data_4405 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 4405 _Entry.Title ; C-TERMINAL KH DOMAIN OF HNRNP K (KH3) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 1999-09-15 _Entry.Accession_date 1999-09-15 _Entry.Last_release_date 1999-11-29 _Entry.Original_release_date 1999-11-29 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 J. BABER . . . 4405 2 D. LIBUTTI . . . 4405 3 D. LEVENS . . . 4405 4 N. TJANDRA . . . 4405 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 4405 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 363 4405 '15N chemical shifts' 92 4405 '1H chemical shifts' 604 4405 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 . . 1999-11-29 1999-09-15 original author . 4405 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1KHM 'BMRB Entry Tracking System' 4405 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 4405 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code 99299390 _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; HIGH PRECISION SOLUTION STRUCTURE OF THE C-TERMINAL KH DOMAIN OF HNRNP K, A C-MYC TRANSCRIPTION FACTOR ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full . _Citation.Journal_volume 289 _Citation.Journal_issue . _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 949 _Citation.Page_last 962 _Citation.Year 1999 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 J. BABER . . . 4405 1 2 D. LIBUTTI . . . 4405 1 3 D. LEVENS . . . 4405 1 4 N. TJANDRA . . . 4405 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID C-MYC 4405 1 'DIPOLAR COUPLING' 4405 1 DNA-BINDING 4405 1 'HNRNP K' 4405 1 'KH DOMAIN' 4405 1 NMR 4405 1 RNA-BINDING 4405 1 'THREE-DIMENSIONAL STRUCTURE' 4405 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_hnRNP_K _Assembly.Sf_category assembly _Assembly.Sf_framecode hnRNP_K _Assembly.Entry_ID 4405 _Assembly.ID 1 _Assembly.Name 'hnRNP K' _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 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 4405 1 stop_ 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 'hnRNP K subunit 1' 1 $KH3 . . . native . . . . . 4405 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . PDB 1KHM . 'A Chain A, C-Terminal Kh Domain Of Hnrnp K (Kh3)' . . . . 4405 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'hnRNP K' abbreviation 4405 1 'hnRNP K' system 4405 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_KH3 _Entity.Sf_category entity _Entity.Sf_framecode KH3 _Entity.Entry_ID 4405 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'hnRNP K' _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 ; GSPNSYGDLGGPIITTQVTI PKDLARSIIGKGGQRIKQIR HESGASIKIDEPLEGSEDRI ITITGTQDQIQNAQYLLQNS VKQYSGKFF ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 89 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-24 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1KHM . "C-Terminal Kh Domain Of Hnrnp K (Kh3)" . . . . . 100.00 89 100.00 100.00 6.77e-55 . . . . 4405 1 2 no PDB 1ZZI . "Crystal Structure Analysis Of The Third Kh Domain Of Hnrnp K In Complex With Ssdna" . . . . . 88.76 82 98.73 98.73 1.26e-45 . . . . 4405 1 3 no PDB 1ZZJ . "Structure Of The Third Kh Domain Of Hnrnp K In Complex With 15-Mer Ssdna" . . . . . 88.76 82 98.73 98.73 1.26e-45 . . . . 4405 1 4 no PDB 1ZZK . "Crystal Structure Of The Third Kh Domain Of Hnrnp K At 0.95a Resolution" . . . . . 88.76 82 98.73 98.73 1.26e-45 . . . . 4405 1 5 no GB EGW07100 . "Kinesin-like protein KIF27 [Cricetulus griseus]" . . . . . 80.90 1648 98.61 98.61 2.57e-36 . . . . 4405 1 6 no GB EMP30398 . "Heterogeneous nuclear ribonucleoprotein K [Chelonia mydas]" . . . . . 80.90 384 98.61 98.61 7.21e-37 . . . . 4405 1 7 no GB ERE80796 . "heterogeneous nuclear ribonucleoprotein K-like isoform 1 [Cricetulus griseus]" . . . . . 87.64 459 97.44 98.72 2.07e-40 . . . . 4405 1 8 no GB ERE80797 . "heterogeneous nuclear ribonucleoprotein K-like isoform 2 [Cricetulus griseus]" . . . . . 92.13 458 98.78 98.78 2.88e-44 . . . . 4405 1 9 no REF XP_011972837 . "PREDICTED: heterogeneous nuclear ribonucleoprotein K isoform X1 [Ovis aries]" . . . . . 87.64 459 97.44 98.72 2.09e-40 . . . . 4405 1 10 no REF XP_011972846 . "PREDICTED: heterogeneous nuclear ribonucleoprotein K isoform X2 [Ovis aries]" . . . . . 92.13 458 98.78 98.78 2.82e-44 . . . . 4405 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'G26R for fragment' variant 4405 1 'hnRNP K' common 4405 1 KH3 abbreviation 4405 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 4405 1 2 . SER . 4405 1 3 . PRO . 4405 1 4 . ASN . 4405 1 5 . SER . 4405 1 6 . TYR . 4405 1 7 . GLY . 4405 1 8 . ASP . 4405 1 9 . LEU . 4405 1 10 . GLY . 4405 1 11 . GLY . 4405 1 12 . PRO . 4405 1 13 . ILE . 4405 1 14 . ILE . 4405 1 15 . THR . 4405 1 16 . THR . 4405 1 17 . GLN . 4405 1 18 . VAL . 4405 1 19 . THR . 4405 1 20 . ILE . 4405 1 21 . PRO . 4405 1 22 . LYS . 4405 1 23 . ASP . 4405 1 24 . LEU . 4405 1 25 . ALA . 4405 1 26 . ARG . 4405 1 27 . SER . 4405 1 28 . ILE . 4405 1 29 . ILE . 4405 1 30 . GLY . 4405 1 31 . LYS . 4405 1 32 . GLY . 4405 1 33 . GLY . 4405 1 34 . GLN . 4405 1 35 . ARG . 4405 1 36 . ILE . 4405 1 37 . LYS . 4405 1 38 . GLN . 4405 1 39 . ILE . 4405 1 40 . ARG . 4405 1 41 . HIS . 4405 1 42 . GLU . 4405 1 43 . SER . 4405 1 44 . GLY . 4405 1 45 . ALA . 4405 1 46 . SER . 4405 1 47 . ILE . 4405 1 48 . LYS . 4405 1 49 . ILE . 4405 1 50 . ASP . 4405 1 51 . GLU . 4405 1 52 . PRO . 4405 1 53 . LEU . 4405 1 54 . GLU . 4405 1 55 . GLY . 4405 1 56 . SER . 4405 1 57 . GLU . 4405 1 58 . ASP . 4405 1 59 . ARG . 4405 1 60 . ILE . 4405 1 61 . ILE . 4405 1 62 . THR . 4405 1 63 . ILE . 4405 1 64 . THR . 4405 1 65 . GLY . 4405 1 66 . THR . 4405 1 67 . GLN . 4405 1 68 . ASP . 4405 1 69 . GLN . 4405 1 70 . ILE . 4405 1 71 . GLN . 4405 1 72 . ASN . 4405 1 73 . ALA . 4405 1 74 . GLN . 4405 1 75 . TYR . 4405 1 76 . LEU . 4405 1 77 . LEU . 4405 1 78 . GLN . 4405 1 79 . ASN . 4405 1 80 . SER . 4405 1 81 . VAL . 4405 1 82 . LYS . 4405 1 83 . GLN . 4405 1 84 . TYR . 4405 1 85 . SER . 4405 1 86 . GLY . 4405 1 87 . LYS . 4405 1 88 . PHE . 4405 1 89 . PHE . 4405 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 4405 1 . SER 2 2 4405 1 . PRO 3 3 4405 1 . ASN 4 4 4405 1 . SER 5 5 4405 1 . TYR 6 6 4405 1 . GLY 7 7 4405 1 . ASP 8 8 4405 1 . LEU 9 9 4405 1 . GLY 10 10 4405 1 . GLY 11 11 4405 1 . PRO 12 12 4405 1 . ILE 13 13 4405 1 . ILE 14 14 4405 1 . THR 15 15 4405 1 . THR 16 16 4405 1 . GLN 17 17 4405 1 . VAL 18 18 4405 1 . THR 19 19 4405 1 . ILE 20 20 4405 1 . PRO 21 21 4405 1 . LYS 22 22 4405 1 . ASP 23 23 4405 1 . LEU 24 24 4405 1 . ALA 25 25 4405 1 . ARG 26 26 4405 1 . SER 27 27 4405 1 . ILE 28 28 4405 1 . ILE 29 29 4405 1 . GLY 30 30 4405 1 . LYS 31 31 4405 1 . GLY 32 32 4405 1 . GLY 33 33 4405 1 . GLN 34 34 4405 1 . ARG 35 35 4405 1 . ILE 36 36 4405 1 . LYS 37 37 4405 1 . GLN 38 38 4405 1 . ILE 39 39 4405 1 . ARG 40 40 4405 1 . HIS 41 41 4405 1 . GLU 42 42 4405 1 . SER 43 43 4405 1 . GLY 44 44 4405 1 . ALA 45 45 4405 1 . SER 46 46 4405 1 . ILE 47 47 4405 1 . LYS 48 48 4405 1 . ILE 49 49 4405 1 . ASP 50 50 4405 1 . GLU 51 51 4405 1 . PRO 52 52 4405 1 . LEU 53 53 4405 1 . GLU 54 54 4405 1 . GLY 55 55 4405 1 . SER 56 56 4405 1 . GLU 57 57 4405 1 . ASP 58 58 4405 1 . ARG 59 59 4405 1 . ILE 60 60 4405 1 . ILE 61 61 4405 1 . THR 62 62 4405 1 . ILE 63 63 4405 1 . THR 64 64 4405 1 . GLY 65 65 4405 1 . THR 66 66 4405 1 . GLN 67 67 4405 1 . ASP 68 68 4405 1 . GLN 69 69 4405 1 . ILE 70 70 4405 1 . GLN 71 71 4405 1 . ASN 72 72 4405 1 . ALA 73 73 4405 1 . GLN 74 74 4405 1 . TYR 75 75 4405 1 . LEU 76 76 4405 1 . LEU 77 77 4405 1 . GLN 78 78 4405 1 . ASN 79 79 4405 1 . SER 80 80 4405 1 . VAL 81 81 4405 1 . LYS 82 82 4405 1 . GLN 83 83 4405 1 . TYR 84 84 4405 1 . SER 85 85 4405 1 . GLY 86 86 4405 1 . LYS 87 87 4405 1 . PHE 88 88 4405 1 . PHE 89 89 4405 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 4405 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $KH3 . 9606 organism . 'homo sapiens' human . . Eukaryota Metazoa homo sapiens . . . . . . . . . . . . . . . . . . . . . 4405 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 4405 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $KH3 . 'recombinant technology' 'Escherichia coli' 'Escherichia coli' . . Escherichia coli BL21 DE3 . . . . . . . . . . . . . . . . . . . . . 4405 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 4405 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'hnRNP K' '[U-99% 13C; U-99% 15N]' . . 1 $KH3 . . . 1 . mM . . . . 4405 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_cond_1 _Sample_condition_list.Entry_ID 4405 _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' 5 . mM 4405 1 pH* 5.5 0.1 n/a 4405 1 pressure 1 . atm 4405 1 temperature 300 0.4 K 4405 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer _NMR_spectrometer.Entry_ID 4405 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 4405 _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 NMR_spectrometer Bruker AMX . 600 . . . 4405 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 4405 _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 . . . . . . . . . . . . 1 $sample_1 . . . 1 $sample_cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 4405 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 4405 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 external indirect 0.251449530 external_to_the_sample cylindrical parallel_to_Bo 1 $entry_citation . . 1 $entry_citation 4405 1 H 1 TSP 'methyl protons' . . . . ppm 0.00 external indirect 1.000 external_to_the_sample cylindrical parallel_to_Bo 1 $entry_citation . . 