data_26802 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26802 _Entry.Title ; Cold Shock Protein A ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-05-17 _Entry.Accession_date 2016-05-17 _Entry.Last_release_date 2016-05-17 _Entry.Original_release_date 2016-05-17 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.6.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Icaro Caruso . P. . . 26802 2 Vineet Panwalkar . . . . 26802 3 Raghuvir Arni . K. . . 26802 4 Marinonio Cornelio . L. . . 26802 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 26802 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'ICS-6 (Strukturbiochemie), Forschungszentrum Juelich GmbH' . 26802 2 . 'CMIB, Department of Physics, IBILCE-UNESP' . 26802 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26802 spectral_peak_list 6 26802 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 322 26802 '15N chemical shifts' 84 26802 '1H chemical shifts' 494 26802 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2018-06-22 2016-05-17 update BMRB 'update entry citation' 26802 1 . . 2017-05-30 2016-05-17 original author 'original release' 26802 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 26802 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 29197185 _Citation.DOI 10.1111/febs.14350 _Citation.Full_citation . _Citation.Title ; Structure and interaction of Corynebacterium pseudotuberculosis cold shock protein A with Y-box single-stranded DNA fragment. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'FEBS J.' _Citation.Journal_name_full 'The FEBS journal' _Citation.Journal_volume 285 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1742-4658 _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 372 _Citation.Page_last 390 _Citation.Year 2018 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Icaro Caruso I. P. . . 26802 1 2 Vineet Panwalkar V. . . . 26802 1 3 Monika Coronado M. A. . . 26802 1 4 Andrew Dingley A. J. . . 26802 1 5 Marinonio Cornelio M. L. . . 26802 1 6 Dieter Willbold D. . . . 26802 1 7 Raghuvir Arni R. K. . . 26802 1 8 Raphael Eberle R. J. . . 26802 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Cold shock protein' 26802 1 NMR 26802 1 'Protein Structure' 26802 1 'Protein dynamics' 26802 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26802 _Assembly.ID 1 _Assembly.Name 'Cold Shock Protein A' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass 9118.9276 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Cold Shock Protein A' 1 $Molecule_1 A . yes native no no . . 'Cold Shock Protein A' 26802 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Molecule_1 _Entity.Sf_category entity _Entity.Sf_framecode Molecule_1 _Entity.Entry_ID 26802 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Molecule_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MAQGTVKWFNAEKGFGFIAP DDGSADVFVHYSEIQGNGFR TLEENQKVEFEIGEGAKGPQ AQQVHALGGENLYFQGHHHH HH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 82 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment CspA _Entity.Mutation 'Last six residues are 6X His tag' _Entity.EC_number N.A. _Entity.Calc_isoelectric_point . _Entity.Formula_weight 9118.9276 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'Cold Shock Protein A' _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 MET . 26802 1 2 2 ALA . 26802 1 3 3 GLN . 26802 1 4 4 GLY . 26802 1 5 5 THR . 26802 1 6 6 VAL . 26802 1 7 7 LYS . 26802 1 8 8 TRP . 26802 1 9 9 PHE . 26802 1 10 10 ASN . 26802 1 11 11 ALA . 26802 1 12 12 GLU . 26802 1 13 13 LYS . 26802 1 14 14 GLY . 26802 1 15 15 PHE . 26802 1 16 16 GLY . 26802 1 17 17 PHE . 26802 1 18 18 ILE . 26802 1 19 19 ALA . 26802 1 20 20 PRO . 26802 1 21 21 ASP . 26802 1 22 22 ASP . 26802 1 23 23 GLY . 26802 1 24 24 SER . 26802 1 25 25 ALA . 26802 1 26 26 ASP . 26802 1 27 27 VAL . 26802 1 28 28 PHE . 26802 1 29 29 VAL . 26802 1 30 30 HIS . 26802 1 31 31 TYR . 26802 1 32 32 SER . 26802 1 33 33 GLU . 26802 1 34 34 ILE . 26802 1 35 35 GLN . 26802 1 36 36 GLY . 26802 1 37 37 ASN . 26802 1 38 38 GLY . 26802 1 39 39 PHE . 26802 1 40 40 ARG . 26802 1 41 41 THR . 26802 1 42 42 LEU . 26802 1 43 43 GLU . 26802 1 44 44 GLU . 26802 1 45 45 ASN . 26802 1 46 46 GLN . 26802 1 47 47 LYS . 26802 1 48 48 VAL . 26802 1 49 49 GLU . 26802 1 50 50 PHE . 26802 1 51 51 GLU . 26802 1 52 52 ILE . 26802 1 53 53 GLY . 26802 1 54 54 GLU . 26802 1 55 55 GLY . 26802 1 56 56 ALA . 26802 1 57 57 LYS . 26802 1 58 58 GLY . 26802 1 59 59 PRO . 26802 1 60 60 GLN . 26802 1 61 61 ALA . 26802 1 62 62 GLN . 26802 1 63 63 GLN . 26802 1 64 64 VAL . 26802 1 65 65 HIS . 26802 1 66 66 ALA . 26802 1 67 67 LEU . 26802 1 68 68 GLY . 26802 1 69 69 GLY . 26802 1 70 70 GLU . 26802 1 71 71 ASN . 26802 1 72 72 LEU . 26802 1 73 73 TYR . 26802 1 74 74 PHE . 26802 1 75 75 GLN . 26802 1 76 76 GLY . 26802 1 77 77 HIS . 26802 1 78 78 HIS . 26802 1 79 79 HIS . 26802 1 80 80 HIS . 26802 1 81 81 HIS . 26802 1 82 82 HIS . 26802 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 26802 1 . ALA 2 2 26802 1 . GLN 3 3 26802 1 . GLY 4 4 26802 1 . THR 5 5 26802 1 . VAL 6 6 26802 1 . LYS 7 7 26802 1 . TRP 8 8 26802 1 . PHE 9 9 26802 1 . ASN 10 10 26802 1 . ALA 11 11 26802 1 . GLU 12 12 26802 1 . LYS 13 13 26802 1 . GLY 14 14 26802 1 . PHE 15 15 26802 1 . GLY 16 16 26802 1 . PHE 17 17 26802 1 . ILE 18 18 26802 1 . ALA 19 19 26802 1 . PRO 20 20 26802 1 . ASP 21 21 26802 1 . ASP 22 22 26802 1 . GLY 23 23 26802 1 . SER 24 24 26802 1 . ALA 25 25 26802 1 . ASP 26 26 26802 1 . VAL 27 27 26802 1 . PHE 28 28 26802 1 . VAL 29 29 26802 1 . HIS 30 30 26802 1 . TYR 31 31 26802 1 . SER 32 32 26802 1 . GLU 33 33 26802 1 . ILE 34 34 26802 1 . GLN 35 35 26802 1 . GLY 36 36 26802 1 . ASN 37 37 26802 1 . GLY 38 38 26802 1 . PHE 39 39 26802 1 . ARG 40 40 26802 1 . THR 41 41 26802 1 . LEU 42 42 26802 1 . GLU 43 43 26802 1 . GLU 44 44 26802 1 . ASN 45 45 26802 1 . GLN 46 46 26802 1 . LYS 47 47 26802 1 . VAL 48 48 26802 1 . GLU 49 49 26802 1 . PHE 50 50 26802 1 . GLU 51 51 26802 1 . ILE 52 52 26802 1 . GLY 53 53 26802 1 . GLU 54 54 26802 1 . GLY 55 55 26802 1 . ALA 56 56 26802 1 . LYS 57 57 26802 1 . GLY 58 58 26802 1 . PRO 59 59 26802 1 . GLN 60 60 26802 1 . ALA 61 61 26802 1 . GLN 62 62 26802 1 . GLN 63 63 26802 1 . VAL 64 64 26802 1 . HIS 65 65 26802 1 . ALA 66 66 26802 1 . LEU 67 67 26802 1 . GLY 68 68 26802 1 . GLY 69 69 26802 1 . GLU 70 70 26802 1 . ASN 71 71 26802 1 . LEU 72 72 26802 1 . TYR 73 73 26802 1 . PHE 74 74 26802 1 . GLN 75 75 26802 1 . GLY 76 76 26802 1 . HIS 77 77 26802 1 . HIS 78 78 26802 1 . HIS 79 79 26802 1 . HIS 80 80 26802 1 . HIS 81 81 26802 1 . HIS 82 82 26802 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 26802 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Molecule_1 . 1719 organism . 'Corynebacterium pseudotuberculosis' 'high GC Gram+' . . Bacteria . Corynebacterium pseudotuberculosis . . . . . . . . . . . . . 26802 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 26802 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Molecule_1 . 'recombinant technology' 'Escherichia coli' 'Escherichia coli' . . Escherichia coli 'BL21 (DE3) T1' . . . . . pD441-SR . . 'Cold Shock Protein A' 26802 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_CspA _Sample.Sf_category sample _Sample.Sf_framecode CspA _Sample.Entry_ID 26802 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.8 mM' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Molecule 1' '[U-13C; U-15N]' . . 1 $Molecule_1 . . 0.8 . . mM . . . . 26802 1 2 K2HPO4 'natural abundance' . . . . . . 50.0 . . mM . . . . 26802 1 3 NaCl 'natural abundance' . . . . . . 50.0 . . mM . . . . 26802 1 4 DSS 'natural abundance' . . . . . . 0.1 . . mM . . . . 26802 1 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 26802 1 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 26802 1 stop_ save_ ####################### # Sample conditions # ####################### save_CspA_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode CspA_1 _Sample_condition_list.Entry_ID 26802 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details '50 mM Potassium phosphate, 50 mM NaCl, pH 6.5' loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.050 . M 26802 1 pH 6.500 . pH 26802 1 pressure 1.000 . atm 26802 1 temperature 298.000 . K 26802 1 stop_ save_ ############################ # Computer software used # ############################ save_CcpNmr_Analysis _Software.Sf_category software _Software.Sf_framecode CcpNmr_Analysis _Software.Entry_ID 26802 _Software.ID 1 _Software.Type . _Software.Name CcpNmr_Analysis _Software.Version 2.4 _Software.DOI . _Software.Details 'The CCPN NMR assignment and data analysis application' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN 'Department of Biochemistry, Cambridge CB2 1GA, UK' http://www.ccpn.ac.uk 26802 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'Chemical shift assignment' 26802 1 stop_ save_ save_manual _Method.Sf_category method _Method.Sf_framecode manual _Method.Entry_ID 26802 _Method.ID 1 _Method.Name . _Method.Derivation_type . _Method.Details manual _Method.Computer_ID . _Method.Computer_label . _Method.Computing_platform_ID . _Method.Computing_platform_label . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 26802 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model VNMRS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 26802 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 599 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 26802 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian VNMRS . 900 . . . 26802 1 2 spectrometer_2 Bruker Avance . 599 . . . 26802 1 stop_ save_ save_HCN_Triple_resonance_cryogenic_probe _NMR_spectrometer_probe.Sf_category NMR_spectrometer_probe _NMR_spectrometer_probe.Sf_framecode HCN_Triple_resonance_cryogenic_probe _NMR_spectrometer_probe.Entry_ID 26802 _NMR_spectrometer_probe.ID 1 _NMR_spectrometer_probe.Name . _NMR_spectrometer_probe.Details . _NMR_spectrometer_probe.Manufacturer Varian _NMR_spectrometer_probe.Model . _NMR_spectrometer_probe.Serial_number . _NMR_spectrometer_probe.Diameter 0.005 _NMR_spectrometer_probe.Rotor_length . _NMR_spectrometer_probe.Rotor_composition . _NMR_spectrometer_probe.Internal_volume . _NMR_spectrometer_probe.Spacer_present . loop_ _NMR_probe.Type _NMR_probe.Entry_ID _NMR_probe.NMR_spectrometer_probe_ID liquid 26802 1 stop_ save_ save_QCI_Cryoprobe _NMR_spectrometer_probe.Sf_category NMR_spectrometer_probe _NMR_spectrometer_probe.Sf_framecode QCI_Cryoprobe _NMR_spectrometer_probe.Entry_ID 26802 _NMR_spectrometer_probe.ID 2 _NMR_spectrometer_probe.Name . _NMR_spectrometer_probe.Details . _NMR_spectrometer_probe.Manufacturer Bruker _NMR_spectrometer_probe.Model . _NMR_spectrometer_probe.Serial_number . _NMR_spectrometer_probe.Diameter 0.005 _NMR_spectrometer_probe.Rotor_length . _NMR_spectrometer_probe.Rotor_composition . _NMR_spectrometer_probe.Internal_volume . _NMR_spectrometer_probe.Spacer_present . loop_ _NMR_probe.Type _NMR_probe.Entry_ID _NMR_probe.NMR_spectrometer_probe_ID liquid 26802 2 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 26802 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC/HMQC' no . . . . . . . . . . 1 $CspA isotropic . . 1 $CspA_1 . . . 1 $spectrometer_1 1 $HCN_Triple_resonance_cryogenic_probe . . . . . . . . . . . . . . 26802 1 2 '2D 1H-13C HSQC/HMQC' no . . . . . . . . . . 1 $CspA isotropic . . 1 $CspA_1 . . . 2 $spectrometer_2 2 $QCI_Cryoprobe . . . . . . . . . . . . . . 26802 1 3 'hbcbcgcdhd (hbCBcgcdHD)' no . . . . . . . . . . 1 $CspA isotropic . . 1 $CspA_1 . . . 1 $spectrometer_1 1 $HCN_Triple_resonance_cryogenic_probe . . . . . . . . . . . . . . 26802 1 4 'hbcbcgcdcehe (hbCBcgcdceHE)' no . . . . . . . . . . 1 $CspA isotropic . . 1 $CspA_1 . . . 1 $spectrometer_1 1 $HCN_Triple_resonance_cryogenic_probe . . . . . . . . . . . . . . 26802 1 5 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $CspA isotropic . . 1 $CspA_1 . . . 1 $spectrometer_1 1 $HCN_Triple_resonance_cryogenic_probe . . . . . . . . . . . . . . 26802 1 6 '3D HNCO' no . . . . . . . . . . 1 $CspA isotropic . . 1 $CspA_1 . . . 2 $spectrometer_2 2 $QCI_Cryoprobe . . . . . . . . . . . . . . 26802 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 26802 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 external indirect 0.251 . . . . . 26802 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 26802 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 external indirect 0.101 . . . . . 26802 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list _Assigned_chem_shift_list.Entry_ID 26802 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $CspA_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC/HMQC' 1 $CspA isotropic 26802 1 2 '2D 1H-13C HSQC/HMQC' 1 $CspA isotropic 26802 1 3 'hbcbcgcdhd (hbCBcgcdHD)' 1 $CspA isotropic 26802 1 4 'hbcbcgcdcehe (hbCBcgcdceHE)' 1 $CspA isotropic 26802 1 5 '3D 1H-13C NOESY' 1 $CspA isotropic 26802 1 6 '3D HNCO' 1 $CspA isotropic 26802 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $CcpNmr_Analysis 1 $manual 26802 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 ALA HA H 1 3.943 0.002 . 1 . . 661 . . 2 ALA HA . 26802 1 2 . 1 . 1 2 2 ALA HB1 H 1 0.837 0.002 . 1 . . 662 . . 2 ALA HB1 . 26802 1 3 . 1 . 1 2 2 ALA HB2 H 1 0.837 0.002 . 1 . . 662 . . 2 ALA HB2 . 26802 1 4 . 1 . 1 2 2 ALA HB3 H 1 0.837 0.002 . 1 . . 662 . . 2 ALA HB3 . 26802 1 5 . 1 . 1 2 2 ALA C C 13 172.386 0.002 . 1 . . 444 . . 2 ALA C . 26802 1 6 . 1 . 1 2 2 ALA CA C 13 51.580 0.002 . 1 . . 192 . . 2 ALA CA . 26802 1 7 . 1 . 1 2 2 ALA CB C 13 19.183 0.002 . 1 . . 355 . . 2 ALA CB . 26802 1 8 . 1 . 1 3 3 GLN H H 1 8.406 0.002 . 1 . . 87 . . 3 GLN H . 26802 1 9 . 1 . 1 3 3 GLN HA H 1 5.462 0.002 . 1 . . 709 . . 3 GLN HA . 26802 1 10 . 1 . 1 3 3 GLN HB2 H 1 2.114 0.002 . 2 . . 757 . . 3 GLN HB2 . 26802 1 11 . 1 . 1 3 3 GLN HB3 H 1 2.007 0.002 . 2 . . 758 . . 3 GLN HB3 . 26802 1 12 . 1 . 1 3 3 GLN HG2 H 1 2.327 0.002 . 2 . . 710 . . 3 GLN HG2 . 26802 1 13 . 1 . 1 3 3 GLN HG3 H 1 2.418 0.002 . 2 . . 711 . . 3 GLN HG3 . 26802 1 14 . 1 . 1 3 3 GLN HE21 H 1 7.721 0.002 . 1 . . 827 . . 3 GLN HE21 . 26802 1 15 . 1 . 1 3 3 GLN HE22 H 1 6.743 0.002 . 1 . . 829 . . 3 GLN HE22 . 26802 1 16 . 1 . 1 3 3 GLN C C 13 176.232 0.002 . 1 . . 463 . . 3 GLN C . 26802 1 17 . 1 . 1 3 3 GLN CA C 13 54.250 0.002 . 1 . . 191 . . 3 GLN CA . 26802 1 18 . 1 . 1 3 3 GLN CB C 13 31.870 0.002 . 1 . . 756 . . 3 GLN CB . 26802 1 19 . 1 . 1 3 3 GLN CG C 13 34.460 0.002 . 1 . . 388 . . 3 GLN CG . 26802 1 20 . 1 . 1 3 3 GLN CD C 13 180.086 0.002 . 1 . . 933 . . 3 GLN CD . 26802 1 21 . 1 . 1 3 3 GLN N N 15 116.430 0.010 . 1 . . 88 . . 3 GLN N . 26802 1 22 . 1 . 1 3 3 GLN NE2 N 15 111.554 0.010 . 1 . . 828 . . 3 GLN NE2 . 26802 1 23 . 1 . 1 4 4 GLY H H 1 8.811 0.002 . 1 . . 179 . . 4 GLY H . 26802 1 24 . 1 . 1 4 4 GLY HA2 H 1 4.737 0.002 . 2 . . 666 . . 4 GLY HA2 . 26802 1 25 . 1 . 1 4 4 GLY HA3 H 1 3.919 0.002 . 2 . . 667 . . 4 GLY HA3 . 26802 1 26 . 1 . 1 4 4 GLY C C 13 171.288 0.002 . 1 . . 449 . . 4 GLY C . 26802 1 27 . 1 . 1 4 4 GLY CA C 13 46.345 0.002 . 1 . . 190 . . 4 GLY CA . 26802 1 28 . 1 . 1 4 4 GLY N N 15 108.203 0.010 . 1 . . 180 . . 4 GLY N . 26802 1 29 . 1 . 1 5 5 THR H H 1 8.337 0.002 . 1 . . 45 . . 5 THR H . 26802 1 30 . 1 . 1 5 5 THR HA H 1 5.131 0.002 . 1 . . 497 . . 5 THR HA . 26802 1 31 . 1 . 1 5 5 THR HB H 1 3.854 0.002 . 1 . . 498 . . 5 THR HB . 26802 1 32 . 1 . 1 5 5 THR HG21 H 1 1.135 0.002 . 1 . . 500 . . 5 THR HG21 . 26802 1 33 . 1 . 1 5 5 THR HG22 H 1 1.135 0.002 . 1 . . 500 . . 5 THR HG22 . 26802 1 34 . 1 . 1 5 5 THR HG23 H 1 1.135 0.002 . 1 . . 500 . . 5 THR HG23 . 26802 1 35 . 1 . 1 5 5 THR C C 13 174.238 0.002 . 1 . . 400 . . 5 THR C . 26802 1 36 . 1 . 1 5 5 THR CA C 13 60.764 0.002 . 1 . . 189 . . 5 THR CA . 26802 1 37 . 1 . 1 5 5 THR CB C 13 71.542 0.002 . 1 . . 307 . . 5 THR CB . 26802 1 38 . 1 . 1 5 5 THR CG2 C 13 21.873 0.002 . 1 . . 308 . . 5 THR CG2 . 26802 1 39 . 1 . 1 5 5 THR N N 15 115.625 0.010 . 1 . . 46 . . 5 THR N . 26802 1 40 . 1 . 1 6 6 VAL H H 1 9.135 0.002 . 1 . . 63 . . 6 VAL H . 26802 1 41 . 1 . 1 6 6 VAL HA H 1 3.564 0.002 . 1 . . 470 . . 6 VAL HA . 26802 1 42 . 1 . 1 6 6 VAL HB H 1 2.418 0.002 . 1 . . 471 . . 6 VAL HB . 26802 1 43 . 1 . 1 6 6 VAL HG11 H 1 0.831 0.002 . 2 . . 472 . . 6 VAL HG11 . 26802 1 44 . 1 . 1 6 6 VAL HG12 H 1 0.831 0.002 . 2 . . 472 . . 6 VAL HG12 . 26802 1 45 . 1 . 1 6 6 VAL HG13 H 1 0.831 0.002 . 2 . . 472 . . 6 VAL HG13 . 26802 1 46 . 1 . 1 6 6 VAL HG21 H 1 0.494 0.002 . 2 . . 473 . . 6 VAL HG21 . 26802 1 47 . 1 . 1 6 6 VAL HG22 H 1 0.494 0.002 . 2 . . 473 . . 6 VAL HG22 . 26802 1 48 . 1 . 1 6 6 VAL HG23 H 1 0.494 0.002 . 2 . . 473 . . 6 VAL HG23 . 26802 1 49 . 1 . 1 6 6 VAL C C 13 175.366 0.002 . 1 . . 393 . . 6 VAL C . 26802 1 50 . 1 . 1 6 6 VAL CA C 13 64.738 0.002 . 1 . . 188 . . 6 VAL CA . 26802 1 51 . 1 . 1 6 6 VAL CB C 13 31.650 0.002 . 1 . . 291 . . 6 VAL CB . 26802 1 52 . 1 . 1 6 6 VAL CG1 C 13 23.968 0.002 . 2 . . 292 . . 6 VAL CG1 . 26802 1 53 . 1 . 1 6 6 VAL CG2 C 13 21.176 0.002 . 2 . . 293 . . 6 VAL CG2 . 26802 1 54 . 1 . 1 6 6 VAL N N 15 127.207 0.010 . 1 . . 64 . . 6 VAL N . 26802 1 55 . 1 . 1 7 7 LYS H H 1 9.063 0.002 . 1 . . 89 . . 7 LYS H . 26802 1 56 . 1 . 1 7 7 LYS HA H 1 4.384 0.002 . 1 . . 696 . . 7 LYS HA . 26802 1 57 . 1 . 1 7 7 LYS HB2 H 1 1.614 0.002 . 2 . . 760 . . 7 LYS HB2 . 26802 1 58 . 1 . 1 7 7 LYS HB3 H 1 1.872 0.002 . 2 . . 761 . . 7 LYS HB3 . 26802 1 59 . 1 . 1 7 7 LYS HG2 H 1 1.614 0.002 . 2 . . 939 . . 7 LYS HG2 . 26802 1 60 . 1 . 1 7 7 LYS HG3 H 1 1.529 0.002 . 2 . . 940 . . 7 LYS HG3 . 26802 1 61 . 1 . 1 7 7 LYS HD2 H 1 1.746 0.002 . 2 . . 942 . . 7 LYS HD2 . 26802 1 62 . 1 . 1 7 7 LYS HD3 H 1 1.615 0.002 . 2 . . 943 . . 7 LYS HD3 . 26802 1 63 . 1 . 1 7 7 LYS HE2 H 1 3.038 0.002 . 1 . . 697 . . 7 LYS HE2 . 26802 1 64 . 1 . 1 7 7 LYS HE3 H 1 3.038 0.002 . 1 . . 698 . . 7 LYS HE3 . 26802 1 65 . 1 . 1 7 7 LYS C C 13 176.418 0.002 . 1 . . 456 . . 7 LYS C . 26802 1 66 . 1 . 1 7 7 LYS CA C 13 58.115 0.002 . 1 . . 261 . . 7 LYS CA . 26802 1 67 . 1 . 1 7 7 LYS CB C 13 33.889 0.002 . 1 . . 370 . . 7 LYS CB . 26802 1 68 . 1 . 1 7 7 LYS CG C 13 24.846 0.002 . 1 . . 372 . . 7 LYS CG . 26802 1 69 . 1 . 1 7 7 LYS CD C 13 28.845 0.002 . 1 . . 371 . . 7 LYS CD . 26802 1 70 . 1 . 1 7 7 LYS CE C 13 41.446 0.002 . 1 . . 369 . . 7 LYS CE . 26802 1 71 . 1 . 1 7 7 LYS N N 15 133.709 0.010 . 1 . . 90 . . 7 LYS N . 26802 1 72 . 1 . 1 8 8 TRP H H 1 7.377 0.002 . 1 . . 131 . . 8 TRP H . 26802 1 73 . 1 . 1 8 8 TRP HA H 1 4.604 0.002 . 1 . . 587 . . 8 TRP HA . 26802 1 74 . 1 . 1 8 8 TRP HB2 H 1 3.533 0.002 . 2 . . 588 . . 8 TRP HB2 . 26802 1 75 . 1 . 1 8 8 TRP HB3 H 1 3.359 0.002 . 2 . . 589 . . 8 TRP HB3 . 26802 1 76 . 1 . 1 8 8 TRP HD1 H 1 7.142 0.002 . 1 . . 787 . . 8 TRP HD1 . 26802 1 77 . 1 . 1 8 8 TRP HE1 H 1 10.351 0.002 . 1 . . 285 . . 8 TRP HE1 . 26802 1 78 . 1 . 1 8 8 TRP HE3 H 1 7.325 0.002 . 1 . . 898 . . 8 TRP HE3 . 26802 1 79 . 1 . 1 8 8 TRP HZ2 H 1 7.652 0.002 . 1 . . 790 . . 8 TRP HZ2 . 26802 1 80 . 1 . 1 8 8 TRP HZ3 H 1 6.746 0.002 . 1 . . 896 . . 8 TRP HZ3 . 26802 1 81 . 1 . 1 8 8 TRP HH2 H 1 7.333 0.002 . 1 . . 893 . . 8 TRP HH2 . 26802 1 82 . 1 . 1 8 8 TRP C C 13 173.549 0.002 . 1 . . 425 . . 8 TRP C . 26802 1 83 . 1 . 1 8 8 TRP CA C 13 56.117 0.002 . 1 . . 262 . . 8 TRP CA . 26802 1 84 . 1 . 1 8 8 TRP CB C 13 30.789 0.002 . 1 . . 331 . . 8 TRP CB . 26802 1 85 . 1 . 1 8 8 TRP CD1 C 13 128.217 0.002 . 1 . . 788 . . 8 TRP CD1 . 26802 1 86 . 1 . 1 8 8 TRP CE3 C 13 120.234 0.002 . 1 . . 897 . . 8 TRP CE3 . 26802 1 87 . 1 . 1 8 8 TRP CZ2 C 13 115.303 0.002 . 1 . . 789 . . 8 TRP CZ2 . 26802 1 88 . 1 . 1 8 8 TRP CZ3 C 13 122.373 0.002 . 1 . . 895 . . 8 TRP CZ3 . 26802 1 89 . 1 . 1 8 8 TRP CH2 C 13 123.974 0.002 . 1 . . 892 . . 8 TRP CH2 . 26802 1 90 . 1 . 1 8 8 TRP N N 15 112.071 0.010 . 1 . . 132 . . 8 TRP N . 26802 1 91 . 1 . 1 8 8 TRP NE1 N 15 129.934 0.010 . 1 . . 286 . . 8 TRP NE1 . 26802 1 92 . 1 . 1 9 9 PHE H H 1 9.098 0.002 . 1 . . 129 . . 9 PHE H . 26802 1 93 . 1 . 1 9 9 PHE HA H 1 4.228 0.002 . 1 . . 501 . . 9 PHE HA . 26802 1 94 . 1 . 1 9 9 PHE HB2 H 1 2.779 0.002 . 2 . . 502 . . 9 PHE HB2 . 26802 1 95 . 1 . 1 9 9 PHE HB3 H 1 2.383 0.002 . 2 . . 503 . . 9 PHE HB3 . 26802 1 96 . 1 . 1 9 9 PHE HD1 H 1 6.710 0.002 . 1 . . 809 . . 9 PHE HD1 . 26802 1 97 . 1 . 1 9 9 PHE HD2 H 1 6.710 0.002 . 1 . . 809 . . 9 PHE HD2 . 26802 1 98 . 1 . 1 9 9 PHE HE1 H 1 6.956 0.002 . 1 . . 808 . . 9 PHE HE1 . 26802 1 99 . 1 . 1 9 9 PHE HE2 H 1 6.956 0.002 . 1 . . 808 . . 9 PHE HE2 . 26802 1 100 . 1 . 1 9 9 PHE HZ H 1 6.725 0.002 . 1 . . 919 . . 9 PHE HZ . 26802 1 101 . 1 . 1 9 9 PHE C C 13 172.417 0.002 . 1 . . 401 . . 9 PHE C . 26802 1 102 . 1 . 1 9 9 PHE CA C 13 59.323 0.002 . 1 . . 263 . . 9 PHE CA . 26802 1 103 . 1 . 1 9 9 PHE CB C 13 42.286 0.002 . 1 . . 306 . . 9 PHE CB . 26802 1 104 . 1 . 1 9 9 PHE CD1 C 13 131.783 0.002 . 1 . . 910 . . 9 PHE CD1 . 26802 1 105 . 1 . 1 9 9 PHE CD2 C 13 131.783 0.002 . 1 . . 910 . . 9 PHE CD2 . 26802 1 106 . 1 . 1 9 9 PHE CE1 C 13 130.627 0.002 . 1 . . 915 . . 9 PHE CE1 . 26802 1 107 . 1 . 1 9 9 PHE CE2 C 13 130.627 0.002 . 1 . . 915 . . 9 PHE CE2 . 26802 1 108 . 1 . 1 9 9 PHE CZ C 13 128.680 0.002 . 1 . . 918 . . 9 PHE CZ . 26802 1 109 . 1 . 1 9 9 PHE N N 15 120.836 0.010 . 1 . . 130 . . 9 PHE N . 26802 1 110 . 1 . 1 10 10 ASN H H 1 8.200 0.002 . 1 . . 101 . . 10 ASN H . 26802 1 111 . 1 . 1 10 10 ASN HA H 1 4.772 0.002 . 1 . . 479 . . 10 ASN HA . 26802 1 112 . 1 . 1 10 10 ASN HB2 H 1 2.460 0.002 . 2 . . 480 . . 10 ASN HB2 . 26802 1 113 . 1 . 1 10 10 ASN HB3 H 1 2.514 0.002 . 2 . . 481 . . 10 ASN HB3 . 26802 1 114 . 1 . 1 10 10 ASN HD21 H 1 7.242 0.002 . 1 . . 837 . . 10 ASN HD21 . 26802 1 115 . 1 . 1 10 10 ASN HD22 H 1 7.527 0.002 . 1 . . 839 . . 10 ASN HD22 . 26802 1 116 . 1 . 1 10 10 ASN C C 13 174.121 0.002 . 1 . . 397 . . 10 ASN C . 26802 1 117 . 1 . 1 10 10 ASN CA C 13 51.606 0.002 . 1 . . 264 . . 10 ASN CA . 26802 1 118 . 1 . 1 10 10 ASN CB C 13 39.062 0.002 . 1 . . 301 . . 10 ASN CB . 26802 1 119 . 1 . 1 10 10 ASN CG C 13 176.467 0.002 . 1 . . 929 . . 10 ASN CG . 26802 1 120 . 1 . 1 10 10 ASN N N 15 127.232 0.010 . 1 . . 102 . . 10 ASN N . 26802 1 121 . 1 . 1 10 10 ASN ND2 N 15 112.946 0.010 . 1 . . 838 . . 10 ASN ND2 . 26802 1 122 . 1 . 1 11 11 ALA H H 1 8.976 0.002 . 1 . . 123 . . 11 ALA H . 26802 1 123 . 1 . 1 11 11 ALA HA H 1 4.035 0.002 . 1 . . 469 . . 11 ALA HA . 26802 1 124 . 1 . 1 11 11 ALA HB1 H 1 1.584 0.002 . 1 . . 643 . . 11 ALA HB1 . 26802 1 125 . 1 . 1 11 11 ALA HB2 H 1 1.584 0.002 . 1 . . 643 . . 11 ALA HB2 . 26802 1 126 . 1 . 1 11 11 ALA HB3 H 1 1.584 0.002 . 1 . . 643 . . 11 ALA HB3 . 26802 1 127 . 1 . 1 11 11 ALA C C 13 178.962 0.002 . 1 . . 439 . . 11 ALA C . 26802 1 128 . 1 . 1 11 11 ALA CA C 13 54.636 0.002 . 1 . . 265 . . 11 ALA CA . 26802 1 129 . 1 . 1 11 11 ALA CB C 13 18.766 0.002 . 1 . . 349 . . 11 ALA CB . 26802 1 130 . 1 . 1 11 11 ALA N N 15 128.672 0.010 . 1 . . 124 . . 11 ALA N . 26802 1 131 . 1 . 1 12 12 GLU H H 1 8.125 0.002 . 1 . . 51 . . 12 GLU H . 26802 1 132 . 1 . 1 12 12 GLU HA H 1 4.038 0.002 . 1 . . 663 . . 12 GLU HA . 26802 1 133 . 1 . 1 12 12 GLU HB2 H 1 2.118 0.002 . 1 . . 762 . . 12 GLU HB2 . 26802 1 134 . 1 . 1 12 12 GLU HB3 H 1 2.118 0.002 . 1 . . 763 . . 12 GLU HB3 . 26802 1 135 . 1 . 1 12 12 GLU HG2 H 1 2.213 0.002 . 2 . . 766 . . 12 GLU HG2 . 26802 1 136 . 1 . 1 12 12 GLU HG3 H 1 2.287 0.002 . 2 . . 767 . . 12 GLU HG3 . 26802 1 137 . 1 . 1 12 12 GLU C C 13 178.498 0.002 . 1 . . 447 . . 12 GLU C . 26802 1 138 . 1 . 1 12 12 GLU CA C 13 59.252 0.002 . 1 . . 198 . . 12 GLU CA . 26802 1 139 . 1 . 1 12 12 GLU CB C 13 29.363 0.002 . 1 . . 764 . . 12 GLU CB . 26802 1 140 . 1 . 1 12 12 GLU CG C 13 36.585 0.002 . 1 . . 765 . . 12 GLU CG . 26802 1 141 . 1 . 1 12 12 GLU N N 15 118.054 0.010 . 1 . . 52 . . 12 GLU N . 26802 1 142 . 1 . 1 13 13 LYS H H 1 7.579 0.002 . 1 . . 119 . . 13 LYS H . 26802 1 143 . 1 . 1 13 13 LYS HA H 1 4.275 0.002 . 1 . . 714 . . 13 LYS HA . 26802 1 144 . 1 . 1 13 13 LYS HB2 H 1 1.904 0.002 . 2 . . 719 . . 13 LYS HB2 . 26802 1 145 . 1 . 1 13 13 LYS HB3 H 1 1.160 0.002 . 2 . . 720 . . 13 LYS HB3 . 26802 1 146 . 1 . 1 13 13 LYS HG2 H 1 1.403 0.002 . 2 . . 717 . . 13 LYS HG2 . 26802 1 147 . 1 . 1 13 13 LYS HG3 H 1 1.473 0.002 . 2 . . 718 . . 13 LYS HG3 . 26802 1 148 . 1 . 1 13 13 LYS HD2 H 1 1.770 0.002 . 2 . . 721 . . 13 LYS HD2 . 26802 1 149 . 1 . 1 13 13 LYS HD3 H 1 1.608 0.002 . 2 . . 722 . . 13 LYS HD3 . 26802 1 150 . 1 . 1 13 13 LYS HE2 H 1 3.000 0.002 . 2 . . 715 . . 13 LYS HE2 . 26802 1 151 . 1 . 1 13 13 LYS HE3 H 1 3.048 0.002 . 2 . . 716 . . 13 LYS HE3 . 26802 1 152 . 1 . 1 13 13 LYS C C 13 177.430 0.002 . 1 . . 464 . . 13 LYS C . 26802 1 153 . 1 . 1 13 13 LYS CA C 13 56.367 0.002 . 1 . . 197 . . 13 LYS CA . 26802 1 154 . 1 . 1 13 13 LYS CB C 13 33.805 0.002 . 1 . . 380 . . 13 LYS CB . 26802 1 155 . 1 . 1 13 13 LYS CG C 13 25.763 0.002 . 1 . . 382 . . 13 LYS CG . 26802 1 156 . 1 . 1 13 13 LYS CD C 13 28.992 0.002 . 1 . . 381 . . 13 LYS CD . 26802 1 157 . 1 . 1 13 13 LYS CE C 13 42.301 0.002 . 1 . . 379 . . 13 LYS CE . 26802 1 158 . 1 . 1 13 13 LYS N N 15 116.118 0.010 . 1 . . 120 . . 13 LYS N . 26802 1 159 . 1 . 1 14 14 GLY H H 1 8.192 0.002 . 1 . . 9 . . 14 GLY H . 26802 1 160 . 1 . 1 14 14 GLY HA2 H 1 4.087 0.002 . 2 . . 687 . . 14 GLY HA2 . 26802 1 161 . 1 . 1 14 14 GLY HA3 H 1 3.689 0.002 . 2 . . 688 . . 14 GLY HA3 . 26802 1 162 . 1 . 1 14 14 GLY C C 13 172.356 0.002 . 1 . . 453 . . 14 GLY C . 26802 1 163 . 1 . 1 14 14 GLY CA C 13 46.356 0.002 . 1 . . 266 . . 14 GLY CA . 26802 1 164 . 1 . 1 14 14 GLY N N 15 107.881 0.010 . 1 . . 10 . . 14 GLY N . 26802 1 165 . 1 . 1 15 15 PHE H H 1 6.660 0.002 . 1 . . 17 . . 15 PHE H . 26802 1 166 . 1 . 1 15 15 PHE HA H 1 5.146 0.002 . 1 . . 727 . . 15 PHE HA . 26802 1 167 . 1 . 1 15 15 PHE HB2 H 1 2.965 0.002 . 2 . . 728 . . 15 PHE HB2 . 26802 1 168 . 1 . 1 15 15 PHE HB3 H 1 2.857 0.002 . 2 . . 729 . . 15 PHE HB3 . 26802 1 169 . 1 . 1 15 15 PHE HD1 H 1 6.962 0.002 . 1 . . 807 . . 15 PHE HD1 . 26802 1 170 . 1 . 1 15 15 PHE HD2 H 1 6.962 0.002 . 1 . . 807 . . 15 PHE HD2 . 26802 1 171 . 1 . 1 15 15 PHE HE1 H 1 7.579 0.002 . 1 . . 806 . . 15 PHE HE1 . 26802 1 172 . 1 . 1 15 15 PHE HE2 H 1 7.579 0.002 . 1 . . 806 . . 15 PHE HE2 . 26802 1 173 . 1 . 1 15 15 PHE C C 13 171.922 0.002 . 1 . . 466 . . 15 PHE C . 26802 1 174 . 1 . 1 15 15 PHE CA C 13 55.192 0.002 . 1 . . 267 . . 15 PHE CA . 26802 1 175 . 1 . 1 15 15 PHE CB C 13 42.413 0.002 . 1 . . 391 . . 15 PHE CB . 26802 1 176 . 1 . 1 15 15 PHE CD1 C 13 132.686 0.002 . 1 . . 917 . . 15 PHE CD1 . 26802 1 177 . 1 . 1 15 15 PHE CD2 C 13 132.686 0.002 . 1 . . 917 . . 15 PHE CD2 . 26802 1 178 . 1 . 1 15 15 PHE CE1 C 13 131.423 0.002 . 1 . . 908 . . 15 PHE CE1 . 26802 1 179 . 1 . 1 15 15 PHE CE2 C 13 131.423 0.002 . 1 . . 908 . . 15 PHE CE2 . 26802 1 180 . 1 . 1 15 15 PHE N N 15 112.701 0.010 . 1 . . 18 . . 15 PHE N . 26802 1 181 . 1 . 1 16 16 GLY H H 1 8.094 0.002 . 1 . . 147 . . 16 GLY H . 26802 1 182 . 1 . 1 16 16 GLY HA2 H 1 3.866 0.002 . 2 . . 681 . . 16 GLY HA2 . 26802 1 183 . 1 . 1 16 16 GLY HA3 H 1 2.883 0.002 . 2 . . 682 . . 16 GLY HA3 . 26802 1 184 . 1 . 1 16 16 GLY C C 13 170.517 0.002 . 1 . . 452 . . 16 GLY C . 26802 1 185 . 1 . 1 16 16 GLY CA C 13 45.262 0.002 . 1 . . 268 . . 16 GLY CA . 26802 1 186 . 1 . 1 16 16 GLY N N 15 105.694 0.010 . 1 . . 148 . . 16 GLY N . 26802 1 187 . 1 . 1 17 17 PHE H H 1 7.673 0.002 . 1 . . 165 . . 17 PHE H . 26802 1 188 . 1 . 1 17 17 PHE HA H 1 5.241 0.002 . 1 . . 558 . . 17 PHE HA . 26802 1 189 . 1 . 1 17 17 PHE HB2 H 1 2.575 0.002 . 2 . . 559 . . 17 PHE HB2 . 26802 1 190 . 1 . 1 17 17 PHE HB3 H 1 2.244 0.002 . 2 . . 560 . . 17 PHE HB3 . 26802 1 191 . 1 . 1 17 17 PHE HD1 H 1 6.790 0.002 . 1 . . 811 . . 17 PHE HD1 . 26802 1 192 . 1 . 1 17 17 PHE HD2 H 1 6.790 0.002 . 1 . . 811 . . 17 PHE HD2 . 26802 1 193 . 1 . 1 17 17 PHE HE1 H 1 7.553 0.002 . 1 . . 810 . . 17 PHE HE1 . 26802 1 194 . 1 . 1 17 17 PHE HE2 H 1 7.553 0.002 . 1 . . 810 . . 17 PHE HE2 . 26802 1 195 . 1 . 1 17 17 PHE C C 13 174.739 0.002 . 1 . . 416 . . 17 PHE C . 26802 1 196 . 1 . 1 17 17 PHE CA C 13 56.806 0.002 . 1 . . 269 . . 17 PHE CA . 26802 1 197 . 1 . 1 17 17 PHE CB C 13 45.313 0.002 . 1 . . 324 . . 17 PHE CB . 26802 1 198 . 1 . 1 17 17 PHE CD1 C 13 131.750 0.002 . 1 . . 905 . . 17 PHE CD1 . 26802 1 199 . 1 . 1 17 17 PHE CD2 C 13 131.750 0.002 . 1 . . 905 . . 17 PHE CD2 . 26802 1 200 . 1 . 1 17 17 PHE CE1 C 13 131.484 0.002 . 1 . . 907 . . 17 PHE CE1 . 26802 1 201 . 1 . 1 17 17 PHE CE2 C 13 131.484 0.002 . 1 . . 907 . . 17 PHE CE2 . 26802 1 202 . 1 . 1 17 17 PHE N N 15 114.695 0.010 . 1 . . 166 . . 17 PHE N . 26802 1 203 . 1 . 1 18 18 ILE H H 1 9.387 0.002 . 1 . . 183 . . 18 ILE H . 26802 1 204 . 1 . 1 18 18 ILE HA H 1 4.167 0.002 . 1 . . 474 . . 18 ILE HA . 26802 1 205 . 1 . 1 18 18 ILE HB H 1 0.969 0.002 . 1 . . 494 . . 18 ILE HB . 26802 1 206 . 1 . 1 18 18 ILE HG12 H 1 0.340 0.002 . 2 . . 495 . . 18 ILE HG12 . 26802 1 207 . 1 . 1 18 18 ILE HG13 H 1 1.144 0.002 . 2 . . 496 . . 18 ILE HG13 . 26802 1 208 . 1 . 1 18 18 ILE HG21 H 1 0.108 0.002 . 1 . . 493 . . 18 ILE HG21 . 26802 1 209 . 1 . 1 18 18 ILE HG22 H 1 0.108 0.002 . 1 . . 493 . . 18 ILE HG22 . 26802 1 210 . 1 . 1 18 18 ILE HG23 H 1 0.108 0.002 . 1 . . 493 . . 18 ILE HG23 . 26802 1 211 . 1 . 1 18 18 ILE HD11 H 1 -0.091 0.002 . 1 . . 492 . . 18 ILE HD11 . 26802 1 212 . 1 . 1 18 18 ILE HD12 H 1 -0.091 0.002 . 1 . . 492 . . 18 ILE HD12 . 26802 1 213 . 1 . 1 18 18 ILE HD13 H 1 -0.091 0.002 . 1 . . 492 . . 18 ILE HD13 . 26802 1 214 . 1 . 1 18 18 ILE C C 13 173.779 0.002 . 1 . . 394 . . 18 ILE C . 26802 1 215 . 1 . 1 18 18 ILE CA C 13 59.393 0.002 . 1 . . 270 . . 18 ILE CA . 26802 1 216 . 1 . 1 18 18 ILE CB C 13 41.984 0.002 . 1 . . 294 . . 18 ILE CB . 26802 1 217 . 1 . 1 18 18 ILE CG1 C 13 27.948 0.002 . 1 . . 295 . . 18 ILE CG1 . 26802 1 218 . 1 . 1 18 18 ILE CG2 C 13 17.670 0.002 . 1 . . 296 . . 18 ILE CG2 . 26802 1 219 . 1 . 1 18 18 ILE CD1 C 13 14.053 0.002 . 1 . . 297 . . 18 ILE CD1 . 26802 1 220 . 1 . 1 18 18 ILE N N 15 121.868 0.010 . 1 . . 184 . . 18 ILE N . 26802 1 221 . 1 . 1 19 19 ALA H H 1 9.216 0.002 . 1 . . 25 . . 19 ALA H . 26802 1 222 . 1 . 1 19 19 ALA HA H 1 5.333 0.002 . 1 . . 746 . . 19 ALA HA . 26802 1 223 . 1 . 1 19 19 ALA HB1 H 1 1.431 0.002 . 1 . . 801 . . 19 ALA HB1 . 26802 1 224 . 1 . 1 19 19 ALA HB2 H 1 1.431 0.002 . 1 . . 801 . . 19 ALA HB2 . 26802 1 225 . 1 . 1 19 19 ALA HB3 H 1 1.431 0.002 . 1 . . 801 . . 19 ALA HB3 . 26802 1 226 . 1 . 1 19 19 ALA CA C 13 48.624 0.002 . 1 . . 271 . . 19 ALA CA . 26802 1 227 . 1 . 1 19 19 ALA CB C 13 19.641 0.002 . 1 . . 800 . . 19 ALA CB . 26802 1 228 . 1 . 1 19 19 ALA N N 15 131.144 0.010 . 1 . . 26 . . 19 ALA N . 26802 1 229 . 1 . 1 20 20 PRO HA H 1 4.692 0.002 . 1 . . 504 . . 20 PRO HA . 26802 1 230 . 1 . 1 20 20 PRO HB2 H 1 2.472 0.002 . 2 . . 507 . . 20 PRO HB2 . 26802 1 231 . 1 . 1 20 20 PRO HB3 H 1 2.280 0.002 . 2 . . 508 . . 20 PRO HB3 . 26802 1 232 . 1 . 1 20 20 PRO HG2 H 1 1.793 0.002 . 2 . . 510 . . 20 PRO HG2 . 26802 1 233 . 1 . 1 20 20 PRO HG3 H 1 2.263 0.002 . 2 . . 882 . . 20 PRO HG3 . 26802 1 234 . 1 . 1 20 20 PRO HD2 H 1 4.505 0.002 . 2 . . 505 . . 20 PRO HD2 . 26802 1 235 . 1 . 1 20 20 PRO HD3 H 1 3.809 0.002 . 2 . . 506 . . 20 PRO HD3 . 26802 1 236 . 1 . 1 20 20 PRO C C 13 177.945 0.002 . 1 . . 404 . . 20 PRO C . 26802 1 237 . 1 . 1 20 20 PRO CA C 13 63.477 0.002 . 1 . . 209 . . 20 PRO CA . 26802 1 238 . 1 . 1 20 20 PRO CB C 13 33.175 0.002 . 1 . . 313 . . 20 PRO CB . 26802 1 239 . 1 . 1 20 20 PRO CG C 13 28.779 0.002 . 1 . . 314 . . 20 PRO CG . 26802 1 240 . 1 . 1 20 20 PRO CD C 13 52.638 0.002 . 1 . . 312 . . 20 PRO CD . 26802 1 241 . 1 . 1 21 21 ASP H H 1 9.197 0.002 . 1 . . 29 . . 21 ASP H . 26802 1 242 . 1 . 1 21 21 ASP HA H 1 4.485 0.002 . 1 . . 654 . . 21 ASP HA . 26802 1 243 . 1 . 1 21 21 ASP HB2 H 1 2.683 0.002 . 1 . . 655 . . 21 ASP HB2 . 26802 1 244 . 1 . 1 21 21 ASP HB3 H 1 2.683 0.002 . 1 . . 656 . . 21 ASP HB3 . 26802 1 245 . 1 . 1 21 21 ASP C C 13 176.885 0.002 . 1 . . 445 . . 21 ASP C . 26802 1 246 . 1 . 1 21 21 ASP CA C 13 56.647 0.002 . 1 . . 208 . . 21 ASP CA . 26802 1 247 . 1 . 1 21 21 ASP CB C 13 40.153 0.002 . 1 . . 356 . . 21 ASP CB . 26802 1 248 . 1 . 1 21 21 ASP N N 15 125.232 0.010 . 1 . . 30 . . 21 ASP N . 26802 1 249 . 1 . 1 22 22 ASP H H 1 8.041 0.002 . 1 . . 61 . . 22 ASP H . 26802 1 250 . 1 . 1 22 22 ASP HA H 1 4.511 0.002 . 1 . . 724 . . 22 ASP HA . 26802 1 251 . 1 . 1 22 22 ASP HB2 H 1 3.123 0.002 . 2 . . 725 . . 22 ASP HB2 . 26802 1 252 . 1 . 1 22 22 ASP HB3 H 1 2.672 0.002 . 2 . . 726 . . 22 ASP HB3 . 26802 1 253 . 1 . 1 22 22 ASP C C 13 177.796 0.002 . 1 . . 465 . . 22 ASP C . 26802 1 254 . 1 . 1 22 22 ASP CA C 13 53.766 0.002 . 1 . . 210 . . 22 ASP CA . 26802 1 255 . 1 . 1 22 22 ASP CB C 13 39.921 0.002 . 1 . . 390 . . 22 ASP CB . 26802 1 256 . 1 . 1 22 22 ASP N N 15 116.690 0.010 . 1 . . 62 . . 22 ASP N . 26802 1 257 . 1 . 1 23 23 GLY H H 1 7.822 0.002 . 1 . . 21 . . 23 GLY H . 26802 1 258 . 1 . 1 23 23 GLY HA2 H 1 4.154 0.002 . 2 . . 664 . . 23 GLY HA2 . 26802 1 259 . 1 . 1 23 23 GLY HA3 H 1 3.968 0.002 . 2 . . 665 . . 23 GLY HA3 . 26802 1 260 . 1 . 1 23 23 GLY C C 13 174.785 0.002 . 1 . . 448 . . 23 GLY C . 26802 1 261 . 1 . 1 23 23 GLY CA C 13 45.888 0.002 . 1 . . 211 . . 23 GLY CA . 26802 1 262 . 1 . 1 23 23 GLY N N 15 107.454 0.010 . 1 . . 22 . . 23 GLY N . 26802 1 263 . 1 . 1 24 24 SER H H 1 7.974 0.002 . 1 . . 127 . . 24 SER H . 26802 1 264 . 1 . 1 24 24 SER HA H 1 4.333 0.002 . 1 . . 606 . . 24 SER HA . 26802 1 265 . 1 . 1 24 24 SER HB2 H 1 4.162 0.002 . 2 . . 607 . . 24 SER HB2 . 26802 1 266 . 1 . 1 24 24 SER HB3 H 1 3.939 0.002 . 2 . . 608 . . 24 SER HB3 . 26802 1 267 . 1 . 1 24 24 SER C C 13 171.788 0.002 . 1 . . 432 . . 24 SER C . 26802 1 268 . 1 . 1 24 24 SER CA C 13 58.585 0.002 . 1 . . 212 . . 24 SER CA . 26802 1 269 . 1 . 1 24 24 SER CB C 13 63.336 0.002 . 1 . . 335 . . 24 SER CB . 26802 1 270 . 1 . 1 24 24 SER N N 15 115.829 0.010 . 1 . . 128 . . 24 SER N . 26802 1 271 . 1 . 1 25 25 ALA H H 1 7.857 0.002 . 1 . . 41 . . 25 ALA H . 26802 1 272 . 1 . 1 25 25 ALA HA H 1 4.099 0.002 . 1 . . 652 . . 25 ALA HA . 26802 1 273 . 1 . 1 25 25 ALA HB1 H 1 1.448 0.002 . 1 . . 653 . . 25 ALA HB1 . 26802 1 274 . 1 . 1 25 25 ALA HB2 H 1 1.448 0.002 . 1 . . 653 . . 25 ALA HB2 . 26802 1 275 . 1 . 1 25 25 ALA HB3 H 1 1.448 0.002 . 1 . . 653 . . 25 ALA HB3 . 26802 1 276 . 1 . 1 25 25 ALA C C 13 176.370 0.002 . 1 . . 442 . . 25 ALA C . 26802 1 277 . 1 . 1 25 25 ALA CA C 13 52.941 0.002 . 1 . . 213 . . 25 ALA CA . 26802 1 278 . 1 . 1 25 25 ALA CB C 13 19.506 0.002 . 1 . . 354 . . 25 ALA CB . 26802 1 279 . 1 . 1 25 25 ALA N N 15 119.692 0.010 . 1 . . 42 . . 25 ALA N . 26802 1 280 . 1 . 1 26 26 ASP H H 1 8.018 0.002 . 1 . . 59 . . 26 ASP H . 26802 1 281 . 1 . 1 26 26 ASP HA H 1 4.846 0.002 . 1 . . 596 . . 26 ASP HA . 26802 1 282 . 1 . 1 26 26 ASP HB2 H 1 2.426 0.002 . 1 . . 597 . . 26 ASP HB2 . 26802 1 283 . 1 . 1 26 26 ASP HB3 H 1 2.426 0.002 . 1 . . 598 . . 26 ASP HB3 . 26802 1 284 . 1 . 1 26 26 ASP C C 13 176.656 0.002 . 1 . . 429 . . 26 ASP C . 26802 1 285 . 1 . 1 26 26 ASP CA C 13 55.247 0.002 . 1 . . 214 . . 26 ASP CA . 26802 1 286 . 1 . 1 26 26 ASP CB C 13 41.356 0.002 . 1 . . 334 . . 26 ASP CB . 26802 1 287 . 1 . 1 26 26 ASP N N 15 117.553 0.010 . 1 . . 60 . . 26 ASP N . 26802 1 288 . 1 . 1 27 27 VAL H H 1 9.338 0.002 . 1 . . 217 . . 27 VAL H . 26802 1 289 . 1 . 1 27 27 VAL HA H 1 4.425 0.002 . 1 . . 475 . . 27 VAL HA . 26802 1 290 . 1 . 1 27 27 VAL HB H 1 1.668 0.002 . 1 . . 476 . . 27 VAL HB . 26802 1 291 . 1 . 1 27 27 VAL HG11 H 1 0.932 0.002 . 2 . . 477 . . 27 VAL HG11 . 26802 1 292 . 1 . 1 27 27 VAL HG12 H 1 0.932 0.002 . 2 . . 477 . . 27 VAL HG12 . 26802 1 293 . 1 . 1 27 27 VAL HG13 H 1 0.932 0.002 . 2 . . 477 . . 27 VAL HG13 . 26802 1 294 . 1 . 1 27 27 VAL HG21 H 1 0.810 0.002 . 2 . . 478 . . 27 VAL HG21 . 26802 1 295 . 1 . 1 27 27 VAL HG22 H 1 0.810 0.002 . 2 . . 478 . . 27 VAL HG22 . 26802 1 296 . 1 . 1 27 27 VAL HG23 H 1 0.810 0.002 . 2 . . 478 . . 27 VAL HG23 . 26802 1 297 . 1 . 1 27 27 VAL C C 13 174.631 0.002 . 1 . . 396 . . 27 VAL C . 26802 1 298 . 1 . 1 27 27 VAL CA C 13 60.510 0.002 . 1 . . 215 . . 27 VAL CA . 26802 1 299 . 1 . 1 27 27 VAL CB C 13 34.888 0.002 . 1 . . 298 . . 27 VAL CB . 26802 1 300 . 1 . 1 27 27 VAL CG1 C 13 21.460 0.002 . 2 . . 775 . . 27 VAL CG1 . 26802 1 301 . 1 . 1 27 27 VAL CG2 C 13 22.234 0.002 . 2 . . 774 . . 27 VAL CG2 . 26802 1 302 . 1 . 1 27 27 VAL N N 15 119.920 0.010 . 1 . . 216 . . 27 VAL N . 26802 1 303 . 1 . 1 28 28 PHE H H 1 8.386 0.002 . 1 . . 95 . . 28 PHE H . 26802 1 304 . 1 . 1 28 28 PHE HA H 1 3.760 0.002 . 1 . . 536 . . 28 PHE HA . 26802 1 305 . 1 . 1 28 28 PHE HB2 H 1 3.062 0.002 . 2 . . 537 . . 28 PHE HB2 . 26802 1 306 . 1 . 1 28 28 PHE HB3 H 1 2.755 0.002 . 2 . . 538 . . 28 PHE HB3 . 26802 1 307 . 1 . 1 28 28 PHE HD1 H 1 6.822 0.002 . 1 . . 872 . . 28 PHE HD1 . 26802 1 308 . 1 . 1 28 28 PHE HD2 H 1 6.822 0.002 . 1 . . 872 . . 28 PHE HD2 . 26802 1 309 . 1 . 1 28 28 PHE C C 13 172.711 0.002 . 1 . . 407 . . 28 PHE C . 26802 1 310 . 1 . 1 28 28 PHE CA C 13 58.342 0.002 . 1 . . 218 . . 28 PHE CA . 26802 1 311 . 1 . 1 28 28 PHE CB C 13 40.440 0.002 . 1 . . 316 . . 28 PHE CB . 26802 1 312 . 1 . 1 28 28 PHE CD1 C 13 131.887 0.002 . 1 . . 906 . . 28 PHE CD1 . 26802 1 313 . 1 . 1 28 28 PHE CD2 C 13 131.887 0.002 . 1 . . 906 . . 28 PHE CD2 . 26802 1 314 . 1 . 1 28 28 PHE N N 15 129.889 0.010 . 1 . . 96 . . 28 PHE N . 26802 1 315 . 1 . 1 29 29 VAL H H 1 7.710 0.002 . 1 . . 157 . . 29 VAL H . 26802 1 316 . 1 . 1 29 29 VAL HA H 1 4.607 0.002 . 1 . . 482 . . 29 VAL HA . 26802 1 317 . 1 . 1 29 29 VAL HB H 1 1.442 0.002 . 1 . . 483 . . 29 VAL HB . 26802 1 318 . 1 . 1 29 29 VAL HG11 H 1 0.545 0.002 . 2 . . 484 . . 29 VAL HG11 . 26802 1 319 . 1 . 1 29 29 VAL HG12 H 1 0.545 0.002 . 2 . . 484 . . 29 VAL HG12 . 26802 1 320 . 1 . 1 29 29 VAL HG13 H 1 0.545 0.002 . 2 . . 484 . . 29 VAL HG13 . 26802 1 321 . 1 . 1 29 29 VAL HG21 H 1 0.411 0.002 . 2 . . 485 . . 29 VAL HG21 . 26802 1 322 . 1 . 1 29 29 VAL HG22 H 1 0.411 0.002 . 2 . . 485 . . 29 VAL HG22 . 26802 1 323 . 1 . 1 29 29 VAL HG23 H 1 0.411 0.002 . 2 . . 485 . . 29 VAL HG23 . 26802 1 324 . 1 . 1 29 29 VAL C C 13 170.181 0.002 . 1 . . 467 . . 29 VAL C . 26802 1 325 . 1 . 1 29 29 VAL CA C 13 58.033 0.002 . 1 . . 278 . . 29 VAL CA . 26802 1 326 . 1 . 1 29 29 VAL CB C 13 34.391 0.002 . 1 . . 288 . . 29 VAL CB . 26802 1 327 . 1 . 1 29 29 VAL CG1 C 13 22.808 0.002 . 2 . . 289 . . 29 VAL CG1 . 26802 1 328 . 1 . 1 29 29 VAL CG2 C 13 18.006 0.002 . 2 . . 290 . . 29 VAL CG2 . 26802 1 329 . 1 . 1 29 29 VAL N N 15 124.229 0.010 . 1 . . 158 . . 29 VAL N . 26802 1 330 . 1 . 1 30 30 HIS H H 1 8.966 0.002 . 1 . . 85 . . 30 HIS H . 26802 1 331 . 1 . 1 30 30 HIS HA H 1 4.809 0.002 . 1 . . 870 . . 30 HIS HA . 26802 1 332 . 1 . 1 30 30 HIS HB2 H 1 3.123 0.002 . 2 . . 551 . . 30 HIS HB2 . 26802 1 333 . 1 . 1 30 30 HIS HB3 H 1 2.885 0.002 . 2 . . 552 . . 30 HIS HB3 . 26802 1 334 . 1 . 1 30 30 HIS HD2 H 1 7.313 0.002 . 1 . . 871 . . 30 HIS HD2 . 26802 1 335 . 1 . 1 30 30 HIS C C 13 177.054 0.002 . 1 . . 875 . . 30 HIS C . 26802 1 336 . 1 . 1 30 30 HIS CA C 13 55.736 0.002 . 1 . . 861 . . 30 HIS CA . 26802 1 337 . 1 . 1 30 30 HIS CB C 13 34.678 0.002 . 1 . . 862 . . 30 HIS CB . 26802 1 338 . 1 . 1 30 30 HIS CD2 C 13 118.654 0.002 . 1 . . 899 . . 30 HIS CD2 . 26802 1 339 . 1 . 1 30 30 HIS N N 15 127.780 0.010 . 1 . . 86 . . 30 HIS N . 26802 1 340 . 1 . 1 31 31 TYR H H 1 8.259 0.002 . 1 . . 145 . . 31 TYR H . 26802 1 341 . 1 . 1 31 31 TYR HA H 1 4.024 0.002 . 1 . . 869 . . 31 TYR HA . 26802 1 342 . 1 . 1 31 31 TYR HB2 H 1 3.118 0.002 . 2 . . 880 . . 31 TYR HB2 . 26802 1 343 . 1 . 1 31 31 TYR HB3 H 1 2.853 0.002 . 2 . . 881 . . 31 TYR HB3 . 26802 1 344 . 1 . 1 31 31 TYR HD1 H 1 6.975 0.002 . 1 . . 868 . . 31 TYR HD1 . 26802 1 345 . 1 . 1 31 31 TYR HD2 H 1 6.975 0.002 . 1 . . 868 . . 31 TYR HD2 . 26802 1 346 . 1 . 