data_25743 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25743 _Entry.Title ; Backbone and side-chain NMR assignments for the Bromodomain of mouse BAZ1A (ACF1) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-08-07 _Entry.Accession_date 2015-08-07 _Entry.Last_release_date 2016-10-28 _Entry.Original_release_date 2016-10-28 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Kai Fan . . . . 25743 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 25743 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 338 25743 '15N chemical shifts' 112 25743 '1H chemical shifts' 715 25743 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2016-10-28 . original BMRB . 25743 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 25743 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 26542424 _Citation.Full_citation . _Citation.Title ; Backbone and side-chain NMR assignments for the bromodomain of mouse BAZ1A (ACF1) ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full . _Citation.Journal_volume 10 _Citation.Journal_issue 1 _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 131 _Citation.Page_last 134 _Citation.Year 2016 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Kai Fan . . . . 25743 1 2 Shengrong Chen . . . . 25743 1 3 Yifeng Ge . . . . 25743 1 4 Kaiqin Ye . . . . 25743 1 5 Qi Yao . . . . 25743 1 6 Jun Jing . . . . 25743 1 7 Jiahai Zhang . . . . 25743 1 8 Xiaoming Tu . . . . 25743 1 9 Bing Yao . . . . 25743 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25743 _Assembly.ID 1 _Assembly.Name Baz1a-bromodomain _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 Baz1a-bromodomain 1 $Baz1a-bromodomain A . yes native no no . . . 25743 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Baz1a-bromodomain _Entity.Sf_category entity _Entity.Sf_framecode Baz1a-bromodomain _Entity.Entry_ID 25743 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Baz1a-bromodomain _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 ; MNRRSSGRQGGVHELSAFEQ LVVELVRHDDSWPFLKLVSK IQVPDYYDIIKKPIALNIIR EKVNKCEYKLASEFIDDIEL MFSNCFEYNPRNTSEAKAGT RLQAFFHIQAQKLGLHVSPS TVDLEHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 131 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1417 MET . 25743 1 2 1418 ASN . 25743 1 3 1419 ARG . 25743 1 4 1420 ARG . 25743 1 5 1421 SER . 25743 1 6 1422 SER . 25743 1 7 1423 GLY . 25743 1 8 1424 ARG . 25743 1 9 1425 GLN . 25743 1 10 1426 GLY . 25743 1 11 1427 GLY . 25743 1 12 1428 VAL . 25743 1 13 1429 HIS . 25743 1 14 1430 GLU . 25743 1 15 1431 LEU . 25743 1 16 1432 SER . 25743 1 17 1433 ALA . 25743 1 18 1434 PHE . 25743 1 19 1435 GLU . 25743 1 20 1436 GLN . 25743 1 21 1437 LEU . 25743 1 22 1438 VAL . 25743 1 23 1439 VAL . 25743 1 24 1440 GLU . 25743 1 25 1441 LEU . 25743 1 26 1442 VAL . 25743 1 27 1443 ARG . 25743 1 28 1444 HIS . 25743 1 29 1445 ASP . 25743 1 30 1446 ASP . 25743 1 31 1447 SER . 25743 1 32 1448 TRP . 25743 1 33 1449 PRO . 25743 1 34 1450 PHE . 25743 1 35 1451 LEU . 25743 1 36 1452 LYS . 25743 1 37 1453 LEU . 25743 1 38 1454 VAL . 25743 1 39 1455 SER . 25743 1 40 1456 LYS . 25743 1 41 1457 ILE . 25743 1 42 1458 GLN . 25743 1 43 1459 VAL . 25743 1 44 1460 PRO . 25743 1 45 1461 ASP . 25743 1 46 1462 TYR . 25743 1 47 1463 TYR . 25743 1 48 1464 ASP . 25743 1 49 1465 ILE . 25743 1 50 1466 ILE . 25743 1 51 1467 LYS . 25743 1 52 1468 LYS . 25743 1 53 1469 PRO . 25743 1 54 1470 ILE . 25743 1 55 1471 ALA . 25743 1 56 1472 LEU . 25743 1 57 1473 ASN . 25743 1 58 1474 ILE . 25743 1 59 1475 ILE . 25743 1 60 1476 ARG . 25743 1 61 1477 GLU . 25743 1 62 1478 LYS . 25743 1 63 1479 VAL . 25743 1 64 1480 ASN . 25743 1 65 1481 LYS . 25743 1 66 1482 CYS . 25743 1 67 1483 GLU . 25743 1 68 1484 TYR . 25743 1 69 1485 LYS . 25743 1 70 1486 LEU . 25743 1 71 1487 ALA . 25743 1 72 1488 SER . 25743 1 73 1489 GLU . 25743 1 74 1490 PHE . 25743 1 75 1491 ILE . 25743 1 76 1492 ASP . 25743 1 77 1493 ASP . 25743 1 78 1494 ILE . 25743 1 79 1495 GLU . 25743 1 80 1496 LEU . 25743 1 81 1497 MET . 25743 1 82 1498 PHE . 25743 1 83 1499 SER . 25743 1 84 1500 ASN . 25743 1 85 1501 CYS . 25743 1 86 1502 PHE . 25743 1 87 1503 GLU . 25743 1 88 1504 TYR . 25743 1 89 1505 ASN . 25743 1 90 1506 PRO . 25743 1 91 1507 ARG . 25743 1 92 1508 ASN . 25743 1 93 1509 THR . 25743 1 94 1510 SER . 25743 1 95 1511 GLU . 25743 1 96 1512 ALA . 25743 1 97 1513 LYS . 25743 1 98 1514 ALA . 25743 1 99 1515 GLY . 25743 1 100 1516 THR . 25743 1 101 1517 ARG . 25743 1 102 1518 LEU . 25743 1 103 1519 GLN . 25743 1 104 1520 ALA . 25743 1 105 1521 PHE . 25743 1 106 1522 PHE . 25743 1 107 1523 HIS . 25743 1 108 1524 ILE . 25743 1 109 1525 GLN . 25743 1 110 1526 ALA . 25743 1 111 1527 GLN . 25743 1 112 1528 LYS . 25743 1 113 1529 LEU . 25743 1 114 1530 GLY . 25743 1 115 1531 LEU . 25743 1 116 1532 HIS . 25743 1 117 1533 VAL . 25743 1 118 1534 SER . 25743 1 119 1535 PRO . 25743 1 120 1536 SER . 25743 1 121 1537 THR . 25743 1 122 1538 VAL . 25743 1 123 1539 ASP . 25743 1 124 1540 LEU . 25743 1 125 1541 GLU . 25743 1 126 1542 HIS . 25743 1 127 1543 HIS . 25743 1 128 1544 HIS . 25743 1 129 1545 HIS . 25743 1 130 1546 HIS . 25743 1 131 1547 HIS . 25743 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 25743 1 . ASN 2 2 25743 1 . ARG 3 3 25743 1 . ARG 4 4 25743 1 . SER 5 5 25743 1 . SER 6 6 25743 1 . GLY 7 7 25743 1 . ARG 8 8 25743 1 . GLN 9 9 25743 1 . GLY 10 10 25743 1 . GLY 11 11 25743 1 . VAL 12 12 25743 1 . HIS 13 13 25743 1 . GLU 14 14 25743 1 . LEU 15 15 25743 1 . SER 16 16 25743 1 . ALA 17 17 25743 1 . PHE 18 18 25743 1 . GLU 19 19 25743 1 . GLN 20 20 25743 1 . LEU 21 21 25743 1 . VAL 22 22 25743 1 . VAL 23 23 25743 1 . GLU 24 24 25743 1 . LEU 25 25 25743 1 . VAL 26 26 25743 1 . ARG 27 27 25743 1 . HIS 28 28 25743 1 . ASP 29 29 25743 1 . ASP 30 30 25743 1 . SER 31 31 25743 1 . TRP 32 32 25743 1 . PRO 33 33 25743 1 . PHE 34 34 25743 1 . LEU 35 35 25743 1 . LYS 36 36 25743 1 . LEU 37 37 25743 1 . VAL 38 38 25743 1 . SER 39 39 25743 1 . LYS 40 40 25743 1 . ILE 41 41 25743 1 . GLN 42 42 25743 1 . VAL 43 43 25743 1 . PRO 44 44 25743 1 . ASP 45 45 25743 1 . TYR 46 46 25743 1 . TYR 47 47 25743 1 . ASP 48 48 25743 1 . ILE 49 49 25743 1 . ILE 50 50 25743 1 . LYS 51 51 25743 1 . LYS 52 52 25743 1 . PRO 53 53 25743 1 . ILE 54 54 25743 1 . ALA 55 55 25743 1 . LEU 56 56 25743 1 . ASN 57 57 25743 1 . ILE 58 58 25743 1 . ILE 59 59 25743 1 . ARG 60 60 25743 1 . GLU 61 61 25743 1 . LYS 62 62 25743 1 . VAL 63 63 25743 1 . ASN 64 64 25743 1 . LYS 65 65 25743 1 . CYS 66 66 25743 1 . GLU 67 67 25743 1 . TYR 68 68 25743 1 . LYS 69 69 25743 1 . LEU 70 70 25743 1 . ALA 71 71 25743 1 . SER 72 72 25743 1 . GLU 73 73 25743 1 . PHE 74 74 25743 1 . ILE 75 75 25743 1 . ASP 76 76 25743 1 . ASP 77 77 25743 1 . ILE 78 78 25743 1 . GLU 79 79 25743 1 . LEU 80 80 25743 1 . MET 81 81 25743 1 . PHE 82 82 25743 1 . SER 83 83 25743 1 . ASN 84 84 25743 1 . CYS 85 85 25743 1 . PHE 86 86 25743 1 . GLU 87 87 25743 1 . TYR 88 88 25743 1 . ASN 89 89 25743 1 . PRO 90 90 25743 1 . ARG 91 91 25743 1 . ASN 92 92 25743 1 . THR 93 93 25743 1 . SER 94 94 25743 1 . GLU 95 95 25743 1 . ALA 96 96 25743 1 . LYS 97 97 25743 1 . ALA 98 98 25743 1 . GLY 99 99 25743 1 . THR 100 100 25743 1 . ARG 101 101 25743 1 . LEU 102 102 25743 1 . GLN 103 103 25743 1 . ALA 104 104 25743 1 . PHE 105 105 25743 1 . PHE 106 106 25743 1 . HIS 107 107 25743 1 . ILE 108 108 25743 1 . GLN 109 109 25743 1 . ALA 110 110 25743 1 . GLN 111 111 25743 1 . LYS 112 112 25743 1 . LEU 113 113 25743 1 . GLY 114 114 25743 1 . LEU 115 115 25743 1 . HIS 116 116 25743 1 . VAL 117 117 25743 1 . SER 118 118 25743 1 . PRO 119 119 25743 1 . SER 120 120 25743 1 . THR 121 121 25743 1 . VAL 122 122 25743 1 . ASP 123 123 25743 1 . LEU 124 124 25743 1 . GLU 125 125 25743 1 . HIS 126 126 25743 1 . HIS 127 127 25743 1 . HIS 128 128 25743 1 . HIS 129 129 25743 1 . HIS 130 130 25743 1 . HIS 131 131 25743 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 25743 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Baz1a-bromodomain . 10090 organism . 'Mus musculus' 'house mouse' . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . 25743 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 25743 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Baz1a-bromodomain . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET22b . . . 25743 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25743 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Baz1a-bromodomain '[U-99% 13C; U-99% 15N]' . . 1 $Baz1a-bromodomain . . 0.4 . . mM . . . . 25743 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25743 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25743 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 25743 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.1 . M 25743 1 pH 6.5 . pH 25743 1 pressure 1 . atm 25743 1 temperature 298 . K 25743 1 stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 25743 _Software.ID 1 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 25743 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 25743 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 25743 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 25743 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DMX . 600 . . . 25743 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 25743 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25743 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25743 1 3 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25743 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25743 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25743 1 6 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25743 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25743 1 8 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25743 1 9 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25743 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 25743 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 water protons . . . . ppm 4.808 internal indirect 0.25144953 . . . . . 25743 1 H 1 water protons . . . . ppm 4.808 internal direct 1 . . . . . 25743 1 N 15 water protons . . . . ppm 4.808 internal indirect 0.101329118 . . . . . 25743 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 25743 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 25743 1 2 '3D CBCA(CO)NH' . . . 25743 1 3 '3D C(CO)NH' . . . 25743 1 4 '3D HNCO' . . . 25743 1 5 '3D HNCA' . . . 25743 1 6 '3D HNCACB' . . . 25743 1 7 '3D HBHA(CO)NH' . . . 25743 1 8 '3D H(CCO)NH' . . . 25743 1 9 '3D 1H-15N NOESY' . . . 25743 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 ASN HA H 1 4.779 0.040 . 1 . . . . 1418 ASN HA . 25743 1 2 . 1 1 2 2 ASN HB2 H 1 2.793 0.001 . 2 . . . . 1418 ASN HB2 . 25743 1 3 . 1 1 2 2 ASN HB3 H 1 2.793 0.001 . 2 . . . . 1418 ASN HB3 . 25743 1 4 . 1 1 2 2 ASN CA C 13 53.116 0.116 . 1 . . . . 1418 ASN CA . 25743 1 5 . 1 1 2 2 ASN CB C 13 38.877 0.067 . 1 . . . . 1418 ASN CB . 25743 1 6 . 1 1 3 3 ARG H H 1 8.592 0.006 . 1 . . . . 1419 ARG H . 25743 1 7 . 1 1 3 3 ARG HA H 1 4.309 0.002 . 1 . . . . 1419 ARG HA . 25743 1 8 . 1 1 3 3 ARG HB2 H 1 1.796 0.012 . 2 . . . . 1419 ARG HB2 . 25743 1 9 . 1 1 3 3 ARG HB3 H 1 1.796 0.012 . 2 . . . . 1419 ARG HB3 . 25743 1 10 . 1 1 3 3 ARG HG2 H 1 1.617 0.000 . 2 . . . . 1419 ARG HG2 . 25743 1 11 . 1 1 3 3 ARG HG3 H 1 1.617 0.000 . 2 . . . . 1419 ARG HG3 . 25743 1 12 . 1 1 3 3 ARG HD2 H 1 3.161 0.012 . 2 . . . . 1419 ARG HD2 . 25743 1 13 . 1 1 3 3 ARG HD3 H 1 3.161 0.012 . 2 . . . . 1419 ARG HD3 . 25743 1 14 . 1 1 3 3 ARG CA C 13 56.416 0.067 . 1 . . . . 1419 ARG CA . 25743 1 15 . 1 1 3 3 ARG CB C 13 30.766 0.117 . 1 . . . . 1419 ARG CB . 25743 1 16 . 1 1 3 3 ARG CG C 13 27.336 0.000 . 1 . . . . 1419 ARG CG . 25743 1 17 . 1 1 3 3 ARG CD C 13 43.195 0.000 . 1 . . . . 1419 ARG CD . 25743 1 18 . 1 1 3 3 ARG N N 15 122.605 0.030 . 1 . . . . 1419 ARG N . 25743 1 19 . 1 1 4 4 ARG H H 1 8.526 0.005 . 1 . . . . 1420 ARG H . 25743 1 20 . 1 1 4 4 ARG HA H 1 4.339 0.000 . 1 . . . . 1420 ARG HA . 25743 1 21 . 1 1 4 4 ARG HB2 H 1 1.820 0.007 . 2 . . . . 1420 ARG HB2 . 25743 1 22 . 1 1 4 4 ARG HB3 H 1 1.820 0.007 . 2 . . . . 1420 ARG HB3 . 25743 1 23 . 1 1 4 4 ARG HG2 H 1 1.635 0.001 . 2 . . . . 1420 ARG HG2 . 25743 1 24 . 1 1 4 4 ARG HG3 H 1 1.635 0.001 . 