1 $entry_citation 4405 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chem_shift_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_set_1 _Assigned_chem_shift_list.Entry_ID 4405 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _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 $sample_1 . 4405 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 SER HB2 H 1 3.88 . . 1 . . . . . . . . 4405 1 2 . 1 1 2 2 SER HB3 H 1 3.88 . . 1 . . . . . . . . 4405 1 3 . 1 1 2 2 SER HA H 1 4.85 . . 1 . . . . . . . . 4405 1 4 . 1 1 2 2 SER CA C 13 56.43 . . 1 . . . . . . . . 4405 1 5 . 1 1 2 2 SER CB C 13 63.19 . . 1 . . . . . . . . 4405 1 6 . 1 1 3 3 PRO HA H 1 4.43 . . 1 . . . . . . . . 4405 1 7 . 1 1 3 3 PRO HB3 H 1 2.28 . . 1 . . . . . . . . 4405 1 8 . 1 1 3 3 PRO HB2 H 1 1.92 . . 1 . . . . . . . . 4405 1 9 . 1 1 3 3 PRO HD3 H 1 3.82 . . 1 . . . . . . . . 4405 1 10 . 1 1 3 3 PRO HD2 H 1 3.72 . . 1 . . . . . . . . 4405 1 11 . 1 1 3 3 PRO HG2 H 1 2.00 . . 1 . . . . . . . . 4405 1 12 . 1 1 3 3 PRO HG3 H 1 2.00 . . 1 . . . . . . . . 4405 1 13 . 1 1 3 3 PRO C C 13 176.53 . . 1 . . . . . . . . 4405 1 14 . 1 1 3 3 PRO CA C 13 63.67 . . 1 . . . . . . . . 4405 1 15 . 1 1 3 3 PRO CB C 13 32.13 . . 1 . . . . . . . . 4405 1 16 . 1 1 3 3 PRO CD C 13 50.99 . . 1 . . . . . . . . 4405 1 17 . 1 1 3 3 PRO CG C 13 27.50 . . 1 . . . . . . . . 4405 1 18 . 1 1 4 4 ASN HA H 1 4.65 . . 1 . . . . . . . . 4405 1 19 . 1 1 4 4 ASN HB2 H 1 2.74 . . 1 . . . . . . . . 4405 1 20 . 1 1 4 4 ASN HB3 H 1 2.74 . . 1 . . . . . . . . 4405 1 21 . 1 1 4 4 ASN H H 1 8.41 . . 1 . . . . . . . . 4405 1 22 . 1 1 4 4 ASN C C 13 175.09 . . 1 . . . . . . . . 4405 1 23 . 1 1 4 4 ASN CA C 13 53.42 . . 1 . . . . . . . . 4405 1 24 . 1 1 4 4 ASN CB C 13 39.04 . . 1 . . . . . . . . 4405 1 25 . 1 1 4 4 ASN N N 15 117.83 . . 1 . . . . . . . . 4405 1 26 . 1 1 5 5 SER HA H 1 4.39 . . 1 . . . . . . . . 4405 1 27 . 1 1 5 5 SER HB2 H 1 3.77 . . 1 . . . . . . . . 4405 1 28 . 1 1 5 5 SER HB3 H 1 3.77 . . 1 . . . . . . . . 4405 1 29 . 1 1 5 5 SER H H 1 8.14 . . 1 . . . . . . . . 4405 1 30 . 1 1 5 5 SER C C 13 174.15 . . 1 . . . . . . . . 4405 1 31 . 1 1 5 5 SER CA C 13 58.52 . . 1 . . . . . . . . 4405 1 32 . 1 1 5 5 SER CB C 13 63.92 . . 1 . . . . . . . . 4405 1 33 . 1 1 5 5 SER N N 15 115.52 . . 1 . . . . . . . . 4405 1 34 . 1 1 6 6 TYR HA H 1 4.58 . . 1 . . . . . . . . 4405 1 35 . 1 1 6 6 TYR HB3 H 1 3.11 . . 1 . . . . . . . . 4405 1 36 . 1 1 6 6 TYR HB2 H 1 2.94 . . 1 . . . . . . . . 4405 1 37 . 1 1 6 6 TYR H H 1 8.19 . . 1 . . . . . . . . 4405 1 38 . 1 1 6 6 TYR C C 13 176.31 . . 1 . . . . . . . . 4405 1 39 . 1 1 6 6 TYR CA C 13 58.29 . . 1 . . . . . . . . 4405 1 40 . 1 1 6 6 TYR CB C 13 38.75 . . 1 . . . . . . . . 4405 1 41 . 1 1 6 6 TYR N N 15 121.28 . . 1 . . . . . . . . 4405 1 42 . 1 1 7 7 GLY HA2 H 1 3.90 . . 1 . . . . . . . . 4405 1 43 . 1 1 7 7 GLY HA3 H 1 3.90 . . 1 . . . . . . . . 4405 1 44 . 1 1 7 7 GLY H H 1 8.24 . . 1 . . . . . . . . 4405 1 45 . 1 1 7 7 GLY C C 13 173.78 . . 1 . . . . . . . . 4405 1 46 . 1 1 7 7 GLY CA C 13 45.57 . . 1 . . . . . . . . 4405 1 47 . 1 1 7 7 GLY N N 15 109.58 . . 1 . . . . . . . . 4405 1 48 . 1 1 8 8 ASP HA H 1 4.61 . . 1 . . . . . . . . 4405 1 49 . 1 1 8 8 ASP HB3 H 1 2.67 . . 1 . . . . . . . . 4405 1 50 . 1 1 8 8 ASP HB2 H 1 2.61 . . 1 . . . . . . . . 4405 1 51 . 1 1 8 8 ASP H H 1 8.22 . . 1 . . . . . . . . 4405 1 52 . 1 1 8 8 ASP C C 13 176.54 . . 1 . . . . . . . . 4405 1 53 . 1 1 8 8 ASP CA C 13 54.67 . . 1 . . . . . . . . 4405 1 54 . 1 1 8 8 ASP CB C 13 41.35 . . 1 . . . . . . . . 4405 1 55 . 1 1 8 8 ASP N N 15 120.31 . . 1 . . . . . . . . 4405 1 56 . 1 1 9 9 LEU HA H 1 4.34 . . 1 . . . . . . . . 4405 1 57 . 1 1 9 9 LEU HB2 H 1 1.66 . . 1 . . . . . . . . 4405 1 58 . 1 1 9 9 LEU HB3 H 1 1.66 . . 1 . . . . . . . . 4405 1 59 . 1 1 9 9 LEU HD11 H 1 0.92 . . 1 . . . . . . . . 4405 1 60 . 1 1 9 9 LEU HD12 H 1 0.92 . . 1 . . . . . . . . 4405 1 61 . 1 1 9 9 LEU HD13 H 1 0.92 . . 1 . . . . . . . . 4405 1 62 . 1 1 9 9 LEU HD21 H 1 0.86 . . 1 . . . . . . . . 4405 1 63 . 1 1 9 9 LEU HD22 H 1 0.86 . . 1 . . . . . . . . 4405 1 64 . 1 1 9 9 LEU HD23 H 1 0.86 . . 1 . . . . . . . . 4405 1 65 . 1 1 9 9 LEU HG H 1 1.67 . . 1 . . . . . . . . 4405 1 66 . 1 1 9 9 LEU H H 1 8.30 . . 1 . . . . . . . . 4405 1 67 . 1 1 9 9 LEU C C 13 178.09 . . 1 . . . . . . . . 4405 1 68 . 1 1 9 9 LEU CA C 13 55.70 . . 1 . . . . . . . . 4405 1 69 . 1 1 9 9 LEU CB C 13 42.19 . . 1 . . . . . . . . 4405 1 70 . 1 1 9 9 LEU CD1 C 13 25.27 . . 1 . . . . . . . . 4405 1 71 . 1 1 9 9 LEU CD2 C 13 23.45 . . 1 . . . . . . . . 4405 1 72 . 1 1 9 9 LEU CG C 13 27.24 . . 1 . . . . . . . . 4405 1 73 . 1 1 9 9 LEU N N 15 121.99 . . 1 . . . . . . . . 4405 1 74 . 1 1 10 10 GLY HA3 H 1 4.34 . . 1 . . . . . . . . 4405 1 75 . 1 1 10 10 GLY HA2 H 1 4.00 . . 1 . . . . . . . . 4405 1 76 . 1 1 10 10 GLY H H 1 8.43 . . 1 . . . . . . . . 4405 1 77 . 1 1 10 10 GLY C C 13 174.33 . . 1 . . . . . . . . 4405 1 78 . 1 1 10 10 GLY CA C 13 45.62 . . 1 . . . . . . . . 4405 1 79 . 1 1 10 10 GLY N N 15 108.56 . . 1 . . . . . . . . 4405 1 80 . 1 1 11 11 GLY HA3 H 1 4.16 . . 1 . . . . . . . . 4405 1 81 . 1 1 11 11 GLY HA2 H 1 4.01 . . 1 . . . . . . . . 4405 1 82 . 1 1 11 11 GLY H H 1 8.01 . . 1 . . . . . . . . 4405 1 83 . 1 1 11 11 GLY CA C 13 44.73 . . 1 . . . . . . . . 4405 1 84 . 1 1 11 11 GLY N N 15 108.67 . . 1 . . . . . . . . 4405 1 85 . 1 1 12 12 PRO HA H 1 4.39 . . 1 . . . . . . . . 4405 1 86 . 1 1 12 12 PRO HB3 H 1 2.24 . . 1 . . . . . . . . 4405 1 87 . 1 1 12 12 PRO HB2 H 1 1.83 . . 1 . . . . . . . . 4405 1 88 . 1 1 12 12 PRO HD3 H 1 3.63 . . 1 . . . . . . . . 4405 1 89 . 1 1 12 12 PRO HD2 H 1 3.57 . . 1 . . . . . . . . 4405 1 90 . 1 1 12 12 PRO HG2 H 1 2.00 . . 1 . . . . . . . . 4405 1 91 . 1 1 12 12 PRO HG3 H 1 2.00 . . 1 . . . . . . . . 4405 1 92 . 1 1 12 12 PRO C C 13 175.94 . . 1 . . . . . . . . 4405 1 93 . 1 1 12 12 PRO CA C 13 63.04 . . 1 . . . . . . . . 4405 1 94 . 1 1 12 12 PRO CB C 13 32.50 . . 1 . . . . . . . . 4405 1 95 . 1 1 12 12 PRO CD C 13 49.98 . . 1 . . . . . . . . 4405 1 96 . 1 1 12 12 PRO CG C 13 27.34 . . 1 . . . . . . . . 4405 1 97 . 1 1 13 13 ILE HA H 1 3.94 . . 1 . . . . . . . . 4405 1 98 . 1 1 13 13 ILE HB H 1 1.77 . . 1 . . . . . . . . 4405 1 99 . 1 1 13 13 ILE HD11 H 1 0.75 . . 1 . . . . . . . . 4405 1 100 . 1 1 13 13 ILE HD12 H 1 0.75 . . 1 . . . . . . . . 4405 1 101 . 1 1 13 13 ILE HD13 H 1 0.75 . . 1 . . . . . . . . 4405 1 102 . 1 1 13 13 ILE HG13 H 1 1.47 . . 1 . . . . . . . . 4405 1 103 . 1 1 13 13 ILE HG12 H 1 1.26 . . 1 . . . . . . . . 4405 1 104 . 1 1 13 13 ILE HG21 H 1 0.74 . . 1 . . . . . . . . 4405 1 105 . 1 1 13 13 ILE HG22 H 1 0.74 . . 1 . . . . . . . . 4405 1 106 . 1 1 13 13 ILE HG23 H 1 0.74 . . 1 . . . . . . . . 4405 1 107 . 1 1 13 13 ILE H H 1 8.12 . . 1 . . . . . . . . 4405 1 108 . 1 1 13 13 ILE C C 13 175.86 . . 1 . . . . . . . . 4405 1 109 . 1 1 13 13 ILE CA C 13 60.42 . . 1 . . . . . . . . 4405 1 110 . 1 1 13 13 ILE CB C 13 37.00 . . 1 . . . . . . . . 4405 1 111 . 1 1 13 13 ILE CD1 C 13 11.51 . . 1 . . . . . . . . 4405 1 112 . 1 1 13 13 ILE CG1 C 13 27.47 . . 1 . . . . . . . . 4405 1 113 . 1 1 13 13 ILE CG2 C 13 18.36 . . 1 . . . . . . . . 4405 1 114 . 1 1 13 13 ILE N N 15 120.56 . . 1 . . . . . . . . 4405 1 115 . 1 1 14 14 ILE HA H 1 4.50 . . 1 . . . . . . . . 4405 1 116 . 1 1 14 14 ILE HB H 1 1.89 . . 1 . . . . . . . . 4405 1 117 . 1 1 14 14 ILE HD11 H 1 0.82 . . 1 . . . . . . . . 4405 1 118 . 1 1 14 14 ILE HD12 H 1 0.82 . . 1 . . . . . . . . 4405 1 119 . 1 1 14 14 ILE HD13 H 1 0.82 . . 1 . . . . . . . . 4405 1 120 . 1 1 14 14 ILE HG13 H 1 1.38 . . 1 . . . . . . . . 4405 1 121 . 1 1 14 14 ILE HG12 H 1 1.13 . . 1 . . . . . . . . 4405 1 122 . 1 1 14 14 ILE HG21 H 1 0.85 . . 1 . . . . . . . . 4405 1 123 . 1 1 14 14 ILE HG22 H 1 0.85 . . 1 . . . . . . . . 4405 1 124 . 1 1 14 14 ILE HG23 H 1 0.85 . . 1 . . . . . . . . 4405 1 125 . 1 1 14 14 ILE H H 1 8.98 . . 1 . . . . . . . . 4405 1 126 . 1 1 14 14 ILE C C 13 173.63 . . 1 . . . . . . . . 4405 1 127 . 1 1 14 14 ILE CA C 13 60.21 . . 1 . . . . . . . . 4405 1 128 . 1 1 14 14 ILE CB C 13 41.68 . . 1 . . . . . . . . 4405 1 129 . 1 1 14 14 ILE CD1 C 13 13.87 . . 1 . . . . . . . . 4405 1 130 . 1 1 14 14 ILE CG1 C 13 26.98 . . 1 . . . . . . . . 4405 1 131 . 1 1 14 14 ILE CG2 C 13 18.21 . . 1 . . . . . . . . 4405 1 132 . 1 1 14 14 ILE N N 15 128.87 . . 1 . . . . . . . . 4405 1 133 . 1 1 15 15 THR HA H 1 5.46 . . 1 . . . . . . . . 4405 1 134 . 1 1 15 15 THR HB H 1 3.78 . . 1 . . . . . . . . 4405 1 135 . 1 1 15 15 THR HG21 H 1 1.06 . . 1 . . . . . . . . 4405 1 136 . 1 1 15 15 THR HG22 H 1 1.06 . . 1 . . . . . . . . 4405 1 137 . 1 1 15 15 THR HG23 H 1 1.06 . . 1 . . . . . . . . 4405 1 138 . 1 1 15 15 THR H H 1 8.06 . . 1 . . . . . . . . 4405 1 139 . 1 1 15 15 THR C C 13 174.08 . . 1 . . . . . . . . 4405 1 140 . 1 1 15 15 THR CA C 13 61.44 . . 1 . . . . . . . . 4405 1 141 . 1 1 15 15 THR CB C 13 71.85 . . 1 . . . . . . . . 4405 1 142 . 1 1 15 15 THR CG2 C 13 21.85 . . 1 . . . . . . . . 4405 1 143 . 1 1 15 15 THR N N 15 116.10 . . 1 . . . . . . . . 4405 1 144 . 1 1 16 16 THR HA H 1 4.70 . . 1 . . . . . . . . 4405 1 145 . 1 1 16 16 THR HB H 1 3.88 . . 1 . . . . . . . . 4405 1 146 . 1 1 16 16 THR HG21 H 1 1.05 . . 1 . . . . . . . . 4405 1 147 . 1 1 16 16 THR HG22 H 1 1.05 . . 1 . . . . . . . . 4405 1 148 . 1 1 16 16 THR HG23 H 1 1.05 . . 1 . . . . . . . . 4405 1 149 . 1 1 16 16 THR H H 1 9.24 . . 1 . . . . . . . . 4405 1 150 . 