1 31 31 TYR HE1 H 1 6.868 0.002 . 1 . . 867 . . 31 TYR HE1 . 26802 1 347 . 1 . 1 31 31 TYR HE2 H 1 6.868 0.002 . 1 . . 867 . . 31 TYR HE2 . 26802 1 348 . 1 . 1 31 31 TYR C C 13 176.252 0.002 . 1 . . 874 . . 31 TYR C . 26802 1 349 . 1 . 1 31 31 TYR CA C 13 60.317 0.002 . 1 . . 855 . . 31 TYR CA . 26802 1 350 . 1 . 1 31 31 TYR CB C 13 37.084 0.002 . 1 . . 859 . . 31 TYR CB . 26802 1 351 . 1 . 1 31 31 TYR CD1 C 13 133.250 0.002 . 1 . . 903 . . 31 TYR CD1 . 26802 1 352 . 1 . 1 31 31 TYR CD2 C 13 133.250 0.002 . 1 . . 903 . . 31 TYR CD2 . 26802 1 353 . 1 . 1 31 31 TYR CE1 C 13 118.457 0.002 . 1 . . 904 . . 31 TYR CE1 . 26802 1 354 . 1 . 1 31 31 TYR CE2 C 13 118.457 0.002 . 1 . . 904 . . 31 TYR CE2 . 26802 1 355 . 1 . 1 31 31 TYR N N 15 123.112 0.010 . 1 . . 146 . . 31 TYR N . 26802 1 356 . 1 . 1 32 32 SER H H 1 7.808 0.002 . 1 . . 857 . . 32 SER H . 26802 1 357 . 1 . 1 32 32 SER HA H 1 3.828 0.002 . 1 . . 863 . . 32 SER HA . 26802 1 358 . 1 . 1 32 32 SER HB2 H 1 3.930 0.002 . 2 . . 865 . . 32 SER HB2 . 26802 1 359 . 1 . 1 32 32 SER HB3 H 1 3.631 0.002 . 2 . . 866 . . 32 SER HB3 . 26802 1 360 . 1 . 1 32 32 SER C C 13 175.749 0.002 . 1 . . 873 . . 32 SER C . 26802 1 361 . 1 . 1 32 32 SER CA C 13 60.606 0.002 . 1 . . 207 . . 32 SER CA . 26802 1 362 . 1 . 1 32 32 SER CB C 13 62.596 0.002 . 1 . . 860 . . 32 SER CB . 26802 1 363 . 1 . 1 32 32 SER N N 15 117.415 0.010 . 1 . . 856 . . 32 SER N . 26802 1 364 . 1 . 1 33 33 GLU H H 1 7.791 0.002 . 1 . . 23 . . 33 GLU H . 26802 1 365 . 1 . 1 33 33 GLU HA H 1 4.458 0.002 . 1 . . 567 . . 33 GLU HA . 26802 1 366 . 1 . 1 33 33 GLU HB2 H 1 2.565 0.002 . 2 . . 570 . . 33 GLU HB2 . 26802 1 367 . 1 . 1 33 33 GLU HB3 H 1 1.871 0.002 . 2 . . 571 . . 33 GLU HB3 . 26802 1 368 . 1 . 1 33 33 GLU HG2 H 1 2.775 0.002 . 2 . . 568 . . 33 GLU HG2 . 26802 1 369 . 1 . 1 33 33 GLU HG3 H 1 2.300 0.002 . 2 . . 569 . . 33 GLU HG3 . 26802 1 370 . 1 . 1 33 33 GLU C C 13 176.311 0.002 . 1 . . 419 . . 33 GLU C . 26802 1 371 . 1 . 1 33 33 GLU CA C 13 55.859 0.002 . 1 . . 206 . . 33 GLU CA . 26802 1 372 . 1 . 1 33 33 GLU CB C 13 30.377 0.002 . 1 . . 325 . . 33 GLU CB . 26802 1 373 . 1 . 1 33 33 GLU CG C 13 35.666 0.002 . 1 . . 326 . . 33 GLU CG . 26802 1 374 . 1 . 1 33 33 GLU N N 15 120.161 0.010 . 1 . . 24 . . 33 GLU N . 26802 1 375 . 1 . 1 34 34 ILE H H 1 7.476 0.002 . 1 . . 53 . . 34 ILE H . 26802 1 376 . 1 . 1 34 34 ILE HA H 1 3.984 0.002 . 1 . . 486 . . 34 ILE HA . 26802 1 377 . 1 . 1 34 34 ILE HB H 1 1.660 0.002 . 1 . . 488 . . 34 ILE HB . 26802 1 378 . 1 . 1 34 34 ILE HG12 H 1 0.325 0.002 . 2 . . 887 . . 34 ILE HG12 . 26802 1 379 . 1 . 1 34 34 ILE HG13 H 1 1.533 0.002 . 2 . . 888 . . 34 ILE HG13 . 26802 1 380 . 1 . 1 34 34 ILE HG21 H 1 0.658 0.002 . 1 . . 489 . . 34 ILE HG21 . 26802 1 381 . 1 . 1 34 34 ILE HG22 H 1 0.658 0.002 . 1 . . 489 . . 34 ILE HG22 . 26802 1 382 . 1 . 1 34 34 ILE HG23 H 1 0.658 0.002 . 1 . . 489 . . 34 ILE HG23 . 26802 1 383 . 1 . 1 34 34 ILE HD11 H 1 0.331 0.002 . 1 . . 487 . . 34 ILE HD11 . 26802 1 384 . 1 . 1 34 34 ILE HD12 H 1 0.331 0.002 . 1 . . 487 . . 34 ILE HD12 . 26802 1 385 . 1 . 1 34 34 ILE HD13 H 1 0.331 0.002 . 1 . . 487 . . 34 ILE HD13 . 26802 1 386 . 1 . 1 34 34 ILE C C 13 175.992 0.002 . 1 . . 399 . . 34 ILE C . 26802 1 387 . 1 . 1 34 34 ILE CA C 13 62.303 0.002 . 1 . . 205 . . 34 ILE CA . 26802 1 388 . 1 . 1 34 34 ILE CB C 13 37.748 0.002 . 1 . . 302 . . 34 ILE CB . 26802 1 389 . 1 . 1 34 34 ILE CG1 C 13 27.406 0.002 . 1 . . 303 . . 34 ILE CG1 . 26802 1 390 . 1 . 1 34 34 ILE CG2 C 13 17.203 0.002 . 1 . . 304 . . 34 ILE CG2 . 26802 1 391 . 1 . 1 34 34 ILE CD1 C 13 14.385 0.002 . 1 . . 305 . . 34 ILE CD1 . 26802 1 392 . 1 . 1 34 34 ILE N N 15 121.476 0.010 . 1 . . 54 . . 34 ILE N . 26802 1 393 . 1 . 1 35 35 GLN H H 1 8.789 0.002 . 1 . . 75 . . 35 GLN H . 26802 1 394 . 1 . 1 35 35 GLN HA H 1 4.292 0.002 . 1 . . 705 . . 35 GLN HA . 26802 1 395 . 1 . 1 35 35 GLN HB2 H 1 1.722 0.002 . 2 . . 780 . . 35 GLN HB2 . 26802 1 396 . 1 . 1 35 35 GLN HB3 H 1 1.979 0.002 . 2 . . 782 . . 35 GLN HB3 . 26802 1 397 . 1 . 1 35 35 GLN HG2 H 1 2.137 0.002 . 2 . . 784 . . 35 GLN HG2 . 26802 1 398 . 1 . 1 35 35 GLN HG3 H 1 2.190 0.002 . 2 . . 785 . . 35 GLN HG3 . 26802 1 399 . 1 . 1 35 35 GLN HE21 H 1 7.219 0.002 . 1 . . 843 . . 35 GLN HE21 . 26802 1 400 . 1 . 1 35 35 GLN HE22 H 1 6.901 0.002 . 1 . . 845 . . 35 GLN HE22 . 26802 1 401 . 1 . 1 35 35 GLN C C 13 175.965 0.002 . 1 . . 458 . . 35 GLN C . 26802 1 402 . 1 . 1 35 35 GLN CA C 13 55.728 0.002 . 1 . . 204 . . 35 GLN CA . 26802 1 403 . 1 . 1 35 35 GLN CB C 13 29.764 0.002 . 1 . . 779 . . 35 GLN CB . 26802 1 404 . 1 . 1 35 35 GLN CG C 13 33.840 0.002 . 1 . . 377 . . 35 GLN CG . 26802 1 405 . 1 . 1 35 35 GLN CD C 13 179.551 0.002 . 1 . . 931 . . 35 GLN CD . 26802 1 406 . 1 . 1 35 35 GLN N N 15 127.625 0.010 . 1 . . 76 . . 35 GLN N . 26802 1 407 . 1 . 1 35 35 GLN NE2 N 15 112.459 0.010 . 1 . . 844 . . 35 GLN NE2 . 26802 1 408 . 1 . 1 36 36 GLY H H 1 8.337 0.002 . 1 . . 125 . . 36 GLY H . 26802 1 409 . 1 . 1 36 36 GLY HA2 H 1 4.227 0.002 . 2 . . 650 . . 36 GLY HA2 . 26802 1 410 . 1 . 1 36 36 GLY HA3 H 1 3.768 0.002 . 2 . . 651 . . 36 GLY HA3 . 26802 1 411 . 1 . 1 36 36 GLY C C 13 173.291 0.002 . 1 . . 441 . . 36 GLY C . 26802 1 412 . 1 . 1 36 36 GLY CA C 13 44.923 0.002 . 1 . . 203 . . 36 GLY CA . 26802 1 413 . 1 . 1 36 36 GLY N N 15 109.833 0.010 . 1 . . 126 . . 36 GLY N . 26802 1 414 . 1 . 1 37 37 ASN H H 1 8.370 0.002 . 1 . . 244 . . 37 ASN H . 26802 1 415 . 1 . 1 37 37 ASN HA H 1 4.820 0.002 . 1 . . 706 . . 37 ASN HA . 26802 1 416 . 1 . 1 37 37 ASN HB2 H 1 2.717 0.002 . 2 . . 707 . . 37 ASN HB2 . 26802 1 417 . 1 . 1 37 37 ASN HB3 H 1 2.796 0.002 . 2 . . 708 . . 37 ASN HB3 . 26802 1 418 . 1 . 1 37 37 ASN HD21 H 1 7.564 0.002 . 1 . . 849 . . 37 ASN HD21 . 26802 1 419 . 1 . 1 37 37 ASN HD22 H 1 6.925 0.002 . 1 . . 851 . . 37 ASN HD22 . 26802 1 420 . 1 . 1 37 37 ASN C C 13 175.539 0.002 . 1 . . 459 . . 37 ASN C . 26802 1 421 . 1 . 1 37 37 ASN CA C 13 52.935 0.002 . 1 . . 243 . . 37 ASN CA . 26802 1 422 . 1 . 1 37 37 ASN CB C 13 39.636 0.002 . 1 . . 387 . . 37 ASN CB . 26802 1 423 . 1 . 1 37 37 ASN CG C 13 177.156 0.002 . 1 . . 937 . . 37 ASN CG . 26802 1 424 . 1 . 1 37 37 ASN N N 15 117.864 0.010 . 1 . . 245 . . 37 ASN N . 26802 1 425 . 1 . 1 37 37 ASN ND2 N 15 112.974 0.010 . 1 . . 850 . . 37 ASN ND2 . 26802 1 426 . 1 . 1 38 38 GLY H H 1 8.422 0.002 . 1 . . 155 . . 38 GLY H . 26802 1 427 . 1 . 1 38 38 GLY HA2 H 1 3.836 0.002 . 1 . . 575 . . 38 GLY HA2 . 26802 1 428 . 1 . 1 38 38 GLY HA3 H 1 3.836 0.002 . 1 . . 576 . . 38 GLY HA3 . 26802 1 429 . 1 . 1 38 38 GLY C C 13 173.874 0.002 . 1 . . 421 . . 38 GLY C . 26802 1 430 . 1 . 1 38 38 GLY CA C 13 45.273 0.002 . 1 . . 242 . . 38 GLY CA . 26802 1 431 . 1 . 1 38 38 GLY N N 15 109.398 0.010 . 1 . . 156 . . 38 GLY N . 26802 1 432 . 1 . 1 39 39 PHE H H 1 8.162 0.002 . 1 . . 79 . . 39 PHE H . 26802 1 433 . 1 . 1 39 39 PHE HA H 1 4.496 0.002 . 1 . . 541 . . 39 PHE HA . 26802 1 434 . 1 . 1 39 39 PHE HB2 H 1 2.958 0.002 . 2 . . 542 . . 39 PHE HB2 . 26802 1 435 . 1 . 1 39 39 PHE HB3 H 1 3.019 0.002 . 2 . . 543 . . 39 PHE HB3 . 26802 1 436 . 1 . 1 39 39 PHE HD1 H 1 7.138 0.002 . 1 . . 815 . . 39 PHE HD1 . 26802 1 437 . 1 . 1 39 39 PHE HD2 H 1 7.138 0.002 . 1 . . 815 . . 39 PHE HD2 . 26802 1 438 . 1 . 1 39 39 PHE HE1 H 1 7.218 0.002 . 1 . . 814 . . 39 PHE HE1 . 26802 1 439 . 1 . 1 39 39 PHE HE2 H 1 7.218 0.002 . 1 . . 814 . . 39 PHE HE2 . 26802 1 440 . 1 . 1 39 39 PHE C C 13 175.728 0.002 . 1 . . 411 . . 39 PHE C . 26802 1 441 . 1 . 1 39 39 PHE CA C 13 58.132 0.002 . 1 . . 241 . . 39 PHE CA . 26802 1 442 . 1 . 1 39 39 PHE CB C 13 38.989 0.002 . 1 . . 317 . . 39 PHE CB . 26802 1 443 . 1 . 1 39 39 PHE CD1 C 13 131.609 0.002 . 1 . . 911 . . 39 PHE CD1 . 26802 1 444 . 1 . 1 39 39 PHE CD2 C 13 131.609 0.002 . 1 . . 911 . . 39 PHE CD2 . 26802 1 445 . 1 . 1 39 39 PHE N N 15 121.234 0.010 . 1 . . 80 . . 39 PHE N . 26802 1 446 . 1 . 1 40 40 ARG H H 1 8.141 0.002 . 1 . . 33 . . 40 ARG H . 26802 1 447 . 1 . 1 40 40 ARG HA H 1 4.250 0.002 . 1 . . 689 . . 40 ARG HA . 26802 1 448 . 1 . 1 40 40 ARG HB2 H 1 1.704 0.002 . 2 . . 692 . . 40 ARG HB2 . 26802 1 449 . 1 . 1 40 40 ARG HB3 H 1 1.740 0.002 . 2 . . 695 . . 40 ARG HB3 . 26802 1 450 . 1 . 1 40 40 ARG HG2 H 1 1.493 0.002 . 1 . . 693 . . 40 ARG HG2 . 26802 1 451 . 1 . 1 40 40 ARG HG3 H 1 1.493 0.002 . 1 . . 694 . . 40 ARG HG3 . 26802 1 452 . 1 . 1 40 40 ARG HD2 H 1 3.067 0.002 . 1 . . 690 . . 40 ARG HD2 . 26802 1 453 . 1 . 1 40 40 ARG HD3 H 1 3.067 0.002 . 1 . . 691 . . 40 ARG HD3 . 26802 1 454 . 1 . 1 40 40 ARG C C 13 174.091 0.002 . 1 . . 455 . . 40 ARG C . 26802 1 455 . 1 . 1 40 40 ARG CA C 13 55.683 0.002 . 1 . . 240 . . 40 ARG CA . 26802 1 456 . 1 . 1 40 40 ARG CB C 13 30.962 0.002 . 1 . . 367 . . 40 ARG CB . 26802 1 457 . 1 . 1 40 40 ARG CG C 13 26.694 0.002 . 1 . . 368 . . 40 ARG CG . 26802 1 458 . 1 . 1 40 40 ARG CD C 13 43.541 0.002 . 1 . . 366 . . 40 ARG CD . 26802 1 459 . 1 . 1 40 40 ARG N N 15 123.537 0.010 . 1 . . 34 . . 40 ARG N . 26802 1 460 . 1 . 1 41 41 THR H H 1 7.564 0.002 . 1 . . 113 . . 41 THR H . 26802 1 461 . 1 . 1 41 41 THR HA H 1 4.038 0.002 . 1 . . 610 . . 41 THR HA . 26802 1 462 . 1 . 1 41 41 THR HB H 1 3.878 0.002 . 1 . . 611 . . 41 THR HB . 26802 1 463 . 1 . 1 41 41 THR HG21 H 1 1.029 0.002 . 1 . . 609 . . 41 THR HG21 . 26802 1 464 . 1 . 1 41 41 THR HG22 H 1 1.029 0.002 . 1 . . 609 . . 41 THR HG22 . 26802 1 465 . 1 . 1 41 41 THR HG23 H 1 1.029 0.002 . 1 . . 609 . . 41 THR HG23 . 26802 1 466 . 1 . 1 41 41 THR C C 13 171.918 0.002 . 1 . . 392 . . 41 THR C . 26802 1 467 . 1 . 1 41 41 THR CA C 13 59.898 0.002 . 1 . . 239 . . 41 THR CA . 26802 1 468 . 1 . 1 41 41 THR CB C 13 70.287 0.002 . 1 . . 786 . . 41 THR CB . 26802 1 469 . 1 . 1 41 41 THR CG2 C 13 20.500 0.002 . 1 . . 344 . . 41 THR CG2 . 26802 1 470 . 1 . 1 41 41 THR N N 15 112.116 0.010 . 1 . . 114 . . 41 THR N . 26802 1 471 . 1 . 1 42 42 LEU H H 1 6.071 0.002 . 1 . . 83 . . 42 LEU H . 26802 1 472 . 1 . 1 42 42 LEU HA H 1 4.503 0.002 . 1 . . 644 . . 42 LEU HA . 26802 1 473 . 1 . 1 42 42 LEU HB2 H 1 1.005 0.002 . 2 . . 648 . . 42 LEU HB2 . 26802 1 474 . 1 . 1 42 42 LEU HB3 H 1 0.431 0.002 . 2 . . 649 . . 42 LEU HB3 . 26802 1 475 . 1 . 1 42 42 LEU HG H 1 0.248 0.002 . 1 . . 647 . . 42 LEU HG . 26802 1 476 . 1 . 1 42 42 LEU HD11 H 1 0.471 0.002 . 1 . . 645 . . 42 LEU HD11 . 26802 1 477 . 1 . 1 42 42 LEU HD12 H 1 0.471 0.002 . 1 . . 645 . . 42 LEU HD12 . 26802 1 478 . 1 . 1 42 42 LEU HD13 H 1 0.471 0.002 . 1 . . 645 . . 42 LEU HD13 . 26802 1 479 . 1 . 1 42 42 LEU HD21 H 1 0.471 0.002 . 1 . . 646 . . 42 LEU HD21 . 26802 1 480 . 1 . 1 42 42 LEU HD22 H 1 0.471 0.002 . 1 . . 646 . . 42 LEU HD22 . 26802 1 481 . 1 . 1 42 42 LEU HD23 H 1 0.471 0.002 . 1 . . 646 . . 42 LEU HD23 . 26802 1 482 . 1 . 1 42 42 LEU C C 13 174.596 0.002 . 1 . . 440 . . 42 LEU C . 26802 1 483 . 1 . 1 42 42 LEU CA C 13 52.843 0.002 . 1 . . 238 . . 42 LEU CA . 26802 1 484 . 1 . 1 42 42 LEU CB C 13 45.291 0.002 . 1 . . 350 . . 42 LEU CB . 26802 1 485 . 1 . 1 42 42 LEU CG C 13 25.759 0.002 . 1 . . 351 . . 42 LEU CG . 26802 1 486 . 1 . 1 42 42 LEU CD1 C 13 22.544 0.002 . 1 . . 352 . . 42 LEU CD1 . 26802 1 487 . 1 . 1 42 42 LEU CD2 C 13 22.544 0.002 . 1 . . 353 . . 42 LEU CD2 . 26802 1 488 . 1 . 1 42 42 LEU N N 15 119.123 0.010 . 1 . . 84 . . 42 LEU N . 26802 1 489 . 1 . 1 43 43 GLU H H 1 8.057 0.002 . 1 . . 236 . . 43 GLU H . 26802 1 490 . 1 . 1 43 43 GLU HA H 1 4.566 0.002 . 1 . . 579 . . 43 GLU HA . 26802 1 491 . 1 . 1 43 43 GLU HB2 H 1 1.992 0.002 . 2 . . 741 . . 43 GLU HB2 . 26802 1 492 . 1 . 1 43 43 GLU HB3 H 1 1.713 0.002 . 2 . . 742 . . 43 GLU HB3 . 26802 1 493 . 1 . 1 43 43 GLU HG2 H 1 2.178 0.002 . 1 . . 581 . . 43 GLU HG2 . 26802 1 494 . 1 . 1 43 43 GLU HG3 H 1 2.178 0.002 . 1 . . 582 . . 43 GLU HG3 . 26802 1 495 . 1 . 1 43 43 GLU C C 13 175.249 0.002 . 1 . . 423 . . 43 GLU C . 26802 1 496 . 1 . 1 43 43 GLU CA C 13 54.009 0.002 . 1 . . 235 . . 43 GLU CA . 26802 1 497 . 1 . 1 43 43 GLU CB C 13 32.785 0.002 . 1 . . 740 . . 43 GLU CB . 26802 1 498 . 1 . 1 43 43 GLU CG C 13 35.985 0.002 . 1 . . 580 . . 43 GLU CG . 26802 1 499 . 1 . 1 43 43 GLU N N 15 118.078 0.010 . 1 . . 237 . . 43 GLU N . 26802 1 500 . 1 . 1 44 44 GLU H H 1 8.682 0.002 . 1 . . 234 . . 44 GLU H . 26802 1 501 . 1 . 1 44 44 GLU HA H 1 3.523 0.002 . 1 . . 658 . . 44 GLU HA . 26802 1 502 . 1 . 1 44 44 GLU HB2 H 1 1.995 0.002 . 2 . . 885 . . 44 GLU HB2 . 26802 1 503 . 1 . 1 44 44 GLU HB3 H 1 2.071 0.002 . 2 . . 886 . . 44 GLU HB3 . 26802 1 504 . 1 . 1 44 44 GLU HG2 H 1 2.494 0.002 . 2 . . 659 . . 44 GLU HG2 . 26802 1 505 . 1 . 1 44 44 GLU HG3 H 1 2.329 0.002 . 2 . . 660 . . 44 GLU HG3 . 26802 1 506 . 1 . 1 44 44 GLU C C 13 176.877 0.002 . 1 . . 443 . . 44 GLU C . 26802 1 507 . 1 . 1 44 44 GLU CA C 13 58.441 0.002 . 1 . . 232 . . 44 GLU CA . 26802 1 508 . 1 . 1 44 44 GLU CB C 13 29.752 0.002 . 1 . . 884 . . 44 GLU CB . 26802 1 509 . 1 . 1 44 44 GLU CG C 13 35.983 0.002 . 1 . . 657 . . 44 GLU CG . 26802 1 510 . 1 . 1 44 44 GLU N N 15 121.208 0.010 . 1 . . 233 . . 44 GLU N . 26802 1 511 . 1 . 1 45 45 ASN H H 1 8.988 0.002 . 1 . . 231 . . 45 ASN H . 26802 1 512 . 1 . 1 45 45 ASN HA H 1 4.245 0.002 . 1 . . 592 . . 45 ASN HA . 26802 1 513 . 1 . 1 45 45 ASN HB2 H 1 3.228 0.002 . 2 . . 593 . . 45 ASN HB2 . 26802 1 514 . 1 . 1 45 45 ASN HB3 H 1 3.032 0.002 . 2 . . 594 . . 45 ASN HB3 . 26802 1 515 . 1 . 1 45 45 ASN HD21 H 1 7.646 0.002 . 1 . . 822 . . 45 ASN HD21 . 26802 1 516 . 1 . 1 45 45 ASN HD22 H 1 7.041 0.002 . 1 . . 823 . . 45 ASN HD22 . 26802 1 517 . 1 . 1 45 45 ASN C C 13 174.159 0.002 . 1 . . 427 . . 45 ASN C . 26802 1 518 . 1 . 1 45 45 ASN CA C 13 55.657 0.002 . 1 . . 229 . . 45 ASN CA . 26802 1 519 . 1 . 1 45 45 ASN CB C 13 37.644 0.002 . 1 . . 332 . . 45 ASN CB . 26802 1 520 . 1 . 1 45 45 ASN CG C 13 177.933 0.002 . 1 . . 927 . . 45 ASN CG . 26802 1 521 . 1 . 1 45 45 ASN N N 15 116.476 0.010 . 1 . . 230 . . 45 ASN N . 26802 1 522 . 1 . 1 45 45 ASN ND2 N 15 114.251 0.010 . 1 . . 821 . . 45 ASN ND2 . 26802 1 523 . 1 . 1 46 46 GLN H H 1 7.863 0.002 . 1 . . 1 . . 46 GLN H . 26802 1 524 . 1 . 1 46 46 GLN HA H 1 4.213 0.002 . 1 . . 531 . . 46 GLN HA . 26802 1 525 . 1 . 1 46 46 GLN HB2 H 1 1.998 0.002 . 2 . . 534 . . 46 GLN HB2 . 26802 1 526 . 1 . 1 46 46 GLN HB3 H 1 2.095 0.002 . 2 . . 535 . . 46 GLN HB3 . 26802 1 527 . 1 . 1 46 46 GLN HG2 H 1 2.318 0.002 . 2 . . 532 . . 46 GLN HG2 . 26802 1 528 . 1 . 1 46 46 GLN HG3 H 1 2.398 0.002 . 2 . . 533 . . 46 GLN HG3 . 26802 1 529 . 1 . 1 46 46 GLN HE21 H 1 7.363 0.002 . 1 . . 890 . . 46 GLN HE21 . 26802 1 530 . 1 . 1 46 46 GLN HE22 H 1 6.646 0.002 . 1 . . 891 . . 46 GLN HE22 . 26802 1 531 . 1 . 1 46 46 GLN C C 13 175.796 0.002 . 1 . . 402 . . 46 GLN C . 26802 1 532 . 1 . 1 46 46 GLN CA C 13 56.896 0.002 . 1 . . 228 . . 46 GLN CA . 26802 1 533 . 1 . 1 46 46 GLN CB C 13 30.330 0.002 . 1 . . 883 . . 46 GLN CB . 26802 1 534 . 1 . 1 46 46 GLN CG C 13 34.055 0.002 . 1 . . 310 . . 46 GLN CG . 26802 1 535 . 1 . 1 46 46 GLN CD C 13 179.330 0.002 . 1 . . 935 . . 46 GLN CD . 26802 1 536 . 1 . 1 46 46 GLN N N 15 120.878 0.010 . 1 . . 2 . . 46 GLN N . 26802 1 537 . 1 . 1 46 46 GLN NE2 N 15 109.878 0.010 . 1 . . 889 . . 46 GLN NE2 . 26802 1 538 . 1 . 1 47 47 LYS H H 1 8.843 0.002 . 1 . . 227 . . 47 LYS H . 26802 1 539 . 1 . 1 47 47 LYS HA H 1 5.071 0.002 . 1 . . 668 . . 47 LYS HA . 26802 1 540 . 1 . 1 47 47 LYS HB2 H 1 1.852 0.002 . 1 . . 675 . . 47 LYS HB2 . 26802 1 541 . 1 . 1 47 47 LYS HB3 H 1 1.852 0.002 . 1 . . 676 . . 47 LYS HB3 . 26802 1 542 . 1 . 1 47 47 LYS HG2 H 1 1.621 0.002 . 2 . . 672 . . 47 LYS HG2 . 26802 1 543 . 1 . 1 47 47 LYS HG3 H 1 1.545 0.002 . 2 . . 674 . . 47 LYS HG3 . 26802 1 544 . 1 . 1 47 47 LYS HD2 H 1 1.705 0.002 . 1 . . 677 . . 47 LYS HD2 . 26802 1 545 . 1 . 1 47 47 LYS HD3 H 1 1.705 0.002 . 1 . . 678 . . 47 LYS HD3 . 26802 1 546 . 1 . 1 47 47 LYS HE2 H 1 2.955 0.002 . 2 . . 669 . . 47 LYS HE2 . 26802 1 547 . 1 . 1 47 47 LYS HE3 H 1 3.003 0.002 . 2 . . 670 . . 47 LYS HE3 . 26802 1 548 . 1 . 1 47 47 LYS C C 13 177.001 0.002 . 1 . . 450 . . 47 LYS C . 26802 1 549 . 1 . 1 47 47 LYS CA C 13 55.588 0.002 . 1 . . 225 . . 47 LYS CA . 26802 1 550 . 1 . 1 47 47 LYS CB C 13 32.539 0.002 . 1 . . 362 . . 47 LYS CB . 26802 1 551 . 1 . 1 47 47 LYS CG C 13 24.722 0.002 . 1 . . 364 . . 47 LYS CG . 26802 1 552 . 1 . 1 47 47 LYS CD C 13 28.557 0.002 . 1 . . 363 . . 47 LYS CD . 26802 1 553 . 1 . 1 47 47 LYS CE C 13 41.744 0.002 . 1 . . 361 . . 47 LYS CE . 26802 1 554 . 1 . 1 47 47 LYS N N 15 125.436 0.010 . 1 . . 226 . . 47 LYS N . 26802 1 555 . 1 . 1 48 48 VAL H H 1 8.649 0.002 . 1 . . 151 . . 48 VAL H . 26802 1 556 . 1 . 1 48 48 VAL HA H 1 5.129 0.002 . 1 . . 583 . . 48 VAL HA . 26802 1 557 . 1 . 1 48 48 VAL HB H 1 1.974 0.002 . 1 . . 584 . . 48 VAL HB . 26802 1 558 . 1 . 1 48 48 VAL HG11 H 1 0.493 0.002 . 2 . . 585 . . 48 VAL HG11 . 26802 1 559 . 1 . 1 48 48 VAL HG12 H 1 0.493 0.002 . 2 . . 585 . . 48 VAL HG12 . 26802 1 560 . 1 . 1 48 48 VAL HG13 H 1 0.493 0.002 . 2 . . 585 . . 48 VAL HG13 . 26802 1 561 . 1 . 1 48 48 VAL HG21 H 1 0.551 0.002 . 2 . . 586 . . 48 VAL HG21 . 26802 1 562 . 1 . 1 48 48 VAL HG22 H 1 0.551 0.002 . 2 . . 586 . . 48 VAL HG22 . 26802 1 563 . 1 . 1 48 48 VAL HG23 H 1 0.551 0.002 . 2 . . 586 . . 48 VAL HG23 . 26802 1 564 . 1 . 1 48 48 VAL C C 13 173.648 0.002 . 1 . . 424 . . 48 VAL C . 26802 1 565 . 1 . 1 48 48 VAL CA C 13 58.638 0.002 . 1 . . 224 . . 48 VAL CA . 26802 1 566 . 1 . 1 48 48 VAL CB C 13 36.768 0.002 . 1 . . 328 . . 48 VAL CB . 26802 1 567 . 1 . 1 48 48 VAL CG1 C 13 18.518 0.002 . 2 . . 330 . . 48 VAL CG1 . 26802 1 568 . 1 . 1 48 48 VAL CG2 C 13 22.918 0.002 . 2 . . 329 . . 48 VAL CG2 . 26802 1 569 . 1 . 1 48 48 VAL N N 15 114.955 0.010 . 1 . . 152 . . 48 VAL N . 26802 1 570 . 1 . 1 49 49 GLU H H 1 8.721 0.002 . 1 . . 69 . . 49 GLU H . 26802 1 571 . 1 . 1 49 49 GLU HA H 1 5.397 0.002 . 1 . . 638 . . 49 GLU HA . 26802 1 572 . 1 . 1 49 49 GLU HB2 H 1 1.824 0.002 . 2 . . 641 . . 49 GLU HB2 . 26802 1 573 . 1 . 1 49 49 GLU HB3 H 1 1.674 0.002 . 2 . . 642 . . 49 GLU HB3 . 26802 1 574 . 1 . 1 49 49 GLU HG2 H 1 2.316 0.002 . 1 . . 639 . . 49 GLU HG2 . 26802 1 575 . 1 . 1 49 49 GLU HG3 H 1 2.316 0.002 . 1 . . 640 . . 49 GLU HG3 . 26802 1 576 . 1 . 1 49 49 GLU C C 13 174.416 0.002 . 1 . . 438 . . 49 GLU C . 26802 1 577 . 1 . 1 49 49 GLU CA C 13 54.130 0.002 . 1 . . 223 . . 49 GLU CA . 26802 1 578 . 1 . 1 49 49 GLU CB C 13 33.260 0.002 . 1 . . 743 . . 49 GLU CB . 26802 1 579 . 1 . 1 49 49 GLU CG C 13 36.695 0.002 . 1 . . 637 . . 49 GLU CG . 26802 1 580 . 1 . 1 49 49 GLU N N 15 121.181 0.010 . 1 . . 70 . . 49 GLU N . 26802 1 581 . 1 . 1 50 50 PHE H H 1 8.387 0.002 . 1 . . 55 . . 50 PHE H . 26802 1 582 . 1 . 1 50 50 PHE HA H 1 5.039 0.002 . 1 . . 634 . . 50 PHE HA . 26802 1 583 . 1 . 1 50 50 PHE HB2 H 1 2.969 0.002 . 2 . . 635 . . 50 PHE HB2 . 26802 1 584 . 1 . 1 50 50 PHE HB3 H 1 3.021 0.002 . 2 . . 636 . . 50 PHE HB3 . 26802 1 585 . 1 . 1 50 50 PHE HD1 H 1 6.731 0.002 . 1 . . 805 . . 50 PHE HD1 . 26802 1 586 . 1 . 1 50 50 PHE HD2 H 1 6.731 0.002 . 1 . . 805 . . 50 PHE HD2 . 26802 1 587 . 1 . 1 50 50 PHE HE1 H 1 6.808 0.002 . 1 . . 804 . . 50 PHE HE1 . 26802 1 588 . 1 . 1 50 50 PHE HE2 H 1 6.808 0.002 . 1 . . 804 . . 50 PHE HE2 . 26802 1 589 . 1 . 1 50 50 PHE C C 13 172.260 0.002 . 1 . . 437 . . 50 PHE C . 26802 1 590 . 1 . 1 50 50 PHE CA C 13 56.207 0.002 . 1 . . 222 . . 50 PHE CA . 26802 1 591 . 1 . 1 50 50 PHE CB C 13 41.324 0.002 . 1 . . 348 . . 50 PHE CB . 26802 1 592 . 1 . 1 50 50 PHE CD1 C 13 132.242 0.002 . 1 . . 909 . . 50 PHE CD1 . 26802 1 593 . 1 . 1 50 50 PHE CD2 C 13 132.242 0.002 . 1 . . 909 . . 50 PHE CD2 . 26802 1 594 . 1 . 1 50 50 PHE CE1 C 13 130.296 0.002 . 1 . . 913 . . 50 PHE CE1 . 26802 1 595 . 1 . 1 50 50 PHE CE2 C 13 130.296 0.002 . 1 . . 913 . . 50 PHE CE2 . 26802 1 596 . 1 . 1 50 50 PHE N N 15 118.095 0.010 . 1 . . 56 . . 50 PHE N . 26802 1 597 . 1 . 1 51 51 GLU H H 1 8.788 0.002 . 1 . . 27 . . 51 GLU H . 26802 1 598 . 1 . 1 51 51 GLU HA H 1 4.659 0.002 . 1 . . 553 . . 51 GLU HA . 26802 1 599 . 1 . 1 51 51 GLU HB2 H 1 2.058 0.002 . 2 . . 556 . . 51 GLU HB2 . 26802 1 600 . 1 . 1 51 51 GLU HB3 H 1 1.662 0.002 . 2 . . 557 . . 51 GLU HB3 . 26802 1 601 . 1 . 1 51 51 GLU HG2 H 1 2.218 0.002 . 2 . . 554 . . 51 GLU HG2 . 26802 1 602 . 1 . 1 51 51 GLU HG3 H 1 2.294 0.002 . 2 . . 555 . . 51 GLU HG3 . 26802 1 603 . 1 . 1 51 51 GLU C C 13 175.898 0.002 . 1 . . 415 . . 51 GLU C . 26802 1 604 . 1 . 1 51 51 GLU CA C 13 53.738 0.002 . 1 . . 221 . . 51 GLU CA . 26802 1 605 . 1 . 1 51 51 GLU CB C 13 32.402 0.002 . 1 . . 744 . . 51 GLU CB . 26802 1 606 . 1 . 1 51 51 GLU CG C 13 35.682 0.002 . 1 . . 745 . . 51 GLU CG . 26802 1 607 . 1 . 1 51 51 GLU N N 15 118.362 0.010 . 1 . . 28 . . 51 GLU N . 26802 1 608 . 1 . 1 52 52 ILE H H 1 8.866 0.002 . 1 . . 159 . . 52 ILE H . 26802 1 609 . 1 . 1 52 52 ILE HA H 1 4.730 0.002 . 1 . . 730 . . 52 ILE HA . 26802 1 610 . 1 . 1 52 52 ILE HB H 1 1.790 0.002 . 1 . . 735 . . 52 ILE HB . 26802 1 611 . 1 . 1 52 52 ILE HG12 H 1 1.115 0.002 . 2 . . 792 . . 52 ILE HG12 . 26802 1 612 . 1 . 1 52 52 ILE HG13 H 1 1.650 0.002 . 2 . . 793 . . 52 ILE HG13 . 26802 1 613 . 1 . 1 52 52 ILE HG21 H 1 0.967 0.002 . 1 . . 732 . . 52 ILE HG21 . 26802 1 614 . 1 . 1 52 52 ILE HG22 H 1 0.967 0.002 . 1 . . 732 . . 52 ILE HG22 . 26802 1 615 . 1 . 1 52 52 ILE HG23 H 1 0.967 0.002 . 1 . . 732 . . 52 ILE HG23 . 26802 1 616 . 1 . 1 52 52 ILE HD11 H 1 0.973 0.002 . 1 . . 731 . . 52 ILE HD11 . 26802 1 617 . 1 . 1 52 52 ILE HD12 H 1 0.973 0.002 . 1 . . 731 . . 52 ILE HD12 . 26802 1 618 . 1 . 1 52 52 ILE HD13 H 1 0.973 0.002 . 1 . . 731 . . 52 ILE HD13 . 26802 1 619 . 1 . 1 52 52 ILE C C 13 176.372 0.002 . 1 . . 446 . . 52 ILE C . 26802 1 620 . 1 . 1 52 52 ILE CA C 13 61.249 0.002 . 1 . . 220 . . 52 ILE CA . 26802 1 621 . 1 . 1 52 52 ILE CB C 13 39.062 0.002 . 1 . . 357 . . 52 ILE CB . 26802 1 622 . 1 . 1 52 52 ILE CG1 C 13 28.903 0.002 . 1 . . 358 . . 52 ILE CG1 . 26802 1 623 . 1 . 1 52 52 ILE CG2 C 13 18.182 0.002 . 1 . . 359 . . 52 ILE CG2 . 26802 1 624 . 1 . 1 52 52 ILE CD1 C 13 13.350 0.002 . 1 . . 360 . . 52 ILE CD1 . 26802 1 625 . 1 . 1 52 52 ILE N N 15 122.657 0.010 . 1 . . 160 . . 52 ILE N . 26802 1 626 . 1 . 1 53 53 GLY H H 1 8.988 0.002 . 1 . . 248 . . 53 GLY H . 26802 1 627 . 1 . 1 53 53 GLY HA2 H 1 4.576 0.002 . 2 . . 577 . . 53 GLY HA2 . 26802 1 628 . 1 . 1 53 53 GLY HA3 H 1 3.683 0.002 . 2 . . 578 . . 53 GLY HA3 . 26802 1 629 . 1 . 1 53 53 GLY C C 13 172.831 0.002 . 1 . . 422 . . 53 GLY C . 26802 1 630 . 1 . 1 53 53 GLY CA C 13 43.800 0.002 . 1 . . 246 . . 53 GLY CA . 26802 1 631 . 1 . 1 53 53 GLY N N 15 116.052 0.010 . 1 . . 247 . . 53 GLY N . 26802 1 632 . 1 . 1 54 54 GLU H H 1 8.547 0.002 . 1 . . 251 . . 54 GLU H . 26802 1 633 . 1 . 1 54 54 GLU HA H 1 4.449 0.002 . 1 . . 683 . . 54 GLU HA . 26802 1 634 . 1 . 1 54 54 GLU HB2 H 1 1.965 0.002 . 2 . . 748 . . 54 GLU HB2 . 26802 1 635 . 1 . 1 54 54 GLU HB3 H 1 1.873 0.002 . 2 . . 749 . . 54 GLU HB3 . 26802 1 636 . 1 . 1 54 54 GLU HG2 H 1 2.202 0.002 . 1 . . 685 . . 54 GLU HG2 . 26802 1 637 . 1 . 1 54 54 GLU HG3 H 1 2.202 0.002 . 1 . . 686 . . 54 GLU HG3 . 26802 1 638 . 1 . 1 54 54 GLU C C 13 176.232 0.002 . 1 . . 454 . . 54 GLU C . 26802 1 639 . 1 . 1 54 54 GLU CA C 13 56.279 0.002 . 1 . . 249 . . 54 GLU CA . 26802 1 640 . 1 . 1 54 54 GLU CB C 13 31.093 0.002 . 1 . . 747 . . 54 GLU CB . 26802 1 641 . 1 . 1 54 54 GLU CG C 13 35.854 0.002 . 1 . . 684 . . 54 GLU CG . 26802 1 642 . 1 . 1 54 54 GLU N N 15 121.175 0.010 . 1 . . 250 . . 54 GLU N . 26802 1 643 . 1 . 1 55 55 GLY H H 1 7.956 0.002 . 1 . . 254 . . 55 GLY H . 26802 1 644 . 1 . 1 55 55 GLY HA2 H 1 4.409 0.002 . 2 . . 539 . . 55 GLY HA2 . 26802 1 645 . 1 . 1 55 55 GLY HA3 H 1 3.769 0.002 . 2 . . 540 . . 55 GLY HA3 . 26802 1 646 . 1 . 1 55 55 GLY C C 13 174.530 0.002 . 1 . . 410 . . 55 GLY C . 26802 1 647 . 1 . 1 55 55 GLY CA C 13 44.300 0.002 . 1 . . 252 . . 55 GLY CA . 26802 1 648 . 1 . 1 55 55 GLY N N 15 112.622 0.010 . 1 . . 253 . . 55 GLY N . 26802 1 649 . 1 . 1 56 56 ALA H H 1 8.628 0.002 . 1 . . 181 . . 56 ALA H . 26802 1 650 . 1 . 1 56 56 ALA HA H 1 4.071 0.002 . 1 . . 679 . . 56 ALA HA . 26802 1 651 . 1 . 1 56 56 ALA HB1 H 1 1.361 0.002 . 1 . . 680 . . 56 ALA HB1 . 26802 1 652 . 1 . 1 56 56 ALA HB2 H 1 1.361 0.002 . 1 . . 680 . . 56 ALA HB2 . 26802 1 653 . 1 . 1 56 56 ALA HB3 H 1 1.361 0.002 . 1 . . 680 . . 56 ALA HB3 . 26802 1 654 . 1 . 1 56 56 ALA C C 13 179.252 0.002 . 1 . . 451 . . 56 ALA C . 26802 1 655 . 1 . 1 56 56 ALA CA C 13 54.738 0.002 . 1 . . 255 . . 56 ALA CA . 26802 1 656 . 1 . 1 56 56 ALA CB C 13 18.749 0.002 . 1 . . 365 . . 56 ALA CB . 26802 1 657 . 1 . 1 56 56 ALA N N 15 123.693 0.010 . 1 . . 182 . . 56 ALA N . 26802 1 658 . 1 . 1 57 57 LYS H H 1 8.365 0.002 . 1 . . 171 . . 57 LYS H . 26802 1 659 . 1 . 1 57 57 LYS HA H 1 4.414 0.002 . 1 . . 519 . . 57 LYS HA . 26802 1 660 . 1 . 1 57 57 LYS HB2 H 1 1.791 0.002 . 2 . . 523 . . 57 LYS HB2 . 26802 1 661 . 1 . 1 57 57 LYS HB3 H 1 1.369 0.002 . 2 . . 794 . . 57 LYS HB3 . 26802 1 662 . 1 . 1 57 57 LYS HG2 H 1 1.125 0.002 . 1 . . 526 . . 57 LYS HG2 . 26802 1 663 . 1 . 1 57 57 LYS HG3 H 1 1.125 0.002 . 1 . . 527 . . 57 LYS HG3 . 26802 1 664 . 1 . 1 57 57 LYS HD2 H 1 1.358 0.002 . 2 . . 524 . . 57 LYS HD2 . 26802 1 665 . 1 . 1 57 57 LYS HD3 H 1 1.420 0.002 . 2 . . 525 . . 57 LYS HD3 . 26802 1 666 . 1 . 1 57 57 LYS HE2 H 1 2.770 0.002 . 1 . . 520 . . 57 LYS HE2 . 26802 1 667 . 1 . 1 57 57 LYS HE3 H 1 2.770 0.002 . 1 . . 521 . . 57 LYS HE3 . 26802 1 668 . 1 . 1 57 57 LYS C C 13 175.920 0.002 . 1 . . 462 . . 57 LYS C . 26802 1 669 . 1 . 1 57 57 LYS CA C 13 54.860 0.002 . 1 . . 256 . . 57 LYS CA . 26802 1 670 . 1 . 1 57 57 LYS CB C 13 32.122 0.002 . 1 . . 384 . . 57 LYS CB . 26802 1 671 . 1 . 1 57 57 LYS CG C 13 24.690 0.002 . 1 . . 386 . . 57 LYS CG . 26802 1 672 . 1 . 1 57 57 LYS CD C 13 28.655 0.002 . 1 . . 385 . . 57 LYS CD . 26802 1 673 . 1 . 1 57 57 LYS CE C 13 42.002 0.002 . 1 . . 383 . . 57 LYS CE . 26802 1 674 . 1 . 1 57 57 LYS N N 15 114.813 0.010 . 1 . . 172 . . 57 LYS N . 26802 1 675 . 1 . 1 58 58 GLY H H 1 7.431 0.002 . 1 . . 161 . . 58 GLY H . 26802 1 676 . 1 . 1 58 58 GLY HA2 H 1 4.532 0.002 . 2 . . 878 . . 58 GLY HA2 . 26802 1 677 . 1 . 1 58 58 GLY HA3 H 1 3.861 0.002 . 2 . . 879 . . 58 GLY HA3 . 26802 1 678 . 1 . 1 58 58 GLY CA C 13 44.150 0.002 . 1 . . 277 . . 58 GLY CA . 26802 1 679 . 1 . 1 58 58 GLY N N 15 108.794 0.010 . 1 . . 162 . . 58 GLY N . 26802 1 680 . 1 . 1 59 59 PRO HA H 1 4.828 0.002 . 1 . . 512 . . 59 PRO HA . 26802 1 681 . 1 . 1 59 59 PRO HB2 H 1 2.338 0.002 . 2 . . 515 . . 59 PRO HB2 . 26802 1 682 . 1 . 1 59 59 PRO HB3 H 1 1.914 0.002 . 2 . . 516 . . 59 PRO HB3 . 26802 1 683 . 1 . 1 59 59 PRO HG2 H 1 2.173 0.002 . 2 . . 517 . . 59 PRO HG2 . 26802 1 684 . 1 . 1 59 59 PRO HG3 H 1 2.085 0.002 . 2 . . 518 . . 59 PRO HG3 . 26802 1 685 . 1 . 1 59 59 PRO HD2 H 1 3.726 0.002 . 1 . . 513 . . 59 PRO HD2 . 26802 1 686 . 1 . 1 59 59 PRO HD3 H 1 3.726 0.002 . 1 . . 514 . . 59 PRO HD3 . 26802 1 687 . 1 . 1 59 59 PRO C C 13 176.825 0.002 . 1 . . 430 . . 59 PRO C . 26802 1 688 . 1 . 1 59 59 PRO CA C 13 63.151 0.002 . 1 . . 202 . . 59 PRO CA . 26802 1 689 . 1 . 1 59 59 PRO CB C 13 32.522 0.002 . 1 . . 341 . . 59 PRO CB . 26802 1 690 . 1 . 1 59 59 PRO CG C 13 27.627 0.002 . 1 . . 342 . . 59 PRO CG . 26802 1 691 . 1 . 1 59 59 PRO CD C 13 49.837 0.002 . 1 . . 340 . . 59 PRO CD . 26802 1 692 . 1 . 1 60 60 GLN H H 1 8.832 0.002 . 1 . . 49 . . 60 GLN H . 26802 1 693 . 1 . 1 60 60 GLN HA H 1 5.275 0.002 . 1 . . 750 . . 60 GLN HA . 26802 1 694 . 1 . 1 60 60 GLN HB2 H 1 2.121 0.002 . 1 . . 769 . . 60 GLN HB2 . 26802 1 695 . 1 . 1 60 60 GLN HB3 H 1 2.121 0.002 . 1 . . 770 . . 60 GLN HB3 . 26802 1 696 . 1 . 1 60 60 GLN HG2 H 1 2.222 0.002 . 1 . . 771 . . 60 GLN HG2 . 26802 1 697 . 1 . 1 60 60 GLN HG3 H 1 2.222 0.002 . 1 . . 772 . . 60 GLN HG3 . 26802 1 698 . 1 . 1 60 60 GLN HE21 H 1 7.614 0.002 . 1 . . 923 . . 60 GLN HE21 . 26802 1 699 . 1 . 1 60 60 GLN HE22 H 1 6.896 0.002 . 1 . . 925 . . 60 GLN HE22 . 26802 1 700 . 1 . 1 60 60 GLN C C 13 173.441 0.002 . 1 . . 405 . . 60 GLN C . 26802 1 701 . 1 . 1 60 60 GLN CA C 13 53.647 0.002 . 1 . . 201 . . 60 GLN CA . 26802 1 702 . 1 . 1 60 60 GLN CB C 13 32.185 0.002 . 1 . . 768 . . 60 GLN CB . 26802 1 703 . 1 . 1 60 60 GLN CG C 13 32.171 0.002 . 1 . . 315 . . 60 GLN CG . 26802 1 704 . 1 . 1 60 60 GLN CD C 13 180.393 0.002 . 1 . . 930 . . 60 GLN CD . 26802 1 705 . 1 . 1 60 60 GLN N N 15 119.574 0.010 . 1 . . 50 . . 60 GLN N . 26802 1 706 . 1 . 1 60 60 GLN NE2 N 15 112.318 0.010 . 1 . . 924 . . 60 GLN NE2 . 26802 1 707 . 1 . 1 61 61 ALA H H 1 9.012 0.002 . 1 . . 31 . . 61 ALA H . 26802 1 708 . 1 . 1 61 61 ALA HA H 1 4.765 0.002 . 1 . . 632 . . 61 ALA HA . 26802 1 709 . 1 . 1 61 61 ALA HB1 H 1 0.784 0.002 . 1 . . 633 . . 61 ALA HB1 . 26802 1 710 . 1 . 1 61 61 ALA HB2 H 1 0.784 0.002 . 1 . . 633 . . 61 ALA HB2 . 26802 1 711 . 1 . 1 61 61 ALA HB3 H 1 0.784 0.002 . 1 . . 633 . . 61 ALA HB3 . 26802 1 712 . 1 . 1 61 61 ALA C C 13 176.198 0.002 . 1 . . 435 . . 61 ALA C . 26802 1 713 . 1 . 1 61 61 ALA CA C 13 51.145 0.002 . 1 . . 200 . . 61 ALA CA . 26802 1 714 . 1 . 1 61 61 ALA CB C 13 20.141 0.002 . 1 . . 345 . . 61 ALA CB . 26802 1 715 . 1 . 1 61 61 ALA N N 15 124.760 0.010 . 1 . . 32 . . 61 ALA N . 26802 1 716 . 1 . 1 62 62 GLN H H 1 9.294 0.002 . 1 . . 5 . . 62 GLN H . 26802 1 717 . 1 . 1 62 62 GLN HA H 1 4.772 0.002 . 1 . . 627 . . 62 GLN HA . 26802 1 718 . 1 . 1 62 62 GLN HB2 H 1 1.794 0.002 . 2 . . 630 . . 62 GLN HB2 . 26802 1 719 . 1 . 1 62 62 GLN HB3 H 1 2.053 0.002 . 2 . . 796 . . 62 GLN HB3 . 26802 1 720 . 1 . 1 62 62 GLN HG2 H 1 2.145 0.002 . 2 . . 628 . . 62 GLN HG2 . 26802 1 721 . 1 . 1 62 62 GLN HG3 H 1 2.197 0.002 . 2 . . 629 . . 62 GLN HG3 . 26802 1 722 . 1 . 1 62 62 GLN HE21 H 1 7.317 0.002 . 1 . . 824 . . 62 GLN HE21 . 26802 1 723 . 1 . 1 62 62 GLN HE22 H 1 6.829 0.002 . 1 . . 826 . . 62 GLN HE22 . 26802 1 724 . 1 . 1 62 62 GLN C C 13 174.905 0.002 . 1 . . 436 . . 62 GLN C . 26802 1 725 . 1 . 1 62 62 GLN CA C 13 53.610 0.002 . 1 . . 273 . . 62 GLN CA . 26802 1 726 . 1 . 1 62 62 GLN CB C 13 32.607 0.002 . 1 . . 795 . . 62 GLN CB . 26802 1 727 . 1 . 1 62 62 GLN CG C 13 34.570 0.002 . 1 . . 346 . . 62 GLN CG . 26802 1 728 . 1 . 1 62 62 GLN CD C 13 179.838 0.002 . 1 . . 934 . . 62 GLN CD . 26802 1 729 . 1 . 1 62 62 GLN N N 15 118.746 0.010 . 1 . . 6 . . 62 GLN N . 26802 1 730 . 1 . 1 62 62 GLN NE2 N 15 110.282 0.010 . 1 . . 825 . . 62 GLN NE2 . 26802 1 731 . 1 . 1 63 63 GLN H H 1 9.446 0.002 . 1 . . 3 . . 63 GLN H . 26802 1 732 . 1 . 1 63 63 GLN HA H 1 3.785 0.002 . 1 . . 612 . . 63 GLN HA . 26802 1 733 . 1 . 1 63 63 GLN HB2 H 1 2.142 0.002 . 2 . . 617 . . 63 GLN HB2 . 26802 1 734 . 1 . 1 63 63 GLN HB3 H 1 2.187 0.002 . 2 . . 618 . . 63 GLN HB3 . 26802 1 735 . 1 . 1 63 63 GLN HG2 H 1 2.347 0.002 . 1 . . 615 . . 63 GLN HG2 . 26802 1 736 . 1 . 1 63 63 GLN HG3 H 1 2.347 0.002 . 1 . . 616 . . 63 GLN HG3 . 26802 1 737 . 1 . 1 63 63 GLN HE21 H 1 7.807 0.002 . 1 . . 921 . . 63 GLN HE21 . 26802 1 738 . 1 . 1 63 63 GLN HE22 H 1 6.788 0.002 . 1 . . 922 . . 63 GLN HE22 . 26802 1 739 . 1 . 1 63 63 GLN C C 13 174.836 0.002 . 1 . . 433 . . 63 GLN C . 26802 1 740 . 1 . 1 63 63 GLN CA C 13 56.480 0.002 . 1 . . 272 . . 63 GLN CA . 26802 1 741 . 1 . 1 63 63 GLN CB C 13 26.765 0.002 . 1 . . 614 . . 63 GLN CB . 26802 1 742 . 1 . 1 63 63 GLN CG C 13 34.226 0.002 . 1 . . 613 . . 63 GLN CG . 26802 1 743 . 1 . 1 63 63 GLN CD C 13 180.983 0.002 . 1 . . 928 . . 63 GLN CD . 26802 1 744 . 1 . 1 63 63 GLN N N 15 118.823 0.010 . 1 . . 4 . . 63 GLN N . 26802 1 745 . 1 . 1 63 63 GLN NE2 N 15 113.319 0.010 . 1 . . 920 . . 63 GLN NE2 . 26802 1 746 . 1 . 1 64 64 VAL H H 1 8.291 0.002 . 1 . . 77 . . 64 VAL H . 26802 1 747 . 1 . 1 64 64 VAL HA H 1 4.464 0.002 . 1 . . 544 . . 64 VAL HA . 26802 1 748 . 1 . 1 64 64 VAL HB H 1 1.798 0.002 . 1 . . 545 . . 64 VAL HB . 26802 1 749 . 1 . 1 64 64 VAL HG11 H 1 0.635 0.002 . 2 . . 546 . . 64 VAL HG11 . 26802 1 750 . 1 . 1 64 64 VAL HG12 H 1 0.635 0.002 . 2 . . 546 . . 64 VAL HG12 . 26802 1 751 . 1 . 1 64 64 VAL HG13 H 1 0.635 0.002 . 2 . . 546 . . 64 VAL HG13 . 26802 1 752 . 1 . 1 64 64 VAL HG21 H 1 0.632 0.002 . 2 . . 547 . . 64 VAL HG21 . 26802 1 753 . 1 . 1 64 64 VAL HG22 H 1 0.632 0.002 . 2 . . 547 . . 64 VAL HG22 . 26802 1 754 . 1 . 1 64 64 VAL HG23 H 1 0.632 0.002 . 2 . . 547 . . 64 VAL HG23 . 26802 1 755 . 1 . 1 64 64 VAL C C 13 175.838 0.002 . 1 . . 413 . . 64 VAL C . 26802 1 756 . 1 . 1 64 64 VAL CA C 13 62.751 0.002 . 1 . . 195 . . 64 VAL CA . 26802 1 757 . 1 . 1 64 64 VAL CB C 13 32.167 0.002 . 1 . . 319 . . 64 VAL CB . 26802 1 758 . 1 . 1 64 64 VAL CG1 C 13 21.736 0.002 . 2 . . 320 . . 64 VAL CG1 . 26802 1 759 . 1 . 1 64 64 VAL CG2 C 13 22.349 0.002 . 2 . . 321 . . 64 VAL CG2 . 26802 1 760 . 1 . 1 64 64 VAL N N 15 119.141 0.010 . 1 . . 78 . . 64 VAL N . 26802 1 761 . 1 . 1 65 65 HIS H H 1 9.099 0.002 . 1 . . 135 . . 65 HIS H . 26802 1 762 . 1 . 1 65 65 HIS HA H 1 5.061 0.002 . 1 . . 528 . . 65 HIS HA . 26802 1 763 . 1 . 1 65 65 HIS HB2 H 1 3.182 0.002 . 2 . . 529 . . 65 HIS HB2 . 26802 1 764 . 1 . 1 65 65 HIS HB3 H 1 3.247 0.002 . 2 . . 530 . . 65 HIS HB3 . 26802 1 765 . 1 . 1 65 65 HIS HD2 H 1 7.235 0.002 . 1 . . 816 . . 65 HIS HD2 . 26802 1 766 . 1 . 1 65 65 HIS C C 13 173.450 0.002 . 1 . . 403 . . 65 HIS C . 26802 1 767 . 1 . 1 65 65 HIS CA C 13 53.679 0.002 . 1 . . 194 . . 65 HIS CA . 26802 1 768 . 1 . 1 65 65 HIS CB C 13 31.431 0.002 . 1 . . 311 . . 65 HIS CB . 26802 1 769 . 1 . 1 65 65 HIS CD2 C 13 120.964 0.002 . 1 . . 900 . . 65 HIS CD2 . 26802 1 770 . 1 . 1 65 65 HIS N N 15 123.199 0.010 . 1 . . 136 . . 65 HIS N . 26802 1 771 . 1 . 1 66 66 ALA H H 1 8.865 0.002 . 1 . . 43 . . 66 ALA H . 26802 1 772 . 1 . 1 66 66 ALA HA H 1 4.472 0.002 . 1 . . 548 . . 66 ALA HA . 26802 1 773 . 1 . 1 66 66 ALA HB1 H 1 1.341 0.002 . 1 . . 549 . . 66 ALA HB1 . 26802 1 774 . 1 . 1 66 66 ALA HB2 H 1 1.341 0.002 . 1 . . 549 . . 66 ALA HB2 . 26802 1 775 . 1 . 1 66 66 ALA HB3 H 1 1.341 0.002 . 1 . . 549 . . 66 ALA HB3 . 26802 1 776 . 1 . 1 66 66 ALA C C 13 177.454 0.002 . 1 . . 412 . . 66 ALA C . 26802 1 777 . 1 . 1 66 66 ALA CA C 13 52.486 0.002 . 1 . . 193 . . 66 ALA CA . 26802 1 778 . 1 . 1 66 66 ALA CB C 13 19.015 0.002 . 1 . . 318 . . 66 ALA CB . 26802 1 779 . 1 . 1 66 66 ALA N N 15 125.243 0.010 . 1 . . 44 . . 66 ALA N . 26802 1 780 . 1 . 1 67 67 LEU H H 1 8.203 0.002 . 1 . . 177 . . 67 LEU H . 26802 1 781 . 1 . 1 67 67 LEU HA H 1 4.417 0.002 . 1 . . 699 . . 67 LEU HA . 26802 1 782 . 1 . 1 67 67 LEU HB2 H 1 1.561 0.002 . 2 . . 702 . . 67 LEU HB2 . 26802 1 783 . 1 . 1 67 67 LEU HB3 H 1 1.424 0.002 . 2 . . 703 . . 67 LEU HB3 . 26802 1 784 . 1 . 1 67 67 LEU HG H 1 1.554 0.002 . 1 . . 704 . . 67 LEU HG . 26802 1 785 . 1 . 1 67 67 LEU HD11 H 1 0.828 0.002 . 2 . . 700 . . 67 LEU HD11 . 26802 1 786 . 1 . 1 67 67 LEU HD12 H 1 0.828 0.002 . 2 . . 700 . . 67 LEU HD12 . 26802 1 787 . 1 . 1 67 67 LEU HD13 H 1 0.828 0.002 . 2 . . 700 . . 67 LEU HD13 . 26802 1 788 . 1 . 1 67 67 LEU HD21 H 1 0.828 0.002 . 2 . . 701 . . 67 LEU HD21 . 26802 1 789 . 1 . 1 67 67 LEU HD22 H 1 0.828 0.002 . 2 . . 701 . . 67 LEU HD22 . 26802 1 790 . 1 . 1 67 67 LEU HD23 H 1 0.828 0.002 . 2 . . 701 . . 67 LEU HD23 . 26802 1 791 . 1 . 1 67 67 LEU C C 13 177.703 0.002 . 1 . . 457 . . 67 LEU C . 26802 1 792 . 1 . 1 67 67 LEU CA C 13 54.925 0.002 . 1 . . 274 . . 67 LEU CA . 26802 1 793 . 1 . 1 67 67 LEU CB C 13 42.713 0.002 . 1 . . 373 . . 67 LEU CB . 26802 1 794 . 1 . 1 67 67 LEU CG C 13 27.249 0.002 . 1 . . 374 . . 67 LEU CG . 26802 1 795 . 1 . 1 67 67 LEU CD1 C 13 23.689 0.002 . 2 . . 376 . . 67 LEU CD1 . 26802 1 796 . 1 . 1 67 67 LEU CD2 C 13 25.308 0.002 . 2 . . 375 . . 67 LEU CD2 . 26802 1 797 . 1 . 1 67 67 LEU N N 15 123.349 0.010 . 1 . . 178 . . 67 LEU N . 26802 1 798 . 1 . 1 68 68 GLY H H 1 8.630 0.002 . 1 . . 167 . . 68 GLY H . 26802 1 799 . 1 . 1 68 68 GLY HA2 H 1 4.005 0.002 . 1 . . 712 . . 68 GLY HA2 . 26802 1 800 . 1 . 1 68 68 GLY HA3 H 1 4.005 0.002 . 1 . . 713 . . 68 GLY HA3 . 26802 1 801 . 1 . 1 68 68 GLY C C 13 174.560 0.002 . 1 . . 460 . . 68 GLY C . 26802 1 802 . 1 . 1 68 68 GLY CA C 13 45.301 0.002 . 1 . . 275 . . 68 GLY CA . 26802 1 803 . 1 . 1 68 68 GLY N N 15 110.678 0.010 . 1 . . 168 . . 68 GLY N . 26802 1 804 . 1 . 1 69 69 GLY H H 1 8.318 0.002 . 1 . . 169 . . 69 GLY H . 26802 1 805 . 1 . 1 69 69 GLY HA2 H 1 3.973 0.002 . 1 . . 590 . . 69 GLY HA2 . 26802 1 806 . 1 . 1 69 69 GLY HA3 H 1 3.973 0.002 . 1 . . 591 . . 69 GLY HA3 . 26802 1 807 . 1 . 1 69 69 GLY C C 13 174.375 0.002 . 1 . . 426 . . 69 GLY C . 26802 1 808 . 1 . 1 69 69 GLY CA C 13 45.342 0.002 . 1 . . 219 . . 69 GLY CA . 26802 1 809 . 1 . 1 69 69 GLY N N 15 108.672 0.010 . 1 . . 170 . . 69 GLY N . 26802 1 810 . 1 . 1 70 70 GLU H H 1 8.578 0.002 . 1 . . 11 . . 70 GLU H . 26802 1 811 . 1 . 1 70 70 GLU HA H 1 4.227 0.002 . 1 . . 619 . . 70 GLU HA . 26802 1 812 . 1 . 1 70 70 GLU HB2 H 1 1.925 0.002 . 2 . . 624 . . 70 GLU HB2 . 26802 1 813 . 1 . 1 70 70 GLU HB3 H 1 2.020 0.002 . 2 . . 625 . . 70 GLU HB3 . 26802 1 814 . 1 . 1 70 70 GLU HG2 H 1 2.243 0.002 . 1 . . 621 . . 70 GLU HG2 . 26802 1 815 . 1 . 1 70 70 GLU HG3 H 1 2.243 0.002 . 1 . . 622 . . 70 GLU HG3 . 26802 1 816 . 1 . 1 70 70 GLU C C 13 176.368 0.002 . 1 . . 434 . . 70 GLU C . 26802 1 817 . 1 . 1 70 70 GLU CA C 13 56.980 0.002 . 1 . . 276 . . 70 GLU CA . 26802 1 818 . 1 . 1 70 70 GLU CB C 13 30.149 0.002 . 1 . . 623 . . 70 GLU CB . 26802 1 819 . 1 . 1 70 70 GLU CG C 13 36.271 0.002 . 1 . . 620 . . 70 GLU CG . 26802 1 820 . 1 . 1 70 70 GLU N N 15 120.740 0.010 . 1 . . 12 . . 70 GLU N . 26802 1 821 . 1 . 1 71 71 ASN H H 1 8.476 0.002 . 1 . . 91 . . 71 ASN H . 26802 1 822 . 1 . 1 71 71 ASN HA H 1 4.625 0.002 . 1 . . 564 . . 71 ASN HA . 26802 1 823 . 1 . 1 71 71 ASN HB2 H 1 2.705 0.002 . 2 . . 565 . . 71 ASN HB2 . 26802 1 824 . 1 . 1 71 71 ASN HB3 H 1 2.771 0.002 . 2 . . 566 . . 71 ASN HB3 . 26802 1 825 . 1 . 1 71 71 ASN HD21 H 1 7.583 0.002 . 1 . . 846 . . 71 ASN HD21 . 26802 1 826 . 1 . 1 71 71 ASN HD22 H 1 6.918 0.002 . 1 . . 848 . . 71 ASN HD22 . 26802 1 827 . 1 . 1 71 71 ASN C C 13 175.133 0.002 . 1 . . 418 . . 71 ASN C . 26802 1 828 . 1 . 1 71 71 ASN CA C 13 53.413 0.002 . 1 . . 279 . . 71 ASN CA . 26802 1 829 . 1 . 1 71 71 ASN CB C 13 38.733 0.002 . 1 . . 322 . . 71 ASN CB . 26802 1 830 . 1 . 1 71 71 ASN CG C 13 177.047 0.002 . 1 . . 936 . . 71 ASN CG . 26802 1 831 . 1 . 1 71 71 ASN N N 15 119.036 0.010 . 1 . . 92 . . 71 ASN N . 26802 1 832 . 1 . 1 71 71 ASN ND2 N 15 113.051 0.010 . 1 . . 847 . . 71 ASN ND2 . 26802 1 833 . 1 . 1 72 72 LEU H H 1 8.068 0.002 . 1 . . 163 . . 72 LEU H . 26802 1 834 . 1 . 1 72 72 LEU HA H 1 4.183 0.002 . 1 . . 600 . . 72 LEU HA . 26802 1 835 . 1 . 1 72 72 LEU HB2 H 1 1.444 0.002 . 2 . . 603 . . 72 LEU HB2 . 26802 1 836 . 1 . 1 72 72 LEU HB3 H 1 1.317 0.002 . 2 . . 604 . . 72 LEU HB3 . 26802 1 837 . 1 . 1 72 72 LEU HG H 1 1.443 0.002 . 1 . . 605 . . 72 LEU HG . 26802 1 838 . 1 . 1 72 72 LEU HD11 H 1 0.765 0.002 . 2 . . 601 . . 72 LEU HD11 . 26802 1 839 . 1 . 1 72 72 LEU HD12 H 1 0.765 0.002 . 2 . . 601 . . 72 LEU HD12 . 26802 1 840 . 1 . 1 72 72 LEU HD13 H 1 0.765 0.002 . 2 . . 601 . . 72 LEU HD13 . 26802 1 841 . 1 . 1 72 72 LEU HD21 H 1 0.834 0.002 . 2 . . 602 . . 72 LEU HD21 . 26802 1 842 . 1 . 1 72 72 LEU HD22 H 1 0.834 0.002 . 2 . . 602 . . 72 LEU HD22 . 26802 1 843 . 1 . 1 72 72 LEU HD23 H 1 0.834 0.002 . 2 . . 602 . . 72 LEU HD23 . 26802 1 844 . 1 . 1 72 72 LEU C C 13 177.081 0.002 . 1 . . 431 . . 72 LEU C . 26802 1 845 . 1 . 1 72 72 LEU CA C 13 55.568 0.002 . 1 . . 280 . . 72 LEU CA . 26802 1 846 . 1 . 1 72 72 LEU CB C 13 42.200 0.002 . 1 . . 336 . . 72 LEU CB . 26802 1 847 . 1 . 1 72 72 LEU CG C 13 26.866 0.002 . 1 . . 337 . . 72 LEU CG . 26802 1 848 . 1 . 1 72 72 LEU CD1 C 13 23.332 0.002 . 2 . . 339 . . 72 LEU CD1 . 26802 1 849 . 1 . 1 72 72 LEU CD2 C 13 24.957 0.002 . 2 . . 338 . . 72 LEU CD2 . 26802 1 850 . 1 . 1 72 72 LEU N N 15 122.073 0.010 . 1 . . 164 . . 72 LEU N . 26802 1 851 . 1 . 1 73 73 TYR H H 1 8.023 0.002 . 1 . . 65 . . 73 TYR H . 