data_18841 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18841 _Entry.Title ; E. coli O157 ParE2-associated antitoxin 2 (PaaA2) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2012-11-15 _Entry.Accession_date 2012-11-15 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _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 ; The antitoxins from prokaryotic type II toxin-antitoxin modules are usually characterized by a high degree of flexibility or intrinsic disorder. The description of such highly flexible proteins is challenging since they cannot be represented by a single structure. Here, we present a novel ensemble-based refinement protocol that combines SAXS and NMR data to describe the conformational ensemble of the PaaA2 antitoxin from the human pathogen E. coli O157. The method encompasses the use of SAXS data to filter ensembles out of a pool of NMR-generated structures. The selected ensembles are then compared to the experimental SAXS and NMR data by applying a jackknife procedure and back-calculating ensemble-averaged NOEs, respectively. Through this method, we show that the conformational ensemble of PaaA2 displays an uneven distribution in that two distinct populations are required to adequately describe the experimental data. Furthermore, PaaA2 exists in solution as two pre-formed, transient helices connected by a highly flexible linker, which probably act as molecular recognition elements for the inhibition of the ParE2 toxin. ; 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 Yann Sterckx . G.J. . . 18841 2 Nico 'van Nuland' . A.J. . . 18841 3 Wim Vranken . F. . . 18841 4 Remy Loris . . . . 18841 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' . 18841 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Structural Biology Brussels (VUB)' . 18841 2 . 'Molecular Recognition (VIB)' . 18841 3 . 'VAN NULANDGroup' . 18841 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Partially disordered protein' . 18841 SAXS/NMR . 18841 Toxin-antitoxin . 18841 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18841 spectral_peak_list 3 18841 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 311 18841 '15N chemical shifts' 70 18841 '1H chemical shifts' 484 18841 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 . . 2014-05-05 2012-11-15 update BMRB 'update entry citation' 18841 1 . . 2014-01-13 2012-11-15 original author 'original release' 18841 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18841 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 24768114 _Citation.Full_citation . _Citation.Title ; Small-Angle X-Ray Scattering- and Nuclear Magnetic Resonance-Derived Conformational Ensemble of the Highly Flexible Antitoxin PaaA2. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Structure _Citation.Journal_name_full 'Structure (London, England : 1993)' _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year 2014 _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 Yann Sterckx . G.J. . . 18841 1 2 Alexander Volkov . N. . . 18841 1 3 Wim Vranken . F. . . 18841 1 4 Jaka Kragelj . . . . 18841 1 5 'Malene Ringkjbing' Jensen . . . . 18841 1 6 Lieven Buts . . . . 18841 1 7 Abel Garcia-Pino . . . . 18841 1 8 Thomas Jove . . . . 18841 1 9 Laurence 'Van Melderen' . . . . 18841 1 10 Martin Blackledge . . . . 18841 1 11 Nico 'van Nuland' . A.J. . . 18841 1 12 Remy Loris . . . . 18841 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18841 _Assembly.ID 1 _Assembly.Name 'Antitoxin PaaA2' _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 8457.4051 _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 'Antitoxin PaaA2' 1 $Molecule_1 A . yes native no no . . 'The first 8 residues are a FLAG-tag' 18841 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Molecule_1 _Entity.Sf_category entity _Entity.Sf_framecode Molecule_1 _Entity.Entry_ID 18841 _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 ; MDYKDDDDKNRALSPMVSEF ETIEQENSYNEWLRAKVATS LADPRPAIPHDEVERRMAER FAKMRKERSKQ ; _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 71 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 8457.4051 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'The first 8 residues are a FLAG-tag' _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes PDB 3ZBE . 3ZBE . . . . . . . . . . . . . . 18841 1 2 no PDB 3ZBE . 