1 1 16 16 THR C C 13 181.39 . . 1 . . . . . . . . 4405 1 151 . 1 1 16 16 THR CA C 13 60.55 . . 1 . . . . . . . . 4405 1 152 . 1 1 16 16 THR CB C 13 71.33 . . 1 . . . . . . . . 4405 1 153 . 1 1 16 16 THR CG2 C 13 20.57 . . 1 . . . . . . . . 4405 1 154 . 1 1 16 16 THR N N 15 122.22 . . 1 . . . . . . . . 4405 1 155 . 1 1 17 17 GLN HA H 1 5.63 . . 1 . . . . . . . . 4405 1 156 . 1 1 17 17 GLN HB2 H 1 1.90 . . 1 . . . . . . . . 4405 1 157 . 1 1 17 17 GLN HB3 H 1 1.79 . . 1 . . . . . . . . 4405 1 158 . 1 1 17 17 GLN HG3 H 1 2.28 . . 1 . . . . . . . . 4405 1 159 . 1 1 17 17 GLN HG2 H 1 2.23 . . 1 . . . . . . . . 4405 1 160 . 1 1 17 17 GLN H H 1 8.15 . . 1 . . . . . . . . 4405 1 161 . 1 1 17 17 GLN HE21 H 1 7.35 . . 1 . . . . . . . . 4405 1 162 . 1 1 17 17 GLN HE22 H 1 6.78 . . 1 . . . . . . . . 4405 1 163 . 1 1 17 17 GLN C C 13 175.34 . . 1 . . . . . . . . 4405 1 164 . 1 1 17 17 GLN CA C 13 54.48 . . 1 . . . . . . . . 4405 1 165 . 1 1 17 17 GLN CB C 13 32.58 . . 1 . . . . . . . . 4405 1 166 . 1 1 17 17 GLN CG C 13 34.62 . . 1 . . . . . . . . 4405 1 167 . 1 1 17 17 GLN N N 15 121.74 . . 1 . . . . . . . . 4405 1 168 . 1 1 17 17 GLN NE2 N 15 112.32 . . 1 . . . . . . . . 4405 1 169 . 1 1 18 18 VAL HA H 1 4.46 . . 1 . . . . . . . . 4405 1 170 . 1 1 18 18 VAL HB H 1 1.95 . . 1 . . . . . . . . 4405 1 171 . 1 1 18 18 VAL HG11 H 1 0.84 . . 1 . . . . . . . . 4405 1 172 . 1 1 18 18 VAL HG12 H 1 0.84 . . 1 . . . . . . . . 4405 1 173 . 1 1 18 18 VAL HG13 H 1 0.84 . . 1 . . . . . . . . 4405 1 174 . 1 1 18 18 VAL HG21 H 1 0.80 . . 1 . . . . . . . . 4405 1 175 . 1 1 18 18 VAL HG22 H 1 0.80 . . 1 . . . . . . . . 4405 1 176 . 1 1 18 18 VAL HG23 H 1 0.80 . . 1 . . . . . . . . 4405 1 177 . 1 1 18 18 VAL H H 1 9.07 . . 1 . . . . . . . . 4405 1 178 . 1 1 18 18 VAL C C 13 173.96 . . 1 . . . . . . . . 4405 1 179 . 1 1 18 18 VAL CA C 13 60.53 . . 1 . . . . . . . . 4405 1 180 . 1 1 18 18 VAL CB C 13 35.68 . . 1 . . . . . . . . 4405 1 181 . 1 1 18 18 VAL CG1 C 13 21.43 . . 1 . . . . . . . . 4405 1 182 . 1 1 18 18 VAL CG2 C 13 20.73 . . 1 . . . . . . . . 4405 1 183 . 1 1 18 18 VAL N N 15 120.81 . . 1 . . . . . . . . 4405 1 184 . 1 1 19 19 THR HA H 1 4.97 . . 1 . . . . . . . . 4405 1 185 . 1 1 19 19 THR HB H 1 3.93 . . 1 . . . . . . . . 4405 1 186 . 1 1 19 19 THR HG21 H 1 1.03 . . 1 . . . . . . . . 4405 1 187 . 1 1 19 19 THR HG22 H 1 1.03 . . 1 . . . . . . . . 4405 1 188 . 1 1 19 19 THR HG23 H 1 1.03 . . 1 . . . . . . . . 4405 1 189 . 1 1 19 19 THR H H 1 8.49 . . 1 . . . . . . . . 4405 1 190 . 1 1 19 19 THR C C 13 174.16 . . 1 . . . . . . . . 4405 1 191 . 1 1 19 19 THR CA C 13 61.82 . . 1 . . . . . . . . 4405 1 192 . 1 1 19 19 THR CB C 13 69.77 . . 1 . . . . . . . . 4405 1 193 . 1 1 19 19 THR CG2 C 13 21.97 . . 1 . . . . . . . . 4405 1 194 . 1 1 19 19 THR N N 15 119.93 . . 1 . . . . . . . . 4405 1 195 . 1 1 20 20 ILE HA H 1 4.85 . . 1 . . . . . . . . 4405 1 196 . 1 1 20 20 ILE HB H 1 1.73 . . 1 . . . . . . . . 4405 1 197 . 1 1 20 20 ILE HD11 H 1 0.59 . . 1 . . . . . . . . 4405 1 198 . 1 1 20 20 ILE HD12 H 1 0.59 . . 1 . . . . . . . . 4405 1 199 . 1 1 20 20 ILE HD13 H 1 0.59 . . 1 . . . . . . . . 4405 1 200 . 1 1 20 20 ILE HG13 H 1 1.39 . . 1 . . . . . . . . 4405 1 201 . 1 1 20 20 ILE HG12 H 1 1.06 . . 1 . . . . . . . . 4405 1 202 . 1 1 20 20 ILE HG21 H 1 0.77 . . 1 . . . . . . . . 4405 1 203 . 1 1 20 20 ILE HG22 H 1 0.77 . . 1 . . . . . . . . 4405 1 204 . 1 1 20 20 ILE HG23 H 1 0.77 . . 1 . . . . . . . . 4405 1 205 . 1 1 20 20 ILE H H 1 9.06 . . 1 . . . . . . . . 4405 1 206 . 1 1 20 20 ILE CA C 13 56.99 . . 1 . . . . . . . . 4405 1 207 . 1 1 20 20 ILE CB C 13 40.48 . . 1 . . . . . . . . 4405 1 208 . 1 1 20 20 ILE CD1 C 13 13.58 . . 1 . . . . . . . . 4405 1 209 . 1 1 20 20 ILE CG1 C 13 26.21 . . 1 . . . . . . . . 4405 1 210 . 1 1 20 20 ILE CG2 C 13 17.84 . . 1 . . . . . . . . 4405 1 211 . 1 1 20 20 ILE N N 15 122.46 . . 1 . . . . . . . . 4405 1 212 . 1 1 21 21 PRO HA H 1 4.79 . . 1 . . . . . . . . 4405 1 213 . 1 1 21 21 PRO HB3 H 1 2.52 . . 1 . . . . . . . . 4405 1 214 . 1 1 21 21 PRO HB2 H 1 1.99 . . 1 . . . . . . . . 4405 1 215 . 1 1 21 21 PRO HD3 H 1 3.91 . . 1 . . . . . . . . 4405 1 216 . 1 1 21 21 PRO HD2 H 1 3.43 . . 1 . . . . . . . . 4405 1 217 . 1 1 21 21 PRO HG2 H 1 2.06 . . 1 . . . . . . . . 4405 1 218 . 1 1 21 21 PRO HG3 H 1 2.06 . . 1 . . . . . . . . 4405 1 219 . 1 1 21 21 PRO C C 13 178.49 . . 1 . . . . . . . . 4405 1 220 . 1 1 21 21 PRO CA C 13 62.81 . . 1 . . . . . . . . 4405 1 221 . 1 1 21 21 PRO CB C 13 33.03 . . 1 . . . . . . . . 4405 1 222 . 1 1 21 21 PRO CD C 13 51.48 . . 1 . . . . . . . . 4405 1 223 . 1 1 21 21 PRO CG C 13 28.08 . . 1 . . . . . . . . 4405 1 224 . 1 1 22 22 LYS HA H 1 3.85 . . 1 . . . . . . . . 4405 1 225 . 1 1 22 22 LYS HB3 H 1 1.72 . . 1 . . . . . . . . 4405 1 226 . 1 1 22 22 LYS HB2 H 1 1.89 . . 1 . . . . . . . . 4405 1 227 . 1 1 22 22 LYS HD2 H 1 1.67 . . 1 . . . . . . . . 4405 1 228 . 1 1 22 22 LYS HD3 H 1 1.67 . . 1 . . . . . . . . 4405 1 229 . 1 1 22 22 LYS HE2 H 1 2.98 . . 1 . . . . . . . . 4405 1 230 . 1 1 22 22 LYS HE3 H 1 2.98 . . 1 . . . . . . . . 4405 1 231 . 1 1 22 22 LYS HG2 H 1 1.39 . . 1 . . . . . . . . 4405 1 232 . 1 1 22 22 LYS HG3 H 1 1.39 . . 1 . . . . . . . . 4405 1 233 . 1 1 22 22 LYS H H 1 8.88 . . 1 . . . . . . . . 4405 1 234 . 1 1 22 22 LYS C C 13 178.10 . . 1 . . . . . . . . 4405 1 235 . 1 1 22 22 LYS CA C 13 60.44 . . 1 . . . . . . . . 4405 1 236 . 1 1 22 22 LYS CB C 13 32.93 . . 1 . . . . . . . . 4405 1 237 . 1 1 22 22 LYS CD C 13 29.83 . . 1 . . . . . . . . 4405 1 238 . 1 1 22 22 LYS CE C 13 42.13 . . 1 . . . . . . . . 4405 1 239 . 1 1 22 22 LYS CG C 13 24.42 . . 1 . . . . . . . . 4405 1 240 . 1 1 22 22 LYS N N 15 121.99 . . 1 . . . . . . . . 4405 1 241 . 1 1 23 23 ASP HA H 1 4.43 . . 1 . . . . . . . . 4405 1 242 . 1 1 23 23 ASP HB3 H 1 2.63 . . 1 . . . . . . . . 4405 1 243 . 1 1 23 23 ASP HB2 H 1 2.59 . . 1 . . . . . . . . 4405 1 244 . 1 1 23 23 ASP H H 1 9.00 . . 1 . . . . . . . . 4405 1 245 . 1 1 23 23 ASP C C 13 177.92 . . 1 . . . . . . . . 4405 1 246 . 1 1 23 23 ASP CA C 13 57.28 . . 1 . . . . . . . . 4405 1 247 . 1 1 23 23 ASP CB C 13 40.15 . . 1 . . . . . . . . 4405 1 248 . 1 1 23 23 ASP N N 15 118.24 . . 1 . . . . . . . . 4405 1 249 . 1 1 24 24 LEU HA H 1 4.25 . . 1 . . . . . . . . 4405 1 250 . 1 1 24 24 LEU HB2 H 1 1.61 . . 1 . . . . . . . . 4405 1 251 . 1 1 24 24 LEU HB3 H 1 1.61 . . 1 . . . . . . . . 4405 1 252 . 1 1 24 24 LEU HD11 H 1 0.83 . . 1 . . . . . . . . 4405 1 253 . 1 1 24 24 LEU HD12 H 1 0.83 . . 1 . . . . . . . . 4405 1 254 . 1 1 24 24 LEU HD13 H 1 0.83 . . 1 . . . . . . . . 4405 1 255 . 1 1 24 24 LEU HD21 H 1 0.78 . . 1 . . . . . . . . 4405 1 256 . 1 1 24 24 LEU HD22 H 1 0.78 . . 1 . . . . . . . . 4405 1 257 . 1 1 24 24 LEU HD23 H 1 0.78 . . 1 . . . . . . . . 4405 1 258 . 1 1 24 24 LEU HG H 1 1.53 . . 1 . . . . . . . . 4405 1 259 . 1 1 24 24 LEU H H 1 7.38 . . 1 . . . . . . . . 4405 1 260 . 1 1 24 24 LEU C C 13 178.41 . . 1 . . . . . . . . 4405 1 261 . 1 1 24 24 LEU CA C 13 56.47 . . 1 . . . . . . . . 4405 1 262 . 1 1 24 24 LEU CB C 13 42.12 . . 1 . . . . . . . . 4405 1 263 . 1 1 24 24 LEU CD1 C 13 24.60 . . 1 . . . . . . . . 4405 1 264 . 1 1 24 24 LEU CD2 C 13 24.60 . . 1 . . . . . . . . 4405 1 265 . 1 1 24 24 LEU CG C 13 27.73 . . 1 . . . . . . . . 4405 1 266 . 1 1 24 24 LEU N N 15 119.90 . . 1 . . . . . . . . 4405 1 267 . 1 1 25 25 ALA HA H 1 3.73 . . 1 . . . . . . . . 4405 1 268 . 1 1 25 25 ALA HB1 H 1 1.33 . . 1 . . . . . . . . 4405 1 269 . 1 1 25 25 ALA HB2 H 1 1.33 . . 1 . . . . . . . . 4405 1 270 . 1 1 25 25 ALA HB3 H 1 1.33 . . 1 . . . . . . . . 4405 1 271 . 1 1 25 25 ALA H H 1 8.02 . . 1 . . . . . . . . 4405 1 272 . 1 1 25 25 ALA C C 13 178.30 . . 1 . . . . . . . . 4405 1 273 . 1 1 25 25 ALA CA C 13 55.78 . . 1 . . . . . . . . 4405 1 274 . 1 1 25 25 ALA CB C 13 18.02 . . 1 . . . . . . . . 4405 1 275 . 1 1 25 25 ALA N N 15 120.77 . . 1 . . . . . . . . 4405 1 276 . 1 1 26 26 ARG HA H 1 3.96 . . 1 . . . . . . . . 4405 1 277 . 1 1 26 26 ARG HB2 H 1 1.91 . . 1 . . . . . . . . 4405 1 278 . 1 1 26 26 ARG HB3 H 1 1.91 . . 1 . . . . . . . . 4405 1 279 . 1 1 26 26 ARG HD2 H 1 3.21 . . 1 . . . . . . . . 4405 1 280 . 1 1 26 26 ARG HD3 H 1 3.21 . . 1 . . . . . . . . 4405 1 281 . 1 1 26 26 ARG HG3 H 1 1.76 . . 1 . . . . . . . . 4405 1 282 . 1 1 26 26 ARG HG2 H 1 1.63 . . 1 . . . . . . . . 4405 1 283 . 1 1 26 26 ARG H H 1 7.94 . . 1 . . . . . . . . 4405 1 284 . 1 1 26 26 ARG C C 13 178.71 . . 1 . . . . . . . . 4405 1 285 . 1 1 26 26 ARG CA C 13 59.67 . . 1 . . . . . . . . 4405 1 286 . 1 1 26 26 ARG CB C 13 29.95 . . 1 . . . . . . . . 4405 1 287 . 1 1 26 26 ARG CD C 13 43.53 . . 1 . . . . . . . . 4405 1 288 . 1 1 26 26 ARG CG C 13 27.53 . . 1 . . . . . . . . 4405 1 289 . 1 1 26 26 ARG N N 15 115.20 . . 1 . . . . . . . . 4405 1 290 . 1 1 27 27 SER HA H 1 4.21 . . 1 . . . . . . . . 4405 1 291 . 1 1 27 27 SER HB3 H 1 3.86 . . 1 . . . . . . . . 4405 1 292 . 1 1 27 27 SER HB2 H 1 3.75 . . 1 . . . . . . . . 4405 1 293 . 1 1 27 27 SER H H 1 7.50 . . 1 . . . . . . . . 4405 1 294 . 1 1 27 27 SER C C 13 175.37 . . 1 . . . . . . . . 4405 1 295 . 1 1 27 27 SER CA C 13 61.30 . . 1 . . . . . . . . 4405 1 296 . 1 1 27 27 SER CB C 13 63.38 . . 1 . . . . . . . . 4405 1 297 . 1 1 27 27 SER N N 15 113.83 . . 1 . . . . . . . . 4405 1 298 . 1 1 28 28 ILE HA H 1 3.86 . . 1 . . . . . . . . 4405 1 299 . 1 1 28 28 ILE HB H 1 1.74 . . 1 . . . . . . . . 4405 1 300 . 1 1 28 28 ILE HD11 H 1 0.68 . . 1 . . . . . . . . 4405 1 301 . 1 1 28 28 ILE HD12 H 1 0.68 . . 1 . . . . . . . . 4405 1 302 . 