26802 1 852 . 1 . 1 73 73 TYR HA H 1 4.468 0.002 . 1 . . 572 . . 73 TYR HA . 26802 1 853 . 1 . 1 73 73 TYR HB2 H 1 2.822 0.002 . 2 . . 573 . . 73 TYR HB2 . 26802 1 854 . 1 . 1 73 73 TYR HB3 H 1 2.905 0.002 . 2 . . 574 . . 73 TYR HB3 . 26802 1 855 . 1 . 1 73 73 TYR HD1 H 1 6.935 0.002 . 1 . . 803 . . 73 TYR HD1 . 26802 1 856 . 1 . 1 73 73 TYR HD2 H 1 6.935 0.002 . 1 . . 803 . . 73 TYR HD2 . 26802 1 857 . 1 . 1 73 73 TYR HE1 H 1 6.718 0.002 . 1 . . 802 . . 73 TYR HE1 . 26802 1 858 . 1 . 1 73 73 TYR HE2 H 1 6.718 0.002 . 1 . . 802 . . 73 TYR HE2 . 26802 1 859 . 1 . 1 73 73 TYR C C 13 175.689 0.002 . 1 . . 420 . . 73 TYR C . 26802 1 860 . 1 . 1 73 73 TYR CA C 13 57.936 0.002 . 1 . . 281 . . 73 TYR CA . 26802 1 861 . 1 . 1 73 73 TYR CB C 13 38.597 0.002 . 1 . . 327 . . 73 TYR CB . 26802 1 862 . 1 . 1 73 73 TYR CD1 C 13 133.080 0.002 . 1 . . 902 . . 73 TYR CD1 . 26802 1 863 . 1 . 1 73 73 TYR CD2 C 13 133.080 0.002 . 1 . . 902 . . 73 TYR CD2 . 26802 1 864 . 1 . 1 73 73 TYR CE1 C 13 118.171 0.002 . 1 . . 901 . . 73 TYR CE1 . 26802 1 865 . 1 . 1 73 73 TYR CE2 C 13 118.171 0.002 . 1 . . 901 . . 73 TYR CE2 . 26802 1 866 . 1 . 1 73 73 TYR N N 15 119.652 0.010 . 1 . . 66 . . 73 TYR N . 26802 1 867 . 1 . 1 74 74 PHE H H 1 8.021 0.002 . 1 . . 143 . . 74 PHE H . 26802 1 868 . 1 . 1 74 74 PHE HA H 1 4.506 0.002 . 1 . . 561 . . 74 PHE HA . 26802 1 869 . 1 . 1 74 74 PHE HB2 H 1 2.966 0.002 . 2 . . 562 . . 74 PHE HB2 . 26802 1 870 . 1 . 1 74 74 PHE HB3 H 1 3.027 0.002 . 2 . . 563 . . 74 PHE HB3 . 26802 1 871 . 1 . 1 74 74 PHE HD1 H 1 7.148 0.002 . 1 . . 813 . . 74 PHE HD1 . 26802 1 872 . 1 . 1 74 74 PHE HD2 H 1 7.148 0.002 . 1 . . 813 . . 74 PHE HD2 . 26802 1 873 . 1 . 1 74 74 PHE HE1 H 1 7.249 0.002 . 1 . . 812 . . 74 PHE HE1 . 26802 1 874 . 1 . 1 74 74 PHE HE2 H 1 7.249 0.002 . 1 . . 812 . . 74 PHE HE2 . 26802 1 875 . 1 . 1 74 74 PHE C C 13 175.562 0.002 . 1 . . 417 . . 74 PHE C . 26802 1 876 . 1 . 1 74 74 PHE CA C 13 57.821 0.002 . 1 . . 282 . . 74 PHE CA . 26802 1 877 . 1 . 1 74 74 PHE CB C 13 39.512 0.002 . 1 . . 323 . . 74 PHE CB . 26802 1 878 . 1 . 1 74 74 PHE CD1 C 13 131.768 0.002 . 1 . . 912 . . 74 PHE CD1 . 26802 1 879 . 1 . 1 74 74 PHE CD2 C 13 131.768 0.002 . 1 . . 912 . . 74 PHE CD2 . 26802 1 880 . 1 . 1 74 74 PHE N N 15 121.297 0.010 . 1 . . 144 . . 74 PHE N . 26802 1 881 . 1 . 1 75 75 GLN H H 1 8.250 0.002 . 1 . . 175 . . 75 GLN H . 26802 1 882 . 1 . 1 75 75 GLN HA H 1 4.192 0.002 . 1 . . 723 . . 75 GLN HA . 26802 1 883 . 1 . 1 75 75 GLN HB2 H 1 1.867 0.002 . 2 . . 754 . . 75 GLN HB2 . 26802 1 884 . 1 . 1 75 75 GLN HB3 H 1 2.038 0.002 . 2 . . 755 . . 75 GLN HB3 . 26802 1 885 . 1 . 1 75 75 GLN HG2 H 1 2.243 0.002 . 1 . . 736 . . 75 GLN HG2 . 26802 1 886 . 1 . 1 75 75 GLN HG3 H 1 2.243 0.002 . 1 . . 737 . . 75 GLN HG3 . 26802 1 887 . 1 . 1 75 75 GLN HE21 H 1 7.443 0.002 . 1 . . 840 . . 75 GLN HE21 . 26802 1 888 . 1 . 1 75 75 GLN HE22 H 1 6.841 0.002 . 1 . . 842 . . 75 GLN HE22 . 26802 1 889 . 1 . 1 75 75 GLN C C 13 176.094 0.002 . 1 . . 461 . . 75 GLN C . 26802 1 890 . 1 . 1 75 75 GLN CA C 13 56.073 0.002 . 1 . . 283 . . 75 GLN CA . 26802 1 891 . 1 . 1 75 75 GLN CB C 13 29.241 0.002 . 1 . . 753 . . 75 GLN CB . 26802 1 892 . 1 . 1 75 75 GLN CG C 13 33.797 0.002 . 1 . . 751 . . 75 GLN CG . 26802 1 893 . 1 . 1 75 75 GLN CD C 13 180.387 0.002 . 1 . . 932 . . 75 GLN CD . 26802 1 894 . 1 . 1 75 75 GLN N N 15 121.998 0.010 . 1 . . 176 . . 75 GLN N . 26802 1 895 . 1 . 1 75 75 GLN NE2 N 15 112.301 0.010 . 1 . . 841 . . 75 GLN NE2 . 26802 1 896 . 1 . 1 76 76 GLY H H 1 7.819 0.002 . 1 . . 173 . . 76 GLY H . 26802 1 897 . 1 . 1 76 76 GLY HA2 H 1 3.747 0.002 . 1 . . 798 . . 76 GLY HA2 . 26802 1 898 . 1 . 1 76 76 GLY HA3 H 1 3.747 0.002 . 1 . . 799 . . 76 GLY HA3 . 26802 1 899 . 1 . 1 76 76 GLY CA C 13 46.134 0.002 . 1 . . 797 . . 76 GLY CA . 26802 1 900 . 1 . 1 76 76 GLY N N 15 108.658 0.010 . 1 . . 174 . . 76 GLY N . 26802 1 stop_ save_ ######################### # Spectral peak lists # ######################### save_peak_list_1 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode peak_list_1 _Spectral_peak_list.Entry_ID 26802 _Spectral_peak_list.ID 1 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $CspA _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $CspA_1 _Spectral_peak_list.Chem_shift_reference_ID . _Spectral_peak_list.Chem_shift_reference_label . _Spectral_peak_list.Experiment_ID 1 _Spectral_peak_list.Experiment_name '2D 1H-15N HSQC/HMQC' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details 'Default list' _Spectral_peak_list.Text_data_format . _Spectral_peak_list.Text_data . loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . H 1 1H . . 7267.442 . . . . . . . 26802 1 2 . . N 15 15N . . 3280.033 . . . . . . . 26802 1 stop_ loop_ _Peak.ID _Peak.Figure_of_merit _Peak.Restraint _Peak.Details _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 1.0 . . 26802 1 2 1.0 . . 26802 1 3 1.0 . . 26802 1 4 1.0 . . 26802 1 5 1.0 . . 26802 1 6 1.0 . . 26802 1 7 1.0 . . 26802 1 8 1.0 . . 26802 1 9 1.0 . . 26802 1 10 1.0 . . 26802 1 11 1.0 . . 26802 1 12 1.0 . . 26802 1 13 1.0 . . 26802 1 14 1.0 . . 26802 1 15 1.0 . . 26802 1 16 1.0 . . 26802 1 17 1.0 . . 26802 1 18 1.0 . . 26802 1 19 1.0 . . 26802 1 20 1.0 . . 26802 1 21 1.0 . . 26802 1 22 1.0 . . 26802 1 23 1.0 . . 26802 1 24 1.0 . . 26802 1 25 1.0 . . 26802 1 26 1.0 . . 26802 1 27 1.0 . . 26802 1 28 1.0 . . 26802 1 29 1.0 . . 26802 1 30 1.0 . . 26802 1 31 1.0 . . 26802 1 32 1.0 . . 26802 1 33 1.0 . . 26802 1 34 1.0 . . 26802 1 35 1.0 . . 26802 1 36 1.0 . . 26802 1 37 1.0 . . 26802 1 38 1.0 . . 26802 1 39 1.0 . . 26802 1 40 1.0 . . 26802 1 41 1.0 . . 26802 1 42 1.0 . . 26802 1 43 1.0 . . 26802 1 44 1.0 . . 26802 1 45 1.0 . . 26802 1 46 1.0 . . 26802 1 47 1.0 . . 26802 1 48 1.0 . . 26802 1 49 1.0 . . 26802 1 50 1.0 . . 26802 1 51 1.0 . . 26802 1 52 1.0 . . 26802 1 53 1.0 . . 26802 1 54 1.0 . . 26802 1 55 1.0 . . 26802 1 56 1.0 . . 26802 1 57 1.0 . . 26802 1 58 1.0 . . 26802 1 59 1.0 . . 26802 1 60 1.0 . . 26802 1 61 1.0 . . 26802 1 62 1.0 . . 26802 1 63 1.0 . . 26802 1 64 1.0 . . 26802 1 65 1.0 . . 26802 1 66 1.0 . . 26802 1 67 1.0 . . 26802 1 68 1.0 . . 26802 1 69 1.0 . . 26802 1 70 1.0 . . 26802 1 71 1.0 . . 26802 1 72 1.0 . . 26802 1 73 1.0 . . 26802 1 74 1.0 . . 26802 1 75 1.0 . . 26802 1 76 1.0 . . 26802 1 77 1.0 . . 26802 1 78 1.0 . . 26802 1 79 1.0 . . 26802 1 80 1.0 . . 26802 1 81 1.0 . . 26802 1 82 1.0 . . 26802 1 83 1.0 . . 26802 1 84 1.0 . . 26802 1 85 1.0 . . 26802 1 86 1.0 . . 26802 1 87 1.0 . . 26802 1 88 1.0 . . 26802 1 89 1.0 . . 26802 1 90 1.0 . . 26802 1 91 1.0 . . 26802 1 92 1.0 . . 26802 1 93 1.0 . . 26802 1 94 1.0 . . 26802 1 95 1.0 . . 26802 1 stop_ loop_ _Peak_general_char.Peak_ID _Peak_general_char.Intensity_val _Peak_general_char.Intensity_val_err _Peak_general_char.Measurement_method _Peak_general_char.Entry_ID _Peak_general_char.Spectral_peak_list_ID 1 327045.21875000 . height 26802 1 1 2326316.37500000 . volume 26802 1 2 366019.00000000 . height 26802 1 2 2582355.95312000 . volume 26802 1 3 244809.70312500 . height 26802 1 3 1787245.31250000 . volume 26802 1 4 285866.43750000 . height 26802 1 4 2056161.68750000 . volume 26802 1 5 258319.92187500 . height 26802 1 5 1897431.37500000 . volume 26802 1 6 233821.29687500 . height 26802 1 6 1707915.60938000 . volume 26802 1 7 405861.00000000 . height 26802 1 7 2905113.09375000 . volume 26802 1 8 393255.84375000 . height 26802 1 8 2789370.26562000 . volume 26802 1 9 201641.48437500 . height 26802 1 9 1467057.42188000 . volume 26802 1 10 122236.49218800 . height 26802 1 10 903993.36718800 . volume 26802 1 11 222144.21875000 . height 26802 1 11 1621259.32812000 . volume 26802 1 12 315598.21875000 . height 26802 1 12 2286717.90625000 . volume 26802 1 13 199677.23437500 . height 26802 1 13 1478102.46094000 . volume 26802 1 14 374715.50000000 . height 26802 1 14 2705122.89062000 . volume 26802 1 15 461976.21875000 . height 26802 1 15 3305858.57812000 . volume 26802 1 16 404158.68750000 . height 26802 1 16 2886030.40625000 . volume 26802 1 17 597919.18750000 . height 26802 1 17 4250080.06250000 . volume 26802 1 18 566732.62500000 . height 26802 1 18 4005899.87500000 . volume 26802 1 19 368613.96875000 . height 26802 1 19 2684265.45312000 . volume 26802 1 20 326147.71875000 . height 26802 1 20 2325548.25000000 . volume 26802 1 21 339523.53125000 . height 26802 1 21 2419481.59375000 . volume 26802 1 22 209659.23437500 . height 26802 1 22 1537893.42188000 . volume 26802 1 23 368963.78125000 . height 26802 1 23 2630363.12500000 . volume 26802 1 24 419748.40625000 . height 26802 1 24 3077938.35938000 . volume 26802 1 25 408261.50000000 . height 26802 1 25 2874293.59375000 . volume 26802 1 26 446308.12500000 . height 26802 1 26 3202783.76562000 . volume 26802 1 27 365110.37500000 . height 26802 1 27 2574374.73438000 . volume 26802 1 28 159365.45312500 . height 26802 1 28 1200090.80469000 . volume 26802 1 29 543290.68750000 . height 26802 1 29 3892428.96875000 . volume 26802 1 30 313271.40625000 . height 26802 1 30 2268499.89062000 . volume 26802 1 31 250717.37500000 . height 26802 1 31 1836319.90625000 . volume 26802 1 32 500838.78125000 . height 26802 1 32 3517775.65625000 . volume 26802 1 33 953009.43750000 . height 26802 1 33 6498267.18750000 . volume 26802 1 34 576375.62500000 . height 26802 1 34 4048867.59375000 . volume 26802 1 35 260273.81250000 . height 26802 1 35 1885099.09375000 . volume 26802 1 36 832561.06250000 . height 26802 1 36 5741651.59375000 . volume 26802 1 37 694486.06250000 . height 26802 1 37 4887552.34375000 . volume 26802 1 38 213263.04687500 . height 26802 1 38 1549821.23438000 . volume 26802 1 39 382718.28125000 . height 26802 1 39 2768354.17188000 . volume 26802 1 40 793106.56250000 . height 26802 1 40 5457549.37500000 . volume 26802 1 41 639669.06250000 . height 26802 1 41 4535577.43750000 . volume 26802 1 42 325372.68750000 . height 26802 1 42 2335197.26562000 . volume 26802 1 43 747913.93750000 . height 26802 1 43 5133856.71875000 . volume 26802 1 44 233670.51562500 . height 26802 1 44 1729194.18750000 . volume 26802 1 45 279684.56250000 . height 26802 1 45 2033332.29688000 . volume 26802 1 46 803878.75000000 . height 26802 1 46 5529623.53125000 . volume 26802 1 47 982224.81250000 . height 26802 1 47 6772496.31250000 . volume 26802 1 48 402272.03125000 . height 26802 1 48 2873527.21875000 . volume 26802 1 49 319977.56250000 . height 26802 1 49 2314871.85938000 . volume 26802 1 50 354911.00000000 . height 26802 1 50 2550910.59375000 . volume 26802 1 51 405847.09375000 . height 26802 1 51 2955753.67188000 . volume 26802 1 52 436714.53125000 . height 26802 1 52 3136250.90625000 . volume 26802 1 53 433788.87500000 . height 26802 1 53 3130742.87500000 . volume 26802 1 54 174936.04687500 . height 26802 1 54 1385273.14062000 . volume 26802 1 55 697491.00000000 . height 26802 1 55 4883279.03125000 . volume 26802 1 56 696604.75000000 . height 26802 1 56 4852648.53125000 . volume 26802 1 57 390880.81250000 . height 26802 1 57 2798496.18750000 . volume 26802 1 58 539587.18750000 . height 26802 1 58 3915246.62500000 . volume 26802 1 59 433038.87500000 . height 26802 1 59 3052841.98438000 . volume 26802 1 60 614548.87500000 . height 26802 1 60 4288334.12500000 . volume 26802 1 61 477260.75000000 . height 26802 1 61 3410339.50000000 . volume 26802 1 62 299630.46875000 . height 26802 1 62 2197471.68750000 . volume 26802 1 63 230684.76562500 . height 26802 1 63 1698050.90625000 . volume 26802 1 64 258518.60937500 . height 26802 1 64 1954480.89062000 . volume 26802 1 65 423201.71875000 . height 26802 1 65 3061444.75000000 . volume 26802 1 66 345060.15625000 . height 26802 1 66 2513563.73438000 . volume 26802 1 67 245639.70312500 . height 26802 1 67 1785401.67188000 . volume 26802 1 68 628517.31250000 . height 26802 1 68 4348612.03125000 . volume 26802 1 69 430206.21875000 . height 26802 1 69 3036891.25000000 . volume 26802 1 70 608610.25000000 . height 26802 1 70 4284733.62500000 . volume 26802 1 71 303047.46875000 . height 26802 1 71 2174717.23438000 . volume 26802 1 72 623148.62500000 . height 26802 1 72 4376449.87500000 . volume 26802 1 73 8963.21289062 . height 26802 1 73 65884.52001950 . volume 26802 1 74 539986.68750000 . height 26802 1 74 3766969.06250000 . volume 26802 1 75 537242.62500000 . height 26802 1 75 3726970.65625000 . volume 26802 1 76 677049.93750000 . height 26802 1 76 4563016.53125000 . volume 26802 1 77 732662.50000000 . height 26802 1 77 4914261.12500000 . volume 26802 1 78 250391.09375000 . height 26802 1 78 1772141.54688000 . volume 26802 1 79 667020.68750000 . height 26802 1 79 4512354.62500000 . volume 26802 1 80 632466.68750000 . height 26802 1 80 4219319.81250000 . volume 26802 1 81 264302.65625000 . height 26802 1 81 1869756.92188000 . volume 26802 1 82 1167310.75000000 . height 26802 1 82 7605436.87500000 . volume 26802 1 83 619061.37500000 . height 26802 1 83 4221472.96875000 . volume 26802 1 84 712556.93750000 . height 26802 1 84 4845870.25000000 . volume 26802 1 85 1061456.87500000 . height 26802 1 85 7126840.09375000 . volume 26802 1 86 520975.06250000 . height 26802 1 86 3512984.21875000 . volume 26802 1 87 764828.81250000 . height 26802 1 87 5212751.62500000 . volume 26802 1 88 592294.06250000 . height 26802 1 88 4511011.96875000 . volume 26802 1 89 545373.25000000 . height 26802 1 89 4117852.92188000 . volume 26802 1 90 655454.18750000 . height 26802 1 90 5184368.61719000 . volume 26802 1 91 612336.75000000 . height 26802 1 91 4342687.42188000 . volume 26802 1 92 1298652.50000000 . height 26802 1 92 8850130.12500000 . volume 26802 1 93 387852.25000000 . height 26802 1 93 2684364.62500000 . volume 26802 1 94 322858.28125000 . height 26802 1 94 2302692.15625000 . volume 26802 1 95 539356.18750000 . height 26802 1 95 4336578.82812000 . volume 26802 1 stop_ loop_ _Peak_char.Peak_ID _Peak_char.Spectral_dim_ID _Peak_char.Chem_shift_val _Peak_char.Chem_shift_val_err _Peak_char.Line_width_val _Peak_char.Line_width_val_err _Peak_char.Phase_val _Peak_char.Phase_val_err _Peak_char.Decay_rate_val _Peak_char.Decay_rate_val_err _Peak_char.Coupling_pattern _Peak_char.Bounding_box_upper_val _Peak_char.Bounding_box_lower_val _Peak_char.Bounding_box_range_val _Peak_char.Details _Peak_char.Derivation_method_ID _Peak_char.Entry_ID _Peak_char.Spectral_peak_list_ID 1 1 9.215 . 22.8288826086 . . . . . . . . . . 1 26802 1 1 2 131.139 . 19.3520824018 . . . . . . . . . . 1 26802 1 2 1 10.351 . 22.6060149463 . . . . . . . . . . 1 26802 1 2 2 129.934 . 18.7318421490 . . . . . . . . . . 1 26802 1 3 1 9.061 . 22.2165921507 . . . . . . . . . . 1 26802 1 3 2 133.707 . 21.1672993244 . . . . . . . . . . 1 26802 1 4 1 8.383 . 21.8436299404 . . . . . . . . . . 1 26802 1 4 2 129.893 . 20.3778004431 . . . . . . . . . . 1 26802 1 5 1 8.089 . 23.8739131920 . . . . . . . . . . 1 26802 1 5 2 105.684 . 20.9206206360 . . . . . . . . . . 1 26802 1 6 1 6.070 . 25.4108120563 . . . . . . . . . . 1 26802 1 6 2 119.121 . 20.3778981957 . . . . . . . . . . 1 26802 1 7 1 7.475 . 22.0740781354 . . . . . . . . . . 1 26802 1 7 2 121.461 . 19.9762327586 . . . . . . . . . . 1 26802 1 8 1 8.289 . 21.5031557275 . . . . . . . . . . 1 26802 1 8 2 119.143 . 19.5583403897 . . . . . . . . . . 1 26802 1 9 1 8.789 . 24.2676677207 . . . . . . . . . . 1 26802 1 9 2 127.627 . 20.4915355943 . . . . . . . . . . 1 26802 1 10 1 8.629 . 25.8483170881 . . . . . . . . . . 1 26802 1 10 2 123.692 . 21.4485824335 . . . . . . . . . . 1 26802 1 11 1 9.445 . 24.0426341919 . . . . . . . . . . 1 26802 1 11 2 118.783 . 20.8056635773 . . . . . . . . . . 1 26802 1 12 1 7.704 . 24.1468123703 . . . . . . . . . . 1 26802 1 12 2 124.218 . 20.0403584648 . . . . . . . . . . 1 26802 1 13 1 8.198 . 26.5491914856 . . . . . . . . . . 1 26802 1 13 2 127.244 . 21.0186176184 . . . . . . . . . . 1 26802 1 14 1 6.655 . 21.4784648495 . . . . . . . . . . 1 26802 1 14 2 112.689 . 20.6111359015 . . . . . . . . . . 1 26802 1 15 1 8.810 . 20.0580896026 . . . . . . . . . . 1 26802 1 15 2 108.201 . 20.2560984550 . . . . . . . . . . 1 26802 1 16 1 8.634 . 22.0528526437 . . . . . . . . . . 1 26802 1 16 2 110.691 . 19.6686053236 . . . . . . . . . . 1 26802 1 17 1 7.954 . 20.6168831581 . . . . . . . . . . 1 26802 1 17 2 112.627 . 19.6062391642 . . . . . . . . . . 1 26802 1 18 1 7.820 . 20.1811108195 . . . . . . . . . . 1 26802 1 18 2 107.453 . 19.4508125287 . . . . . . . . . . 1 26802 1 19 1 8.647 . 23.3419763811 . . . . . . . . . . 1 26802 1 19 2 114.952 . 20.5522888358 . . . . . . . . . . 1 26802 1 20 1 7.578 . 24.4786231172 . . . . . . . . . . 1 26802 1 20 2 116.119 . 19.2699702170 . . . . . . . . . . 1 26802 1 21 1 8.975 . 20.6712464071 . . . . . . . . . . 1 26802 1 21 2 128.678 . 19.9104941345 . . . . . . . . . . 1 26802 1 22 1 8.965 . 24.7036566460 . . . . . . . . . . 1 26802 1 22 2 127.770 . 20.7419777578 . . . . . . . . . . 1 26802 1 23 1 9.133 . 21.2228926032 . . . . . . . . . . 1 26802 1 23 2 127.215 . 19.8754987034 . . . . . . . . . . 1 26802 1 24 1 8.843 . 20.8685568447 . . . . . . . . . . 1 26802 1 24 2 125.429 . 22.1237596480 . . . . . . . . . . 1 26802 1 25 1 9.196 . 19.7503199738 . . . . . . . . . . 1 26802 1 25 2 125.241 . 19.5039899436 . . . . . . . . . . 1 26802 1 26 1 8.865 . 21.9718492368 . . . . . . . . . . 1 26802 1 26 2 125.236 . 20.0508179931 . . . . . . . . . . 1 26802 1 27 1 9.011 . 21.6428541164 . . . . . . . . . . 1 26802 1 27 2 124.757 . 19.1689917803 . . . . . . . . . . 1 26802 1 28 1 8.137 . 25.3939182977 . . . . . . . . . . 1 26802 1 28 2 123.559 . 22.8954186795 . . . . . . . . . . 1 26802 1 29 1 8.203 . 20.5090230067 . . . . . . . . . . 1 26802 1 29 2 123.370 . 20.2109367534 . . . . . . . . . . 1 26802 1 30 1 9.099 . 23.5031168482 . . . . . . . . . . 1 26802 1 30 2 123.198 . 20.2021390193 . . . . . . . . . . 1 26802 1 31 1 8.255 . 23.2718023067 . . . . . . . . . . 1 26802 1 31 2 123.106 . 20.9921755398 . . . . . . . . . . 1 26802 1 32 1 8.866 . 21.4271338136 . . . . . . . . . . 1 26802 1 32 2 122.656 . 18.9546203265 . . . . . . . . . . 1 26802 1 33 1 8.068 . 18.6186547306 . . . . . . . . . . 1 26802 1 33 2 122.083 . 18.2338904000 . . . . . . . . . . 1 26802 1 34 1 8.248 . 19.9818511020 . . . . . . . . . . 1 26802 1 34 2 122.007 . 19.2704589801 . . . . . . . . . . 1 26802 1 35 1 9.385 . 23.9605478518 . . . . . . . . . . 1 26802 1 35 2 121.865 . 20.0688044717 . . . . . . . . . . 1 26802 1 36 1 8.019 . 18.9959486738 . . . . . . . . . . 1 26802 1 36 2 121.310 . 18.7137579179 . . . . . . . . . . 1 26802 1 37 1 8.682 . 18.3669810439 . . . . . . . . . . 1 26802 1 37 2 121.223 . 19.8769161161 . . . . . . . . . . 1 26802 1 38 1 8.164 . 23.6685890484 . . . . . . . . . . 1 26802 1 38 2 121.249 . 20.4998934417 . . . . . . . . . . 1 26802 1 39 1 8.721 . 24.8732439924 . . . . . . . . . . 1 26802 1 39 2 121.182 . 19.9907978961 . . . . . . . . . . 1 26802 1 40 1 8.547 . 18.8876553491 . . . . . . . . . . 1 26802 1 40 2 121.169 . 18.5562784778 . . . . . . . . . . 1 26802 1 41 1 7.862 . 19.8007846631 . . . . . . . . . . 1 26802 1 41 2 120.876 . 19.8345892399 . . . . . . . . . . 1 26802 1 42 1 9.097 . 21.6242276645 . . . . . . . . . . 1 26802 1 42 2 120.837 . 20.1620604529 . . . . . . . . . . 1 26802 1 43 1 8.578 . 18.3955704817 . . . . . . . . . . 1 26802 1 43 2 120.738 . 18.4139506909 . . . . . . . . . . 1 26802 1 44 1 7.786 . 26.4577919196 . . . . . . . . . . 1 26802 1 44 2 120.171 . 20.9735047931 . . . . . . . . . . 1 26802 1 45 1 9.339 . 23.9161475887 . . . . . . . . . . 1 26802 1 45 2 119.924 . 20.3933431067 . . . . . . . . . . 1 26802 1 46 1 7.856 . 17.8497721251 . . . . . . . . . . 1 26802 1 46 2 119.689 . 18.8633193973 . . . . . . . . . . 1 26802 1 47 1 8.021 . 18.8486697522 . . . . . . . . . . 1 26802 1 47 2 119.652 . 18.3607732760 . . . . . . . . . . 1 26802 1 48 1 8.833 . 22.6677421414 . . . . . . . . . . 1 26802 1 48 2 119.566 . 19.5683111550 . . . . . . . . . . 1 26802 1 49 1 9.293 . 23.1004822670 . . . . . . . . . . 1 26802 1 49 2 118.747 . 19.9441699055 . . . . . . . . . . 1 26802 1 50 1 8.787 . 23.4481038393 . . . . . . . . . . 1 26802 1 50 2 118.356 . 19.7349793396 . . . . . . . . . . 1 26802 1 51 1 8.387 . 22.4925235420 . . . . . . . . . . 1 26802 1 51 2 118.094 . 20.9501419215 . . . . . . . . . . 1 26802 1 52 1 8.059 . 23.3658009125 . . . . . . . . . . 1 26802 1 52 2 118.076 . 19.7670421927 . . . . . . . . . . 1 26802 1 53 1 8.124 . 21.1440550628 . . . . . . . . . . 1 26802 1 53 2 118.035 . 20.6690054412 . . . . . . . . . . 1 26802 1 54 1 8.368 . 24.8758430322 . . . . . . . . . . 1 26802 1 54 2 117.861 . 37.0596727985 . . . . . . . . . . 1 26802 1 55 1 8.019 . 18.2482915601 . . . . . . . . . . 1 26802 1 55 2 117.552 . 19.4850259390 . . . . . . . . . . 1 26802 1 56 1 8.040 . 19.2957045966 . . . . . . . . . . 1 26802 1 56 2 116.689 . 19.0482673182 . . . . . . . . . . 1 26802 1 57 1 8.986 . 21.7829856786 . . . . . . . . . . 1 26802 1 57 2 116.481 . 19.8009623452 . . . . . . . . . . 1 26802 1 58 1 8.405 . 21.2649104131 . . . . . . . . . . 1 26802 1 58 2 116.432 . 20.3761386489 . . . . . . . . . . 1 26802 1 59 1 8.986 . 21.4888610086 . . . . . . . . . . 1 26802 1 59 2 116.052 . 19.1788647930 . . . . . . . . . . 1 26802 1 60 1 7.973 . 19.8016510097 . . . . . . . . . . 1 26802 1 60 2 115.827 . 19.0523729274 . . . . . . . . . . 1 26802 1 61 1 8.334 . 22.7740861863 . . . . . . . . . . 1 26802 1 61 2 115.630 . 19.5677246394 . . . . . . . . . . 1 26802 1 62 1 8.362 . 23.8613511664 . . . . . . . . . . 1 26802 1 62 2 114.804 . 20.9030251678 . . . . . . . . . . 1 26802 1 63 1 7.667 . 25.6798126749 . . . . . . . . . . 1 26802 1 63 2 114.684 . 20.6242347500 . . . . . . . . . . 1 26802 1 64 1 7.561 . 22.5778586819 . . . . . . . . . . 1 26802 1 64 2 112.096 . 24.1357036799 . . . . . . . . . . 1 26802 1 65 1 7.373 . 20.3023993431 . . . . . . . . . . 1 26802 1 65 2 112.062 . 21.0107485340 . . . . . . . . . . 1 26802 1 66 1 8.334 . 21.3861989368 . . . . . . . . . . 1 26802 1 66 2 109.832 . 20.8967690014 . . . . . . . . . . 1 26802 1 67 1 8.418 . 22.8009429308 . . . . . . . . . . 1 26802 1 67 2 109.394 . 20.5303922532 . . . . . . . . . . 1 26802 1 68 1 8.315 . 20.2300594022 . . . . . . . . . . 1 26802 1 68 2 108.664 . 18.5116055392 . . . . . . . . . . 1 26802 1 69 1 7.817 . 21.5204826595 . . . . . . . . . . 1 26802 1 69 2 108.661 . 19.2660601130 . . . . . . . . . . 1 26802 1 70 1 7.427 . 20.3006666499 . . . . . . . . . . 1 26802 1 70 2 108.787 . 19.0736829944 . . . . . . . . . . 1 26802 1 71 1 8.192 . 23.7747165066 . . . . . . . . . . 1 26802 1 71 2 107.888 . 19.7370321442 . . . . . . . . . . 1 26802 1 72 1 8.476 . 20.1529545550 . . . . . . . . . . 1 26802 1 72 2 119.046 . 19.0176707541 . . . . . . . . . . 1 26802 1 73 1 7.806 . 22.0428896579 . . . . . . . . . . 1 26802 1 73 2 117.360 . 21.1176898794 . . . . . . . . . . 1 26802 1 74 1 7.041 . 18.7598692260 . . . . . . . . . . 1 26802 1 74 2 114.250 . 18.7888319154 . . . . . . . . . . 1 26802 1 75 1 7.646 . 17.1991458303 . . . . . . . . . . 1 26802 1 75 2 114.252 . 18.9837506016 . . . . . . . . . . 1 26802 1 76 1 7.807 . 16.7573090655 . . . . . . . . . . 1 26802 1 76 2 113.318 . 18.1802242221 . . . . . . . . . . 1 26802 1 77 1 7.721 . 16.6559465135 . . . . . . . . . . 1 26802 1 77 2 111.553 . 18.1796377065 . . . . . . . . . . 1 26802 1 78 1 7.527 . 21.8332337812 . . . . . . . . . . 1 26802 1 78 2 112.948 . 19.4242238213 . . . . . . . . . . 1 26802 1 79 1 7.317 . 16.5060685521 . . . . . . . . . . 1 26802 1 79 2 110.282 . 18.6406389724 . . . . . . . . . . 1 26802 1 80 1 7.219 . 16.4826771940 . . . . . . . . . . 1 26802 1 80 2 112.459 . 17.9952763012 . . . . . . . . . . 1 26802 1 81 1 7.242 . 21.6885538994 . . . . . . . . . . 1 26802 1 81 2 112.944 . 19.3125903510 . . . . . . . . . . 1 26802 1 82 1 7.443 . 14.6027050771 . . . . . . . . . . 1 26802 1 82 2 112.300 . 17.4392595072 . . . . . . . . . . 1 26802 1 83 1 6.829 . 17.6297200893 . . . . . . . . . . 1 26802 1 83 2 110.282 . 18.4771966237 . . . . . . . . . . 1 26802 1 84 1 6.743 . 17.7427783203 . . . . . . . . . . 1 26802 1 84 2 111.555 . 18.4081832874 . . . . . . . . . . 1 26802 1 85 1 6.841 . 16.7906634095 . . . . . . . . . . 1 26802 1 85 2 112.301 . 17.6996724361 . . . . . . . . . . 1 26802 1 86 1 7.614 . 17.4144329598 . . . . . . . . . . 1 26802 1 86 2 112.319 . 18.1901949874 . . . . . . . . . . 1 26802 1 87 1 6.788 . 17.2740848110 . . . . . . . . . . 1 26802 1 87 2 113.320 . 18.5503155692 . . . . . . . . . . 1 26802 1 88 1 6.901 . 20.0910107733 . . . . . . . . . . 1 26802 1 88 2 112.459 . 25.6717880505 . . . . . . . . . . 1 26802 1 89 1 7.564 . 27.7893666402 . . . . . . . . . . 1 26802 1 89 2 112.974 . 20.3030197034 . . . . . . . . . . 1 26802 1 90 1 6.925 . 21.5871913475 . . . . . . . . . . 1 26802 1 90 2 112.974 . 22.6944393321 . . . . . . . . . . 1 26802 1 91 1 7.583 . 29.9015196453 . . . . . . . . . . 1 26802 1 91 2 113.053 . 18.4799336965 . . . . . . . . . . 1 26802 1 92 1 6.918 . 17.8181504743 . . . . . . . . . . 1 26802 1 92 2 113.050 . 18.4199135995 . . . . . . . . . . 1 26802 1 93 1 7.363 . 17.9164808131 . . . . . . . . . . 1 26802 1 93 2 109.880 . 19.2302826611 . . . . . . . . . . 1 26802 1 94 1 6.646 . 20.0199703523 . . . . . . . . . . 1 26802 1 94 2 109.877 . 20.0991077780 . . . . . . . . . . 1 26802 1 95 1 6.896 . 19.4295551460 . . . . . . . . . . 1 26802 1 95 2 112.318 . 28.2186343146 . . . . . . . . . . 1 26802 1 stop_ loop_ _Assigned_peak_chem_shift.Peak_ID _Assigned_peak_chem_shift.Spectral_dim_ID _Assigned_peak_chem_shift.Set_ID _Assigned_peak_chem_shift.Magnetization_linkage_ID _Assigned_peak_chem_shift.Assembly_atom_ID _Assigned_peak_chem_shift.Val _Assigned_peak_chem_shift.Contribution_fractional_val _Assigned_peak_chem_shift.Figure_of_merit _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID _Assigned_peak_chem_shift.Atom_chem_shift_ID _Assigned_peak_chem_shift.Entity_assembly_ID _Assigned_peak_chem_shift.Entity_ID _Assigned_peak_chem_shift.Comp_index_ID _Assigned_peak_chem_shift.Comp_ID _Assigned_peak_chem_shift.Atom_ID _Assigned_peak_chem_shift.Ambiguity_code _Assigned_peak_chem_shift.Ambiguity_set_ID _Assigned_peak_chem_shift.Auth_atom_peak_num _Assigned_peak_chem_shift.Auth_entity_ID _Assigned_peak_chem_shift.Auth_seq_ID _Assigned_peak_chem_shift.Auth_comp_ID _Assigned_peak_chem_shift.Auth_atom_ID _Assigned_peak_chem_shift.Auth_ambiguity_code _Assigned_peak_chem_shift.Auth_ambiguity_set_ID _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID _Assigned_peak_chem_shift.Resonance_ID _Assigned_peak_chem_shift.Details _Assigned_peak_chem_shift.Entry_ID _Assigned_peak_chem_shift.Spectral_peak_list_ID 1 1 1 . . 9.215 . . 1 . 1 1 19 ALA H . . . . . . . . . . 25 . 26802 1 1 2 1 . . 131.139 . . 1 . 1 1 19 ALA N . . . . . . . . . . 26 . 26802 1 2 1 1 . . 10.351 . . 1 . 1 1 8 TRP HE1 . . . . . . . . . . 285 . 26802 1 2 2 1 . . 129.934 . . 1 . 1 1 8 TRP NE1 . . . . . . . . . . 286 . 26802 1 3 1 1 . . 9.061 . . 1 . 1 1 7 LYS H . . . . . . . . . . 89 . 26802 1 3 2 1 . . 133.707 . . 1 . 1 1 7 LYS N . . . . . . . . . . 90 . 26802 1 4 1 1 . . 8.383 . . 1 . 1 1 28 PHE H . . . . . . . . . . 95 . 26802 1 4 2 1 . . 129.893 . . 1 . 1 1 28 PHE N . . . . . . . . . . 96 . 26802 1 5 1 1 . . 8.089 . . 1 . 1 1 16 GLY H . . . . . . . . . . 147 . 26802 1 5 2 1 . . 105.684 . . 1 . 1 1 16 GLY N . . . . . . . . . . 148 . 26802 1 6 1 1 . . 6.070 . . 1 . 1 1 42 LEU H . . . . . . . . . . 83 . 26802 1 6 2 1 . . 119.121 . . 1 . 1 1 42 LEU N . . . . . . . . . . 84 . 26802 1 7 1 1 . . 7.475 . . 1 . 1 1 34 ILE H . . . . . . . . . . 53 . 26802 1 7 2 1 . . 121.461 . . 1 . 1 1 34 ILE N . . . . . . . . . . 54 . 26802 1 8 1 1 . . 8.289 . . 1 . 1 1 64 VAL H . . . . . . . . . . 77 . 26802 1 8 2 1 . . 119.143 . . 1 . 1 1 64 VAL N . . . . . . . . . . 78 . 26802 1 9 1 1 . . 8.789 . . 1 . 1 1 35 GLN H . . . . . . . . . . 75 . 26802 1 9 2 1 . . 127.627 . . 1 . 1 1 35 GLN N . . . . . . . . . . 76 . 26802 1 10 1 1 . . 8.629 . . 1 . 1 1 56 ALA H . . . . . . . . . . 181 . 26802 1 10 2 1 . . 123.692 . . 1 . 1 1 56 ALA N . . . . . . . . . . 182 . 26802 1 11 1 1 . . 9.445 . . 1 . 1 1 63 GLN H . . . . . . . . . . 3 . 26802 1 11 2 1 . . 118.783 . . 1 . 1 1 63 GLN N . . . . . . . . . . 4 . 26802 1 12 1 1 . . 7.704 . . 1 . 1 1 29 VAL H . . . . . . . . . . 157 . 26802 1 12 2 1 . . 124.218 . . 1 . 1 1 29 VAL N . . . . . . . . . . 158 . 26802 1 13 1 1 . . 8.198 . . 1 . 1 1 10 ASN H . . . . . . . . . . 101 . 26802 1 13 2 1 . . 127.244 . . 1 . 1 1 10 ASN N . . . . . . . . . . 102 . 26802 1 14 1 1 . . 6.655 . . 1 . 1 1 15 PHE H . . . . . . . . . . 17 . 26802 1 14 2 1 . . 112.689 . . 1 . 1 1 15 PHE N . . . . . . . . . . 18 . 26802 1 15 1 1 . . 8.810 . . 1 . 1 1 4 GLY H . . . . . . . . . . 179 . 26802 1 15 2 1 . . 108.201 . . 1 . 1 1 4 GLY N . . . . . . . . . . 180 . 26802 1 16 1 1 . . 8.634 . . 1 . 1 1 68 GLY H . . . . . . . . . . 167 . 26802 1 16 2 1 . . 110.691 . . 1 . 1 1 68 GLY N . . . . . . . . . . 168 . 26802 1 17 1 1 . . 7.954 . . 1 . 1 1 55 GLY H . . . . . . . . . . 254 . 26802 1 17 2 1 . . 112.627 . . 1 . 1 1 55 GLY N . . . . . . . . . . 253 . 26802 1 18 1 1 . . 7.820 . . 1 . 1 1 23 GLY H . . . . . . . . . . 21 . 26802 1 18 2 1 . . 107.453 . . 1 . 1 1 23 GLY N . . . . . . . . . . 22 . 26802 1 19 1 1 . . 8.647 . . 1 . 1 1 48 VAL H . . . . . . . . . . 151 . 26802 1 19 2 1 . . 114.952 . . 1 . 1 1 48 VAL N . . . . . . . . . . 152 . 26802 1 20 1 1 . . 7.578 . . 1 . 1 1 13 LYS H . . . . . . . . . . 119 . 26802 1 20 2 1 . . 116.119 . . 1 . 1 1 13 LYS N . . . . . . . . . . 120 . 26802 1 21 1 1 . . 8.975 . . 1 . 1 1 11 ALA H . . . . . . . . . . 123 . 26802 1 21 2 1 . . 128.678 . . 1 . 1 1 11 ALA N . . . . . . . . . . 124 . 26802 1 22 1 1 . . 8.965 . . 1 . 1 1 30 HIS H . . . . . . . . . . 85 . 26802 1 22 2 1 . . 127.770 . . 1 . 1 1 30 HIS N . . . . . . . . . . 86 . 26802 1 23 1 1 . . 9.133 . . 1 . 1 1 6 VAL H . . . . . . . . . . 63 . 26802 1 23 2 1 . . 127.215 . . 1 . 1 1 6 VAL N . . . . . . . . . . 64 . 26802 1 24 1 1 . . 8.843 . . 1 . 1 1 47 LYS H . . . . . . . . . . 227 . 26802 1 24 2 1 . . 125.429 . . 1 . 1 1 47 LYS N . . . . . . . . . . 226 . 26802 1 25 1 1 . . 9.196 . . 1 . 1 1 21 ASP H . . . . . . . . . . 29 . 26802 1 25 2 1 . . 125.241 . . 1 . 1 1 21 ASP N . . . . . . . . . . 30 . 26802 1 26 1 1 . . 8.865 . . 1 . 1 1 66 ALA H . . . . . . . . . . 43 . 26802 1 26 2 1 . . 125.236 . . 1 . 1 1 66 ALA N . . . . . . . . . . 44 . 26802 1 27 1 1 . . 9.011 . . 1 . 1 1 61 ALA H . . . . . . . . . . 31 . 26802 1 27 2 1 . . 124.757 . . 1 . 1 1 61 ALA N . . . . . . . . . . 32 . 26802 1 28 1 1 . . 8.137 . . 1 . 1 1 40 ARG H . . . . . . . . . . 33 . 26802 1 28 2 1 . . 123.559 . . 1 . 1 1 40 ARG N . . . . . . . . . . 34 . 26802 1 29 1 1 . . 8.203 . . 1 . 1 1 67 LEU H . . . . . . . . . . 177 . 26802 1 29 2 1 . . 123.370 . . 1 . 1 1 67 LEU N . . . . . . . . . . 178 . 26802 1 30 1 1 . . 9.099 . . 1 . 1 1 65 HIS H . . . . . . . . . . 135 . 26802 1 30 2 1 . . 123.198 . . 1 . 1 1 65 HIS N . . . . . . . . . . 136 . 26802 1 31 1 1 . . 8.255 . . 1 . 1 1 31 TYR H . . . . . . . . . . 145 . 26802 1 31 2 1 . . 123.106 . . 1 . 1 1 31 TYR N . . . . . . . . . . 146 . 26802 1 32 1 1 . . 8.866 . . 1 . 1 1 52 ILE H . . . . . . . . . . 159 . 26802 1 32 2 1 . . 122.656 . . 1 . 1 1 52 ILE N . . . . . . . . . . 160 . 26802 1 33 1 1 . . 8.068 . . 1 . 1 1 72 LEU H . . . . . . . . . . 163 . 26802 1 33 2 1 . . 122.083 . . 1 . 1 1 72 LEU N . . . . . . . . . . 164 . 26802 1 34 1 1 . . 8.248 . . 1 . 1 1 75 GLN H . . . . . . . . . . 175 . 26802 1 34 2 1 . . 122.007 . . 1 . 1 1 75 GLN N . . . . . . . . . . 176 . 26802 1 35 1 1 . . 9.385 . . 1 . 1 1 18 ILE H . . . . . . . . . . 183 . 26802 1 35 2 1 . . 121.865 . . 1 . 1 1 18 ILE N . . . . . . . . . . 184 . 26802 1 36 1 1 . . 8.019 . . 1 . 1 1 74 PHE H . . . . . . . . . . 143 . 26802 1 36 2 1 . . 121.310 . . 1 . 1 1 74 PHE N . . . . . . . . . . 144 . 26802 1 37 1 1 . . 8.682 . . 1 . 1 1 44 GLU H . . . . . . . . . . 234 . 26802 1 37 2 1 . . 121.223 . . 1 . 1 1 44 GLU N . . . . . . . . . . 233 . 26802 1 38 1 1 . . 8.164 . . 1 . 1 1 39 PHE H . . . . . . . . . . 79 . 26802 1 38 2 1 . . 121.249 . . 1 . 1 1 39 PHE N . . . . . . . . . . 80 . 26802 1 39 1 1 . . 8.721 . . 1 . 1 1 49 GLU H . . . . . . . . . . 69 . 26802 1 39 2 1 . . 121.182 . . 1 . 1 1 49 GLU N . . . . . . . . . . 70 . 26802 1 40 1 1 . . 8.547 . . 1 . 1 1 54 GLU H . . . . . . . . . . 251 . 26802 1 40 2 1 . . 121.169 . . 1 . 1 1 54 GLU N . . . . . . . . . . 250 . 26802 1 41 1 1 . . 7.862 . . 1 . 1 1 46 GLN H . . . . . . . . . . 1 . 26802 1 41 2 1 . . 120.876 . . 1 . 1 1 46 GLN N . . . . . . . . . . 2 . 26802 1 42 1 1 . . 9.097 . . 1 . 1 1 9 PHE H . . . . . . . . . . 129 . 26802 1 42 2 1 . . 120.837 . . 1 . 1 1 9 PHE N . . . . . . . . . . 130 . 26802 1 43 1 1 . . 8.578 . . 1 . 1 1 70 GLU H . . . . . . . . . . 11 . 26802 1 43 2 1 . . 120.738 . . 1 . 1 1 70 GLU N . . . . . . . . . . 12 . 26802 1 44 1 1 . . 7.786 . . 1 . 1 1 33 GLU H . . . . . . . . . . 23 . 26802 1 44 2 1 . . 120.171 . . 1 . 1 1 33 GLU N . . . . . . . . . . 24 . 26802 1 45 1 1 . . 9.339 . . 1 . 1 1 27 VAL H . . . . . . . . . . 217 . 26802 1 45 2 1 . . 119.924 . . 1 . 1 1 27 VAL N . . . . . . . . . . 216 . 26802 1 46 1 1 . . 7.856 . . 1 . 1 1 25 ALA H . . . . . . . . . . 41 . 26802 1 46 2 1 . . 119.689 . . 1 . 1 1 25 ALA N . . . . . . . . . . 42 . 26802 1 47 1 1 . . 8.021 . . 1 . 1 1 73 TYR H . . . . . . . . . . 65 . 26802 1 47 2 1 . . 119.652 . . 1 . 1 1 73 TYR N . . . . . . . . . . 66 . 26802 1 48 1 1 . . 8.833 . . 1 . 1 1 60 GLN H . . . . . . . . . . 49 . 26802 1 48 2 1 . . 119.566 . . 1 . 1 1 60 GLN N . . . . . . . . . . 50 . 26802 1 49 1 1 . . 9.293 . . 1 . 1 1 62 GLN H . . . . . . . . . . 5 . 26802 1 49 2 1 . . 118.747 . . 1 . 1 1 62 GLN N . . . . . . . . . . 6 . 26802 1 50 1 1 . . 8.787 . . 1 . 1 1 51 GLU H . . . . . . . . . . 27 . 26802 1 50 2 1 . . 118.356 . . 1 . 1 1 51 GLU N . . . . . . . . . . 28 . 26802 1 51 1 1 . . 8.387 . . 1 . 1 1 50 PHE H . . . . . . . . . . 55 . 26802 1 51 2 1 . . 118.094 . . 1 . 1 1 50 PHE N . . . . . . . . . . 56 . 26802 1 52 1 1 . . 8.059 . . 1 . 1 1 43 GLU H . . . . . . . . . . 236 . 26802 1 52 2 1 . . 118.076 . . 1 . 1 1 43 GLU N . . . . . . . . . . 237 . 26802 1 53 1 1 . . 8.124 . . 1 . 1 1 12 GLU H . . . . . . . . . . 51 . 26802 1 53 2 1 . . 118.035 . . 1 . 1 1 12 GLU N . . . . . . . . . . 52 . 26802 1 54 1 1 . . 8.368 . . 1 . 1 1 37 ASN H . . . . . . . . . . 244 . 26802 1 54 2 1 . . 117.861 . . 1 . 1 1 37 ASN N . . . . . . . . . . 245 . 26802 1 55 1 1 . . 8.019 . . 1 . 1 1 26 ASP H . . . . . . . . . . 59 . 26802 1 55 2 1 . . 117.552 . . 1 . 1 1 26 ASP N . . . . . . . . . . 60 . 26802 1 56 1 1 . . 8.040 . . 1 . 1 1 22 ASP H . . . . . . . . . . 61 . 26802 1 56 2 1 . . 116.689 . . 1 . 1 1 22 ASP N . . . . . . . . . . 62 . 26802 1 57 1 1 . . 8.986 . . 1 . 1 1 45 ASN H . . . . . . . . . . 231 . 26802 1 57 2 1 . . 116.481 . . 1 . 1 1 45 ASN N . . . . . . . . . . 230 . 26802 1 58 1 1 . . 8.405 . . 1 . 1 1 3 GLN H . . . . . . . . . . 87 . 26802 1 58 2 1 . . 116.432 . . 1 . 1 1 3 GLN N . . . . . . . . . . 88 . 26802 1 59 1 1 . . 8.986 . . 1 . 1 1 53 GLY H . . . . . . . . . . 248 . 26802 1 59 2 1 . . 116.052 . . 1 . 1 1 53 GLY N . . . . . . . . . . 247 . 26802 1 60 1 1 . . 7.973 . . 1 . 1 1 24 SER H . . . . . . . . . . 127 . 26802 1 60 2 1 . . 115.827 . . 1 . 1 1 24 SER N . . . . . . . . . . 128 . 26802 1 61 1 1 . . 8.334 . . 1 . 1 1 5 THR H . . . . . . . . . . 45 . 26802 1 61 2 1 . . 115.630 . . 1 . 1 1 5 THR N . . . . . . . . . . 46 . 26802 1 62 1 1 . . 8.362 . . 1 . 1 1 57 LYS H . . . . . . . . . . 171 . 26802 1 62 2 1 . . 114.804 . . 1 . 1 1 57 LYS N . . . . . . . . . . 172 . 26802 1 63 1 1 . . 7.667 . . 1 . 1 1 17 PHE H . . . . . . . . . . 165 . 26802 1 63 2 1 . . 114.684 . . 1 . 1 1 17 PHE N . . . . . . . . . . 166 . 26802 1 64 1 1 . . 7.561 . . 1 . 1 1 41 THR H . . . . . . . . . . 113 . 26802 1 64 2 1 . . 112.096 . . 1 . 1 1 41 THR N . . . . . . . . . . 114 . 26802 1 65 1 1 . . 7.373 . . 1 . 1 1 8 TRP H . . . . . . . . . . 131 . 26802 1 65 2 1 . . 112.062 . . 1 . 1 1 8 TRP N . . . . . . . . . . 132 . 26802 1 66 1 1 . . 8.334 . . 1 . 1 1 36 GLY H . . . . . . . . . . 125 . 26802 1 66 2 1 . . 109.832 . . 1 . 1 1 36 GLY N . . . . . . . . . . 126 . 26802 1 67 1 1 . . 8.418 . . 1 . 1 1 38 GLY H . . . . . . . . . . 155 . 26802 1 67 2 1 . . 109.394 . . 1 . 1 1 38 GLY N . . . . . . . . . . 156 . 26802 1 68 1 1 . . 8.315 . . 1 . 1 1 69 GLY H . . . . . . . . . . 169 . 26802 1 68 2 1 . . 108.664 . . 1 . 1 1 69 GLY N . . . . . . . . . . 170 . 26802 1 69 1 1 . . 7.817 . . 1 . 1 1 76 GLY H . . . . . . . . . . 173 . 26802 1 69 2 1 . . 108.661 . . 1 . 1 1 76 GLY N . . . . . . . . . . 174 . 26802 1 70 1 1 . . 7.427 . . 1 . 1 1 58 GLY H . . . . . . . . . . 161 . 26802 1 70 2 1 . . 108.787 . . 1 . 1 1 58 GLY N . . . . . . . . . . 162 . 26802 1 71 1 1 . . 8.192 . . 1 . 1 1 14 GLY H . . . . . . . . . . 9 . 26802 1 71 2 1 . . 107.888 . . 1 . 1 1 14 GLY N . . . . . . . . . . 10 . 26802 1 72 1 1 . . 8.476 . . 1 . 1 1 71 ASN H . . . . . . . . . . 91 . 26802 1 72 2 1 . . 119.046 . . 1 . 1 1 71 ASN N . . . . . . . . . . 92 . 26802 1 73 1 1 . . 7.806 . . 1 . 1 1 32 SER H . . . . . . . . . . 857 . 26802 1 73 2 1 . . 117.360 . . 1 . 1 1 32 SER N . . . . . . . . . . 856 . 26802 1 74 1 1 . . 7.041 . . 1 . 1 1 45 ASN HD22 . . . . . . . . . . 823 . 26802 1 74 2 1 . . 114.250 . . 1 . 1 1 45 ASN ND2 . . . . . . . . . . 821 . 26802 1 75 1 1 . . 7.646 . . 1 . 1 1 45 ASN HD21 . . . . . . . . . . 822 . 26802 1 75 2 1 . . 114.252 . . 1 . 1 1 45 ASN ND2 . . . . . . . . . . 821 . 26802 1 76 1 1 . . 7.807 . . 1 . 1 1 63 GLN HE21 . . . . . . . . . . 921 . 26802 1 76 2 1 . . 113.318 . . 1 . 1 1 63 GLN NE2 . . . . . . . . . . 920 . 26802 1 77 1 2 . . 7.721 . . 1 . 1 1 3 GLN HE21 . . . . . . . . . . 827 . 26802 1 77 2 1 . . 111.553 . . 1 . 1 1 3 GLN NE2 . . . . . . . . . . 828 . 26802 1 78 1 1 . . 7.527 . . 1 . 1 1 10 ASN HD22 . . . . . . . . . . 839 . 26802 1 78 2 2 . . 112.948 . . 1 . 1 1 10 ASN ND2 . . . . . . . . . . 838 . 26802 1 79 1 2 . . 7.317 . . 1 . 1 1 62 GLN HE21 . . . . . . . . . . 824 . 26802 1 79 2 2 . . 110.282 . . 1 . 1 1 62 GLN NE2 . . . . . . . . . . 825 . 26802 1 80 1 1 . . 7.219 . . 1 . 1 1 35 GLN HE21 . . . . . . . . . . 843 . 26802 1 80 2 2 . . 112.459 . . 1 . 1 1 35 GLN NE2 . . . . . . . . . . 844 . 26802 1 81 1 1 . . 7.242 . . 1 . 1 1 10 ASN HD21 . . . . . . . . . . 837 . 26802 1 81 2 1 . . 112.944 . . 1 . 1 1 10 ASN ND2 . . . . . . . . . . 838 . 26802 1 82 1 2 . . 7.443 . . 1 . 1 1 75 GLN HE21 . . . . . . . . . . 840 . 26802 1 82 2 3 . . 112.300 . . 1 . 1 1 75 GLN NE2 . . . . . . . . . . 841 . 26802 1 83 1 2 . . 6.829 . . 1 . 1 1 62 GLN HE22 . . . . . . . . . . 826 . 26802 1 83 2 3 . . 110.282 . . 1 . 1 1 62 GLN NE2 . . . . . . . . . . 825 . 26802 1 84 1 1 . . 6.743 . . 1 . 1 1 3 GLN HE22 . . . . . . . . . . 829 . 26802 1 84 2 1 . . 111.555 . . 1 . 1 1 3 GLN NE2 . . . . . . . . . . 828 . 26802 1 85 1 2 . . 6.841 . . 1 . 1 1 75 GLN HE22 . . . . . . . . . . 842 . 26802 1 85 2 3 . . 112.301 . . 1 . 1 1 75 GLN NE2 . . . . . . . . . . 841 . 26802 1 86 1 1 . . 7.614 . . 1 . 1 1 60 GLN HE21 . . . . . . . . . . 923 . 26802 1 86 2 1 . . 112.319 . . 1 . 1 1 60 GLN NE2 . . . . . . . . . . 924 . 26802 1 87 1 1 . . 6.788 . . 1 . 1 1 63 GLN HE22 . . . . . . . . . . 922 . 26802 1 87 2 1 . . 113.320 . . 1 . 1 1 63 GLN NE2 . . . . . . . . . . 920 . 26802 1 88 1 1 . . 6.901 . . 1 . 1 1 35 GLN HE22 . . . . . . . . . . 845 . 26802 1 88 2 2 . . 112.459 . . 1 . 1 1 35 GLN NE2 . . . . . . . . . . 844 . 26802 1 89 1 1 . . 7.564 . . 1 . 1 1 37 ASN HD21 . . . . . . . . . . 849 . 26802 1 89 2 1 . . 112.974 . . 1 . 1 1 37 ASN ND2 . . . . . . . . . . 850 . 26802 1 90 1 1 . . 6.925 . . 1 . 1 1 37 ASN HD22 . . . . . . . . . . 851 . 26802 1 90 2 2 . . 112.974 . . 1 . 1 1 37 ASN ND2 . . . . . . . . . . 850 . 26802 1 91 1 1 . . 7.583 . . 1 . 1 1 71 ASN HD21 . . . . . . . . . . 846 . 26802 1 91 2 1 . . 113.053 . . 1 . 1 1 71 ASN ND2 . . . . . . . . . . 847 . 26802 1 92 1 1 . . 6.918 . . 1 . 