 116 116 PHE H H 1 9.181 0.020 . 1 . . . . 429 PHE H . 6900 1 1319 . 1 1 116 116 PHE HA H 1 4.025 0.020 . 1 . . . . 429 PHE HA . 6900 1 1320 . 1 1 116 116 PHE HB2 H 1 3.169 0.020 . 2 . . . . 429 PHE HB2 . 6900 1 1321 . 1 1 116 116 PHE HB3 H 1 3.075 0.020 . 2 . . . . 429 PHE HB3 . 6900 1 1322 . 1 1 116 116 PHE HD1 H 1 6.233 0.020 . 1 . . . . 429 PHE HD1 . 6900 1 1323 . 1 1 116 116 PHE HD2 H 1 6.233 0.020 . 1 . . . . 429 PHE HD2 . 6900 1 1324 . 1 1 116 116 PHE HE1 H 1 6.969 0.020 . 1 . . . . 429 PHE HE1 . 6900 1 1325 . 1 1 116 116 PHE HE2 H 1 6.969 0.020 . 1 . . . . 429 PHE HE2 . 6900 1 1326 . 1 1 116 116 PHE HZ H 1 6.718 0.020 . 1 . . . . 429 PHE HZ . 6900 1 1327 . 1 1 116 116 PHE CA C 13 62.964 0.400 . 1 . . . . 429 PHE CA . 6900 1 1328 . 1 1 116 116 PHE CB C 13 39.418 0.400 . 1 . . . . 429 PHE CB . 6900 1 1329 . 1 1 116 116 PHE N N 15 122.309 0.400 . 1 . . . . 429 PHE N . 6900 1 1330 . 1 1 117 117 VAL H H 1 9.649 0.020 . 1 . . . . 430 VAL H . 6900 1 1331 . 1 1 117 117 VAL HA H 1 3.590 0.020 . 1 . . . . 430 VAL HA . 6900 1 1332 . 1 1 117 117 VAL HB H 1 2.442 0.020 . 1 . . . . 430 VAL HB . 6900 1 1333 . 1 1 117 117 VAL HG11 H 1 1.532 0.020 . 2 . . . . 430 VAL HG1 . 6900 1 1334 . 1 1 117 117 VAL HG12 H 1 1.532 0.020 . 2 . . . . 430 VAL HG1 . 6900 1 1335 . 1 1 117 117 VAL HG13 H 1 1.532 0.020 . 2 . . . . 430 VAL HG1 . 6900 1 1336 . 1 1 117 117 VAL HG21 H 1 1.173 0.020 . 2 . . . . 430 VAL HG2 . 6900 1 1337 . 1 1 117 117 VAL HG22 H 1 1.173 0.020 . 2 . . . . 430 VAL HG2 . 6900 1 1338 . 1 1 117 117 VAL HG23 H 1 1.173 0.020 . 2 . . . . 430 VAL HG2 . 6900 1 1339 . 1 1 117 117 VAL CA C 13 67.582 0.400 . 1 . . . . 430 VAL CA . 6900 1 1340 . 1 1 117 117 VAL CB C 13 31.839 0.400 . 1 . . . . 430 VAL CB . 6900 1 1341 . 1 1 117 117 VAL CG1 C 13 24.222 0.400 . 1 . . . . 430 VAL CG1 . 6900 1 1342 . 1 1 117 117 VAL CG2 C 13 22.446 0.400 . 1 . . . . 430 VAL CG2 . 6900 1 1343 . 1 1 117 117 VAL N N 15 121.092 0.400 . 1 . . . . 430 VAL N . 6900 1 1344 . 1 1 118 118 GLU H H 1 8.234 0.020 . 1 . . . . 431 GLU H . 6900 1 1345 . 1 1 118 118 GLU HA H 1 4.338 0.020 . 1 . . . . 431 GLU HA . 6900 1 1346 . 1 1 118 118 GLU HB2 H 1 2.252 0.020 . 1 . . . . 431 GLU HB2 . 6900 1 1347 . 