2 . . . . 1420 ARG HG3 . 25743 1 25 . 1 1 4 4 ARG HD2 H 1 3.177 0.000 . 2 . . . . 1420 ARG HD2 . 25743 1 26 . 1 1 4 4 ARG HD3 H 1 3.177 0.000 . 2 . . . . 1420 ARG HD3 . 25743 1 27 . 1 1 4 4 ARG CA C 13 56.343 0.081 . 1 . . . . 1420 ARG CA . 25743 1 28 . 1 1 4 4 ARG CB C 13 30.719 0.138 . 1 . . . . 1420 ARG CB . 25743 1 29 . 1 1 4 4 ARG CG C 13 27.282 0.000 . 1 . . . . 1420 ARG CG . 25743 1 30 . 1 1 4 4 ARG CD C 13 43.195 0.000 . 1 . . . . 1420 ARG CD . 25743 1 31 . 1 1 4 4 ARG N N 15 122.603 0.014 . 1 . . . . 1420 ARG N . 25743 1 32 . 1 1 5 5 SER H H 1 8.456 0.006 . 1 . . . . 1421 SER H . 25743 1 33 . 1 1 5 5 SER HA H 1 4.470 0.002 . 1 . . . . 1421 SER HA . 25743 1 34 . 1 1 5 5 SER HB2 H 1 3.876 0.000 . 2 . . . . 1421 SER HB2 . 25743 1 35 . 1 1 5 5 SER HB3 H 1 3.876 0.000 . 2 . . . . 1421 SER HB3 . 25743 1 36 . 1 1 5 5 SER CA C 13 58.449 0.082 . 1 . . . . 1421 SER CA . 25743 1 37 . 1 1 5 5 SER CB C 13 63.922 0.065 . 1 . . . . 1421 SER CB . 25743 1 38 . 1 1 5 5 SER N N 15 117.419 0.116 . 1 . . . . 1421 SER N . 25743 1 39 . 1 1 6 6 SER H H 1 8.460 0.006 . 1 . . . . 1422 SER H . 25743 1 40 . 1 1 6 6 SER HA H 1 4.459 0.003 . 1 . . . . 1422 SER HA . 25743 1 41 . 1 1 6 6 SER HB2 H 1 3.888 0.000 . 2 . . . . 1422 SER HB2 . 25743 1 42 . 1 1 6 6 SER HB3 H 1 3.888 0.000 . 2 . . . . 1422 SER HB3 . 25743 1 43 . 1 1 6 6 SER CA C 13 58.617 0.065 . 1 . . . . 1422 SER CA . 25743 1 44 . 1 1 6 6 SER CB C 13 63.966 0.105 . 1 . . . . 1422 SER CB . 25743 1 45 . 1 1 6 6 SER N N 15 117.928 0.095 . 1 . . . . 1422 SER N . 25743 1 46 . 1 1 7 7 GLY H H 1 8.451 0.006 . 1 . . . . 1423 GLY H . 25743 1 47 . 1 1 7 7 GLY HA2 H 1 3.963 0.004 . 2 . . . . 1423 GLY HA2 . 25743 1 48 . 1 1 7 7 GLY HA3 H 1 3.963 0.004 . 2 . . . . 1423 GLY HA3 . 25743 1 49 . 1 1 7 7 GLY CA C 13 45.337 0.036 . 1 . . . . 1423 GLY CA . 25743 1 50 . 1 1 7 7 GLY N N 15 117.928 0.095 . 1 . . . . 1423 GLY N . 25743 1 51 . 1 1 8 8 ARG H H 1 8.283 0.006 . 1 . . . . 1424 ARG H . 25743 1 52 . 1 1 8 8 ARG HA H 1 4.311 0.006 . 1 . . . . 1424 ARG HA . 25743 1 53 . 1 1 8 8 ARG HB2 H 1 1.775 0.010 . 2 . . . . 1424 ARG HB2 . 25743 1 54 . 1 1 8 8 ARG HB3 H 1 1.775 0.010 . 2 . . . . 1424 ARG HB3 . 25743 1 55 . 1 1 8 8 ARG HG2 H 1 1.586 0.008 . 2 . . . . 1424 ARG HG2 . 25743 1 56 . 1 1 8 8 ARG HG3 H 1 1.586 0.008 . 2 . . . . 1424 ARG HG3 . 25743 1 57 . 1 1 8 8 ARG HD2 H 1 3.160 0.000 . 2 . . . . 1424 ARG HD2 . 25743 1 58 . 1 1 8 8 ARG HD3 H 1 3.160 0.000 . 2 . . . . 1424 ARG HD3 . 25743 1 59 . 1 1 8 8 ARG CA C 13 56.275 0.070 . 1 . . . . 1424 ARG CA . 25743 1 60 . 1 1 8 8 ARG CB C 13 30.760 0.090 . 1 . . . . 1424 ARG CB . 25743 1 61 . 1 1 8 8 ARG CG C 13 27.229 0.000 . 1 . . . . 1424 ARG CG . 25743 1 62 . 1 1 8 8 ARG CD C 13 43.182 0.000 . 1 . . . . 1424 ARG CD . 25743 1 63 . 1 1 8 8 ARG N N 15 120.789 0.033 . 1 . . . . 1424 ARG N . 25743 1 64 . 1 1 9 9 GLN H H 1 8.614 0.004 . 1 . . . . 1425 GLN H . 25743 1 65 . 1 1 9 9 GLN HA H 1 4.334 0.005 . 1 . . . . 1425 GLN HA . 25743 1 66 . 1 1 9 9 GLN HB2 H 1 2.144 0.000 . 2 . . . . 1425 GLN HB2 . 25743 1 67 . 1 1 9 9 GLN HB3 H 1 2.025 0.000 . 2 . . . . 1425 GLN HB3 . 25743 1 68 . 1 1 9 9 GLN HG2 H 1 2.357 0.008 . 2 . . . . 1425 GLN HG2 . 25743 1 69 . 1 1 9 9 GLN HG3 H 1 2.357 0.008 . 2 . . . . 1425 GLN HG3 . 25743 1 70 . 1 1 9 9 GLN CA C 13 56.115 0.071 . 1 . . . . 1425 GLN CA . 25743 1 71 . 1 1 9 9 GLN CB C 13 29.507 0.058 . 1 . . . . 1425 GLN CB . 25743 1 72 . 1 1 9 9 GLN CG C 13 33.672 0.000 . 1 . . . . 1425 GLN CG . 25743 1 73 . 1 1 9 9 GLN N N 15 122.138 0.037 . 1 . . . . 1425 GLN N . 25743 1 74 . 1 1 10 10 GLY H H 1 8.542 0.005 . 1 . . . . 1426 GLY H . 25743 1 75 . 1 1 10 10 GLY HA2 H 1 3.970 0.003 . 2 . . . . 1426 GLY HA2 . 25743 1 76 . 1 1 10 10 GLY HA3 H 1 3.970 0.003 . 2 . . . . 1426 GLY HA3 . 25743 1 77 . 1 1 10 10 GLY CA C 13 45.339 0.040 . 1 . . . . 1426 GLY CA . 25743 1 78 . 1 1 10 10 GLY N N 15 110.494 0.042 . 1 . . . . 1426 GLY N . 25743 1 79 . 1 1 11 11 GLY H H 1 8.330 0.008 . 1 . . . . 1427 GLY H . 25743 1 80 . 1 1 11 11 GLY HA2 H 1 3.976 0.003 . 2 . . . . 1427 GLY HA2 . 25743 1 81 . 1 1 11 11 GLY HA3 H 1 3.976 0.003 . 2 . . . . 1427 GLY HA3 . 25743 1 82 . 1 1 11 11 GLY CA C 13 45.214 0.021 . 1 . . . . 1427 GLY CA . 25743 1 83 . 1 1 11 11 GLY N N 15 108.762 0.016 . 1 . . . . 1427 GLY N . 25743 1 84 . 1 1 12 12 VAL H H 1 8.090 0.005 . 1 . . . . 1428 VAL H . 25743 1 85 . 1 1 12 12 VAL HA H 1 4.041 0.002 . 1 . . . . 1428 VAL HA . 25743 1 86 . 1 1 12 12 VAL HB H 1 2.005 0.010 . 1 . . . . 1428 VAL HB . 25743 1 87 . 1 1 12 12 VAL HG11 H 1 0.850 0.009 . 2 . . . . 1428 VAL MG1 . 25743 1 88 . 1 1 12 12 VAL HG12 H 1 0.850 0.009 . 2 . . . . 1428 VAL MG1 . 25743 1 89 . 1 1 12 12 VAL HG13 H 1 0.850 0.009 . 2 . . . . 1428 VAL MG1 . 25743 1 90 . 1 1 12 12 VAL HG21 H 1 0.850 0.009 . 2 . . . . 1428 VAL MG2 . 25743 1 91 . 1 1 12 12 VAL HG22 H 1 0.850 0.009 . 2 . . . . 1428 VAL MG2 . 25743 1 92 . 1 1 12 12 VAL HG23 H 1 0.850 0.009 . 2 . . . . 1428 VAL MG2 . 25743 1 93 . 1 1 12 12 VAL CA C 13 62.627 0.107 . 1 . . . . 1428 VAL CA . 25743 1 94 . 1 1 12 12 VAL CB C 13 32.605 0.105 . 1 . . . . 1428 VAL CB . 25743 1 95 . 1 1 12 12 VAL CG1 C 13 21.214 0.000 . 2 . . . . 1428 VAL CG1 . 25743 1 96 . 1 1 12 12 VAL CG2 C 13 21.214 0.000 . 2 . . . . 1428 VAL CG2 . 25743 1 97 . 1 1 12 12 VAL N N 15 119.311 0.031 . 1 . . . . 1428 VAL N . 25743 1 98 . 1 1 13 13 HIS H H 1 8.478 0.013 . 1 . . . . 1429 HIS H . 25743 1 99 . 1 1 13 13 HIS HA H 1 4.593 0.008 . 1 . . . . 1429 HIS HA . 25743 1 100 . 1 1 13 13 HIS HB2 H 1 3.101 0.016 . 2 . . . . 1429 HIS HB2 . 25743 1 101 . 1 1 13 13 HIS HB3 H 1 3.101 0.016 . 2 . . . . 1429 HIS HB3 . 25743 1 102 . 1 1 13 13 HIS CA C 13 56.283 0.047 . 1 . . . . 1429 HIS CA . 25743 1 103 . 1 1 13 13 HIS CB C 13 30.307 0.174 . 1 . . . . 1429 HIS CB . 25743 1 104 . 1 1 13 13 HIS N N 15 122.850 0.058 . 1 . . . . 1429 HIS N . 25743 1 105 . 1 1 14 14 GLU H H 1 8.348 0.009 . 1 . . . . 1430 GLU H . 25743 1 106 . 1 1 14 14 GLU HA H 1 4.116 0.009 . 1 . . . . 1430 GLU HA . 25743 1 107 . 1 1 14 14 GLU HB2 H 1 1.847 0.018 . 2 . . . . 1430 GLU HB2 . 25743 1 108 . 1 1 14 14 GLU HB3 H 1 1.847 0.018 . 2 . . . . 1430 GLU HB3 . 25743 1 109 . 1 1 14 14 GLU HG2 H 1 2.145 0.010 . 2 . . . . 1430 GLU HG2 . 25743 1 110 . 1 1 14 14 GLU HG3 H 1 2.145 0.010 . 2 . . . . 1430 GLU HG3 . 25743 1 111 . 1 1 14 14 GLU CA C 13 56.788 0.144 . 1 . . . . 1430 GLU CA . 25743 1 112 . 1 1 14 14 GLU CB C 13 30.258 0.053 . 1 . . . . 1430 GLU CB . 25743 1 113 . 1 1 14 14 GLU CG C 13 36.348 0.000 . 1 . . . . 1430 GLU CG . 25743 1 114 . 1 1 14 14 GLU N N 15 122.613 0.035 . 1 . . . . 1430 GLU N . 25743 1 115 . 1 1 15 15 LEU H H 1 8.237 0.007 . 1 . . . . 1431 LEU H . 25743 1 116 . 1 1 15 15 LEU HA H 1 4.082 0.000 . 1 . . . . 1431 LEU HA . 25743 1 117 . 1 1 15 15 LEU HB2 H 1 1.635 0.008 . 2 . . . . 1431 LEU HB2 . 25743 1 118 . 1 1 15 15 LEU HB3 H 1 1.528 0.000 . 2 . . . . 1431 LEU HB3 . 25743 1 119 . 1 1 15 15 LEU HD11 H 1 0.877 0.007 . 2 . . . . 1431 LEU MD1 . 25743 1 120 . 1 1 15 15 LEU HD12 H 1 0.877 0.007 . 2 . . . . 1431 LEU MD1 . 25743 1 121 . 1 1 15 15 LEU HD13 H 1 0.877 0.007 . 2 . . . . 1431 LEU MD1 . 25743 1 122 . 1 1 15 15 LEU HD21 H 1 0.854 0.000 . 2 . . . . 1431 LEU MD2 . 25743 1 123 . 1 1 15 15 LEU HD22 H 1 0.854 0.000 . 2 . . . . 1431 LEU MD2 . 25743 1 124 . 1 1 15 15 LEU HD23 H 1 0.854 0.000 . 2 . . . . 1431 LEU MD2 . 25743 1 125 . 1 1 15 15 LEU CA C 13 55.890 0.028 . 1 . . . . 1431 LEU CA . 25743 1 126 . 1 1 15 15 LEU CB C 13 42.559 0.352 . 1 . . . . 1431 LEU CB . 25743 1 127 . 1 1 15 15 LEU CG C 13 27.290 0.000 . 1 . . . . 1431 LEU CG . 25743 1 128 . 1 1 15 15 LEU CD1 C 13 25.292 0.000 . 2 . . . . 1431 LEU CD1 . 25743 1 129 . 1 1 15 15 LEU CD2 C 13 23.723 0.000 . 2 . . . . 1431 LEU CD2 . 25743 1 130 . 1 1 15 15 LEU N N 15 122.190 0.031 . 1 . . . . 1431 LEU N . 25743 1 131 . 1 1 16 16 SER H H 1 8.540 0.011 . 1 . . . . 1432 SER H . 25743 1 132 . 1 1 16 16 SER HA H 1 4.263 0.013 . 1 . . . . 1432 SER HA . 25743 1 133 . 1 1 16 16 SER HB2 H 1 4.054 0.000 . 2 . . . . 1432 SER HB2 . 25743 1 134 . 1 1 16 16 SER HB3 H 1 4.054 0.000 . 2 . . . . 1432 SER HB3 . 25743 1 135 . 1 1 16 16 SER CA C 13 58.778 0.018 . 1 . . . . 1432 SER CA . 25743 1 136 . 1 1 16 16 SER CB C 13 63.939 0.000 . 1 . . . . 1432 SER CB . 25743 1 137 . 1 1 16 16 SER N N 15 117.132 0.098 . 1 . . . . 1432 SER N . 25743 1 138 . 1 1 17 17 ALA H H 1 8.377 0.010 . 1 . . . . 1433 ALA H . 25743 1 139 . 1 1 17 17 ALA HA H 1 4.067 0.016 . 1 . . . . 1433 ALA HA . 25743 1 140 . 1 1 17 17 ALA HB1 H 1 1.331 0.008 . 1 . . . . 1433 ALA MB . 25743 1 141 . 1 1 17 17 ALA HB2 H 1 1.331 0.008 . 1 . . . . 1433 ALA MB . 25743 1 142 . 1 1 17 17 ALA HB3 H 1 1.331 0.008 . 1 . . . . 1433 ALA MB . 25743 1 143 . 1 1 17 17 ALA CA C 13 55.272 0.061 . 1 . . . . 1433 ALA CA . 25743 1 144 . 1 1 17 17 ALA CB C 13 18.421 0.100 . 1 . . . . 1433 ALA CB . 25743 1 145 . 1 1 17 17 ALA N N 15 124.560 0.053 . 1 . . . . 1433 ALA N . 25743 1 146 . 1 1 18 18 PHE H H 1 7.393 0.008 . 1 . . . . 1434 PHE H . 25743 1 147 . 1 1 18 18 PHE HA H 1 3.977 0.002 . 1 . . . . 1434 PHE HA . 25743 1 148 . 1 1 18 18 PHE HB2 H 1 2.796 0.003 . 2 . . . . 1434 PHE HB2 . 25743 1 149 . 1 1 18 18 PHE HB3 H 1 2.316 0.013 . 2 . . . . 1434 PHE HB3 . 25743 1 150 . 1 1 18 18 PHE CA C 13 57.093 0.000 . 1 . . . . 1434 PHE CA . 25743 1 151 . 1 1 18 18 PHE CB C 13 37.410 0.046 . 1 . . . . 1434 PHE CB . 25743 1 152 . 1 1 18 18 PHE N N 15 114.053 0.036 . 1 . . . . 1434 PHE N . 25743 1 153 . 1 1 19 19 GLU H H 1 7.737 0.011 . 1 . . . . 1435 GLU H . 25743 1 154 . 1 1 19 19 GLU HA H 1 3.929 0.000 . 1 . . . . 1435 GLU HA . 25743 1 155 . 1 1 19 19 GLU HB2 H 1 2.094 0.000 . 2 . . . . 1435 GLU HB2 . 25743 1 156 . 1 1 19 19 GLU HB3 H 1 2.094 0.000 . 2 . . . . 1435 GLU HB3 . 25743 1 157 . 1 1 19 19 GLU HG2 H 1 2.270 0.000 . 2 . . . . 1435 GLU HG2 . 25743 1 158 . 1 1 19 19 GLU HG3 H 1 2.270 0.000 . 2 . . . . 1435 GLU HG3 . 25743 1 159 . 1 1 19 19 GLU CA C 13 59.811 0.052 . 1 . . . . 1435 GLU CA . 25743 1 160 . 1 1 19 19 GLU CB C 13 29.967 0.000 . 1 . . . . 1435 GLU CB . 25743 1 161 . 1 1 19 19 GLU CG C 13 36.930 0.000 . 1 . . . . 1435 GLU CG . 25743 1 162 . 1 1 19 19 GLU N N 15 118.194 0.095 . 1 . . . . 1435 GLU N . 25743 1 163 . 1 1 20 20 GLN H H 1 8.410 0.011 . 1 . . . . 1436 GLN H . 25743 1 164 . 1 1 20 20 GLN HA H 1 3.228 0.009 . 1 . . . . 1436 GLN HA . 25743 1 165 . 1 1 20 20 GLN HG2 H 1 2.370 0.000 . 2 . . . . 1436 GLN HG2 . 25743 1 166 . 1 1 20 20 GLN HG3 H 1 2.370 0.000 . 2 . . . . 1436 GLN HG3 . 25743 1 167 . 1 1 20 20 GLN CA C 13 59.176 0.077 . 1 . . . . 1436 GLN CA . 25743 1 168 . 1 1 20 20 GLN CB C 13 28.448 0.000 . 1 . . . . 1436 GLN CB . 25743 1 169 . 1 1 20 20 GLN N N 15 117.427 0.118 . 1 . . . . 1436 GLN N . 25743 1 170 . 1 1 21 21 LEU H H 1 8.113 0.006 . 1 . . . . 1437 LEU H . 25743 1 171 . 1 1 21 21 LEU HA H 1 4.179 0.008 . 1 . . . . 1437 LEU HA . 25743 1 172 . 1 1 21 21 LEU HB2 H 1 1.956 0.011 . 2 . . . . 1437 LEU HB2 . 25743 1 173 . 1 1 21 21 LEU HB3 H 1 1.956 0.011 . 2 . . . . 1437 LEU HB3 . 25743 1 174 . 1 1 21 21 LEU HG H 1 1.553 0.000 . 1 . . . . 1437 LEU HG . 25743 1 175 . 1 1 21 21 LEU HD11 H 1 1.019 0.015 . 2 . . . . 1437 LEU MD1 . 25743 1 176 . 1 1 21 21 LEU HD12 H 1 1.019 0.015 . 2 . . . . 1437 LEU MD1 . 25743 1 177 . 1 1 21 21 LEU HD13 H 1 1.019 0.015 . 2 . . . . 1437 LEU MD1 . 25743 1 178 . 1 1 21 21 LEU HD21 H 1 1.019 0.015 . 2 . . . . 1437 LEU MD2 . 25743 1 179 . 1 1 21 21 LEU HD22 H 1 1.019 0.015 . 2 . . . . 1437 LEU MD2 . 25743 1 180 . 1 1 21 21 LEU HD23 H 1 1.019 0.015 . 2 . . . . 1437 LEU MD2 . 25743 1 181 . 1 1 21 21 LEU CA C 13 58.343 0.103 . 1 . . . . 1437 LEU CA . 25743 1 182 . 1 1 21 21 LEU CB C 13 41.577 0.029 . 1 . . . . 1437 LEU CB . 25743 1 183 . 1 1 21 21 LEU CG C 13 27.813 0.000 . 1 . . . . 1437 LEU CG . 25743 1 184 . 1 1 21 21 LEU CD1 C 13 25.567 0.000 . 2 . . . . 1437 LEU CD1 . 25743 1 185 . 1 1 21 21 LEU CD2 C 13 25.567 0.000 . 2 . . . . 1437 LEU CD2 . 25743 1 186 . 1 1 21 21 LEU N N 15 118.352 0.063 . 1 . . . . 1437 LEU N . 25743 1 187 . 1 1 22 22 VAL H H 1 8.210 0.007 . 1 . . . . 1438 VAL H . 25743 1 188 . 1 1 22 22 VAL HA H 1 3.650 0.006 . 1 . . . . 1438 VAL HA . 25743 1 189 . 1 1 22 22 VAL HB H 1 2.347 0.010 . 1 . . . . 1438 VAL HB . 25743 1 190 . 1 1 22 22 VAL HG11 H 1 1.066 0.010 . 2 . . . . 1438 VAL MG1 . 