1 1 71 ASN HD22 . . . . . . . . . . 848 . 26802 1 92 2 2 . . 113.050 . . 1 . 1 1 71 ASN ND2 . . . . . . . . . . 847 . 26802 1 93 1 1 . . 7.363 . . 1 . 1 1 46 GLN HE21 . . . . . . . . . . 890 . 26802 1 93 2 1 . . 109.880 . . 1 . 1 1 46 GLN NE2 . . . . . . . . . . 889 . 26802 1 94 1 1 . . 6.646 . . 1 . 1 1 46 GLN HE22 . . . . . . . . . . 891 . 26802 1 94 2 1 . . 109.877 . . 1 . 1 1 46 GLN NE2 . . . . . . . . . . 889 . 26802 1 95 1 1 . . 6.896 . . 1 . 1 1 60 GLN HE22 . . . . . . . . . . 925 . 26802 1 95 2 2 . . 112.318 . . 1 . 1 1 60 GLN NE2 . . . . . . . . . . 924 . 26802 1 stop_ save_ save_peak_list_1_2 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode peak_list_1_2 _Spectral_peak_list.Entry_ID 26802 _Spectral_peak_list.ID 2 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $CspA _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $CspA_1 _Spectral_peak_list.Chem_shift_reference_ID . _Spectral_peak_list.Chem_shift_reference_label . _Spectral_peak_list.Experiment_ID 2 _Spectral_peak_list.Experiment_name '2D 1H-13C HSQC/HMQC' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details 'Default list' _Spectral_peak_list.Text_data_format . _Spectral_peak_list.Text_data . loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . H 1 1H . . 4496.958 . . . . . . . 26802 2 2 . . C 13 13C . . 11160.714 . . . . . . . 26802 2 stop_ loop_ _Peak.ID _Peak.Figure_of_merit _Peak.Restraint _Peak.Details _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 1.0 . . 26802 2 2 1.0 . . 26802 2 3 1.0 . . 26802 2 4 1.0 . . 26802 2 5 1.0 . . 26802 2 6 1.0 . . 26802 2 7 1.0 . . 26802 2 8 1.0 . . 26802 2 9 1.0 . . 26802 2 10 1.0 . . 26802 2 11 1.0 . . 26802 2 12 1.0 . . 26802 2 13 1.0 . . 26802 2 14 1.0 . . 26802 2 15 1.0 . . 26802 2 16 1.0 . . 26802 2 17 1.0 . . 26802 2 18 1.0 . . 26802 2 19 1.0 . . 26802 2 20 1.0 . . 26802 2 21 1.0 . . 26802 2 22 1.0 . . 26802 2 23 1.0 . . 26802 2 24 1.0 . . 26802 2 25 1.0 . . 26802 2 26 1.0 . . 26802 2 27 1.0 . . 26802 2 28 1.0 . . 26802 2 29 1.0 . . 26802 2 30 1.0 . . 26802 2 31 1.0 . . 26802 2 32 1.0 . . 26802 2 33 1.0 . . 26802 2 34 1.0 . . 26802 2 35 1.0 . . 26802 2 36 1.0 . . 26802 2 37 1.0 . . 26802 2 38 1.0 . . 26802 2 39 1.0 . . 26802 2 40 1.0 . . 26802 2 41 1.0 . . 26802 2 42 1.0 . . 26802 2 43 1.0 . . 26802 2 44 1.0 . . 26802 2 45 1.0 . . 26802 2 46 1.0 . . 26802 2 47 1.0 . . 26802 2 48 1.0 . . 26802 2 49 1.0 . . 26802 2 50 1.0 . . 26802 2 51 1.0 . . 26802 2 52 1.0 . . 26802 2 53 1.0 . . 26802 2 54 1.0 . . 26802 2 55 1.0 . . 26802 2 56 1.0 . . 26802 2 57 1.0 . . 26802 2 58 1.0 . . 26802 2 59 1.0 . . 26802 2 60 1.0 . . 26802 2 61 1.0 . . 26802 2 62 1.0 . . 26802 2 63 1.0 . . 26802 2 64 1.0 . . 26802 2 65 1.0 . . 26802 2 66 1.0 . . 26802 2 67 1.0 . . 26802 2 68 1.0 . . 26802 2 69 1.0 . . 26802 2 70 1.0 . . 26802 2 71 1.0 . . 26802 2 72 1.0 . . 26802 2 73 1.0 . . 26802 2 74 1.0 . . 26802 2 75 1.0 . . 26802 2 76 1.0 . . 26802 2 77 1.0 . . 26802 2 78 1.0 . . 26802 2 79 1.0 . . 26802 2 80 1.0 . . 26802 2 81 1.0 . . 26802 2 82 1.0 . . 26802 2 83 1.0 . . 26802 2 84 1.0 . . 26802 2 85 1.0 . . 26802 2 86 1.0 . . 26802 2 87 1.0 . . 26802 2 88 1.0 . . 26802 2 89 1.0 . . 26802 2 90 1.0 . . 26802 2 91 1.0 . . 26802 2 92 1.0 . . 26802 2 93 1.0 . . 26802 2 94 1.0 . . 26802 2 95 1.0 . . 26802 2 96 1.0 . . 26802 2 97 1.0 . . 26802 2 98 1.0 . . 26802 2 99 1.0 . . 26802 2 100 1.0 . . 26802 2 101 1.0 . . 26802 2 102 1.0 . . 26802 2 103 1.0 . . 26802 2 104 1.0 . . 26802 2 105 1.0 . . 26802 2 106 1.0 . . 26802 2 107 1.0 . . 26802 2 108 1.0 . . 26802 2 109 1.0 . . 26802 2 110 1.0 . . 26802 2 111 1.0 . . 26802 2 112 1.0 . . 26802 2 113 1.0 . . 26802 2 114 1.0 . . 26802 2 115 1.0 . . 26802 2 116 1.0 . . 26802 2 117 1.0 . . 26802 2 118 1.0 . . 26802 2 119 1.0 . . 26802 2 120 1.0 . . 26802 2 121 1.0 . . 26802 2 122 1.0 . . 26802 2 123 1.0 . . 26802 2 124 1.0 . . 26802 2 125 1.0 . . 26802 2 126 1.0 . . 26802 2 127 1.0 . . 26802 2 128 1.0 . . 26802 2 129 1.0 . . 26802 2 130 1.0 . . 26802 2 131 1.0 . . 26802 2 132 1.0 . . 26802 2 133 1.0 . . 26802 2 134 1.0 . . 26802 2 135 1.0 . . 26802 2 136 1.0 . . 26802 2 137 1.0 . . 26802 2 138 1.0 . . 26802 2 139 1.0 . . 26802 2 140 1.0 . . 26802 2 141 1.0 . . 26802 2 142 1.0 . . 26802 2 143 1.0 . . 26802 2 144 1.0 . . 26802 2 145 1.0 . . 26802 2 146 1.0 . . 26802 2 147 1.0 . . 26802 2 148 1.0 . . 26802 2 149 1.0 . . 26802 2 150 1.0 . . 26802 2 151 1.0 . . 26802 2 152 1.0 . . 26802 2 153 1.0 . . 26802 2 154 1.0 . . 26802 2 155 1.0 . . 26802 2 156 1.0 . . 26802 2 157 1.0 . . 26802 2 158 1.0 . . 26802 2 159 1.0 . . 26802 2 160 1.0 . . 26802 2 161 1.0 . . 26802 2 162 1.0 . . 26802 2 163 1.0 . . 26802 2 164 1.0 . . 26802 2 165 1.0 . . 26802 2 166 1.0 . . 26802 2 167 1.0 . . 26802 2 168 1.0 . . 26802 2 169 1.0 . . 26802 2 170 1.0 . . 26802 2 171 1.0 . . 26802 2 172 1.0 . . 26802 2 173 1.0 . . 26802 2 174 1.0 . . 26802 2 175 1.0 . . 26802 2 176 1.0 . . 26802 2 177 1.0 . . 26802 2 178 1.0 . . 26802 2 179 1.0 . . 26802 2 180 1.0 . . 26802 2 181 1.0 . . 26802 2 182 1.0 . . 26802 2 183 1.0 . . 26802 2 184 1.0 . . 26802 2 185 1.0 . . 26802 2 186 1.0 . . 26802 2 187 1.0 . . 26802 2 188 1.0 . . 26802 2 189 1.0 . . 26802 2 190 1.0 . . 26802 2 191 1.0 . . 26802 2 192 1.0 . . 26802 2 193 1.0 . . 26802 2 194 1.0 . . 26802 2 195 1.0 . . 26802 2 196 1.0 . . 26802 2 197 1.0 . . 26802 2 198 1.0 . . 26802 2 199 1.0 . . 26802 2 200 1.0 . . 26802 2 201 1.0 . . 26802 2 202 1.0 . . 26802 2 203 1.0 . . 26802 2 204 1.0 . . 26802 2 205 1.0 . . 26802 2 206 1.0 . . 26802 2 207 1.0 . . 26802 2 208 1.0 . . 26802 2 209 1.0 . . 26802 2 210 1.0 . . 26802 2 211 1.0 . . 26802 2 212 1.0 . . 26802 2 213 1.0 . . 26802 2 214 1.0 . . 26802 2 215 1.0 . . 26802 2 216 1.0 . . 26802 2 217 1.0 . . 26802 2 218 1.0 . . 26802 2 219 1.0 . . 26802 2 220 1.0 . . 26802 2 221 1.0 . . 26802 2 222 1.0 . . 26802 2 223 1.0 . . 26802 2 224 1.0 . . 26802 2 225 1.0 . . 26802 2 226 1.0 . . 26802 2 227 1.0 . . 26802 2 228 1.0 . . 26802 2 229 1.0 . . 26802 2 230 1.0 . . 26802 2 231 1.0 . . 26802 2 232 1.0 . . 26802 2 233 1.0 . . 26802 2 234 1.0 . . 26802 2 235 1.0 . . 26802 2 236 1.0 . . 26802 2 237 1.0 . . 26802 2 238 1.0 . . 26802 2 239 1.0 . . 26802 2 240 1.0 . . 26802 2 241 1.0 . . 26802 2 242 1.0 . . 26802 2 243 1.0 . . 26802 2 244 1.0 . . 26802 2 245 1.0 . . 26802 2 246 1.0 . . 26802 2 247 1.0 . . 26802 2 248 1.0 . . 26802 2 249 1.0 . . 26802 2 250 1.0 . . 26802 2 251 1.0 . . 26802 2 252 1.0 . . 26802 2 253 1.0 . . 26802 2 254 1.0 . . 26802 2 255 1.0 . . 26802 2 256 1.0 . . 26802 2 257 1.0 . . 26802 2 258 1.0 . . 26802 2 259 1.0 . . 26802 2 260 1.0 . . 26802 2 261 1.0 . . 26802 2 262 1.0 . . 26802 2 263 1.0 . . 26802 2 264 1.0 . . 26802 2 265 1.0 . . 26802 2 266 1.0 . . 26802 2 267 1.0 . . 26802 2 268 1.0 . . 26802 2 269 1.0 . . 26802 2 270 1.0 . . 26802 2 271 1.0 . . 26802 2 stop_ loop_ _Peak_general_char.Peak_ID _Peak_general_char.Intensity_val _Peak_general_char.Intensity_val_err _Peak_general_char.Measurement_method _Peak_general_char.Entry_ID _Peak_general_char.Spectral_peak_list_ID 1 228427760.0000 . height 26802 2 1 1797616112.0000 . volume 26802 2 2 203514336.0000 . height 26802 2 2 1600214848.0000 . volume 26802 2 3 -117640896.0000 . height 26802 2 3 -922969904.0000 . volume 26802 2 4 -130897000.0000 . height 26802 2 4 -1020536376.0000 . volume 26802 2 5 1989049728.0000 . height 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_Peak_char.Derivation_method_ID _Peak_char.Entry_ID _Peak_char.Spectral_peak_list_ID 1 1 4.167 . 64.87114812250 . . . . . . . . . . 1 26802 2 1 2 59.393 . 38.94591338220 . . . . . . . . . . 1 26802 2 2 1 0.969 . 32.34037219940 . . . . . . . . . . 1 26802 2 2 2 41.984 . 39.18872247580 . . . . . . . . . . 1 26802 2 3 1 0.340 . 36.86124741920 . . . . . . . . . . 1 26802 2 3 2 27.947 . 38.39576784680 . . . . . . . . . . 1 26802 2 4 1 1.144 . 32.69120604710 . . . . . . . . . . 1 26802 2 4 2 27.949 . 37.89551459100 . . . . . . . . . . 1 26802 2 5 1 0.108 . 15.39301347950 . . . . . . . . . . 1 26802 2 5 2 17.670 . 37.90017120370 . . . . . . . . . . 1 26802 2 6 1 -0.091 . 19.99353283560 . . . . . . . . . . 1 26802 2 6 2 14.053 . 37.79173864960 . . . . . . . . . . 1 26802 2 7 1 3.564 . 27.97393238370 . . . . . . . . . . 1 26802 2 7 2 64.738 . 38.36566617150 . . . . . . . . . . 1 26802 2 8 1 2.418 . 35.56438967320 . . . . . . . . . . 1 26802 2 8 2 31.650 . 36.63490299550 . . . . . . . . . . 1 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38.56274067560 . . . . . . . . . . 1 26802 2 86 1 5.129 . 28.88869809960 . . . . . . . . . . 1 26802 2 86 2 58.638 . 37.62709412720 . . . . . . . . . . 1 26802 2 87 1 5.241 . 27.98720640640 . . . . . . . . . . 1 26802 2 87 2 56.806 . 39.32442947600 . . . . . . . . . . 1 26802 2 88 1 5.039 . 23.11007354480 . . . . . . . . . . 1 26802 2 88 2 56.207 . 38.01359298580 . . . . . . . . . . 1 26802 2 89 1 4.275 . 28.08026729680 . . . . . . . . . . 1 26802 2 89 2 56.367 . 40.37549349760 . . . . . . . . . . 1 26802 2 90 1 5.146 . 29.22468787880 . . . . . . . . . . 1 26802 2 90 2 55.192 . 37.98066408130 . . . . . . . . . . 1 26802 2 91 1 5.462 . 30.91855308910 . . . . . . . . . . 1 26802 2 91 2 54.250 . 38.49488717540 . . . . . . . . . . 1 26802 2 92 1 5.397 . 29.83829028360 . . . . . . . . . . 1 26802 2 92 2 54.130 . 40.16561330850 . . . . . . . . . . 1 26802 2 93 1 5.275 . 24.83384098900 . . . . . . . . . . 1 26802 2 93 2 53.647 . 37.64771626940 . . . . . . . . . . 1 26802 2 94 1 5.061 . 30.35626263230 . . . . . . . . . . 1 26802 2 94 2 53.679 . 38.60431757520 . . . . . . . . . . 1 26802 2 95 1 4.099 . 21.64279447490 . . . . . . . . . . 1 26802 2 95 2 52.941 . 37.79207126480 . . . . . . . . . . 1 26802 2 96 1 3.943 . 21.31808047840 . . . . . . . . . . 1 26802 2 96 2 51.580 . 38.22946024850 . . . . . . . . . . 1 26802 2 97 1 5.333 . 28.65290578210 . . . . . . . . . . 1 26802 2 97 2 48.624 . 38.84612882320 . . . . . . . . . . 1 26802 2 98 1 4.625 . 20.61584185740 . . . . . . . . . . 1 26802 2 98 2 53.413 . 42.36519760430 . . . . . . . . . . 1 26802 2 99 1 4.566 . 26.36706197820 . . . . . . . . . . 1 26802 2 99 2 54.009 . 37.26321310200 . . . . . . . . . . 1 26802 2 100 1 4.511 . 21.77803250200 . . . . . . . . . . 1 26802 2 100 2 53.766 . 41.67069707360 . . . . . . . . . . 1 26802 2 101 1 4.183 . 22.36758466140 . . . . . . . . . . 1 26802 2 101 2 55.568 . 39.34970823100 . . . . . . . . . . 1 26802 2 102 1 4.192 . 21.87287753530 . . . . . . . . . . 1 26802 2 102 2 56.073 . 39.50337645190 . . . . . . . . . . 1 26802 2 103 1 4.485 . 21.18691029700 . . . . . . . . . . 1 26802 2 103 2 56.647 . 37.69794116410 . . . . . . . . . . 1 26802 2 104 1 4.449 . 23.36242270780 . . . . . . . . . . 1 26802 2 104 2 56.279 . 42.23115368000 . . . . . . . . . . 1 26802 2 105 1 4.384 . 25.99653119360 . . . . . . . . . . 1 26802 2 105 2 58.115 . 43.57891045710 . . . . . . . . . . 1 26802 2 106 1 3.631 . 34.00476337000 . . . . . . . . . . 1 26802 2 106 2 62.599 . 39.07280607970 . . . . . . . . . . 1 26802 2 107 1 4.730 . 17.53683951350 . . . . . . . . . . 1 26802 2 107 2 61.249 . 36.91479868350 . . . . . . . . . . 1 26802 2 108 1 2.575 . 31.12501409830 . . . . . . . . . . 1 26802 2 108 2 45.295 . 38.82783498730 . . . . . . . . . . 1 26802 2 109 1 2.244 . 33.35661995990 . . . . . . . . . . 1 26802 2 109 2 45.295 . 38.96753337000 . . . . . . . . . . 1 26802 2 110 1 2.514 . 74.69335400500 . . . . . . . . . . 1 26802 2 110 2 39.061 . 38.41638998900 . . . . . . . . . . 1 26802 2 111 1 2.460 . 70.32391682940 . . . . . . . . . . 1 26802 2 111 2 39.063 . 38.00195145390 . . . . . . . . . . 1 26802 2 112 1 3.247 . 77.63419232760 . . . . . . . . . . 1 26802 2 112 2 31.432 . 42.76965768350 . . . . . . . . . . 1 26802 2 113 1 3.182 . 78.86753458860 . . . . . . . . . . 1 26802 2 113 2 31.433 . 41.86627480920 . . . . . . . . . . 1 26802 2 114 1 3.019 . 29.41823169380 . . . . . . . . . . 1 26802 2 114 2 38.991 . 35.47407595900 . . . . . . . . . . 1 26802 2 115 1 2.958 . 29.01801277240 . . . . . . . . . . 1 26802 2 115 2 38.989 . 36.10737529350 . . . . . . . . . . 1 26802 2 116 1 2.771 . 30.83798119850 . . . . . . . . . . 1 26802 2 116 2 38.730 . 40.28036555140 . . . . . . . . . . 1 26802 2 117 1 2.705 . 30.45731648260 . . . . . . . . . . 1 26802 2 117 2 38.737 . 39.55060780980 . . . . . . . . . . 1 26802 2 118 1 2.905 . 25.89105266910 . . . . . . . . . . 1 26802 2 118 2 38.600 . 40.86377260640 . . . . . . . . . . 1 26802 2 119 1 2.822 . 54.21196515190 . . . . . . . . . . 1 26802 2 119 2 38.607 . 40.70145639040 . . . . . . . . . . 1 26802 2 120 1 3.027 . 26.20420542000 . . . . . . . . . . 1 26802 2 120 2 39.512 . 39.24260613760 . . . . . . . . . . 1 26802 2 121 1 2.966 . 28.25439963780 . . . . . . . . . . 1 26802 2 121 2 39.516 . 39.25657597590 . . . . . . . . . . 1 26802 2 122 1 2.683 . 27.38702075580 . . . . . . . . . . 1 26802 2 122 2 40.153 . 45.02545394750 . . . . . . . . . . 1 26802 2 123 1 3.038 . 19.61343904540 . . . . . . . . . . 1 26802 2 123 2 41.446 . 38.08843140510 . . . . . . . . . . 1 26802 2 124 1 3.048 . 54.28233174540 . . . . . . . . . . 1 26802 2 124 2 42.302 . 37.33638844530 . . . . . . . . . . 1 26802 2 125 1 3.000 . 54.13531837560 . . . . . . . . . . 1 26802 2 125 2 42.301 . 37.63175074000 . . . . . . . . . . 1 26802 2 126 1 3.769 . 32.98037991820 . . . . . . . . . . 1 26802 2 126 2 44.300 . 39.83432857260 . . . . . . . . . . 1 26802 2 127 1 4.409 . 36.76247727170 . . . . . . . . . . 1 26802 2 127 2 44.301 . 40.68482563050 . . . . . . . . . . 1 26802 2 128 1 1.420 . 33.71145028750 . . . . . . . . . . 1 26802 2 128 2 28.655 . 37.25689341330 . . . . . . . . . . 1 26802 2 129 1 1.358 . 69.23758793820 . . . . . . . . . . 1 26802 2 129 2 28.655 . 37.55691232070 . . . . . . . . . . 1 26802 2 130 1 2.883 . 46.48719758960 . . . . . . . . . . 1 26802 2 130 2 45.254 . 38.95090261010 . . . . . . . . . . 1 26802 2 131 1 3.854 . 25.53736419290 . . . . . . . . . . 1 26802 2 131 2 71.542 . 38.04976488850 . . . . . . . . . . 1 26802 2 132 1 3.878 . 25.46128834230 . . . . . . . . . . 1 26802 2 132 2 70.287 . 37.88828021050 . . . . . . . . . . 1 26802 2 133 1 3.359 . 32.82894187420 . . . . . . . . . . 1 26802 2 133 2 30.798 . 78.20315458850 . . . . . . . . . . 1 26802 2 134 1 3.533 . 33.17049817900 . . . . . . . . . . 1 26802 2 134 2 30.757 . 80.40573242100 . . . . . . . . . . 1 26802 2 135 1 1.160 . 37.01625374890 . . . . . . . . . . 1 26802 2 135 2 33.805 . 38.44965150870 . . . . . . . . . . 1 26802 2 136 1 1.614 . 30.34698508950 . . . . . . . . . . 1 26802 2 136 2 33.888 . 39.54528596660 . . . . . . . . . . 1 26802 2 137 1 4.846 . 16.35095545200 . . . . . . . . . . 1 26802 2 137 2 55.247 . 37.10522088360 . . . . . . . . . . 1 26802 2 138 1 4.607 . 18.47529864630 . . . . . . . . . . 1 26802 2 138 2 58.033 . 32.50348963720 . . . . . . . . . . 1 26802 2 139 1 4.250 . 46.20858584400 . . . . . . . . . . 1 26802 2 139 2 55.683 . 40.33657751960 . . . . . . . . . . 1 26802 2 140 1 4.292 . 63.57871505080 . . . . . . . . . . 1 26802 2 140 2 55.728 . 42.57707348460 . . . . . . . . . . 1 26802 2 141 1 4.820 . 10.33082932280 . . . . . . . . . . 1 26802 2 141 2 52.935 . 43.68867347200 . . . . . . . . . . 1 26802 2 142 1 4.496 . 33.61089599710 . . . . . . . . . . 1 26802 2 142 2 58.132 . 98.45709176140 . . . . . . . . . . 1 26802 2 143 1 4.506 . 43.86921775500 . . . . . . . . . . 1 26802 2 143 2 57.821 . 42.12737773870 . . . . . . . . . . 1 26802 2 144 1 4.468 . 42.35348136560 . . . . . . . . . . 1 26802 2 144 2 57.936 . 42.38581974650 . . . . . . . . . . 1 26802 2 145 1 0.331 . 29.20570459900 . . . . . . . . . . 1 26802 2 145 2 14.385 . 38.18888119450 . . . . . . . . . . 1 26802 2 146 1 0.828 . 12.75762041080 . . . . . . . . . . 1 26802 2 146 2 23.689 . 43.96308100930 . . . . . . . . . . 1 26802 2 147 1 0.831 . 16.20715353930 . . . . . . . . . . 1 26802 2 147 2 23.968 . 93.87531742680 . . . . . . . . . . 1 26802 2 148 1 2.383 . 32.98980019240 . . . . . . . . . . 1 26802 2 148 2 42.295 . 38.79889746520 . . . . . . . . . . 1 26802 2 149 1 1.872 . 38.90887247140 . . . . . . . . . . 1 26802 2 149 2 33.891 . 41.37333908770 . . . . . . . . . . 1 26802 2 150 1 1.608 . 39.32536277540 . . . . . . . . . . 1 26802 2 150 2 28.984 . 49.66277502000 . . . . . . . . . . 1 26802 2 151 1 1.650 . 60.47359285570 . . . . . . . . . . 1 26802 2 151 2 28.921 . 43.61516551350 . . . . . . . . . . 1 26802 2 152 1 1.770 . 36.09163956460 . . . . . . . . . . 1 26802 2 152 2 29.001 . 54.99393139280 . . . . . . . . . . 1 26802 2 153 1 4.087 . 37.16940457020 . . . . . . . . . . 1 26802 2 153 2 46.363 . 36.23576475940 . . . . . . . . . . 1 26802 2 154 1 1.793 . 57.04746768130 . . . . . . . . . . 1 26802 2 154 2 28.798 . 85.95242344130 . . . . . . . . . . 1 26802 2 155 1 4.154 . 36.54238541120 . . . . . . . . . . 1 26802 2 155 2 45.894 . 38.47093888130 . . . . . . . . . . 1 26802 2 156 1 3.968 . 37.36409023660 . . . . . . . . . . 1 26802 2 156 2 45.881 . 33.55654935000 . . . . . . . . . . 1 26802 2 157 1 3.062 . 28.98861009850 . . . . . . . . . . 1 26802 2 157 2 40.436 . 36.38544159790 . . . . . . . . . . 1 26802 2 158 1 2.755 . 33.44882446170 . . . . . . . . . . 1 26802 2 158 2 40.450 . 46.41046362660 . . . . . . . . . . 1 26802 2 159 1 0.551 . 17.84970680160 . . . . . . . . . . 1 26802 2 159 2 22.918 . 42.89804714940 . . . . . . . . . . 1 26802 2 160 1 0.545 . 19.75517135240 . . . . . . . . . . 1 26802 2 160 2 22.808 . 53.90694493000 . . . . . . . . . . 1 26802 2 161 1 4.458 . 103.50140884800 . . . . . . . . . . 1 26802 2 161 2 55.859 . 111.56312835700 . . . . . . . . . . 1 26802 2 162 1 2.300 . 29.27564299820 . . . . . . . . . . 1 26802 2 162 2 35.682 . 43.85132230320 . . . . . . . . . . 1 26802 2 163 1 2.775 . 38.68078765100 . . . . . . . . . . 1 26802 2 163 2 35.649 . 38.86941188690 . . . . . . . . . . 1 26802 2 164 1 2.565 . 39.15208682300 . . . . . . . . . . 1 26802 2 164 2 30.379 . 35.46210181190 . . . . . . . . . . 1 26802 2 165 1 1.871 . 41.02615045990 . . . . . . . . . . 1 26802 2 165 2 30.374 . 48.03229532580 . . . . . . . . . . 1 26802 2 166 1 1.722 . 32.20020993810 . . . . . . . . . . 1 26802 2 166 2 29.764 . 39.47011493220 . . . . . . . . . . 1 26802 2 167 1 1.740 . 61.64513240880 . . . . . . . . . . 1 26802 2 167 2 30.958 . 39.05966777940 . . . . . . . . . . 1 26802 2 168 1 1.704 . 60.56322819190 . . . . . . . . . . 1 26802 2 168 2 30.966 . 40.57838876760 . . . . . . . . . . 1 26802 2 169 1 1.493 . 30.92590375760 . . . . . . . . . . 1 26802 2 169 2 26.694 . 36.46061263240 . . . . . . . . . . 1 26802 2 170 1 4.503 . 33.84369095460 . . . . . . . . . . 1 26802 2 170 2 52.843 . 84.32493728380 . . . . . . . . . . 1 26802 2 171 1 1.992 . 32.95640103850 . . . . . . . . . . 1 26802 2 171 2 32.789 . 43.57325599870 . . . . . . . . . . 1 26802 2 172 1 1.713 . 32.48167631220 . . . . . . . . . . 1 26802 2 172 2 32.782 . 42.76899245310 . . . . . . . . . . 1 26802 2 173 1 2.071 . 84.68683760000 . . . . . . . . . . 1 26802 2 173 2 29.753 . 38.88072080360 . . . . . . . . . . 1 26802 2 174 1 1.995 . 38.32253176910 . . . . . . . . . . 1 26802 2 174 2 29.750 . 39.13284312270 . . . . . . . . . . 1 26802 2 175 1 2.347 . 21.46823393970 . . . . . . . . . . 1 26802 2 175 2 34.226 . 47.82274775180 . . . . . . . . . . 1 26802 2 176 1 2.398 . 81.38260506430 . . . . . . . . . . 1 26802 2 176 2 34.057 . 41.06733310680 . . . . . . . . . . 1 26802 2 177 1 2.318 . 78.31016836600 . . . . . . . . . . 1 26802 2 177 2 34.053 . 52.68558192770 . . . . . . . . . . 1 26802 2 178 1 1.852 . 87.28911697760 . . . . . . . . . . 1 26802 2 178 2 32.539 . 38.16293720910 . . . . . . . . . . 1 26802 2 179 1 1.705 . 25.52323378160 . . . . . . . . . . 1 26802 2 179 2 28.557 . 37.74982913480 . . . . . . . . . . 1 26802 2 180 1 2.316 . 29.90251942570 . . . . . . . . . . 1 26802 2 180 2 36.695 . 41.10125985680 . . . . . . . . . . 1 26802 2 181 1 2.770 . 23.84471219970 . . . . . . . . . . 1 26802 2 181 2 42.002 . 38.41339645220 . . . . . . . . . . 1 26802 2 182 1 1.125 . 25.83010634970 . . . . . . . . . . 1 26802 2 182 2 24.690 . 38.54677514610 . . . . . . . . . . 1 26802 2 183 1 1.824 . 30.92504736900 . . . . . . . . . . 1 26802 2 183 2 33.260 . 37.55026001680 . . . . . . . . . . 1 26802 2 184 1 1.674 . 34.42567834830 . . . . . . . . . . 1 26802 2 184 2 33.260 . 37.52830741380 . . . . . . . . . . 1 26802 2 185 1 4.659 . 21.86288633540 . . . . . . . . . . 1 26802 2 185 2 53.738 . 34.65284903830 . . . . . . . . . . 1 26802 2 186 1 2.218 . 28.07784086260 . . . . . . . . . . 1 26802 2 186 2 35.682 . 75.27747131820 . . . . . . . . . . 1 26802 2 187 1 2.058 . 31.18624588050 . . . . . . . . . . 1 26802 2 187 2 32.414 . 51.22473598370 . . . . . . . . . . 1 26802 2 188 1 1.662 . 32.20078086380 . . . . . . . . . . 1 26802 2 188 2 32.391 . 38.50286994020 . . . . . . . . . . 1 26802 2 189 1 4.576 . 36.93047216130 . . . . . . . . . . 1 26802 2 189 2 43.804 . 40.51885064740 . . . . . . . . . . 1 26802 2 190 1 3.683 . 36.69182521530 . . . . . . . . . . 1 26802 2 190 2 43.796 . 40.78494280480 . . . . . . . . . . 1 26802 2 191 1 1.965 . 28.33361557980 . . . . . . . . . . 1 26802 2 191 2 31.093 . 37.48573266860 . . . . . . . . . . 1 26802 2 192 1 1.873 . 29.51029346430 . . . . . . . . . . 1 26802 2 192 2 31.093 . 37.39792225670 . . . . . . . . . . 1 26802 2 193 1 2.114 . 32.41487800430 . . . . . . . . . . 1 26802 2 193 2 31.872 . 36.89766900090 . . . . . . . . . . 1 26802 2 194 1 4.765 . 10.06071009710 . . . . . . . . . . 1 26802 2 194 2 51.145 . 38.17457874100 . . . . . . . . . . 1 26802 2 195 1 4.472 . 31.55335111080 . . . . . . . . . . 1 26802 2 195 2 52.486 . 43.95376778380 . . . . . . . . . . 1 26802 2 196 1 0.828 . 13.29571789070 . . . . . . . . . . 1 26802 2 196 2 25.308 . 89.60653399230 . . . . . . . . . . 1 26802 2 197 1 0.834 . 13.06848945890 . . . . . . . . . . 1 26802 2 197 2 24.957 . 39.83133503580 . . . . . . . . . . 1 26802 2 198 1 3.973 . 19.43944943580 . . . . . . . . . . 1 26802 2 198 2 45.342 . 39.17109387030 . . . . . . . . . . 1 26802 2 199 1 2.243 . 23.22953974920 . . . . . . . . . . 1 26802 2 199 2 36.271 . 39.61779607950 . . . . . . . . . . 1 26802 2 200 1 0.765 . 12.75790587370 . . . . . . . . . . 1 26802 2 200 2 23.332 . 38.67849076400 . . . . . . . . . . 1 26802 2 201 1 2.243 . 20.05547827490 . . . . . . . . . . 1 26802 2 201 2 33.797 . 38.80954115150 . . . . . . . . . . 1 26802 2 202 1 2.038 . 28.49889857230 . . . . . . . . . . 1 26802 2 202 2 29.242 . 39.60715239320 . . . . . . . . . . 1 26802 2 203 1 1.867 . 29.53769789830 . . . . . . . . . . 1 26802 2 203 2 29.240 . 38.49621763620 . . . . . . . . . . 1 26802 2 204 1 2.007 . 34.48762378770 . . . . . . . . . . 1 26802 2 204 2 31.868 . 38.49754809700 . . . . . . . . . . 1 26802 2 205 1 3.919 . 40.42696392930 . . . . . . . . . . 1 26802 2 205 2 46.365 . 32.53675115690 . . . . . . . . . . 1 26802 2 206 1 4.737 . 18.56828817100 . . . . . . . . . . 1 26802 2 206 2 46.324 . 71.44607686740 . . . . . . . . . . 1 26802 2 207 1 2.118 . 51.43469704470 . . . . . . . . . . 1 26802 2 207 2 29.363 . 37.12850394740 . . . . . . . . . . 1 26802 2 208 1 2.857 . 180.08409875300 . . . . . . . . . . 1 26802 2 208 2 42.383 . 45.90355806680 . . . . . . . . . . 1 26802 2 209 1 2.965 . 77.25780955450 . . . . . . . . . . 1 26802 2 209 2 42.380 . 46.51823095040 . . . . . . . . . . 1 26802 2 210 1 3.123 . 36.46773687490 . . . . . . . . . . 1 26802 2 210 2 39.920 . 37.59616091390 . . . . . . . . . . 1 26802 2 211 1 0.810 . 14.20891356090 . . . . . . . . . . 1 26802 2 211 2 22.234 . 38.57604528340 . . . . . . . . . . 1 26802 2 212 1 4.227 . 35.39111372080 . . . . . . . . . . 1 26802 2 212 2 44.917 . 38.59367388890 . . . . . . . . . . 1 26802 2 213 1 3.768 . 31.36366104430 . . . . . . . . . . 1 26802 2 213 2 44.928 . 102.81435083800 . . . . . . . . . . 1 26802 2 214 1 3.836 . 37.25019055790 . . . . . . . . . . 1 26802 2 214 2 45.273 . 39.44350571640 . . . . . . . . . . 1 26802 2 215 1 2.222 . 30.04753455560 . . . . . . . . . . 1 26802 2 215 2 32.171 . 34.61060690830 . . . . . . . . . . 1 26802 2 216 1 2.121 . 31.47741799160 . . . . . . . . . . 1 26802 2 216 2 32.185 . 30.90660407780 . . . . . . . . . . 1 26802 2 217 1 2.779 . 17.43749844030 . . . . . . . . . . 1 26802 2 217 2 42.295 . 2.56479578179 . . . . . . . . . . 1 26802 2 218 1 4.772 . 13.33903687890 . . . . . . . . . . 1 26802 2 218 2 51.606 . 34.04283276750 . . . . . . . . . . 1 26802 2 219 1 1.904 . 48.99541695680 . . . . . . . . . . 1 26802 2 219 2 33.806 . 40.67617763540 . . . . . . . . . . 1 26802 2 220 1 3.689 . 64.26582414050 . . . . . . . . . . 1 26802 2 220 2 46.349 . 71.65462659570 . . . . . . . . . . 1 26802 2 221 1 2.672 . 33.87487777140 . . . . . . . . . . 1 26802 2 221 2 39.922 . 89.85000831630 . . . . . . . . . . 1 26802 2 222 1 1.979 . 38.73673837040 . . . . . . . . . . 1 26802 2 222 2 29.764 . 40.11804933540 . . . . . . . . . . 1 26802 2 223 1 3.866 . 88.80506746410 . . . . . . . . . . 1 26802 2 223 2 45.270 . 41.12853430300 . . . . . . . . . . 1 26802 2 224 1 2.294 . 29.42008720240 . . . . . . . . . . 1 26802 2 224 2 35.683 . 41.36602155340 . . . . . . . . . . 1 26802 2 225 1 2.202 . 25.15869771700 . . . . . . . . . . 1 26802 2 225 2 35.854 . 46.99919252480 . . . . . . . . . . 1 26802 2 226 1 2.178 . 24.73021797300 . . . . . . . . . . 1 26802 2 226 2 35.985 . 47.19876164280 . . . . . . . . . . 1 26802 2 227 1 4.245 . 77.41210222710 . . . . . . . . . . 1 26802 2 227 2 55.657 . 40.21849912480 . . . . . . . . . . 1 26802 2 228 1 4.417 . 28.62721412520 . . . . . . . . . . 1 26802 2 228 2 54.925 . 42.16928725340 . . . . . . . . . . 1 26802 2 229 1 4.772 . 37.76252501520 . . . . . . . . . . 1 26802 2 229 2 53.610 . 143.97115743300 . . . . . . . . . . 1 26802 2 230 1 4.005 . 69.36618895400 . . . . . . . . . . 1 26802 2 230 2 45.301 . 40.41141593890 . . . . . . . . . . 1 26802 2 231 1 4.227 . 21.66520330900 . . . . . . . . . . 1 26802 2 231 2 56.980 . 40.78627326550 . . . . . . . . . . 1 26802 2 232 1 4.213 . 24.33627923440 . . . . . . . . . . 1 26802 2 232 2 56.896 . 42.74304846780 . . . . . . . . . . 1 26802 2 233 1 2.020 . 27.67448184980 . . . . . . . . . . 1 26802 2 233 2 30.149 . 41.92215416230 . . . . . . . . . . 1 26802 2 234 1 4.604 . 84.84063071260 . . . . . . . . . . 1 26802 2 234 2 56.117 . 55.16988483180 . . . . . . . . . . 1 26802 2 235 1 2.287 . 38.03078873230 . . . . . . . . . . 1 26802 2 235 2 36.585 . 42.06783961840 . . . . . . . . . . 1 26802 2 236 1 2.213 . 28.84859056860 . . . . . . . . . . 1 26802 2 236 2 36.585 . 41.94942860840 . . . . . . . . . . 1 26802 2 237 1 3.021 . 27.48978738320 . . . . . . . . . . 1 26802 2 237 2 41.338 . 74.77588760160 . . . . . . . . . . 1 26802 2 238 1 2.969 . 74.37463472850 . . . . . . . . . . 1 26802 2 238 2 41.335 . 106.26124212200 . . . . . . . . . . 1 26802 2 239 1 1.115 . 30.86167461540 . . . . . . . . . . 1 26802 2 239 2 28.885 . 43.67370578810 . . . . . . . . . . 1 26802 2 240 1 1.369 . 33.47908352430 . . . . . . . . . . 1 26802 2 240 2 32.122 . 37.29614200650 . . . . . . . . . . 1 26802 2 241 1 1.794 . 113.59880092200 . . . . . . . . . . 1 26802 2 241 2 32.607 . 37.59948706590 . . . . . . . . . . 1 26802 2 242 1 2.053 . 65.01987426950 . . . . . . . . . . 1 26802 2 242 2 32.607 . 76.79885322800 . . . . . . . . . . 1 26802 2 243 1 2.197 . 69.73714793280 . . . . . . . . . . 1 26802 2 243 2 34.565 . 37.57620400210 . . . . . . . . . . 1 26802 2 244 1 2.145 . 68.63754501900 . . . . . . . . . . 1 26802 2 244 2 34.575 . 38.05450465500 . . . . . . . . . . 1 26802 2 245 1 3.747 . 17.15531840910 . . . . . . . . . . 1 26802 2 245 2 46.134 . 38.13333445660 . . . . . . . . . . 1 26802 2 246 1 1.431 . 18.31558217940 . . . . . . . . . . 1 26802 2 246 2 19.641 . 49.60423474540 . . . . . . . . . . 1 26802 2 247 1 1.448 . 19.20651174690 . . . . . . . . . . 1 26802 2 247 2 19.506 . 40.00762109010 . . . . . . . . . . 1 26802 2 248 1 3.118 . 34.09810972330 . . . . . . . . . . 1 26802 2 248 2 37.096 . 40.34023628680 . . . . . . . . . . 1 26802 2 249 1 2.853 . 35.00702345060 . . . . . . . . . . 1 26802 2 249 2 37.096 . 39.88122731530 . . . . . . . . . . 1 26802 2 250 1 4.024 . 34.82161532690 . . . . . . . . . . 1 26802 2 250 2 60.317 . 38.12102769430 . . . . . . . . . . 1 26802 2 251 1 2.885 . 35.60421174130 . . . . . . . . . . 1 26802 2 251 2 34.684 . 40.19987267370 . . . . . . . . . . 1 26802 2 252 1 3.123 . 33.03889980330 . . . . . . . . . . 1 26802 2 252 2 34.679 . 40.42538577710 . . . . . . . . . . 1 26802 2 253 1 4.809 . 28.77708212360 . . . . . . . . . . 1 26802 2 253 2 55.736 . 103.26471181500 . . . . . . . . . . 1 26802 2 254 1 3.785 . 35.07182351850 . . . . . . . . . . 1 26802 2 254 2 56.480 . 38.67649507280 . . . . . . . . . . 1 26802 2 255 1 4.532 . 35.39660888070 . . . . . . . . . . 1 26802 2 255 2 44.148 . 39.82435011670 . . . . . . . . . . 1 26802 2 256 1 3.861 . 34.51088901030 . . . . . . . . . . 1 26802 2 256 2 44.151 . 39.63309637860 . . . . . . . . . . 1 26802 2 257 1 2.190 . 94.10311530410 . . . . . . . . . . 1 26802 2 257 2 33.842 . 39.68032773650 . . . . . . . . . . 1 26802 2 258 1 2.137 . 96.55267205480 . . . . . . . . . . 1 26802 2 258 2 33.839 . 38.85810297020 . . . . . . . . . . 1 26802 2 259 1 2.263 . 26.10586346670 . . . . . . . . . . 1 26802 2 259 2 28.761 . 38.90134294580 . . . . . . . . . . 1 26802 2 260 1 2.095 . 33.40885966220 . . . . . . . . . . 1 26802 2 260 2 30.332 . 36.66816451510 . . . . . . . . . . 1 26802 2 261 1 1.998 . 40.37415330130 . . . . . . . . . . 1 26802 2 261 2 30.329 . 53.64617461570 . . . . . . . . . . 1 26802 2 262 1 0.325 . 43.95614119400 . . . . . . . . . . 1 26802 2 262 2 27.407 . 36.75863584860 . . . . . . . . . . 1 26802 2 263 1 1.533 . 62.08217603830 . . . . . . . . . . 1 26802 2 263 2 27.406 . 36.45329509810 . . . . . . . . . . 1 26802 2 264 1 1.791 . 26.00623693070 . . . . . . . . . . 1 26802 2 264 2 32.121 . 35.42884029220 . . . . . . . . . . 1 26802 2 265 1 1.798 . 26.83664837310 . . . . . . . . . . 1 26802 2 265 2 32.167 . 32.87768173350 . . . . . . . . . . 1 26802 2 266 1 1.529 . 36.60547270200 . . . . . . . . . . 1 26802 2 266 2 24.846 . 38.76696640630 . . . . . . . . . . 1 26802 2 267 1 1.614 . 32.41858902140 . . . . . . . . . . 1 26802 2 267 2 24.846 . 38.52415731280 . . . . . . . . . . 1 26802 2 268 1 1.621 . 34.09967976900 . . . . . . . . . . 1 26802 2 268 2 24.722 . 44.35689740220 . . . . . . . . . . 1 26802 2 269 1 1.545 . 36.72822172920 . . . . . . . . . . 1 26802 2 269 2 24.722 . 43.97106377400 . . . . . . . . . . 1 26802 2 270 1 1.615 . 55.51224845210 . . . . . . . . . . 1 26802 2 270 2 28.845 . 60.90982528140 . . . . . . . . . . 1 26802 2 271 1 1.746 . 40.66304170960 . . . . . . . . . . 1 26802 2 271 2 28.845 . 56.88451617090 . . . . . . . . . . 1 26802 2 stop_ loop_ _Assigned_peak_chem_shift.Peak_ID _Assigned_peak_chem_shift.Spectral_dim_ID _Assigned_peak_chem_shift.Set_ID _Assigned_peak_chem_shift.Magnetization_linkage_ID _Assigned_peak_chem_shift.Assembly_atom_ID _Assigned_peak_chem_shift.Val _Assigned_peak_chem_shift.Contribution_fractional_val _Assigned_peak_chem_shift.Figure_of_merit _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID _Assigned_peak_chem_shift.Atom_chem_shift_ID _Assigned_peak_chem_shift.Entity_assembly_ID _Assigned_peak_chem_shift.Entity_ID _Assigned_peak_chem_shift.Comp_index_ID _Assigned_peak_chem_shift.Comp_ID _Assigned_peak_chem_shift.Atom_ID _Assigned_peak_chem_shift.Ambiguity_code _Assigned_peak_chem_shift.Ambiguity_set_ID _Assigned_peak_chem_shift.Auth_atom_peak_num _Assigned_peak_chem_shift.Auth_entity_ID _Assigned_peak_chem_shift.Auth_seq_ID _Assigned_peak_chem_shift.Auth_comp_ID _Assigned_peak_chem_shift.Auth_atom_ID _Assigned_peak_chem_shift.Auth_ambiguity_code _Assigned_peak_chem_shift.Auth_ambiguity_set_ID _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID _Assigned_peak_chem_shift.Resonance_ID _Assigned_peak_chem_shift.Details _Assigned_peak_chem_shift.Entry_ID _Assigned_peak_chem_shift.Spectral_peak_list_ID 1 1 1 . . 4.167 . . 1 . 1 1 18 ILE HA . . . . . . . . . . 474 . 26802 2 1 2 1 . . 59.393 . . 1 . 1 1 18 ILE CA . . . . . . . . . . 270 . 26802 2 2 1 1 . . 0.969 . . 1 . 1 1 18 ILE HB . . . . . . . . . . 494 . 26802 2 2 2 1 . . 41.984 . . 1 . 1 1 18 ILE CB . . . . . . . . . . 294 . 26802 2 3 1 1 . . 0.340 . . 1 . 1 1 18 ILE HG12 . . . . . . . . . . 495 . 26802 2 3 2 1 . . 27.947 . . 1 . 1 1 18 ILE CG1 . . . . . . . . . . 295 . 26802 2 4 1 1 . . 1.144 . . 1 . 1 1 18 ILE HG13 . . . . . . . . . . 496 . 26802 2 4 2 1 . . 27.949 . . 1 . 1 1 18 ILE CG1 . . . . . . . . . . 295 . 26802 2 5 1 1 . . 0.108 . . 1 . 1 1 18 ILE MG . . . . . . . . . . 493 . 26802 2 5 2 1 . . 17.670 . . 1 . 1 1 18 ILE CG2 . . . . . . . . . . 296 . 26802 2 6 1 1 . . -0.091 . . 1 . 1 1 18 ILE MD . . . . . . . . . . 492 . 26802 2 6 2 1 . . 14.053 . . 1 . 1 1 18 ILE CD1 . . . . . . . . . . 297 . 26802 2 7 1 1 . . 3.564 . . 1 . 1 1 6 VAL HA . . . . . . . . . . 470 . 26802 2 7 2 1 . . 64.738 . . 1 . 1 1 6 VAL CA . . . . . . . . . . 188 . 26802 2 8 1 1 . . 2.418 . . 1 . 1 1 6 VAL HB . . . . . . . . . . 471 . 26802 2 8 2 1 . . 31.650 . . 1 . 1 1 6 VAL CB . . . . . . . . . . 291 . 26802 2 9 1 1 . . 0.494 . . 1 . 1 1 6 VAL MG2 . . . . . . . . . . 473 . 26802 2 9 2 1 . . 21.176 . . 1 . 1 1 6 VAL CG2 . . . . . . . . . . 293 . 26802 2 10 1 1 . . 4.692 . . 1 . 1 1 20 PRO HA . . . . . . . . . . 504 . 26802 2 10 2 1 . . 63.477 . . 1 . 1 1 20 PRO CA . . . . . . . . . . 209 . 26802 2 11 1 1 . . 3.809 . . 1 . 1 1 20 PRO HD3 . . . . . . . . . . 506 . 26802 2 11 2 1 . . 52.640 . . 1 . 1 1 20 PRO CD . . . . . . . . . . 312 . 26802 2 12 1 1 . . 2.472 . . 1 . 1 1 20 PRO HB2 . . . . . . . . . . 507 . 26802 2 12 2 1 . . 33.173 . . 1 . 1 1 20 PRO CB . . . . . . . . . . 313 . 26802 2 13 1 1 . . 2.280 . . 1 . 1 1 20 PRO HB3 . . . . . . . . . . 508 . 26802 2 13 2 1 . . 33.176 . . 1 . 1 1 20 PRO CB . . . . . . . . . . 313 . 26802 2 14 1 1 . . 4.505 . . 1 . 1 1 20 PRO HD2 . . . . . . . . . . 505 . 26802 2 14 2 1 . . 52.636 . . 1 . 1 1 20 PRO CD . . . . . . . . . . 312 . 26802 2 15 1 1 . . 4.828 . . 1 . 1 1 59 PRO HA . . . . . . . . . . 512 . 26802 2 15 2 1 . . 63.151 . . 1 . 1 1 59 PRO CA . . . . . . . . . . 202 . 26802 2 16 1 1 . . 3.726 . . 1 . 1 1 59 PRO HD2 . . . . . . . . . . 513 . 26802 2 16 1 2 . . 3.726 . . 1 . 1 1 59 PRO HD3 . . . . . . . . . . 514 . 26802 2 16 2 1 . . 49.837 . . 1 . 1 1 59 PRO CD . . . . . . . . . . 340 . 26802 2 17 1 1 . . 1.914 . . 1 . 1 1 59 PRO HB3 . . . . . . . . . . 516 . 26802 2 17 2 1 . . 32.525 . . 1 . 1 1 59 PRO CB . . . . . . . . . . 341 . 26802 2 18 1 1 . . 2.338 . . 1 . 1 1 59 PRO HB2 . . . . . . . . . . 515 . 26802 2 18 2 1 . . 32.519 . . 1 . 1 1 59 PRO CB . . . . . . . . . . 341 . 26802 2 19 1 1 . . 2.173 . . 1 . 1 1 59 PRO HG2 . . . . . . . . . . 517 . 26802 2 19 2 1 . . 27.626 . . 1 . 1 1 59 PRO CG . . . . . . . . . . 342 . 26802 2 20 1 1 . . 2.085 . . 1 . 1 1 59 PRO HG3 . . . . . . . . . . 518 . 26802 2 20 2 1 . . 27.628 . . 1 . 1 1 59 PRO CG . . . . . . . . . . 342 . 26802 2 21 1 1 . . 4.414 . . 1 . 1 1 57 LYS HA . . . . . . . . . . 519 . 26802 2 21 2 1 . . 54.860 . . 1 . 1 1 57 LYS CA . . . . . . . . . . 256 . 26802 2 22 1 1 . . 1.444 . . 1 . 1 1 72 LEU HB2 . . . . . . . . . . 603 . 26802 2 22 2 1 . . 42.200 . . 1 . 1 1 72 LEU CB . . . . . . . . . . 336 . 26802 2 23 1 1 . . 1.317 . . 1 . 1 1 72 LEU HB3 . . . . . . . . . . 604 . 26802 2 23 2 1 . . 42.201 . . 1 . 1 1 72 LEU CB . . . . . . . . . . 336 . 26802 2 24 1 1 . . 1.443 . . 1 . 1 1 72 LEU HG . . . . . . . . . . 605 . 26802 2 24 2 1 . . 26.866 . . 1 . 1 1 72 LEU CG . . . . . . . . . . 337 . 26802 2 25 1 1 . . 4.333 . . 1 . 1 1 24 SER HA . . . . . . . . . . 606 . 26802 2 25 2 1 . . 58.585 . . 1 . 1 1 24 SER CA . . . . . . . . . . 212 . 26802 2 26 1 1 . . 4.162 . . 1 . 1 1 24 SER HB2 . . . . . . . . . . 607 . 26802 2 26 2 1 . . 63.334 . . 1 . 1 1 24 SER CB . . . . . . . . . . 335 . 26802 2 27 1 1 . . 3.939 . . 1 . 1 1 24 SER HB3 . . . . . . . . . . 608 . 26802 2 27 2 1 . . 63.337 . . 1 . 1 1 24 SER CB . . . . . . . . . . 335 . 26802 2 28 1 2 . . 2.187 . . 1 . 1 1 63 GLN HB3 . . . . . . . . . . 618 . 26802 2 28 2 1 . . 26.763 . . 1 . 1 1 63 GLN CB . . . . . . . . . . 614 . 26802 2 29 1 2 . . 2.142 . . 1 . 1 1 63 GLN HB2 . . . . . . . . . . 617 . 26802 2 29 2 1 . . 26.768 . . 1 . 1 1 63 GLN CB . . . . . . . . . . 614 . 26802 2 30 1 1 . . 1.925 . . 1 . 1 1 70 GLU HB2 . . . . . . . . . . 624 . 26802 2 30 2 1 . . 30.149 . . 1 . 1 1 70 GLU CB . . . . . . . . . . 623 . 26802 2 31 1 1 . . 1.005 . . 1 . 1 1 42 LEU HB2 . . . . . . . . . . 648 . 26802 2 31 2 1 . . 45.287 . . 1 . 1 1 42 LEU CB . . . . . . . . . . 350 . 26802 2 32 1 1 . . 0.431 . . 1 . 1 1 42 LEU HB3 . . . . . . . . . . 649 . 26802 2 32 2 1 . . 45.296 . . 1 . 1 1 42 LEU CB . . . . . . . . . . 350 . 26802 2 33 1 1 . . 0.248 . . 1 . 1 1 42 LEU HG . . . . . . . . . . 647 . 26802 2 33 2 1 . . 25.759 . . 1 . 1 1 42 LEU CG . . . . . . . . . . 351 . 26802 2 34 1 1 . . 3.523 . . 1 . 1 1 44 GLU HA . . . . . . . . . . 658 . 26802 2 34 2 1 . . 58.441 . . 1 . 1 1 44 GLU CA . . . . . . . . . . 232 . 26802 2 35 1 1 . . 2.494 . . 1 . 1 1 44 GLU HG2 . . . . . . . . . . 659 . 26802 2 35 2 1 . . 35.983 . . 1 . 1 1 44 GLU CG . . . . . . . . . . 657 . 26802 2 36 1 1 . . 2.329 . . 1 . 1 1 44 GLU HG3 . . . . . . . . . . 660 . 26802 2 36 2 1 . . 35.984 . . 1 . 1 1 44 GLU CG . . . . . . . . . . 657 . 26802 2 37 1 1 . . 5.071 . . 1 . 1 1 47 LYS HA . . . . . . . . . . 668 . 26802 2 37 2 1 . . 55.588 . . 1 . 1 1 47 LYS CA . . . . . . . . . . 225 . 26802 2 38 1 1 . . 3.003 . . 1 . 1 1 47 LYS HE3 . . . . . . . . . . 670 . 26802 2 38 2 1 . . 41.745 . . 1 . 1 1 47 LYS CE . . . . . . . . . . 361 . 26802 2 39 1 1 . . 2.955 . . 1 . 1 1 47 LYS HE2 . . . . . . . . . . 669 . 26802 2 39 2 1 . . 41.743 . . 1 . 1 1 47 LYS CE . . . . . . . . . . 361 . 26802 2 40 1 1 . . 1.361 . . 1 . 1 1 56 ALA MB . . . . . . . . . . 680 . 26802 2 40 2 1 . . 18.749 . . 1 . 1 1 56 ALA CB . . . . . . . . . . 365 . 26802 2 41 1 1 . . 4.071 . . 1 . 1 1 56 ALA HA . . . . . . . . . . 679 . 26802 2 41 2 1 . . 54.738 . . 1 . 1 1 56 ALA CA . . . . . . . . . . 255 . 26802 2 42 1 1 . . 4.035 . . 1 . 1 1 11 ALA HA . . . . . . . . . . 469 . 26802 2 42 2 1 . . 54.636 . . 1 . 1 1 11 ALA CA . . . . . . . . . . 265 . 26802 2 43 1 1 . . 3.067 . . 1 . 1 1 40 ARG HD2 . . . . . . . . . . 690 . 26802 2 43 1 2 . . 3.067 . . 1 . 1 1 40 ARG HD3 . . . . . . . . . . 691 . 26802 2 43 2 1 . . 43.541 . . 1 . 1 1 40 ARG CD . . . . . . . . . . 366 . 26802 2 44 1 1 . . 1.561 . . 1 . 1 1 67 LEU HB2 . . . . . . . . . . 702 . 26802 2 44 2 1 . . 42.714 . . 1 . 1 1 67 LEU CB . . . . . . . . . . 373 . 26802 2 45 1 1 . . 1.424 . . 1 . 1 1 67 LEU HB3 . . . . . . . . . . 703 . 26802 2 45 2 1 . . 42.712 . . 1 . 1 1 67 LEU CB . . . . . . . . . . 373 . 26802 2 46 1 4 . . 1.554 . . 1 . 1 1 67 LEU HG . . . . . . . . . . 704 . 26802 2 46 2 3 . . 27.249 . . 1 . 1 1 67 LEU CG . . . . . . . . . . 374 . 26802 2 47 1 1 . . 2.796 . . 1 . 1 1 37 ASN HB3 . . . . . . . . . . 708 . 26802 2 47 2 1 . . 39.633 . . 1 . 1 1 37 ASN CB . . . . . . . . . . 387 . 26802 2 48 1 1 . . 2.717 . . 1 . 1 1 37 ASN HB2 . . . . . . . . . . 707 . 26802 2 48 2 1 . . 39.639 . . 1 . 1 1 37 ASN CB . . . . . . . . . . 387 . 26802 2 49 1 1 . . 2.418 . . 1 . 1 1 3 GLN HG3 . . . . . . . . . . 711 . 26802 2 49 2 1 . . 34.465 . . 1 . 1 1 3 GLN CG . . . . . . . . . . 388 . 26802 2 50 1 1 . . 2.327 . . 1 . 1 1 3 GLN HG2 . . . . . . . . . . 710 . 26802 2 50 2 1 . . 34.455 . . 1 . 1 1 3 GLN CG . . . . . . . . . . 388 . 26802 2 51 1 1 . . 1.473 . . 1 . 1 1 13 LYS HG3 . . . . . . . . . . 718 . 26802 2 51 2 1 . . 25.762 . . 1 . 1 1 13 LYS CG . . . . . . . . . . 382 . 26802 2 52 1 1 . . 1.403 . . 1 . 1 1 13 LYS HG2 . . . . . . . . . . 717 . 26802 2 52 2 1 . . 25.764 . . 1 . 1 1 13 LYS CG . . . . . . . . . . 382 . 26802 2 53 1 1 . . 0.973 . . 1 . 1 1 52 ILE MD . . . . . . . . . . 731 . 26802 2 53 2 1 . . 13.350 . . 1 . 1 1 52 ILE CD1 . . . . . . . . . . 360 . 26802 2 54 1 1 . . 0.967 . . 1 . 1 1 52 ILE MG . . . . . . . . . . 732 . 26802 2 54 2 1 . . 