1 1 28 28 ILE HD13 H 1 0.68 . . 1 . . . . . . . . 4405 1 303 . 1 1 28 28 ILE HG13 H 1 1.51 . . 1 . . . . . . . . 4405 1 304 . 1 1 28 28 ILE HG12 H 1 1.11 . . 1 . . . . . . . . 4405 1 305 . 1 1 28 28 ILE HG21 H 1 0.73 . . 1 . . . . . . . . 4405 1 306 . 1 1 28 28 ILE HG22 H 1 0.73 . . 1 . . . . . . . . 4405 1 307 . 1 1 28 28 ILE HG23 H 1 0.73 . . 1 . . . . . . . . 4405 1 308 . 1 1 28 28 ILE H H 1 7.61 . . 1 . . . . . . . . 4405 1 309 . 1 1 28 28 ILE C C 13 175.41 . . 1 . . . . . . . . 4405 1 310 . 1 1 28 28 ILE CA C 13 63.84 . . 1 . . . . . . . . 4405 1 311 . 1 1 28 28 ILE CB C 13 38.68 . . 1 . . . . . . . . 4405 1 312 . 1 1 28 28 ILE CD1 C 13 14.17 . . 1 . . . . . . . . 4405 1 313 . 1 1 28 28 ILE CG1 C 13 28.53 . . 1 . . . . . . . . 4405 1 314 . 1 1 28 28 ILE CG2 C 13 17.93 . . 1 . . . . . . . . 4405 1 315 . 1 1 28 28 ILE N N 15 118.63 . . 1 . . . . . . . . 4405 1 316 . 1 1 29 29 ILE HA H 1 3.86 . . 1 . . . . . . . . 4405 1 317 . 1 1 29 29 ILE HB H 1 1.90 . . 1 . . . . . . . . 4405 1 318 . 1 1 29 29 ILE HD11 H 1 0.78 . . 1 . . . . . . . . 4405 1 319 . 1 1 29 29 ILE HD12 H 1 0.78 . . 1 . . . . . . . . 4405 1 320 . 1 1 29 29 ILE HD13 H 1 0.78 . . 1 . . . . . . . . 4405 1 321 . 1 1 29 29 ILE HG13 H 1 1.59 . . 1 . . . . . . . . 4405 1 322 . 1 1 29 29 ILE HG12 H 1 1.08 . . 1 . . . . . . . . 4405 1 323 . 1 1 29 29 ILE HG21 H 1 1.01 . . 1 . . . . . . . . 4405 1 324 . 1 1 29 29 ILE HG22 H 1 1.01 . . 1 . . . . . . . . 4405 1 325 . 1 1 29 29 ILE HG23 H 1 1.01 . . 1 . . . . . . . . 4405 1 326 . 1 1 29 29 ILE H H 1 7.83 . . 1 . . . . . . . . 4405 1 327 . 1 1 29 29 ILE C C 13 178.01 . . 1 . . . . . . . . 4405 1 328 . 1 1 29 29 ILE CA C 13 63.71 . . 1 . . . . . . . . 4405 1 329 . 1 1 29 29 ILE CB C 13 38.99 . . 1 . . . . . . . . 4405 1 330 . 1 1 29 29 ILE CD1 C 13 13.64 . . 1 . . . . . . . . 4405 1 331 . 1 1 29 29 ILE CG1 C 13 28.61 . . 1 . . . . . . . . 4405 1 332 . 1 1 29 29 ILE CG2 C 13 18.06 . . 1 . . . . . . . . 4405 1 333 . 1 1 29 29 ILE N N 15 115.78 . . 1 . . . . . . . . 4405 1 334 . 1 1 30 30 GLY HA2 H 1 4.05 . . 1 . . . . . . . . 4405 1 335 . 1 1 30 30 GLY HA3 H 1 4.05 . . 1 . . . . . . . . 4405 1 336 . 1 1 30 30 GLY H H 1 7.56 . . 1 . . . . . . . . 4405 1 337 . 1 1 30 30 GLY C C 13 174.24 . . 1 . . . . . . . . 4405 1 338 . 1 1 30 30 GLY CA C 13 44.79 . . 1 . . . . . . . . 4405 1 339 . 1 1 30 30 GLY N N 15 105.70 . . 1 . . . . . . . . 4405 1 340 . 1 1 31 31 LYS HA H 1 4.14 . . 1 . . . . . . . . 4405 1 341 . 1 1 31 31 LYS HB2 H 1 1.86 . . 1 . . . . . . . . 4405 1 342 . 1 1 31 31 LYS HB3 H 1 1.86 . . 1 . . . . . . . . 4405 1 343 . 1 1 31 31 LYS HD2 H 1 1.69 . . 1 . . . . . . . . 4405 1 344 . 1 1 31 31 LYS HD3 H 1 1.69 . . 1 . . . . . . . . 4405 1 345 . 1 1 31 31 LYS HE2 H 1 2.98 . . 1 . . . . . . . . 4405 1 346 . 1 1 31 31 LYS HE3 H 1 2.98 . . 1 . . . . . . . . 4405 1 347 . 1 1 31 31 LYS HG3 H 1 1.49 . . 1 . . . . . . . . 4405 1 348 . 1 1 31 31 LYS HG2 H 1 1.39 . . 1 . . . . . . . . 4405 1 349 . 1 1 31 31 LYS H H 1 8.86 . . 1 . . . . . . . . 4405 1 350 . 1 1 31 31 LYS CA C 13 57.80 . . 1 . . . . . . . . 4405 1 351 . 1 1 31 31 LYS CB C 13 31.62 . . 1 . . . . . . . . 4405 1 352 . 1 1 31 31 LYS CD C 13 29.34 . . 1 . . . . . . . . 4405 1 353 . 1 1 31 31 LYS CE C 13 42.12 . . 1 . . . . . . . . 4405 1 354 . 1 1 31 31 LYS CG C 13 25.11 . . 1 . . . . . . . . 4405 1 355 . 1 1 31 31 LYS N N 15 121.91 . . 1 . . . . . . . . 4405 1 356 . 1 1 32 32 GLY HA2 H 1 3.98 . . 1 . . . . . . . . 4405 1 357 . 1 1 32 32 GLY HA3 H 1 3.98 . . 1 . . . . . . . . 4405 1 358 . 1 1 32 32 GLY H H 1 9.02 . . 1 . . . . . . . . 4405 1 359 . 1 1 32 32 GLY C C 13 175.39 . . 1 . . . . . . . . 4405 1 360 . 1 1 32 32 GLY CA C 13 46.43 . . 1 . . . . . . . . 4405 1 361 . 1 1 32 32 GLY N N 15 112.59 . . 1 . . . . . . . . 4405 1 362 . 1 1 33 33 GLY HA3 H 1 4.03 . . 1 . . . . . . . . 4405 1 363 . 1 1 33 33 GLY HA2 H 1 3.89 . . 1 . . . . . . . . 4405 1 364 . 1 1 33 33 GLY H H 1 7.91 . . 1 . . . . . . . . 4405 1 365 . 1 1 33 33 GLY C C 13 176.05 . . 1 . . . . . . . . 4405 1 366 . 1 1 33 33 GLY CA C 13 46.34 . . 1 . . . . . . . . 4405 1 367 . 1 1 33 33 GLY N N 15 106.97 . . 1 . . . . . . . . 4405 1 368 . 1 1 34 34 GLN HA H 1 3.98 . . 1 . . . . . . . . 4405 1 369 . 1 1 34 34 GLN HB3 H 1 2.16 . . 1 . . . . . . . . 4405 1 370 . 1 1 34 34 GLN HB2 H 1 2.25 . . 1 . . . . . . . . 4405 1 371 . 1 1 34 34 GLN HG2 H 1 2.46 . . 1 . . . . . . . . 4405 1 372 . 1 1 34 34 GLN HG3 H 1 2.46 . . 1 . . . . . . . . 4405 1 373 . 1 1 34 34 GLN H H 1 7.82 . . 1 . . . . . . . . 4405 1 374 . 1 1 34 34 GLN C C 13 177.99 . . 1 . . . . . . . . 4405 1 375 . 1 1 34 34 GLN CA C 13 59.42 . . 1 . . . . . . . . 4405 1 376 . 1 1 34 34 GLN CB C 13 28.97 . . 1 . . . . . . . . 4405 1 377 . 1 1 34 34 GLN CG C 13 33.83 . . 1 . . . . . . . . 4405 1 378 . 1 1 34 34 GLN N N 15 118.21 . . 1 . . . . . . . . 4405 1 379 . 1 1 35 35 ARG HA H 1 4.28 . . 1 . . . . . . . . 4405 1 380 . 1 1 35 35 ARG HB2 H 1 1.89 . . 1 . . . . . . . . 4405 1 381 . 1 1 35 35 ARG HB3 H 1 1.89 . . 1 . . . . . . . . 4405 1 382 . 1 1 35 35 ARG H H 1 8.48 . . 1 . . . . . . . . 4405 1 383 . 1 1 35 35 ARG HD3 H 1 3.38 . . 1 . . . . . . . . 4405 1 384 . 1 1 35 35 ARG HD2 H 1 3.19 . . 1 . . . . . . . . 4405 1 385 . 1 1 35 35 ARG HG3 H 1 1.78 . . 1 . . . . . . . . 4405 1 386 . 1 1 35 35 ARG HG2 H 1 1.59 . . 1 . . . . . . . . 4405 1 387 . 1 1 35 35 ARG C C 13 178.47 . . 1 . . . . . . . . 4405 1 388 . 1 1 35 35 ARG CA C 13 58.55 . . 1 . . . . . . . . 4405 1 389 . 1 1 35 35 ARG CB C 13 29.05 . . 1 . . . . . . . . 4405 1 390 . 1 1 35 35 ARG CD C 13 42.91 . . 1 . . . . . . . . 4405 1 391 . 1 1 35 35 ARG CG C 13 27.13 . . 1 . . . . . . . . 4405 1 392 . 1 1 35 35 ARG N N 15 119.08 . . 1 . . . . . . . . 4405 1 393 . 1 1 36 36 ILE HA H 1 3.90 . . 1 . . . . . . . . 4405 1 394 . 1 1 36 36 ILE HB H 1 2.02 . . 1 . . . . . . . . 4405 1 395 . 1 1 36 36 ILE HD11 H 1 0.73 . . 1 . . . . . . . . 4405 1 396 . 1 1 36 36 ILE HD12 H 1 0.73 . . 1 . . . . . . . . 4405 1 397 . 1 1 36 36 ILE HD13 H 1 0.73 . . 1 . . . . . . . . 4405 1 398 . 1 1 36 36 ILE HG13 H 1 1.37 . . 1 . . . . . . . . 4405 1 399 . 1 1 36 36 ILE HG12 H 1 1.28 . . 1 . . . . . . . . 4405 1 400 . 1 1 36 36 ILE HG21 H 1 0.99 . . 1 . . . . . . . . 4405 1 401 . 1 1 36 36 ILE HG22 H 1 0.99 . . 1 . . . . . . . . 4405 1 402 . 1 1 36 36 ILE HG23 H 1 0.99 . . 1 . . . . . . . . 4405 1 403 . 1 1 36 36 ILE H H 1 7.59 . . 1 . . . . . . . . 4405 1 404 . 1 1 36 36 ILE C C 13 177.18 . . 1 . . . . . . . . 4405 1 405 . 1 1 36 36 ILE CA C 13 63.19 . . 1 . . . . . . . . 4405 1 406 . 1 1 36 36 ILE CB C 13 36.98 . . 1 . . . . . . . . 4405 1 407 . 1 1 36 36 ILE CD1 C 13 12.76 . . 1 . . . . . . . . 4405 1 408 . 1 1 36 36 ILE CG1 C 13 28.91 . . 1 . . . . . . . . 4405 1 409 . 1 1 36 36 ILE CG2 C 13 17.98 . . 1 . . . . . . . . 4405 1 410 . 1 1 36 36 ILE N N 15 118.69 . . 1 . . . . . . . . 4405 1 411 . 1 1 37 37 LYS HA H 1 3.99 . . 1 . . . . . . . . 4405 1 412 . 1 1 37 37 LYS HB2 H 1 1.93 . . 1 . . . . . . . . 4405 1 413 . 1 1 37 37 LYS HB3 H 1 1.93 . . 1 . . . . . . . . 4405 1 414 . 1 1 37 37 LYS HD2 H 1 1.68 . . 1 . . . . . . . . 4405 1 415 . 1 1 37 37 LYS HD3 H 1 1.68 . . 1 . . . . . . . . 4405 1 416 . 1 1 37 37 LYS HE2 H 1 2.98 . . 1 . . . . . . . . 4405 1 417 . 1 1 37 37 LYS HE3 H 1 2.98 . . 1 . . . . . . . . 4405 1 418 . 1 1 37 37 LYS HG3 H 1 1.59 . . 1 . . . . . . . . 4405 1 419 . 1 1 37 37 LYS HG2 H 1 1.39 . . 1 . . . . . . . . 4405 1 420 . 1 1 37 37 LYS H H 1 7.72 . . 1 . . . . . . . . 4405 1 421 . 1 1 37 37 LYS C C 13 179.06 . . 1 . . . . . . . . 4405 1 422 . 1 1 37 37 LYS CA C 13 60.55 . . 1 . . . . . . . . 4405 1 423 . 1 1 37 37 LYS CB C 13 32.56 . . 1 . . . . . . . . 4405 1 424 . 1 1 37 37 LYS CD C 13 29.82 . . 1 . . . . . . . . 4405 1 425 . 1 1 37 37 LYS CE C 13 42.13 . . 1 . . . . . . . . 4405 1 426 . 1 1 37 37 LYS CG C 13 25.64 . . 1 . . . . . . . . 4405 1 427 . 1 1 37 37 LYS N N 15 121.39 . . 1 . . . . . . . . 4405 1 428 . 1 1 38 38 GLN HA H 1 4.23 . . 1 . . . . . . . . 4405 1 429 . 1 1 38 38 GLN HB2 H 1 2.31 . . 1 . . . . . . . . 4405 1 430 . 1 1 38 38 GLN HB3 H 1 2.31 . . 1 . . . . . . . . 4405 1 431 . 1 1 38 38 GLN HG3 H 1 2.58 . . 1 . . . . . . . . 4405 1 432 . 1 1 38 38 GLN HG2 H 1 2.40 . . 1 . . . . . . . . 4405 1 433 . 1 1 38 38 GLN H H 1 7.82 . . 1 . . . . . . . . 4405 1 434 . 1 1 38 38 GLN HE21 H 1 7.82 . . 1 . . . . . . . . 4405 1 435 . 1 1 38 38 GLN HE22 H 1 6.80 . . 1 . . . . . . . . 4405 1 436 . 1 1 38 38 GLN C C 13 178.19 . . 1 . . . . . . . . 4405 1 437 . 1 1 38 38 GLN CA C 13 59.16 . . 1 . . . . . . . . 4405 1 438 . 1 1 38 38 GLN CB C 13 28.18 . . 1 . . . . . . . . 4405 1 439 . 1 1 38 38 GLN CG C 13 33.30 . . 1 . . . . . . . . 4405 1 440 . 1 1 38 38 GLN N N 15 120.10 . . 1 . . . . . . . . 4405 1 441 . 1 1 38 38 GLN NE2 N 15 111.49 . . 1 . . . . . . . . 4405 1 442 . 1 1 39 39 ILE HG13 H 1 2.00 . . 1 . . . . . . . . 4405 1 443 . 1 1 39 39 ILE HG12 H 1 0.94 . . 1 . . . . . . . . 4405 1 444 . 1 1 39 39 ILE HA H 1 3.70 . . 1 . . . . . . . . 4405 1 445 . 1 1 39 39 ILE HB H 1 1.82 . . 1 . . . . . . . . 4405 1 446 . 1 1 39 39 ILE HD11 H 1 0.71 . . 1 . . . . . . . . 4405 1 447 . 1 1 39 39 ILE HD12 H 1 0.71 . . 1 . . . . . . . . 4405 1 448 . 1 1 39 39 ILE HD13 H 1 0.71 . . 1 . . . . . . . . 4405 1 449 . 1 1 39 39 ILE HG21 H 1 0.87 . . 1 . . . . . . . . 4405 1 450 . 1 1 39 39 ILE HG22 H 1 0.87 . . 1 . . . . . . . . 4405 1 451 . 1 1 39 39 ILE HG23 H 1 0.87 . . 1 . . . . . . . . 4405 1 452 . 1 1 39 39 ILE H H 1 8.46 . . 1 . . . . . . . . 4405 1 453 . 1 1 39 39 ILE C C 13 180.28 . . 1 . . . . . . . . 