25743 1 191 . 1 1 22 22 VAL HG12 H 1 1.066 0.010 . 2 . . . . 1438 VAL MG1 . 25743 1 192 . 1 1 22 22 VAL HG13 H 1 1.066 0.010 . 2 . . . . 1438 VAL MG1 . 25743 1 193 . 1 1 22 22 VAL HG21 H 1 1.066 0.010 . 2 . . . . 1438 VAL MG2 . 25743 1 194 . 1 1 22 22 VAL HG22 H 1 1.066 0.010 . 2 . . . . 1438 VAL MG2 . 25743 1 195 . 1 1 22 22 VAL HG23 H 1 1.066 0.010 . 2 . . . . 1438 VAL MG2 . 25743 1 196 . 1 1 22 22 VAL CA C 13 68.040 0.064 . 1 . . . . 1438 VAL CA . 25743 1 197 . 1 1 22 22 VAL CB C 13 31.371 0.114 . 1 . . . . 1438 VAL CB . 25743 1 198 . 1 1 22 22 VAL CG1 C 13 24.958 0.000 . 2 . . . . 1438 VAL CG1 . 25743 1 199 . 1 1 22 22 VAL CG2 C 13 22.292 0.000 . 2 . . . . 1438 VAL CG2 . 25743 1 200 . 1 1 22 22 VAL N N 15 117.758 0.054 . 1 . . . . 1438 VAL N . 25743 1 201 . 1 1 23 23 VAL H H 1 8.150 0.042 . 1 . . . . 1439 VAL H . 25743 1 202 . 1 1 23 23 VAL HA H 1 3.626 0.010 . 1 . . . . 1439 VAL HA . 25743 1 203 . 1 1 23 23 VAL HB H 1 2.279 0.004 . 1 . . . . 1439 VAL HB . 25743 1 204 . 1 1 23 23 VAL HG11 H 1 0.979 0.010 . 2 . . . . 1439 VAL MG1 . 25743 1 205 . 1 1 23 23 VAL HG12 H 1 0.979 0.010 . 2 . . . . 1439 VAL MG1 . 25743 1 206 . 1 1 23 23 VAL HG13 H 1 0.979 0.010 . 2 . . . . 1439 VAL MG1 . 25743 1 207 . 1 1 23 23 VAL HG21 H 1 0.979 0.010 . 2 . . . . 1439 VAL MG2 . 25743 1 208 . 1 1 23 23 VAL HG22 H 1 0.979 0.010 . 2 . . . . 1439 VAL MG2 . 25743 1 209 . 1 1 23 23 VAL HG23 H 1 0.979 0.010 . 2 . . . . 1439 VAL MG2 . 25743 1 210 . 1 1 23 23 VAL CA C 13 67.211 0.071 . 1 . . . . 1439 VAL CA . 25743 1 211 . 1 1 23 23 VAL CB C 13 31.326 0.105 . 1 . . . . 1439 VAL CB . 25743 1 212 . 1 1 23 23 VAL CG1 C 13 23.410 0.000 . 2 . . . . 1439 VAL CG1 . 25743 1 213 . 1 1 23 23 VAL CG2 C 13 21.150 0.000 . 2 . . . . 1439 VAL CG2 . 25743 1 214 . 1 1 23 23 VAL N N 15 119.427 0.042 . 1 . . . . 1439 VAL N . 25743 1 215 . 1 1 24 24 GLU H H 1 8.173 0.007 . 1 . . . . 1440 GLU H . 25743 1 216 . 1 1 24 24 GLU HA H 1 4.142 0.010 . 1 . . . . 1440 GLU HA . 25743 1 217 . 1 1 24 24 GLU HB2 H 1 2.388 0.000 . 2 . . . . 1440 GLU HB2 . 25743 1 218 . 1 1 24 24 GLU HB3 H 1 2.388 0.000 . 2 . . . . 1440 GLU HB3 . 25743 1 219 . 1 1 24 24 GLU HG2 H 1 2.621 0.000 . 2 . . . . 1440 GLU HG2 . 25743 1 220 . 1 1 24 24 GLU HG3 H 1 2.621 0.000 . 2 . . . . 1440 GLU HG3 . 25743 1 221 . 1 1 24 24 GLU CA C 13 59.479 0.000 . 1 . . . . 1440 GLU CA . 25743 1 222 . 1 1 24 24 GLU N N 15 118.102 0.049 . 1 . . . . 1440 GLU N . 25743 1 223 . 1 1 25 25 LEU H H 1 8.423 0.006 . 1 . . . . 1441 LEU H . 25743 1 224 . 1 1 25 25 LEU HA H 1 3.584 0.000 . 1 . . . . 1441 LEU HA . 25743 1 225 . 1 1 25 25 LEU HB2 H 1 2.234 0.000 . 2 . . . . 1441 LEU HB2 . 25743 1 226 . 1 1 25 25 LEU HB3 H 1 2.234 0.000 . 2 . . . . 1441 LEU HB3 . 25743 1 227 . 1 1 25 25 LEU HG H 1 1.888 0.000 . 1 . . . . 1441 LEU HG . 25743 1 228 . 1 1 25 25 LEU HD11 H 1 1.065 0.000 . 2 . . . . 1441 LEU MD1 . 25743 1 229 . 1 1 25 25 LEU HD12 H 1 1.065 0.000 . 2 . . . . 1441 LEU MD1 . 25743 1 230 . 1 1 25 25 LEU HD13 H 1 1.065 0.000 . 2 . . . . 1441 LEU MD1 . 25743 1 231 . 1 1 25 25 LEU HD21 H 1 0.727 0.006 . 2 . . . . 1441 LEU MD2 . 25743 1 232 . 1 1 25 25 LEU HD22 H 1 0.727 0.006 . 2 . . . . 1441 LEU MD2 . 25743 1 233 . 1 1 25 25 LEU HD23 H 1 0.727 0.006 . 2 . . . . 1441 LEU MD2 . 25743 1 234 . 1 1 25 25 LEU CA C 13 58.523 0.042 . 1 . . . . 1441 LEU CA . 25743 1 235 . 1 1 25 25 LEU CB C 13 41.965 0.071 . 1 . . . . 1441 LEU CB . 25743 1 236 . 1 1 25 25 LEU CD1 C 13 26.829 0.000 . 2 . . . . 1441 LEU CD1 . 25743 1 237 . 1 1 25 25 LEU CD2 C 13 26.829 0.000 . 2 . . . . 1441 LEU CD2 . 25743 1 238 . 1 1 25 25 LEU N N 15 117.783 0.120 . 1 . . . . 1441 LEU N . 25743 1 239 . 1 1 26 26 VAL H H 1 8.422 0.008 . 1 . . . . 1442 VAL H . 25743 1 240 . 1 1 26 26 VAL HA H 1 3.505 0.010 . 1 . . . . 1442 VAL HA . 25743 1 241 . 1 1 26 26 VAL HB H 1 2.232 0.013 . 1 . . . . 1442 VAL HB . 25743 1 242 . 1 1 26 26 VAL HG11 H 1 1.084 0.000 . 2 . . . . 1442 VAL MG1 . 25743 1 243 . 1 1 26 26 VAL HG12 H 1 1.084 0.000 . 2 . . . . 1442 VAL MG1 . 25743 1 244 . 1 1 26 26 VAL HG13 H 1 1.084 0.000 . 2 . . . . 1442 VAL MG1 . 25743 1 245 . 1 1 26 26 VAL HG21 H 1 0.933 0.007 . 2 . . . . 1442 VAL MG2 . 25743 1 246 . 1 1 26 26 VAL HG22 H 1 0.933 0.007 . 2 . . . . 1442 VAL MG2 . 25743 1 247 . 1 1 26 26 VAL HG23 H 1 0.933 0.007 . 2 . . . . 1442 VAL MG2 . 25743 1 248 . 1 1 26 26 VAL CA C 13 66.567 0.126 . 1 . . . . 1442 VAL CA . 25743 1 249 . 1 1 26 26 VAL CB C 13 32.117 0.112 . 1 . . . . 1442 VAL CB . 25743 1 250 . 1 1 26 26 VAL CG1 C 13 24.305 0.000 . 2 . . . . 1442 VAL CG1 . 25743 1 251 . 1 1 26 26 VAL CG2 C 13 21.708 0.000 . 2 . . . . 1442 VAL CG2 . 25743 1 252 . 1 1 26 26 VAL N N 15 116.046 0.079 . 1 . . . . 1442 VAL N . 25743 1 253 . 1 1 27 27 ARG H H 1 7.888 0.009 . 1 . . . . 1443 ARG H . 25743 1 254 . 1 1 27 27 ARG HA H 1 4.170 0.007 . 1 . . . . 1443 ARG HA . 25743 1 255 . 1 1 27 27 ARG HB2 H 1 1.934 0.009 . 2 . . . . 1443 ARG HB2 . 25743 1 256 . 1 1 27 27 ARG HB3 H 1 1.934 0.009 . 2 . . . . 1443 ARG HB3 . 25743 1 257 . 1 1 27 27 ARG HG2 H 1 1.883 0.012 . 2 . . . . 1443 ARG HG2 . 25743 1 258 . 1 1 27 27 ARG HG3 H 1 1.883 0.012 . 2 . . . . 1443 ARG HG3 . 25743 1 259 . 1 1 27 27 ARG HD2 H 1 3.122 0.008 . 2 . . . . 1443 ARG HD2 . 25743 1 260 . 1 1 27 27 ARG HD3 H 1 3.122 0.008 . 2 . . . . 1443 ARG HD3 . 25743 1 261 . 1 1 27 27 ARG CA C 13 57.128 0.058 . 1 . . . . 1443 ARG CA . 25743 1 262 . 1 1 27 27 ARG CB C 13 30.949 0.034 . 1 . . . . 1443 ARG CB . 25743 1 263 . 1 1 27 27 ARG CG C 13 27.533 0.000 . 1 . . . . 1443 ARG CG . 25743 1 264 . 1 1 27 27 ARG CD C 13 44.051 0.000 . 1 . . . . 1443 ARG CD . 25743 1 265 . 1 1 27 27 ARG N N 15 116.215 0.051 . 1 . . . . 1443 ARG N . 25743 1 266 . 1 1 28 28 HIS H H 1 7.419 0.005 . 1 . . . . 1444 HIS H . 25743 1 267 . 1 1 28 28 HIS HA H 1 3.920 0.006 . 1 . . . . 1444 HIS HA . 25743 1 268 . 1 1 28 28 HIS HB2 H 1 2.906 0.011 . 2 . . . . 1444 HIS HB2 . 25743 1 269 . 1 1 28 28 HIS HB3 H 1 2.906 0.011 . 2 . . . . 1444 HIS HB3 . 25743 1 270 . 1 1 28 28 HIS CA C 13 58.491 0.101 . 1 . . . . 1444 HIS CA . 25743 1 271 . 1 1 28 28 HIS CB C 13 31.888 0.035 . 1 . . . . 1444 HIS CB . 25743 1 272 . 1 1 28 28 HIS N N 15 123.488 0.050 . 1 . . . . 1444 HIS N . 25743 1 273 . 1 1 29 29 ASP H H 1 8.181 0.005 . 1 . . . . 1445 ASP H . 25743 1 274 . 1 1 29 29 ASP HA H 1 4.413 0.000 . 1 . . . . 1445 ASP HA . 25743 1 275 . 1 1 29 29 ASP CA C 13 58.004 0.000 . 1 . . . . 1445 ASP CA . 25743 1 276 . 1 1 29 29 ASP CB C 13 41.345 0.000 . 1 . . . . 1445 ASP CB . 25743 1 277 . 1 1 29 29 ASP N N 15 126.724 0.042 . 1 . . . . 1445 ASP N . 25743 1 278 . 1 1 30 30 ASP HA H 1 5.191 0.014 . 1 . . . . 1446 ASP HA . 25743 1 279 . 1 1 30 30 ASP HB2 H 1 3.460 0.020 . 2 . . . . 1446 ASP HB2 . 25743 1 280 . 1 1 30 30 ASP HB3 H 1 2.875 0.000 . 2 . . . . 1446 ASP HB3 . 25743 1 281 . 1 1 30 30 ASP CA C 13 55.812 0.098 . 1 . . . . 1446 ASP CA . 25743 1 282 . 1 1 30 30 ASP CB C 13 41.471 0.021 . 1 . . . . 1446 ASP CB . 25743 1 283 . 1 1 31 31 SER H H 1 8.217 0.005 . 1 . . . . 1447 SER H . 25743 1 284 . 1 1 31 31 SER HA H 1 4.340 0.017 . 1 . . . . 1447 SER HA . 25743 1 285 . 1 1 31 31 SER HB2 H 1 3.920 0.006 . 2 . . . . 1447 SER HB2 . 25743 1 286 . 1 1 31 31 SER HB3 H 1 3.920 0.006 . 2 . . . . 1447 SER HB3 . 25743 1 287 . 1 1 31 31 SER CA C 13 59.884 0.189 . 1 . . . . 1447 SER CA . 25743 1 288 . 1 1 31 31 SER CB C 13 65.335 0.048 . 1 . . . . 1447 SER CB . 25743 1 289 . 1 1 31 31 SER N N 15 110.377 0.078 . 1 . . . . 1447 SER N . 25743 1 290 . 1 1 32 32 TRP H H 1 7.152 0.006 . 1 . . . . 1448 TRP H . 25743 1 291 . 1 1 32 32 TRP CA C 13 60.302 0.000 . 1 . . . . 1448 TRP CA . 25743 1 292 . 1 1 32 32 TRP CB C 13 27.836 0.000 . 1 . . . . 1448 TRP CB . 25743 1 293 . 1 1 32 32 TRP N N 15 121.083 0.005 . 1 . . . . 1448 TRP N . 25743 1 294 . 1 1 33 33 PRO HA H 1 4.241 0.010 . 1 . . . . 1449 PRO HA . 25743 1 295 . 1 1 33 33 PRO HB2 H 1 1.395 0.007 . 2 . . . . 1449 PRO HB2 . 25743 1 296 . 1 1 33 33 PRO HB3 H 1 1.395 0.007 . 2 . . . . 1449 PRO HB3 . 25743 1 297 . 1 1 33 33 PRO HD2 H 1 2.528 0.000 . 2 . . . . 1449 PRO HD2 . 25743 1 298 . 1 1 33 33 PRO HD3 H 1 2.528 0.000 . 2 . . . . 1449 PRO HD3 . 25743 1 299 . 1 1 33 33 PRO CA C 13 63.886 0.137 . 1 . . . . 1449 PRO CA . 25743 1 300 . 1 1 33 33 PRO CB C 13 29.785 0.001 . 1 . . . . 1449 PRO CB . 25743 1 301 . 1 1 33 33 PRO CG C 13 19.250 0.000 . 1 . . . . 1449 PRO CG . 25743 1 302 . 1 1 34 34 PHE H H 1 8.261 0.004 . 1 . . . . 1450 PHE H . 25743 1 303 . 1 1 34 34 PHE HA H 1 4.616 0.005 . 1 . . . . 1450 PHE HA . 25743 1 304 . 1 1 34 34 PHE CA C 13 57.719 0.020 . 1 . . . . 1450 PHE CA . 25743 1 305 . 1 1 34 34 PHE CB C 13 40.755 0.062 . 1 . . . . 1450 PHE CB . 25743 1 306 . 1 1 34 34 PHE N N 15 112.962 0.070 . 1 . . . . 1450 PHE N . 25743 1 307 . 1 1 35 35 LEU H H 1 7.239 0.004 . 1 . . . . 1451 LEU H . 25743 1 308 . 1 1 35 35 LEU HA H 1 4.001 0.006 . 1 . . . . 1451 LEU HA . 25743 1 309 . 1 1 35 35 LEU HB2 H 1 1.918 0.012 . 2 . . . . 1451 LEU HB2 . 25743 1 310 . 1 1 35 35 LEU HB3 H 1 1.504 0.007 . 2 . . . . 1451 LEU HB3 . 25743 1 311 . 1 1 35 35 LEU HG H 1 1.512 0.000 . 1 . . . . 1451 LEU HG . 25743 1 312 . 1 1 35 35 LEU HD11 H 1 1.007 0.008 . 2 . . . . 1451 LEU MD1 . 25743 1 313 . 1 1 35 35 LEU HD12 H 1 1.007 0.008 . 2 . . . . 1451 LEU MD1 . 25743 1 314 . 1 1 35 35 LEU HD13 H 1 1.007 0.008 . 2 . . . . 1451 LEU MD1 . 25743 1 315 . 1 1 35 35 LEU HD21 H 1 1.007 0.008 . 2 . . . . 1451 LEU MD2 . 25743 1 316 . 1 1 35 35 LEU HD22 H 1 1.007 0.008 . 2 . . . . 1451 LEU MD2 . 25743 1 317 . 1 1 35 35 LEU HD23 H 1 1.007 0.008 . 2 . . . . 1451 LEU MD2 . 25743 1 318 . 1 1 35 35 LEU CA C 13 58.601 0.119 . 1 . . . . 1451 LEU CA . 25743 1 319 . 1 1 35 35 LEU CB C 13 41.953 0.103 . 1 . . . . 1451 LEU CB . 25743 1 320 . 1 1 35 35 LEU CG C 13 25.594 0.000 . 1 . . . . 1451 LEU CG . 25743 1 321 . 1 1 35 35 LEU CD1 C 13 22.296 0.000 . 2 . . . . 1451 LEU CD1 . 25743 1 322 . 1 1 35 35 LEU CD2 C 13 22.296 0.000 . 2 . . . . 1451 LEU CD2 . 25743 1 323 . 1 1 35 35 LEU N N 15 120.581 0.018 . 1 . . . . 1451 LEU N . 25743 1 324 . 1 1 36 36 LYS H H 1 7.639 0.005 . 1 . . . . 1452 LYS H . 25743 1 325 . 1 1 36 36 LYS HA H 1 4.582 0.007 . 1 . . . . 1452 LYS HA . 25743 1 326 . 1 1 36 36 LYS HB2 H 1 1.788 0.002 . 2 . . . . 1452 LYS HB2 . 25743 1 327 . 1 1 36 36 LYS HB3 H 1 1.604 0.008 . 2 . . . . 1452 LYS HB3 . 25743 1 328 . 1 1 36 36 LYS HG2 H 1 1.111 0.008 . 2 . . . . 1452 LYS HG2 . 25743 1 329 . 1 1 36 36 LYS HG3 H 1 1.111 0.008 . 2 . . . . 1452 LYS HG3 . 25743 1 330 . 1 1 36 36 LYS HD2 H 1 1.283 0.011 . 2 . . . . 1452 LYS HD2 . 25743 1 331 . 1 1 36 36 LYS HD3 H 1 1.283 0.011 . 2 . . . . 1452 LYS HD3 . 25743 1 332 . 1 1 36 36 LYS HE2 H 1 2.923 0.009 . 2 . . . . 1452 LYS HE2 . 25743 1 333 . 1 1 36 36 LYS HE3 H 1 2.923 0.009 . 2 . . . . 1452 LYS HE3 . 25743 1 334 . 1 1 36 36 LYS CA C 13 53.939 0.115 . 1 . . . . 1452 LYS CA . 25743 1 335 . 1 1 36 36 LYS CB C 13 35.894 0.022 . 1 . . . . 1452 LYS CB . 25743 1 336 . 1 1 36 36 LYS CG C 13 23.549 0.000 . 1 . . . . 1452 LYS CG . 25743 1 337 . 1 1 36 36 LYS CD C 13 29.349 0.000 . 1 . . . . 1452 LYS CD . 25743 1 338 . 1 1 36 36 LYS CE C 13 41.902 0.000 . 1 . . . . 1452 LYS CE . 25743 1 339 . 1 1 36 36 LYS N N 15 111.947 0.067 . 1 . . . . 1452 LYS N . 25743 1 340 . 1 1 37 37 LEU H H 1 8.747 0.008 . 1 . . . . 1453 LEU H . 25743 1 341 . 1 1 37 37 LEU HA H 1 4.168 0.005 . 1 . . . . 1453 LEU HA . 25743 1 342 . 1 1 37 37 LEU HB2 H 1 1.654 0.000 . 2 . . . . 1453 LEU HB2 . 25743 1 343 . 1 1 37 37 LEU HB3 H 1 1.654 0.000 . 2 . . . . 1453 LEU HB3 . 25743 1 344 . 1 1 37 37 LEU HG H 1 1.355 0.000 . 1 . . . . 1453 LEU HG . 25743 1 345 . 1 1 37 37 LEU HD11 H 1 0.909 0.012 . 2 . . . . 1453 LEU MD1 . 25743 1 346 . 1 1 37 37 LEU HD12 H 1 0.909 0.012 . 2 . . . . 1453 LEU MD1 . 25743 1 347 . 1 1 37 37 LEU HD13 H 1 0.909 0.012 . 2 . . . . 1453 LEU MD1 . 25743 1 348 . 1 1 37 37 LEU HD21 H 1 0.743 0.011 . 2 . . . . 1453 LEU MD2 . 25743 1 349 . 1 1 37 37 LEU HD22 H 1 0.743 0.011 . 2 . . . . 1453 LEU MD2 . 25743 1 350 . 1 1 37 37 LEU HD23 H 1 0.743 0.011 . 2 . . . . 1453 LEU MD2 . 25743 1 351 . 1 1 37 37 LEU CA C 13 54.793 0.152 . 1 . . . . 1453 LEU CA . 25743 1 352 . 1 1 37 37 LEU CB C 13 41.489 0.076 . 1 . . . . 1453 LEU CB . 25743 1 353 . 1 1 37 37 LEU CG C 13 26.563 0.000 . 1 . . . . 1453 LEU CG . 25743 1 354 . 1 1 37 37 LEU CD1 C 13 24.050 0.000 . 