1 1 118 118 GLU HB3 H 1 2.252 0.020 . 1 . . . . 431 GLU HB3 . 6900 1 1348 . 1 1 118 118 GLU HG2 H 1 2.532 0.020 . 2 . . . . 431 GLU HG2 . 6900 1 1349 . 1 1 118 118 GLU HG3 H 1 2.287 0.020 . 2 . . . . 431 GLU HG3 . 6900 1 1350 . 1 1 118 118 GLU CA C 13 59.639 0.400 . 1 . . . . 431 GLU CA . 6900 1 1351 . 1 1 118 118 GLU CB C 13 28.722 0.400 . 1 . . . . 431 GLU CB . 6900 1 1352 . 1 1 118 118 GLU CG C 13 34.918 0.400 . 1 . . . . 431 GLU CG . 6900 1 1353 . 1 1 118 118 GLU N N 15 121.897 0.400 . 1 . . . . 431 GLU N . 6900 1 1354 . 1 1 119 119 GLU H H 1 8.295 0.020 . 1 . . . . 432 GLU H . 6900 1 1355 . 1 1 119 119 GLU HA H 1 4.083 0.020 . 1 . . . . 432 GLU HA . 6900 1 1356 . 1 1 119 119 GLU HB2 H 1 2.160 0.020 . 2 . . . . 432 GLU HB2 . 6900 1 1357 . 1 1 119 119 GLU HB3 H 1 2.031 0.020 . 2 . . . . 432 GLU HB3 . 6900 1 1358 . 1 1 119 119 GLU HG2 H 1 2.591 0.020 . 2 . . . . 432 GLU HG2 . 6900 1 1359 . 1 1 119 119 GLU HG3 H 1 2.544 0.020 . 2 . . . . 432 GLU HG3 . 6900 1 1360 . 1 1 119 119 GLU CA C 13 59.839 0.400 . 1 . . . . 432 GLU CA . 6900 1 1361 . 1 1 119 119 GLU CB C 13 28.742 0.400 . 1 . . . . 432 GLU CB . 6900 1 1362 . 1 1 119 119 GLU CG C 13 36.449 0.400 . 1 . . . . 432 GLU CG . 6900 1 1363 . 1 1 119 119 GLU N N 15 118.757 0.400 . 1 . . . . 432 GLU N . 6900 1 1364 . 1 1 120 120 CYS H H 1 8.313 0.020 . 1 . . . . 433 CYS H . 6900 1 1365 . 1 1 120 120 CYS HA H 1 3.700 0.020 . 1 . . . . 433 CYS HA . 6900 1 1366 . 1 1 120 120 CYS HB2 H 1 3.129 0.020 . 2 . . . . 433 CYS HB2 . 6900 1 1367 . 1 1 120 120 CYS HB3 H 1 2.113 0.020 . 2 . . . . 433 CYS HB3 . 6900 1 1368 . 1 1 120 120 CYS CA C 13 64.048 0.400 . 1 . . . . 433 CYS CA . 6900 1 1369 . 1 1 120 120 CYS CB C 13 26.226 0.400 . 1 . . . . 433 CYS CB . 6900 1 1370 . 1 1 120 120 CYS N N 15 119.149 0.400 . 1 . . . . 433 CYS N . 6900 1 1371 . 1 1 121 121 PHE H H 1 8.656 0.020 . 1 . . . . 434 PHE H . 6900 1 1372 . 1 1 121 121 PHE HA H 1 4.240 0.020 . 1 . . . . 434 PHE HA . 6900 1 1373 . 1 1 121 121 PHE HB2 H 1 3.269 0.020 . 2 . . . . 434 PHE HB2 . 6900 1 1374 . 1 1 121 121 PHE HB3 H 1 2.855 0.020 . 2 . . . . 434 PHE HB3 . 6900 1 1375 . 1 1 121 121 PHE HD1 H 1 7.181 0.020 . 1 . . . . 434 PHE HD1 . 6900 1 1376 . 1 1 121 121 PHE HD2 H 1 7.181 0.020 . 