'E. Coli O157 Pare2-associated Antitoxin 2 (paaa2)' . . . . . 100.00 71 100.00 100.00 7.15e-43 . . . . 18841 1 3 no DBJ BAI25904 . 'hypothetical protein ECO26_2665 [Escherichia coli O26:H11 str. 11368]' . . . . . 87.32 63 100.00 100.00 9.45e-36 . . . . 18841 1 4 no DBJ BAI35348 . 'conserved predicted protein [Escherichia coli O111:H- str. 11128]' . . . . . 87.32 63 100.00 100.00 9.45e-36 . . . . 18841 1 5 no EMBL CTR47374 . 'Uncharacterised protein [Escherichia coli]' . . . . . 87.32 63 100.00 100.00 9.45e-36 . . . . 18841 1 6 no EMBL CTS93085 . 'Uncharacterised protein [Escherichia coli]' . . . . . 87.32 63 100.00 100.00 9.45e-36 . . . . 18841 1 7 no EMBL CTT27087 . 'Uncharacterised protein [Escherichia coli]' . . . . . 87.32 63 100.00 100.00 9.45e-36 . . . . 18841 1 8 no EMBL CTT30972 . 'Uncharacterised protein [Escherichia coli]' . . . . . 87.32 63 100.00 100.00 9.45e-36 . . . . 18841 1 9 no EMBL CTT49998 . 'Uncharacterised protein [Escherichia coli]' . . . . . 87.32 63 100.00 100.00 9.45e-36 . . . . 18841 1 10 no GB AAK16987 . ; unknown protein encoded by cryptic prophage CP-933P [Escherichia coli O157:H7 str. EDL933] ; . . . . . 87.32 63 100.00 100.00 9.45e-36 . . . . 18841 1 11 no GB AIL18032 . 'hypothetical protein DR76_3790 [Escherichia coli ATCC 25922]' . . . . . 87.32 63 100.00 100.00 9.45e-36 . . . . 18841 1 12 no GB ALH93779 . 'stability determinant [Escherichia coli O157:H7]' . . . . . 87.32 63 100.00 100.00 9.45e-36 . . . . 18841 1 13 no GB EDZ74536 . 'conserved hypothetical protein [Escherichia coli O157:H7 str. EC4206]' . . . . . 87.32 63 100.00 100.00 9.45e-36 . . . . 18841 1 14 no GB EFZ43696 . 'stability determinant domain protein [Escherichia coli EPECa14]' . . . . . 61.97 44 100.00 100.00 7.42e-22 . . . . 18841 1 15 no REF WP_000315207 . 'hypothetical protein, partial [Escherichia coli]' . . . . . 61.97 44 100.00 100.00 7.42e-22 . . . . 18841 1 16 no REF WP_001302048 . 'MULTISPECIES: hypothetical protein [Escherichia]' . . . . . 87.32 63 100.00 100.00 9.45e-36 . . . . 18841 1 17 no REF WP_001463348 . 'stability determinant [Escherichia coli]' . . . . . 87.32 63 98.39 98.39 3.59e-35 . . . . 18841 1 18 no REF WP_032300357 . 'stability determinant [Escherichia coli]' . . . . . 87.32 63 98.39 100.00 2.99e-35 . . . . 18841 1 19 no REF WP_042020325 . 'stability determinant [Escherichia coli]' . . . . . 87.32 63 98.39 98.39 3.63e-35 . . . . 18841 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 18841 1 2 . ASP . 18841 1 3 . TYR . 18841 1 4 . LYS . 18841 1 5 . ASP . 18841 1 6 . ASP . 18841 1 7 . ASP . 18841 1 8 . ASP . 18841 1 9 . LYS . 18841 1 10 . ASN . 18841 1 11 . ARG . 18841 1 12 . ALA . 18841 1 13 . LEU . 18841 1 14 . SER . 18841 1 15 . PRO . 18841 1 16 . MET . 18841 1 17 . VAL . 18841 1 18 . SER . 18841 1 19 . GLU . 18841 1 20 . PHE . 18841 1 21 . GLU . 18841 1 22 . THR . 18841 1 23 . ILE . 18841 1 24 . GLU . 18841 1 25 . GLN . 18841 1 26 . GLU . 18841 1 27 . ASN . 18841 1 28 . SER . 18841 1 29 . TYR . 18841 1 30 . ASN . 18841 1 31 . GLU . 18841 1 32 . TRP . 18841 1 33 . LEU . 18841 1 34 . ARG . 18841 1 35 . ALA . 18841 1 36 . LYS . 18841 1 37 . VAL . 18841 1 38 . ALA . 18841 1 39 . THR . 18841 1 40 . SER . 18841 1 41 . LEU . 18841 1 42 . ALA . 18841 1 43 . ASP . 18841 1 44 . PRO . 18841 1 45 . ARG . 18841 1 46 . PRO . 18841 1 47 . ALA . 18841 1 48 . ILE . 18841 1 49 . PRO . 18841 1 50 . HIS . 18841 1 51 . ASP . 18841 1 52 . GLU . 18841 1 53 . VAL . 18841 1 54 . GLU . 18841 1 55 . ARG . 18841 1 56 . ARG . 18841 1 57 . MET . 18841 1 58 . ALA . 18841 1 59 . GLU . 18841 1 60 . ARG . 18841 1 61 . PHE . 18841 1 62 . ALA . 18841 1 63 . LYS . 18841 1 64 . MET . 18841 1 65 . ARG . 18841 1 66 . LYS . 18841 1 67 . GLU . 18841 1 68 . ARG . 18841 1 69 . SER . 18841 1 70 . LYS . 18841 1 71 . GLN . 