2 . . . . 1453 LEU CD1 . 25743 1 355 . 1 1 37 37 LEU CD2 C 13 24.050 0.000 . 2 . . . . 1453 LEU CD2 . 25743 1 356 . 1 1 37 37 LEU N N 15 123.367 0.031 . 1 . . . . 1453 LEU N . 25743 1 357 . 1 1 38 38 VAL H H 1 7.775 0.005 . 1 . . . . 1454 VAL H . 25743 1 358 . 1 1 38 38 VAL HA H 1 3.761 0.004 . 1 . . . . 1454 VAL HA . 25743 1 359 . 1 1 38 38 VAL HB H 1 1.484 0.005 . 1 . . . . 1454 VAL HB . 25743 1 360 . 1 1 38 38 VAL HG11 H 1 0.551 0.014 . 2 . . . . 1454 VAL MG1 . 25743 1 361 . 1 1 38 38 VAL HG12 H 1 0.551 0.014 . 2 . . . . 1454 VAL MG1 . 25743 1 362 . 1 1 38 38 VAL HG13 H 1 0.551 0.014 . 2 . . . . 1454 VAL MG1 . 25743 1 363 . 1 1 38 38 VAL HG21 H 1 0.319 0.009 . 2 . . . . 1454 VAL MG2 . 25743 1 364 . 1 1 38 38 VAL HG22 H 1 0.319 0.009 . 2 . . . . 1454 VAL MG2 . 25743 1 365 . 1 1 38 38 VAL HG23 H 1 0.319 0.009 . 2 . . . . 1454 VAL MG2 . 25743 1 366 . 1 1 38 38 VAL CA C 13 61.803 0.043 . 1 . . . . 1454 VAL CA . 25743 1 367 . 1 1 38 38 VAL CB C 13 32.350 0.051 . 1 . . . . 1454 VAL CB . 25743 1 368 . 1 1 38 38 VAL CG1 C 13 20.931 0.000 . 2 . . . . 1454 VAL CG1 . 25743 1 369 . 1 1 38 38 VAL CG2 C 13 20.931 0.000 . 2 . . . . 1454 VAL CG2 . 25743 1 370 . 1 1 38 38 VAL N N 15 118.979 0.048 . 1 . . . . 1454 VAL N . 25743 1 371 . 1 1 39 39 SER H H 1 8.637 0.007 . 1 . . . . 1455 SER H . 25743 1 372 . 1 1 39 39 SER HA H 1 4.393 0.005 . 1 . . . . 1455 SER HA . 25743 1 373 . 1 1 39 39 SER HB2 H 1 4.091 0.001 . 2 . . . . 1455 SER HB2 . 25743 1 374 . 1 1 39 39 SER HB3 H 1 3.788 0.000 . 2 . . . . 1455 SER HB3 . 25743 1 375 . 1 1 39 39 SER CA C 13 57.486 0.054 . 1 . . . . 1455 SER CA . 25743 1 376 . 1 1 39 39 SER CB C 13 63.603 0.012 . 1 . . . . 1455 SER CB . 25743 1 377 . 1 1 39 39 SER N N 15 119.531 0.059 . 1 . . . . 1455 SER N . 25743 1 378 . 1 1 40 40 LYS H H 1 8.917 0.005 . 1 . . . . 1456 LYS H . 25743 1 379 . 1 1 40 40 LYS HA H 1 3.927 0.008 . 1 . . . . 1456 LYS HA . 25743 1 380 . 1 1 40 40 LYS HB2 H 1 1.462 0.009 . 2 . . . . 1456 LYS HB2 . 25743 1 381 . 1 1 40 40 LYS HB3 H 1 1.462 0.009 . 2 . . . . 1456 LYS HB3 . 25743 1 382 . 1 1 40 40 LYS HG2 H 1 1.149 0.010 . 2 . . . . 1456 LYS HG2 . 25743 1 383 . 1 1 40 40 LYS HG3 H 1 1.149 0.010 . 2 . . . . 1456 LYS HG3 . 25743 1 384 . 1 1 40 40 LYS HD2 H 1 1.312 0.007 . 2 . . . . 1456 LYS HD2 . 25743 1 385 . 1 1 40 40 LYS HD3 H 1 1.312 0.007 . 2 . . . . 1456 LYS HD3 . 25743 1 386 . 1 1 40 40 LYS HE2 H 1 2.671 0.001 . 2 . . . . 1456 LYS HE2 . 25743 1 387 . 1 1 40 40 LYS HE3 H 1 2.671 0.001 . 2 . . . . 1456 LYS HE3 . 25743 1 388 . 1 1 40 40 LYS CA C 13 58.525 0.203 . 1 . . . . 1456 LYS CA . 25743 1 389 . 1 1 40 40 LYS CB C 13 32.578 0.056 . 1 . . . . 1456 LYS CB . 25743 1 390 . 1 1 40 40 LYS CG C 13 24.983 0.000 . 1 . . . . 1456 LYS CG . 25743 1 391 . 1 1 40 40 LYS CD C 13 29.408 0.000 . 1 . . . . 1456 LYS CD . 25743 1 392 . 1 1 40 40 LYS CE C 13 41.870 0.000 . 1 . . . . 1456 LYS CE . 25743 1 393 . 1 1 40 40 LYS N N 15 129.609 0.037 . 1 . . . . 1456 LYS N . 25743 1 394 . 1 1 41 41 ILE H H 1 7.509 0.004 . 1 . . . . 1457 ILE H . 25743 1 395 . 1 1 41 41 ILE HA H 1 3.798 0.010 . 1 . . . . 1457 ILE HA . 25743 1 396 . 1 1 41 41 ILE HB H 1 1.650 0.006 . 1 . . . . 1457 ILE HB . 25743 1 397 . 1 1 41 41 ILE HG12 H 1 1.456 0.008 . 2 . . . . 1457 ILE HG12 . 25743 1 398 . 1 1 41 41 ILE HG13 H 1 1.456 0.008 . 2 . . . . 1457 ILE HG13 . 25743 1 399 . 1 1 41 41 ILE HG21 H 1 1.179 0.014 . 1 . . . . 1457 ILE MG . 25743 1 400 . 1 1 41 41 ILE HG22 H 1 1.179 0.014 . 1 . . . . 1457 ILE MG . 25743 1 401 . 1 1 41 41 ILE HG23 H 1 1.179 0.014 . 1 . . . . 1457 ILE MG . 25743 1 402 . 1 1 41 41 ILE HD11 H 1 0.834 0.007 . 1 . . . . 1457 ILE MD . 25743 1 403 . 1 1 41 41 ILE HD12 H 1 0.834 0.007 . 1 . . . . 1457 ILE MD . 25743 1 404 . 1 1 41 41 ILE HD13 H 1 0.834 0.007 . 1 . . . . 1457 ILE MD . 25743 1 405 . 1 1 41 41 ILE CA C 13 62.618 0.117 . 1 . . . . 1457 ILE CA . 25743 1 406 . 1 1 41 41 ILE CB C 13 37.964 0.131 . 1 . . . . 1457 ILE CB . 25743 1 407 . 1 1 41 41 ILE CG1 C 13 28.455 0.000 . 1 . . . . 1457 ILE CG1 . 25743 1 408 . 1 1 41 41 ILE CG2 C 13 17.654 0.000 . 1 . . . . 1457 ILE CG2 . 25743 1 409 . 1 1 41 41 ILE N N 15 115.678 0.033 . 1 . . . . 1457 ILE N . 25743 1 410 . 1 1 42 42 GLN H H 1 7.221 0.007 . 1 . . . . 1458 GLN H . 25743 1 411 . 1 1 42 42 GLN HA H 1 4.220 0.005 . 1 . . . . 1458 GLN HA . 25743 1 412 . 1 1 42 42 GLN HB2 H 1 2.194 0.007 . 2 . . . . 1458 GLN HB2 . 25743 1 413 . 1 1 42 42 GLN HB3 H 1 2.040 0.006 . 2 . . . . 1458 GLN HB3 . 25743 1 414 . 1 1 42 42 GLN HG2 H 1 2.414 0.013 . 2 . . . . 1458 GLN HG2 . 25743 1 415 . 1 1 42 42 GLN HG3 H 1 2.414 0.013 . 2 . . . . 1458 GLN HG3 . 25743 1 416 . 1 1 42 42 GLN CA C 13 57.579 0.047 . 1 . . . . 1458 GLN CA . 25743 1 417 . 1 1 42 42 GLN CB C 13 30.235 0.014 . 1 . . . . 1458 GLN CB . 25743 1 418 . 1 1 42 42 GLN CG C 13 34.121 0.000 . 1 . . . . 1458 GLN CG . 25743 1 419 . 1 1 42 42 GLN N N 15 117.228 0.055 . 1 . . . . 1458 GLN N . 25743 1 420 . 1 1 43 43 VAL H H 1 7.919 0.005 . 1 . . . . 1459 VAL H . 25743 1 421 . 1 1 43 43 VAL CA C 13 59.015 0.000 . 1 . . . . 1459 VAL CA . 25743 1 422 . 1 1 43 43 VAL CB C 13 30.381 0.000 . 1 . . . . 1459 VAL CB . 25743 1 423 . 1 1 43 43 VAL N N 15 117.784 0.037 . 1 . . . . 1459 VAL N . 25743 1 424 . 1 1 44 44 PRO HA H 1 4.586 0.001 . 1 . . . . 1460 PRO HA . 25743 1 425 . 1 1 44 44 PRO HB2 H 1 2.405 0.005 . 2 . . . . 1460 PRO HB2 . 25743 1 426 . 1 1 44 44 PRO HB3 H 1 2.060 0.006 . 2 . . . . 1460 PRO HB3 . 25743 1 427 . 1 1 44 44 PRO HD2 H 1 3.715 0.011 . 2 . . . . 1460 PRO HD2 . 25743 1 428 . 1 1 44 44 PRO HD3 H 1 3.715 0.011 . 2 . . . . 1460 PRO HD3 . 25743 1 429 . 1 1 44 44 PRO CA C 13 65.737 0.039 . 1 . . . . 1460 PRO CA . 25743 1 430 . 1 1 44 44 PRO CB C 13 31.414 0.096 . 1 . . . . 1460 PRO CB . 25743 1 431 . 1 1 44 44 PRO CG C 13 27.451 0.000 . 1 . . . . 1460 PRO CG . 25743 1 432 . 1 1 44 44 PRO CD C 13 50.095 0.000 . 1 . . . . 1460 PRO CD . 25743 1 433 . 1 1 45 45 ASP H H 1 8.586 0.006 . 1 . . . . 1461 ASP H . 25743 1 434 . 1 1 45 45 ASP HA H 1 4.542 0.013 . 1 . . . . 1461 ASP HA . 25743 1 435 . 1 1 45 45 ASP HB2 H 1 2.935 0.014 . 2 . . . . 1461 ASP HB2 . 25743 1 436 . 1 1 45 45 ASP HB3 H 1 2.766 0.013 . 2 . . . . 1461 ASP HB3 . 25743 1 437 . 1 1 45 45 ASP CA C 13 55.561 0.063 . 1 . . . . 1461 ASP CA . 25743 1 438 . 1 1 45 45 ASP CB C 13 40.221 0.031 . 1 . . . . 1461 ASP CB . 25743 1 439 . 1 1 45 45 ASP N N 15 115.751 0.082 . 1 . . . . 1461 ASP N . 25743 1 440 . 1 1 46 46 TYR H H 1 7.633 0.006 . 1 . . . . 1462 TYR H . 25743 1 441 . 1 1 46 46 TYR HA H 1 3.521 0.014 . 1 . . . . 1462 TYR HA . 25743 1 442 . 1 1 46 46 TYR HB2 H 1 2.558 0.011 . 2 . . . . 1462 TYR HB2 . 25743 1 443 . 1 1 46 46 TYR HB3 H 1 2.558 0.011 . 2 . . . . 1462 TYR HB3 . 25743 1 444 . 1 1 46 46 TYR CA C 13 62.245 0.021 . 1 . . . . 1462 TYR CA . 25743 1 445 . 1 1 46 46 TYR CB C 13 38.855 0.091 . 1 . . . . 1462 TYR CB . 25743 1 446 . 1 1 46 46 TYR N N 15 121.384 0.038 . 1 . . . . 1462 TYR N . 25743 1 447 . 1 1 47 47 TYR H H 1 7.294 0.008 . 1 . . . . 1463 TYR H . 25743 1 448 . 1 1 47 47 TYR HA H 1 4.031 0.004 . 1 . . . . 1463 TYR HA . 25743 1 449 . 1 1 47 47 TYR HB2 H 1 3.295 0.009 . 2 . . . . 1463 TYR HB2 . 25743 1 450 . 1 1 47 47 TYR HB3 H 1 2.805 0.000 . 2 . . . . 1463 TYR HB3 . 25743 1 451 . 1 1 47 47 TYR CA C 13 59.950 0.157 . 1 . . . . 1463 TYR CA . 25743 1 452 . 1 1 47 47 TYR CB C 13 41.192 0.041 . 1 . . . . 1463 TYR CB . 25743 1 453 . 1 1 47 47 TYR N N 15 112.749 0.045 . 1 . . . . 1463 TYR N . 25743 1 454 . 1 1 48 48 ASP H H 1 7.386 0.007 . 1 . . . . 1464 ASP H . 25743 1 455 . 1 1 48 48 ASP HA H 1 4.624 0.016 . 1 . . . . 1464 ASP HA . 25743 1 456 . 1 1 48 48 ASP HB2 H 1 2.757 0.007 . 2 . . . . 1464 ASP HB2 . 25743 1 457 . 1 1 48 48 ASP HB3 H 1 2.757 0.007 . 2 . . . . 1464 ASP HB3 . 25743 1 458 . 1 1 48 48 ASP CA C 13 55.884 0.109 . 1 . . . . 1464 ASP CA . 25743 1 459 . 1 1 48 48 ASP CB C 13 41.192 0.041 . 1 . . . . 1464 ASP CB . 25743 1 460 . 1 1 48 48 ASP N N 15 119.014 0.033 . 1 . . . . 1464 ASP N . 25743 1 461 . 1 1 49 49 ILE H H 1 7.069 0.008 . 1 . . . . 1465 ILE H . 25743 1 462 . 1 1 49 49 ILE HA H 1 4.586 0.003 . 1 . . . . 1465 ILE HA . 25743 1 463 . 1 1 49 49 ILE HB H 1 2.616 0.000 . 1 . . . . 1465 ILE HB . 25743 1 464 . 1 1 49 49 ILE HG12 H 1 1.603 0.003 . 2 . . . . 1465 ILE HG12 . 25743 1 465 . 1 1 49 49 ILE HG13 H 1 1.603 0.003 . 2 . . . . 1465 ILE HG13 . 25743 1 466 . 1 1 49 49 ILE HG21 H 1 0.877 0.007 . 1 . . . . 1465 ILE MG . 25743 1 467 . 1 1 49 49 ILE HG22 H 1 0.877 0.007 . 1 . . . . 1465 ILE MG . 25743 1 468 . 1 1 49 49 ILE HG23 H 1 0.877 0.007 . 1 . . . . 1465 ILE MG . 25743 1 469 . 1 1 49 49 ILE HD11 H 1 0.877 0.007 . 1 . . . . 1465 ILE MD . 25743 1 470 . 1 1 49 49 ILE HD12 H 1 0.877 0.007 . 1 . . . . 1465 ILE MD . 25743 1 471 . 1 1 49 49 ILE HD13 H 1 0.877 0.007 . 1 . . . . 1465 ILE MD . 25743 1 472 . 1 1 49 49 ILE CA C 13 62.611 0.000 . 1 . . . . 1465 ILE CA . 25743 1 473 . 1 1 49 49 ILE CB C 13 41.085 0.059 . 1 . . . . 1465 ILE CB . 25743 1 474 . 1 1 49 49 ILE CG1 C 13 29.763 0.000 . 1 . . . . 1465 ILE CG1 . 25743 1 475 . 1 1 49 49 ILE CG2 C 13 17.221 0.000 . 1 . . . . 1465 ILE CG2 . 25743 1 476 . 1 1 49 49 ILE N N 15 119.159 0.024 . 1 . . . . 1465 ILE N . 25743 1 477 . 1 1 50 50 ILE H H 1 8.024 0.011 . 1 . . . . 1466 ILE H . 25743 1 478 . 1 1 50 50 ILE HA H 1 3.868 0.012 . 1 . . . . 1466 ILE HA . 25743 1 479 . 1 1 50 50 ILE HB H 1 1.367 0.004 . 1 . . . . 1466 ILE HB . 25743 1 480 . 1 1 50 50 ILE HG21 H 1 0.309 0.011 . 1 . . . . 1466 ILE MG . 25743 1 481 . 1 1 50 50 ILE HG22 H 1 0.309 0.011 . 1 . . . . 1466 ILE MG . 25743 1 482 . 1 1 50 50 ILE HG23 H 1 0.309 0.011 . 1 . . . . 1466 ILE MG . 25743 1 483 . 1 1 50 50 ILE HD11 H 1 0.309 0.011 . 1 . . . . 1466 ILE MD . 25743 1 484 . 1 1 50 50 ILE HD12 H 1 0.309 0.011 . 1 . . . . 1466 ILE MD . 25743 1 485 . 1 1 50 50 ILE HD13 H 1 0.309 0.011 . 1 . . . . 1466 ILE MD . 25743 1 486 . 1 1 50 50 ILE CA C 13 57.287 0.092 . 1 . . . . 1466 ILE CA . 25743 1 487 . 1 1 50 50 ILE CB C 13 33.588 0.100 . 1 . . . . 1466 ILE CB . 25743 1 488 . 1 1 50 50 ILE CG2 C 13 16.525 0.000 . 1 . . . . 1466 ILE CG2 . 25743 1 489 . 1 1 50 50 ILE N N 15 120.561 0.050 . 1 . . . . 1466 ILE N . 25743 1 490 . 1 1 51 51 LYS H H 1 7.947 0.006 . 1 . . . . 1467 LYS H . 25743 1 491 . 1 1 51 51 LYS HA H 1 4.078 0.012 . 1 . . . . 1467 LYS HA . 25743 1 492 . 1 1 51 51 LYS CA C 13 57.431 0.000 . 1 . . . . 1467 LYS CA . 25743 1 493 . 1 1 51 51 LYS CB C 13 32.504 0.143 . 1 . . . . 1467 LYS CB . 25743 1 494 . 1 1 51 51 LYS CG C 13 24.966 0.000 . 1 . . . . 1467 LYS CG . 25743 1 495 . 1 1 51 51 LYS CD C 13 28.350 0.000 . 1 . . . . 1467 LYS CD . 25743 1 496 . 1 1 51 51 LYS CE C 13 42.096 0.000 . 1 . . . . 1467 LYS CE . 25743 1 497 . 1 1 51 51 LYS N N 15 125.474 0.047 . 1 . . . . 1467 LYS N . 25743 1 498 . 1 1 52 52 LYS H H 1 8.405 0.006 . 1 . . . . 1468 LYS H . 25743 1 499 . 1 1 52 52 LYS N N 15 119.599 0.047 . 1 . . . . 1468 LYS N . 25743 1 500 . 1 1 54 54 ILE HA H 1 4.236 0.010 . 1 . . . . 1470 ILE HA . 25743 1 501 . 1 1 54 54 ILE HB H 1 1.725 0.003 . 1 . . . . 1470 ILE HB . 25743 1 502 . 1 1 54 54 ILE HG12 H 1 0.989 0.000 . 2 . . . . 1470 ILE HG12 . 25743 1 503 . 1 1 54 54 ILE HG13 H 1 0.989 0.000 . 2 . . . . 1470 ILE HG13 . 25743 1 504 . 1 1 54 54 ILE HG21 H 1 0.953 0.001 . 1 . . . . 1470 ILE MG . 25743 1 505 . 1 1 54 54 ILE HG22 H 1 0.953 0.001 . 1 . . . . 1470 ILE MG . 25743 1 506 . 1 1 54 54 ILE HG23 H 1 0.953 0.001 . 1 . . . . 1470 ILE MG . 25743 1 507 . 1 1 54 54 ILE HD11 H 1 0.586 0.004 . 1 . . . . 1470 ILE MD . 25743 1 508 . 1 1 54 54 ILE HD12 H 1 0.586 0.004 . 1 . . . . 1470 ILE MD . 25743 1 509 . 1 1 54 54 ILE HD13 H 1 0.586 0.004 . 1 . . . . 1470 ILE MD . 25743 1 510 . 1 1 54 54 ILE CA C 13 62.911 0.267 . 1 . . . . 1470 ILE CA . 25743 1 511 . 1 1 54 54 ILE CB C 13 40.964 0.255 . 1 . . . . 1470 ILE CB . 25743 1 512 . 1 1 54 54 ILE CG1 C 13 30.858 0.000 . 1 . . . . 1470 ILE CG1 . 25743 1 513 . 1 1 54 54 ILE CD1 C 13 15.044 0.000 . 1 . . . . 1470 ILE CD1 . 25743 1 514 . 1 1 55 55 ALA H H 1 6.621 0.007 . 1 . . . . 1471 ALA H . 25743 1 515 . 1 1 55 55 ALA HA H 1 4.491 0.002 . 1 . . . . 1471 ALA HA . 25743 1 516 . 1 1 55 55 ALA HB1 H 1 1.322 0.008 . 1 . . . . 1471 ALA MB . 25743 1 517 . 1 1 55 55 ALA HB2 H 1 1.322 0.008 . 1 . . . . 1471 ALA MB . 25743 1 518 . 1 1 55 55 ALA HB3 H 1 1.322 0.008 . 