1 . . . . 434 PHE HD2 . 6900 1 1377 . 1 1 121 121 PHE HE1 H 1 7.284 0.020 . 1 . . . . 434 PHE HE1 . 6900 1 1378 . 1 1 121 121 PHE HE2 H 1 7.284 0.020 . 1 . . . . 434 PHE HE2 . 6900 1 1379 . 1 1 121 121 PHE CA C 13 60.497 0.400 . 1 . . . . 434 PHE CA . 6900 1 1380 . 1 1 121 121 PHE CB C 13 38.978 0.400 . 1 . . . . 434 PHE CB . 6900 1 1381 . 1 1 121 121 PHE N N 15 122.561 0.400 . 1 . . . . 434 PHE N . 6900 1 1382 . 1 1 122 122 GLN H H 1 8.906 0.020 . 1 . . . . 435 GLN H . 6900 1 1383 . 1 1 122 122 GLN HA H 1 3.581 0.020 . 1 . . . . 435 GLN HA . 6900 1 1384 . 1 1 122 122 GLN HB2 H 1 2.162 0.020 . 2 . . . . 435 GLN HB2 . 6900 1 1385 . 1 1 122 122 GLN HB3 H 1 1.977 0.020 . 2 . . . . 435 GLN HB3 . 6900 1 1386 . 1 1 122 122 GLN HG2 H 1 2.622 0.020 . 2 . . . . 435 GLN HG2 . 6900 1 1387 . 1 1 122 122 GLN HG3 H 1 2.583 0.020 . 2 . . . . 435 GLN HG3 . 6900 1 1388 . 1 1 122 122 GLN HE21 H 1 8.042 0.020 . 2 . . . . 435 GLN HE21 . 6900 1 1389 . 1 1 122 122 GLN HE22 H 1 6.853 0.020 . 2 . . . . 435 GLN HE22 . 6900 1 1390 . 1 1 122 122 GLN CA C 13 58.367 0.400 . 1 . . . . 435 GLN CA . 6900 1 1391 . 1 1 122 122 GLN CB C 13 27.483 0.400 . 1 . . . . 435 GLN CB . 6900 1 1392 . 1 1 122 122 GLN CG C 13 33.140 0.400 . 1 . . . . 435 GLN CG . 6900 1 1393 . 1 1 122 122 GLN N N 15 121.579 0.400 . 1 . . . . 435 GLN N . 6900 1 1394 . 1 1 122 122 GLN NE2 N 15 112.801 0.400 . 1 . . . . 435 GLN NE2 . 6900 1 1395 . 1 1 123 123 ALA H H 1 7.511 0.020 . 1 . . . . 436 ALA H . 6900 1 1396 . 1 1 123 123 ALA HA H 1 4.283 0.020 . 1 . . . . 436 ALA HA . 6900 1 1397 . 1 1 123 123 ALA HB1 H 1 1.420 0.020 . 1 . . . . 436 ALA HB . 6900 1 1398 . 1 1 123 123 ALA HB2 H 1 1.420 0.020 . 1 . . . . 436 ALA HB . 6900 1 1399 . 1 1 123 123 ALA HB3 H 1 1.420 0.020 . 1 . . . . 436 ALA HB . 6900 1 1400 . 1 1 123 123 ALA CA C 13 52.175 0.400 . 1 . . . . 436 ALA CA . 6900 1 1401 . 1 1 123 123 ALA CB C 13 19.002 0.400 . 1 . . . . 436 ALA CB . 6900 1 1402 . 1 1 123 123 ALA N N 15 117.910 0.400 . 1 . . . . 436 ALA N . 6900 1 1403 . 1 1 124 124 GLY H H 1 7.626 0.020 . 1 . . . . 437 GLY H . 6900 1 1404 . 1 1 124 124 GLY HA2 H 1 3.948 0.020 . 2 . . . . 437 GLY HA2 . 6900 1 1405 . 1 1 124 124 GLY HA3 H 1 3.768 0.020 . 2 . . . . 