18.182 . . 1 . 1 1 52 ILE CG2 . . . . . . . . . . 359 . 26802 2 55 1 1 . . 0.784 . . 1 . 1 1 61 ALA MB . . . . . . . . . . 633 . 26802 2 55 2 1 . . 20.141 . . 1 . 1 1 61 ALA CB . . . . . . . . . . 345 . 26802 2 56 1 2 . . 0.932 . . 1 . 1 1 27 VAL MG1 . . . . . . . . . . 477 . 26802 2 56 2 3 . . 21.460 . . 1 . 1 1 27 VAL CG1 . . . . . . . . . . 775 . 26802 2 57 1 1 . . 1.135 . . 1 . 1 1 5 THR MG . . . . . . . . . . 500 . 26802 2 57 2 1 . . 21.873 . . 1 . 1 1 5 THR CG2 . . . . . . . . . . 308 . 26802 2 58 1 1 . . 0.837 . . 1 . 1 1 2 ALA MB . . . . . . . . . . 662 . 26802 2 58 2 1 . . 19.183 . . 1 . 1 1 2 ALA CB . . . . . . . . . . 355 . 26802 2 59 1 1 . . 0.658 . . 1 . 1 1 34 ILE MG . . . . . . . . . . 489 . 26802 2 59 2 1 . . 17.203 . . 1 . 1 1 34 ILE CG2 . . . . . . . . . . 304 . 26802 2 60 1 1 . . 0.411 . . 1 . 1 1 29 VAL MG2 . . . . . . . . . . 485 . 26802 2 60 2 1 . . 18.006 . . 1 . 1 1 29 VAL CG2 . . . . . . . . . . 290 . 26802 2 61 1 1 . . 0.493 . . 1 . 1 1 48 VAL MG1 . . . . . . . . . . 585 . 26802 2 61 2 1 . . 18.518 . . 1 . 1 1 48 VAL CG1 . . . . . . . . . . 330 . 26802 2 62 1 1 . . 1.584 . . 1 . 1 1 11 ALA MB . . . . . . . . . . 643 . 26802 2 62 2 1 . . 18.766 . . 1 . 1 1 11 ALA CB . . . . . . . . . . 349 . 26802 2 63 1 1 . . 1.341 . . 1 . 1 1 66 ALA MB . . . . . . . . . . 549 . 26802 2 63 2 1 . . 19.015 . . 1 . 1 1 66 ALA CB . . . . . . . . . . 318 . 26802 2 64 1 1 . . 1.029 . . 1 . 1 1 41 THR MG . . . . . . . . . . 609 . 26802 2 64 2 1 . . 20.500 . . 1 . 1 1 41 THR CG2 . . . . . . . . . . 344 . 26802 2 65 1 3 . . 0.635 . . 1 . 1 1 64 VAL MG1 . . . . . . . . . . 546 . 26802 2 65 2 3 . . 21.736 . . 1 . 1 1 64 VAL CG1 . . . . . . . . . . 320 . 26802 2 66 1 1 . . 0.471 . . 1 . 1 1 42 LEU MD2 . . . . . . . . . . 646 . 26802 2 66 1 2 . . 0.471 . . 1 . 1 1 42 LEU MD1 . . . . . . . . . . 645 . 26802 2 66 2 1 . . 22.544 . . 1 . 1 1 42 LEU CD2 . . . . . . . . . . 353 . 26802 2 66 2 2 . . 22.544 . . 1 . 1 1 42 LEU CD1 . . . . . . . . . . 352 . 26802 2 67 1 1 . . 0.632 . . 1 . 1 1 64 VAL MG2 . . . . . . . . . . 547 . 26802 2 67 2 1 . . 22.349 . . 1 . 1 1 64 VAL CG2 . . . . . . . . . . 321 . 26802 2 68 1 1 . . 3.228 . . 1 . 1 1 45 ASN HB2 . . . . . . . . . . 593 . 26802 2 68 2 1 . . 37.643 . . 1 . 1 1 45 ASN CB . . . . . . . . . . 332 . 26802 2 69 1 1 . . 3.032 . . 1 . 1 1 45 ASN HB3 . . . . . . . . . . 594 . 26802 2 69 2 1 . . 37.645 . . 1 . 1 1 45 ASN CB . . . . . . . . . . 332 . 26802 2 70 1 1 . . 1.790 . . 1 . 1 1 52 ILE HB . . . . . . . . . . 735 . 26802 2 70 2 1 . . 39.062 . . 1 . 1 1 52 ILE CB . . . . . . . . . . 357 . 26802 2 71 1 1 . . 1.974 . . 1 . 1 1 48 VAL HB . . . . . . . . . . 584 . 26802 2 71 2 1 . . 36.768 . . 1 . 1 1 48 VAL CB . . . . . . . . . . 328 . 26802 2 72 1 1 . . 1.668 . . 1 . 1 1 27 VAL HB . . . . . . . . . . 476 . 26802 2 72 2 1 . . 34.888 . . 1 . 1 1 27 VAL CB . . . . . . . . . . 298 . 26802 2 73 1 1 . . 1.660 . . 1 . 1 1 34 ILE HB . . . . . . . . . . 488 . 26802 2 73 2 1 . . 37.748 . . 1 . 1 1 34 ILE CB . . . . . . . . . . 302 . 26802 2 74 1 1 . . 1.442 . . 1 . 1 1 29 VAL HB . . . . . . . . . . 483 . 26802 2 74 2 1 . . 34.391 . . 1 . 1 1 29 VAL CB . . . . . . . . . . 288 . 26802 2 75 1 1 . . 2.426 . . 1 . 1 1 26 ASP HB3 . . . . . . . . . . 598 . 26802 2 75 1 2 . . 2.426 . . 1 . 1 1 26 ASP HB2 . . . . . . . . . . 597 . 26802 2 75 2 1 . . 41.356 . . 1 . 1 1 26 ASP CB . . . . . . . . . . 334 . 26802 2 76 1 2 . . 3.828 . . 1 . 1 1 32 SER HA . . . . . . . . . . 863 . 26802 2 76 2 1 . . 60.606 . . 1 . 1 1 32 SER CA . . . . . . . . . . 207 . 26802 2 77 1 1 . . 4.425 . . 1 . 1 1 27 VAL HA . . . . . . . . . . 475 . 26802 2 77 2 1 . . 60.510 . . 1 . 1 1 27 VAL CA . . . . . . . . . . 215 . 26802 2 78 1 1 . . 4.464 . . 1 . 1 1 64 VAL HA . . . . . . . . . . 544 . 26802 2 78 2 1 . . 62.751 . . 1 . 1 1 64 VAL CA . . . . . . . . . . 195 . 26802 2 79 1 1 . . 3.984 . . 1 . 1 1 34 ILE HA . . . . . . . . . . 486 . 26802 2 79 2 1 . . 62.303 . . 1 . 1 1 34 ILE CA . . . . . . . . . . 205 . 26802 2 80 1 2 . . 3.930 . . 1 . 1 1 32 SER HB2 . . . . . . . . . . 865 . 26802 2 80 2 3 . . 62.594 . . 1 . 1 1 32 SER CB . . . . . . . . . . 860 . 26802 2 81 1 1 . . 5.131 . . 1 . 1 1 5 THR HA . . . . . . . . . . 497 . 26802 2 81 2 1 . . 60.764 . . 1 . 1 1 5 THR CA . . . . . . . . . . 189 . 26802 2 82 1 1 . . 4.038 . . 1 . 1 1 12 GLU HA . . . . . . . . . . 663 . 26802 2 82 2 1 . . 59.252 . . 1 . 1 1 12 GLU CA . . . . . . . . . . 198 . 26802 2 83 1 1 . . 4.228 . . 1 . 1 1 9 PHE HA . . . . . . . . . . 501 . 26802 2 83 2 1 . . 59.323 . . 1 . 1 1 9 PHE CA . . . . . . . . . . 263 . 26802 2 84 1 1 . . 4.038 . . 1 . 1 1 41 THR HA . . . . . . . . . . 610 . 26802 2 84 2 1 . . 59.898 . . 1 . 1 1 41 THR CA . . . . . . . . . . 239 . 26802 2 85 1 1 . . 3.760 . . 1 . 1 1 28 PHE HA . . . . . . . . . . 536 . 26802 2 85 2 1 . . 58.342 . . 1 . 1 1 28 PHE CA . . . . . . . . . . 218 . 26802 2 86 1 1 . . 5.129 . . 1 . 1 1 48 VAL HA . . . . . . . . . . 583 . 26802 2 86 2 1 . . 58.638 . . 1 . 1 1 48 VAL CA . . . . . . . . . . 224 . 26802 2 87 1 1 . . 5.241 . . 1 . 1 1 17 PHE HA . . . . . . . . . . 558 . 26802 2 87 2 1 . . 56.806 . . 1 . 1 1 17 PHE CA . . . . . . . . . . 269 . 26802 2 88 1 1 . . 5.039 . . 1 . 1 1 50 PHE HA . . . . . . . . . . 634 . 26802 2 88 2 1 . . 56.207 . . 1 . 1 1 50 PHE CA . . . . . . . . . . 222 . 26802 2 89 1 1 . . 4.275 . . 1 . 1 1 13 LYS HA . . . . . . . . . . 714 . 26802 2 89 2 1 . . 56.367 . . 1 . 1 1 13 LYS CA . . . . . . . . . . 197 . 26802 2 90 1 1 . . 5.146 . . 1 . 1 1 15 PHE HA . . . . . . . . . . 727 . 26802 2 90 2 1 . . 55.192 . . 1 . 1 1 15 PHE CA . . . . . . . . . . 267 . 26802 2 91 1 1 . . 5.462 . . 1 . 1 1 3 GLN HA . . . . . . . . . . 709 . 26802 2 91 2 1 . . 54.250 . . 1 . 1 1 3 GLN CA . . . . . . . . . . 191 . 26802 2 92 1 1 . . 5.397 . . 1 . 1 1 49 GLU HA . . . . . . . . . . 638 . 26802 2 92 2 1 . . 54.130 . . 1 . 1 1 49 GLU CA . . . . . . . . . . 223 . 26802 2 93 1 1 . . 5.275 . . 1 . 1 1 60 GLN HA . . . . . . . . . . 750 . 26802 2 93 2 1 . . 53.647 . . 1 . 1 1 60 GLN CA . . . . . . . . . . 201 . 26802 2 94 1 1 . . 5.061 . . 1 . 1 1 65 HIS HA . . . . . . . . . . 528 . 26802 2 94 2 1 . . 53.679 . . 1 . 1 1 65 HIS CA . . . . . . . . . . 194 . 26802 2 95 1 1 . . 4.099 . . 1 . 1 1 25 ALA HA . . . . . . . . . . 652 . 26802 2 95 2 1 . . 52.941 . . 1 . 1 1 25 ALA CA . . . . . . . . . . 213 . 26802 2 96 1 1 . . 3.943 . . 1 . 1 1 2 ALA HA . . . . . . . . . . 661 . 26802 2 96 2 1 . . 51.580 . . 1 . 1 1 2 ALA CA . . . . . . . . . . 192 . 26802 2 97 1 1 . . 5.333 . . 1 . 1 1 19 ALA HA . . . . . . . . . . 746 . 26802 2 97 2 1 . . 48.624 . . 1 . 1 1 19 ALA CA . . . . . . . . . . 271 . 26802 2 98 1 1 . . 4.625 . . 1 . 1 1 71 ASN HA . . . . . . . . . . 564 . 26802 2 98 2 1 . . 53.413 . . 1 . 1 1 71 ASN CA . . . . . . . . . . 279 . 26802 2 99 1 1 . . 4.566 . . 1 . 1 1 43 GLU HA . . . . . . . . . . 579 . 26802 2 99 2 1 . . 54.009 . . 1 . 1 1 43 GLU CA . . . . . . . . . . 235 . 26802 2 100 1 1 . . 4.511 . . 1 . 1 1 22 ASP HA . . . . . . . . . . 724 . 26802 2 100 2 1 . . 53.766 . . 1 . 1 1 22 ASP CA . . . . . . . . . . 210 . 26802 2 101 1 1 . . 4.183 . . 1 . 1 1 72 LEU HA . . . . . . . . . . 600 . 26802 2 101 2 1 . . 55.568 . . 1 . 1 1 72 LEU CA . . . . . . . . . . 280 . 26802 2 102 1 1 . . 4.192 . . 1 . 1 1 75 GLN HA . . . . . . . . . . 723 . 26802 2 102 2 1 . . 56.073 . . 1 . 1 1 75 GLN CA . . . . . . . . . . 283 . 26802 2 103 1 1 . . 4.485 . . 1 . 1 1 21 ASP HA . . . . . . . . . . 654 . 26802 2 103 2 1 . . 56.647 . . 1 . 1 1 21 ASP CA . . . . . . . . . . 208 . 26802 2 104 1 1 . . 4.449 . . 1 . 1 1 54 GLU HA . . . . . . . . . . 683 . 26802 2 104 2 1 . . 56.279 . . 1 . 1 1 54 GLU CA . . . . . . . . . . 249 . 26802 2 105 1 1 . . 4.384 . . 1 . 1 1 7 LYS HA . . . . . . . . . . 696 . 26802 2 105 2 1 . . 58.115 . . 1 . 1 1 7 LYS CA . . . . . . . . . . 261 . 26802 2 106 1 2 . . 3.631 . . 1 . 1 1 32 SER HB3 . . . . . . . . . . 866 . 26802 2 106 2 2 . . 62.599 . . 1 . 1 1 32 SER CB . . . . . . . . . . 860 . 26802 2 107 1 1 . . 4.730 . . 1 . 1 1 52 ILE HA . . . . . . . . . . 730 . 26802 2 107 2 1 . . 61.249 . . 1 . 1 1 52 ILE CA . . . . . . . . . . 220 . 26802 2 108 1 1 . . 2.575 . . 1 . 1 1 17 PHE HB2 . . . . . . . . . . 559 . 26802 2 108 2 1 . . 45.295 . . 1 . 1 1 17 PHE CB . . . . . . . . . . 324 . 26802 2 109 1 1 . . 2.244 . . 1 . 1 1 17 PHE HB3 . . . . . . . . . . 560 . 26802 2 109 2 1 . . 45.295 . . 1 . 1 1 17 PHE CB . . . . . . . . . . 324 . 26802 2 110 1 1 . . 2.514 . . 1 . 1 1 10 ASN HB3 . . . . . . . . . . 481 . 26802 2 110 2 1 . . 39.061 . . 1 . 1 1 10 ASN CB . . . . . . . . . . 301 . 26802 2 111 1 1 . . 2.460 . . 1 . 1 1 10 ASN HB2 . . . . . . . . . . 480 . 26802 2 111 2 1 . . 39.063 . . 1 . 1 1 10 ASN CB . . . . . . . . . . 301 . 26802 2 112 1 1 . . 3.247 . . 1 . 1 1 65 HIS HB3 . . . . . . . . . . 530 . 26802 2 112 2 1 . . 31.432 . . 1 . 1 1 65 HIS CB . . . . . . . . . . 311 . 26802 2 113 1 1 . . 3.182 . . 1 . 1 1 65 HIS HB2 . . . . . . . . . . 529 . 26802 2 113 2 1 . . 31.433 . . 1 . 1 1 65 HIS CB . . . . . . . . . . 311 . 26802 2 114 1 1 . . 3.019 . . 1 . 1 1 39 PHE HB3 . . . . . . . . . . 543 . 26802 2 114 2 1 . . 38.991 . . 1 . 1 1 39 PHE CB . . . . . . . . . . 317 . 26802 2 115 1 1 . . 2.958 . . 1 . 1 1 39 PHE HB2 . . . . . . . . . . 542 . 26802 2 115 2 1 . . 38.989 . . 1 . 1 1 39 PHE CB . . . . . . . . . . 317 . 26802 2 116 1 1 . . 2.771 . . 1 . 1 1 71 ASN HB3 . . . . . . . . . . 566 . 26802 2 116 2 1 . . 38.730 . . 1 . 1 1 71 ASN CB . . . . . . . . . . 322 . 26802 2 117 1 1 . . 2.705 . . 1 . 1 1 71 ASN HB2 . . . . . . . . . . 565 . 26802 2 117 2 1 . . 38.737 . . 1 . 1 1 71 ASN CB . . . . . . . . . . 322 . 26802 2 118 1 1 . . 2.905 . . 1 . 1 1 73 TYR HB3 . . . . . . . . . . 574 . 26802 2 118 2 1 . . 38.600 . . 1 . 1 1 73 TYR CB . . . . . . . . . . 327 . 26802 2 119 1 1 . . 2.822 . . 1 . 1 1 73 TYR HB2 . . . . . . . . . . 573 . 26802 2 119 2 1 . . 38.607 . . 1 . 1 1 73 TYR CB . . . . . . . . . . 327 . 26802 2 120 1 1 . . 3.027 . . 1 . 1 1 74 PHE HB3 . . . . . . . . . . 563 . 26802 2 120 2 1 . . 39.512 . . 1 . 1 1 74 PHE CB . . . . . . . . . . 323 . 26802 2 121 1 1 . . 2.966 . . 1 . 1 1 74 PHE HB2 . . . . . . . . . . 562 . 26802 2 121 2 1 . . 39.516 . . 1 . 1 1 74 PHE CB . . . . . . . . . . 323 . 26802 2 122 1 1 . . 2.683 . . 1 . 1 1 21 ASP HB3 . . . . . . . . . . 656 . 26802 2 122 1 2 . . 2.683 . . 1 . 1 1 21 ASP HB2 . . . . . . . . . . 655 . 26802 2 122 2 1 . . 40.153 . . 1 . 1 1 21 ASP CB . . . . . . . . . . 356 . 26802 2 123 1 1 . . 3.038 . . 1 . 1 1 7 LYS HE3 . . . . . . . . . . 698 . 26802 2 123 1 2 . . 3.038 . . 1 . 1 1 7 LYS HE2 . . . . . . . . . . 697 . 26802 2 123 2 1 . . 41.446 . . 1 . 1 1 7 LYS CE . . . . . . . . . . 369 . 26802 2 124 1 1 . . 3.048 . . 1 . 1 1 13 LYS HE3 . . . . . . . . . . 716 . 26802 2 124 2 1 . . 42.302 . . 1 . 1 1 13 LYS CE . . . . . . . . . . 379 . 26802 2 125 1 1 . . 3.000 . . 1 . 1 1 13 LYS HE2 . . . . . . . . . . 715 . 26802 2 125 2 1 . . 42.301 . . 1 . 1 1 13 LYS CE . . . . . . . . . . 379 . 26802 2 126 1 1 . . 3.769 . . 1 . 1 1 55 GLY HA3 . . . . . . . . . . 540 . 26802 2 126 2 1 . . 44.300 . . 1 . 1 1 55 GLY CA . . . . . . . . . . 252 . 26802 2 127 1 1 . . 4.409 . . 1 . 1 1 55 GLY HA2 . . . . . . . . . . 539 . 26802 2 127 2 1 . . 44.301 . . 1 . 1 1 55 GLY CA . . . . . . . . . . 252 . 26802 2 128 1 1 . . 1.420 . . 1 . 1 1 57 LYS HD3 . . . . . . . . . . 525 . 26802 2 128 2 1 . . 28.655 . . 1 . 1 1 57 LYS CD . . . . . . . . . . 385 . 26802 2 129 1 1 . . 1.358 . . 1 . 1 1 57 LYS HD2 . . . . . . . . . . 524 . 26802 2 129 2 1 . . 28.655 . . 1 . 1 1 57 LYS CD . . . . . . . . . . 385 . 26802 2 130 1 1 . . 2.883 . . 1 . 1 1 16 GLY HA3 . . . . . . . . . . 682 . 26802 2 130 2 1 . . 45.254 . . 1 . 1 1 16 GLY CA . . . . . . . . . . 268 . 26802 2 131 1 1 . . 3.854 . . 1 . 1 1 5 THR HB . . . . . . . . . . 498 . 26802 2 131 2 1 . . 71.542 . . 1 . 1 1 5 THR CB . . . . . . . . . . 307 . 26802 2 132 1 1 . . 3.878 . . 1 . 1 1 41 THR HB . . . . . . . . . . 611 . 26802 2 132 2 1 . . 70.287 . . 1 . 1 1 41 THR CB . . . . . . . . . . 786 . 26802 2 133 1 1 . . 3.359 . . 1 . 1 1 8 TRP HB3 . . . . . . . . . . 589 . 26802 2 133 2 1 . . 30.798 . . 1 . 1 1 8 TRP CB . . . . . . . . . . 331 . 26802 2 134 1 1 . . 3.533 . . 1 . 1 1 8 TRP HB2 . . . . . . . . . . 588 . 26802 2 134 2 1 . . 30.757 . . 1 . 1 1 8 TRP CB . . . . . . . . . . 331 . 26802 2 135 1 1 . . 1.160 . . 1 . 1 1 13 LYS HB3 . . . . . . . . . . 720 . 26802 2 135 2 1 . . 33.805 . . 1 . 1 1 13 LYS CB . . . . . . . . . . 380 . 26802 2 136 1 1 . . 1.614 . . 1 . 1 1 7 LYS HB2 . . . . . . . . . . 760 . 26802 2 136 2 1 . . 33.888 . . 1 . 1 1 7 LYS CB . . . . . . . . . . 370 . 26802 2 137 1 1 . . 4.846 . . 1 . 1 1 26 ASP HA . . . . . . . . . . 596 . 26802 2 137 2 1 . . 55.247 . . 1 . 1 1 26 ASP CA . . . . . . . . . . 214 . 26802 2 138 1 1 . . 4.607 . . 1 . 1 1 29 VAL HA . . . . . . . . . . 482 . 26802 2 138 2 1 . . 58.033 . . 1 . 1 1 29 VAL CA . . . . . . . . . . 278 . 26802 2 139 1 1 . . 4.250 . . 1 . 1 1 40 ARG HA . . . . . . . . . . 689 . 26802 2 139 2 1 . . 55.683 . . 1 . 1 1 40 ARG CA . . . . . . . . . . 240 . 26802 2 140 1 1 . . 4.292 . . 1 . 1 1 35 GLN HA . . . . . . . . . . 705 . 26802 2 140 2 1 . . 55.728 . . 1 . 1 1 35 GLN CA . . . . . . . . . . 204 . 26802 2 141 1 1 . . 4.820 . . 1 . 1 1 37 ASN HA . . . . . . . . . . 706 . 26802 2 141 2 1 . . 52.935 . . 1 . 1 1 37 ASN CA . . . . . . . . . . 243 . 26802 2 142 1 1 . . 4.496 . . 1 . 1 1 39 PHE HA . . . . . . . . . . 541 . 26802 2 142 2 1 . . 58.132 . . 1 . 1 1 39 PHE CA . . . . . . . . . . 241 . 26802 2 143 1 1 . . 4.506 . . 1 . 1 1 74 PHE HA . . . . . . . . . . 561 . 26802 2 143 2 1 . . 57.821 . . 1 . 1 1 74 PHE CA . . . . . . . . . . 282 . 26802 2 144 1 1 . . 4.468 . . 1 . 1 1 73 TYR HA . . . . . . . . . . 572 . 26802 2 144 2 1 . . 57.936 . . 1 . 1 1 73 TYR CA . . . . . . . . . . 281 . 26802 2 145 1 1 . . 0.331 . . 1 . 1 1 34 ILE MD . . . . . . . . . . 487 . 26802 2 145 2 1 . . 14.385 . . 1 . 1 1 34 ILE CD1 . . . . . . . . . . 305 . 26802 2 146 1 1 . . 0.828 . . 1 . 1 1 67 LEU MD1 . . . . . . . . . . 700 . 26802 2 146 2 1 . . 23.689 . . 1 . 1 1 67 LEU CD1 . . . . . . . . . . 376 . 26802 2 147 1 1 . . 0.831 . . 1 . 1 1 6 VAL MG1 . . . . . . . . . . 472 . 26802 2 147 2 1 . . 23.968 . . 1 . 1 1 6 VAL CG1 . . . . . . . . . . 292 . 26802 2 148 1 1 . . 2.383 . . 1 . 1 1 9 PHE HB3 . . . . . . . . . . 503 . 26802 2 148 2 1 . . 42.295 . . 1 . 1 1 9 PHE CB . . . . . . . . . . 306 . 26802 2 149 1 1 . . 1.872 . . 1 . 1 1 7 LYS HB3 . . . . . . . . . . 761 . 26802 2 149 2 2 . . 33.891 . . 1 . 1 1 7 LYS CB . . . . . . . . . . 370 . 26802 2 150 1 1 . . 1.608 . . 1 . 1 1 13 LYS HD3 . . . . . . . . . . 722 . 26802 2 150 2 1 . . 28.984 . . 1 . 1 1 13 LYS CD . . . . . . . . . . 381 . 26802 2 151 1 1 . . 1.650 . . 1 . 1 1 52 ILE HG13 . . . . . . . . . . 793 . 26802 2 151 2 1 . . 28.921 . . 1 . 1 1 52 ILE CG1 . . . . . . . . . . 358 . 26802 2 152 1 1 . . 1.770 . . 1 . 1 1 13 LYS HD2 . . . . . . . . . . 721 . 26802 2 152 2 1 . . 29.001 . . 1 . 1 1 13 LYS CD . . . . . . . . . . 381 . 26802 2 153 1 1 . . 4.087 . . 1 . 1 1 14 GLY HA2 . . . . . . . . . . 687 . 26802 2 153 2 1 . . 46.363 . . 1 . 1 1 14 GLY CA . . . . . . . . . . 266 . 26802 2 154 1 2 . . 1.793 . . 1 . 1 1 20 PRO HG2 . . . . . . . . . . 510 . 26802 2 154 2 1 . . 28.798 . . 1 . 1 1 20 PRO CG . . . . . . . . . . 314 . 26802 2 155 1 1 . . 4.154 . . 1 . 1 1 23 GLY HA2 . . . . . . . . . . 664 . 26802 2 155 2 1 . . 45.894 . . 1 . 1 1 23 GLY CA . . . . . . . . . . 211 . 26802 2 156 1 1 . . 3.968 . . 1 . 1 1 23 GLY HA3 . . . . . . . . . . 665 . 26802 2 156 2 1 . . 45.881 . . 1 . 1 1 23 GLY CA . . . . . . . . . . 211 . 26802 2 157 1 1 . . 3.062 . . 1 . 1 1 28 PHE HB2 . . . . . . . . . . 537 . 26802 2 157 2 1 . . 40.436 . . 1 . 1 1 28 PHE CB . . . . . . . . . . 316 . 26802 2 158 1 1 . . 2.755 . . 1 . 1 1 28 PHE HB3 . . . . . . . . . . 538 . 26802 2 158 2 1 . . 40.450 . . 1 . 1 1 28 PHE CB . . . . . . . . . . 316 . 26802 2 159 1 1 . . 0.551 . . 1 . 1 1 48 VAL MG2 . . . . . . . . . . 586 . 26802 2 159 2 1 . . 22.918 . . 1 . 1 1 48 VAL CG2 . . . . . . . . . . 329 . 26802 2 160 1 1 . . 0.545 . . 1 . 1 1 29 VAL MG1 . . . . . . . . . . 484 . 26802 2 160 2 1 . . 22.808 . . 1 . 1 1 29 VAL CG1 . . . . . . . . . . 289 . 26802 2 161 1 1 . . 4.458 . . 1 . 1 1 33 GLU HA . . . . . . . . . . 567 . 26802 2 161 2 1 . . 55.859 . . 1 . 1 1 33 GLU CA . . . . . . . . . . 206 . 26802 2 162 1 1 . . 2.300 . . 1 . 1 1 33 GLU HG3 . . . . . . . . . . 569 . 26802 2 162 2 1 . . 35.682 . . 1 . 1 1 33 GLU CG . . . . . . . . . . 326 . 26802 2 163 1 1 . . 2.775 . . 1 . 1 1 33 GLU HG2 . . . . . . . . . . 568 . 26802 2 163 2 1 . . 35.649 . . 1 . 1 1 33 GLU CG . . . . . . . . . . 326 . 26802 2 164 1 1 . . 2.565 . . 1 . 1 1 33 GLU HB2 . . . . . . . . . . 570 . 26802 2 164 2 1 . . 30.379 . . 1 . 1 1 33 GLU CB . . . . . . . . . . 325 . 26802 2 165 1 1 . . 1.871 . . 1 . 1 1 33 GLU HB3 . . . . . . . . . . 571 . 26802 2 165 2 1 . . 30.374 . . 1 . 1 1 33 GLU CB . . . . . . . . . . 325 . 26802 2 166 1 1 . . 1.722 . . 1 . 1 1 35 GLN HB2 . . . . . . . . . . 780 . 26802 2 166 2 1 . . 29.764 . . 1 . 1 1 35 GLN CB . . . . . . . . . . 779 . 26802 2 167 1 1 . . 1.740 . . 1 . 1 1 40 ARG HB3 . . . . . . . . . . 695 . 26802 2 167 2 1 . . 30.958 . . 1 . 1 1 40 ARG CB . . . . . . . . . . 367 . 26802 2 168 1 1 . . 1.704 . . 1 . 1 1 40 ARG HB2 . . . . . . . . . . 692 . 26802 2 168 2 1 . . 30.966 . . 1 . 1 1 40 ARG CB . . . . . . . . . . 367 . 26802 2 169 1 1 . . 1.493 . . 1 . 1 1 40 ARG HG3 . . . . . . . . . . 694 . 26802 2 169 1 2 . . 1.493 . . 1 . 1 1 40 ARG HG2 . . . . . . . . . . 693 . 26802 2 169 2 1 . . 26.694 . . 1 . 1 1 40 ARG CG . . . . . . . . . . 368 . 26802 2 170 1 1 . . 4.503 . . 1 . 1 1 42 LEU HA . . . . . . . . . . 644 . 26802 2 170 2 1 . . 52.843 . . 1 . 1 1 42 LEU CA . . . . . . . . . . 238 . 26802 2 171 1 1 . . 1.992 . . 1 . 1 1 43 GLU HB2 . . . . . . . . . . 741 . 26802 2 171 2 1 . . 32.789 . . 1 . 1 1 43 GLU CB . . . . . . . . . . 740 . 26802 2 172 1 1 . . 1.713 . . 1 . 1 1 43 GLU HB3 . . . . . . . . . . 742 . 26802 2 172 2 1 . . 32.782 . . 1 . 1 1 43 GLU CB . . . . . . . . . . 740 . 26802 2 173 1 2 . . 2.071 . . 1 . 1 1 44 GLU HB3 . . . . . . . . . . 886 . 26802 2 173 2 2 . . 29.753 . . 1 . 1 1 44 GLU CB . . . . . . . . . . 884 . 26802 2 174 1 2 . . 1.995 . . 1 . 1 1 44 GLU HB2 . . . . . . . . . . 885 . 26802 2 174 2 2 . . 29.750 . . 1 . 1 1 44 GLU CB . . . . . . . . . . 884 . 26802 2 175 1 1 . . 2.347 . . 1 . 1 1 63 GLN HG3 . . . . . . . . . . 616 . 26802 2 175 1 2 . . 2.347 . . 1 . 1 1 63 GLN HG2 . . . . . . . . . . 615 . 26802 2 175 2 1 . . 34.226 . . 1 . 1 1 63 GLN CG . . . . . . . . . . 613 . 26802 2 176 1 1 . . 2.398 . . 1 . 1 1 46 GLN HG3 . . . . . . . . . . 533 . 26802 2 176 2 1 . . 34.057 . . 1 . 1 1 46 GLN CG . . . . . . . . . . 310 . 26802 2 177 1 1 . . 2.318 . . 1 . 1 1 46 GLN HG2 . . . . . . . . . . 532 . 26802 2 177 2 1 . . 34.053 . . 1 . 1 1 46 GLN CG . . . . . . . . . . 310 . 26802 2 178 1 1 . . 1.852 . . 1 . 1 1 47 LYS HB2 . . . . . . . . . . 675 . 26802 2 178 1 2 . . 1.852 . . 1 . 1 1 47 LYS HB3 . . . . . . . . . . 676 . 26802 2 178 2 1 . . 32.539 . . 1 . 1 1 47 LYS CB . . . . . . . . . . 362 . 26802 2 179 1 1 . . 1.705 . . 1 . 1 1 47 LYS HD3 . . . . . . . . . . 678 . 26802 2 179 1 2 . . 1.705 . . 1 . 1 1 47 LYS HD2 . . . . . . . . . . 677 . 26802 2 179 2 1 . . 28.557 . . 1 . 1 1 47 LYS CD . . . . . . . . . . 363 . 26802 2 180 1 1 . . 2.316 . . 1 . 1 1 49 GLU HG3 . . . . . . . . . . 640 . 26802 2 180 1 2 . . 2.316 . . 1 . 1 1 49 GLU HG2 . . . . . . . . . . 639 . 26802 2 180 2 1 . . 36.695 . . 1 . 1 1 49 GLU CG . . . . . . . . . . 637 . 26802 2 181 1 1 . . 2.770 . . 1 . 1 1 57 LYS HE3 . . . . . . . . . . 521 . 26802 2 181 1 2 . . 2.770 . . 1 . 1 1 57 LYS HE2 . . . . . . . . . . 520 . 26802 2 181 2 1 . . 42.002 . . 1 . 1 1 57 LYS CE . . . . . . . . . . 383 . 26802 2 182 1 1 . . 1.125 . . 1 . 1 1 57 LYS HG3 . . . . . . . . . . 527 . 26802 2 182 1 2 . . 1.125 . . 1 . 1 1 57 LYS HG2 . . . . . . . . . . 526 . 26802 2 182 2 1 . . 24.690 . . 1 . 1 1 57 LYS CG . . . . . . . . . . 386 . 26802 2 183 1 1 . . 1.824 . . 1 . 1 1 49 GLU HB2 . . . . . . . . . . 641 . 26802 2 183 2 1 . . 33.260 . . 1 . 1 1 49 GLU CB . . . . . . . . . . 743 . 26802 2 184 1 1 . . 1.674 . . 1 . 1 1 49 GLU HB3 . . . . . . . . . . 642 . 26802 2 184 2 1 . . 33.260 . . 1 . 1 1 49 GLU CB . . . . . . . . . . 743 . 26802 2 185 1 1 . . 4.659 . . 1 . 1 1 51 GLU HA . . . . . . . . . . 553 . 26802 2 185 2 1 . . 53.738 . . 1 . 1 1 51 GLU CA . . . . . . . . . . 221 . 26802 2 186 1 2 . . 2.218 . . 1 . 1 1 51 GLU HG2 . . . . . . . . . . 554 . 26802 2 186 2 2 . . 35.682 . . 1 . 1 1 51 GLU CG . . . . . . . . . . 745 . 26802 2 187 1 1 . . 2.058 . . 1 . 1 1 51 GLU HB2 . . . . . . . . . . 556 . 26802 2 187 2 2 . . 32.414 . . 1 . 1 1 51 GLU CB . . . . . . . . . . 744 . 26802 2 188 1 1 . . 1.662 . . 1 . 1 1 51 GLU HB3 . . . . . . . . . . 557 . 26802 2 188 2 1 . . 32.391 . . 1 . 1 1 51 GLU CB . . . . . . . . . . 744 . 26802 2 189 1 1 . . 4.576 . . 1 . 1 1 53 GLY HA2 . . . . . . . . . . 577 . 26802 2 189 2 1 . . 43.804 . . 1 . 1 1 53 GLY CA . . . . . . . . . . 246 . 26802 2 190 1 1 . . 3.683 . . 1 . 1 1 53 GLY HA3 . . . . . . . . . . 578 . 26802 2 190 2 1 . . 43.796 . . 1 . 1 1 53 GLY CA . . . . . . . . . . 246 . 26802 2 191 1 1 . . 1.965 . . 1 . 1 1 54 GLU HB2 . . . . . . . . . . 748 . 26802 2 191 2 1 . . 31.093 . . 1 . 1 1 54 GLU CB . . . . . . . . . . 747 . 26802 2 192 1 1 . . 1.873 . . 1 . 1 1 54 GLU HB3 . . . . . . . . . . 749 . 26802 2 192 2 1 . . 31.093 . . 1 . 1 1 54 GLU CB . . . . . . . . . . 747 . 26802 2 193 1 1 . . 2.114 . . 1 . 1 1 3 GLN HB2 . . . . . . . . . . 757 . 26802 2 193 2 2 . . 31.872 . . 1 . 1 1 3 GLN CB . . . . . . . . . . 756 . 26802 2 194 1 1 . . 4.765 . . 1 . 1 1 61 ALA HA . . . . . . . . . . 632 . 26802 2 194 2 1 . . 51.145 . . 1 . 1 1 61 ALA CA . . . . . . . . . . 200 . 26802 2 195 1 1 . . 4.472 . . 1 . 1 1 66 ALA HA . . . . . . . . . . 548 . 26802 2 195 2 1 . . 52.486 . . 1 . 1 1 66 ALA CA . . . . . . . . . . 193 . 26802 2 196 1 1 . . 0.828 . . 1 . 1 1 67 LEU MD2 . . . . . . . . . . 701 . 26802 2 196 2 1 . . 25.308 . . 1 . 1 1 67 LEU CD2 . . . . . . . . . . 375 . 26802 2 197 1 2 . . 0.834 . . 1 . 1 1 72 LEU MD2 . . . . . . . . . . 602 . 26802 2 197 2 1 . . 24.957 . . 1 . 1 1 72 LEU CD2 . . . . . . . . . . 338 . 26802 2 198 1 1 . . 3.973 . . 1 . 1 1 69 GLY HA2 . . . . . . . . . . 590 . 26802 2 198 1 2 . . 3.973 . . 1 . 1 1 69 GLY HA3 . . . . . . . . . . 591 . 26802 2 198 2 1 . . 45.342 . . 1 . 1 1 69 GLY CA . . . . . . . . . . 219 . 26802 2 199 1 1 . . 2.243 . . 1 . 1 1 70 GLU HG2 . . . . . . . . . . 621 . 26802 2 199 1 2 . . 2.243 . . 1 . 1 1 70 GLU HG3 . . . . . . . . . . 622 . 26802 2 199 2 1 . . 36.271 . . 1 . 1 1 70 GLU CG . . . . . . . . . . 620 . 26802 2 200 1 1 . . 0.765 . . 1 . 1 1 72 LEU MD1 . . . . . . . . . . 601 . 26802 2 200 2 1 . . 23.332 . . 1 . 1 1 72 LEU CD1 . . . . . . . . . . 339 . 26802 2 201 1 1 . . 2.243 . . 1 . 1 1 75 GLN HG3 . . . . . . . . . . 737 . 26802 2 201 1 2 . . 2.243 . . 1 . 1 1 75 GLN HG2 . . . . . . . . . . 736 . 26802 2 201 2 1 . . 33.797 . . 1 . 1 1 75 GLN CG . . . . . . . . . . 751 . 26802 2 202 1 1 . . 2.038 . . 1 . 1 1 75 GLN HB3 . . . . . . . . . . 755 . 26802 2 202 2 1 . . 29.242 . . 1 . 1 1 75 GLN CB . . . . . . . . . . 753 . 26802 2 203 1 1 . . 1.867 . . 1 . 1 1 75 GLN HB2 . . . . . . . . . . 754 . 26802 2 203 2 1 . . 29.240 . . 1 . 1 1 75 GLN CB . . . . . . . . . . 753 . 26802 2 204 1 1 . . 2.007 . . 1 . 1 1 3 GLN HB3 . . . . . . . . . . 758 . 26802 2 204 2 1 . . 31.868 . . 1 . 1 1 3 GLN CB . . . . . . . . . . 756 . 26802 2 205 1 1 . . 3.919 . . 1 . 1 1 4 GLY HA3 . . . . . . . . . . 667 . 26802 2 205 2 1 . . 46.365 . . 1 . 1 1 4 GLY CA . . . . . . . . . . 190 . 26802 2 206 1 1 . . 4.737 . . 1 . 1 1 4 GLY HA2 . . . . . . . . . . 666 . 26802 2 206 2 1 . . 46.324 . . 1 . 1 1 4 GLY CA . . . . . . . . . . 190 . 26802 2 207 1 1 . . 2.118 . . 1 . 1 1 12 GLU HB2 . . . . . . . . . . 762 . 26802 2 207 1 2 . . 2.118 . . 1 . 1 1 12 GLU HB3 . . . . . . . . . . 763 . 26802 2 207 2 1 . . 29.363 . . 1 . 1 1 12 GLU CB . . . . . . . . . . 764 . 26802 2 208 1 1 . . 2.857 . . 1 . 1 1 15 PHE HB3 . . . . . . . . . . 729 . 26802 2 208 2 1 . . 42.383 . . 1 . 1 1 15 PHE CB . . . . . . . . . . 391 . 26802 2 209 1 1 . . 2.965 . . 1 . 1 1 15 PHE HB2 . . . . . . . . . . 728 . 26802 2 209 2 1 . . 42.380 . . 1 . 1 1 15 PHE CB . . . . . . . . . . 391 . 26802 2 210 1 1 . . 3.123 . . 1 . 1 1 22 ASP HB2 . . . . . . . . . . 725 . 26802 2 210 2 1 . . 39.920 . . 1 . 1 1 22 ASP CB . . . . . . . . . . 390 . 26802 2 211 1 1 . . 0.810 . . 1 . 1 1 27 VAL MG2 . . . . . . . . . . 478 . 26802 2 211 2 2 . . 22.234 . . 1 . 1 1 27 VAL CG2 . . . . . . . . . . 774 . 26802 2 212 1 1 . . 4.227 . . 1 . 1 1 36 GLY HA2 . . . . . . . . . . 650 . 26802 2 212 2 1 . . 44.917 . . 1 . 1 1 36 GLY CA . . . . . . . . . . 203 . 26802 2 213 1 1 . . 3.768 . . 1 . 1 1 36 GLY HA3 . . . . . . . . . . 651 . 26802 2 213 2 1 . . 44.928 . . 1 . 1 1 36 GLY CA . . . . . . . . . . 203 . 26802 2 214 1 1 . . 3.836 . . 1 . 1 1 38 GLY HA3 . . . . . . . . . . 576 . 26802 2 214 1 2 . . 3.836 . . 1 . 1 1 38 GLY HA2 . . . . . . . . . . 575 . 26802 2 214 2 1 . . 45.273 . . 1 . 1 1 38 GLY CA . . . . . . . . . . 242 . 26802 2 215 1 1 . . 2.222 . . 1 . 1 1 60 GLN HG2 . . . . . . . . . . 771 . 26802 2 215 1 2 . . 2.222 . . 1 . 1 1 60 GLN HG3 . . . . . . . . . . 772 . 26802 2 215 2 1 . . 32.171 . . 1 . 1 1 60 GLN CG . . . . . . . . . . 315 . 26802 2 216 1 1 . . 2.121 . . 1 . 1 1 60 GLN HB2 . . . . . . . . . . 769 . 26802 2 216 1 2 . . 2.121 . . 1 . 1 1 60 GLN HB3 . . . . . . . . . . 770 . 26802 2 216 2 1 . . 32.185 . . 1 . 1 1 60 GLN CB . . . . . . . . . . 768 . 26802 2 217 1 1 . . 2.779 . . 1 . 1 1 9 PHE HB2 . . . . . . . . . . 502 . 26802 2 217 2 1 . . 42.295 . . 1 . 1 1 9 PHE CB . . . . . . . . . . 306 . 26802 2 218 1 1 . . 4.772 . . 1 . 1 1 10 ASN HA . . . . . . . . . . 479 . 26802 2 218 2 1 . . 51.606 . . 1 . 1 1 10 ASN CA . . . . . . . . . . 264 . 26802 2 219 1 1 . . 1.904 . . 1 . 1 1 13 LYS HB2 . . . . . . . . . . 719 . 26802 2 219 2 1 . . 33.806 . . 1 . 1 1 13 LYS CB . . . . . . . . . . 380 . 26802 2 220 1 1 . . 3.689 . . 1 . 1 1 14 GLY HA3 . . . . . . . . . . 688 . 26802 2 220 2 1 . . 46.349 . . 1 . 1 1 14 GLY CA . . . . . . . . . . 266 . 26802 2 221 1 1 . . 2.672 . . 1 . 1 1 22 ASP HB3 . . . . . . . . . . 726 . 26802 2 221 2 1 . . 39.922 . . 1 . 1 1 22 ASP CB . . . . . . . . . . 390 . 26802 2 222 1 2 . . 1.979 . . 1 . 1 1 35 GLN HB3 . . . . . . . . . . 782 . 26802 2 222 2 1 . . 29.764 . . 1 . 1 1 35 GLN CB . . . . . . . . . . 779 . 26802 2 223 1 1 . . 3.866 . . 1 . 1 1 16 GLY HA2 . . . . . . . . . . 681 . 26802 2 223 2 1 . . 45.270 . . 1 . 1 1 16 GLY CA . . . . . . . . . . 268 . 26802 2 224 1 1 . . 2.294 . . 1 . 1 1 51 GLU HG3 . . . . . . . . . . 555 . 26802 2 224 2 1 . . 35.683 . . 1 . 1 1 51 GLU CG . . . . . . . . . . 745 . 26802 2 225 1 1 . . 2.202 . . 1 . 1 1 54 GLU HG2 . . . . . . . . . . 685 . 26802 2 225 1 2 . . 2.202 . . 1 . 1 1 54 GLU HG3 . . . . . . . . . . 686 . 26802 2 225 2 1 . . 35.854 . . 1 . 1 1 54 GLU CG . . . . . . . . . . 684 . 26802 2 226 1 1 . . 2.178 . . 1 . 1 1 43 GLU HG2 . . . . . . . . . . 581 . 26802 2 226 1 2 . . 2.178 . . 1 . 1 1 43 GLU HG3 . . . . . . . . . . 582 . 26802 2 226 2 1 . . 35.985 . . 1 . 1 1 43 GLU CG . . . . . . . . . . 580 . 26802 2 227 1 2 . . 4.245 . . 1 . 1 1 45 ASN HA . . . . . . . . . . 592 . 26802 2 227 2 1 . . 55.657 . . 1 . 1 1 45 ASN CA . . . . . . . . . . 229 . 26802 2 228 1 1 . . 4.417 . . 1 . 1 1 67 LEU HA . . . . . . . . . . 699 . 26802 2 228 2 1 . . 54.925 . . 1 . 1 1 67 LEU CA . . . . . . . . . . 274 . 26802 2 229 1 1 . . 4.772 . . 1 . 1 1 62 GLN HA . . . . . . . . . . 627 . 26802 2 229 2 1 . . 53.610 . . 1 . 1 1 62 GLN CA . . . . . . . . . . 273 . 26802 2 230 1 1 . . 4.005 . . 1 . 1 1 68 GLY HA3 . . . . . . . . . . 713 . 26802 2 230 1 2 . . 4.005 . . 1 . 1 1 68 GLY HA2 . . . . . . . . . . 712 . 26802 2 230 2 1 . . 45.301 . . 1 . 1 1 68 GLY CA . . . . . . . . . . 275 . 26802 2 231 1 2 . . 4.227 . . 1 . 1 1 70 GLU HA . . . . . . . . . . 619 . 26802 2 231 2 1 . . 56.980 . . 1 . 1 1 70 GLU CA . . . . . . . . . . 276 . 26802 2 232 1 1 . . 4.213 . . 1 . 1 1 46 GLN HA . . . . . . . . . . 531 . 26802 2 232 2 2 . . 56.896 . . 1 . 1 1 46 GLN CA . . . . . . . . . . 228 . 26802 2 233 1 1 . . 2.020 . . 1 . 1 1 70 GLU HB3 . . . . . . . . . . 625 . 26802 2 233 2 1 . . 30.149 . . 1 . 1 1 70 GLU CB . . . . . . . . . . 623 . 26802 2 234 1 1 . . 4.604 . . 1 . 1 1 8 TRP HA . . . . . . . . . . 587 . 26802 2 234 2 1 . . 56.117 . . 1 . 1 1 8 TRP CA . . . . . . . . . . 262 . 26802 2 235 1 1 . . 2.287 . . 1 . 1 1 12 GLU HG3 . . . . . . . . . . 767 . 26802 2 235 2 1 . . 36.585 . . 1 . 1 1 12 GLU CG . . . . . . . . . . 765 . 26802 2 236 1 3 . . 2.213 . . 1 . 1 1 12 GLU HG2 . . . . . . . . . . 766 . 26802 2 236 2 1 . . 36.585 . . 1 . 1 1 12 GLU CG . . . . . . . . . . 765 . 26802 2 237 1 1 . . 3.021 . . 1 . 1 1 50 PHE HB3 . . . . . . . . . . 636 . 26802 2 237 2 1 . . 41.338 . . 1 . 1 1 50 PHE CB . . . . . . . . . . 348 . 26802 2 238 1 1 . . 2.969 . . 1 . 1 1 50 PHE HB2 . . . . . . . . . . 635 . 26802 2 238 2 1 . . 41.335 . . 1 . 1 1 50 PHE CB . . . . . . . . . . 348 . 26802 2 239 1 2 . . 1.115 . . 1 . 1 1 52 ILE HG12 . . . . . . . . . . 792 . 26802 2 239 2 1 . . 28.885 . . 1 . 1 1 52 ILE CG1 . . . . . . . . . . 358 . 26802 2 240 1 1 . . 1.369 . . 1 . 1 1 57 LYS HB3 . . . . . . . . . . 794 . 26802 2 240 2 1 . . 32.122 . . 1 . 1 1 57 LYS CB . . . . . . . . . . 384 . 26802 2 241 1 1 . . 1.794 . . 1 . 1 1 62 GLN HB2 . . . . . . . . . . 630 . 26802 2 241 2 1 . . 32.607 . . 1 . 1 1 62 GLN CB . . . . . . . . . . 795 . 26802 2 242 1 1 . . 2.053 . . 1 . 1 1 62 GLN HB3 . . . . . . . . . . 796 . 26802 2 242 2 1 . . 32.607 . . 1 . 1 1 62 GLN CB . . . . . . . . . . 795 . 26802 2 243 1 1 . . 2.197 . . 1 . 1 1 62 GLN HG3 . . . . . . . . . . 629 . 26802 2 243 2 1 . . 34.565 . . 1 . 1 1 62 GLN CG . . . . . . . . . . 346 . 26802 2 244 1 2 . . 2.145 . . 1 . 1 1 62 GLN HG2 . . . . . . . . . . 628 . 26802 2 244 2 1 . . 34.575 . . 1 . 1 1 62 GLN CG . . . . . . . . . . 346 . 26802 2 245 1 1 . . 3.747 . . 1 . 1 1 76 GLY HA2 . . . . . . . . . . 798 . 26802 2 245 1 2 . . 3.747 . . 1 . 1 1 76 GLY HA3 . . . . . . . . . . 799 . 26802 2 245 2 1 . . 46.134 . . 1 . 1 1 76 GLY CA . . . . . . . . . . 797 . 26802 2 246 1 1 . . 1.431 . . 1 . 1 1 19 ALA MB . . . . . . . . . . 801 . 26802 2 246 2 1 . . 19.641 . . 1 . 1 1 19 ALA CB . . . . . . . . . . 800 . 26802 2 247 1 1 . . 1.448 . . 1 . 1 1 25 ALA MB . . . . . . . . . . 653 . 26802 2 247 2 1 . . 19.506 . . 1 . 1 1 25 ALA CB . . . . . . . . . . 354 . 26802 2 248 1 2 . . 3.118 . . 1 . 1 1 31 TYR HB2 . . . . . . . . . . 880 . 26802 2 248 2 1 . . 37.096 . . 1 . 1 1 31 TYR CB . . . . . . . . . . 859 . 26802 2 249 1 2 . . 2.853 . . 1 . 1 1 31 TYR HB3 . . . . . . . . . . 881 . 26802 2 249 2 1 . . 37.096 . . 1 . 1 1 31 TYR CB . . . . . . . . . . 859 . 26802 2 250 1 1 . . 4.024 . . 1 . 1 1 31 TYR HA . . . . . . . . . . 869 . 26802 2 250 2 1 . . 60.317 . . 1 . 1 1 31 TYR CA . . . . . . . . . . 855 . 26802 2 251 1 1 . . 2.885 . . 1 . 1 1 30 HIS HB3 . . . . . . . . . . 552 . 26802 2 251 2 1 . . 34.684 . . 1 . 1 1 30 HIS CB . . . . . . . . . . 862 . 26802 2 252 1 1 . . 3.123 . . 1 . 1 1 30 HIS HB2 . . . . . . . . . . 551 . 26802 2 252 2 1 . . 34.679 . . 1 . 1 1 30 HIS CB . . . . . . . . . . 862 . 26802 2 253 1 1 . . 4.809 . . 1 . 1 1 30 HIS HA . . . . . . . . . . 870 . 26802 2 253 2 1 . . 55.736 . . 1 . 1 1 30 HIS CA . . . . . . . . . . 861 . 26802 2 254 1 1 . . 3.785 . . 1 . 1 1 63 GLN HA . . . . . . . . . . 612 . 26802 2 254 2 1 . . 56.480 . . 1 . 1 1 63 GLN CA . . . . . . . . . . 272 . 26802 2 255 1 1 . . 4.532 . . 1 . 1 1 58 GLY HA2 . . . . . . . . . . 878 . 26802 2 255 2 2 . . 44.148 . . 1 . 1 1 58 GLY CA . . . . . . . . . . 277 . 26802 2 256 1 1 . . 3.861 . . 1 . 1 1 58 GLY HA3 . . . . . . . . . . 879 . 26802 2 256 2 1 . . 44.151 . . 1 . 1 1 58 GLY CA . . . . . . . . . . 277 . 26802 2 257 1 1 . . 2.190 . . 1 . 1 1 35 GLN HG3 . . . . . . . . . . 785 . 26802 2 257 2 1 . . 33.842 . . 1 . 1 1 35 GLN CG . . . . . . . . . . 377 . 26802 2 258 1 2 . . 2.137 . . 1 . 1 1 35 GLN HG2 . . . . . . . . . . 784 . 26802 2 258 2 1 . . 33.839 . . 1 . 1 1 35 GLN CG . . . . . . . . . . 377 . 26802 2 259 1 1 . . 2.263 . . 1 . 1 1 20 PRO HG3 . . . . . . . . . . 882 . 26802 2 259 2 1 . . 28.761 . . 1 . 1 1 20 PRO CG . . . . . . . . . . 314 . 26802 2 260 1 1 . . 2.095 . . 1 . 1 1 46 GLN HB3 . . . . . . . . . . 535 . 26802 2 260 2 1 . . 30.332 . . 1 . 1 1 46 GLN CB . . . . . . . . . . 883 . 26802 2 261 1 1 . . 1.998 . . 1 . 1 1 46 GLN HB2 . . . . . . . . . . 534 . 26802 2 261 2 1 . . 30.329 . . 1 . 1 1 46 GLN CB . . . . . . . . . . 883 . 26802 2 262 1 1 . . 0.325 . . 1 . 1 1 34 ILE HG12 . . . . . . . . . . 887 . 26802 2 262 2 1 . . 27.407 . . 1 . 1 1 34 ILE CG1 . . . . . . . . . . 303 . 26802 2 263 1 3 . . 1.533 . . 1 . 1 1 34 ILE HG13 . . . . . . . . . . 888 . 26802 2 263 2 1 . . 27.406 . . 1 . 1 1 34 ILE CG1 . . . . . . . . . . 303 . 26802 2 264 1 1 . . 1.791 . . 1 . 1 1 57 LYS HB2 . . . . . . . . . . 523 . 26802 2 264 2 1 . . 32.121 . . 1 . 1 1 57 LYS CB . . . . . . . . . . 384 . 26802 2 265 1 1 . . 1.798 . . 1 . 1 1 64 VAL HB . . . . . . . . . . 545 . 26802 2 265 2 1 . . 32.167 . . 1 . 1 1 64 VAL CB . . . . . . . . . . 319 . 26802 2 266 1 1 . . 1.529 . . 1 . 1 1 7 LYS HG3 . . . . . . . . . . 940 . 26802 2 266 2 1 . . 24.846 . . 1 . 1 1 7 LYS CG . . . . . . . . . . 372 . 26802 2 267 1 1 . . 1.614 . . 1 . 1 1 7 LYS HG2 . . . . . . . . . . 939 . 26802 2 267 2 2 . . 24.846 . . 1 . 1 1 7 LYS CG . . . . . . . . . . 372 . 26802 2 268 1 1 . . 1.621 . . 1 . 1 1 47 LYS HG2 . . . . . . . . . . 672 . 26802 2 268 2 1 . . 24.722 . . 1 . 1 1 47 LYS CG . . . . . . . . . . 364 . 26802 2 269 1 1 . . 1.545 . . 1 . 1 1 47 LYS HG3 . . . . . . . . . . 674 . 26802 2 269 2 1 . . 24.722 . . 1 . 1 1 47 LYS CG . . . . . . . . . . 364 . 26802 2 270 1 1 . . 1.615 . . 1 . 1 1 7 LYS HD3 . . . . . . . . . . 943 . 26802 2 270 2 1 . . 28.845 . . 1 . 1 1 7 LYS CD . . . . . . . . . . 371 . 26802 2 271 1 1 . . 1.746 . . 1 . 1 1 7 LYS HD2 . . . . . . . . . . 942 . 26802 2 271 2 2 . . 28.845 . . 1 . 1 1 7 LYS CD . . . . . . . . . . 371 . 26802 2 stop_ save_ save_peak_list_1_2_3 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode peak_list_1_2_3 _Spectral_peak_list.Entry_ID 26802 _Spectral_peak_list.ID 3 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $CspA _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $CspA_1 _Spectral_peak_list.Chem_shift_reference_ID . _Spectral_peak_list.Chem_shift_reference_label . _Spectral_peak_list.Experiment_ID 3 _Spectral_peak_list.Experiment_name 'hbcbcgcdhd (hbCBcgcdHD)' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details 'Default list' _Spectral_peak_list.Text_data_format . _Spectral_peak_list.Text_data . loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . H 1 1H . . 1810.481 . . . . . . . 26802 3 2 . . C 13 13C . . 7500.469 . . . . . . . 26802 3 stop_ loop_ _Peak.ID _Peak.Figure_of_merit _Peak.Restraint _Peak.Details _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 1.0 . . 26802 3 2 1.0 . . 26802 3 3 1.0 . . 26802 3 4 1.0 . . 26802 3 5 1.0 . . 26802 3 6 1.0 . . 26802 3 7 1.0 . . 26802 3 8 1.0 . . 26802 3 9 1.0 . . 26802 3 10 1.0 . . 26802 3 11 1.0 . . 26802 3 stop_ loop_ _Peak_general_char.Peak_ID _Peak_general_char.Intensity_val _Peak_general_char.Intensity_val_err _Peak_general_char.Measurement_method _Peak_general_char.Entry_ID _Peak_general_char.Spectral_peak_list_ID 1 118115.5468750 . height 26802 3 1 709345.7968750 . volume 26802 3 2 32367.1152344 . height 26802 3 2 195455.0810550 . volume 26802 3 3 43036.6992188 . height 26802 3 3 252772.3066410 . volume 26802 3 4 16584.7207031 . height 26802 3 4 94071.8774414 . volume 26802 3 5 36194.4531250 . height 26802 3 5 217857.2460940 . volume 26802 3 6 40424.4218750 . height 26802 3 6 251132.0439450 . volume 26802 3 7 199998.8437500 . height 26802 3 7 1194679.9609400 . volume 26802 3 8 102126.4843750 . height 26802 3 8 639003.4960940 . volume 26802 3 9 44697.7421875 . height 26802 3 9 362636.4169920 . volume 26802 3 10 113472.5781250 . height 26802 3 10 629967.3359380 . volume 26802 3 11 40311.0625000 . height 26802 3 11 257104.7089840 . volume 26802 3 stop_ loop_ _Peak_char.Peak_ID _Peak_char.Spectral_dim_ID _Peak_char.Chem_shift_val _Peak_char.Chem_shift_val_err _Peak_char.Line_width_val _Peak_char.Line_width_val_err _Peak_char.Phase_val _Peak_char.Phase_val_err _Peak_char.Decay_rate_val _Peak_char.Decay_rate_val_err _Peak_char.Coupling_pattern _Peak_char.Bounding_box_upper_val _Peak_char.Bounding_box_lower_val _Peak_char.Bounding_box_range_val _Peak_char.Details _Peak_char.Derivation_method_ID _Peak_char.Entry_ID _Peak_char.Spectral_peak_list_ID 1 1 7.315 . 25.1772065065 . . . . . . . . . . 1 26802 3 1 2 34.671 . 144.8642148170 . . . . . . . . . . 1 26802 3 2 1 6.703 . 24.9665601804 . . . . . . . . . . 1 26802 3 2 2 42.275 . 144.3024804210 . . . . . . . . . . 1 26802 3 3 1 6.960 . 23.1739212277 . . . . . . . . . . 1 26802 3 3 2 42.428 . 140.5337410980 . . . . . . . . . . 1 26802 3 4 1 6.788 . 23.9977754379 . . . . . . . . . . 1 26802 3 4 2 45.332 . 134.3699746410 . . . . . . . . . . 1 26802 3 5 1 6.835 . 28.2337234156 . . . . . . . . . . 1 26802 3 5 2 40.434 . 137.5920679370 . . . . . . . . . . 1 26802 3 6 1 6.727 . 26.1459912490 . . . . . . . . . . 1 26802 3 6 2 41.303 . 150.5439240370 . . . . . . . . . . 1 26802 3 7 1 6.934 . 23.3087013906 . . . . . . . . . . 1 26802 3 7 2 38.589 . 148.2721744680 . . . . . . . . . . 1 26802 3 8 1 7.148 . 21.9222341789 . . . . . . . . . . 1 26802 3 8 2 39.509 . 175.0232941880 . . . . . . . . . . 1 26802 3 9 1 7.138 . 30.1329412472 . . . . . . . . . . 1 26802 3 9 2 38.987 . 219.3245343390 . . . . . . . . . . 1 26802 3 10 1 7.142 . 23.3750973638 . . . . . . . . . . 1 26802 3 10 2 30.811 . 132.5997177560 . . . . . . . . . . 1 26802 3 11 1 6.971 . 36.8944999565 . . . . . . . . . . 1 26802 3 11 2 37.054 . 148.4954823320 . . . . . . . . . . 1 26802 3 stop_ loop_ _Assigned_peak_chem_shift.Peak_ID _Assigned_peak_chem_shift.Spectral_dim_ID _Assigned_peak_chem_shift.Set_ID _Assigned_peak_chem_shift.Magnetization_linkage_ID _Assigned_peak_chem_shift.Assembly_atom_ID _Assigned_peak_chem_shift.Val _Assigned_peak_chem_shift.Contribution_fractional_val _Assigned_peak_chem_shift.Figure_of_merit _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID _Assigned_peak_chem_shift.Atom_chem_shift_ID _Assigned_peak_chem_shift.Entity_assembly_ID _Assigned_peak_chem_shift.Entity_ID _Assigned_peak_chem_shift.Comp_index_ID _Assigned_peak_chem_shift.Comp_ID _Assigned_peak_chem_shift.Atom_ID _Assigned_peak_chem_shift.Ambiguity_code _Assigned_peak_chem_shift.Ambiguity_set_ID _Assigned_peak_chem_shift.Auth_atom_peak_num _Assigned_peak_chem_shift.Auth_entity_ID _Assigned_peak_chem_shift.Auth_seq_ID _Assigned_peak_chem_shift.Auth_comp_ID _Assigned_peak_chem_shift.Auth_atom_ID _Assigned_peak_chem_shift.Auth_ambiguity_code _Assigned_peak_chem_shift.Auth_ambiguity_set_ID _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID _Assigned_peak_chem_shift.Resonance_ID _Assigned_peak_chem_shift.Details _Assigned_peak_chem_shift.Entry_ID _Assigned_peak_chem_shift.Spectral_peak_list_ID 1 1 1 . . 7.315 . . 1 . 1 1 30 HIS HD2 . . . . . . . . . . 871 . 26802 3 1 2 1 . . 34.671 . . 1 . 1 1 30 HIS CB . . . . . . . . . . 862 . 26802 3 2 1 1 . . 6.703 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 3 2 2 1 . . 42.275 . . 1 . 1 1 9 PHE CB . . . . . . . . . . 306 . 26802 3 3 1 1 . . 6.960 . . 1 . 1 1 15 PHE QD . . . . . . . . . . 807 . 26802 3 3 2 1 . . 42.428 . . 1 . 1 1 15 PHE CB . . . . . . . . . . 391 . 26802 3 4 1 1 . . 6.788 . . 1 . 1 1 17 PHE QD . . . . . . . . . . 811 . 26802 3 4 2 1 . . 45.332 . . 1 . 1 1 17 PHE CB . . . . . . . . . . 324 . 26802 3 5 1 1 . . 6.835 . . 