1 . . . . 1471 ALA MB . 25743 1 519 . 1 1 55 55 ALA CA C 13 51.456 0.009 . 1 . . . . 1471 ALA CA . 25743 1 520 . 1 1 55 55 ALA CB C 13 21.330 0.058 . 1 . . . . 1471 ALA CB . 25743 1 521 . 1 1 55 55 ALA N N 15 124.197 0.056 . 1 . . . . 1471 ALA N . 25743 1 522 . 1 1 56 56 LEU H H 1 9.267 0.005 . 1 . . . . 1472 LEU H . 25743 1 523 . 1 1 56 56 LEU HA H 1 3.950 0.000 . 1 . . . . 1472 LEU HA . 25743 1 524 . 1 1 56 56 LEU HB2 H 1 1.269 0.000 . 2 . . . . 1472 LEU HB2 . 25743 1 525 . 1 1 56 56 LEU HB3 H 1 1.269 0.000 . 2 . . . . 1472 LEU HB3 . 25743 1 526 . 1 1 56 56 LEU HD11 H 1 0.747 0.000 . 2 . . . . 1472 LEU MD1 . 25743 1 527 . 1 1 56 56 LEU HD12 H 1 0.747 0.000 . 2 . . . . 1472 LEU MD1 . 25743 1 528 . 1 1 56 56 LEU HD13 H 1 0.747 0.000 . 2 . . . . 1472 LEU MD1 . 25743 1 529 . 1 1 56 56 LEU HD21 H 1 0.711 0.000 . 2 . . . . 1472 LEU MD2 . 25743 1 530 . 1 1 56 56 LEU HD22 H 1 0.711 0.000 . 2 . . . . 1472 LEU MD2 . 25743 1 531 . 1 1 56 56 LEU HD23 H 1 0.711 0.000 . 2 . . . . 1472 LEU MD2 . 25743 1 532 . 1 1 56 56 LEU CA C 13 58.557 0.000 . 1 . . . . 1472 LEU CA . 25743 1 533 . 1 1 56 56 LEU CB C 13 42.296 0.159 . 1 . . . . 1472 LEU CB . 25743 1 534 . 1 1 56 56 LEU CG C 13 30.020 0.000 . 1 . . . . 1472 LEU CG . 25743 1 535 . 1 1 56 56 LEU CD1 C 13 26.726 0.000 . 2 . . . . 1472 LEU CD1 . 25743 1 536 . 1 1 56 56 LEU CD2 C 13 23.145 0.000 . 2 . . . . 1472 LEU CD2 . 25743 1 537 . 1 1 56 56 LEU N N 15 118.611 0.035 . 1 . . . . 1472 LEU N . 25743 1 538 . 1 1 57 57 ASN H H 1 8.382 0.007 . 1 . . . . 1473 ASN H . 25743 1 539 . 1 1 57 57 ASN HA H 1 4.329 0.007 . 1 . . . . 1473 ASN HA . 25743 1 540 . 1 1 57 57 ASN HB2 H 1 3.128 0.018 . 2 . . . . 1473 ASN HB2 . 25743 1 541 . 1 1 57 57 ASN HB3 H 1 2.914 0.012 . 2 . . . . 1473 ASN HB3 . 25743 1 542 . 1 1 57 57 ASN CA C 13 56.977 0.051 . 1 . . . . 1473 ASN CA . 25743 1 543 . 1 1 57 57 ASN CB C 13 34.946 0.031 . 1 . . . . 1473 ASN CB . 25743 1 544 . 1 1 57 57 ASN N N 15 117.106 0.099 . 1 . . . . 1473 ASN N . 25743 1 545 . 1 1 58 58 ILE H H 1 7.230 0.007 . 1 . . . . 1474 ILE H . 25743 1 546 . 1 1 58 58 ILE HA H 1 3.776 0.006 . 1 . . . . 1474 ILE HA . 25743 1 547 . 1 1 58 58 ILE HB H 1 1.804 0.005 . 1 . . . . 1474 ILE HB . 25743 1 548 . 1 1 58 58 ILE HG12 H 1 0.957 0.000 . 2 . . . . 1474 ILE HG12 . 25743 1 549 . 1 1 58 58 ILE HG13 H 1 0.957 0.000 . 2 . . . . 1474 ILE HG13 . 25743 1 550 . 1 1 58 58 ILE HG21 H 1 0.437 0.017 . 1 . . . . 1474 ILE MG . 25743 1 551 . 1 1 58 58 ILE HG22 H 1 0.437 0.017 . 1 . . . . 1474 ILE MG . 25743 1 552 . 1 1 58 58 ILE HG23 H 1 0.437 0.017 . 1 . . . . 1474 ILE MG . 25743 1 553 . 1 1 58 58 ILE HD11 H 1 0.437 0.017 . 1 . . . . 1474 ILE MD . 25743 1 554 . 1 1 58 58 ILE HD12 H 1 0.437 0.017 . 1 . . . . 1474 ILE MD . 25743 1 555 . 1 1 58 58 ILE HD13 H 1 0.437 0.017 . 1 . . . . 1474 ILE MD . 25743 1 556 . 1 1 58 58 ILE CA C 13 63.836 0.094 . 1 . . . . 1474 ILE CA . 25743 1 557 . 1 1 58 58 ILE CB C 13 39.522 0.000 . 1 . . . . 1474 ILE CB . 25743 1 558 . 1 1 58 58 ILE N N 15 124.865 0.064 . 1 . . . . 1474 ILE N . 25743 1 559 . 1 1 59 59 ILE H H 1 7.582 0.011 . 1 . . . . 1475 ILE H . 25743 1 560 . 1 1 59 59 ILE HA H 1 3.902 0.009 . 1 . . . . 1475 ILE HA . 25743 1 561 . 1 1 59 59 ILE HB H 1 1.630 0.009 . 1 . . . . 1475 ILE HB . 25743 1 562 . 1 1 59 59 ILE CA C 13 65.514 0.079 . 1 . . . . 1475 ILE CA . 25743 1 563 . 1 1 59 59 ILE CB C 13 39.080 0.000 . 1 . . . . 1475 ILE CB . 25743 1 564 . 1 1 59 59 ILE CD1 C 13 17.113 0.000 . 1 . . . . 1475 ILE CD1 . 25743 1 565 . 1 1 59 59 ILE N N 15 120.988 0.069 . 1 . . . . 1475 ILE N . 25743 1 566 . 1 1 60 60 ARG H H 1 8.830 0.009 . 1 . . . . 1476 ARG H . 25743 1 567 . 1 1 60 60 ARG HA H 1 3.918 0.001 . 1 . . . . 1476 ARG HA . 25743 1 568 . 1 1 60 60 ARG HB2 H 1 2.068 0.000 . 2 . . . . 1476 ARG HB2 . 25743 1 569 . 1 1 60 60 ARG HB3 H 1 1.879 0.000 . 2 . . . . 1476 ARG HB3 . 25743 1 570 . 1 1 60 60 ARG HG2 H 1 1.768 0.013 . 2 . . . . 1476 ARG HG2 . 25743 1 571 . 1 1 60 60 ARG HG3 H 1 1.768 0.013 . 2 . . . . 1476 ARG HG3 . 25743 1 572 . 1 1 60 60 ARG HD2 H 1 3.178 0.010 . 2 . . . . 1476 ARG HD2 . 25743 1 573 . 1 1 60 60 ARG HD3 H 1 3.178 0.010 . 2 . . . . 1476 ARG HD3 . 25743 1 574 . 1 1 60 60 ARG CA C 13 60.226 0.022 . 1 . . . . 1476 ARG CA . 25743 1 575 . 1 1 60 60 ARG CB C 13 30.304 0.112 . 1 . . . . 1476 ARG CB . 25743 1 576 . 1 1 60 60 ARG CG C 13 27.074 0.000 . 1 . . . . 1476 ARG CG . 25743 1 577 . 1 1 60 60 ARG CD C 13 43.835 0.000 . 1 . . . . 1476 ARG CD . 25743 1 578 . 1 1 60 60 ARG N N 15 119.265 0.038 . 1 . . . . 1476 ARG N . 25743 1 579 . 1 1 61 61 GLU H H 1 7.621 0.005 . 1 . . . . 1477 GLU H . 25743 1 580 . 1 1 61 61 GLU HB2 H 1 2.114 0.009 . 2 . . . . 1477 GLU HB2 . 25743 1 581 . 1 1 61 61 GLU HB3 H 1 2.114 0.009 . 2 . . . . 1477 GLU HB3 . 25743 1 582 . 1 1 61 61 GLU HG2 H 1 2.336 0.009 . 2 . . . . 1477 GLU HG2 . 25743 1 583 . 1 1 61 61 GLU HG3 H 1 2.336 0.009 . 2 . . . . 1477 GLU HG3 . 25743 1 584 . 1 1 61 61 GLU CA C 13 59.500 0.078 . 1 . . . . 1477 GLU CA . 25743 1 585 . 1 1 61 61 GLU CB C 13 29.248 0.055 . 1 . . . . 1477 GLU CB . 25743 1 586 . 1 1 61 61 GLU CG C 13 36.081 0.000 . 1 . . . . 1477 GLU CG . 25743 1 587 . 1 1 61 61 GLU N N 15 119.006 0.045 . 1 . . . . 1477 GLU N . 25743 1 588 . 1 1 62 62 LYS H H 1 8.101 0.005 . 1 . . . . 1478 LYS H . 25743 1 589 . 1 1 62 62 LYS HA H 1 3.770 0.002 . 1 . . . . 1478 LYS HA . 25743 1 590 . 1 1 62 62 LYS HB2 H 1 2.127 0.000 . 2 . . . . 1478 LYS HB2 . 25743 1 591 . 1 1 62 62 LYS HB3 H 1 2.127 0.000 . 2 . . . . 1478 LYS HB3 . 25743 1 592 . 1 1 62 62 LYS HG2 H 1 1.316 0.000 . 2 . . . . 1478 LYS HG2 . 25743 1 593 . 1 1 62 62 LYS HG3 H 1 1.316 0.000 . 2 . . . . 1478 LYS HG3 . 25743 1 594 . 1 1 62 62 LYS HD2 H 1 1.692 0.000 . 2 . . . . 1478 LYS HD2 . 25743 1 595 . 1 1 62 62 LYS HD3 H 1 1.692 0.000 . 2 . . . . 1478 LYS HD3 . 25743 1 596 . 1 1 62 62 LYS HE2 H 1 2.921 0.000 . 2 . . . . 1478 LYS HE2 . 25743 1 597 . 1 1 62 62 LYS HE3 H 1 2.921 0.000 . 2 . . . . 1478 LYS HE3 . 25743 1 598 . 1 1 62 62 LYS CA C 13 60.852 0.000 . 1 . . . . 1478 LYS CA . 25743 1 599 . 1 1 62 62 LYS CB C 13 32.054 0.071 . 1 . . . . 1478 LYS CB . 25743 1 600 . 1 1 62 62 LYS N N 15 120.028 0.041 . 1 . . . . 1478 LYS N . 25743 1 601 . 1 1 63 63 VAL H H 1 8.546 0.007 . 1 . . . . 1479 VAL H . 25743 1 602 . 1 1 63 63 VAL HA H 1 4.007 0.003 . 1 . . . . 1479 VAL HA . 25743 1 603 . 1 1 63 63 VAL HB H 1 2.546 0.014 . 1 . . . . 1479 VAL HB . 25743 1 604 . 1 1 63 63 VAL HG11 H 1 1.338 0.006 . 2 . . . . 1479 VAL MG1 . 25743 1 605 . 1 1 63 63 VAL HG12 H 1 1.338 0.006 . 2 . . . . 1479 VAL MG1 . 25743 1 606 . 1 1 63 63 VAL HG13 H 1 1.338 0.006 . 2 . . . . 1479 VAL MG1 . 25743 1 607 . 1 1 63 63 VAL HG21 H 1 1.031 0.008 . 2 . . . . 1479 VAL MG2 . 25743 1 608 . 1 1 63 63 VAL HG22 H 1 1.031 0.008 . 2 . . . . 1479 VAL MG2 . 25743 1 609 . 1 1 63 63 VAL HG23 H 1 1.031 0.008 . 2 . . . . 1479 VAL MG2 . 25743 1 610 . 1 1 63 63 VAL CA C 13 66.721 0.018 . 1 . . . . 1479 VAL CA . 25743 1 611 . 1 1 63 63 VAL CG1 C 13 24.668 0.000 . 2 . . . . 1479 VAL CG1 . 25743 1 612 . 1 1 63 63 VAL CG2 C 13 22.763 0.000 . 2 . . . . 1479 VAL CG2 . 25743 1 613 . 1 1 63 63 VAL N N 15 119.350 0.055 . 1 . . . . 1479 VAL N . 25743 1 614 . 1 1 64 64 ASN H H 1 8.605 0.006 . 1 . . . . 1480 ASN H . 25743 1 615 . 1 1 64 64 ASN HA H 1 4.487 0.005 . 1 . . . . 1480 ASN HA . 25743 1 616 . 1 1 64 64 ASN HB2 H 1 2.948 0.010 . 2 . . . . 1480 ASN HB2 . 25743 1 617 . 1 1 64 64 ASN HB3 H 1 2.948 0.010 . 2 . . . . 1480 ASN HB3 . 25743 1 618 . 1 1 64 64 ASN CA C 13 56.349 0.028 . 1 . . . . 1480 ASN CA . 25743 1 619 . 1 1 64 64 ASN CB C 13 38.472 0.085 . 1 . . . . 1480 ASN CB . 25743 1 620 . 1 1 64 64 ASN N N 15 121.152 0.074 . 1 . . . . 1480 ASN N . 25743 1 621 . 1 1 65 65 LYS H H 1 8.122 0.007 . 1 . . . . 1481 LYS H . 25743 1 622 . 1 1 65 65 LYS HA H 1 3.981 0.000 . 1 . . . . 1481 LYS HA . 25743 1 623 . 1 1 65 65 LYS HB2 H 1 2.065 0.007 . 2 . . . . 1481 LYS HB2 . 25743 1 624 . 1 1 65 65 LYS HB3 H 1 2.065 0.007 . 2 . . . . 1481 LYS HB3 . 25743 1 625 . 1 1 65 65 LYS HG2 H 1 1.659 0.000 . 2 . . . . 1481 LYS HG2 . 25743 1 626 . 1 1 65 65 LYS HG3 H 1 1.659 0.000 . 2 . . . . 1481 LYS HG3 . 25743 1 627 . 1 1 65 65 LYS HE2 H 1 2.936 0.000 . 2 . . . . 1481 LYS HE2 . 25743 1 628 . 1 1 65 65 LYS HE3 H 1 2.936 0.000 . 2 . . . . 1481 LYS HE3 . 25743 1 629 . 1 1 65 65 LYS CA C 13 56.217 0.013 . 1 . . . . 1481 LYS CA . 25743 1 630 . 1 1 65 65 LYS CB C 13 32.752 0.122 . 1 . . . . 1481 LYS CB . 25743 1 631 . 1 1 65 65 LYS CG C 13 25.523 0.000 . 1 . . . . 1481 LYS CG . 25743 1 632 . 1 1 65 65 LYS CD C 13 29.130 0.000 . 1 . . . . 1481 LYS CD . 25743 1 633 . 1 1 65 65 LYS CE C 13 41.888 0.000 . 1 . . . . 1481 LYS CE . 25743 1 634 . 1 1 65 65 LYS N N 15 117.015 0.044 . 1 . . . . 1481 LYS N . 25743 1 635 . 1 1 66 66 CYS H H 1 8.245 0.008 . 1 . . . . 1482 CYS H . 25743 1 636 . 1 1 66 66 CYS HA H 1 4.293 0.011 . 1 . . . . 1482 CYS HA . 25743 1 637 . 1 1 66 66 CYS HB2 H 1 3.128 0.013 . 2 . . . . 1482 CYS HB2 . 25743 1 638 . 1 1 66 66 CYS HB3 H 1 3.128 0.013 . 2 . . . . 1482 CYS HB3 . 25743 1 639 . 1 1 66 66 CYS CA C 13 60.139 0.067 . 1 . . . . 1482 CYS CA . 25743 1 640 . 1 1 66 66 CYS CB C 13 24.948 0.074 . 1 . . . . 1482 CYS CB . 25743 1 641 . 1 1 66 66 CYS N N 15 116.128 0.050 . 1 . . . . 1482 CYS N . 25743 1 642 . 1 1 67 67 GLU H H 1 8.368 0.007 . 1 . . . . 1483 GLU H . 25743 1 643 . 1 1 67 67 GLU HA H 1 3.989 0.005 . 1 . . . . 1483 GLU HA . 25743 1 644 . 1 1 67 67 GLU HB2 H 1 1.306 0.009 . 2 . . . . 1483 GLU HB2 . 25743 1 645 . 1 1 67 67 GLU HB3 H 1 1.306 0.009 . 2 . . . . 1483 GLU HB3 . 25743 1 646 . 1 1 67 67 GLU HG2 H 1 1.987 0.000 . 2 . . . . 1483 GLU HG2 . 25743 1 647 . 1 1 67 67 GLU HG3 H 1 1.987 0.000 . 2 . . . . 1483 GLU HG3 . 25743 1 648 . 1 1 67 67 GLU CA C 13 57.839 0.066 . 1 . . . . 1483 GLU CA . 25743 1 649 . 1 1 67 67 GLU CB C 13 30.237 0.023 . 1 . . . . 1483 GLU CB . 25743 1 650 . 1 1 67 67 GLU CG C 13 37.356 0.000 . 1 . . . . 1483 GLU CG . 25743 1 651 . 1 1 67 67 GLU N N 15 114.991 0.045 . 1 . . . . 1483 GLU N . 25743 1 652 . 1 1 68 68 TYR H H 1 7.427 0.006 . 1 . . . . 1484 TYR H . 25743 1 653 . 1 1 68 68 TYR HA H 1 4.719 0.004 . 1 . . . . 1484 TYR HA . 25743 1 654 . 1 1 68 68 TYR HB2 H 1 2.793 0.013 . 2 . . . . 1484 TYR HB2 . 25743 1 655 . 1 1 68 68 TYR HB3 H 1 2.793 0.013 . 2 . . . . 1484 TYR HB3 . 25743 1 656 . 1 1 68 68 TYR CA C 13 57.745 0.087 . 1 . . . . 1484 TYR CA . 25743 1 657 . 1 1 68 68 TYR CB C 13 38.263 0.083 . 1 . . . . 1484 TYR CB . 25743 1 658 . 1 1 68 68 TYR N N 15 116.560 0.026 . 1 . . . . 1484 TYR N . 25743 1 659 . 1 1 69 69 LYS H H 1 9.314 0.006 . 1 . . . . 1485 LYS H . 25743 1 660 . 1 1 69 69 LYS HA H 1 4.384 0.006 . 1 . . . . 1485 LYS HA . 25743 1 661 . 1 1 69 69 LYS HB2 H 1 1.973 0.009 . 2 . . . . 1485 LYS HB2 . 25743 1 662 . 1 1 69 69 LYS HB3 H 1 1.973 0.009 . 2 . . . . 1485 LYS HB3 . 25743 1 663 . 1 1 69 69 LYS HG2 H 1 1.560 0.013 . 2 . . . . 1485 LYS HG2 . 25743 1 664 . 1 1 69 69 LYS HG3 H 1 1.560 0.013 . 2 . . . . 1485 LYS HG3 . 25743 1 665 . 1 1 69 69 LYS HD2 H 1 1.668 0.009 . 2 . . . . 1485 LYS HD2 . 25743 1 666 . 1 1 69 69 LYS HD3 H 1 1.668 0.009 . 2 . . . . 1485 LYS HD3 . 25743 1 667 . 1 1 69 69 LYS HE2 H 1 3.045 0.006 . 2 . . . . 1485 LYS HE2 . 25743 1 668 . 1 1 69 69 LYS HE3 H 1 3.045 0.006 . 2 . . . . 1485 LYS HE3 . 25743 1 669 . 1 1 69 69 LYS CA C 13 57.070 0.087 . 1 . . . . 1485 LYS CA . 25743 1 670 . 1 1 69 69 LYS CB C 13 32.980 0.058 . 1 . . . . 1485 LYS CB . 25743 1 671 . 1 1 69 69 LYS CG C 13 25.268 0.000 . 1 . . . . 1485 LYS CG . 25743 1 672 . 1 1 69 69 LYS CD C 13 28.631 0.000 . 1 . . . . 1485 LYS CD . 25743 1 673 . 1 1 69 69 LYS CE C 13 42.428 0.000 . 1 . . . . 1485 LYS CE . 25743 1 674 . 1 1 69 69 LYS N N 15 124.764 0.056 . 1 . . . . 1485 LYS N . 25743 1 675 . 1 1 70 70 LEU H H 1 7.776 0.007 . 1 . . . . 1486 LEU H . 25743 1 676 . 1 1 70 70 LEU HA H 1 4.834 0.008 . 1 . . . . 1486 LEU HA . 25743 1 677 . 1 1 70 70 LEU HB2 H 1 1.619 0.014 . 2 . . . . 1486 LEU HB2 . 25743 1 678 . 1 1 70 70 LEU HB3 H 1 1.619 0.014 . 2 . . . . 1486 LEU HB3 . 25743 1 679 . 1 1 70 70 LEU HD11 H 1 0.984 0.010 . 2 . . . . 1486 LEU MD1 . 25743 1 680 . 1 1 70 70 LEU HD12 H 1 0.984 0.010 . 2 . . . . 1486 LEU MD1 . 25743 1 681 . 1 1 70 70 LEU HD13 H 1 0.984 0.010 . 2 . . . . 1486 LEU MD1 . 25743 1 682 . 