437 GLY HA3 . 6900 1 1406 . 1 1 124 124 GLY CA C 13 45.202 0.400 . 1 . . . . 437 GLY CA . 6900 1 1407 . 1 1 124 124 GLY N N 15 105.989 0.400 . 1 . . . . 437 GLY N . 6900 1 1408 . 1 1 125 125 ILE H H 1 7.177 0.020 . 1 . . . . 438 ILE H . 6900 1 1409 . 1 1 125 125 ILE HA H 1 2.788 0.020 . 1 . . . . 438 ILE HA . 6900 1 1410 . 1 1 125 125 ILE HB H 1 1.234 0.020 . 1 . . . . 438 ILE HB . 6900 1 1411 . 1 1 125 125 ILE HG12 H 1 0.948 0.020 . 2 . . . . 438 ILE HG12 . 6900 1 1412 . 1 1 125 125 ILE HG13 H 1 0.818 0.020 . 2 . . . . 438 ILE HG13 . 6900 1 1413 . 1 1 125 125 ILE HG21 H 1 0.365 0.020 . 1 . . . . 438 ILE HG2 . 6900 1 1414 . 1 1 125 125 ILE HG22 H 1 0.365 0.020 . 1 . . . . 438 ILE HG2 . 6900 1 1415 . 1 1 125 125 ILE HG23 H 1 0.365 0.020 . 1 . . . . 438 ILE HG2 . 6900 1 1416 . 1 1 125 125 ILE HD11 H 1 0.638 0.020 . 1 . . . . 438 ILE HD1 . 6900 1 1417 . 1 1 125 125 ILE HD12 H 1 0.638 0.020 . 1 . . . . 438 ILE HD1 . 6900 1 1418 . 1 1 125 125 ILE HD13 H 1 0.638 0.020 . 1 . . . . 438 ILE HD1 . 6900 1 1419 . 1 1 125 125 ILE CA C 13 61.619 0.400 . 1 . . . . 438 ILE CA . 6900 1 1420 . 1 1 125 125 ILE CB C 13 37.972 0.400 . 1 . . . . 438 ILE CB . 6900 1 1421 . 1 1 125 125 ILE CG2 C 13 17.671 0.400 . 1 . . . . 438 ILE CG2 . 6900 1 1422 . 1 1 125 125 ILE CD1 C 13 14.170 0.400 . 1 . . . . 438 ILE CD1 . 6900 1 1423 . 1 1 125 125 ILE N N 15 111.574 0.400 . 1 . . . . 438 ILE N . 6900 1 1424 . 1 1 126 126 ILE H H 1 6.455 0.020 . 1 . . . . 439 ILE H . 6900 1 1425 . 1 1 126 126 ILE HA H 1 4.298 0.020 . 1 . . . . 439 ILE HA . 6900 1 1426 . 1 1 126 126 ILE HB H 1 1.575 0.020 . 1 . . . . 439 ILE HB . 6900 1 1427 . 1 1 126 126 ILE HG12 H 1 1.244 0.020 . 2 . . . . 439 ILE HG12 . 6900 1 1428 . 1 1 126 126 ILE HG13 H 1 0.322 0.020 . 2 . . . . 439 ILE HG13 . 6900 1 1429 . 1 1 126 126 ILE HG21 H 1 0.193 0.020 . 1 . . . . 439 ILE HG2 . 6900 1 1430 . 1 1 126 126 ILE HG22 H 1 0.193 0.020 . 1 . . . . 439 ILE HG2 . 6900 1 1431 . 1 1 126 126 ILE HG23 H 1 0.193 0.020 . 1 . . . . 439 ILE HG2 . 6900 1 1432 . 1 1 126 126 ILE HD11 H 1 0.526 0.020 . 1 . . . . 439 ILE HD1 . 6900 1 1433 . 1 1 126 126 ILE HD12 H 1 0.526 0.020 . 1 . . . . 439 ILE HD1 . 6900 1 1434 . 1 1 126 126 ILE HD13 H 1 0.526 0.020 . 1 . . . . 