1 . 1 1 28 PHE QD . . . . . . . . . . 872 . 26802 3 5 2 1 . . 40.434 . . 1 . 1 1 28 PHE CB . . . . . . . . . . 316 . 26802 3 6 1 1 . . 6.727 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 3 6 2 1 . . 41.303 . . 1 . 1 1 50 PHE CB . . . . . . . . . . 348 . 26802 3 7 1 1 . . 6.934 . . 1 . 1 1 73 TYR QD . . . . . . . . . . 803 . 26802 3 7 2 1 . . 38.589 . . 1 . 1 1 73 TYR CB . . . . . . . . . . 327 . 26802 3 8 1 1 . . 7.148 . . 1 . 1 1 74 PHE QD . . . . . . . . . . 813 . 26802 3 8 2 1 . . 39.509 . . 1 . 1 1 74 PHE CB . . . . . . . . . . 323 . 26802 3 9 1 1 . . 7.138 . . 1 . 1 1 39 PHE QD . . . . . . . . . . 815 . 26802 3 9 2 1 . . 38.987 . . 1 . 1 1 39 PHE CB . . . . . . . . . . 317 . 26802 3 10 1 1 . . 7.142 . . 1 . 1 1 8 TRP HD1 . . . . . . . . . . 787 . 26802 3 10 2 1 . . 30.811 . . 1 . 1 1 8 TRP CB . . . . . . . . . . 331 . 26802 3 11 1 1 . . 6.971 . . 1 . 1 1 31 TYR QD . . . . . . . . . . 868 . 26802 3 11 2 1 . . 37.054 . . 1 . 1 1 31 TYR CB . . . . . . . . . . 859 . 26802 3 stop_ save_ save_peak_list_1_2_3_4 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode peak_list_1_2_3_4 _Spectral_peak_list.Entry_ID 26802 _Spectral_peak_list.ID 4 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $CspA _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $CspA_1 _Spectral_peak_list.Chem_shift_reference_ID . _Spectral_peak_list.Chem_shift_reference_label . _Spectral_peak_list.Experiment_ID 4 _Spectral_peak_list.Experiment_name 'hbcbcgcdcehe (hbCBcgcdceHE)' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details 'Default list' _Spectral_peak_list.Text_data_format . _Spectral_peak_list.Text_data . loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . H 1 1H . . 1810.481 . . . . . . . 26802 4 2 . . C 13 13C . . 7500.469 . . . . . . . 26802 4 stop_ loop_ _Peak.ID _Peak.Figure_of_merit _Peak.Restraint _Peak.Details _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 1.0 . . 26802 4 2 1.0 . . 26802 4 3 1.0 . . 26802 4 4 1.0 . . 26802 4 5 1.0 . . 26802 4 6 1.0 . . 26802 4 7 1.0 . . 26802 4 8 1.0 . . 26802 4 9 1.0 . . 26802 4 10 1.0 . . 26802 4 stop_ loop_ _Peak_general_char.Peak_ID _Peak_general_char.Intensity_val _Peak_general_char.Intensity_val_err _Peak_general_char.Measurement_method _Peak_general_char.Entry_ID _Peak_general_char.Spectral_peak_list_ID 1 12395.66992190 . height 26802 4 1 77892.48730470 . volume 26802 4 2 102854.34375000 . height 26802 4 2 632128.01562500 . volume 26802 4 3 9704.76757812 . height 26802 4 3 65675.24804690 . volume 26802 4 4 7047.29199219 . height 26802 4 4 46965.93139650 . volume 26802 4 5 3212.27685547 . height 26802 4 5 19781.74877930 . volume 26802 4 6 33501.43750000 . height 26802 4 6 213340.52636700 . volume 26802 4 7 15371.43164060 . height 26802 4 7 98032.66259770 . volume 26802 4 8 12950.43261720 . height 26802 4 8 88034.06542970 . volume 26802 4 9 3280.26025391 . height 26802 4 9 16915.57031250 . volume 26802 4 10 84137.71875000 . height 26802 4 10 547271.65039100 . volume 26802 4 stop_ loop_ _Peak_char.Peak_ID _Peak_char.Spectral_dim_ID _Peak_char.Chem_shift_val _Peak_char.Chem_shift_val_err _Peak_char.Line_width_val _Peak_char.Line_width_val_err _Peak_char.Phase_val _Peak_char.Phase_val_err _Peak_char.Decay_rate_val _Peak_char.Decay_rate_val_err _Peak_char.Coupling_pattern _Peak_char.Bounding_box_upper_val _Peak_char.Bounding_box_lower_val _Peak_char.Bounding_box_range_val _Peak_char.Details _Peak_char.Derivation_method_ID _Peak_char.Entry_ID _Peak_char.Spectral_peak_list_ID 1 1 6.956 . 25.4617307790 . . . . . . . . . . 1 26802 4 1 2 42.279 . 175.8653369540 . . . . . . . . . . 1 26802 4 2 1 6.715 . 19.6108276348 . . . . . . . . . . 1 26802 4 2 2 38.593 . 180.5688845710 . . . . . . . . . . 1 26802 4 3 1 6.802 . 27.5725890450 . . . . . . . . . . 1 26802 4 3 2 41.319 . 171.0401882570 . . . . . . . . . . 1 26802 4 4 1 7.583 . 29.4702895533 . . . . . . . . . . 1 26802 4 4 2 42.462 . 183.1560369390 . . . . . . . . . . 1 26802 4 5 1 7.554 . 17.5355741440 . . . . . . . . . . 1 26802 4 5 2 45.332 . 206.5416679740 . . . . . . . . . . 1 26802 4 6 1 7.249 . 21.3293793551 . . . . . . . . . . 1 26802 4 6 2 39.512 . 184.8162046120 . . . . . . . . . . 1 26802 4 7 1 7.218 . 49.9735648740 . . . . . . . . . . 1 26802 4 7 2 38.989 . 183.6565237330 . . . . . . . . . . 1 26802 4 8 1 6.861 . 29.5290989101 . . . . . . . . . . 1 26802 4 8 2 37.091 . 178.5705138980 . . . . . . . . . . 1 26802 4 10 1 7.221 . 24.4465891947 . . . . . . . . . . 1 26802 4 10 2 31.427 . 184.9395939420 . . . . . . . . . . 1 26802 4 stop_ loop_ _Assigned_peak_chem_shift.Peak_ID _Assigned_peak_chem_shift.Spectral_dim_ID _Assigned_peak_chem_shift.Set_ID _Assigned_peak_chem_shift.Magnetization_linkage_ID _Assigned_peak_chem_shift.Assembly_atom_ID _Assigned_peak_chem_shift.Val _Assigned_peak_chem_shift.Contribution_fractional_val _Assigned_peak_chem_shift.Figure_of_merit _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID _Assigned_peak_chem_shift.Atom_chem_shift_ID _Assigned_peak_chem_shift.Entity_assembly_ID _Assigned_peak_chem_shift.Entity_ID _Assigned_peak_chem_shift.Comp_index_ID _Assigned_peak_chem_shift.Comp_ID _Assigned_peak_chem_shift.Atom_ID _Assigned_peak_chem_shift.Ambiguity_code _Assigned_peak_chem_shift.Ambiguity_set_ID _Assigned_peak_chem_shift.Auth_atom_peak_num _Assigned_peak_chem_shift.Auth_entity_ID _Assigned_peak_chem_shift.Auth_seq_ID _Assigned_peak_chem_shift.Auth_comp_ID _Assigned_peak_chem_shift.Auth_atom_ID _Assigned_peak_chem_shift.Auth_ambiguity_code _Assigned_peak_chem_shift.Auth_ambiguity_set_ID _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID _Assigned_peak_chem_shift.Resonance_ID _Assigned_peak_chem_shift.Details _Assigned_peak_chem_shift.Entry_ID _Assigned_peak_chem_shift.Spectral_peak_list_ID 1 1 1 . . 6.956 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 4 1 2 1 . . 42.279 . . 1 . 1 1 9 PHE CB . . . . . . . . . . 306 . 26802 4 2 1 1 . . 6.715 . . 1 . 1 1 73 TYR QE . . . . . . . . . . 802 . 26802 4 2 2 1 . . 38.593 . . 1 . 1 1 73 TYR CB . . . . . . . . . . 327 . 26802 4 3 1 1 . . 6.802 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 4 3 2 1 . . 41.319 . . 1 . 1 1 50 PHE CB . . . . . . . . . . 348 . 26802 4 4 1 1 . . 7.583 . . 1 . 1 1 15 PHE QE . . . . . . . . . . 806 . 26802 4 4 2 1 . . 42.462 . . 1 . 1 1 15 PHE CB . . . . . . . . . . 391 . 26802 4 5 1 1 . . 7.554 . . 1 . 1 1 17 PHE QE . . . . . . . . . . 810 . 26802 4 5 2 1 . . 45.332 . . 1 . 1 1 17 PHE CB . . . . . . . . . . 324 . 26802 4 6 1 1 . . 7.249 . . 1 . 1 1 74 PHE QE . . . . . . . . . . 812 . 26802 4 6 2 1 . . 39.512 . . 1 . 1 1 74 PHE CB . . . . . . . . . . 323 . 26802 4 7 1 1 . . 7.218 . . 1 . 1 1 39 PHE QE . . . . . . . . . . 814 . 26802 4 7 2 1 . . 38.989 . . 1 . 1 1 39 PHE CB . . . . . . . . . . 317 . 26802 4 8 1 1 . . 6.861 . . 1 . 1 1 31 TYR QE . . . . . . . . . . 867 . 26802 4 8 2 1 . . 37.091 . . 1 . 1 1 31 TYR CB . . . . . . . . . . 859 . 26802 4 10 1 1 . . 7.221 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 4 10 2 1 . . 31.427 . . 1 . 1 1 65 HIS CB . . . . . . . . . . 311 . 26802 4 stop_ save_ save_peak_list_1_2_3_4_5 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode peak_list_1_2_3_4_5 _Spectral_peak_list.Entry_ID 26802 _Spectral_peak_list.ID 5 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $CspA _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $CspA_1 _Spectral_peak_list.Chem_shift_reference_ID . _Spectral_peak_list.Chem_shift_reference_label . _Spectral_peak_list.Experiment_ID 5 _Spectral_peak_list.Experiment_name '3D 1H-13C NOESY' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details 'Default list' _Spectral_peak_list.Text_data_format . _Spectral_peak_list.Text_data . loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . H 1 1H . . 12626.263 . . . . . . . 26802 5 2 . . H 1 1H . . 5999.700 . . . . . . . 26802 5 3 . . C 13 13C . . 8649.584 . . . . . . . 26802 5 stop_ loop_ _Peak.ID _Peak.Figure_of_merit _Peak.Restraint _Peak.Details _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 1.0 . . 26802 5 2 1.0 . . 26802 5 3 1.0 . . 26802 5 4 1.0 . . 26802 5 5 1.0 . . 26802 5 6 1.0 . . 26802 5 7 1.0 . . 26802 5 8 1.0 . . 26802 5 9 1.0 . . 26802 5 10 1.0 . . 26802 5 11 1.0 . . 26802 5 12 1.0 . . 26802 5 13 1.0 . . 26802 5 14 1.0 . . 26802 5 15 1.0 . . 26802 5 16 1.0 . . 26802 5 17 1.0 . . 26802 5 18 1.0 . . 26802 5 19 1.0 . . 26802 5 20 1.0 . . 26802 5 21 1.0 . . 26802 5 22 1.0 . . 26802 5 23 1.0 . . 26802 5 24 1.0 . . 26802 5 25 1.0 . . 26802 5 26 1.0 . . 26802 5 27 1.0 . . 26802 5 28 1.0 . . 26802 5 29 1.0 . . 26802 5 30 1.0 . . 26802 5 31 1.0 . . 26802 5 32 1.0 . . 26802 5 33 1.0 . . 26802 5 34 1.0 . . 26802 5 35 1.0 . . 26802 5 36 1.0 . . 26802 5 37 1.0 . . 26802 5 38 1.0 . . 26802 5 39 1.0 . . 26802 5 40 1.0 . . 26802 5 41 1.0 . . 26802 5 42 1.0 . . 26802 5 43 1.0 . . 26802 5 44 1.0 . . 26802 5 45 1.0 . . 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_Peak_char.Spectral_peak_list_ID 1 1 7.142 . 25.1095862307 . . . . . . . . . . 1 26802 5 1 2 7.142 . 124.3674557090 . . . . . . . . . . 1 26802 5 1 3 128.210 . 148.4554610710 . . . . . . . . . . 1 26802 5 2 1 10.355 . 21.3878705956 . . . . . . . . . . 1 26802 5 2 2 7.143 . 124.2405041640 . . . . . . . . . . 1 26802 5 2 3 128.222 . 151.1234601710 . . . . . . . . . . 1 26802 5 3 1 9.097 . 52.9222657595 . . . . . . . . . . 1 26802 5 3 2 7.141 . 119.0469343190 . . . . . . . . . . 1 26802 5 3 3 128.185 . 133.2847284060 . . . . . . . . . . 1 26802 5 4 1 7.377 . 27.0512527468 . . . . . . . . . . 1 26802 5 4 2 7.144 . 123.5896539870 . . . . . . . . . . 1 26802 5 4 3 128.216 . 157.1428270310 . . . . . . . . . . 1 26802 5 5 1 3.524 . 41.8105523126 . . . . . . . . . . 1 26802 5 5 2 7.142 . 122.3641245600 . . . . . . . . . . 1 26802 5 5 3 128.195 . 152.2074153610 . . . . . . . . . . 1 26802 5 6 1 3.354 . 38.6624937713 . . . . . . . . . . 1 26802 5 6 2 7.145 . 125.4152529720 . . . . . . . . . . 1 26802 5 6 3 128.215 . 150.4434426230 . . . . . . . . . . 1 26802 5 7 1 3.027 . 24.1233250023 . . . . . . . . . . 1 26802 5 7 2 7.138 . 118.9746971010 . . . . . . . . . . 1 26802 5 7 3 128.209 . 149.3615496540 . . . . . . . . . . 1 26802 5 8 1 2.234 . 35.6589313427 . . . . . . . . . . 1 26802 5 8 2 7.133 . 123.7287642720 . . . . . . . . . . 1 26802 5 8 3 128.212 . 160.4418659190 . . . . . . . . . . 1 26802 5 9 1 1.856 . 37.1859241183 . . . . . . . . . . 1 26802 5 9 2 7.145 . 126.8818115290 . . . . . . . . . . 1 26802 5 9 3 128.219 . 154.4036812880 . . . . . . . . . . 1 26802 5 10 1 1.737 . 34.7520677180 . . . . . . . . . . 1 26802 5 10 2 7.147 . 119.6505799770 . . . . . . . . . . 1 26802 5 10 3 128.267 . 150.5517092530 . . . . . . . . . . 1 26802 5 11 1 1.596 . 38.8423613284 . . . . . . . . . . 1 26802 5 11 2 7.144 . 121.9378534560 . . . . . . . . . . 1 26802 5 11 3 128.224 . 155.9294674400 . . . . . . . . . . 1 26802 5 12 1 1.517 . 35.3548874387 . . . . . . . . . . 1 26802 5 12 2 7.143 . 122.6605832400 . . . . . . . . . . 1 26802 5 12 3 128.231 . 148.3812210960 . . . . . . . . . . 1 26802 5 13 1 7.330 . 31.0361846083 . . . . . . . . . . 1 26802 5 13 2 7.336 . 127.8480737150 . . . . . . . . . . 1 26802 5 13 3 123.986 . 155.8472363570 . . . . . . . . . . 1 26802 5 14 1 6.956 . 32.2064526053 . . . . . . . . . . 1 26802 5 14 2 7.334 . 131.8558088420 . . . . . . . . . . 1 26802 5 14 3 123.964 . 164.1260246770 . . . . . . . . . . 1 26802 5 15 1 6.742 . 39.1930654355 . . . . . . . . . . 1 26802 5 15 2 7.336 . 125.9691908420 . . . . . . . . . . 1 26802 5 15 3 123.986 . 154.3495479730 . . . . . . . . . . 1 26802 5 16 1 7.647 . 30.7562233897 . . . . . . . . . . 1 26802 5 16 2 7.337 . 127.5476813260 . . . . . . . . . . 1 26802 5 16 3 123.984 . 153.2395572360 . . . . . . . . . . 1 26802 5 17 1 7.575 . 152.1397314170 . . . . . . . . . . 1 26802 5 17 2 7.334 . 125.8647687260 . . . . . . . . . . 1 26802 5 17 3 123.981 . 157.9940089660 . . . . . . . . . . 1 26802 5 18 1 10.353 . 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161.9354298600 . . . . . . . . . . 1 26802 5 24 1 7.647 . 41.1332267838 . . . . . . . . . . 1 26802 5 24 2 6.752 . 122.6570071400 . . . . . . . . . . 1 26802 5 24 3 122.379 . 159.8262927930 . . . . . . . . . . 1 26802 5 25 1 7.579 . 78.8011809035 . . . . . . . . . . 1 26802 5 25 2 6.739 . 126.5992996390 . . . . . . . . . . 1 26802 5 25 3 122.376 . 158.1383644730 . . . . . . . . . . 1 26802 5 26 1 7.531 . 82.6623127099 . . . . . . . . . . 1 26802 5 26 2 6.739 . 122.7979054750 . . . . . . . . . . 1 26802 5 26 3 122.317 . 161.7390032600 . . . . . . . . . . 1 26802 5 27 1 4.207 . 34.5609114020 . . . . . . . . . . 1 26802 5 27 2 6.750 . 150.9464604020 . . . . . . . . . . 1 26802 5 27 3 122.409 . 166.7801037830 . . . . . . . . . . 1 26802 5 28 1 3.862 . 39.3247676217 . . . . . . . . . . 1 26802 5 28 2 6.752 . 141.7877110180 . . . . . . . . . . 1 26802 5 28 3 122.380 . 156.4628094830 . . . . . . . . . . 1 26802 5 29 1 2.866 . 39.4632430632 . . . . . . . . . . 1 26802 5 29 2 6.751 . 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34.5134986150 . . . . . . . . . . 1 26802 5 35 2 7.327 . 118.7547669590 . . . . . . . . . . 1 26802 5 35 3 120.237 . 160.7625413670 . . . . . . . . . . 1 26802 5 36 1 9.097 . 26.9054396121 . . . . . . . . . . 1 26802 5 36 2 7.326 . 124.4529244960 . . . . . . . . . . 1 26802 5 36 3 120.228 . 161.6302210740 . . . . . . . . . . 1 26802 5 37 1 7.668 . 48.7147572035 . . . . . . . . . . 1 26802 5 37 2 7.327 . 116.5922993660 . . . . . . . . . . 1 26802 5 37 3 120.237 . 162.7412429220 . . . . . . . . . . 1 26802 5 38 1 4.219 . 34.8085115120 . . . . . . . . . . 1 26802 5 38 2 7.325 . 118.8194943670 . . . . . . . . . . 1 26802 5 38 3 120.232 . 161.5090655590 . . . . . . . . . . 1 26802 5 39 1 3.870 . 35.1712569619 . . . . . . . . . . 1 26802 5 39 2 7.328 . 116.2389806990 . . . . . . . . . . 1 26802 5 39 3 120.260 . 173.2518704900 . . . . . . . . . . 1 26802 5 40 1 3.524 . 38.4457496020 . . . . . . . . . . 1 26802 5 40 2 7.325 . 126.7319729450 . . . . . . . . . . 1 26802 5 40 3 120.200 . 152.5084997040 . . . . . . . . . . 1 26802 5 41 1 3.353 . 37.0233659914 . . . . . . . . . . 1 26802 5 41 2 7.327 . 127.3066521940 . . . . . . . . . . 1 26802 5 41 3 120.232 . 160.1351104670 . . . . . . . . . . 1 26802 5 42 1 2.871 . 44.8916308850 . . . . . . . . . . 1 26802 5 42 2 7.324 . 129.7945448760 . . . . . . . . . . 1 26802 5 42 3 120.229 . 155.4997520290 . . . . . . . . . . 1 26802 5 43 1 2.443 . 41.3665277992 . . . . . . . . . . 1 26802 5 43 2 7.326 . 124.3088076710 . . . . . . . . . . 1 26802 5 43 3 120.251 . 156.1962673500 . . . . . . . . . . 1 26802 5 44 1 2.382 . 46.4246443320 . . . . . . . . . . 1 26802 5 44 2 7.330 . 118.9611079220 . . . . . . . . . . 1 26802 5 44 3 120.258 . 153.6061171120 . . . . . . . . . . 1 26802 5 45 1 2.500 . 40.8908947612 . . . . . . . . . . 1 26802 5 45 2 7.309 . 137.4445377230 . . . . . . . . . . 1 26802 5 45 3 120.206 . 162.5401763230 . . . . . . . . . . 1 26802 5 46 1 7.647 . 30.2711830526 . . . . . . . . . . 1 26802 5 46 2 7.651 . 126.3314497590 . . . . . . . . . . 1 26802 5 46 3 115.305 . 155.7889785990 . . . . . . . . . . 1 26802 5 47 1 10.354 . 21.8586118382 . . . . . . . . . . 1 26802 5 47 2 7.651 . 126.1748165850 . . . . . . . . . . 1 26802 5 47 3 115.313 . 160.6527280700 . . . . . . . . . . 1 26802 5 48 1 7.331 . 31.6867934079 . . . . . . . . . . 1 26802 5 48 2 7.652 . 123.9962565420 . . . . . . . . . . 1 26802 5 48 3 115.303 . 158.0228800680 . . . . . . . . . . 1 26802 5 49 1 6.784 . 56.2910195357 . . . . . . . . . . 1 26802 5 49 2 7.654 . 125.3816376330 . . . . . . . . . . 1 26802 5 49 3 115.308 . 151.6763933180 . . . . . . . . . . 1 26802 5 50 1 6.752 . 80.9102973419 . . . . . . . . . . 1 26802 5 50 2 7.655 . 123.3464791950 . . . . . . . . . . 1 26802 5 50 3 115.285 . 154.6382589860 . . . . . . . . . . 1 26802 5 51 1 3.114 . 42.0927712830 . . . . . . . . . . 1 26802 5 51 2 7.311 . 127.0588284730 . . . . . . . . . . 1 26802 5 51 3 118.654 . 143.7662270960 . . . . . . . . . . 1 26802 5 52 1 2.956 . 39.8365246879 . . . . . . . . . . 1 26802 5 52 2 7.317 . 124.3821177180 . . . . . . . . . . 1 26802 5 52 3 118.642 . 162.4128341440 . . . . . . . . . . 1 26802 5 53 1 2.852 . 52.6582969493 . . . . . . . . . . 1 26802 5 53 2 7.316 . 126.4873677130 . . . . . . . . . . 1 26802 5 53 3 118.649 . 154.4279123910 . . . . . . . . . . 1 26802 5 54 1 7.314 . 29.5577334955 . . . . . . . . . . 1 26802 5 54 2 7.316 . 128.4982086720 . . . . . . . . . . 1 26802 5 54 3 118.643 . 147.3220125640 . . . . . . . . . . 1 26802 5 55 1 6.953 . 79.3825519824 . . . . . . . . . . 1 26802 5 55 2 7.308 . 130.3491979660 . . . . . . . . . . 1 26802 5 55 3 118.661 . 155.6569964210 . . . . . . . . . . 1 26802 5 56 1 5.149 . 53.3548133681 . . . . . . . . . . 1 26802 5 56 2 7.291 . 116.7378466310 . . . . . . . . . . 1 26802 5 56 3 118.629 . 102.6115031900 . . . . . . . . . . 1 26802 5 57 1 8.260 . 22.4074336625 . . . . . . . . . . 1 26802 5 57 2 7.313 . 119.4556825340 . . . . . . . . . . 1 26802 5 57 3 118.683 . 144.2261024960 . . . . . . . . . . 1 26802 5 58 1 8.966 . 21.8836352535 . . . . . . . . . . 1 26802 5 58 2 7.325 . 112.6274774370 . . . . . . . . . . 1 26802 5 58 3 118.664 . 140.5135881920 . . . . . . . . . . 1 26802 5 59 1 7.706 . 31.8945065701 . . . . . . . . . . 1 26802 5 59 2 7.318 . 118.3803493020 . . . . . . . . . . 1 26802 5 59 3 118.658 . 127.8701080090 . . . . . . . . . . 1 26802 5 60 1 3.236 . 112.7295455200 . . . . . . . . . . 1 26802 5 60 2 7.237 . 127.4150080200 . . . . . . . . . . 1 26802 5 60 3 120.952 . 144.9793289090 . . . . . . . . . . 1 26802 5 61 1 3.167 . 46.0965177425 . . . . . . . . . . 1 26802 5 61 2 7.235 . 117.4405502560 . . . . . . . . . . 1 26802 5 61 3 120.959 . 146.4842350680 . . . . . . . . . . 1 26802 5 62 1 2.309 . 41.3138469248 . . . . . . . . . . 1 26802 5 62 2 7.238 . 134.1441551510 . . . . . . . . . . 1 26802 5 62 3 120.928 . 140.1526994250 . . . . . . . . . . 1 26802 5 63 1 2.184 . 26.5759960007 . . . . . . . . . . 1 26802 5 63 2 7.239 . 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21.7970881026 . . . . . . . . . . 1 26802 5 70 2 7.244 . 137.0790603160 . . . . . . . . . . 1 26802 5 70 3 121.025 . 144.6978356700 . . . . . . . . . . 1 26802 5 71 1 7.222 . 24.9278372138 . . . . . . . . . . 1 26802 5 71 2 7.229 . 124.8366400120 . . . . . . . . . . 1 26802 5 71 3 120.953 . 153.5411571340 . . . . . . . . . . 1 26802 5 72 1 9.097 . 29.9947966076 . . . . . . . . . . 1 26802 5 72 2 7.233 . 125.6044286550 . . . . . . . . . . 1 26802 5 72 3 120.927 . 272.9783257640 . . . . . . . . . . 1 26802 5 73 1 8.863 . 22.2529658128 . . . . . . . . . . 1 26802 5 73 2 7.241 . 135.3982933760 . . . . . . . . . . 1 26802 5 73 3 120.929 . 135.4193854650 . . . . . . . . . . 1 26802 5 74 1 8.720 . 19.7225905245 . . . . . . . . . . 1 26802 5 74 2 7.244 . 161.6858459290 . . . . . . . . . . 1 26802 5 74 3 120.982 . 107.2494394040 . . . . . . . . . . 1 26802 5 75 1 5.045 . 36.9420869279 . . . . . . . . . . 1 26802 5 75 2 7.241 . 111.7148567500 . . . . . . . . . . 1 26802 5 75 3 120.942 . 155.1955743540 . . . . . . . . . . 1 26802 5 76 1 8.025 . 21.2661401464 . . . . . . . . . . 1 26802 5 76 2 6.721 . 113.6302158420 . . . . . . . . . . 1 26802 5 76 3 118.115 . 157.1691203560 . . . . . . . . . . 1 26802 5 77 1 6.932 . 27.3496522714 . . . . . . . . . . 1 26802 5 77 2 6.720 . 124.6009750310 . . . . . . . . . . 1 26802 5 77 3 118.127 . 156.7613160490 . . . . . . . . . . 1 26802 5 78 1 6.716 . 22.6260592916 . . . . . . . . . . 1 26802 5 78 2 6.718 . 122.4149051790 . . . . . . . . . . 1 26802 5 78 3 118.128 . 155.2837343240 . . . . . . . . . . 1 26802 5 79 1 2.934 . 89.6026416290 . . . . . . . . . . 1 26802 5 79 2 6.722 . 133.7786777440 . . . . . . . . . . 1 26802 5 79 3 118.162 . 151.1360912780 . . . . . . . . . . 1 26802 5 80 1 2.893 . 63.9282411656 . . . . . . . . . . 1 26802 5 80 2 6.715 . 117.0997479380 . . . . . . . . . . 1 26802 5 80 3 118.113 . 153.9685525460 . . . . . . . . . . 1 26802 5 81 1 2.818 . 35.1953396474 . . . . . . . . . . 1 26802 5 81 2 6.722 . 120.0178454340 . . . . . . . . . . 1 26802 5 81 3 118.163 . 171.2406889460 . . . . . . . . . . 1 26802 5 82 1 1.424 . 23.5837223310 . . . . . . . . . . 1 26802 5 82 2 6.724 . 134.7774824380 . . . . . . . . . . 1 26802 5 82 3 118.157 . 150.7391136340 . . . . . . . . . . 1 26802 5 83 1 0.820 . 21.1762063679 . . . . . . . . . . 1 26802 5 83 2 6.711 . 124.8073159930 . . . . . . . . . . 1 26802 5 83 3 118.262 . 159.4731373570 . . . . . . . . . . 1 26802 5 84 1 0.753 . 22.9620880123 . . . . . . . . . . 1 26802 5 84 2 6.716 . 121.8895761070 . . . . . . . . . . 1 26802 5 84 3 118.160 . 143.5182449570 . . . . . . . . . . 1 26802 5 85 1 4.214 . 27.5987575493 . . . . . . . . . . 1 26802 5 85 2 6.712 . 117.3532934190 . . . . . . . . . . 1 26802 5 85 3 118.256 . 142.7500674380 . . . . . . . . . . 1 26802 5 86 1 3.026 . 25.1084573548 . . . . . . . . . . 1 26802 5 86 2 6.727 . 125.0465570750 . . . . . . . . . . 1 26802 5 86 3 118.235 . 174.5469456090 . . . . . . . . . . 1 26802 5 87 1 6.934 . 28.5496473334 . . . . . . . . . . 1 26802 5 87 2 6.937 . 124.4468451260 . . . . . . . . . . 1 26802 5 87 3 133.081 . 157.7947468110 . . . . . . . . . . 1 26802 5 88 1 8.024 . 25.2409121249 . . . . . . . . . . 1 26802 5 88 2 6.933 . 119.6309114280 . . . . . . . . . . 1 26802 5 88 3 133.077 . 155.9560185420 . . . . . . . . . . 1 26802 5 89 1 7.141 . 345.2708275480 . . . . . . . . . . 1 26802 5 89 2 6.940 . 119.3104928790 . . . . . . . . . . 1 26802 5 89 3 133.065 . 168.2025210810 . . . . . . . . . . 1 26802 5 90 1 4.460 . 24.6343294846 . . . . . . . . . . 1 26802 5 90 2 6.931 . 124.0237925110 . . . . . . . . . . 1 26802 5 90 3 133.099 . 158.2414755500 . . . . . . . . . . 1 26802 5 91 1 2.897 . 34.1040929620 . . . . . . . . . . 1 26802 5 91 2 6.938 . 125.9606082020 . . . . . . . . . . 1 26802 5 91 3 133.071 . 162.2749230790 . . . . . . . . . . 1 26802 5 92 1 2.813 . 54.6436133327 . . . . . . . . . . 1 26802 5 92 2 6.939 . 125.7388900100 . . . . . . . . . . 1 26802 5 92 3 133.082 . 163.8450469940 . . . . . . . . . . 1 26802 5 93 1 6.717 . 23.3504213155 . . . . . . . . . . 1 26802 5 93 2 6.932 . 125.2890166460 . . . . . . . . . . 1 26802 5 93 3 133.086 . 157.2482581070 . . . . . . . . . . 1 26802 5 95 1 8.257 . 24.9263320460 . . . . . . . . . . 1 26802 5 95 2 6.972 . 128.0140047490 . . . . . . . . . . 1 26802 5 95 3 133.245 . 168.9356408340 . . . . . . . . . . 1 26802 5 96 1 7.578 . 40.0984238924 . . . . . . . . . . 1 26802 5 96 2 6.964 . 127.7404331090 . . . . . . . . . . 1 26802 5 96 3 132.681 . 160.4998659000 . . . . . . . . . . 1 26802 5 97 1 7.794 . 55.0304414681 . . . . . . . . . . 1 26802 5 97 2 6.978 . 113.6523876610 . . . . . . . . . . 1 26802 5 97 3 133.260 . 179.2044729280 . . . . . . . . . . 1 26802 5 98 1 4.080 . 43.9381070572 . . . . . . . . . . 1 26802 5 98 2 6.977 . 125.9845680710 . . . . . . . . . . 1 26802 5 98 3 133.249 . 155.0836988360 . . . . . . . . . . 1 26802 5 99 1 4.015 . 107.7527080510 . . . . . . . . . . 1 26802 5 99 2 6.976 . 129.0224649130 . . . . . . . . . . 1 26802 5 99 3 133.259 . 153.1212372760 . . . . . . . . . . 1 26802 5 100 1 3.816 . 37.7210112861 . . . . . . . . . . 1 26802 5 100 2 6.981 . 118.9671872910 . . . . . . . . . . 1 26802 5 100 3 133.220 . 139.6874106930 . . . . . . . . . . 1 26802 5 101 1 3.702 . 64.0674691910 . . . . . . . . . . 1 26802 5 101 2 6.981 . 119.1138073860 . . . . . . . . . . 1 26802 5 101 3 133.260 . 148.6173454600 . . . . . . . . . . 1 26802 5 102 1 3.106 . 43.1027389049 . . . . . . . . . . 1 26802 5 102 2 6.976 . 128.6673581960 . . . . . . . . . . 1 26802 5 102 3 133.262 . 162.1452609000 . . . . . . . . . . 1 26802 5 103 1 3.033 . 152.0136736100 . . . . . . . . . . 1 26802 5 103 2 6.973 . 125.6248124240 . . . . . . . . . . 1 26802 5 103 3 133.198 . 189.2619273160 . . . . . . . . . . 1 26802 5 104 1 1.681 . 44.5740404704 . . . . . . . . . . 1 26802 5 104 2 6.972 . 127.8048029070 . . . . . . . . . . 1 26802 5 104 3 133.266 . 142.5678186110 . . . . . . . . . . 1 26802 5 105 1 0.825 . 21.0843911295 . . . . . . . . . . 1 26802 5 105 2 6.967 . 112.8903207780 . . . . . . . . . . 1 26802 5 105 3 133.219 . 133.4811550070 . . . . . . . . . . 1 26802 5 106 1 0.318 . 23.1005634537 . . . . . . . . . . 1 26802 5 106 2 6.974 . 129.0289018930 . . . . . . . . . . 1 26802 5 106 3 133.283 . 158.6281420860 . . . . . . . . . . 1 26802 5 107 1 7.304 . 652.2825463060 . . . . . . . . . . 1 26802 5 107 2 6.980 . 125.9005297240 . . . . . . . . . . 1 26802 5 107 3 133.276 . 232.9114237140 . . . . . . . . . . 1 26802 5 108 1 6.863 . 33.0169854882 . . . . . . . . . . 1 26802 5 108 2 6.864 . 128.5175196110 . . . . . . . . . . 1 26802 5 108 3 118.478 . 164.0358024850 . . . . . . . . . . 1 26802 5 109 1 7.575 . 40.3524209658 . . . . . . . . . . 1 26802 5 109 2 6.860 . 131.0225775720 . . . . . . . . . . 1 26802 5 109 3 118.436 . 160.9610301890 . . . . . . . . . . 1 26802 5 110 1 8.259 . 24.7340468542 . . . . . . . . . . 1 26802 5 110 2 6.869 . 118.2805761160 . . . . . . . . . . 1 26802 5 110 3 118.489 . 176.9133448110 . . . . . . . . . . 1 26802 5 111 1 6.970 . 36.2839522891 . . . . . . . . . . 1 26802 5 111 2 6.869 . 130.1635983820 . . . . . . . . . . 1 26802 5 111 3 118.502 . 152.8446418130 . . . . . . . . . . 1 26802 5 112 1 3.111 . 44.5762982221 . . . . . . . . . . 1 26802 5 112 2 6.870 . 119.6466462670 . . . . . . . . . . 1 26802 5 112 3 118.519 . 172.1233197590 . . . . . . . . . . 1 26802 5 113 1 2.848 . 37.0489538447 . . . . . . . . . . 1 26802 5 113 2 6.857 . 132.7952502790 . . . . . . . . . . 1 26802 5 113 3 118.493 . 162.5546118740 . . . . . . . . . . 1 26802 5 114 1 4.078 . 80.6642023998 . . . . . . . . . . 1 26802 5 114 2 6.871 . 119.0000874100 . . . . . . . . . . 1 26802 5 114 3 118.473 . 156.3426850790 . . . . . . . . . . 1 26802 5 115 1 4.030 . 93.2082711943 . . . . . . . . . . 1 26802 5 115 2 6.871 . 113.8744634630 . . . . . . . . . . 1 26802 5 115 3 118.397 . 153.5303304710 . . . . . . . . . . 1 26802 5 116 1 3.929 . 24.0382830192 . . . . . . . . . . 1 26802 5 116 2 6.880 . 142.5333278420 . . . . . . . . . . 1 26802 5 116 3 118.351 . 140.6759881370 . . . . . . . . . . 1 26802 5 117 1 3.815 . 28.2128660288 . . . . . . . . . . 1 26802 5 117 2 6.877 . 141.7380032300 . . . . . . . . . . 1 26802 5 117 3 118.435 . 141.8607344050 . . . . . . . . . . 1 26802 5 118 1 8.386 . 26.5534184831 . . . . . . . . . . 1 26802 5 118 2 6.749 . 156.5713078920 . . . . . . . . . . 1 26802 5 118 3 132.191 . 181.2040544760 . . . . . . . . . . 1 26802 5 119 1 8.791 . 38.9546844786 . . . . . . . . . . 1 26802 5 119 2 6.730 . 126.8585668800 . . . . . . . . . . 1 26802 5 119 3 132.275 . 157.4171024940 . . . . . . . . . . 1 26802 5 120 1 9.294 . 25.9148510261 . . . . . . . . . . 1 26802 5 120 2 6.732 . 122.0240374620 . . . . . . . . . . 1 26802 5 120 3 132.269 . 162.5760074220 . . . . . . . . . . 1 26802 5 121 1 5.450 . 32.8664687040 . . . . . . . . . . 1 26802 5 121 2 6.728 . 124.1146254480 . . . . . . . . . . 1 26802 5 121 3 132.290 . 154.6439300960 . . . . . . . . . . 1 26802 5 122 1 5.387 . 35.1720095459 . . . . . . . . . . 1 26802 5 122 2 6.727 . 124.0606263400 . . . . . . . . . . 1 26802 5 122 3 132.257 . 159.6693061800 . . . . . . . . . . 1 26802 5 123 1 2.229 . 42.0543895030 . . . . . . . . . . 1 26802 5 123 2 6.790 . 133.1757473050 . . . . . . . . . . 1 26802 5 123 3 131.723 . 154.4294590570 . . . . . . . . . . 1 26802 5 124 1 9.388 . 29.0982810118 . . . . . . . . . . 1 26802 5 124 2 6.792 . 131.3315526010 . . . . . . . . . . 1 26802 5 124 3 131.733 . 156.8584982380 . . . . . . . . . . 1 26802 5 125 1 9.342 . 23.6700813359 . . . . . . . . . . 1 26802 5 125 2 6.790 . 119.8705101190 . . . . . . . . . . 1 26802 5 125 3 131.719 . 181.6427921060 . . . . . . . . . . 1 26802 5 126 1 8.384 . 22.1829755081 . . . . . . . . . . 1 26802 5 126 2 7.548 . 118.1507636900 . . . . . . . . . . 1 26802 5 126 3 131.508 . 141.3245568080 . . . . . . . . . . 1 26802 5 127 1 3.044 . 30.6896197127 . . . . . . . . . . 1 26802 5 127 2 7.565 . 126.7684491630 . . . . . . . . . . 1 26802 5 127 3 131.467 . 139.3778196860 . . . . . . . . . . 1 26802 5 128 1 6.787 . 40.7693524580 . . . . . . . . . . 1 26802 5 128 2 7.553 . 128.6104982080 . . . . . . . . . . 1 26802 5 128 3 131.507 . 152.3901797440 . . . . . . . . . . 1 26802 5 129 1 6.956 . 32.2625201074 . . . . . . . . . . 1 26802 5 129 2 7.582 . 131.9942039070 . . . . . . . . . . 1 26802 5 129 3 131.405 . 152.3597619770 . . . . . . . . . . 1 26802 5 130 1 2.858 . 46.6195635675 . . . . . . . . . . 1 26802 5 130 2 7.583 . 133.1296156170 . . . . . . . . . . 1 26802 5 130 3 131.433 . 142.6595874690 . . . . . . . . . . 1 26802 5 131 1 2.959 . 56.3391849067 . . . . . . . . . . 1 26802 5 131 2 7.573 . 108.6329738800 . . . . . . . . . . 1 26802 5 131 3 131.473 . 132.7065330460 . . . . . . . . . . 1 26802 5 132 1 7.329 . 42.0434770361 . . . . . . . . . . 1 26802 5 132 2 7.576 . 138.6933117990 . . . . . . . . . . 1 26802 5 132 3 131.433 . 157.0791559410 . . . . . . . . . . 1 26802 5 133 1 10.357 . 21.3574850198 . . . . . . . . . . 1 26802 5 133 2 7.545 . 134.5010499180 . . . . . . . . . . 1 26802 5 133 3 131.501 . 163.7893670130 . . . . . . . . . . 1 26802 5 134 1 2.988 . 51.7521859084 . . . . . . . . . . 1 26802 5 134 2 7.587 . 135.3779096070 . . . . . . . . . . 1 26802 5 134 3 131.406 . 163.7246648130 . . . . . . . . . . 1 26802 5 135 1 1.884 . 43.0989759853 . . . . . . . . . . 1 26802 5 135 2 7.581 . 127.7204069500 . . . . . . . . . . 1 26802 5 135 3 131.402 . 148.4281366350 . . . . . . . . . . 1 26802 5 136 1 1.764 . 24.6734638485 . . . . . . . . . . 1 26802 5 136 2 7.572 . 116.2303980590 . . . . . . . . . . 1 26802 5 136 3 131.407 . 160.1642393460 . . . . . . . . . . 1 26802 5 137 1 1.595 . 33.6608210326 . . . . . . . . . . 1 26802 5 137 2 7.584 . 153.0338298980 . . . . . . . . . . 1 26802 5 137 3 131.397 . 151.2484823510 . . . . . . . . . . 1 26802 5 138 1 1.148 . 36.9097258193 . . . . . . . . . . 1 26802 5 138 2 7.585 . 125.0951920330 . . . . . . . . . . 1 26802 5 138 3 131.407 . 152.3350153180 . . . . . . . . . . 1 26802 5 139 1 10.355 . 20.8930466676 . . . . . . . . . . 1 26802 5 139 2 6.792 . 126.8964735390 . . . . . . . . . . 1 26802 5 139 3 131.722 . 165.9853751620 . . . . . . . . . . 1 26802 5 140 1 3.018 . 35.9238408829 . . . . . . . . . . 1 26802 5 140 2 7.150 . 126.7173109350 . . . . . . . . . . 1 26802 5 140 3 131.756 . 158.0370578410 . . . . . . . . . . 1 26802 5 141 1 2.949 . 36.5815992298 . . . . . . . . . . 1 26802 5 141 2 7.149 . 125.7295921500 . . . . . . . . . . 1 26802 5 141 3 131.750 . 158.9325775390 . . . . . . . . . . 1 26802 5 142 1 3.011 . 97.0569853660 . . . . . . . . . . 1 26802 5 142 2 6.730 . 128.8357925000 . . . . . . . . . . 1 26802 5 142 3 132.263 . 159.8492350080 . . . . . . . . . . 1 26802 5 143 1 2.954 . 92.4406355949 . . . . . . . . . . 1 26802 5 143 2 6.730 . 125.6459114130 . . . . . . . . . . 1 26802 5 143 3 132.260 . 165.2321487490 . . . . . . . . . . 1 26802 5 144 1 1.959 . 30.6008148100 . . . . . . . . . . 1 26802 5 144 2 6.739 . 124.5534129020 . . . . . . . . . . 1 26802 5 144 3 132.280 . 149.3703140950 . . . . . . . . . . 1 26802 5 145 1 1.780 . 35.9095417884 . . . . . . . . . . 1 26802 5 145 2 6.737 . 126.8056406020 . . . . . . . . . . 1 26802 5 145 3 132.297 . 146.1370085190 . . . . . . . . . . 1 26802 5 146 1 1.642 . 35.8312730606 . . . . . . . . . . 1 26802 5 146 2 6.733 . 128.1627705040 . . . . . . . . . . 1 26802 5 146 3 132.279 . 153.1885172530 . . . . . . . . . . 1 26802 5 147 1 1.101 . 35.2284533399 . . . . . . . . . . 1 26802 5 147 2 6.734 . 126.2524179520 . . . . . . . . . . 1 26802 5 147 3 132.287 . 149.0854697470 . . . . . . . . . . 1 26802 5 148 1 0.961 . 23.9291583507 . . . . . . . . . . 1 26802 5 148 2 6.730 . 128.8937253180 . . . . . . . . . . 1 26802 5 148 3 132.246 . 167.2428147380 . . . . . . . . . . 1 26802 5 149 1 0.921 . 63.4255151064 . . . . . . . . . . 1 26802 5 149 2 6.729 . 132.6067898150 . . . . . . . . . . 1 26802 5 149 3 132.261 . 167.2928236100 . . . . . . . . . . 1 26802 5 150 1 0.770 . 67.2057441413 . . . . . . . . . . 1 26802 5 150 2 6.731 . 127.5970315040 . . . . . . . . . . 1 26802 5 150 3 132.248 . 164.1863446570 . . . . . . . . . . 1 26802 5 151 1 0.619 . 27.5061897270 . . . . . . . . . . 1 26802 5 151 2 6.729 . 128.5193076610 . . . . . . . . . . 1 26802 5 151 3 132.237 . 161.6508432890 . . . . . . . . . . 1 26802 5 152 1 0.095 . 23.6507023000 . . . . . . . . . . 1 26802 5 152 2 6.740 . 122.2700731340 . . . . . . . . . . 1 26802 5 152 3 132.258 . 161.0922390330 . . . . . . . . . . 1 26802 5 153 1 0.821 . 75.7061795285 . . . . . . . . . . 1 26802 5 153 2 6.728 . 129.4490936280 . . . . . . . . . . 1 26802 5 153 3 132.202 . 181.5719032410 . . . . . . . . . . 1 26802 5 154 1 0.531 . 159.4732854340 . . . . . . . . . . 1 26802 5 154 2 6.726 . 134.3730255420 . . . . . . . . . . 1 26802 5 154 3 132.096 . 203.9787134660 . . . . . . . . . . 1 26802 5 155 1 0.479 . 25.1204986976 . . . . . . . . . . 1 26802 5 155 2 6.726 . 127.4021340610 . . . . . . . . . . 1 26802 5 155 3 132.180 . 188.9330029820 . . . . . . . . . . 1 26802 5 156 1 2.309 . 127.0745476370 . . . . . . . . . . 1 26802 5 156 2 6.718 . 124.9317642690 . . . . . . . . . . 1 26802 5 156 3 132.109 . 214.5674476750 . . . . . . . . . . 1 26802 5 157 1 -0.104 . 25.9317841644 . . . . . . . . . . 1 26802 5 157 2 6.728 . 124.6986025570 . . . . . . . . . . 1 26802 5 157 3 132.216 . 169.4331517770 . . . . . . . . . . 1 26802 5 158 1 0.397 . 28.2866192530 . . . . . . . . . . 1 26802 5 158 2 6.711 . 133.8280279220 . . . . . . . . . . 1 26802 5 158 3 131.785 . 170.6475424790 . . . . . . . . . . 1 26802 5 159 1 8.865 . 25.8979178879 . . . . . . . . . . 1 26802 5 159 2 6.737 . 126.1823263940 . . . . . . . . . . 1 26802 5 159 3 132.298 . 144.3268935730 . . . . . . . . . . 1 26802 5 160 1 8.721 . 26.4474922962 . . . . . . . . . . 1 26802 5 160 2 6.728 . 126.9232942880 . . . . . . . . . . 1 26802 5 160 3 132.258 . 161.4154922580 . . . . . . . . . . 1 26802 5 161 1 6.070 . 39.6148887232 . . . . . . . . . . 1 26802 5 161 2 6.707 . 118.9092544730 . . . . . . . . . . 1 26802 5 161 3 131.764 . 158.2203377790 . . . . . . . . . . 1 26802 5 162 1 2.370 . 43.2126161574 . . . . . . . . . . 1 26802 5 162 2 6.711 . 134.4513421300 . . . . . . . . . . 1 26802 5 162 3 131.759 . 160.9801057380 . . . . . . . . . . 1 26802 5 163 1 2.767 . 50.1378933980 . . . . . . . . . . 1 26802 5 163 2 6.719 . 162.5555534180 . . . . . . . . . . 1 26802 5 163 3 131.771 . 161.5044255610 . . . . . . . . . . 1 26802 5 164 1 2.870 . 55.1395661367 . . . . . . . . . . 1 26802 5 164 2 6.722 . 160.7542719130 . . . . . . . . . . 1 26802 5 164 3 131.784 . 181.1470856070 . . . . . . . . . . 1 26802 5 165 1 4.024 . 34.3486827363 . . . . . . . . . . 1 26802 5 165 2 6.704 . 127.4779473780 . . . . . . . . . . 1 26802 5 165 3 131.782 . 143.9314625950 . . . . . . . . . . 1 26802 5 166 1 3.868 . 39.4655008149 . . . . . . . . . . 1 26802 5 166 2 6.707 . 133.1356949870 . . . . . . . . . . 1 26802 5 166 3 131.751 . 157.1002937120 . . . . . . . . . . 1 26802 5 167 1 4.219 . 37.5336178898 . . . . . . . . . . 1 26802 5 167 2 6.708 . 132.5488569970 . . . . . . . . . . 1 26802 5 167 3 131.763 . 154.6068101080 . . . . . . . . . . 1 26802 5 168 1 1.574 . 24.3852242068 . . . . . . . . . . 1 26802 5 168 2 6.709 . 132.2663451080 . . . . . . . . . . 1 26802 5 168 3 131.760 . 161.4928255650 . . . . . . . . . . 1 26802 5 169 1 0.237 . 27.5325301642 . . . . . . . . . . 1 26802 5 169 2 6.709 . 130.0302098570 . . . . . . . . . . 1 26802 5 169 3 131.788 . 164.8261488860 . . . . . . . . . . 1 26802 5 170 1 1.015 . 73.9391124821 . . . . . . . . . . 1 26802 5 170 2 6.704 . 126.9837303760 . . . . . . . . . . 1 26802 5 170 3 131.744 . 141.8207788620 . . . . . . . . . . 1 26802 5 171 1 0.321 . 228.4656638040 . . . . . . . . . . 1 26802 5 171 2 6.700 . 135.6572030070 . . . . . . . . . . 1 26802 5 171 3 131.844 . 157.8164001370 . . . . . . . . . . 1 26802 5 172 1 8.200 . 31.9705175461 . . . . . . . . . . 1 26802 5 172 2 6.703 . 127.8123127160 . . . . . . . . . . 1 26802 5 172 3 131.767 . 161.9880165090 . . . . . . . . . . 1 26802 5 173 1 8.096 . 28.1086331557 . . . . . . . . . . 1 26802 5 173 2 6.713 . 146.9394404950 . . . . . . . . . . 1 26802 5 173 3 131.744 . 147.4725547350 . . . . . . . . . . 1 26802 5 174 1 8.975 . 25.1400658795 . . . . . . . . . . 1 26802 5 174 2 6.714 . 161.3661426010 . . . . . . . . . . 1 26802 5 174 3 131.824 . 179.3289795530 . . . . . . . . . . 1 26802 5 175 1 9.096 . 26.6967857200 . . . . . . . . . . 1 26802 5 175 2 6.711 . 131.9416352390 . . . . . . . . . . 1 26802 5 175 3 131.895 . 213.1656525920 . . . . . . . . . . 1 26802 5 176 1 4.495 . 29.6533116535 . . . . . . . . . . 1 26802 5 176 2 7.142 . 126.6729672970 . . . . . . . . . . 1 26802 5 176 3 131.753 . 167.1940947540 . . . . . . . . . . 1 26802 5 177 1 8.022 . 25.3575626327 . . . . . . . . . . 1 26802 5 177 2 7.152 . 132.1343870220 . . . . . . . . . . 1 26802 5 177 3 131.814 . 140.4898726440 . . . . . . . . . . 1 26802 5 178 1 8.158 . 33.8060697293 . . . . . . . . . . 1 26802 5 178 2 7.138 . 130.3717273950 . . . . . . . . . . 1 26802 5 178 3 131.609 . 159.7332350470 . . . . . . . . . . 1 26802 5 179 1 1.780 . 31.8937539862 . . . . . . . . . . 1 26802 5 179 2 6.805 . 136.4807788070 . . . . . . . . . . 1 26802 5 179 3 130.300 . 165.0122643790 . . . . . . . . . . 1 26802 5 180 1 1.642 . 34.7249746968 . . . . . . . . . . 1 26802 5 180 2 6.809 . 124.8495139720 . . . . . . . . . . 1 26802 5 180 3 130.291 . 151.5127044840 . . . . . . . . . . 1 26802 5 181 1 1.104 . 38.4209143326 . . . . . . . . . . 1 26802 5 181 2 6.810 . 125.8451001760 . . . . . . . . . . 1 26802 5 181 3 130.297 . 155.0904010560 . . . . . . . . . . 1 26802 5 182 1 0.961 . 23.8862610672 . . . . . . . . . . 1 26802 5 182 2 6.809 . 129.6654476700 . . . . . . . . . . 1 26802 5 182 3 130.299 . 157.4663380330 . . . . . . . . . . 1 26802 5 183 1 0.921 . 23.8697042209 . . . . . . . . . . 1 26802 5 183 2 6.810 . 128.8279250800 . . . . . . . . . . 1 26802 5 183 3 130.299 . 158.6732531820 . . . . . . . . . . 1 26802 5 184 1 3.924 . 43.5271962363 . . . . . . . . . . 1 26802 5 184 2 6.809 . 129.9397345300 . . . . . . . . . . 1 26802 5 184 3 130.312 . 148.0128567750 . . . . . . . . . . 1 26802 5 185 1 3.006 . 103.1604409650 . . . . . . . . . . 1 26802 5 185 2 6.811 . 117.8596691610 . . . . . . . . . . 1 26802 5 185 3 130.274 . 165.1738909910 . . . . . . . . . . 1 26802 5 186 1 2.953 . 41.4327551843 . . . . . . . . . . 1 26802 5 186 2 6.811 . 137.8196706000 . . . . . . . . . . 1 26802 5 186 3 130.271 . 168.1012144480 . . . . . . . . . . 1 26802 5 187 1 2.460 . 28.6636637974 . . . . . . . . . . 1 26802 5 187 2 6.811 . 131.9791842880 . . . . . . . . . . 1 26802 5 187 3 130.298 . 153.8198148180 . . . . . . . . . . 1 26802 5 188 1 2.257 . 29.1731631119 . . . . . . . . . . 1 26802 5 188 2 6.806 . 146.9823536930 . . . . . . . . . . 1 26802 5 188 3 130.305 . 168.3435254780 . . . . . . . . . . 1 26802 5 189 1 0.823 . 46.9469375731 . . . . . . . . . . 1 26802 5 189 2 6.810 . 129.3886575400 . . . . . . . . . . 1 26802 5 189 3 130.300 . 157.7666490430 . . . . . . . . . . 1 26802 5 190 1 0.800 . 52.7132355755 . . . . . . . . . . 1 26802 5 190 2 6.812 . 129.9608335200 . . . . . . . . . . 1 26802 5 190 3 130.297 . 151.8707576970 . . . . . . . . . . 1 26802 5 191 1 0.095 . 22.3931345680 . . . . . . . . . . 1 26802 5 191 2 6.809 . 127.9753828700 . . . . . . . . . . 1 26802 5 191 3 130.306 . 156.7597693820 . . . . . . . . . . 1 26802 5 192 1 5.449 . 34.0875361158 . . . . . . . . . . 1 26802 5 192 2 6.809 . 127.9786013600 . . . . . . . . . . 1 26802 5 192 3 130.294 . 160.9527813020 . . . . . . . . . . 1 26802 5 193 1 5.390 . 27.5784377834 . . . . . . . . . . 1 26802 5 193 2 6.796 . 132.0070778670 . . . . . . . . . . 1 26802 5 193 3 130.342 . 132.4196264760 . . . . . . . . . . 1 26802 5 194 1 6.730 . 