1 1 70 70 LEU HD21 H 1 0.961 0.000 . 2 . . . . 1486 LEU MD2 . 25743 1 683 . 1 1 70 70 LEU HD22 H 1 0.961 0.000 . 2 . . . . 1486 LEU MD2 . 25743 1 684 . 1 1 70 70 LEU HD23 H 1 0.961 0.000 . 2 . . . . 1486 LEU MD2 . 25743 1 685 . 1 1 70 70 LEU CA C 13 53.028 0.051 . 1 . . . . 1486 LEU CA . 25743 1 686 . 1 1 70 70 LEU CB C 13 46.567 0.003 . 1 . . . . 1486 LEU CB . 25743 1 687 . 1 1 70 70 LEU CG C 13 25.751 0.000 . 1 . . . . 1486 LEU CG . 25743 1 688 . 1 1 70 70 LEU CD1 C 13 23.116 0.000 . 2 . . . . 1486 LEU CD1 . 25743 1 689 . 1 1 70 70 LEU CD2 C 13 23.116 0.000 . 2 . . . . 1486 LEU CD2 . 25743 1 690 . 1 1 70 70 LEU N N 15 117.925 0.007 . 1 . . . . 1486 LEU N . 25743 1 691 . 1 1 71 71 ALA H H 1 9.295 0.012 . 1 . . . . 1487 ALA H . 25743 1 692 . 1 1 71 71 ALA HA H 1 4.189 0.000 . 1 . . . . 1487 ALA HA . 25743 1 693 . 1 1 71 71 ALA HB1 H 1 1.653 0.002 . 1 . . . . 1487 ALA MB . 25743 1 694 . 1 1 71 71 ALA HB2 H 1 1.653 0.002 . 1 . . . . 1487 ALA MB . 25743 1 695 . 1 1 71 71 ALA HB3 H 1 1.653 0.002 . 1 . . . . 1487 ALA MB . 25743 1 696 . 1 1 71 71 ALA CB C 13 18.411 0.079 . 1 . . . . 1487 ALA CB . 25743 1 697 . 1 1 71 71 ALA N N 15 125.428 0.074 . 1 . . . . 1487 ALA N . 25743 1 698 . 1 1 72 72 SER H H 1 8.498 0.005 . 1 . . . . 1488 SER H . 25743 1 699 . 1 1 72 72 SER HA H 1 4.796 0.009 . 1 . . . . 1488 SER HA . 25743 1 700 . 1 1 72 72 SER HB2 H 1 3.970 0.006 . 2 . . . . 1488 SER HB2 . 25743 1 701 . 1 1 72 72 SER HB3 H 1 3.976 0.006 . 2 . . . . 1488 SER HB3 . 25743 1 702 . 1 1 72 72 SER CA C 13 61.183 0.162 . 1 . . . . 1488 SER CA . 25743 1 703 . 1 1 72 72 SER CB C 13 61.584 0.000 . 1 . . . . 1488 SER CB . 25743 1 704 . 1 1 72 72 SER N N 15 110.850 0.034 . 1 . . . . 1488 SER N . 25743 1 705 . 1 1 73 73 GLU H H 1 7.136 0.011 . 1 . . . . 1489 GLU H . 25743 1 706 . 1 1 73 73 GLU HA H 1 4.169 0.011 . 1 . . . . 1489 GLU HA . 25743 1 707 . 1 1 73 73 GLU HB2 H 1 2.359 0.029 . 2 . . . . 1489 GLU HB2 . 25743 1 708 . 1 1 73 73 GLU HB3 H 1 2.359 0.029 . 2 . . . . 1489 GLU HB3 . 25743 1 709 . 1 1 73 73 GLU CA C 13 58.536 0.014 . 1 . . . . 1489 GLU CA . 25743 1 710 . 1 1 73 73 GLU CB C 13 31.546 0.000 . 1 . . . . 1489 GLU CB . 25743 1 711 . 1 1 73 73 GLU CG C 13 37.008 0.000 . 1 . . . . 1489 GLU CG . 25743 1 712 . 1 1 73 73 GLU N N 15 120.869 0.116 . 1 . . . . 1489 GLU N . 25743 1 713 . 1 1 74 74 PHE H H 1 6.621 0.007 . 1 . . . . 1490 PHE H . 25743 1 714 . 1 1 74 74 PHE CA C 13 59.502 0.000 . 1 . . . . 1490 PHE CA . 25743 1 715 . 1 1 75 75 ILE HA H 1 3.215 0.009 . 1 . . . . 1491 ILE HA . 25743 1 716 . 1 1 75 75 ILE HB H 1 1.956 0.000 . 1 . . . . 1491 ILE HB . 25743 1 717 . 1 1 75 75 ILE HG12 H 1 1.047 0.016 . 2 . . . . 1491 ILE HG12 . 25743 1 718 . 1 1 75 75 ILE HG13 H 1 1.047 0.016 . 2 . . . . 1491 ILE HG13 . 25743 1 719 . 1 1 75 75 ILE HG21 H 1 0.781 0.018 . 1 . . . . 1491 ILE MG . 25743 1 720 . 1 1 75 75 ILE HG22 H 1 0.781 0.018 . 1 . . . . 1491 ILE MG . 25743 1 721 . 1 1 75 75 ILE HG23 H 1 0.781 0.018 . 1 . . . . 1491 ILE MG . 25743 1 722 . 1 1 75 75 ILE HD11 H 1 0.781 0.018 . 1 . . . . 1491 ILE MD . 25743 1 723 . 1 1 75 75 ILE HD12 H 1 0.781 0.018 . 1 . . . . 1491 ILE MD . 25743 1 724 . 1 1 75 75 ILE HD13 H 1 0.781 0.018 . 1 . . . . 1491 ILE MD . 25743 1 725 . 1 1 75 75 ILE CA C 13 69.663 0.000 . 1 . . . . 1491 ILE CA . 25743 1 726 . 1 1 75 75 ILE CB C 13 36.810 0.000 . 1 . . . . 1491 ILE CB . 25743 1 727 . 1 1 75 75 ILE CG1 C 13 28.350 0.000 . 1 . . . . 1491 ILE CG1 . 25743 1 728 . 1 1 75 75 ILE CG2 C 13 21.398 0.000 . 1 . . . . 1491 ILE CG2 . 25743 1 729 . 1 1 75 75 ILE CD1 C 13 18.733 0.000 . 1 . . . . 1491 ILE CD1 . 25743 1 730 . 1 1 76 76 ASP H H 1 8.376 0.008 . 1 . . . . 1492 ASP H . 25743 1 731 . 1 1 76 76 ASP HA H 1 4.297 0.011 . 1 . . . . 1492 ASP HA . 25743 1 732 . 1 1 76 76 ASP HB2 H 1 2.812 0.013 . 2 . . . . 1492 ASP HB2 . 25743 1 733 . 1 1 76 76 ASP HB3 H 1 2.544 0.015 . 2 . . . . 1492 ASP HB3 . 25743 1 734 . 1 1 76 76 ASP CA C 13 57.540 0.042 . 1 . . . . 1492 ASP CA . 25743 1 735 . 1 1 76 76 ASP CB C 13 39.904 0.054 . 1 . . . . 1492 ASP CB . 25743 1 736 . 1 1 76 76 ASP N N 15 117.725 0.081 . 1 . . . . 1492 ASP N . 25743 1 737 . 1 1 77 77 ASP H H 1 7.202 0.005 . 1 . . . . 1493 ASP H . 25743 1 738 . 1 1 77 77 ASP HA H 1 4.482 0.010 . 1 . . . . 1493 ASP HA . 25743 1 739 . 1 1 77 77 ASP HB2 H 1 2.263 0.005 . 2 . . . . 1493 ASP HB2 . 25743 1 740 . 1 1 77 77 ASP HB3 H 1 2.263 0.005 . 2 . . . . 1493 ASP HB3 . 25743 1 741 . 1 1 77 77 ASP CA C 13 57.239 0.097 . 1 . . . . 1493 ASP CA . 25743 1 742 . 1 1 77 77 ASP CB C 13 39.829 0.077 . 1 . . . . 1493 ASP CB . 25743 1 743 . 1 1 77 77 ASP N N 15 122.030 0.084 . 1 . . . . 1493 ASP N . 25743 1 744 . 1 1 78 78 ILE H H 1 7.176 0.005 . 1 . . . . 1494 ILE H . 25743 1 745 . 1 1 78 78 ILE HA H 1 2.898 0.007 . 1 . . . . 1494 ILE HA . 25743 1 746 . 1 1 78 78 ILE HB H 1 1.216 0.001 . 1 . . . . 1494 ILE HB . 25743 1 747 . 1 1 78 78 ILE HD11 H 1 0.588 0.004 . 1 . . . . 1494 ILE MD . 25743 1 748 . 1 1 78 78 ILE HD12 H 1 0.588 0.004 . 1 . . . . 1494 ILE MD . 25743 1 749 . 1 1 78 78 ILE HD13 H 1 0.588 0.004 . 1 . . . . 1494 ILE MD . 25743 1 750 . 1 1 78 78 ILE CA C 13 63.545 0.050 . 1 . . . . 1494 ILE CA . 25743 1 751 . 1 1 78 78 ILE CB C 13 35.778 0.000 . 1 . . . . 1494 ILE CB . 25743 1 752 . 1 1 78 78 ILE CG1 C 13 27.591 0.000 . 1 . . . . 1494 ILE CG1 . 25743 1 753 . 1 1 78 78 ILE CG2 C 13 17.115 0.000 . 1 . . . . 1494 ILE CG2 . 25743 1 754 . 1 1 78 78 ILE N N 15 120.464 0.068 . 1 . . . . 1494 ILE N . 25743 1 755 . 1 1 79 79 GLU H H 1 8.772 0.006 . 1 . . . . 1495 GLU H . 25743 1 756 . 1 1 79 79 GLU HB2 H 1 1.971 0.000 . 2 . . . . 1495 GLU HB2 . 25743 1 757 . 1 1 79 79 GLU HB3 H 1 1.971 0.000 . 2 . . . . 1495 GLU HB3 . 25743 1 758 . 1 1 79 79 GLU HG2 H 1 2.580 0.000 . 2 . . . . 1495 GLU HG2 . 25743 1 759 . 1 1 79 79 GLU HG3 H 1 2.580 0.000 . 2 . . . . 1495 GLU HG3 . 25743 1 760 . 1 1 79 79 GLU CA C 13 58.832 0.132 . 1 . . . . 1495 GLU CA . 25743 1 761 . 1 1 79 79 GLU CB C 13 28.523 0.155 . 1 . . . . 1495 GLU CB . 25743 1 762 . 1 1 79 79 GLU CG C 13 35.590 0.000 . 1 . . . . 1495 GLU CG . 25743 1 763 . 1 1 79 79 GLU N N 15 116.597 0.038 . 1 . . . . 1495 GLU N . 25743 1 764 . 1 1 80 80 LEU H H 1 8.144 0.007 . 1 . . . . 1496 LEU H . 25743 1 765 . 1 1 80 80 LEU HA H 1 4.113 0.003 . 1 . . . . 1496 LEU HA . 25743 1 766 . 1 1 80 80 LEU HB2 H 1 1.554 0.000 . 2 . . . . 1496 LEU HB2 . 25743 1 767 . 1 1 80 80 LEU HB3 H 1 1.554 0.000 . 2 . . . . 1496 LEU HB3 . 25743 1 768 . 1 1 80 80 LEU HG H 1 0.915 0.000 . 1 . . . . 1496 LEU HG . 25743 1 769 . 1 1 80 80 LEU HD11 H 1 0.567 0.000 . 2 . . . . 1496 LEU MD1 . 25743 1 770 . 1 1 80 80 LEU HD12 H 1 0.567 0.000 . 2 . . . . 1496 LEU MD1 . 25743 1 771 . 1 1 80 80 LEU HD13 H 1 0.567 0.000 . 2 . . . . 1496 LEU MD1 . 25743 1 772 . 1 1 80 80 LEU HD21 H 1 0.567 0.000 . 2 . . . . 1496 LEU MD2 . 25743 1 773 . 1 1 80 80 LEU HD22 H 1 0.567 0.000 . 2 . . . . 1496 LEU MD2 . 25743 1 774 . 1 1 80 80 LEU HD23 H 1 0.567 0.000 . 2 . . . . 1496 LEU MD2 . 25743 1 775 . 1 1 80 80 LEU CA C 13 57.627 0.000 . 1 . . . . 1496 LEU CA . 25743 1 776 . 1 1 80 80 LEU CB C 13 41.614 0.076 . 1 . . . . 1496 LEU CB . 25743 1 777 . 1 1 80 80 LEU CG C 13 25.522 0.000 . 1 . . . . 1496 LEU CG . 25743 1 778 . 1 1 80 80 LEU N N 15 124.151 0.049 . 1 . . . . 1496 LEU N . 25743 1 779 . 1 1 81 81 MET H H 1 7.344 0.008 . 1 . . . . 1497 MET H . 25743 1 780 . 1 1 81 81 MET HA H 1 3.396 0.005 . 1 . . . . 1497 MET HA . 25743 1 781 . 1 1 81 81 MET HB2 H 1 1.406 0.008 . 2 . . . . 1497 MET HB2 . 25743 1 782 . 1 1 81 81 MET HB3 H 1 1.406 0.008 . 2 . . . . 1497 MET HB3 . 25743 1 783 . 1 1 81 81 MET HG2 H 1 2.121 0.005 . 2 . . . . 1497 MET HG2 . 25743 1 784 . 1 1 81 81 MET HG3 H 1 2.121 0.005 . 2 . . . . 1497 MET HG3 . 25743 1 785 . 1 1 81 81 MET CA C 13 59.878 0.141 . 1 . . . . 1497 MET CA . 25743 1 786 . 1 1 81 81 MET CG C 13 31.847 0.000 . 1 . . . . 1497 MET CG . 25743 1 787 . 1 1 81 81 MET N N 15 119.426 0.082 . 1 . . . . 1497 MET N . 25743 1 788 . 1 1 82 82 PHE H H 1 7.443 0.007 . 1 . . . . 1498 PHE H . 25743 1 789 . 1 1 82 82 PHE HA H 1 3.914 0.004 . 1 . . . . 1498 PHE HA . 25743 1 790 . 1 1 82 82 PHE HB2 H 1 2.913 0.013 . 2 . . . . 1498 PHE HB2 . 25743 1 791 . 1 1 82 82 PHE HB3 H 1 2.913 0.013 . 2 . . . . 1498 PHE HB3 . 25743 1 792 . 1 1 82 82 PHE CA C 13 61.868 0.064 . 1 . . . . 1498 PHE CA . 25743 1 793 . 1 1 82 82 PHE CB C 13 37.312 0.038 . 1 . . . . 1498 PHE CB . 25743 1 794 . 1 1 82 82 PHE N N 15 118.138 0.034 . 1 . . . . 1498 PHE N . 25743 1 795 . 1 1 83 83 SER H H 1 9.046 0.018 . 1 . . . . 1499 SER H . 25743 1 796 . 1 1 83 83 SER HA H 1 4.193 0.000 . 1 . . . . 1499 SER HA . 25743 1 797 . 1 1 83 83 SER HB2 H 1 4.031 0.007 . 2 . . . . 1499 SER HB2 . 25743 1 798 . 1 1 83 83 SER HB3 H 1 4.031 0.007 . 2 . . . . 1499 SER HB3 . 25743 1 799 . 1 1 83 83 SER CA C 13 62.146 0.000 . 1 . . . . 1499 SER CA . 25743 1 800 . 1 1 83 83 SER CB C 13 62.605 0.000 . 1 . . . . 1499 SER CB . 25743 1 801 . 1 1 83 83 SER N N 15 116.930 0.035 . 1 . . . . 1499 SER N . 25743 1 802 . 1 1 84 84 ASN H H 1 8.938 0.009 . 1 . . . . 1500 ASN H . 25743 1 803 . 1 1 84 84 ASN HA H 1 4.275 0.000 . 1 . . . . 1500 ASN HA . 25743 1 804 . 1 1 84 84 ASN HB2 H 1 2.970 0.000 . 2 . . . . 1500 ASN HB2 . 25743 1 805 . 1 1 84 84 ASN HB3 H 1 2.527 0.007 . 2 . . . . 1500 ASN HB3 . 25743 1 806 . 1 1 84 84 ASN CA C 13 55.115 0.030 . 1 . . . . 1500 ASN CA . 25743 1 807 . 1 1 84 84 ASN CB C 13 37.480 0.269 . 1 . . . . 1500 ASN CB . 25743 1 808 . 1 1 84 84 ASN N N 15 119.951 0.072 . 1 . . . . 1500 ASN N . 25743 1 809 . 1 1 85 85 CYS H H 1 7.136 0.007 . 1 . . . . 1501 CYS H . 25743 1 810 . 1 1 85 85 CYS HA H 1 4.193 0.007 . 1 . . . . 1501 CYS HA . 25743 1 811 . 1 1 85 85 CYS HB2 H 1 3.112 0.016 . 2 . . . . 1501 CYS HB2 . 25743 1 812 . 1 1 85 85 CYS HB3 H 1 3.112 0.016 . 2 . . . . 1501 CYS HB3 . 25743 1 813 . 1 1 85 85 CYS CA C 13 61.997 0.124 . 1 . . . . 1501 CYS CA . 25743 1 814 . 1 1 85 85 CYS CB C 13 26.185 0.082 . 1 . . . . 1501 CYS CB . 25743 1 815 . 1 1 85 85 CYS N N 15 119.376 0.032 . 1 . . . . 1501 CYS N . 25743 1 816 . 1 1 86 86 PHE H H 1 7.830 0.005 . 1 . . . . 1502 PHE H . 25743 1 817 . 1 1 86 86 PHE HA H 1 4.986 0.005 . 1 . . . . 1502 PHE HA . 25743 1 818 . 1 1 86 86 PHE HB2 H 1 3.461 0.005 . 2 . . . . 1502 PHE HB2 . 25743 1 819 . 1 1 86 86 PHE HB3 H 1 3.461 0.005 . 2 . . . . 1502 PHE HB3 . 25743 1 820 . 1 1 86 86 PHE CA C 13 57.283 0.000 . 1 . . . . 1502 PHE CA . 25743 1 821 . 1 1 86 86 PHE CB C 13 37.557 0.006 . 1 . . . . 1502 PHE CB . 25743 1 822 . 1 1 86 86 PHE N N 15 117.223 0.040 . 1 . . . . 1502 PHE N . 25743 1 823 . 1 1 87 87 GLU H H 1 8.257 0.010 . 1 . . . . 1503 GLU H . 25743 1 824 . 1 1 87 87 GLU HA H 1 4.169 0.008 . 1 . . . . 1503 GLU HA . 25743 1 825 . 1 1 87 87 GLU HB2 H 1 2.138 0.009 . 2 . . . . 1503 GLU HB2 . 25743 1 826 . 1 1 87 87 GLU HB3 H 1 2.040 0.011 . 2 . . . . 1503 GLU HB3 . 25743 1 827 . 1 1 87 87 GLU HG2 H 1 2.991 0.000 . 2 . . . . 1503 GLU HG2 . 25743 1 828 . 1 1 87 87 GLU HG3 H 1 2.991 0.000 . 2 . . . . 1503 GLU HG3 . 25743 1 829 . 1 1 87 87 GLU CA C 13 58.498 0.157 . 1 . . . . 1503 GLU CA . 25743 1 830 . 1 1 87 87 GLU CB C 13 29.875 0.000 . 1 . . . . 1503 GLU CB . 25743 1 831 . 1 1 87 87 GLU CG C 13 36.078 0.000 . 1 . . . . 1503 GLU CG . 25743 1 832 . 1 1 87 87 GLU N N 15 120.075 0.043 . 1 . . . . 1503 GLU N . 25743 1 833 . 1 1 88 88 TYR H H 1 8.039 0.006 . 1 . . . . 1504 TYR H . 25743 1 834 . 1 1 88 88 TYR HA H 1 4.151 0.004 . 1 . . . . 1504 TYR HA . 25743 1 835 . 1 1 88 88 TYR HB2 H 1 2.847 0.007 . 2 . . . . 1504 TYR HB2 . 25743 1 836 . 1 1 88 88 TYR HB3 H 1 2.847 0.007 . 2 . . . . 1504 TYR HB3 . 25743 1 837 . 1 1 88 88 TYR CA C 13 61.630 0.111 . 1 . . . . 1504 TYR CA . 25743 1 838 . 1 1 88 88 TYR CB C 13 40.709 0.066 . 1 . . . . 1504 TYR CB . 25743 1 839 . 1 1 88 88 TYR N N 15 116.652 0.087 . 1 . . . . 1504 TYR N . 25743 1 840 . 1 1 89 89 ASN H H 1 8.332 0.005 . 1 . . . . 1505 ASN H . 25743 1 841 . 1 1 89 89 ASN CA C 13 51.028 0.000 . 1 . . . . 1505 ASN CA . 25743 1 842 . 1 1 89 89 ASN N N 15 115.611 0.071 . 1 . . . . 1505 ASN N . 25743 1 843 . 1 1 90 90 PRO HA H 1 4.441 0.005 . 1 . . . . 1506 PRO HA . 25743 1 844 . 1 1 90 90 PRO HB2 H 1 2.433 0.014 . 2 . . . . 1506 PRO HB2 . 25743 1 845 . 1 1 90 90 PRO HB3 H 1 2.057 0.001 . 2 . . . . 1506 PRO HB3 . 25743 1 846 . 1 1 90 90 PRO HG2 H 1 1.808 0.000 . 