18841 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 18841 1 . ASP 2 2 18841 1 . TYR 3 3 18841 1 . LYS 4 4 18841 1 . ASP 5 5 18841 1 . ASP 6 6 18841 1 . ASP 7 7 18841 1 . ASP 8 8 18841 1 . LYS 9 9 18841 1 . ASN 10 10 18841 1 . ARG 11 11 18841 1 . ALA 12 12 18841 1 . LEU 13 13 18841 1 . SER 14 14 18841 1 . PRO 15 15 18841 1 . MET 16 16 18841 1 . VAL 17 17 18841 1 . SER 18 18 18841 1 . GLU 19 19 18841 1 . PHE 20 20 18841 1 . GLU 21 21 18841 1 . THR 22 22 18841 1 . ILE 23 23 18841 1 . GLU 24 24 18841 1 . GLN 25 25 18841 1 . GLU 26 26 18841 1 . ASN 27 27 18841 1 . SER 28 28 18841 1 . TYR 29 29 18841 1 . ASN 30 30 18841 1 . GLU 31 31 18841 1 . TRP 32 32 18841 1 . LEU 33 33 18841 1 . ARG 34 34 18841 1 . ALA 35 35 18841 1 . LYS 36 36 18841 1 . VAL 37 37 18841 1 . ALA 38 38 18841 1 . THR 39 39 18841 1 . SER 40 40 18841 1 . LEU 41 41 18841 1 . ALA 42 42 18841 1 . ASP 43 43 18841 1 . PRO 44 44 18841 1 . ARG 45 45 18841 1 . PRO 46 46 18841 1 . ALA 47 47 18841 1 . ILE 48 48 18841 1 . PRO 49 49 18841 1 . HIS 50 50 18841 1 . ASP 51 51 18841 1 . GLU 52 52 18841 1 . VAL 53 53 18841 1 . GLU 54 54 18841 1 . ARG 55 55 18841 1 . ARG 56 56 18841 1 . MET 57 57 18841 1 . ALA 58 58 18841 1 . GLU 59 59 18841 1 . ARG 60 60 18841 1 . PHE 61 61 18841 1 . ALA 62 62 18841 1 . LYS 63 63 18841 1 . MET 64 64 18841 1 . ARG 65 65 18841 1 . LYS 66 66 18841 1 . GLU 67 67 18841 1 . ARG 68 68 18841 1 . SER 69 69 18841 1 . LYS 70 70 18841 1 . GLN 71 71 18841 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 18841 _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 . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli O157\:H7 . . . . . . . . . . . . 18841 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 18841 _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) . . . . . pET21b . . . 18841 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_PaaA2 _Sample.Sf_category sample _Sample.Sf_framecode PaaA2 _Sample.Entry_ID 18841 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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-99% 13C; U-99% 15N]' . . 1 $Molecule_1 . . 0.5 . . mM . . . . 18841 1 2 Phosphate 'natural abundance' . . . . . . 20.0 . . mM . . . . 18841 1 3 NaCl 'natural abundance' . . . . . . 500.0 . . mM . . . . 18841 1 stop_ save_ save_sample_new_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_new_1 _Sample.Entry_ID 18841 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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-99% 13C; U-99% 15N]' . . 1 $Molecule_1 . . 0.5 . . mM . . . . 18841 2 2 Phosphate 'natural abundance' . . . . . . 20.0 . . mM . . . . 18841 2 3 NaCl 'natural abundance' . . . . . . 500.0 . . mM . . . . 18841 2 stop_ save_ ####################### # Sample conditions # ####################### save_PaaA2_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode PaaA2_1 _Sample_condition_list.Entry_ID 18841 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.500 . M 18841 1 pH 6.600 . pH 18841 1 pressure 1.000 . atm 18841 1 temperature 298.000 . K 18841 1 stop_ save_ ############################ # Computer software used # ############################ save_ARIA _Software.Sf_category software _Software.Sf_framecode ARIA _Software.Entry_ID 18841 _Software.ID 1 _Software.Type . _Software.Name ARIA _Software.Version 2.3 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "Linge, O'Donoghue and Nilges" . . 18841 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Structure calculation' 18841 1 stop_ save_ save_ATSAS _Software.Sf_category software _Software.Sf_framecode ATSAS _Software.Entry_ID 18841 _Software.ID 2 _Software.Type . _Software.Name ATSAS _Software.Version 2.4.3 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID ATSAS . . 18841 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Ensemble selection' 18841 2 stop_ save_ save_AutoDep _Software.Sf_category software _Software.Sf_framecode AutoDep _Software.Entry_ID 18841 _Software.ID 3 _Software.Type . _Software.Name AutoDep _Software.Version 4.3 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID PDBe . . 18841 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 18841 3 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 18841 _Software.ID 4 _Software.Type . _Software.Name CNS _Software.Version 1.2 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 18841 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Structure calculation' 18841 4 stop_ save_ save_CcpNmr_Analysis _Software.Sf_category software _Software.Sf_framecode CcpNmr_Analysis _Software.Entry_ID 18841 _Software.ID 5 _Software.Type . _Software.Name ANALYSIS _Software.Version 2.1 _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 18841 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Data analysis' 18841 5 stop_ save_ save_DANGLE _Software.Sf_category software _Software.Sf_framecode DANGLE _Software.Entry_ID 18841 _Software.ID 6 _Software.Type . _Software.Name DANGLE _Software.Version 1.1 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID DANGLE . . 