36.7577038673 . . . . . . . . . . 1 26802 5 194 2 6.811 . 137.2843284490 . . . . . . . . . . 1 26802 5 194 3 130.301 . 155.9160630000 . . . . . . . . . . 1 26802 5 195 1 9.197 . 22.7635940031 . . . . . . . . . . 1 26802 5 195 2 6.804 . 115.5852696420 . . . . . . . . . . 1 26802 5 195 3 130.271 . 145.3868754380 . . . . . . . . . . 1 26802 5 196 1 8.809 . 23.8644361335 . . . . . . . . . . 1 26802 5 196 2 6.810 . 128.5804589690 . . . . . . . . . . 1 26802 5 196 3 130.298 . 155.8650230170 . . . . . . . . . . 1 26802 5 197 1 8.391 . 32.9712660150 . . . . . . . . . . 1 26802 5 197 2 6.811 . 130.3030662780 . . . . . . . . . . 1 26802 5 197 3 130.285 . 155.2628543310 . . . . . . . . . . 1 26802 5 198 1 8.337 . 23.0920968846 . . . . . . . . . . 1 26802 5 198 2 6.807 . 132.7140728120 . . . . . . . . . . 1 26802 5 198 3 130.271 . 157.7269512790 . . . . . . . . . . 1 26802 5 199 1 0.479 . 23.4708347428 . . . . . . . . . . 1 26802 5 199 2 6.811 . 131.3165329810 . . . . . . . . . . 1 26802 5 199 3 130.301 . 156.7914760380 . . . . . . . . . . 1 26802 5 200 1 0.619 . 29.5727851740 . . . . . . . . . . 1 26802 5 200 2 6.812 . 138.2867092430 . . . . . . . . . . 1 26802 5 200 3 130.286 . 150.6403847780 . . . . . . . . . . 1 26802 5 201 1 -0.105 . 25.3304696115 . . . . . . . . . . 1 26802 5 201 2 6.809 . 126.2989072500 . . . . . . . . . . 1 26802 5 201 3 130.304 . 167.6782012580 . . . . . . . . . . 1 26802 5 202 1 2.372 . 37.0542219322 . . . . . . . . . . 1 26802 5 202 2 6.958 . 118.4611691590 . . . . . . . . . . 1 26802 5 202 3 130.531 . 150.0165627670 . . . . . . . . . . 1 26802 5 203 1 4.024 . 38.5465958474 . . . . . . . . . . 1 26802 5 203 2 6.960 . 131.2907850620 . . . . . . . . . . 1 26802 5 203 3 130.634 . 160.3506126170 . . . . . . . . . . 1 26802 5 204 1 5.131 . 41.6660561998 . . . . . . . . . . 1 26802 5 204 2 6.964 . 128.7242181840 . . . . . . . . . . 1 26802 5 204 3 130.693 . 155.2022765740 . . . . . . . . . . 1 26802 5 205 1 2.769 . 47.9644310343 . . . . . . . . . . 1 26802 5 205 2 6.963 . 128.6348156870 . . . . . . . . . . 1 26802 5 205 3 130.634 . 193.6513658360 . . . . . . . . . . 1 26802 5 206 1 1.572 . 31.7552785447 . . . . . . . . . . 1 26802 5 206 2 6.957 . 124.5258769330 . . . . . . . . . . 1 26802 5 206 3 130.607 . 160.3531903930 . . . . . . . . . . 1 26802 5 207 1 1.018 . 26.3607569993 . . . . . . . . . . 1 26802 5 207 2 6.961 . 125.5200326980 . . . . . . . . . . 1 26802 5 207 3 130.634 . 154.3204190940 . . . . . . . . . . 1 26802 5 208 1 1.050 . 78.0120966623 . . . . . . . . . . 1 26802 5 208 2 6.951 . 121.7214994130 . . . . . . . . . . 1 26802 5 208 3 130.598 . 148.7405631970 . . . . . . . . . . 1 26802 5 209 1 0.396 . 27.0553919584 . . . . . . . . . . 1 26802 5 209 2 6.957 . 134.4474084200 . . . . . . . . . . 1 26802 5 209 3 130.612 . 166.1859262050 . . . . . . . . . . 1 26802 5 210 1 0.316 . 50.3892564276 . . . . . . . . . . 1 26802 5 210 2 6.964 . 129.6686661600 . . . . . . . . . . 1 26802 5 210 3 130.637 . 151.3539134270 . . . . . . . . . . 1 26802 5 211 1 0.235 . 30.2486055350 . . . . . . . . . . 1 26802 5 211 2 6.955 . 131.9716744780 . . . . . . . . . . 1 26802 5 211 3 130.624 . 163.3838827050 . . . . . . . . . . 1 26802 5 212 1 0.528 . 25.9204954056 . . . . . . . . . . 1 26802 5 212 2 6.950 . 142.1628438950 . . . . . . . . . . 1 26802 5 212 3 130.623 . 183.9710402100 . . . . . . . . . . 1 26802 5 213 1 3.697 . 42.5503423069 . . . . . . . . . . 1 26802 5 213 2 6.969 . 115.8538347420 . . . . . . . . . . 1 26802 5 213 3 130.589 . 148.5482610390 . . . . . . . . . . 1 26802 5 214 1 3.870 . 37.1972128772 . . . . . . . . . . 1 26802 5 214 2 6.956 . 140.5378641130 . . . . . . . . . . 1 26802 5 214 3 130.607 . 166.9654459420 . . . . . . . . . . 1 26802 5 215 1 6.070 . 29.7801220442 . . . . . . . . . . 1 26802 5 215 2 6.963 . 126.6200410190 . . . . . . . . . . 1 26802 5 215 3 130.621 . 169.3743784640 . . . . . . . . . . 1 26802 5 216 1 8.194 . 37.1125471860 . . . . . . . . . . 1 26802 5 216 2 6.958 . 131.9548668090 . . . . . . . . . . 1 26802 5 216 3 130.682 . 156.9242315490 . . . . . . . . . . 1 26802 5 217 1 8.257 . 22.3905005243 . . . . . . . . . . 1 26802 5 217 2 6.942 . 120.7555948380 . . . . . . . . . . 1 26802 5 217 3 130.640 . 146.8590438310 . . . . . . . . . . 1 26802 5 218 1 8.095 . 31.5991173811 . . . . . . . . . . 1 26802 5 218 2 6.948 . 134.2031607990 . . . . . . . . . . 1 26802 5 218 3 130.713 . 193.0930193580 . . . . . . . . . . 1 26802 5 219 1 6.712 . 57.8402135370 . . . . . . . . . . 1 26802 5 219 2 6.937 . 240.3761355760 . . . . . . . . . . 1 26802 5 219 3 130.598 . 163.2204516490 . . . . . . . . . . 1 26802 5 220 1 2.954 . 40.9082041914 . . . . . . . . . . 1 26802 5 220 2 6.965 . 125.8139881070 . . . . . . . . . . 1 26802 5 220 3 132.685 . 167.8563256420 . . . . . . . . . . 1 26802 5 221 1 1.883 . 33.5328817660 . . . . . . . . . . 1 26802 5 221 2 6.963 . 127.2866260350 . . . . . . . . . . 1 26802 5 221 3 132.656 . 150.4398337350 . . . . . . . . . . 1 26802 5 222 1 1.150 . 38.7618348488 . . . . . . . . . . 1 26802 5 222 2 6.950 . 131.0418885110 . . . . . . . . . . 1 26802 5 222 3 132.643 . 159.3452796220 . . . . . . . . . . 1 26802 5 223 1 5.135 . 41.9843991984 . . . . . . . . . . 1 26802 5 223 2 6.956 . 129.7895383360 . . . . . . . . . . 1 26802 5 223 3 132.662 . 134.9963722740 . . . . . . . . . . 1 26802 5 224 1 6.665 . 33.5257322188 . . . . . . . . . . 1 26802 5 224 2 7.565 . 127.2862684250 . . . . . . . . . . 1 26802 5 224 3 131.418 . 145.0566622160 . . . . . . . . . . 1 26802 5 225 1 3.046 . 52.1811587434 . . . . . . . . . . 1 26802 5 225 2 6.820 . 155.4709419610 . . . . . . . . . . 1 26802 5 225 3 131.953 . 175.5592386010 . . . . . . . . . . 1 26802 5 226 1 2.561 . 35.6709726855 . . . . . . . . . . 1 26802 5 226 2 6.791 . 131.4009289380 . . . . . . . . . . 1 26802 5 226 3 131.714 . 148.3817366510 . . . . . . . . . . 1 26802 5 227 1 2.411 . 80.8531009640 . . . . . . . . . . 1 26802 5 227 2 6.779 . 139.8548290370 . . . . . . . . . . 1 26802 5 227 3 131.725 . 153.3668994150 . . . . . . . . . . 1 26802 5 228 1 2.107 . 45.2927581149 . . . . . . . . . . 1 26802 5 228 2 6.836 . 124.1042547580 . . . . . . . . . . 1 26802 5 228 3 131.938 . 166.4998994330 . . . . . . . . . . 1 26802 5 229 1 3.747 . 34.3659921665 . . . . . . . . . . 1 26802 5 229 2 6.826 . 134.7170463500 . . . . . . . . . . 1 26802 5 229 3 131.864 . 169.2137829620 . . . . . . . . . . 1 26802 5 230 1 5.264 . 71.1876656671 . . . . . . . . . . 1 26802 5 230 2 6.824 . 133.3710023580 . . . . . . . . . . 1 26802 5 230 3 131.793 . 129.2133875570 . . . . . . . . . . 1 26802 5 231 1 5.229 . 61.9369041107 . . . . . . . . . . 1 26802 5 231 2 6.802 . 123.0868543450 . . . . . . . . . . 1 26802 5 231 3 131.748 . 133.9198926370 . . . . . . . . . . 1 26802 5 232 1 6.939 . 250.1852357630 . . . . . . . . . . 1 26802 5 232 2 6.805 . 221.0594745040 . . . . . . . . . . 1 26802 5 232 3 131.918 . 190.1216159150 . . . . . . . . . . 1 26802 5 233 1 6.952 . 37.9076520985 . . . . . . . . . . 1 26802 5 233 2 6.731 . 187.4434204820 . . . . . . . . . . 1 26802 5 233 3 131.782 . 171.2896667070 . . . . . . . . . . 1 26802 5 234 1 7.544 . 46.2519263221 . . . . . . . . . . 1 26802 5 234 2 6.797 . 134.3254634140 . . . . . . . . . . 1 26802 5 234 3 131.738 . 157.0015648570 . . . . . . . . . . 1 26802 5 235 1 7.323 . 33.2149150594 . . . . . . . . . . 1 26802 5 235 2 6.783 . 153.6399788260 . . . . . . . . . . 1 26802 5 235 3 131.779 . 166.3942105790 . . . . . . . . . . 1 26802 5 236 1 7.666 . 53.8699570620 . . . . . . . . . . 1 26802 5 236 2 6.774 . 144.0424419880 . . . . . . . . . . 1 26802 5 236 3 131.736 . 157.8331556870 . . . . . . . . . . 1 26802 5 237 1 7.709 . 218.6414333000 . . . . . . . . . . 1 26802 5 237 2 6.818 . 146.2914511980 . . . . . . . . . . 1 26802 5 237 3 131.867 . 168.2447966220 . . . . . . . . . . 1 26802 5 238 1 2.746 . 43.0199546736 . . . . . . . . . . 1 26802 5 238 2 6.798 . 221.3698799730 . . . . . . . . . . 1 26802 5 238 3 131.908 . 170.9532668200 . . . . . . . . . . 1 26802 5 239 1 2.849 . 89.0043374118 . . . . . . . . . . 1 26802 5 239 2 6.964 . 128.9094601570 . . . . . . . . . . 1 26802 5 239 3 132.672 . 267.6910475460 . . . . . . . . . . 1 26802 5 240 1 7.326 . 49.6694099072 . . . . . . . . . . 1 26802 5 240 2 6.961 . 123.2041504200 . . . . . . . . . . 1 26802 5 240 3 132.811 . 207.1470590650 . . . . . . . . . . 1 26802 5 241 1 8.095 . 33.9358904557 . . . . . . . . . . 1 26802 5 241 2 6.961 . 128.4556530830 . . . . . . . . . . 1 26802 5 241 3 132.700 . 165.5267886500 . . . . . . . . . . 1 26802 5 242 1 8.194 . 30.0619647226 . . . . . . . . . . 1 26802 5 242 2 6.973 . 106.4075669290 . . . . . . . . . . 1 26802 5 242 3 132.670 . 298.2951883410 . . . . . . . . . . 1 26802 5 243 1 6.953 . 39.0195948417 . . . . . . . . . . 1 26802 5 243 2 6.728 . 128.7935945210 . . . . . . . . . . 1 26802 5 243 3 128.705 . 160.5506481050 . . . . . . . . . . 1 26802 5 244 1 5.132 . 28.1801286282 . . . . . . . . . . 1 26802 5 244 2 6.721 . 106.1930009370 . . . . . . . . . . 1 26802 5 244 3 128.704 . 129.1930231190 . . . . . . . . . . 1 26802 5 245 1 4.018 . 44.4987820783 . . . . . . . . . . 1 26802 5 245 2 6.725 . 126.7401979740 . . . . . . . . . . 1 26802 5 245 3 128.716 . 154.5279301350 . . . . . . . . . . 1 26802 5 246 1 3.105 . 39.9321028459 . . . . . . . . . . 1 26802 5 246 2 6.720 . 130.2837553380 . . . . . . . . . . 1 26802 5 246 3 128.695 . 161.4304433640 . . . . . . . . . . 1 26802 5 247 1 2.845 . 44.6997219852 . . . . . . . . . . 1 26802 5 247 2 6.723 . 123.6139714660 . . . . . . . . . . 1 26802 5 247 3 128.700 . 156.2362228920 . . . . . . . . . . 1 26802 5 248 1 0.398 . 27.1043099132 . . . . . . . . . . 1 26802 5 248 2 6.725 . 129.0643052820 . . . . . . . . . . 1 26802 5 248 3 128.668 . 163.8953136440 . . . . . . . . . . 1 26802 5 249 1 0.317 . 44.2511819683 . . . . . . . . . . 1 26802 5 249 2 6.722 . 133.6864143670 . . . . . . . . . . 1 26802 5 249 3 128.696 . 158.9609330850 . . . . . . . . . . 1 26802 5 250 1 0.235 . 24.6629276736 . . . . . . . . . . 1 26802 5 250 2 6.730 . 126.7316153350 . . . . . . . . . . 1 26802 5 250 3 128.698 . 157.4743291420 . . . . . . . . . . 1 26802 5 251 1 8.258 . 25.1554938499 . . . . . . . . . . 1 26802 5 251 2 6.719 . 129.4376501080 . . . . . . . . . . 1 26802 5 251 3 128.675 . 167.7867256660 . . . . . . . . . . 1 26802 5 252 1 3.706 . 59.8387001391 . . . . . . . . . . 1 26802 5 252 2 6.722 . 112.6485764270 . . . . . . . . . . 1 26802 5 252 3 128.693 . 146.0833907590 . . . . . . . . . . 1 26802 5 253 1 6.803 . 37.0632529392 . . . . . . . . . . 1 26802 5 253 2 6.737 . 129.0972054000 . . . . . . . . . . 1 26802 5 253 3 128.531 . 160.3983014890 . . . . . . . . . . 1 26802 5 stop_ loop_ _Assigned_peak_chem_shift.Peak_ID _Assigned_peak_chem_shift.Spectral_dim_ID _Assigned_peak_chem_shift.Set_ID _Assigned_peak_chem_shift.Magnetization_linkage_ID _Assigned_peak_chem_shift.Assembly_atom_ID _Assigned_peak_chem_shift.Val _Assigned_peak_chem_shift.Contribution_fractional_val _Assigned_peak_chem_shift.Figure_of_merit _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID _Assigned_peak_chem_shift.Atom_chem_shift_ID _Assigned_peak_chem_shift.Entity_assembly_ID _Assigned_peak_chem_shift.Entity_ID _Assigned_peak_chem_shift.Comp_index_ID _Assigned_peak_chem_shift.Comp_ID _Assigned_peak_chem_shift.Atom_ID _Assigned_peak_chem_shift.Ambiguity_code _Assigned_peak_chem_shift.Ambiguity_set_ID _Assigned_peak_chem_shift.Auth_atom_peak_num _Assigned_peak_chem_shift.Auth_entity_ID _Assigned_peak_chem_shift.Auth_seq_ID _Assigned_peak_chem_shift.Auth_comp_ID _Assigned_peak_chem_shift.Auth_atom_ID _Assigned_peak_chem_shift.Auth_ambiguity_code _Assigned_peak_chem_shift.Auth_ambiguity_set_ID _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID _Assigned_peak_chem_shift.Resonance_ID _Assigned_peak_chem_shift.Details _Assigned_peak_chem_shift.Entry_ID _Assigned_peak_chem_shift.Spectral_peak_list_ID 1 1 1 . . 7.142 . . 1 . 1 1 8 TRP HD1 . . . . . . . . . . 787 . 26802 5 1 2 1 . . 7.142 . . 1 . 1 1 8 TRP HD1 . . . . . . . . . . 787 . 26802 5 1 3 1 . . 128.210 . . 1 . 1 1 8 TRP CD1 . . . . . . . . . . 788 . 26802 5 2 2 1 . . 7.143 . . 1 . 1 1 8 TRP HD1 . . . . . . . . . . 787 . 26802 5 2 3 1 . . 128.222 . . 1 . 1 1 8 TRP CD1 . . . . . . . . . . 788 . 26802 5 3 2 1 . . 7.141 . . 1 . 1 1 8 TRP HD1 . . . . . . . . . . 787 . 26802 5 3 3 1 . . 128.185 . . 1 . 1 1 8 TRP CD1 . . . . . . . . . . 788 . 26802 5 4 2 1 . . 7.144 . . 1 . 1 1 8 TRP HD1 . . . . . . . . . . 787 . 26802 5 4 3 1 . . 128.216 . . 1 . 1 1 8 TRP CD1 . . . . . . . . . . 788 . 26802 5 5 2 1 . . 7.142 . . 1 . 1 1 8 TRP HD1 . . . . . . . . . . 787 . 26802 5 5 3 1 . . 128.195 . . 1 . 1 1 8 TRP CD1 . . . . . . . . . . 788 . 26802 5 6 2 1 . . 7.145 . . 1 . 1 1 8 TRP HD1 . . . . . . . . . . 787 . 26802 5 6 3 1 . . 128.215 . . 1 . 1 1 8 TRP CD1 . . . . . . . . . . 788 . 26802 5 7 2 1 . . 7.138 . . 1 . 1 1 8 TRP HD1 . . . . . . . . . . 787 . 26802 5 7 3 1 . . 128.209 . . 1 . 1 1 8 TRP CD1 . . . . . . . . . . 788 . 26802 5 8 2 1 . . 7.133 . . 1 . 1 1 8 TRP HD1 . . . . . . . . . . 787 . 26802 5 8 3 1 . . 128.212 . . 1 . 1 1 8 TRP CD1 . . . . . . . . . . 788 . 26802 5 9 2 1 . . 7.145 . . 1 . 1 1 8 TRP HD1 . . . . . . . . . . 787 . 26802 5 9 3 1 . . 128.219 . . 1 . 1 1 8 TRP CD1 . . . . . . . . . . 788 . 26802 5 10 2 1 . . 7.147 . . 1 . 1 1 8 TRP HD1 . . . . . . . . . . 787 . 26802 5 10 3 1 . . 128.267 . . 1 . 1 1 8 TRP CD1 . . . . . . . . . . 788 . 26802 5 11 2 1 . . 7.144 . . 1 . 1 1 8 TRP HD1 . . . . . . . . . . 787 . 26802 5 11 3 1 . . 128.224 . . 1 . 1 1 8 TRP CD1 . . . . . . . . . . 788 . 26802 5 12 2 1 . . 7.143 . . 1 . 1 1 8 TRP HD1 . . . . . . . . . . 787 . 26802 5 12 3 1 . . 128.231 . . 1 . 1 1 8 TRP CD1 . . . . . . . . . . 788 . 26802 5 13 1 2 . . 7.330 . . 1 . 1 1 8 TRP HH2 . . . . . . . . . . 893 . 26802 5 13 2 1 . . 7.336 . . 1 . 1 1 8 TRP HH2 . . . . . . . . . . 893 . 26802 5 13 3 1 . . 123.986 . . 1 . 1 1 8 TRP CH2 . . . . . . . . . . 892 . 26802 5 14 2 1 . . 7.334 . . 1 . 1 1 8 TRP HH2 . . . . . . . . . . 893 . 26802 5 14 3 1 . . 123.964 . . 1 . 1 1 8 TRP CH2 . . . . . . . . . . 892 . 26802 5 15 2 1 . . 7.336 . . 1 . 1 1 8 TRP HH2 . . . . . . . . . . 893 . 26802 5 15 3 1 . . 123.986 . . 1 . 1 1 8 TRP CH2 . . . . . . . . . . 892 . 26802 5 16 2 1 . . 7.337 . . 1 . 1 1 8 TRP HH2 . . . . . . . . . . 893 . 26802 5 16 3 1 . . 123.984 . . 1 . 1 1 8 TRP CH2 . . . . . . . . . . 892 . 26802 5 17 2 1 . . 7.334 . . 1 . 1 1 8 TRP HH2 . . . . . . . . . . 893 . 26802 5 17 3 1 . . 123.981 . . 1 . 1 1 8 TRP CH2 . . . . . . . . . . 892 . 26802 5 18 2 1 . . 7.340 . . 1 . 1 1 8 TRP HH2 . . . . . . . . . . 893 . 26802 5 18 3 1 . . 123.984 . . 1 . 1 1 8 TRP CH2 . . . . . . . . . . 892 . 26802 5 19 2 1 . . 7.323 . . 1 . 1 1 8 TRP HH2 . . . . . . . . . . 893 . 26802 5 19 3 1 . . 123.986 . . 1 . 1 1 8 TRP CH2 . . . . . . . . . . 892 . 26802 5 20 2 1 . . 7.326 . . 1 . 1 1 8 TRP HH2 . . . . . . . . . . 893 . 26802 5 20 3 1 . . 123.924 . . 1 . 1 1 8 TRP CH2 . . . . . . . . . . 892 . 26802 5 21 1 1 . . 6.742 . . 1 . 1 1 8 TRP HZ3 . . . . . . . . . . 896 . 26802 5 21 2 1 . . 6.749 . . 1 . 1 1 8 TRP HZ3 . . . . . . . . . . 896 . 26802 5 21 3 1 . . 122.377 . . 1 . 1 1 8 TRP CZ3 . . . . . . . . . . 895 . 26802 5 22 2 1 . . 6.748 . . 1 . 1 1 8 TRP HZ3 . . . . . . . . . . 896 . 26802 5 22 3 1 . . 122.368 . . 1 . 1 1 8 TRP CZ3 . . . . . . . . . . 895 . 26802 5 23 2 1 . . 6.743 . . 1 . 1 1 8 TRP HZ3 . . . . . . . . . . 896 . 26802 5 23 3 1 . . 122.377 . . 1 . 1 1 8 TRP CZ3 . . . . . . . . . . 895 . 26802 5 24 2 1 . . 6.752 . . 1 . 1 1 8 TRP HZ3 . . . . . . . . . . 896 . 26802 5 24 3 1 . . 122.379 . . 1 . 1 1 8 TRP CZ3 . . . . . . . . . . 895 . 26802 5 25 2 1 . . 6.739 . . 1 . 1 1 8 TRP HZ3 . . . . . . . . . . 896 . 26802 5 25 3 1 . . 122.376 . . 1 . 1 1 8 TRP CZ3 . . . . . . . . . . 895 . 26802 5 26 2 1 . . 6.739 . . 1 . 1 1 8 TRP HZ3 . . . . . . . . . . 896 . 26802 5 26 3 1 . . 122.317 . . 1 . 1 1 8 TRP CZ3 . . . . . . . . . . 895 . 26802 5 27 2 1 . . 6.750 . . 1 . 1 1 8 TRP HZ3 . . . . . . . . . . 896 . 26802 5 27 3 1 . . 122.409 . . 1 . 1 1 8 TRP CZ3 . . . . . . . . . . 895 . 26802 5 28 2 1 . . 6.752 . . 1 . 1 1 8 TRP HZ3 . . . . . . . . . . 896 . 26802 5 28 3 1 . . 122.380 . . 1 . 1 1 8 TRP CZ3 . . . . . . . . . . 895 . 26802 5 29 2 1 . . 6.751 . . 1 . 1 1 8 TRP HZ3 . . . . . . . . . . 896 . 26802 5 29 3 1 . . 122.403 . . 1 . 1 1 8 TRP CZ3 . . . . . . . . . . 895 . 26802 5 30 2 1 . . 6.750 . . 1 . 1 1 8 TRP HZ3 . . . . . . . . . . 896 . 26802 5 30 3 1 . . 122.366 . . 1 . 1 1 8 TRP CZ3 . . . . . . . . . . 895 . 26802 5 31 2 1 . . 6.751 . . 1 . 1 1 8 TRP HZ3 . . . . . . . . . . 896 . 26802 5 31 3 1 . . 122.385 . . 1 . 1 1 8 TRP CZ3 . . . . . . . . . . 895 . 26802 5 32 2 1 . . 6.734 . . 1 . 1 1 8 TRP HZ3 . . . . . . . . . . 896 . 26802 5 32 3 1 . . 122.344 . . 1 . 1 1 8 TRP CZ3 . . . . . . . . . . 895 . 26802 5 33 1 1 . . 7.322 . . 1 . 1 1 8 TRP HE3 . . . . . . . . . . 898 . 26802 5 33 2 1 . . 7.325 . . 1 . 1 1 8 TRP HE3 . . . . . . . . . . 898 . 26802 5 33 3 1 . . 120.234 . . 1 . 1 1 8 TRP CE3 . . . . . . . . . . 897 . 26802 5 34 2 1 . . 7.327 . . 1 . 1 1 8 TRP HE3 . . . . . . . . . . 898 . 26802 5 34 3 1 . . 120.232 . . 1 . 1 1 8 TRP CE3 . . . . . . . . . . 897 . 26802 5 35 2 1 . . 7.327 . . 1 . 1 1 8 TRP HE3 . . . . . . . . . . 898 . 26802 5 35 3 1 . . 120.237 . . 1 . 1 1 8 TRP CE3 . . . . . . . . . . 897 . 26802 5 36 2 1 . . 7.326 . . 1 . 1 1 8 TRP HE3 . . . . . . . . . . 898 . 26802 5 36 3 1 . . 120.228 . . 1 . 1 1 8 TRP CE3 . . . . . . . . . . 897 . 26802 5 37 2 1 . . 7.327 . . 1 . 1 1 8 TRP HE3 . . . . . . . . . . 898 . 26802 5 37 3 1 . . 120.237 . . 1 . 1 1 8 TRP CE3 . . . . . . . . . . 897 . 26802 5 38 2 1 . . 7.325 . . 1 . 1 1 8 TRP HE3 . . . . . . . . . . 898 . 26802 5 38 3 1 . . 120.232 . . 1 . 1 1 8 TRP CE3 . . . . . . . . . . 897 . 26802 5 39 2 1 . . 7.328 . . 1 . 1 1 8 TRP HE3 . . . . . . . . . . 898 . 26802 5 39 3 1 . . 120.260 . . 1 . 1 1 8 TRP CE3 . . . . . . . . . . 897 . 26802 5 40 2 1 . . 7.325 . . 1 . 1 1 8 TRP HE3 . . . . . . . . . . 898 . 26802 5 40 3 1 . . 120.200 . . 1 . 1 1 8 TRP CE3 . . . . . . . . . . 897 . 26802 5 41 2 1 . . 7.327 . . 1 . 1 1 8 TRP HE3 . . . . . . . . . . 898 . 26802 5 41 3 1 . . 120.232 . . 1 . 1 1 8 TRP CE3 . . . . . . . . . . 897 . 26802 5 42 2 1 . . 7.324 . . 1 . 1 1 8 TRP HE3 . . . . . . . . . . 898 . 26802 5 42 3 1 . . 120.229 . . 1 . 1 1 8 TRP CE3 . . . . . . . . . . 897 . 26802 5 43 2 1 . . 7.326 . . 1 . 1 1 8 TRP HE3 . . . . . . . . . . 898 . 26802 5 43 3 1 . . 120.251 . . 1 . 1 1 8 TRP CE3 . . . . . . . . . . 897 . 26802 5 44 2 1 . . 7.330 . . 1 . 1 1 8 TRP HE3 . . . . . . . . . . 898 . 26802 5 44 3 1 . . 120.258 . . 1 . 1 1 8 TRP CE3 . . . . . . . . . . 897 . 26802 5 45 2 1 . . 7.309 . . 1 . 1 1 8 TRP HE3 . . . . . . . . . . 898 . 26802 5 45 3 1 . . 120.206 . . 1 . 1 1 8 TRP CE3 . . . . . . . . . . 897 . 26802 5 46 1 1 . . 7.647 . . 1 . 1 1 8 TRP HZ2 . . . . . . . . . . 790 . 26802 5 46 2 1 . . 7.651 . . 1 . 1 1 8 TRP HZ2 . . . . . . . . . . 790 . 26802 5 46 3 1 . . 115.305 . . 1 . 1 1 8 TRP CZ2 . . . . . . . . . . 789 . 26802 5 47 2 1 . . 7.651 . . 1 . 1 1 8 TRP HZ2 . . . . . . . . . . 790 . 26802 5 47 3 1 . . 115.313 . . 1 . 1 1 8 TRP CZ2 . . . . . . . . . . 789 . 26802 5 48 2 1 . . 7.652 . . 1 . 1 1 8 TRP HZ2 . . . . . . . . . . 790 . 26802 5 48 3 1 . . 115.303 . . 1 . 1 1 8 TRP CZ2 . . . . . . . . . . 789 . 26802 5 49 2 1 . . 7.654 . . 1 . 1 1 8 TRP HZ2 . . . . . . . . . . 790 . 26802 5 49 3 1 . . 115.308 . . 1 . 1 1 8 TRP CZ2 . . . . . . . . . . 789 . 26802 5 50 2 1 . . 7.655 . . 1 . 1 1 8 TRP HZ2 . . . . . . . . . . 790 . 26802 5 50 3 1 . . 115.285 . . 1 . 1 1 8 TRP CZ2 . . . . . . . . . . 789 . 26802 5 51 2 1 . . 7.311 . . 1 . 1 1 30 HIS HD2 . . . . . . . . . . 871 . 26802 5 51 3 1 . . 118.654 . . 1 . 1 1 30 HIS CD2 . . . . . . . . . . 899 . 26802 5 52 2 1 . . 7.317 . . 1 . 1 1 30 HIS HD2 . . . . . . . . . . 871 . 26802 5 52 3 1 . . 118.642 . . 1 . 1 1 30 HIS CD2 . . . . . . . . . . 899 . 26802 5 53 2 1 . . 7.316 . . 1 . 1 1 30 HIS HD2 . . . . . . . . . . 871 . 26802 5 53 3 1 . . 118.649 . . 1 . 1 1 30 HIS CD2 . . . . . . . . . . 899 . 26802 5 54 1 1 . . 7.314 . . 1 . 1 1 30 HIS HD2 . . . . . . . . . . 871 . 26802 5 54 2 1 . . 7.316 . . 1 . 1 1 30 HIS HD2 . . . . . . . . . . 871 . 26802 5 54 3 1 . . 118.643 . . 1 . 1 1 30 HIS CD2 . . . . . . . . . . 899 . 26802 5 55 2 1 . . 7.308 . . 1 . 1 1 30 HIS HD2 . . . . . . . . . . 871 . 26802 5 55 3 1 . . 118.661 . . 1 . 1 1 30 HIS CD2 . . . . . . . . . . 899 . 26802 5 56 2 1 . . 7.291 . . 1 . 1 1 30 HIS HD2 . . . . . . . . . . 871 . 26802 5 56 3 1 . . 118.629 . . 1 . 1 1 30 HIS CD2 . . . . . . . . . . 899 . 26802 5 57 2 1 . . 7.313 . . 1 . 1 1 30 HIS HD2 . . . . . . . . . . 871 . 26802 5 57 3 1 . . 118.683 . . 1 . 1 1 30 HIS CD2 . . . . . . . . . . 899 . 26802 5 58 2 1 . . 7.325 . . 1 . 1 1 30 HIS HD2 . . . . . . . . . . 871 . 26802 5 58 3 1 . . 118.664 . . 1 . 1 1 30 HIS CD2 . . . . . . . . . . 899 . 26802 5 59 2 1 . . 7.318 . . 1 . 1 1 30 HIS HD2 . . . . . . . . . . 871 . 26802 5 59 3 1 . . 118.658 . . 1 . 1 1 30 HIS CD2 . . . . . . . . . . 899 . 26802 5 60 2 1 . . 7.237 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 5 60 3 1 . . 120.952 . . 1 . 1 1 65 HIS CD2 . . . . . . . . . . 900 . 26802 5 61 2 1 . . 7.235 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 5 61 3 1 . . 120.959 . . 1 . 1 1 65 HIS CD2 . . . . . . . . . . 900 . 26802 5 62 2 1 . . 7.238 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 5 62 3 1 . . 120.928 . . 1 . 1 1 65 HIS CD2 . . . . . . . . . . 900 . 26802 5 63 2 1 . . 7.239 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 5 63 3 1 . . 121.006 . . 1 . 1 1 65 HIS CD2 . . . . . . . . . . 900 . 26802 5 64 2 1 . . 7.237 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 5 64 3 1 . . 120.960 . . 1 . 1 1 65 HIS CD2 . . . . . . . . . . 900 . 26802 5 65 2 1 . . 7.228 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 5 65 3 1 . . 120.942 . . 1 . 1 1 65 HIS CD2 . . . . . . . . . . 900 . 26802 5 66 2 1 . . 7.242 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 5 66 3 1 . . 120.993 . . 1 . 1 1 65 HIS CD2 . . . . . . . . . . 900 . 26802 5 67 2 1 . . 7.231 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 5 67 3 1 . . 121.027 . . 1 . 1 1 65 HIS CD2 . . . . . . . . . . 900 . 26802 5 69 2 1 . . 7.237 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 5 69 3 1 . . 120.931 . . 1 . 1 1 65 HIS CD2 . . . . . . . . . . 900 . 26802 5 70 2 1 . . 7.244 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 5 70 3 1 . . 121.025 . . 1 . 1 1 65 HIS CD2 . . . . . . . . . . 900 . 26802 5 71 1 1 . . 7.222 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 5 71 2 1 . . 7.229 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 5 71 3 1 . . 120.953 . . 1 . 1 1 65 HIS CD2 . . . . . . . . . . 900 . 26802 5 72 2 1 . . 7.233 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 5 72 3 1 . . 120.927 . . 1 . 1 1 65 HIS CD2 . . . . . . . . . . 900 . 26802 5 73 2 1 . . 7.241 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 5 73 3 1 . . 120.929 . . 1 . 1 1 65 HIS CD2 . . . . . . . . . . 900 . 26802 5 74 2 1 . . 7.244 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 5 74 3 1 . . 120.982 . . 1 . 1 1 65 HIS CD2 . . . . . . . . . . 900 . 26802 5 75 2 1 . . 7.241 . . 1 . 1 1 65 HIS HD2 . . . . . . . . . . 816 . 26802 5 75 3 1 . . 120.942 . . 1 . 1 1 65 HIS CD2 . . . . . . . . . . 900 . 26802 5 76 2 1 . . 6.721 . . 1 . 1 1 73 TYR QE . . . . . . . . . . 802 . 26802 5 76 3 1 . . 118.115 . . 1 . 1 1 73 TYR CE1 . . . . . . . . . . 901 . 26802 5 77 2 1 . . 6.720 . . 1 . 1 1 73 TYR QE . . . . . . . . . . 802 . 26802 5 77 3 1 . . 118.127 . . 1 . 1 1 73 TYR CE1 . . . . . . . . . . 901 . 26802 5 78 1 1 . . 6.716 . . 1 . 1 1 73 TYR QE . . . . . . . . . . 802 . 26802 5 78 2 1 . . 6.718 . . 1 . 1 1 73 TYR QE . . . . . . . . . . 802 . 26802 5 78 3 1 . . 118.128 . . 1 . 1 1 73 TYR CE1 . . . . . . . . . . 901 . 26802 5 79 2 1 . . 6.722 . . 1 . 1 1 73 TYR QE . . . . . . . . . . 802 . 26802 5 79 3 1 . . 118.162 . . 1 . 1 1 73 TYR CE1 . . . . . . . . . . 901 . 26802 5 80 2 1 . . 6.715 . . 1 . 1 1 73 TYR QE . . . . . . . . . . 802 . 26802 5 80 3 1 . . 118.113 . . 1 . 1 1 73 TYR CE1 . . . . . . . . . . 901 . 26802 5 81 2 1 . . 6.722 . . 1 . 1 1 73 TYR QE . . . . . . . . . . 802 . 26802 5 81 3 1 . . 118.163 . . 1 . 1 1 73 TYR CE1 . . . . . . . . . . 901 . 26802 5 82 2 1 . . 6.724 . . 1 . 1 1 73 TYR QE . . . . . . . . . . 802 . 26802 5 82 3 1 . . 118.157 . . 1 . 1 1 73 TYR CE1 . . . . . . . . . . 901 . 26802 5 83 2 1 . . 6.711 . . 1 . 1 1 73 TYR QE . . . . . . . . . . 802 . 26802 5 83 3 1 . . 118.262 . . 1 . 1 1 73 TYR CE1 . . . . . . . . . . 901 . 26802 5 84 2 1 . . 6.716 . . 1 . 1 1 73 TYR QE . . . . . . . . . . 802 . 26802 5 84 3 1 . . 118.160 . . 1 . 1 1 73 TYR CE1 . . . . . . . . . . 901 . 26802 5 85 2 1 . . 6.712 . . 1 . 1 1 73 TYR QE . . . . . . . . . . 802 . 26802 5 85 3 1 . . 118.256 . . 1 . 1 1 73 TYR CE1 . . . . . . . . . . 901 . 26802 5 86 2 1 . . 6.727 . . 1 . 1 1 73 TYR QE . . . . . . . . . . 802 . 26802 5 86 3 1 . . 118.235 . . 1 . 1 1 73 TYR CE1 . . . . . . . . . . 901 . 26802 5 87 1 1 . . 6.934 . . 1 . 1 1 73 TYR QD . . . . . . . . . . 803 . 26802 5 87 2 1 . . 6.937 . . 1 . 1 1 73 TYR QD . . . . . . . . . . 803 . 26802 5 87 3 1 . . 133.081 . . 1 . 1 1 73 TYR CD1 . . . . . . . . . . 902 . 26802 5 88 2 1 . . 6.933 . . 1 . 1 1 73 TYR QD . . . . . . . . . . 803 . 26802 5 88 3 1 . . 133.077 . . 1 . 1 1 73 TYR CD1 . . . . . . . . . . 902 . 26802 5 89 2 1 . . 6.940 . . 1 . 1 1 73 TYR QD . . . . . . . . . . 803 . 26802 5 89 3 1 . . 133.065 . . 1 . 1 1 73 TYR CD1 . . . . . . . . . . 902 . 26802 5 90 2 1 . . 6.931 . . 1 . 1 1 73 TYR QD . . . . . . . . . . 803 . 26802 5 90 3 1 . . 133.099 . . 1 . 1 1 73 TYR CD1 . . . . . . . . . . 902 . 26802 5 91 2 1 . . 6.938 . . 1 . 1 1 73 TYR QD . . . . . . . . . . 803 . 26802 5 91 3 1 . . 133.071 . . 1 . 1 1 73 TYR CD1 . . . . . . . . . . 902 . 26802 5 92 2 1 . . 6.939 . . 1 . 1 1 73 TYR QD . . . . . . . . . . 803 . 26802 5 92 3 1 . . 133.082 . . 1 . 1 1 73 TYR CD1 . . . . . . . . . . 902 . 26802 5 93 2 1 . . 6.932 . . 1 . 1 1 73 TYR QD . . . . . . . . . . 803 . 26802 5 93 3 1 . . 133.086 . . 1 . 1 1 73 TYR CD1 . . . . . . . . . . 902 . 26802 5 95 2 1 . . 6.972 . . 1 . 1 1 31 TYR QD . . . . . . . . . . 868 . 26802 5 95 3 1 . . 133.245 . . 1 . 1 1 31 TYR CD2 . . . . . . . . . . 903 . 26802 5 96 2 1 . . 6.964 . . 1 . 1 1 15 PHE QD . . . . . . . . . . 807 . 26802 5 96 3 1 . . 132.681 . . 1 . 1 1 15 PHE CD2 . . . . . . . . . . 917 . 26802 5 97 2 1 . . 6.978 . . 1 . 1 1 31 TYR QD . . . . . . . . . . 868 . 26802 5 97 3 1 . . 133.260 . . 1 . 1 1 31 TYR CD2 . . . . . . . . . . 903 . 26802 5 98 2 1 . . 6.977 . . 1 . 1 1 31 TYR QD . . . . . . . . . . 868 . 26802 5 98 3 1 . . 133.249 . . 1 . 1 1 31 TYR CD2 . . . . . . . . . . 903 . 26802 5 99 2 1 . . 6.976 . . 1 . 1 1 31 TYR QD . . . . . . . . . . 868 . 26802 5 99 3 1 . . 133.259 . . 1 . 1 1 31 TYR CD2 . . . . . . . . . . 903 . 26802 5 100 2 1 . . 6.981 . . 1 . 1 1 31 TYR QD . . . . . . . . . . 868 . 26802 5 100 3 1 . . 133.220 . . 1 . 1 1 31 TYR CD2 . . . . . . . . . . 903 . 26802 5 101 2 1 . . 6.981 . . 1 . 1 1 31 TYR QD . . . . . . . . . . 868 . 26802 5 101 3 1 . . 133.260 . . 1 . 1 1 31 TYR CD2 . . . . . . . . . . 903 . 26802 5 102 2 1 . . 6.976 . . 1 . 1 1 31 TYR QD . . . . . . . . . . 868 . 26802 5 102 3 1 . . 133.262 . . 1 . 1 1 31 TYR CD2 . . . . . . . . . . 903 . 26802 5 103 2 1 . . 6.973 . . 1 . 1 1 31 TYR QD . . . . . . . . . . 868 . 26802 5 103 3 1 . . 133.198 . . 1 . 1 1 31 TYR CD2 . . . . . . . . . . 903 . 26802 5 104 2 1 . . 6.972 . . 1 . 1 1 31 TYR QD . . . . . . . . . . 868 . 26802 5 104 3 1 . . 133.266 . . 1 . 1 1 31 TYR CD2 . . . . . . . . . . 903 . 26802 5 105 2 1 . . 6.967 . . 1 . 1 1 31 TYR QD . . . . . . . . . . 868 . 26802 5 105 3 1 . . 133.219 . . 1 . 1 1 31 TYR CD2 . . . . . . . . . . 903 . 26802 5 106 2 1 . . 6.974 . . 1 . 1 1 31 TYR QD . . . . . . . . . . 868 . 26802 5 106 3 1 . . 133.283 . . 1 . 1 1 31 TYR CD2 . . . . . . . . . . 903 . 26802 5 107 2 1 . . 6.980 . . 1 . 1 1 31 TYR QD . . . . . . . . . . 868 . 26802 5 107 3 1 . . 133.276 . . 1 . 1 1 31 TYR CD2 . . . . . . . . . . 903 . 26802 5 108 1 1 . . 6.863 . . 1 . 1 1 31 TYR QE . . . . . . . . . . 867 . 26802 5 108 2 1 . . 6.864 . . 1 . 1 1 31 TYR QE . . . . . . . . . . 867 . 26802 5 108 3 1 . . 118.478 . . 1 . 1 1 31 TYR CE2 . . . . . . . . . . 904 . 26802 5 109 2 1 . . 6.860 . . 1 . 1 1 31 TYR QE . . . . . . . . . . 867 . 26802 5 109 3 1 . . 118.436 . . 1 . 1 1 31 TYR CE2 . . . . . . . . . . 904 . 26802 5 110 2 1 . . 6.869 . . 1 . 1 1 31 TYR QE . . . . . . . . . . 867 . 26802 5 110 3 1 . . 118.489 . . 1 . 1 1 31 TYR CE2 . . . . . . . . . . 904 . 26802 5 111 2 1 . . 6.869 . . 1 . 1 1 31 TYR QE . . . . . . . . . . 867 . 26802 5 111 3 1 . . 118.502 . . 1 . 1 1 31 TYR CE2 . . . . . . . . . . 904 . 26802 5 112 2 1 . . 6.870 . . 1 . 1 1 31 TYR QE . . . . . . . . . . 867 . 26802 5 112 3 1 . . 118.519 . . 1 . 1 1 31 TYR CE2 . . . . . . . . . . 904 . 26802 5 113 2 1 . . 6.857 . . 1 . 1 1 31 TYR QE . . . . . . . . . . 867 . 26802 5 113 3 1 . . 118.493 . . 1 . 1 1 31 TYR CE2 . . . . . . . . . . 904 . 26802 5 114 2 1 . . 6.871 . . 1 . 1 1 31 TYR QE . . . . . . . . . . 867 . 26802 5 114 3 1 . . 118.473 . . 1 . 1 1 31 TYR CE2 . . . . . . . . . . 904 . 26802 5 115 2 1 . . 6.871 . . 1 . 1 1 31 TYR QE . . . . . . . . . . 867 . 26802 5 115 3 1 . . 118.397 . . 1 . 1 1 31 TYR CE2 . . . . . . . . . . 904 . 26802 5 116 2 1 . . 6.880 . . 1 . 1 1 31 TYR QE . . . . . . . . . . 867 . 26802 5 116 3 1 . . 118.351 . . 1 . 1 1 31 TYR CE2 . . . . . . . . . . 904 . 26802 5 117 2 1 . . 6.877 . . 1 . 1 1 31 TYR QE . . . . . . . . . . 867 . 26802 5 117 3 1 . . 118.435 . . 1 . 1 1 31 TYR CE2 . . . . . . . . . . 904 . 26802 5 118 2 1 . . 6.749 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 118 3 1 . . 132.191 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 119 2 1 . . 6.730 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 119 3 1 . . 132.275 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 120 2 1 . . 6.732 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 120 3 1 . . 132.269 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 121 2 1 . . 6.728 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 121 3 1 . . 132.290 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 122 2 1 . . 6.727 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 122 3 1 . . 132.257 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 123 2 1 . . 6.790 . . 1 . 1 1 17 PHE QD . . . . . . . . . . 811 . 26802 5 123 3 1 . . 131.723 . . 1 . 1 1 17 PHE CD1 . . . . . . . . . . 905 . 26802 5 124 2 1 . . 6.792 . . 1 . 1 1 17 PHE QD . . . . . . . . . . 811 . 26802 5 124 3 1 . . 131.733 . . 1 . 1 1 17 PHE CD1 . . . . . . . . . . 905 . 26802 5 125 2 1 . . 6.790 . . 1 . 1 1 17 PHE QD . . . . . . . . . . 811 . 26802 5 125 3 1 . . 131.719 . . 1 . 1 1 17 PHE CD1 . . . . . . . . . . 905 . 26802 5 126 2 1 . . 7.548 . . 1 . 1 1 17 PHE QE . . . . . . . . . . 810 . 26802 5 126 3 1 . . 131.508 . . 1 . 1 1 17 PHE CE1 . . . . . . . . . . 907 . 26802 5 127 2 1 . . 7.565 . . 1 . 1 1 15 PHE QE . . . . . . . . . . 806 . 26802 5 127 3 1 . . 131.467 . . 1 . 1 1 15 PHE CE2 . . . . . . . . . . 908 . 26802 5 128 2 1 . . 7.553 . . 1 . 1 1 17 PHE QE . . . . . . . . . . 810 . 26802 5 128 3 1 . . 131.507 . . 1 . 1 1 17 PHE CE1 . . . . . . . . . . 907 . 26802 5 129 2 1 . . 7.582 . . 1 . 1 1 15 PHE QE . . . . . . . . . . 806 . 26802 5 129 3 1 . . 131.405 . . 1 . 1 1 15 PHE CE2 . . . . . . . . . . 908 . 26802 5 130 2 1 . . 7.583 . . 1 . 1 1 15 PHE QE . . . . . . . . . . 806 . 26802 5 130 3 1 . . 131.433 . . 1 . 1 1 15 PHE CE2 . . . . . . . . . . 908 . 26802 5 131 2 1 . . 7.573 . . 1 . 1 1 15 PHE QE . . . . . . . . . . 806 . 26802 5 131 3 1 . . 131.473 . . 1 . 1 1 15 PHE CE2 . . . . . . . . . . 908 . 26802 5 132 2 1 . . 7.576 . . 1 . 1 1 15 PHE QE . . . . . . . . . . 806 . 26802 5 132 3 1 . . 131.433 . . 1 . 1 1 15 PHE CE2 . . . . . . . . . . 908 . 26802 5 133 2 1 . . 7.545 . . 1 . 1 1 17 PHE QE . . . . . . . . . . 810 . 26802 5 133 3 1 . . 131.501 . . 1 . 1 1 17 PHE CE1 . . . . . . . . . . 907 . 26802 5 134 2 1 . . 7.587 . . 1 . 1 1 15 PHE QE . . . . . . . . . . 806 . 26802 5 134 3 1 . . 131.406 . . 1 . 1 1 15 PHE CE2 . . . . . . . . . . 908 . 26802 5 135 2 1 . . 7.581 . . 1 . 1 1 15 PHE QE . . . . . . . . . . 806 . 26802 5 135 3 1 . . 131.402 . . 1 . 1 1 15 PHE CE2 . . . . . . . . . . 908 . 26802 5 136 2 1 . . 7.572 . . 1 . 1 1 15 PHE QE . . . . . . . . . . 806 . 26802 5 136 3 1 . . 131.407 . . 1 . 1 1 15 PHE CE2 . . . . . . . . . . 908 . 26802 5 137 2 1 . . 7.584 . . 1 . 1 1 15 PHE QE . . . . . . . . . . 806 . 26802 5 137 3 1 . . 131.397 . . 1 . 1 1 15 PHE CE2 . . . . . . . . . . 908 . 26802 5 138 2 1 . . 7.585 . . 1 . 1 1 15 PHE QE . . . . . . . . . . 806 . 26802 5 138 3 1 . . 131.407 . . 1 . 1 1 15 PHE CE2 . . . . . . . . . . 908 . 26802 5 139 2 1 . . 6.792 . . 1 . 1 1 17 PHE QD . . . . . . . . . . 811 . 26802 5 139 3 1 . . 131.722 . . 1 . 1 1 17 PHE CD1 . . . . . . . . . . 905 . 26802 5 140 2 1 . . 7.150 . . 1 . 1 1 74 PHE QD . . . . . . . . . . 813 . 26802 5 140 3 1 . . 131.756 . . 1 . 1 1 74 PHE CD2 . . . . . . . . . . 912 . 26802 5 141 2 1 . . 7.149 . . 1 . 1 1 74 PHE QD . . . . . . . . . . 813 . 26802 5 141 3 1 . . 131.750 . . 1 . 1 1 74 PHE CD2 . . . . . . . . . . 912 . 26802 5 142 2 1 . . 6.730 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 142 3 1 . . 132.263 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 143 2 1 . . 6.730 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 143 3 1 . . 132.260 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 144 2 1 . . 6.739 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 144 3 1 . . 132.280 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 145 2 1 . . 6.737 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 145 3 1 . . 132.297 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 146 2 1 . . 6.733 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 146 3 1 . . 132.279 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 147 2 1 . . 6.734 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 147 3 1 . . 132.287 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 148 2 1 . . 6.730 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 148 3 1 . . 132.246 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 149 2 1 . . 6.729 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 149 3 1 . . 132.261 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 150 2 1 . . 6.731 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 150 3 1 . . 132.248 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 151 2 1 . . 6.729 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 151 3 1 . . 132.237 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 152 2 1 . . 6.740 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 152 3 1 . . 132.258 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 153 2 1 . . 6.728 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 153 3 1 . . 132.202 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 154 2 1 . . 6.726 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 154 3 1 . . 132.096 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 155 2 1 . . 6.726 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 155 3 1 . . 132.180 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 156 2 1 . . 6.718 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 156 3 1 . . 132.109 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 157 2 1 . . 6.728 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 157 3 1 . . 132.216 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 158 2 1 . . 6.711 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 158 3 1 . . 131.785 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 159 2 1 . . 6.737 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 159 3 1 . . 132.298 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 160 2 1 . . 6.728 . . 1 . 1 1 50 PHE QD . . . . . . . . . . 805 . 26802 5 160 3 1 . . 132.258 . . 1 . 1 1 50 PHE CD1 . . . . . . . . . . 909 . 26802 5 161 2 1 . . 6.707 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 161 3 1 . . 131.764 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 162 2 1 . . 6.711 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 162 3 1 . . 131.759 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 163 2 1 . . 6.719 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 163 3 1 . . 131.771 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 164 2 1 . . 6.722 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 164 3 1 . . 131.784 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 165 2 1 . . 6.704 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 165 3 1 . . 131.782 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 166 2 1 . . 6.707 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 166 3 1 . . 131.751 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 167 2 1 . . 6.708 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 167 3 1 . . 131.763 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 168 2 1 . . 6.709 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 168 3 1 . . 131.760 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 169 2 1 . . 6.709 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 169 3 1 . . 131.788 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 170 2 1 . . 6.704 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 170 3 1 . . 131.744 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 171 2 1 . . 6.700 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 171 3 1 . . 131.844 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 172 2 1 . . 6.703 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 172 3 1 . . 131.767 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 173 2 1 . . 6.713 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 173 3 1 . . 131.744 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 174 2 1 . . 6.714 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 174 3 1 . . 131.824 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 175 2 1 . . 6.711 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 175 3 1 . . 131.895 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 176 2 1 . . 7.142 . . 1 . 1 1 74 PHE QD . . . . . . . . . . 813 . 26802 5 176 3 1 . . 131.753 . . 1 . 1 1 74 PHE CD2 . . . . . . . . . . 912 . 26802 5 177 2 1 . . 7.152 . . 1 . 1 1 74 PHE QD . . . . . . . . . . 813 . 26802 5 177 3 1 . . 131.814 . . 1 . 1 1 74 PHE CD2 . . . . . . . . . . 912 . 26802 5 178 2 1 . . 7.138 . . 1 . 1 1 39 PHE QD . . . . . . . . . . 815 . 26802 5 178 3 1 . . 131.609 . . 1 . 1 1 39 PHE CD1 . . . . . . . . . . 911 . 26802 5 179 2 1 . . 6.805 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 179 3 1 . . 130.300 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 180 2 1 . . 6.809 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 180 3 1 . . 130.291 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 181 2 1 . . 6.810 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 181 3 1 . . 130.297 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 182 2 1 . . 6.809 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 182 3 1 . . 130.299 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 183 2 1 . . 6.810 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 183 3 1 . . 130.299 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 184 2 1 . . 6.809 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 184 3 1 . . 130.312 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 185 2 1 . . 6.811 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 185 3 1 . . 130.274 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 186 2 1 . . 