2 . . . . 1506 PRO HG2 . 25743 1 847 . 1 1 90 90 PRO HG3 H 1 1.808 0.000 . 2 . . . . 1506 PRO HG3 . 25743 1 848 . 1 1 90 90 PRO HD2 H 1 3.018 0.000 . 2 . . . . 1506 PRO HD2 . 25743 1 849 . 1 1 90 90 PRO HD3 H 1 3.018 0.000 . 2 . . . . 1506 PRO HD3 . 25743 1 850 . 1 1 90 90 PRO CA C 13 62.663 0.119 . 1 . . . . 1506 PRO CA . 25743 1 851 . 1 1 90 90 PRO CG C 13 27.745 0.000 . 1 . . . . 1506 PRO CG . 25743 1 852 . 1 1 91 91 ARG H H 1 8.714 0.007 . 1 . . . . 1507 ARG H . 25743 1 853 . 1 1 91 91 ARG HA H 1 3.896 0.001 . 1 . . . . 1507 ARG HA . 25743 1 854 . 1 1 91 91 ARG HB2 H 1 1.835 0.001 . 2 . . . . 1507 ARG HB2 . 25743 1 855 . 1 1 91 91 ARG HB3 H 1 1.835 0.001 . 2 . . . . 1507 ARG HB3 . 25743 1 856 . 1 1 91 91 ARG HG2 H 1 1.684 0.006 . 2 . . . . 1507 ARG HG2 . 25743 1 857 . 1 1 91 91 ARG HG3 H 1 1.684 0.006 . 2 . . . . 1507 ARG HG3 . 25743 1 858 . 1 1 91 91 ARG HD2 H 1 3.135 0.003 . 2 . . . . 1507 ARG HD2 . 25743 1 859 . 1 1 91 91 ARG HD3 H 1 3.135 0.003 . 2 . . . . 1507 ARG HD3 . 25743 1 860 . 1 1 91 91 ARG CA C 13 58.814 0.056 . 1 . . . . 1507 ARG CA . 25743 1 861 . 1 1 91 91 ARG CB C 13 30.186 0.063 . 1 . . . . 1507 ARG CB . 25743 1 862 . 1 1 91 91 ARG CG C 13 26.878 0.000 . 1 . . . . 1507 ARG CG . 25743 1 863 . 1 1 91 91 ARG CD C 13 43.151 0.000 . 1 . . . . 1507 ARG CD . 25743 1 864 . 1 1 91 91 ARG N N 15 120.669 0.061 . 1 . . . . 1507 ARG N . 25743 1 865 . 1 1 92 92 ASN H H 1 8.455 0.006 . 1 . . . . 1508 ASN H . 25743 1 866 . 1 1 92 92 ASN HA H 1 4.683 0.010 . 1 . . . . 1508 ASN HA . 25743 1 867 . 1 1 92 92 ASN HB2 H 1 2.965 0.007 . 2 . . . . 1508 ASN HB2 . 25743 1 868 . 1 1 92 92 ASN HB3 H 1 2.846 0.009 . 2 . . . . 1508 ASN HB3 . 25743 1 869 . 1 1 92 92 ASN CA C 13 53.555 0.089 . 1 . . . . 1508 ASN CA . 25743 1 870 . 1 1 92 92 ASN CB C 13 37.511 0.101 . 1 . . . . 1508 ASN CB . 25743 1 871 . 1 1 92 92 ASN N N 15 113.863 0.063 . 1 . . . . 1508 ASN N . 25743 1 872 . 1 1 93 93 THR H H 1 7.911 0.005 . 1 . . . . 1509 THR H . 25743 1 873 . 1 1 93 93 THR HA H 1 4.842 0.011 . 1 . . . . 1509 THR HA . 25743 1 874 . 1 1 93 93 THR HB H 1 4.540 0.008 . 1 . . . . 1509 THR HB . 25743 1 875 . 1 1 93 93 THR HG21 H 1 1.486 0.007 . 1 . . . . 1509 THR MG . 25743 1 876 . 1 1 93 93 THR HG22 H 1 1.486 0.007 . 1 . . . . 1509 THR MG . 25743 1 877 . 1 1 93 93 THR HG23 H 1 1.486 0.007 . 1 . . . . 1509 THR MG . 25743 1 878 . 1 1 93 93 THR CA C 13 61.612 0.080 . 1 . . . . 1509 THR CA . 25743 1 879 . 1 1 93 93 THR CB C 13 72.683 0.027 . 1 . . . . 1509 THR CB . 25743 1 880 . 1 1 93 93 THR CG2 C 13 23.553 0.000 . 1 . . . . 1509 THR CG2 . 25743 1 881 . 1 1 93 93 THR N N 15 110.537 0.039 . 1 . . . . 1509 THR N . 25743 1 882 . 1 1 94 94 SER H H 1 9.323 0.008 . 1 . . . . 1510 SER H . 25743 1 883 . 1 1 94 94 SER HA H 1 4.199 0.009 . 1 . . . . 1510 SER HA . 25743 1 884 . 1 1 94 94 SER HB2 H 1 4.234 0.000 . 2 . . . . 1510 SER HB2 . 25743 1 885 . 1 1 94 94 SER HB3 H 1 4.234 0.000 . 2 . . . . 1510 SER HB3 . 25743 1 886 . 1 1 94 94 SER CA C 13 62.396 0.000 . 1 . . . . 1510 SER CA . 25743 1 887 . 1 1 94 94 SER CB C 13 62.620 0.000 . 1 . . . . 1510 SER CB . 25743 1 888 . 1 1 94 94 SER N N 15 118.142 0.028 . 1 . . . . 1510 SER N . 25743 1 889 . 1 1 95 95 GLU H H 1 10.465 0.005 . 1 . . . . 1511 GLU H . 25743 1 890 . 1 1 95 95 GLU HA H 1 3.391 0.012 . 1 . . . . 1511 GLU HA . 25743 1 891 . 1 1 95 95 GLU HB2 H 1 1.377 0.000 . 2 . . . . 1511 GLU HB2 . 25743 1 892 . 1 1 95 95 GLU HB3 H 1 1.377 0.000 . 2 . . . . 1511 GLU HB3 . 25743 1 893 . 1 1 95 95 GLU HG2 H 1 2.062 0.000 . 2 . . . . 1511 GLU HG2 . 25743 1 894 . 1 1 95 95 GLU HG3 H 1 2.062 0.000 . 2 . . . . 1511 GLU HG3 . 25743 1 895 . 1 1 95 95 GLU CA C 13 61.911 0.076 . 1 . . . . 1511 GLU CA . 25743 1 896 . 1 1 95 95 GLU CG C 13 37.779 0.000 . 1 . . . . 1511 GLU CG . 25743 1 897 . 1 1 95 95 GLU N N 15 123.386 0.037 . 1 . . . . 1511 GLU N . 25743 1 898 . 1 1 96 96 ALA H H 1 7.561 0.006 . 1 . . . . 1512 ALA H . 25743 1 899 . 1 1 96 96 ALA HA H 1 4.133 0.008 . 1 . . . . 1512 ALA HA . 25743 1 900 . 1 1 96 96 ALA CA C 13 55.652 0.000 . 1 . . . . 1512 ALA CA . 25743 1 901 . 1 1 96 96 ALA CB C 13 19.233 0.097 . 1 . . . . 1512 ALA CB . 25743 1 902 . 1 1 96 96 ALA N N 15 120.103 0.054 . 1 . . . . 1512 ALA N . 25743 1 903 . 1 1 97 97 LYS H H 1 8.374 0.007 . 1 . . . . 1513 LYS H . 25743 1 904 . 1 1 97 97 LYS HA H 1 3.414 0.000 . 1 . . . . 1513 LYS HA . 25743 1 905 . 1 1 97 97 LYS HE2 H 1 2.922 0.000 . 2 . . . . 1513 LYS HE2 . 25743 1 906 . 1 1 97 97 LYS HE3 H 1 2.922 0.000 . 2 . . . . 1513 LYS HE3 . 25743 1 907 . 1 1 97 97 LYS CA C 13 60.389 0.052 . 1 . . . . 1513 LYS CA . 25743 1 908 . 1 1 97 97 LYS CB C 13 32.852 0.000 . 1 . . . . 1513 LYS CB . 25743 1 909 . 1 1 97 97 LYS CG C 13 19.368 0.000 . 1 . . . . 1513 LYS CG . 25743 1 910 . 1 1 97 97 LYS CD C 13 25.471 0.000 . 1 . . . . 1513 LYS CD . 25743 1 911 . 1 1 97 97 LYS N N 15 119.832 0.057 . 1 . . . . 1513 LYS N . 25743 1 912 . 1 1 98 98 ALA H H 1 8.195 0.006 . 1 . . . . 1514 ALA H . 25743 1 913 . 1 1 98 98 ALA HA H 1 4.117 0.016 . 1 . . . . 1514 ALA HA . 25743 1 914 . 1 1 98 98 ALA HB1 H 1 1.513 0.007 . 1 . . . . 1514 ALA MB . 25743 1 915 . 1 1 98 98 ALA HB2 H 1 1.513 0.007 . 1 . . . . 1514 ALA MB . 25743 1 916 . 1 1 98 98 ALA HB3 H 1 1.513 0.007 . 1 . . . . 1514 ALA MB . 25743 1 917 . 1 1 98 98 ALA CA C 13 55.634 0.052 . 1 . . . . 1514 ALA CA . 25743 1 918 . 1 1 98 98 ALA CB C 13 17.686 0.164 . 1 . . . . 1514 ALA CB . 25743 1 919 . 1 1 98 98 ALA N N 15 122.251 0.085 . 1 . . . . 1514 ALA N . 25743 1 920 . 1 1 99 99 GLY H H 1 8.890 0.011 . 1 . . . . 1515 GLY H . 25743 1 921 . 1 1 99 99 GLY HA2 H 1 4.029 0.010 . 2 . . . . 1515 GLY HA2 . 25743 1 922 . 1 1 99 99 GLY HA3 H 1 4.029 0.010 . 2 . . . . 1515 GLY HA3 . 25743 1 923 . 1 1 99 99 GLY CA C 13 48.382 0.132 . 1 . . . . 1515 GLY CA . 25743 1 924 . 1 1 99 99 GLY N N 15 104.8 0.020 . 1 . . . . 1515 GLY N . 25743 1 925 . 1 1 100 100 THR H H 1 8.793 0.008 . 1 . . . . 1516 THR H . 25743 1 926 . 1 1 100 100 THR HA H 1 4.345 0.008 . 1 . . . . 1516 THR HA . 25743 1 927 . 1 1 100 100 THR HB H 1 3.969 0.005 . 1 . . . . 1516 THR HB . 25743 1 928 . 1 1 100 100 THR HG21 H 1 1.213 0.005 . 1 . . . . 1516 THR MG . 25743 1 929 . 1 1 100 100 THR HG22 H 1 1.213 0.005 . 1 . . . . 1516 THR MG . 25743 1 930 . 1 1 100 100 THR HG23 H 1 1.213 0.005 . 1 . . . . 1516 THR MG . 25743 1 931 . 1 1 100 100 THR CA C 13 67.359 0.034 . 1 . . . . 1516 THR CA . 25743 1 932 . 1 1 100 100 THR CB C 13 68.910 0.000 . 1 . . . . 1516 THR CB . 25743 1 933 . 1 1 100 100 THR CG2 C 13 21.337 0.000 . 1 . . . . 1516 THR CG2 . 25743 1 934 . 1 1 100 100 THR N N 15 118.260 0.066 . 1 . . . . 1516 THR N . 25743 1 935 . 1 1 101 101 ARG H H 1 7.517 0.006 . 1 . . . . 1517 ARG H . 25743 1 936 . 1 1 101 101 ARG HA H 1 4.165 0.013 . 1 . . . . 1517 ARG HA . 25743 1 937 . 1 1 101 101 ARG HB2 H 1 1.780 0.008 . 2 . . . . 1517 ARG HB2 . 25743 1 938 . 1 1 101 101 ARG HB3 H 1 1.780 0.008 . 2 . . . . 1517 ARG HB3 . 25743 1 939 . 1 1 101 101 ARG HG2 H 1 1.519 0.000 . 2 . . . . 1517 ARG HG2 . 25743 1 940 . 1 1 101 101 ARG HG3 H 1 1.519 0.000 . 2 . . . . 1517 ARG HG3 . 25743 1 941 . 1 1 101 101 ARG HD2 H 1 2.283 0.000 . 2 . . . . 1517 ARG HD2 . 25743 1 942 . 1 1 101 101 ARG HD3 H 1 2.283 0.000 . 2 . . . . 1517 ARG HD3 . 25743 1 943 . 1 1 101 101 ARG CA C 13 60.226 0.002 . 1 . . . . 1517 ARG CA . 25743 1 944 . 1 1 101 101 ARG CB C 13 32.004 0.000 . 1 . . . . 1517 ARG CB . 25743 1 945 . 1 1 101 101 ARG N N 15 121.690 0.041 . 1 . . . . 1517 ARG N . 25743 1 946 . 1 1 102 102 LEU H H 1 9.194 0.005 . 1 . . . . 1518 LEU H . 25743 1 947 . 1 1 102 102 LEU HA H 1 3.742 0.001 . 1 . . . . 1518 LEU HA . 25743 1 948 . 1 1 102 102 LEU HB2 H 1 1.514 0.000 . 2 . . . . 1518 LEU HB2 . 25743 1 949 . 1 1 102 102 LEU HB3 H 1 1.514 0.000 . 2 . . . . 1518 LEU HB3 . 25743 1 950 . 1 1 102 102 LEU HG H 1 0.954 0.002 . 1 . . . . 1518 LEU HG . 25743 1 951 . 1 1 102 102 LEU HD11 H 1 0.675 0.021 . 2 . . . . 1518 LEU MD1 . 25743 1 952 . 1 1 102 102 LEU HD12 H 1 0.675 0.021 . 2 . . . . 1518 LEU MD1 . 25743 1 953 . 1 1 102 102 LEU HD13 H 1 0.675 0.021 . 2 . . . . 1518 LEU MD1 . 25743 1 954 . 1 1 102 102 LEU HD21 H 1 0.514 0.009 . 2 . . . . 1518 LEU MD2 . 25743 1 955 . 1 1 102 102 LEU HD22 H 1 0.514 0.009 . 2 . . . . 1518 LEU MD2 . 25743 1 956 . 1 1 102 102 LEU HD23 H 1 0.514 0.009 . 2 . . . . 1518 LEU MD2 . 25743 1 957 . 1 1 102 102 LEU CA C 13 57.184 0.000 . 1 . . . . 1518 LEU CA . 25743 1 958 . 1 1 102 102 LEU N N 15 123.264 0.042 . 1 . . . . 1518 LEU N . 25743 1 959 . 1 1 103 103 GLN H H 1 8.394 0.004 . 1 . . . . 1519 GLN H . 25743 1 960 . 1 1 103 103 GLN HA H 1 2.993 0.011 . 1 . . . . 1519 GLN HA . 25743 1 961 . 1 1 103 103 GLN HG2 H 1 1.624 0.000 . 2 . . . . 1519 GLN HG2 . 25743 1 962 . 1 1 103 103 GLN HG3 H 1 1.464 0.000 . 2 . . . . 1519 GLN HG3 . 25743 1 963 . 1 1 103 103 GLN CA C 13 59.305 0.067 . 1 . . . . 1519 GLN CA . 25743 1 964 . 1 1 103 103 GLN CB C 13 27.714 0.000 . 1 . . . . 1519 GLN CB . 25743 1 965 . 1 1 103 103 GLN CG C 13 34.549 0.000 . 1 . . . . 1519 GLN CG . 25743 1 966 . 1 1 103 103 GLN N N 15 120.542 0.038 . 1 . . . . 1519 GLN N . 25743 1 967 . 1 1 104 104 ALA H H 1 7.277 0.012 . 1 . . . . 1520 ALA H . 25743 1 968 . 1 1 104 104 ALA HA H 1 4.052 0.010 . 1 . . . . 1520 ALA HA . 25743 1 969 . 1 1 104 104 ALA HB1 H 1 1.518 0.002 . 1 . . . . 1520 ALA MB . 25743 1 970 . 1 1 104 104 ALA HB2 H 1 1.518 0.002 . 1 . . . . 1520 ALA MB . 25743 1 971 . 1 1 104 104 ALA HB3 H 1 1.518 0.002 . 1 . . . . 1520 ALA MB . 25743 1 972 . 1 1 104 104 ALA CA C 13 55.225 0.068 . 1 . . . . 1520 ALA CA . 25743 1 973 . 1 1 104 104 ALA CB C 13 17.826 0.088 . 1 . . . . 1520 ALA CB . 25743 1 974 . 1 1 104 104 ALA N N 15 121.529 0.122 . 1 . . . . 1520 ALA N . 25743 1 975 . 1 1 105 105 PHE H H 1 7.699 0.005 . 1 . . . . 1521 PHE H . 25743 1 976 . 1 1 105 105 PHE HA H 1 4.313 0.005 . 1 . . . . 1521 PHE HA . 25743 1 977 . 1 1 105 105 PHE HB2 H 1 3.246 0.012 . 2 . . . . 1521 PHE HB2 . 25743 1 978 . 1 1 105 105 PHE HB3 H 1 3.246 0.012 . 2 . . . . 1521 PHE HB3 . 25743 1 979 . 1 1 105 105 PHE CA C 13 61.225 0.023 . 1 . . . . 1521 PHE CA . 25743 1 980 . 1 1 105 105 PHE CB C 13 38.892 0.036 . 1 . . . . 1521 PHE CB . 25743 1 981 . 1 1 105 105 PHE N N 15 119.585 0.061 . 1 . . . . 1521 PHE N . 25743 1 982 . 1 1 106 106 PHE H H 1 9.079 0.006 . 1 . . . . 1522 PHE H . 25743 1 983 . 1 1 106 106 PHE HA H 1 3.949 0.000 . 1 . . . . 1522 PHE HA . 25743 1 984 . 1 1 106 106 PHE HB2 H 1 3.277 0.000 . 2 . . . . 1522 PHE HB2 . 25743 1 985 . 1 1 106 106 PHE HB3 H 1 3.277 0.000 . 2 . . . . 1522 PHE HB3 . 25743 1 986 . 1 1 106 106 PHE CA C 13 60.340 0.048 . 1 . . . . 1522 PHE CA . 25743 1 987 . 1 1 106 106 PHE CB C 13 38.322 0.031 . 1 . . . . 1522 PHE CB . 25743 1 988 . 1 1 106 106 PHE N N 15 120.529 0.042 . 1 . . . . 1522 PHE N . 25743 1 989 . 1 1 107 107 HIS H H 1 8.224 0.007 . 1 . . . . 1523 HIS H . 25743 1 990 . 1 1 107 107 HIS HA H 1 3.772 0.000 . 1 . . . . 1523 HIS HA . 25743 1 991 . 1 1 107 107 HIS HB2 H 1 3.188 0.013 . 2 . . . . 1523 HIS HB2 . 25743 1 992 . 1 1 107 107 HIS HB3 H 1 2.966 0.001 . 2 . . . . 1523 HIS HB3 . 25743 1 993 . 1 1 107 107 HIS CA C 13 58.550 0.071 . 1 . . . . 1523 HIS CA . 25743 1 994 . 1 1 107 107 HIS CB C 13 29.309 0.032 . 1 . . . . 1523 HIS CB . 25743 1 995 . 1 1 107 107 HIS N N 15 117.177 0.113 . 1 . . . . 1523 HIS N . 25743 1 996 . 1 1 108 108 ILE H H 1 7.543 0.006 . 1 . . . . 1524 ILE H . 25743 1 997 . 1 1 108 108 ILE HA H 1 3.702 0.006 . 1 . . . . 1524 ILE HA . 25743 1 998 . 1 1 108 108 ILE HG12 H 1 1.179 0.000 . 2 . . . . 1524 ILE HG12 . 25743 1 999 . 1 1 108 108 ILE HG13 H 1 1.179 0.000 . 2 . . . . 1524 ILE HG13 . 25743 1 1000 . 1 1 108 108 ILE HG21 H 1 0.881 0.000 . 1 . . . . 1524 ILE MG . 25743 1 1001 . 1 1 108 108 ILE HG22 H 1 0.881 0.000 . 1 . . . . 1524 ILE MG . 25743 1 1002 . 1 1 108 108 ILE HG23 H 1 0.881 0.000 . 1 . . . . 1524 ILE MG . 25743 1 1003 . 1 1 108 108 ILE HD11 H 1 0.881 0.000 . 1 . . . . 1524 ILE MD . 25743 1 1004 . 1 1 108 108 ILE HD12 H 1 0.881 0.000 . 1 . . . . 1524 ILE MD . 25743 1 1005 . 1 1 108 108 ILE HD13 H 1 0.881 0.000 . 1 . . . . 1524 ILE MD . 25743 1 1006 . 1 1 108 108 ILE CA C 13 64.630 0.127 . 1 . . . . 1524 ILE CA . 25743 1 1007 . 1 1 108 108 ILE CB C 13 38.260 0.197 . 1 . . . . 1524 ILE CB . 25743 1 1008 . 1 1 108 108 ILE CG2 C 13 17.349 0.000 . 1 . . . . 