4405 1 454 . 1 1 39 39 ILE CA C 13 66.11 . . 1 . . . . . . . . 4405 1 455 . 1 1 39 39 ILE CB C 13 38.30 . . 1 . . . . . . . . 4405 1 456 . 1 1 39 39 ILE CG2 C 13 17.37 . . 1 . . . . . . . . 4405 1 457 . 1 1 39 39 ILE CD1 C 13 13.79 . . 1 . . . . . . . . 4405 1 458 . 1 1 39 39 ILE CG1 C 13 29.23 . . 1 . . . . . . . . 4405 1 459 . 1 1 39 39 ILE N N 15 119.86 . . 1 . . . . . . . . 4405 1 460 . 1 1 40 40 ARG HA H 1 4.07 . . 1 . . . . . . . . 4405 1 461 . 1 1 40 40 ARG HD2 H 1 3.24 . . 1 . . . . . . . . 4405 1 462 . 1 1 40 40 ARG HD3 H 1 3.24 . . 1 . . . . . . . . 4405 1 463 . 1 1 40 40 ARG H H 1 8.67 . . 1 . . . . . . . . 4405 1 464 . 1 1 40 40 ARG HB2 H 1 2.02 . . 1 . . . . . . . . 4405 1 465 . 1 1 40 40 ARG HB3 H 1 2.10 . . 1 . . . . . . . . 4405 1 466 . 1 1 40 40 ARG HG3 H 1 1.89 . . 1 . . . . . . . . 4405 1 467 . 1 1 40 40 ARG HG2 H 1 1.70 . . 1 . . . . . . . . 4405 1 468 . 1 1 40 40 ARG C C 13 178.09 . . 1 . . . . . . . . 4405 1 469 . 1 1 40 40 ARG CA C 13 60.44 . . 1 . . . . . . . . 4405 1 470 . 1 1 40 40 ARG CB C 13 30.81 . . 1 . . . . . . . . 4405 1 471 . 1 1 40 40 ARG CD C 13 44.43 . . 1 . . . . . . . . 4405 1 472 . 1 1 40 40 ARG CG C 13 28.84 . . 1 . . . . . . . . 4405 1 473 . 1 1 40 40 ARG N N 15 123.55 . . 1 . . . . . . . . 4405 1 474 . 1 1 41 41 HIS HA H 1 4.33 . . 1 . . . . . . . . 4405 1 475 . 1 1 41 41 HIS HB2 H 1 3.36 . . 1 . . . . . . . . 4405 1 476 . 1 1 41 41 HIS HB3 H 1 3.36 . . 1 . . . . . . . . 4405 1 477 . 1 1 41 41 HIS H H 1 8.01 . . 1 . . . . . . . . 4405 1 478 . 1 1 41 41 HIS C C 13 177.10 . . 1 . . . . . . . . 4405 1 479 . 1 1 41 41 HIS CA C 13 59.30 . . 1 . . . . . . . . 4405 1 480 . 1 1 41 41 HIS CB C 13 29.40 . . 1 . . . . . . . . 4405 1 481 . 1 1 41 41 HIS N N 15 117.29 . . 1 . . . . . . . . 4405 1 482 . 1 1 42 42 GLU HA H 1 3.97 . . 1 . . . . . . . . 4405 1 483 . 1 1 42 42 GLU HB2 H 1 2.02 . . 1 . . . . . . . . 4405 1 484 . 1 1 42 42 GLU HB3 H 1 2.02 . . 1 . . . . . . . . 4405 1 485 . 1 1 42 42 GLU HG3 H 1 2.51 . . 1 . . . . . . . . 4405 1 486 . 1 1 42 42 GLU HG2 H 1 2.34 . . 1 . . . . . . . . 4405 1 487 . 1 1 42 42 GLU H H 1 8.79 . . 1 . . . . . . . . 4405 1 488 . 1 1 42 42 GLU C C 13 177.93 . . 1 . . . . . . . . 4405 1 489 . 1 1 42 42 GLU CA C 13 59.03 . . 1 . . . . . . . . 4405 1 490 . 1 1 42 42 GLU CB C 13 30.55 . . 1 . . . . . . . . 4405 1 491 . 1 1 42 42 GLU CG C 13 36.89 . . 1 . . . . . . . . 4405 1 492 . 1 1 42 42 GLU N N 15 116.75 . . 1 . . . . . . . . 4405 1 493 . 1 1 43 43 SER HA H 1 4.40 . . 1 . . . . . . . . 4405 1 494 . 1 1 43 43 SER HB3 H 1 4.22 . . 1 . . . . . . . . 4405 1 495 . 1 1 43 43 SER HB2 H 1 3.71 . . 1 . . . . . . . . 4405 1 496 . 1 1 43 43 SER H H 1 8.21 . . 1 . . . . . . . . 4405 1 497 . 1 1 43 43 SER C C 13 175.36 . . 1 . . . . . . . . 4405 1 498 . 1 1 43 43 SER CA C 13 60.27 . . 1 . . . . . . . . 4405 1 499 . 1 1 43 43 SER CB C 13 65.59 . . 1 . . . . . . . . 4405 1 500 . 1 1 43 43 SER N N 15 110.26 . . 1 . . . . . . . . 4405 1 501 . 1 1 44 44 GLY HA3 H 1 4.30 . . 1 . . . . . . . . 4405 1 502 . 1 1 44 44 GLY HA2 H 1 3.76 . . 1 . . . . . . . . 4405 1 503 . 1 1 44 44 GLY H H 1 7.83 . . 1 . . . . . . . . 4405 1 504 . 1 1 44 44 GLY C C 13 173.03 . . 1 . . . . . . . . 4405 1 505 . 1 1 44 44 GLY CA C 13 45.65 . . 1 . . . . . . . . 4405 1 506 . 1 1 44 44 GLY N N 15 110.36 . . 1 . . . . . . . . 4405 1 507 . 1 1 45 45 ALA HA H 1 4.36 . . 1 . . . . . . . . 4405 1 508 . 1 1 45 45 ALA HB1 H 1 1.04 . . 1 . . . . . . . . 4405 1 509 . 1 1 45 45 ALA HB2 H 1 1.04 . . 1 . . . . . . . . 4405 1 510 . 1 1 45 45 ALA HB3 H 1 1.04 . . 1 . . . . . . . . 4405 1 511 . 1 1 45 45 ALA H H 1 7.94 . . 1 . . . . . . . . 4405 1 512 . 1 1 45 45 ALA C C 13 177.07 . . 1 . . . . . . . . 4405 1 513 . 1 1 45 45 ALA CA C 13 51.30 . . 1 . . . . . . . . 4405 1 514 . 1 1 45 45 ALA CB C 13 19.83 . . 1 . . . . . . . . 4405 1 515 . 1 1 45 45 ALA N N 15 120.82 . . 1 . . . . . . . . 4405 1 516 . 1 1 46 46 SER HA H 1 4.65 . . 1 . . . . . . . . 4405 1 517 . 1 1 46 46 SER HB2 H 1 3.84 . . 1 . . . . . . . . 4405 1 518 . 1 1 46 46 SER HB3 H 1 3.84 . . 1 . . . . . . . . 4405 1 519 . 1 1 46 46 SER H H 1 8.66 . . 1 . . . . . . . . 4405 1 520 . 1 1 46 46 SER C C 13 174.51 . . 1 . . . . . . . . 4405 1 521 . 1 1 46 46 SER CA C 13 57.89 . . 1 . . . . . . . . 4405 1 522 . 1 1 46 46 SER CB C 13 63.49 . . 1 . . . . . . . . 4405 1 523 . 1 1 46 46 SER N N 15 114.77 . . 1 . . . . . . . . 4405 1 524 . 1 1 47 47 ILE HA H 1 4.98 . . 1 . . . . . . . . 4405 1 525 . 1 1 47 47 ILE HB H 1 1.45 . . 1 . . . . . . . . 4405 1 526 . 1 1 47 47 ILE HD11 H 1 0.69 . . 1 . . . . . . . . 4405 1 527 . 1 1 47 47 ILE HD12 H 1 0.69 . . 1 . . . . . . . . 4405 1 528 . 1 1 47 47 ILE HD13 H 1 0.69 . . 1 . . . . . . . . 4405 1 529 . 1 1 47 47 ILE HG13 H 1 1.47 . . 1 . . . . . . . . 4405 1 530 . 1 1 47 47 ILE HG12 H 1 0.85 . . 1 . . . . . . . . 4405 1 531 . 1 1 47 47 ILE HG21 H 1 0.68 . . 1 . . . . . . . . 4405 1 532 . 1 1 47 47 ILE HG22 H 1 0.68 . . 1 . . . . . . . . 4405 1 533 . 1 1 47 47 ILE HG23 H 1 0.68 . . 1 . . . . . . . . 4405 1 534 . 1 1 47 47 ILE H H 1 8.16 . . 1 . . . . . . . . 4405 1 535 . 1 1 47 47 ILE C C 13 173.96 . . 1 . . . . . . . . 4405 1 536 . 1 1 47 47 ILE CA C 13 60.52 . . 1 . . . . . . . . 4405 1 537 . 1 1 47 47 ILE CB C 13 41.61 . . 1 . . . . . . . . 4405 1 538 . 1 1 47 47 ILE CD1 C 13 14.61 . . 1 . . . . . . . . 4405 1 539 . 1 1 47 47 ILE CG1 C 13 27.61 . . 1 . . . . . . . . 4405 1 540 . 1 1 47 47 ILE CG2 C 13 18.01 . . 1 . . . . . . . . 4405 1 541 . 1 1 47 47 ILE N N 15 124.37 . . 1 . . . . . . . . 4405 1 542 . 1 1 48 48 LYS HA H 1 4.69 . . 1 . . . . . . . . 4405 1 543 . 1 1 48 48 LYS HB3 H 1 1.72 . . 1 . . . . . . . . 4405 1 544 . 1 1 48 48 LYS HB2 H 1 1.68 . . 1 . . . . . . . . 4405 1 545 . 1 1 48 48 LYS HD2 H 1 1.63 . . 1 . . . . . . . . 4405 1 546 . 1 1 48 48 LYS HD3 H 1 1.63 . . 1 . . . . . . . . 4405 1 547 . 1 1 48 48 LYS HE2 H 1 2.92 . . 1 . . . . . . . . 4405 1 548 . 1 1 48 48 LYS HE3 H 1 2.92 . . 1 . . . . . . . . 4405 1 549 . 1 1 48 48 LYS HG3 H 1 1.37 . . 1 . . . . . . . . 4405 1 550 . 1 1 48 48 LYS HG2 H 1 1.31 . . 1 . . . . . . . . 4405 1 551 . 1 1 48 48 LYS H H 1 8.86 . . 1 . . . . . . . . 4405 1 552 . 1 1 48 48 LYS C C 13 173.96 . . 1 . . . . . . . . 4405 1 553 . 1 1 48 48 LYS CA C 13 54.77 . . 1 . . . . . . . . 4405 1 554 . 1 1 48 48 LYS CB C 13 35.99 . . 1 . . . . . . . . 4405 1 555 . 1 1 48 48 LYS CD C 13 29.47 . . 1 . . . . . . . . 4405 1 556 . 1 1 48 48 LYS CE C 13 41.99 . . 1 . . . . . . . . 4405 1 557 . 1 1 48 48 LYS CG C 13 24.78 . . 1 . . . . . . . . 4405 1 558 . 1 1 48 48 LYS N N 15 128.43 . . 1 . . . . . . . . 4405 1 559 . 1 1 49 49 ILE HA H 1 4.69 . . 1 . . . . . . . . 4405 1 560 . 1 1 49 49 ILE HB H 1 1.69 . . 1 . . . . . . . . 4405 1 561 . 1 1 49 49 ILE HD11 H 1 0.75 . . 1 . . . . . . . . 4405 1 562 . 1 1 49 49 ILE HD12 H 1 0.75 . . 1 . . . . . . . . 4405 1 563 . 1 1 49 49 ILE HD13 H 1 0.75 . . 1 . . . . . . . . 4405 1 564 . 1 1 49 49 ILE HG13 H 1 1.47 . . 1 . . . . . . . . 4405 1 565 . 1 1 49 49 ILE HG12 H 1 1.00 . . 1 . . . . . . . . 4405 1 566 . 1 1 49 49 ILE HG21 H 1 0.83 . . 1 . . . . . . . . 4405 1 567 . 1 1 49 49 ILE HG22 H 1 0.83 . . 1 . . . . . . . . 4405 1 568 . 1 1 49 49 ILE HG23 H 1 0.83 . . 1 . . . . . . . . 4405 1 569 . 1 1 49 49 ILE H H 1 8.75 . . 1 . . . . . . . . 4405 1 570 . 1 1 49 49 ILE C C 13 175.04 . . 1 . . . . . . . . 4405 1 571 . 1 1 49 49 ILE CA C 13 60.44 . . 1 . . . . . . . . 4405 1 572 . 1 1 49 49 ILE CB C 13 39.53 . . 1 . . . . . . . . 4405 1 573 . 1 1 49 49 ILE CD1 C 13 14.09 . . 1 . . . . . . . . 4405 1 574 . 1 1 49 49 ILE CG1 C 13 28.00 . . 1 . . . . . . . . 4405 1 575 . 1 1 49 49 ILE CG2 C 13 17.24 . . 1 . . . . . . . . 4405 1 576 . 1 1 49 49 ILE N N 15 123.62 . . 1 . . . . . . . . 4405 1 577 . 1 1 50 50 ASP HA H 1 4.77 . . 1 . . . . . . . . 4405 1 578 . 1 1 50 50 ASP HB3 H 1 2.79 . . 1 . . . . . . . . 4405 1 579 . 1 1 50 50 ASP HB2 H 1 2.70 . . 1 . . . . . . . . 4405 1 580 . 1 1 50 50 ASP H H 1 8.44 . . 1 . . . . . . . . 4405 1 581 . 1 1 50 50 ASP C C 13 176.41 . . 1 . . . . . . . . 4405 1 582 . 1 1 50 50 ASP CA C 13 54.32 . . 1 . . . . . . . . 4405 1 583 . 1 1 50 50 ASP CB C 13 42.52 . . 1 . . . . . . . . 4405 1 584 . 1 1 50 50 ASP N N 15 128.31 . . 1 . . . . . . . . 4405 1 585 . 1 1 51 51 GLU HA H 1 4.44 . . 1 . . . . . . . . 4405 1 586 . 1 1 51 51 GLU HB2 H 1 1.81 . . 1 . . . . . . . . 4405 1 587 . 1 1 51 51 GLU HB3 H 1 2.10 . . 1 . . . . . . . . 4405 1 588 . 1 1 51 51 GLU HG3 H 1 2.37 . . 1 . . . . . . . . 4405 1 589 . 1 1 51 51 GLU HG2 H 1 2.32 . . 1 . . . . . . . . 4405 1 590 . 1 1 51 51 GLU H H 1 8.61 . . 1 . . . . . . . . 4405 1 591 . 1 1 51 51 GLU CA C 13 54.72 . . 1 . . . . . . . . 4405 1 592 . 1 1 51 51 GLU CB C 13 28.98 . . 1 . . . . . . . . 4405 1 593 . 1 1 51 51 GLU CG C 13 36.15 . . 1 . . . . . . . . 4405 1 594 . 1 1 51 51 GLU N N 15 120.45 . . 1 . . . . . . . . 4405 1 595 . 1 1 52 52 PRO HA H 1 4.42 . . 1 . . . . . . . . 4405 1 596 . 1 1 52 52 PRO HB3 H 1 2.14 . . 1 . . . . . . . . 4405 1 597 . 1 1 52 52 PRO HB2 H 1 1.93 . . 1 . . . . . . . . 4405 1 598 . 1 1 52 52 PRO HD3 H 1 3.72 . . 1 . . . . . . . . 4405 1 599 . 1 1 52 52 PRO HD2 H 1 3.59 . . 1 . . . . . . . . 4405 1 600 . 1 1 52 52 PRO HG3 H 1 2.09 . . 1 . . . . . . . . 4405 1 601 . 1 1 52 52 PRO HG2 H 1 1.81 . . 1 . . . . . . . . 4405 1 602 . 1 1 52 52 PRO C C 13 176.65 . . 1 . . . . . . . . 4405 1 603 . 1 1 52 52 PRO CA C 13 63.30 . . 1 . . . . . . . . 4405 1 604 . 1 1 52 52 PRO CB C 13 32.11 . . 1 . . . . . . . . 4405 1 605 . 1 1 52 52 PRO CD C 13 50.65 . . 1 . . . . . . . . 