439 ILE HD1 . 6900 1 1435 . 1 1 126 126 ILE CA C 13 58.581 0.400 . 1 . . . . 439 ILE CA . 6900 1 1436 . 1 1 126 126 ILE CB C 13 42.100 0.400 . 1 . . . . 439 ILE CB . 6900 1 1437 . 1 1 126 126 ILE CG1 C 13 24.558 0.400 . 1 . . . . 439 ILE CG1 . 6900 1 1438 . 1 1 126 126 ILE CG2 C 13 18.092 0.400 . 1 . . . . 439 ILE CG2 . 6900 1 1439 . 1 1 126 126 ILE CD1 C 13 14.165 0.400 . 1 . . . . 439 ILE CD1 . 6900 1 1440 . 1 1 126 126 ILE N N 15 107.220 0.400 . 1 . . . . 439 ILE N . 6900 1 1441 . 1 1 127 127 SER H H 1 7.937 0.020 . 1 . . . . 440 SER H . 6900 1 1442 . 1 1 127 127 SER HA H 1 4.492 0.020 . 1 . . . . 440 SER HA . 6900 1 1443 . 1 1 127 127 SER HB2 H 1 4.378 0.020 . 2 . . . . 440 SER HB2 . 6900 1 1444 . 1 1 127 127 SER HB3 H 1 4.040 0.020 . 2 . . . . 440 SER HB3 . 6900 1 1445 . 1 1 127 127 SER CA C 13 56.739 0.400 . 1 . . . . 440 SER CA . 6900 1 1446 . 1 1 127 127 SER CB C 13 65.561 0.400 . 1 . . . . 440 SER CB . 6900 1 1447 . 1 1 127 127 SER N N 15 116.729 0.400 . 1 . . . . 440 SER N . 6900 1 1448 . 1 1 128 128 LYS H H 1 9.050 0.020 . 1 . . . . 441 LYS H . 6900 1 1449 . 1 1 128 128 LYS HA H 1 3.306 0.020 . 1 . . . . 441 LYS HA . 6900 1 1450 . 1 1 128 128 LYS HB2 H 1 1.940 0.020 . 2 . . . . 441 LYS HB2 . 6900 1 1451 . 1 1 128 128 LYS HB3 H 1 1.728 0.020 . 2 . . . . 441 LYS HB3 . 6900 1 1452 . 1 1 128 128 LYS HG2 H 1 1.368 0.020 . 2 . . . . 441 LYS HG2 . 6900 1 1453 . 1 1 128 128 LYS HG3 H 1 1.016 0.020 . 2 . . . . 441 LYS HG3 . 6900 1 1454 . 1 1 128 128 LYS HD2 H 1 1.633 0.020 . 2 . . . . 441 LYS HD2 . 6900 1 1455 . 1 1 128 128 LYS HD3 H 1 1.427 0.020 . 2 . . . . 441 LYS HD3 . 6900 1 1456 . 1 1 128 128 LYS HE2 H 1 2.950 0.020 . 2 . . . . 441 LYS HE2 . 6900 1 1457 . 1 1 128 128 LYS HE3 H 1 2.901 0.020 . 2 . . . . 441 LYS HE3 . 6900 1 1458 . 1 1 128 128 LYS CA C 13 59.120 0.400 . 1 . . . . 441 LYS CA . 6900 1 1459 . 1 1 128 128 LYS CB C 13 32.300 0.400 . 1 . . . . 441 LYS CB . 6900 1 1460 . 1 1 128 128 LYS CG C 13 24.747 0.400 . 1 . . . . 441 LYS CG . 6900 1 1461 . 1 1 128 128 LYS CD C 13 28.443 0.400 . 1 . . . . 441 LYS CD . 6900 1 1462 . 1 1 128 128 LYS CE C 13 41.967 0.400 . 1 . . . . 441 LYS CE . 6900 1 1463 . 1 1 128 128 LYS N N 15 121.847 0.400 . 1 . . . . 441 LYS N . 