1524 ILE CG2 . 25743 1 1009 . 1 1 108 108 ILE N N 15 119.869 0.090 . 1 . . . . 1524 ILE N . 25743 1 1010 . 1 1 109 109 GLN H H 1 8.393 0.007 . 1 . . . . 1525 GLN H . 25743 1 1011 . 1 1 109 109 GLN HA H 1 3.731 0.010 . 1 . . . . 1525 GLN HA . 25743 1 1012 . 1 1 109 109 GLN HB2 H 1 1.836 0.005 . 2 . . . . 1525 GLN HB2 . 25743 1 1013 . 1 1 109 109 GLN HB3 H 1 1.444 0.001 . 2 . . . . 1525 GLN HB3 . 25743 1 1014 . 1 1 109 109 GLN HG2 H 1 2.433 0.000 . 2 . . . . 1525 GLN HG2 . 25743 1 1015 . 1 1 109 109 GLN HG3 H 1 2.433 0.000 . 2 . . . . 1525 GLN HG3 . 25743 1 1016 . 1 1 109 109 GLN CA C 13 57.859 0.012 . 1 . . . . 1525 GLN CA . 25743 1 1017 . 1 1 109 109 GLN CB C 13 28.491 0.019 . 1 . . . . 1525 GLN CB . 25743 1 1018 . 1 1 109 109 GLN CG C 13 33.211 0.000 . 1 . . . . 1525 GLN CG . 25743 1 1019 . 1 1 109 109 GLN N N 15 119.598 0.104 . 1 . . . . 1525 GLN N . 25743 1 1020 . 1 1 110 110 ALA H H 1 8.962 0.008 . 1 . . . . 1526 ALA H . 25743 1 1021 . 1 1 110 110 ALA HA H 1 3.769 0.000 . 1 . . . . 1526 ALA HA . 25743 1 1022 . 1 1 110 110 ALA HB1 H 1 0.915 0.012 . 1 . . . . 1526 ALA MB . 25743 1 1023 . 1 1 110 110 ALA HB2 H 1 0.915 0.012 . 1 . . . . 1526 ALA MB . 25743 1 1024 . 1 1 110 110 ALA HB3 H 1 0.915 0.012 . 1 . . . . 1526 ALA MB . 25743 1 1025 . 1 1 110 110 ALA CA C 13 55.422 0.079 . 1 . . . . 1526 ALA CA . 25743 1 1026 . 1 1 110 110 ALA CB C 13 17.594 0.082 . 1 . . . . 1526 ALA CB . 25743 1 1027 . 1 1 110 110 ALA N N 15 120.491 0.067 . 1 . . . . 1526 ALA N . 25743 1 1028 . 1 1 111 111 GLN H H 1 7.308 0.006 . 1 . . . . 1527 GLN H . 25743 1 1029 . 1 1 111 111 GLN HA H 1 4.117 0.008 . 1 . . . . 1527 GLN HA . 25743 1 1030 . 1 1 111 111 GLN HB2 H 1 2.104 0.009 . 2 . . . . 1527 GLN HB2 . 25743 1 1031 . 1 1 111 111 GLN HB3 H 1 2.104 0.009 . 2 . . . . 1527 GLN HB3 . 25743 1 1032 . 1 1 111 111 GLN HG2 H 1 2.452 0.003 . 2 . . . . 1527 GLN HG2 . 25743 1 1033 . 1 1 111 111 GLN HG3 H 1 2.270 0.000 . 2 . . . . 1527 GLN HG3 . 25743 1 1034 . 1 1 111 111 GLN CA C 13 58.962 0.103 . 1 . . . . 1527 GLN CA . 25743 1 1035 . 1 1 111 111 GLN CB C 13 28.431 0.119 . 1 . . . . 1527 GLN CB . 25743 1 1036 . 1 1 111 111 GLN CG C 13 34.139 0.000 . 1 . . . . 1527 GLN CG . 25743 1 1037 . 1 1 111 111 GLN N N 15 116.542 0.022 . 1 . . . . 1527 GLN N . 25743 1 1038 . 1 1 112 112 LYS H H 1 7.774 0.007 . 1 . . . . 1528 LYS H . 25743 1 1039 . 1 1 112 112 LYS HA H 1 3.987 0.007 . 1 . . . . 1528 LYS HA . 25743 1 1040 . 1 1 112 112 LYS HB2 H 1 1.881 0.006 . 2 . . . . 1528 LYS HB2 . 25743 1 1041 . 1 1 112 112 LYS HB3 H 1 1.881 0.006 . 2 . . . . 1528 LYS HB3 . 25743 1 1042 . 1 1 112 112 LYS HG2 H 1 1.378 0.010 . 2 . . . . 1528 LYS HG2 . 25743 1 1043 . 1 1 112 112 LYS HG3 H 1 1.378 0.010 . 2 . . . . 1528 LYS HG3 . 25743 1 1044 . 1 1 112 112 LYS HD2 H 1 1.582 0.008 . 2 . . . . 1528 LYS HD2 . 25743 1 1045 . 1 1 112 112 LYS HD3 H 1 1.582 0.008 . 2 . . . . 1528 LYS HD3 . 25743 1 1046 . 1 1 112 112 LYS HE2 H 1 2.895 0.000 . 2 . . . . 1528 LYS HE2 . 25743 1 1047 . 1 1 112 112 LYS HE3 H 1 2.895 0.000 . 2 . . . . 1528 LYS HE3 . 25743 1 1048 . 1 1 112 112 LYS CA C 13 59.531 0.076 . 1 . . . . 1528 LYS CA . 25743 1 1049 . 1 1 112 112 LYS CB C 13 32.399 0.041 . 1 . . . . 1528 LYS CB . 25743 1 1050 . 1 1 112 112 LYS CG C 13 25.392 0.000 . 1 . . . . 1528 LYS CG . 25743 1 1051 . 1 1 112 112 LYS CD C 13 29.739 0.000 . 1 . . . . 1528 LYS CD . 25743 1 1052 . 1 1 112 112 LYS CE C 13 42.071 0.000 . 1 . . . . 1528 LYS CE . 25743 1 1053 . 1 1 112 112 LYS N N 15 121.310 0.039 . 1 . . . . 1528 LYS N . 25743 1 1054 . 1 1 113 113 LEU H H 1 7.443 0.007 . 1 . . . . 1529 LEU H . 25743 1 1055 . 1 1 113 113 LEU HA H 1 4.304 0.006 . 1 . . . . 1529 LEU HA . 25743 1 1056 . 1 1 113 113 LEU HB2 H 1 1.688 0.010 . 2 . . . . 1529 LEU HB2 . 25743 1 1057 . 1 1 113 113 LEU HB3 H 1 1.688 0.010 . 2 . . . . 1529 LEU HB3 . 25743 1 1058 . 1 1 113 113 LEU HD11 H 1 0.866 0.005 . 2 . . . . 1529 LEU MD1 . 25743 1 1059 . 1 1 113 113 LEU HD12 H 1 0.866 0.005 . 2 . . . . 1529 LEU MD1 . 25743 1 1060 . 1 1 113 113 LEU HD13 H 1 0.866 0.005 . 2 . . . . 1529 LEU MD1 . 25743 1 1061 . 1 1 113 113 LEU HD21 H 1 0.866 0.005 . 2 . . . . 1529 LEU MD2 . 25743 1 1062 . 1 1 113 113 LEU HD22 H 1 0.866 0.005 . 2 . . . . 1529 LEU MD2 . 25743 1 1063 . 1 1 113 113 LEU HD23 H 1 0.866 0.005 . 2 . . . . 1529 LEU MD2 . 25743 1 1064 . 1 1 113 113 LEU CA C 13 54.749 0.009 . 1 . . . . 1529 LEU CA . 25743 1 1065 . 1 1 113 113 LEU CB C 13 42.649 0.106 . 1 . . . . 1529 LEU CB . 25743 1 1066 . 1 1 113 113 LEU CG C 13 26.259 0.000 . 1 . . . . 1529 LEU CG . 25743 1 1067 . 1 1 113 113 LEU CD1 C 13 22.514 0.000 . 2 . . . . 1529 LEU CD1 . 25743 1 1068 . 1 1 113 113 LEU CD2 C 13 22.514 0.000 . 2 . . . . 1529 LEU CD2 . 25743 1 1069 . 1 1 113 113 LEU N N 15 116.785 0.050 . 1 . . . . 1529 LEU N . 25743 1 1070 . 1 1 114 114 GLY H H 1 7.721 0.004 . 1 . . . . 1530 GLY H . 25743 1 1071 . 1 1 114 114 GLY HA2 H 1 3.754 0.004 . 2 . . . . 1530 GLY HA2 . 25743 1 1072 . 1 1 114 114 GLY HA3 H 1 3.754 0.004 . 2 . . . . 1530 GLY HA3 . 25743 1 1073 . 1 1 114 114 GLY CA C 13 45.654 0.241 . 1 . . . . 1530 GLY CA . 25743 1 1074 . 1 1 114 114 GLY N N 15 107.052 0.055 . 1 . . . . 1530 GLY N . 25743 1 1075 . 1 1 115 115 LEU H H 1 7.914 0.007 . 1 . . . . 1531 LEU H . 25743 1 1076 . 1 1 115 115 LEU HA H 1 4.328 0.008 . 1 . . . . 1531 LEU HA . 25743 1 1077 . 1 1 115 115 LEU HB2 H 1 1.529 0.000 . 2 . . . . 1531 LEU HB2 . 25743 1 1078 . 1 1 115 115 LEU HB3 H 1 1.529 0.000 . 2 . . . . 1531 LEU HB3 . 25743 1 1079 . 1 1 115 115 LEU HG H 1 0.881 0.007 . 1 . . . . 1531 LEU HG . 25743 1 1080 . 1 1 115 115 LEU HD11 H 1 0.625 0.056 . 2 . . . . 1531 LEU MD1 . 25743 1 1081 . 1 1 115 115 LEU HD12 H 1 0.625 0.056 . 2 . . . . 1531 LEU MD1 . 25743 1 1082 . 1 1 115 115 LEU HD13 H 1 0.625 0.056 . 2 . . . . 1531 LEU MD1 . 25743 1 1083 . 1 1 115 115 LEU HD21 H 1 0.625 0.056 . 2 . . . . 1531 LEU MD2 . 25743 1 1084 . 1 1 115 115 LEU HD22 H 1 0.625 0.056 . 2 . . . . 1531 LEU MD2 . 25743 1 1085 . 1 1 115 115 LEU HD23 H 1 0.625 0.056 . 2 . . . . 1531 LEU MD2 . 25743 1 1086 . 1 1 115 115 LEU CA C 13 54.409 0.037 . 1 . . . . 1531 LEU CA . 25743 1 1087 . 1 1 115 115 LEU CB C 13 42.144 0.056 . 1 . . . . 1531 LEU CB . 25743 1 1088 . 1 1 115 115 LEU CG C 13 26.956 0.000 . 1 . . . . 1531 LEU CG . 25743 1 1089 . 1 1 115 115 LEU CD1 C 13 26.365 0.000 . 2 . . . . 1531 LEU CD1 . 25743 1 1090 . 1 1 115 115 LEU CD2 C 13 24.118 0.000 . 2 . . . . 1531 LEU CD2 . 25743 1 1091 . 1 1 115 115 LEU N N 15 119.632 0.045 . 1 . . . . 1531 LEU N . 25743 1 1092 . 1 1 116 116 HIS H H 1 8.585 0.015 . 1 . . . . 1532 HIS H . 25743 1 1093 . 1 1 116 116 HIS HA H 1 4.568 0.008 . 1 . . . . 1532 HIS HA . 25743 1 1094 . 1 1 116 116 HIS HB2 H 1 2.958 0.012 . 2 . . . . 1532 HIS HB2 . 25743 1 1095 . 1 1 116 116 HIS HB3 H 1 2.958 0.012 . 2 . . . . 1532 HIS HB3 . 25743 1 1096 . 1 1 116 116 HIS CA C 13 55.644 0.062 . 1 . . . . 1532 HIS CA . 25743 1 1097 . 1 1 116 116 HIS CB C 13 30.174 0.067 . 1 . . . . 1532 HIS CB . 25743 1 1098 . 1 1 116 116 HIS N N 15 120.502 0.063 . 1 . . . . 1532 HIS N . 25743 1 1099 . 1 1 117 117 VAL H H 1 7.776 0.010 . 1 . . . . 1533 VAL H . 25743 1 1100 . 1 1 117 117 VAL HA H 1 4.157 0.006 . 1 . . . . 1533 VAL HA . 25743 1 1101 . 1 1 117 117 VAL HB H 1 1.808 0.005 . 1 . . . . 1533 VAL HB . 25743 1 1102 . 1 1 117 117 VAL HG11 H 1 0.600 0.010 . 2 . . . . 1533 VAL MG1 . 25743 1 1103 . 1 1 117 117 VAL HG12 H 1 0.600 0.010 . 2 . . . . 1533 VAL MG1 . 25743 1 1104 . 1 1 117 117 VAL HG13 H 1 0.600 0.010 . 2 . . . . 1533 VAL MG1 . 25743 1 1105 . 1 1 117 117 VAL HG21 H 1 0.600 0.010 . 2 . . . . 1533 VAL MG2 . 25743 1 1106 . 1 1 117 117 VAL HG22 H 1 0.600 0.010 . 2 . . . . 1533 VAL MG2 . 25743 1 1107 . 1 1 117 117 VAL HG23 H 1 0.600 0.010 . 2 . . . . 1533 VAL MG2 . 25743 1 1108 . 1 1 117 117 VAL CA C 13 60.585 0.035 . 1 . . . . 1533 VAL CA . 25743 1 1109 . 1 1 117 117 VAL CB C 13 33.274 0.121 . 1 . . . . 1533 VAL CB . 25743 1 1110 . 1 1 117 117 VAL CG1 C 13 21.696 0.000 . 2 . . . . 1533 VAL CG1 . 25743 1 1111 . 1 1 117 117 VAL CG2 C 13 19.842 0.000 . 2 . . . . 1533 VAL CG2 . 25743 1 1112 . 1 1 117 117 VAL N N 15 120.526 0.077 . 1 . . . . 1533 VAL N . 25743 1 1113 . 1 1 118 118 SER H H 1 8.701 0.006 . 1 . . . . 1534 SER H . 25743 1 1114 . 1 1 118 118 SER CA C 13 56.306 0.000 . 1 . . . . 1534 SER CA . 25743 1 1115 . 1 1 118 118 SER CB C 13 63.321 0.000 . 1 . . . . 1534 SER CB . 25743 1 1116 . 1 1 118 118 SER N N 15 120.458 0.048 . 1 . . . . 1534 SER N . 25743 1 1117 . 1 1 119 119 PRO HA H 1 4.335 0.004 . 1 . . . . 1535 PRO HA . 25743 1 1118 . 1 1 119 119 PRO HB2 H 1 2.212 0.012 . 2 . . . . 1535 PRO HB2 . 25743 1 1119 . 1 1 119 119 PRO HB3 H 1 1.869 0.007 . 2 . . . . 1535 PRO HB3 . 25743 1 1120 . 1 1 119 119 PRO HG2 H 1 1.343 0.000 . 2 . . . . 1535 PRO HG2 . 25743 1 1121 . 1 1 119 119 PRO HG3 H 1 1.343 0.000 . 2 . . . . 1535 PRO HG3 . 25743 1 1122 . 1 1 119 119 PRO HD2 H 1 3.690 0.025 . 2 . . . . 1535 PRO HD2 . 25743 1 1123 . 1 1 119 119 PRO HD3 H 1 3.690 0.025 . 2 . . . . 1535 PRO HD3 . 25743 1 1124 . 1 1 119 119 PRO CA C 13 63.164 0.059 . 1 . . . . 1535 PRO CA . 25743 1 1125 . 1 1 119 119 PRO CB C 13 32.126 0.051 . 1 . . . . 1535 PRO CB . 25743 1 1126 . 1 1 119 119 PRO CG C 13 27.302 0.000 . 1 . . . . 1535 PRO CG . 25743 1 1127 . 1 1 119 119 PRO CD C 13 50.694 0.000 . 1 . . . . 1535 PRO CD . 25743 1 1128 . 1 1 120 120 SER H H 1 8.478 0.005 . 1 . . . . 1536 SER H . 25743 1 1129 . 1 1 120 120 SER HA H 1 4.429 0.011 . 1 . . . . 1536 SER HA . 25743 1 1130 . 1 1 120 120 SER HB2 H 1 3.829 0.007 . 2 . . . . 1536 SER HB2 . 25743 1 1131 . 1 1 120 120 SER HB3 H 1 3.829 0.007 . 2 . . . . 1536 SER HB3 . 25743 1 1132 . 1 1 120 120 SER CA C 13 58.406 0.099 . 1 . . . . 1536 SER CA . 25743 1 1133 . 1 1 120 120 SER CB C 13 63.930 0.054 . 1 . . . . 1536 SER CB . 25743 1 1134 . 1 1 120 120 SER N N 15 116.192 0.041 . 1 . . . . 1536 SER N . 25743 1 1135 . 1 1 121 121 THR H H 1 8.234 0.006 . 1 . . . . 1537 THR H . 25743 1 1136 . 1 1 121 121 THR HA H 1 4.289 0.014 . 1 . . . . 1537 THR HA . 25743 1 1137 . 1 1 121 121 THR HB H 1 3.912 0.000 . 1 . . . . 1537 THR HB . 25743 1 1138 . 1 1 121 121 THR HG21 H 1 1.135 0.004 . 1 . . . . 1537 THR MG . 25743 1 1139 . 1 1 121 121 THR HG22 H 1 1.135 0.004 . 1 . . . . 1537 THR MG . 25743 1 1140 . 1 1 121 121 THR HG23 H 1 1.135 0.004 . 1 . . . . 1537 THR MG . 25743 1 1141 . 1 1 121 121 THR CA C 13 62.199 0.099 . 1 . . . . 1537 THR CA . 25743 1 1142 . 1 1 121 121 THR CB C 13 69.504 0.018 . 1 . . . . 1537 THR CB . 25743 1 1143 . 1 1 121 121 THR CG2 C 13 21.861 0.000 . 1 . . . . 1537 THR CG2 . 25743 1 1144 . 1 1 121 121 THR N N 15 116.091 0.013 . 1 . . . . 1537 THR N . 25743 1 1145 . 1 1 122 122 VAL H H 1 7.981 0.010 . 1 . . . . 1538 VAL H . 25743 1 1146 . 1 1 122 122 VAL HA H 1 4.008 0.005 . 1 . . . . 1538 VAL HA . 25743 1 1147 . 1 1 122 122 VAL HB H 1 1.965 0.006 . 1 . . . . 1538 VAL HB . 25743 1 1148 . 1 1 122 122 VAL HG11 H 1 0.831 0.004 . 2 . . . . 1538 VAL MG1 . 25743 1 1149 . 1 1 122 122 VAL HG12 H 1 0.831 0.004 . 2 . . . . 1538 VAL MG1 . 25743 1 1150 . 1 1 122 122 VAL HG13 H 1 0.831 0.004 . 2 . . . . 1538 VAL MG1 . 25743 1 1151 . 1 1 122 122 VAL HG21 H 1 0.831 0.004 . 2 . . . . 1538 VAL MG2 . 25743 1 1152 . 1 1 122 122 VAL HG22 H 1 0.831 0.004 . 2 . . . . 1538 VAL MG2 . 25743 1 1153 . 1 1 122 122 VAL HG23 H 1 0.831 0.004 . 2 . . . . 1538 VAL MG2 . 25743 1 1154 . 1 1 122 122 VAL CA C 13 62.610 0.116 . 1 . . . . 1538 VAL CA . 25743 1 1155 . 1 1 122 122 VAL CB C 13 32.715 0.156 . 1 . . . . 1538 VAL CB . 25743 1 1156 . 1 1 122 122 VAL CG1 C 13 21.279 0.000 . 2 . . . . 1538 VAL CG1 . 25743 1 1157 . 1 1 122 122 VAL CG2 C 13 21.279 0.000 . 2 . . . . 1538 VAL CG2 . 25743 1 1158 . 1 1 122 122 VAL N N 15 121.717 0.036 . 1 . . . . 1538 VAL N . 25743 1 1159 . 1 1 123 123 ASP H H 1 8.323 0.008 . 1 . . . . 1539 ASP H . 25743 1 1160 . 1 1 123 123 ASP HA H 1 4.566 0.005 . 1 . . . . 1539 ASP HA . 25743 1 1161 . 1 1 123 123 ASP HB2 H 1 2.679 0.001 . 2 . . . . 1539 ASP HB2 . 25743 1 1162 . 1 1 123 123 ASP HB3 H 1 2.604 0.000 . 2 . . . . 1539 ASP HB3 . 25743 1 1163 . 1 1 123 123 ASP CA C 13 54.314 0.086 . 1 . . . . 1539 ASP CA . 25743 1 1164 . 1 1 123 123 ASP CB C 13 41.100 0.034 . 1 . . . . 1539 ASP CB . 25743 1 1165 . 1 1 123 123 ASP N N 15 123.809 0.013 . 1 . . . . 1539 ASP N . 25743 1 stop_ save_