4405 1 606 . 1 1 52 52 PRO CG C 13 27.75 . . 1 . . . . . . . . 4405 1 607 . 1 1 53 53 LEU HA H 1 4.35 . . 1 . . . . . . . . 4405 1 608 . 1 1 53 53 LEU HB2 H 1 1.57 . . 1 . . . . . . . . 4405 1 609 . 1 1 53 53 LEU HB3 H 1 1.57 . . 1 . . . . . . . . 4405 1 610 . 1 1 53 53 LEU HD11 H 1 0.90 . . 1 . . . . . . . . 4405 1 611 . 1 1 53 53 LEU HD12 H 1 0.90 . . 1 . . . . . . . . 4405 1 612 . 1 1 53 53 LEU HD13 H 1 0.90 . . 1 . . . . . . . . 4405 1 613 . 1 1 53 53 LEU HD21 H 1 0.90 . . 1 . . . . . . . . 4405 1 614 . 1 1 53 53 LEU HD22 H 1 0.90 . . 1 . . . . . . . . 4405 1 615 . 1 1 53 53 LEU HD23 H 1 0.90 . . 1 . . . . . . . . 4405 1 616 . 1 1 53 53 LEU HG H 1 1.71 . . 1 . . . . . . . . 4405 1 617 . 1 1 53 53 LEU H H 1 8.47 . . 1 . . . . . . . . 4405 1 618 . 1 1 53 53 LEU C C 13 177.43 . . 1 . . . . . . . . 4405 1 619 . 1 1 53 53 LEU CA C 13 54.77 . . 1 . . . . . . . . 4405 1 620 . 1 1 53 53 LEU CB C 13 43.01 . . 1 . . . . . . . . 4405 1 621 . 1 1 53 53 LEU CD1 C 13 23.67 . . 1 . . . . . . . . 4405 1 622 . 1 1 53 53 LEU CD2 C 13 25.19 . . 1 . . . . . . . . 4405 1 623 . 1 1 53 53 LEU CG C 13 27.28 . . 1 . . . . . . . . 4405 1 624 . 1 1 53 53 LEU N N 15 123.37 . . 1 . . . . . . . . 4405 1 625 . 1 1 54 54 GLU HA H 1 4.09 . . 1 . . . . . . . . 4405 1 626 . 1 1 54 54 GLU HB2 H 1 1.98 . . 1 . . . . . . . . 4405 1 627 . 1 1 54 54 GLU HB3 H 1 1.98 . . 1 . . . . . . . . 4405 1 628 . 1 1 54 54 GLU HG2 H 1 2.26 . . 1 . . . . . . . . 4405 1 629 . 1 1 54 54 GLU HG3 H 1 2.26 . . 1 . . . . . . . . 4405 1 630 . 1 1 54 54 GLU H H 1 8.55 . . 1 . . . . . . . . 4405 1 631 . 1 1 54 54 GLU C C 13 177.55 . . 1 . . . . . . . . 4405 1 632 . 1 1 54 54 GLU CA C 13 57.96 . . 1 . . . . . . . . 4405 1 633 . 1 1 54 54 GLU CB C 13 29.53 . . 1 . . . . . . . . 4405 1 634 . 1 1 54 54 GLU CG C 13 36.13 . . 1 . . . . . . . . 4405 1 635 . 1 1 54 54 GLU N N 15 122.08 . . 1 . . . . . . . . 4405 1 636 . 1 1 55 55 GLY HA3 H 1 4.16 . . 1 . . . . . . . . 4405 1 637 . 1 1 55 55 GLY HA2 H 1 3.75 . . 1 . . . . . . . . 4405 1 638 . 1 1 55 55 GLY H H 1 8.75 . . 1 . . . . . . . . 4405 1 639 . 1 1 55 55 GLY C C 13 174.08 . . 1 . . . . . . . . 4405 1 640 . 1 1 55 55 GLY CA C 13 45.76 . . 1 . . . . . . . . 4405 1 641 . 1 1 55 55 GLY N N 15 112.11 . . 1 . . . . . . . . 4405 1 642 . 1 1 56 56 SER HA H 1 4.57 . . 1 . . . . . . . . 4405 1 643 . 1 1 56 56 SER HB2 H 1 3.86 . . 1 . . . . . . . . 4405 1 644 . 1 1 56 56 SER HB3 H 1 3.86 . . 1 . . . . . . . . 4405 1 645 . 1 1 56 56 SER H H 1 7.93 . . 1 . . . . . . . . 4405 1 646 . 1 1 56 56 SER C C 13 174.85 . . 1 . . . . . . . . 4405 1 647 . 1 1 56 56 SER CA C 13 57.80 . . 1 . . . . . . . . 4405 1 648 . 1 1 56 56 SER CB C 13 64.74 . . 1 . . . . . . . . 4405 1 649 . 1 1 56 56 SER N N 15 114.50 . . 1 . . . . . . . . 4405 1 650 . 1 1 57 57 GLU HA H 1 4.39 . . 1 . . . . . . . . 4405 1 651 . 1 1 57 57 GLU HB2 H 1 1.93 . . 1 . . . . . . . . 4405 1 652 . 1 1 57 57 GLU HB3 H 1 2.31 . . 1 . . . . . . . . 4405 1 653 . 1 1 57 57 GLU HG3 H 1 2.32 . . 1 . . . . . . . . 4405 1 654 . 1 1 57 57 GLU HG2 H 1 2.22 . . 1 . . . . . . . . 4405 1 655 . 1 1 57 57 GLU H H 1 8.68 . . 1 . . . . . . . . 4405 1 656 . 1 1 57 57 GLU C C 13 175.57 . . 1 . . . . . . . . 4405 1 657 . 1 1 57 57 GLU CA C 13 56.70 . . 1 . . . . . . . . 4405 1 658 . 1 1 57 57 GLU CB C 13 30.25 . . 1 . . . . . . . . 4405 1 659 . 1 1 57 57 GLU CG C 13 36.55 . . 1 . . . . . . . . 4405 1 660 . 1 1 57 57 GLU N N 15 121.76 . . 1 . . . . . . . . 4405 1 661 . 1 1 58 58 ASP HA H 1 4.93 . . 1 . . . . . . . . 4405 1 662 . 1 1 58 58 ASP HB2 H 1 2.35 . . 1 . . . . . . . . 4405 1 663 . 1 1 58 58 ASP HB3 H 1 2.45 . . 1 . . . . . . . . 4405 1 664 . 1 1 58 58 ASP H H 1 8.12 . . 1 . . . . . . . . 4405 1 665 . 1 1 58 58 ASP C C 13 175.83 . . 1 . . . . . . . . 4405 1 666 . 1 1 58 58 ASP CA C 13 54.31 . . 1 . . . . . . . . 4405 1 667 . 1 1 58 58 ASP CB C 13 43.05 . . 1 . . . . . . . . 4405 1 668 . 1 1 58 58 ASP N N 15 119.35 . . 1 . . . . . . . . 4405 1 669 . 1 1 59 59 ARG HD2 H 1 3.12 . . 1 . . . . . . . . 4405 1 670 . 1 1 59 59 ARG HD3 H 1 3.12 . . 1 . . . . . . . . 4405 1 671 . 1 1 59 59 ARG HA H 1 4.67 . . 1 . . . . . . . . 4405 1 672 . 1 1 59 59 ARG HB2 H 1 1.38 . . 1 . . . . . . . . 4405 1 673 . 1 1 59 59 ARG HB3 H 1 1.69 . . 1 . . . . . . . . 4405 1 674 . 1 1 59 59 ARG H H 1 8.86 . . 1 . . . . . . . . 4405 1 675 . 1 1 59 59 ARG HG2 H 1 1.48 . . 1 . . . . . . . . 4405 1 676 . 1 1 59 59 ARG HG3 H 1 1.48 . . 1 . . . . . . . . 4405 1 677 . 1 1 59 59 ARG C C 13 174.07 . . 1 . . . . . . . . 4405 1 678 . 1 1 59 59 ARG CA C 13 54.05 . . 1 . . . . . . . . 4405 1 679 . 1 1 59 59 ARG CB C 13 33.15 . . 1 . . . . . . . . 4405 1 680 . 1 1 59 59 ARG CD C 13 42.90 . . 1 . . . . . . . . 4405 1 681 . 1 1 59 59 ARG CG C 13 27.94 . . 1 . . . . . . . . 4405 1 682 . 1 1 59 59 ARG N N 15 117.50 . . 1 . . . . . . . . 4405 1 683 . 1 1 60 60 ILE HA H 1 4.54 . . 1 . . . . . . . . 4405 1 684 . 1 1 60 60 ILE HB H 1 1.69 . . 1 . . . . . . . . 4405 1 685 . 1 1 60 60 ILE HD11 H 1 0.75 . . 1 . . . . . . . . 4405 1 686 . 1 1 60 60 ILE HD12 H 1 0.75 . . 1 . . . . . . . . 4405 1 687 . 1 1 60 60 ILE HD13 H 1 0.75 . . 1 . . . . . . . . 4405 1 688 . 1 1 60 60 ILE HG13 H 1 1.43 . . 1 . . . . . . . . 4405 1 689 . 1 1 60 60 ILE HG12 H 1 1.06 . . 1 . . . . . . . . 4405 1 690 . 1 1 60 60 ILE HG21 H 1 0.70 . . 1 . . . . . . . . 4405 1 691 . 1 1 60 60 ILE HG22 H 1 0.70 . . 1 . . . . . . . . 4405 1 692 . 1 1 60 60 ILE HG23 H 1 0.70 . . 1 . . . . . . . . 4405 1 693 . 1 1 60 60 ILE H H 1 8.36 . . 1 . . . . . . . . 4405 1 694 . 1 1 60 60 ILE C C 13 175.65 . . 1 . . . . . . . . 4405 1 695 . 1 1 60 60 ILE CA C 13 60.88 . . 1 . . . . . . . . 4405 1 696 . 1 1 60 60 ILE CB C 13 39.21 . . 1 . . . . . . . . 4405 1 697 . 1 1 60 60 ILE CD1 C 13 12.98 . . 1 . . . . . . . . 4405 1 698 . 1 1 60 60 ILE CG1 C 13 28.16 . . 1 . . . . . . . . 4405 1 699 . 1 1 60 60 ILE CG2 C 13 17.98 . . 1 . . . . . . . . 4405 1 700 . 1 1 60 60 ILE N N 15 121.75 . . 1 . . . . . . . . 4405 1 701 . 1 1 61 61 ILE HA H 1 4.92 . . 1 . . . . . . . . 4405 1 702 . 1 1 61 61 ILE HB H 1 1.80 . . 1 . . . . . . . . 4405 1 703 . 1 1 61 61 ILE HD11 H 1 0.67 . . 1 . . . . . . . . 4405 1 704 . 1 1 61 61 ILE HD12 H 1 0.67 . . 1 . . . . . . . . 4405 1 705 . 1 1 61 61 ILE HD13 H 1 0.67 . . 1 . . . . . . . . 4405 1 706 . 1 1 61 61 ILE HG13 H 1 1.51 . . 1 . . . . . . . . 4405 1 707 . 1 1 61 61 ILE HG12 H 1 0.99 . . 1 . . . . . . . . 4405 1 708 . 1 1 61 61 ILE HG21 H 1 0.70 . . 1 . . . . . . . . 4405 1 709 . 1 1 61 61 ILE HG22 H 1 0.70 . . 1 . . . . . . . . 4405 1 710 . 1 1 61 61 ILE HG23 H 1 0.70 . . 1 . . . . . . . . 4405 1 711 . 1 1 61 61 ILE H H 1 9.24 . . 1 . . . . . . . . 4405 1 712 . 1 1 61 61 ILE C C 13 175.01 . . 1 . . . . . . . . 4405 1 713 . 1 1 61 61 ILE CA C 13 59.48 . . 1 . . . . . . . . 4405 1 714 . 1 1 61 61 ILE CB C 13 39.43 . . 1 . . . . . . . . 4405 1 715 . 1 1 61 61 ILE CD1 C 13 14.01 . . 1 . . . . . . . . 4405 1 716 . 1 1 61 61 ILE CG2 C 13 17.92 . . 1 . . . . . . . . 4405 1 717 . 1 1 61 61 ILE CG1 C 13 27.98 . . 1 . . . . . . . . 4405 1 718 . 1 1 61 61 ILE N N 15 127.87 . . 1 . . . . . . . . 4405 1 719 . 1 1 62 62 THR HA H 1 4.90 . . 1 . . . . . . . . 4405 1 720 . 1 1 62 62 THR HB H 1 3.89 . . 1 . . . . . . . . 4405 1 721 . 1 1 62 62 THR HG21 H 1 1.10 . . 1 . . . . . . . . 4405 1 722 . 1 1 62 62 THR HG22 H 1 1.10 . . 1 . . . . . . . . 4405 1 723 . 1 1 62 62 THR HG23 H 1 1.10 . . 1 . . . . . . . . 4405 1 724 . 1 1 62 62 THR H H 1 9.01 . . 1 . . . . . . . . 4405 1 725 . 1 1 62 62 THR C C 13 173.99 . . 1 . . . . . . . . 4405 1 726 . 1 1 62 62 THR CA C 13 62.65 . . 1 . . . . . . . . 4405 1 727 . 1 1 62 62 THR CB C 13 69.71 . . 1 . . . . . . . . 4405 1 728 . 1 1 62 62 THR CG2 C 13 21.96 . . 1 . . . . . . . . 4405 1 729 . 1 1 62 62 THR N N 15 123.16 . . 1 . . . . . . . . 4405 1 730 . 1 1 63 63 ILE HG13 H 1 1.57 . . 1 . . . . . . . . 4405 1 731 . 1 1 63 63 ILE HG12 H 1 0.64 . . 1 . . . . . . . . 4405 1 732 . 1 1 63 63 ILE HA H 1 4.92 . . 1 . . . . . . . . 4405 1 733 . 1 1 63 63 ILE HB H 1 1.64 . . 1 . . . . . . . . 4405 1 734 . 1 1 63 63 ILE HD11 H 1 0.64 . . 1 . . . . . . . . 4405 1 735 . 1 1 63 63 ILE HD12 H 1 0.64 . . 1 . . . . . . . . 4405 1 736 . 1 1 63 63 ILE HD13 H 1 0.64 . . 1 . . . . . . . . 4405 1 737 . 1 1 63 63 ILE HG21 H 1 0.75 . . 1 . . . . . . . . 4405 1 738 . 1 1 63 63 ILE HG22 H 1 0.75 . . 1 . . . . . . . . 4405 1 739 . 1 1 63 63 ILE HG23 H 1 0.75 . . 1 . . . . . . . . 4405 1 740 . 1 1 63 63 ILE H H 1 9.18 . . 1 . . . . . . . . 4405 1 741 . 1 1 63 63 ILE C C 13 174.14 . . 1 . . . . . . . . 4405 1 742 . 1 1 63 63 ILE CA C 13 60.55 . . 1 . . . . . . . . 4405 1 743 . 1 1 63 63 ILE CB C 13 40.18 . . 1 . . . . . . . . 4405 1 744 . 1 1 63 63 ILE CD1 C 13 14.39 . . 1 . . . . . . . . 4405 1 745 . 1 1 63 63 ILE CG2 C 13 20.14 . . 1 . . . . . . . . 4405 1 746 . 1 1 63 63 ILE CG1 C 13 28.06 . . 1 . . . . . . . . 4405 1 747 . 1 1 63 63 ILE N N 15 128.79 . . 1 . . . . . . . . 4405 1 748 . 1 1 64 64 THR HA H 1 5.71 . . 1 . . . . . . . . 4405 1 749 . 1 1 64 64 THR HB H 1 3.78 . . 1 . . . . . . . . 4405 1 750 . 1 1 64 64 THR HG21 H 1 1.12 . . 1 . . . . . . . . 4405 1 751 . 1 1 64 64 THR HG22 H 1 1.12 . . 1 . . . . . . . . 4405 1 752 . 1 1 64 64 THR HG23 H 1 1.12 . . 1 . . . . . . . . 4405 1 753 . 1 1 64 64 THR H H 1 8.94 . . 1 . . . . . . . . 4405 1 754 . 1 1 64 64 THR C C 13 173.98 . . 1 . . . . . . . . 4405 1 755 . 1 1 64 64 THR CA C 13 60.77 . . 1 . . . . . . . . 4405 1 756 . 1 1 64 64 THR CB C 13 72.20 . . 1 . . . . . . . . 4405 1 757 . 1 1 64 64 THR CG2 C 13 21.91 . . 