6900 1 1464 . 1 1 129 129 GLN H H 1 8.137 0.020 . 1 . . . . 442 GLN H . 6900 1 1465 . 1 1 129 129 GLN HA H 1 3.967 0.020 . 1 . . . . 442 GLN HA . 6900 1 1466 . 1 1 129 129 GLN HB2 H 1 2.051 0.020 . 2 . . . . 442 GLN HB2 . 6900 1 1467 . 1 1 129 129 GLN HB3 H 1 1.933 0.020 . 2 . . . . 442 GLN HB3 . 6900 1 1468 . 1 1 129 129 GLN HG2 H 1 2.401 0.020 . 2 . . . . 442 GLN HG2 . 6900 1 1469 . 1 1 129 129 GLN HG3 H 1 2.355 0.020 . 2 . . . . 442 GLN HG3 . 6900 1 1470 . 1 1 129 129 GLN HE21 H 1 7.572 0.020 . 2 . . . . 442 GLN HE21 . 6900 1 1471 . 1 1 129 129 GLN HE22 H 1 6.936 0.020 . 2 . . . . 442 GLN HE22 . 6900 1 1472 . 1 1 129 129 GLN CA C 13 59.379 0.400 . 1 . . . . 442 GLN CA . 6900 1 1473 . 1 1 129 129 GLN CB C 13 27.963 0.400 . 1 . . . . 442 GLN CB . 6900 1 1474 . 1 1 129 129 GLN CG C 13 34.042 0.400 . 1 . . . . 442 GLN CG . 6900 1 1475 . 1 1 129 129 GLN N N 15 116.563 0.400 . 1 . . . . 442 GLN N . 6900 1 1476 . 1 1 129 129 GLN NE2 N 15 112.434 0.400 . 1 . . . . 442 GLN NE2 . 6900 1 1477 . 1 1 130 130 LEU H H 1 7.627 0.020 . 1 . . . . 443 LEU H . 6900 1 1478 . 1 1 130 130 LEU HA H 1 4.215 0.020 . 1 . . . . 443 LEU HA . 6900 1 1479 . 1 1 130 130 LEU HB2 H 1 1.503 0.020 . 1 . . . . 443 LEU HB2 . 6900 1 1480 . 1 1 130 130 LEU HB3 H 1 1.503 0.020 . 1 . . . . 443 LEU HB3 . 6900 1 1481 . 1 1 130 130 LEU HG H 1 1.468 0.020 . 1 . . . . 443 LEU HG . 6900 1 1482 . 1 1 130 130 LEU HD11 H 1 0.997 0.020 . 2 . . . . 443 LEU HD1 . 6900 1 1483 . 1 1 130 130 LEU HD12 H 1 0.997 0.020 . 2 . . . . 443 LEU HD1 . 6900 1 1484 . 1 1 130 130 LEU HD13 H 1 0.997 0.020 . 2 . . . . 443 LEU HD1 . 6900 1 1485 . 1 1 130 130 LEU HD21 H 1 0.727 0.020 . 2 . . . . 443 LEU HD2 . 6900 1 1486 . 1 1 130 130 LEU HD22 H 1 0.727 0.020 . 2 . . . . 443 LEU HD2 . 6900 1 1487 . 1 1 130 130 LEU HD23 H 1 0.727 0.020 . 2 . . . . 443 LEU HD2 . 6900 1 1488 . 1 1 130 130 LEU CA C 13 57.097 0.400 . 1 . . . . 443 LEU CA . 6900 1 1489 . 1 1 130 130 LEU CB C 13 42.290 0.400 . 1 . . . . 443 LEU CB . 6900 1 1490 . 1 1 130 130 LEU CG C 13 27.003 0.400 . 1 . . . . 443 LEU CG . 6900 1 1491 . 1 1 130 130 LEU CD1 C 13 24.234 0.400 . 1 . . . . 443 LEU CD1 . 6900 1 1492 . 1 1 130 130 LEU CD2 C 13 25.178 0.400 . 1 . . . . 