6.811 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 186 3 1 . . 130.271 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 187 2 1 . . 6.811 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 187 3 1 . . 130.298 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 188 2 1 . . 6.806 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 188 3 1 . . 130.305 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 189 2 1 . . 6.810 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 189 3 1 . . 130.300 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 190 2 1 . . 6.812 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 190 3 1 . . 130.297 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 191 2 1 . . 6.809 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 191 3 1 . . 130.306 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 192 2 1 . . 6.809 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 192 3 1 . . 130.294 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 193 2 1 . . 6.796 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 193 3 1 . . 130.342 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 194 2 1 . . 6.811 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 194 3 1 . . 130.301 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 195 2 1 . . 6.804 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 195 3 1 . . 130.271 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 196 2 1 . . 6.810 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 196 3 1 . . 130.298 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 197 2 1 . . 6.811 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 197 3 1 . . 130.285 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 198 2 1 . . 6.807 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 198 3 1 . . 130.271 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 199 2 1 . . 6.811 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 199 3 1 . . 130.301 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 200 2 1 . . 6.812 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 200 3 1 . . 130.286 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 201 2 1 . . 6.809 . . 1 . 1 1 50 PHE QE . . . . . . . . . . 804 . 26802 5 201 3 1 . . 130.304 . . 1 . 1 1 50 PHE CE1 . . . . . . . . . . 913 . 26802 5 202 2 1 . . 6.958 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 202 3 1 . . 130.531 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 203 2 1 . . 6.960 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 203 3 1 . . 130.634 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 204 2 1 . . 6.964 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 204 3 1 . . 130.693 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 205 2 1 . . 6.963 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 205 3 1 . . 130.634 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 206 2 1 . . 6.957 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 206 3 1 . . 130.607 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 207 2 1 . . 6.961 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 207 3 1 . . 130.634 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 208 2 1 . . 6.951 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 208 3 1 . . 130.598 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 209 2 1 . . 6.957 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 209 3 1 . . 130.612 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 210 2 1 . . 6.964 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 210 3 1 . . 130.637 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 211 2 1 . . 6.955 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 211 3 1 . . 130.624 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 212 2 1 . . 6.950 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 212 3 1 . . 130.623 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 213 2 1 . . 6.969 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 213 3 1 . . 130.589 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 214 2 1 . . 6.956 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 214 3 1 . . 130.607 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 215 2 1 . . 6.963 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 215 3 1 . . 130.621 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 216 2 1 . . 6.958 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 216 3 1 . . 130.682 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 217 2 1 . . 6.942 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 217 3 1 . . 130.640 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 218 2 1 . . 6.948 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 218 3 1 . . 130.713 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 219 2 1 . . 6.937 . . 1 . 1 1 9 PHE QE . . . . . . . . . . 808 . 26802 5 219 3 1 . . 130.598 . . 1 . 1 1 9 PHE CE1 . . . . . . . . . . 915 . 26802 5 220 2 1 . . 6.965 . . 1 . 1 1 15 PHE QD . . . . . . . . . . 807 . 26802 5 220 3 1 . . 132.685 . . 1 . 1 1 15 PHE CD2 . . . . . . . . . . 917 . 26802 5 221 2 1 . . 6.963 . . 1 . 1 1 15 PHE QD . . . . . . . . . . 807 . 26802 5 221 3 1 . . 132.656 . . 1 . 1 1 15 PHE CD2 . . . . . . . . . . 917 . 26802 5 222 2 1 . . 6.950 . . 1 . 1 1 15 PHE QD . . . . . . . . . . 807 . 26802 5 222 3 1 . . 132.643 . . 1 . 1 1 15 PHE CD2 . . . . . . . . . . 917 . 26802 5 223 2 1 . . 6.956 . . 1 . 1 1 15 PHE QD . . . . . . . . . . 807 . 26802 5 223 3 1 . . 132.662 . . 1 . 1 1 15 PHE CD2 . . . . . . . . . . 917 . 26802 5 224 2 1 . . 7.565 . . 1 . 1 1 17 PHE QE . . . . . . . . . . 810 . 26802 5 224 3 1 . . 131.418 . . 1 . 1 1 17 PHE CE1 . . . . . . . . . . 907 . 26802 5 225 2 1 . . 6.820 . . 1 . 1 1 28 PHE QD . . . . . . . . . . 872 . 26802 5 225 3 1 . . 131.953 . . 1 . 1 1 28 PHE CD2 . . . . . . . . . . 906 . 26802 5 226 2 1 . . 6.791 . . 1 . 1 1 17 PHE QD . . . . . . . . . . 811 . 26802 5 226 3 1 . . 131.714 . . 1 . 1 1 17 PHE CD1 . . . . . . . . . . 905 . 26802 5 227 2 1 . . 6.779 . . 1 . 1 1 17 PHE QD . . . . . . . . . . 811 . 26802 5 227 3 1 . . 131.725 . . 1 . 1 1 17 PHE CD1 . . . . . . . . . . 905 . 26802 5 228 2 1 . . 6.836 . . 1 . 1 1 28 PHE QD . . . . . . . . . . 872 . 26802 5 228 3 1 . . 131.938 . . 1 . 1 1 28 PHE CD2 . . . . . . . . . . 906 . 26802 5 229 2 1 . . 6.826 . . 1 . 1 1 28 PHE QD . . . . . . . . . . 872 . 26802 5 229 3 1 . . 131.864 . . 1 . 1 1 28 PHE CD2 . . . . . . . . . . 906 . 26802 5 230 2 1 . . 6.824 . . 1 . 1 1 28 PHE QD . . . . . . . . . . 872 . 26802 5 230 3 1 . . 131.793 . . 1 . 1 1 28 PHE CD2 . . . . . . . . . . 906 . 26802 5 231 2 1 . . 6.802 . . 1 . 1 1 17 PHE QD . . . . . . . . . . 811 . 26802 5 231 3 1 . . 131.748 . . 1 . 1 1 17 PHE CD1 . . . . . . . . . . 905 . 26802 5 232 2 1 . . 6.805 . . 1 . 1 1 17 PHE QD . . . . . . . . . . 811 . 26802 5 232 3 1 . . 131.918 . . 1 . 1 1 17 PHE CD1 . . . . . . . . . . 905 . 26802 5 233 2 1 . . 6.731 . . 1 . 1 1 9 PHE QD . . . . . . . . . . 809 . 26802 5 233 3 1 . . 131.782 . . 1 . 1 1 9 PHE CD1 . . . . . . . . . . 910 . 26802 5 234 2 1 . . 6.797 . . 1 . 1 1 17 PHE QD . . . . . . . . . . 811 . 26802 5 234 3 1 . . 131.738 . . 1 . 1 1 17 PHE CD1 . . . . . . . . . . 905 . 26802 5 235 2 1 . . 6.783 . . 1 . 1 1 17 PHE QD . . . . . . . . . . 811 . 26802 5 235 3 1 . . 131.779 . . 1 . 1 1 17 PHE CD1 . . . . . . . . . . 905 . 26802 5 236 2 1 . . 6.774 . . 1 . 1 1 17 PHE QD . . . . . . . . . . 811 . 26802 5 236 3 1 . . 131.736 . . 1 . 1 1 17 PHE CD1 . . . . . . . . . . 905 . 26802 5 237 2 1 . . 6.818 . . 1 . 1 1 28 PHE QD . . . . . . . . . . 872 . 26802 5 237 3 1 . . 131.867 . . 1 . 1 1 28 PHE CD2 . . . . . . . . . . 906 . 26802 5 238 2 1 . . 6.798 . . 1 . 1 1 28 PHE QD . . . . . . . . . . 872 . 26802 5 238 3 1 . . 131.908 . . 1 . 1 1 28 PHE CD2 . . . . . . . . . . 906 . 26802 5 239 2 1 . . 6.964 . . 1 . 1 1 15 PHE QD . . . . . . . . . . 807 . 26802 5 239 3 1 . . 132.672 . . 1 . 1 1 15 PHE CD2 . . . . . . . . . . 917 . 26802 5 240 2 1 . . 6.961 . . 1 . 1 1 15 PHE QD . . . . . . . . . . 807 . 26802 5 240 3 1 . . 132.811 . . 1 . 1 1 15 PHE CD2 . . . . . . . . . . 917 . 26802 5 241 2 1 . . 6.961 . . 1 . 1 1 15 PHE QD . . . . . . . . . . 807 . 26802 5 241 3 1 . . 132.700 . . 1 . 1 1 15 PHE CD2 . . . . . . . . . . 917 . 26802 5 242 2 1 . . 6.973 . . 1 . 1 1 15 PHE QD . . . . . . . . . . 807 . 26802 5 242 3 1 . . 132.670 . . 1 . 1 1 15 PHE CD2 . . . . . . . . . . 917 . 26802 5 243 2 1 . . 6.728 . . 1 . 1 1 9 PHE HZ . . . . . . . . . . 919 . 26802 5 243 3 1 . . 128.705 . . 1 . 1 1 9 PHE CZ . . . . . . . . . . 918 . 26802 5 244 2 1 . . 6.721 . . 1 . 1 1 9 PHE HZ . . . . . . . . . . 919 . 26802 5 244 3 1 . . 128.704 . . 1 . 1 1 9 PHE CZ . . . . . . . . . . 918 . 26802 5 245 2 1 . . 6.725 . . 1 . 1 1 9 PHE HZ . . . . . . . . . . 919 . 26802 5 245 3 1 . . 128.716 . . 1 . 1 1 9 PHE CZ . . . . . . . . . . 918 . 26802 5 246 2 1 . . 6.720 . . 1 . 1 1 9 PHE HZ . . . . . . . . . . 919 . 26802 5 246 3 1 . . 128.695 . . 1 . 1 1 9 PHE CZ . . . . . . . . . . 918 . 26802 5 247 2 1 . . 6.723 . . 1 . 1 1 9 PHE HZ . . . . . . . . . . 919 . 26802 5 247 3 1 . . 128.700 . . 1 . 1 1 9 PHE CZ . . . . . . . . . . 918 . 26802 5 248 2 1 . . 6.725 . . 1 . 1 1 9 PHE HZ . . . . . . . . . . 919 . 26802 5 248 3 1 . . 128.668 . . 1 . 1 1 9 PHE CZ . . . . . . . . . . 918 . 26802 5 249 2 1 . . 6.722 . . 1 . 1 1 9 PHE HZ . . . . . . . . . . 919 . 26802 5 249 3 1 . . 128.696 . . 1 . 1 1 9 PHE CZ . . . . . . . . . . 918 . 26802 5 250 2 1 . . 6.730 . . 1 . 1 1 9 PHE HZ . . . . . . . . . . 919 . 26802 5 250 3 1 . . 128.698 . . 1 . 1 1 9 PHE CZ . . . . . . . . . . 918 . 26802 5 251 2 1 . . 6.719 . . 1 . 1 1 9 PHE HZ . . . . . . . . . . 919 . 26802 5 251 3 1 . . 128.675 . . 1 . 1 1 9 PHE CZ . . . . . . . . . . 918 . 26802 5 252 2 1 . . 6.722 . . 1 . 1 1 9 PHE HZ . . . . . . . . . . 919 . 26802 5 252 3 1 . . 128.693 . . 1 . 1 1 9 PHE CZ . . . . . . . . . . 918 . 26802 5 253 2 1 . . 6.737 . . 1 . 1 1 9 PHE HZ . . . . . . . . . . 919 . 26802 5 253 3 1 . . 128.531 . . 1 . 1 1 9 PHE CZ . . . . . . . . . . 918 . 26802 5 stop_ save_ save_peak_list_1_2_3_4_5_6 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode peak_list_1_2_3_4_5_6 _Spectral_peak_list.Entry_ID 26802 _Spectral_peak_list.ID 6 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $CspA _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $CspA_1 _Spectral_peak_list.Chem_shift_reference_ID . _Spectral_peak_list.Chem_shift_reference_label . _Spectral_peak_list.Experiment_ID 6 _Spectral_peak_list.Experiment_name '3D HNCO' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details 'Default list' _Spectral_peak_list.Text_data_format . _Spectral_peak_list.Text_data . loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . H 1 1H . . 2997.972 . . . . . . . 26802 6 2 . . C 13 13C . . 1960.016 . . . . . . . 26802 6 3 . . N 15 15N . . 1822.157 . . . . . . . 26802 6 stop_ loop_ _Peak.ID _Peak.Figure_of_merit _Peak.Restraint _Peak.Details _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 1.0 . . 26802 6 2 1.0 . . 26802 6 3 1.0 . . 26802 6 4 1.0 . . 26802 6 5 1.0 . . 26802 6 6 1.0 . . 26802 6 7 1.0 . . 26802 6 8 1.0 . . 26802 6 9 1.0 . . 26802 6 10 1.0 . . 26802 6 11 1.0 . . 26802 6 12 1.0 . . 26802 6 13 1.0 . . 26802 6 14 1.0 . . 26802 6 15 1.0 . . 26802 6 16 1.0 . . 26802 6 17 1.0 . . 26802 6 18 1.0 . . 26802 6 19 1.0 . . 26802 6 20 1.0 . . 26802 6 21 1.0 . . 26802 6 22 1.0 . . 26802 6 23 1.0 . . 26802 6 24 1.0 . . 26802 6 25 1.0 . . 26802 6 26 1.0 . . 26802 6 27 1.0 . . 26802 6 28 1.0 . . 26802 6 29 1.0 . . 26802 6 30 1.0 . . 26802 6 31 1.0 . . 26802 6 32 1.0 . . 26802 6 33 1.0 . . 26802 6 34 1.0 . . 26802 6 35 1.0 . . 26802 6 36 1.0 . . 26802 6 37 1.0 . . 26802 6 38 1.0 . . 26802 6 39 1.0 . . 26802 6 40 1.0 . . 26802 6 41 1.0 . . 26802 6 42 1.0 . . 26802 6 43 1.0 . . 26802 6 44 1.0 . . 26802 6 45 1.0 . . 26802 6 46 1.0 . . 26802 6 47 1.0 . . 26802 6 48 1.0 . . 26802 6 49 1.0 . . 26802 6 50 1.0 . . 26802 6 51 1.0 . . 26802 6 52 1.0 . . 26802 6 53 1.0 . . 26802 6 54 1.0 . . 26802 6 55 1.0 . . 26802 6 56 1.0 . . 26802 6 57 1.0 . . 26802 6 58 1.0 . . 26802 6 59 1.0 . . 26802 6 60 1.0 . . 26802 6 61 1.0 . . 26802 6 62 1.0 . . 26802 6 63 1.0 . . 26802 6 64 1.0 . . 26802 6 65 1.0 . . 26802 6 66 1.0 . . 26802 6 67 1.0 . . 26802 6 68 1.0 . . 26802 6 69 1.0 . . 26802 6 70 1.0 . . 26802 6 71 1.0 . . 26802 6 72 1.0 . . 26802 6 73 1.0 . . 26802 6 74 1.0 . . 26802 6 75 1.0 . . 26802 6 76 1.0 . . 26802 6 77 1.0 . . 26802 6 78 1.0 . . 26802 6 79 1.0 . . 26802 6 80 1.0 . . 26802 6 81 1.0 . . 26802 6 82 1.0 . . 26802 6 83 1.0 . . 26802 6 84 1.0 . . 26802 6 85 1.0 . . 26802 6 86 1.0 . . 26802 6 87 1.0 . . 26802 6 88 1.0 . . 26802 6 89 1.0 . . 26802 6 90 1.0 . . 26802 6 91 1.0 . . 26802 6 92 1.0 . . 26802 6 93 1.0 . . 26802 6 94 1.0 . . 26802 6 stop_ loop_ _Peak_general_char.Peak_ID _Peak_general_char.Intensity_val _Peak_general_char.Intensity_val_err _Peak_general_char.Measurement_method _Peak_general_char.Entry_ID _Peak_general_char.Spectral_peak_list_ID 1 432163392.0 . height 26802 6 1 10199155232.0 . volume 26802 6 2 525201664.0 . height 26802 6 2 12414888192.0 . volume 26802 6 3 537427392.0 . height 26802 6 3 12536350976.0 . volume 26802 6 4 524715456.0 . height 26802 6 4 12384213568.0 . volume 26802 6 5 293718400.0 . height 26802 6 5 6993321120.0 . volume 26802 6 6 314459584.0 . height 26802 6 6 7416615344.0 . volume 26802 6 7 656878720.0 . height 26802 6 7 15365158336.0 . volume 26802 6 8 288556640.0 . height 26802 6 8 6899035616.0 . volume 26802 6 9 812102656.0 . height 26802 6 9 19058500864.0 . volume 26802 6 10 625257152.0 . height 26802 6 10 14836172864.0 . volume 26802 6 11 719080768.0 . height 26802 6 11 16737225984.0 . volume 26802 6 12 632192256.0 . height 26802 6 12 14894558752.0 . volume 26802 6 13 506129024.0 . height 26802 6 13 12038159616.0 . volume 26802 6 14 184588016.0 . height 26802 6 14 4365081496.0 . volume 26802 6 15 681326784.0 . height 26802 6 15 16163406944.0 . volume 26802 6 16 337676736.0 . height 26802 6 16 7912155824.0 . volume 26802 6 17 439581376.0 . height 26802 6 17 10467032992.0 . volume 26802 6 18 884744960.0 . height 26802 6 18 20858666944.0 . volume 26802 6 19 436178720.0 . height 26802 6 19 10351571232.0 . volume 26802 6 20 885135744.0 . height 26802 6 20 20763386688.0 . volume 26802 6 21 1682638464.0 . height 26802 6 21 39103199872.0 . volume 26802 6 22 483873376.0 . height 26802 6 22 11665707296.0 . volume 26802 6 23 1308156928.0 . height 26802 6 23 30592050432.0 . volume 26802 6 24 269491008.0 . height 26802 6 24 6338209200.0 . volume 26802 6 25 1291056896.0 . height 26802 6 25 30278531008.0 . volume 26802 6 26 1342110336.0 . height 26802 6 26 31096618688.0 . volume 26802 6 27 599564736.0 . height 26802 6 27 14238507136.0 . volume 26802 6 28 542036352.0 . height 26802 6 28 12810938080.0 . volume 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volume 26802 6 90 82799280.0 . height 26802 6 90 1905607636.0 . volume 26802 6 91 59647704.0 . height 26802 6 91 1355428904.0 . volume 26802 6 92 59430716.0 . height 26802 6 92 1389485696.0 . volume 26802 6 93 58007884.0 . height 26802 6 93 1361397096.0 . volume 26802 6 94 69002440.0 . height 26802 6 94 1715845156.0 . volume 26802 6 stop_ loop_ _Peak_char.Peak_ID _Peak_char.Spectral_dim_ID _Peak_char.Chem_shift_val _Peak_char.Chem_shift_val_err _Peak_char.Line_width_val _Peak_char.Line_width_val_err _Peak_char.Phase_val _Peak_char.Phase_val_err _Peak_char.Decay_rate_val _Peak_char.Decay_rate_val_err _Peak_char.Coupling_pattern _Peak_char.Bounding_box_upper_val _Peak_char.Bounding_box_lower_val _Peak_char.Bounding_box_range_val _Peak_char.Details _Peak_char.Derivation_method_ID _Peak_char.Entry_ID _Peak_char.Spectral_peak_list_ID 1 1 9.066 . 20.6797141710 . . . . . . . . . . 1 26802 6 1 2 175.366 . 40.0979156280 . . . . . . . . . . 1 26802 6 1 3 133.712 . 41.2849293287 . . . . . . . . . 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40.8152699828 . . . . . . . . . . 1 26802 6 65 1 7.821 . 20.3004054037 . . . . . . . . . . 1 26802 6 65 2 176.094 . 39.0921600995 . . . . . . . . . . 1 26802 6 65 3 108.654 . 41.0316191521 . . . . . . . . . . 1 26802 6 66 1 7.435 . 18.3855205787 . . . . . . . . . . 1 26802 6 66 2 175.920 . 40.1650906110 . . . . . . . . . . 1 26802 6 66 3 108.802 . 40.6748385190 . . . . . . . . . . 1 26802 6 67 1 8.811 . 17.9015183096 . . . . . . . . . . 1 26802 6 67 2 176.232 . 40.1230916433 . . . . . . . . . . 1 26802 6 67 3 108.206 . 40.8563241926 . . . . . . . . . . 1 26802 6 68 1 8.192 . 22.2429801256 . . . . . . . . . . 1 26802 6 68 2 177.430 . 39.9952839365 . . . . . . . . . . 1 26802 6 68 3 107.873 . 40.5805658891 . . . . . . . . . . 1 26802 6 69 1 7.824 . 18.3502659162 . . . . . . . . . . 1 26802 6 69 2 177.796 . 40.7779601083 . . . . . . . . . . 1 26802 6 69 3 107.455 . 41.0084854307 . . . . . . . . . . 1 26802 6 70 1 8.100 . 23.2326798406 . . . . . . . . . . 1 26802 6 70 2 171.922 . 41.5540940208 . . . . . . . . . . 1 26802 6 70 3 105.704 . 41.1816082097 . . . . . . . . . . 1 26802 6 71 1 7.957 . 19.3542387739 . . . . . . . . . . 1 26802 6 71 2 176.232 . 40.0673072009 . . . . . . . . . . 1 26802 6 71 3 112.618 . 41.1137275717 . . . . . . . . . . 1 26802 6 72 1 8.627 . 25.0402306325 . . . . . . . . . . 1 26802 6 72 2 174.530 . 39.6809050159 . . . . . . . . . . 1 26802 6 72 3 123.694 . 40.5895261333 . . . . . . . . . . 1 26802 6 73 1 7.653 . 11.4540542878 . . . . . . . . . . 1 26802 6 73 2 177.944 . 39.2804837041 . . . . . . . . . . 1 26802 6 73 3 113.767 . 42.7239649128 . . . . . . . . . . 1 26802 6 74 1 7.048 . 14.7921141717 . . . . . . . . . . 1 26802 6 74 2 177.921 . 38.6352533889 . . . . . . . . . . 1 26802 6 74 3 113.712 . 42.4344132636 . . . . . . . . . . 1 26802 6 75 1 7.810 . 12.9470250145 . . . . . . . . . . 1 26802 6 75 2 180.998 . 40.6728458631 . . . . . . . . . . 1 26802 6 75 3 112.823 . 41.5319809105 . . . . . . . . . . 1 26802 6 76 1 6.797 . 14.2674334460 . . . . . . . . . . 1 26802 6 76 2 180.968 . 39.2050286742 . . . . . . . . . . 1 26802 6 76 3 112.741 . 43.4154785476 . . . . . . . . . . 1 26802 6 77 1 7.532 . 13.0415132192 . . . . . . . . . . 1 26802 6 77 2 176.483 . 39.8450456266 . . . . . . . . . . 1 26802 6 77 3 112.446 . 41.4062116645 . . . . . . . . . . 1 26802 6 78 1 7.246 . 15.9072748111 . . . . . . . . . . 1 26802 6 78 2 176.450 . 39.7086512046 . . . . . . . . . . 1 26802 6 78 3 112.389 . 43.5637298609 . . . . . . . . . . 1 26802 6 79 1 7.585 . 13.7006469492 . . . . . . . . . . 1 26802 6 79 2 177.047 . 39.9414271240 . . . . . . . . . . 1 26802 6 79 3 112.557 . 41.2585033963 . . . . . . . . . . 1 26802 6 80 1 6.927 . 14.7381616923 . . . . . . . . . . 1 26802 6 80 2 177.046 . 41.0644176011 . . . . . . . . . . 1 26802 6 80 3 112.498 . 42.2012296961 . . . . . . . . . . 1 26802 6 81 1 7.620 . 11.7026924337 . . . . . . . . . . 1 26802 6 81 2 180.408 . 41.1660854776 . . . . . . . . . . 1 26802 6 81 3 111.819 . 42.2289249964 . . . . . . . . . . 1 26802 6 82 1 6.902 . 14.0022384545 . . . . . . . . . . 1 26802 6 82 2 180.377 . 41.0850958133 . . . . . . . . . . 1 26802 6 82 3 111.776 . 42.4155152940 . . . . . . . . . . 1 26802 6 83 1 6.905 . 14.9699575298 . . . . . . . . . . 1 26802 6 83 2 179.539 . 39.0999582388 . . . . . . . . . . 1 26802 6 83 3 111.917 . 43.1588354317 . . . . . . . . . . 1 26802 6 84 1 7.225 . 11.7393744104 . . . . . . . . . . 1 26802 6 84 2 179.563 . 39.7009406848 . . . . . . . . . . 1 26802 6 84 3 111.960 . 41.7487645158 . . . . . . . . . . 1 26802 6 85 1 7.449 . 10.3132019915 . . . . . . . . . . 1 26802 6 85 2 180.399 . 39.4474719499 . . . . . . . . . . 1 26802 6 85 3 111.811 . 42.1992747337 . . . . . . . . . . 1 26802 6 86 1 6.847 . 13.7730117827 . . . . . . . . . . 1 26802 6 86 2 180.374 . 38.8091635786 . . . . . . . . . . 1 26802 6 86 3 111.765 . 42.8590745345 . . . . . . . . . . 1 26802 6 87 1 7.728 . 11.4718957162 . . . . . . . . . . 1 26802 6 87 2 180.101 . 39.6202576889 . . . . . . . . . . 1 26802 6 87 3 111.072 . 41.6984785392 . . . . . . . . . . 1 26802 6 88 1 6.752 . 14.2366034577 . . . . . . . . . . 1 26802 6 88 2 180.072 . 39.1564290344 . . . . . . . . . . 1 26802 6 88 3 111.000 . 42.3916213094 . . . . . . . . . . 1 26802 6 89 1 7.322 . 11.8037462840 . . . . . . . . . . 1 26802 6 89 2 179.851 . 39.5804346066 . . . . . . . . . . 1 26802 6 89 3 109.801 . 42.2347898835 . . . . . . . . . . 1 26802 6 90 1 6.835 . 13.9157432098 . . . . . . . . . . 1 26802 6 90 2 179.824 . 39.1808018706 . . . . . . . . . . 1 26802 6 90 3 109.753 . 42.3189618745 . . . . . . . . . . 1 26802 6 91 1 7.370 . 13.0589264533 . . . . . . . . . . 1 26802 6 91 2 179.354 . 40.3688060486 . . . . . . . . . . 1 26802 6 91 3 109.394 . 41.7490903429 . . . . . . . . . . 1 26802 6 92 1 6.651 . 15.3718892283 . . . . . . . . . . 1 26802 6 92 2 179.306 . 41.3582935486 . . . . . . . . . . 1 26802 6 92 3 109.311 . 42.1104325548 . . . . . . . . . . 1 26802 6 93 1 7.565 . 22.9650584149 . . . . . . . . . . 1 26802 6 93 2 177.156 . 39.5882619524 . . . . . . . . . . 1 26802 6 93 3 112.490 . 43.2273677238 . . . . . . . . . . 1 26802 6 94 1 6.918 . 17.7238176829 . . . . . . . . . . 1 26802 6 94 2 177.156 . 52.6027431636 . . . . . . . . . . 1 26802 6 94 3 112.490 . 41.7890584625 . . . . . . . . . . 1 26802 6 stop_ loop_ _Assigned_peak_chem_shift.Peak_ID _Assigned_peak_chem_shift.Spectral_dim_ID _Assigned_peak_chem_shift.Set_ID _Assigned_peak_chem_shift.Magnetization_linkage_ID _Assigned_peak_chem_shift.Assembly_atom_ID _Assigned_peak_chem_shift.Val _Assigned_peak_chem_shift.Contribution_fractional_val _Assigned_peak_chem_shift.Figure_of_merit _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID _Assigned_peak_chem_shift.Atom_chem_shift_ID _Assigned_peak_chem_shift.Entity_assembly_ID _Assigned_peak_chem_shift.Entity_ID _Assigned_peak_chem_shift.Comp_index_ID _Assigned_peak_chem_shift.Comp_ID _Assigned_peak_chem_shift.Atom_ID _Assigned_peak_chem_shift.Ambiguity_code _Assigned_peak_chem_shift.Ambiguity_set_ID _Assigned_peak_chem_shift.Auth_atom_peak_num _Assigned_peak_chem_shift.Auth_entity_ID _Assigned_peak_chem_shift.Auth_seq_ID _Assigned_peak_chem_shift.Auth_comp_ID _Assigned_peak_chem_shift.Auth_atom_ID _Assigned_peak_chem_shift.Auth_ambiguity_code _Assigned_peak_chem_shift.Auth_ambiguity_set_ID _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID _Assigned_peak_chem_shift.Resonance_ID _Assigned_peak_chem_shift.Details _Assigned_peak_chem_shift.Entry_ID _Assigned_peak_chem_shift.Spectral_peak_list_ID 1 1 1 . . 9.066 . . 1 . 1 1 7 LYS H . . . . . . . . . . 89 . 26802 6 1 2 1 . . 175.366 . . 1 . 1 1 6 VAL C . . . . . . . . . . 393 . 26802 6 1 3 1 . . 133.712 . . 1 . 1 1 7 LYS N . . . . . . . . . . 90 . 26802 6 2 1 1 . . 9.218 . . 1 . 1 1 19 ALA H . . . . . . . . . . 25 . 26802 6 2 2 1 . . 173.779 . . 1 . 1 1 18 ILE C . . . . . . . . . . 394 . 26802 6 2 3 1 . . 131.149 . . 1 . 1 1 19 ALA N . . . . . . . . . . 26 . 26802 6 3 1 1 . . 8.389 . . 1 . 1 1 28 PHE H . . . . . . . . . . 95 . 26802 6 3 2 1 . . 174.631 . . 1 . 1 1 27 VAL C . . . . . . . . . . 396 . 26802 6 3 3 1 . . 129.886 . . 1 . 1 1 28 PHE N . . . . . . . . . . 96 . 26802 6 4 1 1 . . 8.976 . . 1 . 1 1 11 ALA H . . . . . . . . . . 123 . 26802 6 4 2 1 . . 174.121 . . 1 . 1 1 10 ASN C . . . . . . . . . . 397 . 26802 6 4 3 1 . . 128.666 . . 1 . 1 1 11 ALA N . . . . . . . . . . 124 . 26802 6 5 1 1 . . 8.966 . . 1 . 1 1 30 HIS H . . . . . . . . . . 85 . 26802 6 5 2 1 . . 170.181 . . 1 . 1 1 29 VAL C . . . . . . . . . . 467 . 26802 6 5 3 1 . . 127.791 . . 1 . 1 1 30 HIS N . . . . . . . . . . 86 . 26802 6 6 1 1 . . 8.789 . . 1 . 1 1 35 GLN H . . . . . . . . . . 75 . 26802 6 6 2 1 . . 175.992 . . 1 . 1 1 34 ILE C . . . . . . . . . . 399 . 26802 6 6 3 1 . . 127.623 . . 1 . 1 1 35 GLN N . . . . . . . . . . 76 . 26802 6 7 1 1 . . 9.138 . . 1 . 1 1 6 VAL H . . . . . . . . . . 63 . 26802 6 7 2 1 . . 174.238 . . 1 . 1 1 5 THR C . . . . . . . . . . 400 . 26802 6 7 3 1 . . 127.199 . . 1 . 1 1 6 VAL N . . . . . . . . . . 64 . 26802 6 8 1 1 . . 8.201 . . 1 . 1 1 10 ASN H . . . . . . . . . . 101 . 26802 6 8 2 1 . . 172.417 . . 1 . 1 1 9 PHE C . . . . . . . . . . 401 . 26802 6 8 3 1 . . 127.221 . . 1 . 1 1 10 ASN N . . . . . . . . . . 102 . 26802 6 9 1 1 . . 8.843 . . 1 . 1 1 47 LYS H . . . . . . . . . . 227 . 26802 6 9 2 1 . . 175.796 . . 1 . 1 1 46 GLN C . . . . . . . . . . 402 . 26802 6 9 3 1 . . 125.443 . . 1 . 1 1 47 LYS N . . . . . . . . . . 226 . 26802 6 10 1 1 . . 8.865 . . 1 . 1 1 66 ALA H . . . . . . . . . . 43 . 26802 6 10 2 1 . . 173.450 . . 1 . 1 1 65 HIS C . . . . . . . . . . 403 . 26802 6 10 3 1 . . 125.250 . . 1 . 1 1 66 ALA N . . . . . . . . . . 44 . 26802 6 11 1 1 . . 9.199 . . 1 . 1 1 21 ASP H . . . . . . . . . . 29 . 26802 6 11 2 1 . . 177.945 . . 1 . 1 1 20 PRO C . . . . . . . . . . 404 . 26802 6 11 3 1 . . 125.224 . . 1 . 1 1 21 ASP N . . . . . . . . . . 30 . 26802 6 12 1 1 . . 9.013 . . 1 . 1 1 61 ALA H . . . . . . . . . . 31 . 26802 6 12 2 1 . . 173.441 . . 1 . 1 1 60 GLN C . . . . . . . . . . 405 . 26802 6 12 3 1 . . 124.763 . . 1 . 1 1 61 ALA N . . . . . . . . . . 32 . 26802 6 13 1 1 . . 7.716 . . 1 . 1 1 29 VAL H . . . . . . . . . . 157 . 26802 6 13 2 1 . . 172.711 . . 1 . 1 1 28 PHE C . . . . . . . . . . 407 . 26802 6 13 3 1 . . 124.240 . . 1 . 1 1 29 VAL N . . . . . . . . . . 158 . 26802 6 14 1 1 . . 8.145 . . 1 . 1 1 40 ARG H . . . . . . . . . . 33 . 26802 6 14 2 1 . . 175.728 . . 1 . 1 1 39 PHE C . . . . . . . . . . 411 . 26802 6 14 3 1 . . 123.516 . . 1 . 1 1 40 ARG N . . . . . . . . . . 34 . 26802 6 15 1 1 . . 8.203 . . 1 . 1 1 67 LEU H . . . . . . . . . . 177 . 26802 6 15 2 1 . . 177.454 . . 1 . 1 1 66 ALA C . . . . . . . . . . 412 . 26802 6 15 3 1 . . 123.329 . . 1 . 1 1 67 LEU N . . . . . . . . . . 178 . 26802 6 16 1 1 . . 8.262 . . 1 . 1 1 31 TYR H . . . . . . . . . . 145 . 26802 6 16 2 1 . . 177.054 . . 1 . 1 1 30 HIS C . . . . . . . . . . 875 . 26802 6 16 3 1 . . 123.117 . . 1 . 1 1 31 TYR N . . . . . . . . . . 146 . 26802 6 17 1 1 . . 9.100 . . 1 . 1 1 65 HIS H . . . . . . . . . . 135 . 26802 6 17 2 1 . . 175.838 . . 1 . 1 1 64 VAL C . . . . . . . . . . 413 . 26802 6 17 3 1 . . 123.200 . . 1 . 1 1 65 HIS N . . . . . . . . . . 136 . 26802 6 18 1 1 . . 8.867 . . 1 . 1 1 52 ILE H . . . . . . . . . . 159 . 26802 6 18 2 1 . . 175.898 . . 1 . 1 1 51 GLU C . . . . . . . . . . 415 . 26802 6 18 3 1 . . 122.658 . . 1 . 1 1 52 ILE N . . . . . . . . . . 160 . 26802 6 19 1 1 . . 9.388 . . 1 . 1 1 18 ILE H . . . . . . . . . . 183 . 26802 6 19 2 1 . . 174.739 . . 1 . 1 1 17 PHE C . . . . . . . . . . 416 . 26802 6 19 3 1 . . 121.872 . . 1 . 1 1 18 ILE N . . . . . . . . . . 184 . 26802 6 20 1 1 . . 8.252 . . 1 . 1 1 75 GLN H . . . . . . . . . . 175 . 26802 6 20 2 1 . . 175.562 . . 1 . 1 1 74 PHE C . . . . . . . . . . 417 . 26802 6 20 3 1 . . 121.988 . . 1 . 1 1 75 GLN N . . . . . . . . . . 176 . 26802 6 21 1 1 . . 8.068 . . 1 . 1 1 72 LEU H . . . . . . . . . . 163 . 26802 6 21 2 1 . . 175.133 . . 1 . 1 1 71 ASN C . . . . . . . . . . 418 . 26802 6 21 3 1 . . 122.064 . . 1 . 1 1 72 LEU N . . . . . . . . . . 164 . 26802 6 22 1 1 . . 7.478 . . 1 . 1 1 34 ILE H . . . . . . . . . . 53 . 26802 6 22 2 1 . . 176.311 . . 1 . 1 1 33 GLU C . . . . . . . . . . 419 . 26802 6 22 3 1 . . 121.491 . . 1 . 1 1 34 ILE N . . . . . . . . . . 54 . 26802 6 23 1 1 . . 8.023 . . 1 . 1 1 74 PHE H . . . . . . . . . . 143 . 26802 6 23 2 1 . . 175.689 . . 1 . 1 1 73 TYR C . . . . . . . . . . 420 . 26802 6 23 3 1 . . 121.285 . . 1 . 1 1 74 PHE N . . . . . . . . . . 144 . 26802 6 24 1 1 . . 8.160 . . 1 . 1 1 39 PHE H . . . . . . . . . . 79 . 26802 6 24 2 1 . . 173.874 . . 1 . 1 1 38 GLY C . . . . . . . . . . 421 . 26802 6 24 3 1 . . 121.218 . . 1 . 1 1 39 PHE N . . . . . . . . . . 80 . 26802 6 25 1 1 . . 8.547 . . 1 . 1 1 54 GLU H . . . . . . . . . . 251 . 26802 6 25 2 1 . . 172.831 . . 1 . 1 1 53 GLY C . . . . . . . . . . 422 . 26802 6 25 3 1 . . 121.181 . . 1 . 1 1 54 GLU N . . . . . . . . . . 250 . 26802 6 26 1 1 . . 8.682 . . 1 . 1 1 44 GLU H . . . . . . . . . . 234 . 26802 6 26 2 1 . . 175.249 . . 1 . 1 1 43 GLU C . . . . . . . . . . 423 . 26802 6 26 3 1 . . 121.192 . . 1 . 1 1 44 GLU N . . . . . . . . . . 233 . 26802 6 27 1 1 . . 8.722 . . 1 . 1 1 49 GLU H . . . . . . . . . . 69 . 26802 6 27 2 1 . . 173.648 . . 1 . 1 1 48 VAL C . . . . . . . . . . 424 . 26802 6 27 3 1 . . 121.179 . . 1 . 1 1 49 GLU N . . . . . . . . . . 70 . 26802 6 28 1 1 . . 9.098 . . 1 . 1 1 9 PHE H . . . . . . . . . . 129 . 26802 6 28 2 1 . . 173.549 . . 1 . 1 1 8 TRP C . . . . . . . . . . 425 . 26802 6 28 3 1 . . 120.835 . . 1 . 1 1 9 PHE N . . . . . . . . . . 130 . 26802 6 29 1 1 . . 8.578 . . 1 . 1 1 70 GLU H . . . . . . . . . . 11 . 26802 6 29 2 1 . . 174.375 . . 1 . 1 1 69 GLY C . . . . . . . . . . 426 . 26802 6 29 3 1 . . 120.742 . . 1 . 1 1 70 GLU N . . . . . . . . . . 12 . 26802 6 30 1 1 . . 7.863 . . 1 . 1 1 46 GLN H . . . . . . . . . . 1 . 26802 6 30 2 1 . . 174.159 . . 1 . 1 1 45 ASN C . . . . . . . . . . 427 . 26802 6 30 3 1 . . 120.880 . . 1 . 1 1 46 GLN N . . . . . . . . . . 2 . 26802 6 31 1 1 . . 7.795 . . 1 . 1 1 33 GLU H . . . . . . . . . . 23 . 26802 6 31 2 1 . . 175.749 . . 1 . 1 1 32 SER C . . . . . . . . . . 873 . 26802 6 31 3 1 . . 120.152 . . 1 . 1 1 33 GLU N . . . . . . . . . . 24 . 26802 6 32 1 1 . . 7.857 . . 1 . 1 1 25 ALA H . . . . . . . . . . 41 . 26802 6 32 2 1 . . 171.788 . . 1 . 1 1 24 SER C . . . . . . . . . . 432 . 26802 6 32 3 1 . . 119.696 . . 1 . 1 1 25 ALA N . . . . . . . . . . 42 . 26802 6 33 1 1 . . 8.024 . . 1 . 1 1 73 TYR H . . . . . . . . . . 65 . 26802 6 33 2 1 . . 177.081 . . 1 . 1 1 72 LEU C . . . . . . . . . . 431 . 26802 6 33 3 1 . . 119.653 . . 1 . 1 1 73 TYR N . . . . . . . . . . 66 . 26802 6 34 1 1 . . 8.832 . . 1 . 1 1 60 GLN H . . . . . . . . . . 49 . 26802 6 34 2 1 . . 176.825 . . 1 . 1 1 59 PRO C . . . . . . . . . . 430 . 26802 6 34 3 1 . . 119.582 . . 1 . 1 1 60 GLN N . . . . . . . . . . 50 . 26802 6 35 1 1 . . 9.338 . . 1 . 1 1 27 VAL H . . . . . . . . . . 217 . 26802 6 35 2 1 . . 176.656 . . 1 . 1 1 26 ASP C . . . . . . . . . . 429 . 26802 6 35 3 1 . . 119.917 . . 1 . 1 1 27 VAL N . . . . . . . . . . 216 . 26802 6 36 1 1 . . 6.072 . . 1 . 1 1 42 LEU H . . . . . . . . . . 83 . 26802 6 36 2 1 . . 171.918 . . 1 . 1 1 41 THR C . . . . . . . . . . 392 . 26802 6 36 3 1 . . 119.125 . . 1 . 1 1 42 LEU N . . . . . . . . . . 84 . 26802 6 37 1 1 . . 8.294 . . 1 . 1 1 64 VAL H . . . . . . . . . . 77 . 26802 6 37 2 1 . . 174.836 . . 1 . 1 1 63 GLN C . . . . . . . . . . 433 . 26802 6 37 3 1 . . 119.140 . . 1 . 1 1 64 VAL N . . . . . . . . . . 78 . 26802 6 38 1 1 . . 8.476 . . 1 . 1 1 71 ASN H . . . . . . . . . . 91 . 26802 6 38 2 1 . . 176.368 . . 1 . 1 1 70 GLU C . . . . . . . . . . 434 . 26802 6 38 3 1 . . 119.026 . . 1 . 1 1 71 ASN N . . . . . . . . . . 92 . 26802 6 39 1 1 . . 9.294 . . 1 . 1 1 62 GLN H . . . . . . . . . . 5 . 26802 6 39 2 1 . . 176.198 . . 1 . 1 1 61 ALA C . . . . . . . . . . 435 . 26802 6 39 3 1 . . 118.744 . . 1 . 1 1 62 GLN N . . . . . . . . . . 6 . 26802 6 40 1 1 . . 9.447 . . 1 . 1 1 63 GLN H . . . . . . . . . . 3 . 26802 6 40 2 1 . . 174.905 . . 1 . 1 1 62 GLN C . . . . . . . . . . 436 . 26802 6 40 3 1 . . 118.863 . . 1 . 1 1 63 GLN N . . . . . . . . . . 4 . 26802 6 41 1 1 . . 8.788 . . 1 . 1 1 51 GLU H . . . . . . . . . . 27 . 26802 6 41 2 1 . . 172.260 . . 1 . 1 1 50 PHE C . . . . . . . . . . 437 . 26802 6 41 3 1 . . 118.367 . . 1 . 1 1 51 GLU N . . . . . . . . . . 28 . 26802 6 42 1 1 . . 8.388 . . 1 . 1 1 50 PHE H . . . . . . . . . . 55 . 26802 6 42 2 1 . . 174.416 . . 1 . 1 1 49 GLU C . . . . . . . . . . 438 . 26802 6 42 3 1 . . 118.096 . . 1 . 1 1 50 PHE N . . . . . . . . . . 56 . 26802 6 43 1 1 . . 8.125 . . 1 . 1 1 12 GLU H . . . . . . . . . . 51 . 26802 6 43 2 1 . . 178.962 . . 1 . 1 1 11 ALA C . . . . . . . . . . 439 . 26802 6 43 3 1 . . 118.073 . . 1 . 1 1 12 GLU N . . . . . . . . . . 52 . 26802 6 44 1 1 . . 8.056 . . 1 . 1 1 43 GLU H . . . . . . . . . . 236 . 26802 6 44 2 1 . . 174.596 . . 1 . 1 1 42 LEU C . . . . . . . . . . 440 . 26802 6 44 3 1 . . 118.080 . . 1 . 1 1 43 GLU N . . . . . . . . . . 237 . 26802 6 45 1 1 . . 8.373 . . 1 . 1 1 37 ASN H . . . . . . . . . . 244 . 26802 6 45 2 1 . . 173.291 . . 1 . 1 1 36 GLY C . . . . . . . . . . 441 . 26802 6 45 3 1 . . 117.867 . . 1 . 1 1 37 ASN N . . . . . . . . . . 245 . 26802 6 46 1 1 . . 8.017 . . 1 . 1 1 26 ASP H . . . . . . . . . . 59 . 26802 6 46 2 1 . . 176.370 . . 1 . 1 1 25 ALA C . . . . . . . . . . 442 . 26802 6 46 3 1 . . 117.555 . . 1 . 1 1 26 ASP N . . . . . . . . . . 60 . 26802 6 47 1 1 . . 7.810 . . 1 . 1 1 32 SER H . . . . . . . . . . 857 . 26802 6 47 2 1 . . 176.252 . . 1 . 1 1 31 TYR C . . . . . . . . . . 874 . 26802 6 47 3 1 . . 117.470 . . 1 . 1 1 32 SER N . . . . . . . . . . 856 . 26802 6 48 1 1 . . 8.042 . . 1 . 1 1 22 ASP H . . . . . . . . . . 61 . 26802 6 48 2 1 . . 176.885 . . 1 . 1 1 21 ASP C . . . . . . . . . . 445 . 26802 6 48 3 1 . . 116.692 . . 1 . 1 1 22 ASP N . . . . . . . . . . 62 . 26802 6 49 1 1 . . 8.406 . . 1 . 1 1 3 GLN H . . . . . . . . . . 87 . 26802 6 49 2 1 . . 172.386 . . 1 . 1 1 2 ALA C . . . . . . . . . . 444 . 26802 6 49 3 1 . . 116.427 . . 1 . 1 1 3 GLN N . . . . . . . . . . 88 . 26802 6 50 1 1 . . 8.990 . . 1 . 1 1 45 ASN H . . . . . . . . . . 231 . 26802 6 50 2 1 . . 176.877 . . 1 . 1 1 44 GLU C . . . . . . . . . . 443 . 26802 6 50 3 1 . . 116.472 . . 1 . 1 1 45 ASN N . . . . . . . . . . 230 . 26802 6 51 1 1 . . 8.989 . . 1 . 1 1 53 GLY H . . . . . . . . . . 248 . 26802 6 51 2 1 . . 176.372 . . 1 . 1 1 52 ILE C . . . . . . . . . . 446 . 26802 6 51 3 1 . . 116.052 . . 1 . 1 1 53 GLY N . . . . . . . . . . 247 . 26802 6 52 1 1 . . 7.579 . . 1 . 1 1 13 LYS H . . . . . . . . . . 119 . 26802 6 52 2 1 . . 178.498 . . 1 . 1 1 12 GLU C . . . . . . . . . . 447 . 26802 6 52 3 1 . . 116.118 . . 1 . 1 1 13 LYS N . . . . . . . . . . 120 . 26802 6 53 1 1 . . 7.976 . . 1 . 1 1 24 SER H . . . . . . . . . . 127 . 26802 6 53 2 1 . . 174.785 . . 1 . 1 1 23 GLY C . . . . . . . . . . 448 . 26802 6 53 3 1 . . 115.831 . . 1 . 1 1 24 SER N . . . . . . . . . . 128 . 26802 6 54 1 1 . . 8.340 . . 1 . 1 1 5 THR H . . . . . . . . . . 45 . 26802 6 54 2 1 . . 171.288 . . 1 . 1 1 4 GLY C . . . . . . . . . . 449 . 26802 6 54 3 1 . . 115.620 . . 1 . 1 1 5 THR N . . . . . . . . . . 46 . 26802 6 55 1 1 . . 8.650 . . 1 . 1 1 48 VAL H . . . . . . . . . . 151 . 26802 6 55 2 1 . . 177.001 . . 1 . 1 1 47 LYS C . . . . . . . . . . 450 . 26802 6 55 3 1 . . 114.959 . . 1 . 1 1 48 VAL N . . . . . . . . . . 152 . 26802 6 56 1 1 . . 8.368 . . 1 . 1 1 57 LYS H . . . . . . . . . . 171 . 26802 6 56 2 1 . . 179.252 . . 1 . 1 1 56 ALA C . . . . . . . . . . 451 . 26802 6 56 3 1 . . 114.822 . . 1 . 1 1 57 LYS N . . . . . . . . . . 172 . 26802 6 57 1 1 . . 7.679 . . 1 . 1 1 17 PHE H . . . . . . . . . . 165 . 26802 6 57 2 1 . . 170.517 . . 1 . 1 1 16 GLY C . . . . . . . . . . 452 . 26802 6 57 3 1 . . 114.706 . . 1 . 1 1 17 PHE N . . . . . . . . . . 166 . 26802 6 58 1 1 . . 6.665 . . 1 . 1 1 15 PHE H . . . . . . . . . . 17 . 26802 6 58 2 1 . . 172.356 . . 1 . 1 1 14 GLY C . . . . . . . . . . 453 . 26802 6 58 3 1 . . 112.712 . . 1 . 1 1 15 PHE N . . . . . . . . . . 18 . 26802 6 59 1 1 . . 7.380 . . 1 . 1 1 8 TRP H . . . . . . . . . . 131 . 26802 6 59 2 1 . . 176.418 . . 1 . 1 1 7 LYS C . . . . . . . . . . 456 . 26802 6 59 3 1 . . 112.080 . . 1 . 1 1 8 TRP N . . . . . . . . . . 132 . 26802 6 60 1 1 . . 7.567 . . 1 . 1 1 41 THR H . . . . . . . . . . 113 . 26802 6 60 2 1 . . 174.091 . . 1 . 1 1 40 ARG C . . . . . . . . . . 455 . 26802 6 60 3 1 . . 112.135 . . 1 . 1 1 41 THR N . . . . . . . . . . 114 . 26802 6 61 1 1 . . 8.626 . . 1 . 1 1 68 GLY H . . . . . . . . . . 167 . 26802 6 61 2 1 . . 177.703 . . 1 . 1 1 67 LEU C . . . . . . . . . . 457 . 26802 6 61 3 1 . . 110.665 . . 1 . 1 1 68 GLY N . . . . . . . . . . 168 . 26802 6 62 1 1 . . 8.339 . . 1 . 1 1 36 GLY H . . . . . . . . . . 125 . 26802 6 62 2 1 . . 175.965 . . 1 . 1 1 35 GLN C . . . . . . . . . . 458 . 26802 6 62 3 1 . . 109.835 . . 1 . 1 1 36 GLY N . . . . . . . . . . 126 . 26802 6 63 1 1 . . 8.427 . . 1 . 1 1 38 GLY H . . . . . . . . . . 155 . 26802 6 63 2 1 . . 175.539 . . 1 . 1 1 37 ASN C . . . . . . . . . . 459 . 26802 6 63 3 1 . . 109.401 . . 1 . 1 1 38 GLY N . . . . . . . . . . 156 . 26802 6 64 1 1 . . 8.320 . . 1 . 1 1 69 GLY H . . . . . . . . . . 169 . 26802 6 64 2 1 . . 174.560 . . 1 . 1 1 68 GLY C . . . . . . . . . . 460 . 26802 6 64 3 1 . . 108.680 . . 1 . 1 1 69 GLY N . . . . . . . . . . 170 . 26802 6 65 1 1 . . 7.821 . . 1 . 1 1 76 GLY H . . . . . . . . . . 173 . 26802 6 65 2 1 . . 176.094 . . 1 . 1 1 75 GLN C . . . . . . . . . . 461 . 26802 6 65 3 1 . . 108.654 . . 1 . 1 1 76 GLY N . . . . . . . . . . 174 . 26802 6 66 1 1 . . 7.435 . . 1 . 1 1 58 GLY H . . . . . . . . . . 161 . 26802 6 66 2 1 . . 175.920 . . 1 . 1 1 57 LYS C . . . . . . . . . . 462 . 26802 6 66 3 1 . . 108.802 . . 1 . 1 1 58 GLY N . . . . . . . . . . 162 . 26802 6 67 1 1 . . 8.811 . . 1 . 1 1 4 GLY H . . . . . . . . . . 179 . 26802 6 67 2 1 . . 176.232 . . 1 . 1 1 3 GLN C . . . . . . . . . . 463 . 26802 6 67 3 1 . . 108.206 . . 1 . 1 1 4 GLY N . . . . . . . . . . 180 . 26802 6 68 1 1 . . 8.192 . . 1 . 1 1 14 GLY H . . . . . . . . . . 9 . 26802 6 68 2 1 . . 177.430 . . 1 . 1 1 13 LYS C . . . . . . . . . . 464 . 26802 6 68 3 1 . . 107.873 . . 1 . 1 1 14 GLY N . . . . . . . . . . 10 . 26802 6 69 1 1 . . 7.824 . . 1 . 1 1 23 GLY H . . . . . . . . . . 21 . 26802 6 69 2 1 . . 177.796 . . 1 . 1 1 22 ASP C . . . . . . . . . . 465 . 26802 6 69 3 1 . . 107.455 . . 1 . 1 1 23 GLY N . . . . . . . . . . 22 . 26802 6 70 1 1 . . 8.100 . . 1 . 1 1 16 GLY H . . . . . . . . . . 147 . 26802 6 70 2 1 . . 171.922 . . 1 . 1 1 15 PHE C . . . . . . . . . . 466 . 26802 6 70 3 1 . . 105.704 . . 1 . 1 1 16 GLY N . . . . . . . . . . 148 . 26802 6 71 1 1 . . 7.957 . . 1 . 1 1 55 GLY H . . . . . . . . . . 254 . 26802 6 71 2 1 . . 176.232 . . 1 . 1 1 54 GLU C . . . . . . . . . . 454 . 26802 6 71 3 1 . . 112.618 . . 1 . 1 1 55 GLY N . . . . . . . . . . 253 . 26802 6 72 1 1 . . 8.627 . . 1 . 1 1 56 ALA H . . . . . . . . . . 181 . 26802 6 72 2 1 . . 174.530 . . 1 . 1 1 55 GLY C . . . . . . . . . . 410 . 26802 6 72 3 1 . . 123.694 . . 1 . 1 1 56 ALA N . . . . . . . . . . 182 . 26802 6 73 2 1 . . 177.944 . . 1 . 1 1 45 ASN CG . . . . . . . . . . 927 . 26802 6 74 2 1 . . 177.921 . . 1 . 1 1 45 ASN CG . . . . . . . . . . 927 . 26802 6 75 2 1 . . 180.998 . . 1 . 1 1 63 GLN CD . . . . . . . . . . 928 . 26802 6 76 2 1 . . 180.968 . . 1 . 1 1 63 GLN CD . . . . . . . . . . 928 . 26802 6 77 2 1 . . 176.483 . . 1 . 1 1 10 ASN CG . . . . . . . . . . 929 . 26802 6 78 2 1 . . 176.450 . . 1 . 1 1 10 ASN CG . . . . . . . . . . 929 . 26802 6 79 2 1 . . 177.047 . . 1 . 1 1 71 ASN CG . . . . . . . . . . 936 . 26802 6 80 2 1 . . 177.046 . . 1 . 1 1 71 ASN CG . . . . . . . . . . 936 . 26802 6 81 2 1 . . 180.408 . . 1 . 1 1 60 GLN CD . . . . . . . . . . 930 . 26802 6 82 2 1 . . 180.377 . . 1 . 1 1 60 GLN CD . . . . . . . . . . 930 . 26802 6 83 2 1 . . 179.539 . . 1 . 1 1 35 GLN CD . . . . . . . . . . 931 . 26802 6 84 2 1 . . 179.563 . . 1 . 1 1 35 GLN CD . . . . . . . . . . 931 . 26802 6 85 2 1 . . 180.399 . . 1 . 1 1 75 GLN CD . . . . . . . . . . 932 . 26802 6 86 2 1 . . 180.374 . . 1 . 1 1 75 GLN CD . . . . . . . . . . 932 . 26802 6 87 2 1 . . 180.101 . . 1 . 1 1 3 GLN CD . . . . . . . . . . 933 . 26802 6 88 2 1 . . 180.072 . . 1 . 1 1 3 GLN CD . . . . . . . . . . 933 . 26802 6 89 2 1 . . 179.851 . . 1 . 1 1 62 GLN CD . . . . . . . . . . 934 . 26802 6 90 2 1 . . 179.824 . . 1 . 1 1 62 GLN CD . . . . . . . . . . 934 . 26802 6 91 2 1 . . 179.354 . . 1 . 1 1 46 GLN CD . . . . . . . . . . 935 . 26802 6 92 2 1 . . 179.306 . . 1 . 1 1 46 GLN CD . . . . . . . . . . 935 . 26802 6 93 2 1 . . 177.156 . . 1 . 1 1 37 ASN CG . . . . . . . . . . 937 . 26802 6 94 2 1 . . 177.156 . . 1 . 1 1 37 ASN CG . . . . . . . . . . 937 . 26802 6 stop_ save_