1 . . . . . . . . 4405 1 758 . 1 1 64 64 THR N N 15 122.39 . . 1 . . . . . . . . 4405 1 759 . 1 1 65 65 GLY HA2 H 1 4.28 . . 1 . . . . . . . . 4405 1 760 . 1 1 65 65 GLY HA3 H 1 4.28 . . 1 . . . . . . . . 4405 1 761 . 1 1 65 65 GLY H H 1 9.07 . . 1 . . . . . . . . 4405 1 762 . 1 1 65 65 GLY C C 13 172.20 . . 1 . . . . . . . . 4405 1 763 . 1 1 65 65 GLY CA C 13 45.72 . . 1 . . . . . . . . 4405 1 764 . 1 1 65 65 GLY N N 15 113.86 . . 1 . . . . . . . . 4405 1 765 . 1 1 66 66 THR HA H 1 4.85 . . 1 . . . . . . . . 4405 1 766 . 1 1 66 66 THR HB H 1 4.62 . . 1 . . . . . . . . 4405 1 767 . 1 1 66 66 THR HG21 H 1 1.12 . . 1 . . . . . . . . 4405 1 768 . 1 1 66 66 THR HG22 H 1 1.12 . . 1 . . . . . . . . 4405 1 769 . 1 1 66 66 THR HG23 H 1 1.12 . . 1 . . . . . . . . 4405 1 770 . 1 1 66 66 THR H H 1 8.68 . . 1 . . . . . . . . 4405 1 771 . 1 1 66 66 THR C C 13 175.92 . . 1 . . . . . . . . 4405 1 772 . 1 1 66 66 THR CA C 13 61.78 . . 1 . . . . . . . . 4405 1 773 . 1 1 66 66 THR CB C 13 70.60 . . 1 . . . . . . . . 4405 1 774 . 1 1 66 66 THR CG2 C 13 22.35 . . 1 . . . . . . . . 4405 1 775 . 1 1 66 66 THR N N 15 110.62 . . 1 . . . . . . . . 4405 1 776 . 1 1 67 67 GLN HA H 1 3.91 . . 1 . . . . . . . . 4405 1 777 . 1 1 67 67 GLN HB3 H 1 2.12 . . 1 . . . . . . . . 4405 1 778 . 1 1 67 67 GLN HB2 H 1 2.07 . . 1 . . . . . . . . 4405 1 779 . 1 1 67 67 GLN HG2 H 1 2.36 . . 1 . . . . . . . . 4405 1 780 . 1 1 67 67 GLN HG3 H 1 2.36 . . 1 . . . . . . . . 4405 1 781 . 1 1 67 67 GLN H H 1 9.44 . . 1 . . . . . . . . 4405 1 782 . 1 1 67 67 GLN HE21 H 1 6.80 . . 1 . . . . . . . . 4405 1 783 . 1 1 67 67 GLN HE22 H 1 7.42 . . 1 . . . . . . . . 4405 1 784 . 1 1 67 67 GLN C C 13 177.86 . . 1 . . . . . . . . 4405 1 785 . 1 1 67 67 GLN CA C 13 60.08 . . 1 . . . . . . . . 4405 1 786 . 1 1 67 67 GLN CB C 13 28.49 . . 1 . . . . . . . . 4405 1 787 . 1 1 67 67 GLN CG C 13 33.63 . . 1 . . . . . . . . 4405 1 788 . 1 1 67 67 GLN N N 15 120.28 . . 1 . . . . . . . . 4405 1 789 . 1 1 67 67 GLN NE2 N 15 111.14 . . 1 . . . . . . . . 4405 1 790 . 1 1 68 68 ASP HA H 1 4.35 . . 1 . . . . . . . . 4405 1 791 . 1 1 68 68 ASP HB3 H 1 2.57 . . 1 . . . . . . . . 4405 1 792 . 1 1 68 68 ASP HB2 H 1 2.52 . . 1 . . . . . . . . 4405 1 793 . 1 1 68 68 ASP H H 1 8.49 . . 1 . . . . . . . . 4405 1 794 . 1 1 68 68 ASP C C 13 178.49 . . 1 . . . . . . . . 4405 1 795 . 1 1 68 68 ASP CA C 13 57.46 . . 1 . . . . . . . . 4405 1 796 . 1 1 68 68 ASP CB C 13 40.91 . . 1 . . . . . . . . 4405 1 797 . 1 1 68 68 ASP N N 15 116.02 . . 1 . . . . . . . . 4405 1 798 . 1 1 69 69 GLN HA H 1 4.19 . . 1 . . . . . . . . 4405 1 799 . 1 1 69 69 GLN HB3 H 1 2.38 . . 1 . . . . . . . . 4405 1 800 . 1 1 69 69 GLN HB2 H 1 1.62 . . 1 . . . . . . . . 4405 1 801 . 1 1 69 69 GLN H H 1 7.39 . . 1 . . . . . . . . 4405 1 802 . 1 1 69 69 GLN HE21 H 1 7.59 . . 1 . . . . . . . . 4405 1 803 . 1 1 69 69 GLN HE22 H 1 6.43 . . 1 . . . . . . . . 4405 1 804 . 1 1 69 69 GLN HG3 H 1 2.81 . . 1 . . . . . . . . 4405 1 805 . 1 1 69 69 GLN HG2 H 1 2.52 . . 1 . . . . . . . . 4405 1 806 . 1 1 69 69 GLN C C 13 179.21 . . 1 . . . . . . . . 4405 1 807 . 1 1 69 69 GLN CA C 13 59.08 . . 1 . . . . . . . . 4405 1 808 . 1 1 69 69 GLN CB C 13 28.59 . . 1 . . . . . . . . 4405 1 809 . 1 1 69 69 GLN CG C 13 33.71 . . 1 . . . . . . . . 4405 1 810 . 1 1 69 69 GLN N N 15 119.34 . . 1 . . . . . . . . 4405 1 811 . 1 1 69 69 GLN NE2 N 15 108.97 . . 1 . . . . . . . . 4405 1 812 . 1 1 70 70 ILE HA H 1 3.46 . . 1 . . . . . . . . 4405 1 813 . 1 1 70 70 ILE HB H 1 1.77 . . 1 . . . . . . . . 4405 1 814 . 1 1 70 70 ILE HD11 H 1 0.68 . . 1 . . . . . . . . 4405 1 815 . 1 1 70 70 ILE HD12 H 1 0.68 . . 1 . . . . . . . . 4405 1 816 . 1 1 70 70 ILE HD13 H 1 0.68 . . 1 . . . . . . . . 4405 1 817 . 1 1 70 70 ILE HG13 H 1 1.41 . . 1 . . . . . . . . 4405 1 818 . 1 1 70 70 ILE HG12 H 1 0.87 . . 1 . . . . . . . . 4405 1 819 . 1 1 70 70 ILE HG21 H 1 0.73 . . 1 . . . . . . . . 4405 1 820 . 1 1 70 70 ILE HG22 H 1 0.73 . . 1 . . . . . . . . 4405 1 821 . 1 1 70 70 ILE HG23 H 1 0.73 . . 1 . . . . . . . . 4405 1 822 . 1 1 70 70 ILE H H 1 8.62 . . 1 . . . . . . . . 4405 1 823 . 1 1 70 70 ILE C C 13 178.23 . . 1 . . . . . . . . 4405 1 824 . 1 1 70 70 ILE CA C 13 65.43 . . 1 . . . . . . . . 4405 1 825 . 1 1 70 70 ILE CB C 13 37.83 . . 1 . . . . . . . . 4405 1 826 . 1 1 70 70 ILE CD1 C 13 14.24 . . 1 . . . . . . . . 4405 1 827 . 1 1 70 70 ILE CG1 C 13 28.85 . . 1 . . . . . . . . 4405 1 828 . 1 1 70 70 ILE CG2 C 13 18.07 . . 1 . . . . . . . . 4405 1 829 . 1 1 70 70 ILE N N 15 117.61 . . 1 . . . . . . . . 4405 1 830 . 1 1 71 71 GLN HA H 1 4.05 . . 1 . . . . . . . . 4405 1 831 . 1 1 71 71 GLN HB3 H 1 2.15 . . 1 . . . . . . . . 4405 1 832 . 1 1 71 71 GLN HB2 H 1 2.10 . . 1 . . . . . . . . 4405 1 833 . 1 1 71 71 GLN HG3 H 1 2.47 . . 1 . . . . . . . . 4405 1 834 . 1 1 71 71 GLN HG2 H 1 2.39 . . 1 . . . . . . . . 4405 1 835 . 1 1 71 71 GLN H H 1 8.25 . . 1 . . . . . . . . 4405 1 836 . 1 1 71 71 GLN HE21 H 1 7.34 . . 1 . . . . . . . . 4405 1 837 . 1 1 71 71 GLN HE22 H 1 6.83 . . 1 . . . . . . . . 4405 1 838 . 1 1 71 71 GLN C C 13 178.92 . . 1 . . . . . . . . 4405 1 839 . 1 1 71 71 GLN CA C 13 59.21 . . 1 . . . . . . . . 4405 1 840 . 1 1 71 71 GLN CB C 13 28.37 . . 1 . . . . . . . . 4405 1 841 . 1 1 71 71 GLN CG C 13 34.42 . . 1 . . . . . . . . 4405 1 842 . 1 1 71 71 GLN N N 15 119.55 . . 1 . . . . . . . . 4405 1 843 . 1 1 71 71 GLN NE2 N 15 111.38 . . 1 . . . . . . . . 4405 1 844 . 1 1 72 72 ASN HA H 1 4.62 . . 1 . . . . . . . . 4405 1 845 . 1 1 72 72 ASN HB2 H 1 2.97 . . 1 . . . . . . . . 4405 1 846 . 1 1 72 72 ASN HB3 H 1 2.75 . . 1 . . . . . . . . 4405 1 847 . 1 1 72 72 ASN H H 1 8.00 . . 1 . . . . . . . . 4405 1 848 . 1 1 72 72 ASN HD21 H 1 7.63 . . 1 . . . . . . . . 4405 1 849 . 1 1 72 72 ASN HD22 H 1 6.85 . . 1 . . . . . . . . 4405 1 850 . 1 1 72 72 ASN C C 13 177.32 . . 1 . . . . . . . . 4405 1 851 . 1 1 72 72 ASN CA C 13 56.24 . . 1 . . . . . . . . 4405 1 852 . 1 1 72 72 ASN CB C 13 38.66 . . 1 . . . . . . . . 4405 1 853 . 1 1 72 72 ASN N N 15 118.18 . . 1 . . . . . . . . 4405 1 854 . 1 1 72 72 ASN ND2 N 15 110.76 . . 1 . . . . . . . . 4405 1 855 . 1 1 73 73 ALA HA H 1 3.88 . . 1 . . . . . . . . 4405 1 856 . 1 1 73 73 ALA HB1 H 1 1.39 . . 1 . . . . . . . . 4405 1 857 . 1 1 73 73 ALA HB2 H 1 1.39 . . 1 . . . . . . . . 4405 1 858 . 1 1 73 73 ALA HB3 H 1 1.39 . . 1 . . . . . . . . 4405 1 859 . 1 1 73 73 ALA H H 1 8.63 . . 1 . . . . . . . . 4405 1 860 . 1 1 73 73 ALA C C 13 179.07 . . 1 . . . . . . . . 4405 1 861 . 1 1 73 73 ALA CA C 13 56.17 . . 1 . . . . . . . . 4405 1 862 . 1 1 73 73 ALA CB C 13 18.35 . . 1 . . . . . . . . 4405 1 863 . 1 1 73 73 ALA N N 15 121.36 . . 1 . . . . . . . . 4405 1 864 . 1 1 74 74 GLN HA H 1 3.81 . . 1 . . . . . . . . 4405 1 865 . 1 1 74 74 GLN HB3 H 1 2.20 . . 1 . . . . . . . . 4405 1 866 . 1 1 74 74 GLN HB2 H 1 2.03 . . 1 . . . . . . . . 4405 1 867 . 1 1 74 74 GLN HG3 H 1 2.45 . . 1 . . . . . . . . 4405 1 868 . 1 1 74 74 GLN HG2 H 1 2.00 . . 1 . . . . . . . . 4405 1 869 . 1 1 74 74 GLN H H 1 8.68 . . 1 . . . . . . . . 4405 1 870 . 1 1 74 74 GLN HE21 H 1 6.73 . . 1 . . . . . . . . 4405 1 871 . 1 1 74 74 GLN HE22 H 1 6.65 . . 1 . . . . . . . . 4405 1 872 . 1 1 74 74 GLN C C 13 178.12 . . 1 . . . . . . . . 4405 1 873 . 1 1 74 74 GLN CA C 13 60.47 . . 1 . . . . . . . . 4405 1 874 . 1 1 74 74 GLN CB C 13 28.93 . . 1 . . . . . . . . 4405 1 875 . 1 1 74 74 GLN CG C 13 35.54 . . 1 . . . . . . . . 4405 1 876 . 1 1 74 74 GLN N N 15 115.56 . . 1 . . . . . . . . 4405 1 877 . 1 1 74 74 GLN NE2 N 15 108.54 . . 1 . . . . . . . . 4405 1 878 . 1 1 75 75 TYR HD1 H 1 7.18 . . 1 . . . . . . . . 4405 1 879 . 1 1 75 75 TYR HE1 H 1 7.18 . . 1 . . . . . . . . 4405 1 880 . 1 1 75 75 TYR HE2 H 1 7.18 . . 1 . . . . . . . . 4405 1 881 . 1 1 75 75 TYR HA H 1 4.27 . . 1 . . . . . . . . 4405 1 882 . 1 1 75 75 TYR HB2 H 1 3.26 . . 1 . . . . . . . . 4405 1 883 . 1 1 75 75 TYR HB3 H 1 3.26 . . 1 . . . . . . . . 4405 1 884 . 1 1 75 75 TYR H H 1 8.02 . . 1 . . . . . . . . 4405 1 885 . 1 1 75 75 TYR C C 13 178.17 . . 1 . . . . . . . . 4405 1 886 . 1 1 75 75 TYR CA C 13 61.20 . . 1 . . . . . . . . 4405 1 887 . 1 1 75 75 TYR CB C 13 38.12 . . 1 . . . . . . . . 4405 1 888 . 1 1 75 75 TYR CD1 C 13 133.23 . . 1 . . . . . . . . 4405 1 889 . 1 1 75 75 TYR CE1 C 13 133.23 . . 1 . . . . . . . . 4405 1 890 . 1 1 75 75 TYR CE2 C 13 133.23 . . 1 . . . . . . . . 4405 1 891 . 1 1 75 75 TYR N N 15 120.25 . . 1 . . . . . . . . 4405 1 892 . 1 1 76 76 LEU HA H 1 3.89 . . 1 . . . . . . . . 4405 1 893 . 1 1 76 76 LEU HB2 H 1 1.98 . . 1 . . . . . . . . 4405 1 894 . 1 1 76 76 LEU HB3 H 1 1.33 . . 1 . . . . . . . . 4405 1 895 . 1 1 76 76 LEU HD11 H 1 0.94 . . 1 . . . . . . . . 4405 1 896 . 1 1 76 76 LEU HD12 H 1 0.94 . . 1 . . . . . . . . 4405 1 897 . 1 1 76 76 LEU HD13 H 1 0.94 . . 1 . . . . . . . . 4405 1 898 . 1 1 76 76 LEU HD21 H 1 0.94 . . 1 . . . . . . . . 4405 1 899 . 1 1 76 76 LEU HD22 H 1 0.94 . . 1 . . . . . . . . 4405 1 900 . 1 1 76 76 LEU HD23 H 1 0.94 . . 1 . . . . . . . . 4405 1 901 . 1 1 76 76 LEU HG H 1 2.10 . . 1 . . . . . . . . 4405 1 902 . 1 1 76 76 LEU H H 1 8.19 . . 1 . . . . . . . . 4405 1 903 . 1 1 76 76 LEU C C 13 180.75 . . 1 . . . . . . . . 4405 1 904 . 1 1 76 76 LEU CA C 13 57.90 . . 1 . . . . . . . . 4405 1 905 . 1 1 76 76 LEU CB C 13 43.15 . . 1 . . . . . . . . 4405 1 906 . 1 1 76 76 LEU CD1 C 13 27.18 . . 1 . . . . . . . . 4405 1 907 . 1 1 76 76 LEU CD2 C 13 22.58 . . 1 . . . . . . . . 4405 1 908 . 1 1 76 76 LEU CG C 13 27.40 . . 1 . . . . . . . . 4405 1 909 . 