443 LEU CD2 . 6900 1 1493 . 1 1 130 130 LEU N N 15 119.886 0.400 . 1 . . . . 443 LEU N . 6900 1 1494 . 1 1 131 131 ARG H H 1 8.094 0.020 . 1 . . . . 444 ARG H . 6900 1 1495 . 1 1 131 131 ARG HA H 1 3.706 0.020 . 1 . . . . 444 ARG HA . 6900 1 1496 . 1 1 131 131 ARG HB2 H 1 1.588 0.020 . 2 . . . . 444 ARG HB2 . 6900 1 1497 . 1 1 131 131 ARG HB3 H 1 1.396 0.020 . 2 . . . . 444 ARG HB3 . 6900 1 1498 . 1 1 131 131 ARG HG2 H 1 1.298 0.020 . 2 . . . . 444 ARG HG2 . 6900 1 1499 . 1 1 131 131 ARG HG3 H 1 1.269 0.020 . 2 . . . . 444 ARG HG3 . 6900 1 1500 . 1 1 131 131 ARG HD2 H 1 2.668 0.020 . 2 . . . . 444 ARG HD2 . 6900 1 1501 . 1 1 131 131 ARG HD3 H 1 2.520 0.020 . 2 . . . . 444 ARG HD3 . 6900 1 1502 . 1 1 131 131 ARG HE H 1 7.854 0.020 . 1 . . . . 444 ARG HE . 6900 1 1503 . 1 1 131 131 ARG CA C 13 58.901 0.400 . 1 . . . . 444 ARG CA . 6900 1 1504 . 1 1 131 131 ARG CB C 13 28.804 0.400 . 1 . . . . 444 ARG CB . 6900 1 1505 . 1 1 131 131 ARG CG C 13 25.817 0.400 . 1 . . . . 444 ARG CG . 6900 1 1506 . 1 1 131 131 ARG CD C 13 42.857 0.400 . 1 . . . . 444 ARG CD . 6900 1 1507 . 1 1 131 131 ARG N N 15 123.589 0.400 . 1 . . . . 444 ARG N . 6900 1 1508 . 1 1 131 131 ARG NE N 15 84.231 0.400 . 1 . . . . 444 ARG NE . 6900 1 1509 . 1 1 132 132 ASP H H 1 8.666 0.020 . 1 . . . . 445 ASP H . 6900 1 1510 . 1 1 132 132 ASP HA H 1 4.279 0.020 . 1 . . . . 445 ASP HA . 6900 1 1511 . 1 1 132 132 ASP HB2 H 1 2.597 0.020 . 1 . . . . 445 ASP HB2 . 6900 1 1512 . 1 1 132 132 ASP HB3 H 1 2.597 0.020 . 1 . . . . 445 ASP HB3 . 6900 1 1513 . 1 1 132 132 ASP CA C 13 56.281 0.400 . 1 . . . . 445 ASP CA . 6900 1 1514 . 1 1 132 132 ASP CB C 13 39.846 0.400 . 1 . . . . 445 ASP CB . 6900 1 1515 . 1 1 132 132 ASP N N 15 120.090 0.400 . 1 . . . . 445 ASP N . 6900 1 1516 . 1 1 133 133 LEU H H 1 7.088 0.020 . 1 . . . . 446 LEU H . 6900 1 1517 . 1 1 133 133 LEU HA H 1 4.100 0.020 . 1 . . . . 446 LEU HA . 6900 1 1518 . 1 1 133 133 LEU HB2 H 1 1.893 0.020 . 2 . . . . 446 LEU HB2 . 6900 1 1519 . 1 1 133 133 LEU HB3 H 1 1.716 0.020 . 2 . . . . 446 LEU HB3 . 6900 1 1520 . 1 1 133 133 LEU HG H 1 1.859 0.020 . 1 . . . . 446 LEU HG . 6900 1 1521 . 1 1 133 133 LEU HD11 H 1 0.968 0.020 . 2 . . . . 446 LEU HD1 . 6900 1 1522 . 1 1 133 133 LEU HD12 H 1 0.968 0.020 . 2 . . . . 446 LEU HD1 . 6900 1 1523 . 1 1 133 133 LEU HD13 H 1 0.968 0.020 . 2 . . . . 446 LEU HD1 . 6900 1 1524 . 1 1 133 133 LEU HD21 H 1 0.914 0.020 . 2 . . . . 446 LEU HD2 . 6900 1 1525 . 1 1 133 133 LEU HD22 H 1 0.914 0.020 . 2 . . . . 446 LEU HD2 . 6900 1 1526 . 1 1 133 133 LEU HD23 H 1 0.914 0.020 . 2 . . . . 446 LEU HD2 . 6900 1 1527 . 1 1 133 133 LEU CA C 13 54.742 0.400 . 1 . . . . 446 LEU CA . 6900 1 1528 . 1 1 133 133 LEU CB C 13 43.360 0.400 . 1 . . . . 446 LEU CB . 6900 1 1529 . 1 1 133 133 LEU CG C 13 26.661 0.400 . 1 . . . . 446 LEU CG . 6900 1 1530 . 1 1 133 133 LEU CD1 C 13 25.099 0.400 . 1 . . . . 446 LEU CD1 . 6900 1 1531 . 1 1 133 133 LEU CD2 C 13 23.035 0.400 . 1 . . . . 446 LEU CD2 . 6900 1 1532 . 1 1 133 133 LEU N N 15 119.581 0.400 . 1 . . . . 446 LEU N . 6900 1 1533 . 1 1 134 134 CYS H H 1 7.130 0.020 . 1 . . . . 447 CYS H . 6900 1 1534 . 1 1 134 134 CYS HA H 1 3.063 0.020 . 1 . . . . 447 CYS HA . 6900 1 1535 . 1 1 134 134 CYS HB2 H 1 3.076 0.020 . 2 . . . . 447 CYS HB2 . 6900 1 1536 . 1 1 134 134 CYS HB3 H 1 2.788 0.020 . 2 . . . . 447 CYS HB3 . 6900 1 1537 . 1 1 134 134 CYS CA C 13 56.985 0.400 . 1 . . . . 447 CYS CA . 6900 1 1538 . 1 1 134 134 CYS CB C 13 27.289 0.400 . 1 . . . . 447 CYS CB . 6900 1 1539 . 1 1 134 134 CYS N N 15 122.270 0.400 . 1 . . . . 447 CYS N . 6900 1 1540 . 1 1 135 135 PRO HA H 1 4.197 0.020 . 1 . . . . 448 PRO HA . 6900 1 1541 . 1 1 135 135 PRO HB2 H 1 2.293 0.020 . 2 . . . . 448 PRO HB2 . 6900 1 1542 . 1 1 135 135 PRO HB3 H 1 1.896 0.020 . 2 . . . . 448 PRO HB3 . 6900 1 1543 . 1 1 135 135 PRO HG2 H 1 1.968 0.020 . 1 . . . . 448 PRO HG2 . 6900 1 1544 . 1 1 135 135 PRO HG3 H 1 1.968 0.020 . 1 . . . . 448 PRO HG3 . 6900 1 1545 . 1 1 135 135 PRO HD2 H 1 3.559 0.020 . 2 . . . . 448 PRO HD2 . 6900 1 1546 . 1 1 135 135 PRO HD3 H 1 3.224 0.020 . 2 . . . . 448 PRO HD3 . 6900 1 1547 . 1 1 135 135 PRO CA C 13 64.498 0.400 . 1 . . . . 448 PRO CA . 6900 1 1548 . 1 1 135 135 PRO CB C 13 32.659 0.400 . 1 . . . . 448 PRO CB . 6900 1 1549 . 1 1 135 135 PRO CG C 13 27.567 0.400 . 1 . . . . 448 PRO CG . 6900 1 1550 . 1 1 135 135 PRO CD C 13 51.184 0.400 . 1 . . . . 448 PRO CD . 6900 1 stop_ save_