1 1 76 76 LEU N N 15 119.13 . . 1 . . . . . . . . 4405 1 910 . 1 1 77 77 LEU HA H 1 3.85 . . 1 . . . . . . . . 4405 1 911 . 1 1 77 77 LEU HB2 H 1 1.86 . . 1 . . . . . . . . 4405 1 912 . 1 1 77 77 LEU HB3 H 1 1.26 . . 1 . . . . . . . . 4405 1 913 . 1 1 77 77 LEU HD11 H 1 0.70 . . 1 . . . . . . . . 4405 1 914 . 1 1 77 77 LEU HD12 H 1 0.70 . . 1 . . . . . . . . 4405 1 915 . 1 1 77 77 LEU HD13 H 1 0.70 . . 1 . . . . . . . . 4405 1 916 . 1 1 77 77 LEU HD21 H 1 0.70 . . 1 . . . . . . . . 4405 1 917 . 1 1 77 77 LEU HD22 H 1 0.70 . . 1 . . . . . . . . 4405 1 918 . 1 1 77 77 LEU HD23 H 1 0.70 . . 1 . . . . . . . . 4405 1 919 . 1 1 77 77 LEU HG H 1 1.74 . . 1 . . . . . . . . 4405 1 920 . 1 1 77 77 LEU H H 1 8.71 . . 1 . . . . . . . . 4405 1 921 . 1 1 77 77 LEU C C 13 178.44 . . 1 . . . . . . . . 4405 1 922 . 1 1 77 77 LEU CA C 13 58.44 . . 1 . . . . . . . . 4405 1 923 . 1 1 77 77 LEU CB C 13 42.19 . . 1 . . . . . . . . 4405 1 924 . 1 1 77 77 LEU CD1 C 13 25.88 . . 1 . . . . . . . . 4405 1 925 . 1 1 77 77 LEU CD2 C 13 24.73 . . 1 . . . . . . . . 4405 1 926 . 1 1 77 77 LEU CG C 13 27.21 . . 1 . . . . . . . . 4405 1 927 . 1 1 77 77 LEU N N 15 121.30 . . 1 . . . . . . . . 4405 1 928 . 1 1 78 78 GLN HA H 1 4.04 . . 1 . . . . . . . . 4405 1 929 . 1 1 78 78 GLN HB2 H 1 2.09 . . 1 . . . . . . . . 4405 1 930 . 1 1 78 78 GLN HB3 H 1 2.09 . . 1 . . . . . . . . 4405 1 931 . 1 1 78 78 GLN HG3 H 1 2.41 . . 1 . . . . . . . . 4405 1 932 . 1 1 78 78 GLN HG2 H 1 2.35 . . 1 . . . . . . . . 4405 1 933 . 1 1 78 78 GLN H H 1 8.14 . . 1 . . . . . . . . 4405 1 934 . 1 1 78 78 GLN HE21 H 1 7.29 . . 1 . . . . . . . . 4405 1 935 . 1 1 78 78 GLN HE22 H 1 6.79 . . 1 . . . . . . . . 4405 1 936 . 1 1 78 78 GLN C C 13 177.96 . . 1 . . . . . . . . 4405 1 937 . 1 1 78 78 GLN CA C 13 58.45 . . 1 . . . . . . . . 4405 1 938 . 1 1 78 78 GLN CB C 13 28.48 . . 1 . . . . . . . . 4405 1 939 . 1 1 78 78 GLN CG C 13 33.96 . . 1 . . . . . . . . 4405 1 940 . 1 1 78 78 GLN N N 15 117.20 . . 1 . . . . . . . . 4405 1 941 . 1 1 78 78 GLN NE2 N 15 110.41 . . 1 . . . . . . . . 4405 1 942 . 1 1 79 79 ASN HA H 1 4.51 . . 1 . . . . . . . . 4405 1 943 . 1 1 79 79 ASN HB2 H 1 2.50 . . 1 . . . . . . . . 4405 1 944 . 1 1 79 79 ASN HB3 H 1 2.64 . . 1 . . . . . . . . 4405 1 945 . 1 1 79 79 ASN H H 1 7.94 . . 1 . . . . . . . . 4405 1 946 . 1 1 79 79 ASN HD21 H 1 7.20 . . 1 . . . . . . . . 4405 1 947 . 1 1 79 79 ASN HD22 H 1 6.40 . . 1 . . . . . . . . 4405 1 948 . 1 1 79 79 ASN C C 13 176.54 . . 1 . . . . . . . . 4405 1 949 . 1 1 79 79 ASN CA C 13 55.22 . . 1 . . . . . . . . 4405 1 950 . 1 1 79 79 ASN CB C 13 38.64 . . 1 . . . . . . . . 4405 1 951 . 1 1 79 79 ASN N N 15 116.63 . . 1 . . . . . . . . 4405 1 952 . 1 1 79 79 ASN ND2 N 15 111.83 . . 1 . . . . . . . . 4405 1 953 . 1 1 80 80 SER HA H 1 4.34 . . 1 . . . . . . . . 4405 1 954 . 1 1 80 80 SER HB2 H 1 4.02 . . 1 . . . . . . . . 4405 1 955 . 1 1 80 80 SER HB3 H 1 3.89 . . 1 . . . . . . . . 4405 1 956 . 1 1 80 80 SER H H 1 7.78 . . 1 . . . . . . . . 4405 1 957 . 1 1 80 80 SER C C 13 174.65 . . 1 . . . . . . . . 4405 1 958 . 1 1 80 80 SER CA C 13 61.49 . . 1 . . . . . . . . 4405 1 959 . 1 1 80 80 SER CB C 13 63.70 . . 1 . . . . . . . . 4405 1 960 . 1 1 80 80 SER N N 15 115.14 . . 1 . . . . . . . . 4405 1 961 . 1 1 81 81 VAL HA H 1 4.03 . . 1 . . . . . . . . 4405 1 962 . 1 1 81 81 VAL HB H 1 2.26 . . 1 . . . . . . . . 4405 1 963 . 1 1 81 81 VAL HG11 H 1 0.97 . . 1 . . . . . . . . 4405 1 964 . 1 1 81 81 VAL HG12 H 1 0.97 . . 1 . . . . . . . . 4405 1 965 . 1 1 81 81 VAL HG13 H 1 0.97 . . 1 . . . . . . . . 4405 1 966 . 1 1 81 81 VAL HG21 H 1 0.93 . . 1 . . . . . . . . 4405 1 967 . 1 1 81 81 VAL HG22 H 1 0.93 . . 1 . . . . . . . . 4405 1 968 . 1 1 81 81 VAL HG23 H 1 0.93 . . 1 . . . . . . . . 4405 1 969 . 1 1 81 81 VAL H H 1 7.76 . . 1 . . . . . . . . 4405 1 970 . 1 1 81 81 VAL C C 13 177.01 . . 1 . . . . . . . . 4405 1 971 . 1 1 81 81 VAL CA C 13 63.85 . . 1 . . . . . . . . 4405 1 972 . 1 1 81 81 VAL CB C 13 32.35 . . 1 . . . . . . . . 4405 1 973 . 1 1 81 81 VAL CG1 C 13 21.36 . . 1 . . . . . . . . 4405 1 974 . 1 1 81 81 VAL CG2 C 13 21.90 . . 1 . . . . . . . . 4405 1 975 . 1 1 81 81 VAL N N 15 118.61 . . 1 . . . . . . . . 4405 1 976 . 1 1 82 82 LYS HA H 1 4.09 . . 1 . . . . . . . . 4405 1 977 . 1 1 82 82 LYS HB2 H 1 1.80 . . 1 . . . . . . . . 4405 1 978 . 1 1 82 82 LYS HB3 H 1 1.80 . . 1 . . . . . . . . 4405 1 979 . 1 1 82 82 LYS HD2 H 1 1.60 . . 1 . . . . . . . . 4405 1 980 . 1 1 82 82 LYS HD3 H 1 1.60 . . 1 . . . . . . . . 4405 1 981 . 1 1 82 82 LYS HE2 H 1 2.91 . . 1 . . . . . . . . 4405 1 982 . 1 1 82 82 LYS HE3 H 1 2.91 . . 1 . . . . . . . . 4405 1 983 . 1 1 82 82 LYS HG2 H 1 1.39 . . 1 . . . . . . . . 4405 1 984 . 1 1 82 82 LYS HG3 H 1 1.39 . . 1 . . . . . . . . 4405 1 985 . 1 1 82 82 LYS H H 1 8.01 . . 1 . . . . . . . . 4405 1 986 . 1 1 82 82 LYS C C 13 177.33 . . 1 . . . . . . . . 4405 1 987 . 1 1 82 82 LYS CA C 13 58.05 . . 1 . . . . . . . . 4405 1 988 . 1 1 82 82 LYS CB C 13 32.69 . . 1 . . . . . . . . 4405 1 989 . 1 1 82 82 LYS CD C 13 29.24 . . 1 . . . . . . . . 4405 1 990 . 1 1 82 82 LYS CE C 13 42.09 . . 1 . . . . . . . . 4405 1 991 . 1 1 82 82 LYS CG C 13 25.12 . . 1 . . . . . . . . 4405 1 992 . 1 1 82 82 LYS N N 15 121.66 . . 1 . . . . . . . . 4405 1 993 . 1 1 83 83 GLN HA H 1 4.15 . . 1 . . . . . . . . 4405 1 994 . 1 1 83 83 GLN HB2 H 1 1.92 . . 1 . . . . . . . . 4405 1 995 . 1 1 83 83 GLN HB3 H 1 1.92 . . 1 . . . . . . . . 4405 1 996 . 1 1 83 83 GLN HG3 H 1 2.20 . . 1 . . . . . . . . 4405 1 997 . 1 1 83 83 GLN HG2 H 1 2.07 . . 1 . . . . . . . . 4405 1 998 . 1 1 83 83 GLN H H 1 8.15 . . 1 . . . . . . . . 4405 1 999 . 1 1 83 83 GLN HE21 H 1 7.34 . . 1 . . . . . . . . 4405 1 1000 . 1 1 83 83 GLN HE22 H 1 6.77 . . 1 . . . . . . . . 4405 1 1001 . 1 1 83 83 GLN C C 13 176.19 . . 1 . . . . . . . . 4405 1 1002 . 1 1 83 83 GLN CA C 13 57.04 . . 1 . . . . . . . . 4405 1 1003 . 1 1 83 83 GLN CB C 13 29.00 . . 1 . . . . . . . . 4405 1 1004 . 1 1 83 83 GLN CG C 13 33.69 . . 1 . . . . . . . . 4405 1 1005 . 1 1 83 83 GLN N N 15 118.49 . . 1 . . . . . . . . 4405 1 1006 . 1 1 83 83 GLN NE2 N 15 111.25 . . 1 . . . . . . . . 4405 1 1007 . 1 1 84 84 TYR HD1 H 1 7.18 . . 1 . . . . . . . . 4405 1 1008 . 1 1 84 84 TYR HE1 H 1 7.18 . . 1 . . . . . . . . 4405 1 1009 . 1 1 84 84 TYR HE2 H 1 7.18 . . 1 . . . . . . . . 4405 1 1010 . 1 1 84 84 TYR HA H 1 4.58 . . 1 . . . . . . . . 4405 1 1011 . 1 1 84 84 TYR HB2 H 1 2.92 . . 1 . . . . . . . . 4405 1 1012 . 1 1 84 84 TYR HB3 H 1 3.15 . . 1 . . . . . . . . 4405 1 1013 . 1 1 84 84 TYR H H 1 8.00 . . 1 . . . . . . . . 4405 1 1014 . 1 1 84 84 TYR C C 13 175.87 . . 1 . . . . . . . . 4405 1 1015 . 1 1 84 84 TYR CA C 13 58.58 . . 1 . . . . . . . . 4405 1 1016 . 1 1 84 84 TYR CB C 13 39.10 . . 1 . . . . . . . . 4405 1 1017 . 1 1 84 84 TYR CD1 C 13 133.31 . . 1 . . . . . . . . 4405 1 1018 . 1 1 84 84 TYR CE1 C 13 133.31 . . 1 . . . . . . . . 4405 1 1019 . 1 1 84 84 TYR CE2 C 13 133.31 . . 1 . . . . . . . . 4405 1 1020 . 1 1 84 84 TYR N N 15 119.12 . . 1 . . . . . . . . 4405 1 1021 . 1 1 85 85 SER HA H 1 4.41 . . 1 . . . . . . . . 4405 1 1022 . 1 1 85 85 SER HB2 H 1 3.89 . . 1 . . . . . . . . 4405 1 1023 . 1 1 85 85 SER HB3 H 1 3.89 . . 1 . . . . . . . . 4405 1 1024 . 1 1 85 85 SER H H 1 8.17 . . 1 . . . . . . . . 4405 1 1025 . 1 1 85 85 SER C C 13 174.70 . . 1 . . . . . . . . 4405 1 1026 . 1 1 85 85 SER CA C 13 58.85 . . 1 . . . . . . . . 4405 1 1027 . 1 1 85 85 SER CB C 13 64.13 . . 1 . . . . . . . . 4405 1 1028 . 1 1 85 85 SER N N 15 116.44 . . 1 . . . . . . . . 4405 1 1029 . 1 1 86 86 GLY HA2 H 1 3.86 . . 1 . . . . . . . . 4405 1 1030 . 1 1 86 86 GLY HA3 H 1 3.86 . . 1 . . . . . . . . 4405 1 1031 . 1 1 86 86 GLY H H 1 7.87 . . 1 . . . . . . . . 4405 1 1032 . 1 1 86 86 GLY C C 13 173.20 . . 1 . . . . . . . . 4405 1 1033 . 1 1 86 86 GLY CA C 13 45.41 . . 1 . . . . . . . . 4405 1 1034 . 1 1 86 86 GLY N N 15 109.99 . . 1 . . . . . . . . 4405 1 1035 . 1 1 87 87 LYS HA H 1 4.27 . . 1 . . . . . . . . 4405 1 1036 . 1 1 87 87 LYS HB2 H 1 1.62 . . 1 . . . . . . . . 4405 1 1037 . 1 1 87 87 LYS HB3 H 1 1.62 . . 1 . . . . . . . . 4405 1 1038 . 1 1 87 87 LYS HE2 H 1 2.90 . . 1 . . . . . . . . 4405 1 1039 . 1 1 87 87 LYS HE3 H 1 2.90 . . 1 . . . . . . . . 4405 1 1040 . 1 1 87 87 LYS HG2 H 1 1.22 . . 1 . . . . . . . . 4405 1 1041 . 1 1 87 87 LYS HG3 H 1 1.22 . . 1 . . . . . . . . 4405 1 1042 . 1 1 87 87 LYS HD2 H 1 1.57 . . 1 . . . . . . . . 4405 1 1043 . 1 1 87 87 LYS HD3 H 1 1.57 . . 1 . . . . . . . . 4405 1 1044 . 1 1 87 87 LYS H H 1 7.87 . . 1 . . . . . . . . 4405 1 1045 . 1 1 87 87 LYS C C 13 175.58 . . 1 . . . . . . . . 4405 1 1046 . 1 1 87 87 LYS CA C 13 55.98 . . 1 . . . . . . . . 4405 1 1047 . 1 1 87 87 LYS CB C 13 33.50 . . 1 . . . . . . . . 4405 1 1048 . 1 1 87 87 LYS CE C 13 42.12 . . 1 . . . . . . . . 4405 1 1049 . 1 1 87 87 LYS CD C 13 29.11 . . 1 . . . . . . . . 4405 1 1050 . 1 1 87 87 LYS CG C 13 24.77 . . 1 . . . . . . . . 4405 1 1051 . 1 1 87 87 LYS N N 15 119.66 . . 1 . . . . . . . . 4405 1 1052 . 1 1 88 88 PHE HA H 1 4.58 . . 1 . . . . . . . . 4405 1 1053 . 1 1 88 88 PHE HB3 H 1 3.04 . . 1 . . . . . . . . 4405 1 1054 . 1 1 88 88 PHE HB2 H 1 2.81 . . 1 . . . . . . . . 4405 1 1055 . 1 1 88 88 PHE H H 1 8.19 . . 1 . . . . . . . . 4405 1 1056 . 1 1 88 88 PHE C C 13 174.29 . . 1 . . . . . . . . 4405 1 1057 . 1 1 88 88 PHE CA C 13 57.85 . . 1 . . . . . . . . 4405 1 1058 . 1 1 88 88 PHE CB C 13 40.03 . . 1 . . . . . . . . 4405 1 1059 . 1 1 88 88 PHE N N 15 120.66 . . 1 . . . . . . . . 4405 1 stop_ save_