18841 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Dihedral angle constraints' 18841 6 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 18841 _Software.ID 7 _Software.Type . _Software.Name NMRPipe _Software.Version 2.1 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 18841 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Data processing' 18841 7 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 18841 _Software.ID 8 _Software.Type . _Software.Name TALOS _Software.Version 1.0 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 18841 8 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 18841 8 stop_ save_ save_TALOS+ _Software.Sf_category software _Software.Sf_framecode TALOS+ _Software.Entry_ID 18841 _Software.ID 9 _Software.Type . _Software.Name TALOS+ _Software.Version 1.0 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 18841 9 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Dihedral angle constraints' 18841 9 stop_ save_ save_Structure_calculation_1 _Method.Sf_category method _Method.Sf_framecode Structure_calculation_1 _Method.Entry_ID 18841 _Method.ID 1 _Method.Derivation_type . _Method.Details 'Structure calculation' _Method.Computer_ID . _Method.Computer_label . save_ save_Ensemble_selection _Method.Sf_category method _Method.Sf_framecode Ensemble_selection _Method.Entry_ID 18841 _Method.ID 2 _Method.Derivation_type . _Method.Details 'Ensemble selection' _Method.Computer_ID . _Method.Computer_label . save_ save_Structure_calculation_1_2 _Method.Sf_category method _Method.Sf_framecode Structure_calculation_1_2 _Method.Entry_ID 18841 _Method.ID 3 _Method.Derivation_type . _Method.Details 'Structure calculation' _Method.Computer_ID . _Method.Computer_label . save_ save_sData_analysis_1 _Method.Sf_category method _Method.Sf_framecode sData_analysis_1 _Method.Entry_ID 18841 _Method.ID 4 _Method.Derivation_type . _Method.Details 'Data analysis' _Method.Computer_ID . _Method.Computer_label . save_ save_sData_analysis_1_2 _Method.Sf_category method _Method.Sf_framecode sData_analysis_1_2 _Method.Entry_ID 18841 _Method.ID 5 _Method.Derivation_type . _Method.Details 'Data analysis' _Method.Computer_ID . _Method.Computer_label . save_ save_Dihedral_angle_constraints_1 _Method.Sf_category method _Method.Sf_framecode Dihedral_angle_constraints_1 _Method.Entry_ID 18841 _Method.ID 6 _Method.Derivation_type . _Method.Details 'Dihedral angle constraints' _Method.Computer_ID . _Method.Computer_label . save_ save_sData_processing _Method.Sf_category method _Method.Sf_framecode sData_processing _Method.Entry_ID 18841 _Method.ID 7 _Method.Derivation_type . _Method.Details 'Data processing' _Method.Computer_ID . _Method.Computer_label . save_ save_Dihedral_angle_constraints_1_2 _Method.Sf_category method _Method.Sf_framecode Dihedral_angle_constraints_1_2 _Method.Entry_ID 18841 _Method.ID 8 _Method.Derivation_type . _Method.Details 'Dihedral angle constraints' _Method.Computer_ID . _Method.Computer_label . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_Varian_600_MHz _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode Varian_600_MHz _NMR_spectrometer.Entry_ID 18841 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model VNS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_VARIAN_VNS-600 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode VARIAN_VNS-600 _NMR_spectrometer.Entry_ID 18841 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model VNS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 18841 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 Varian_600_MHz Varian VNS . 600 . . . 18841 1 2 VARIAN_VNS-600 Varian VNS . 600 . . . 18841 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 18841 _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 $PaaA2 isotropic . . 1 $PaaA2_1 . . . 1 $Varian_600_MHz . . . . . . . . . . . . . . . . 18841 1 2 '3D HNCO' no . . . . . . . . . . 1 $PaaA2 isotropic . . 1 $PaaA2_1 . . . 1 $Varian_600_MHz . . . . . . . . . . . . . . . . 18841 1 3 '2D 1H-15N HSQC/HMQC' no . . . . . . . . . . 1 $PaaA2 isotropic . . 1 $PaaA2_1 . . . 1 $Varian_600_MHz . . . . . . . . . . . . . . . . 18841 1 4 '2D 1H-13C HSQC/HMQC' no . . . . . . . . . . 1 $PaaA2 isotropic . . 1 $PaaA2_1 . . . 1 $Varian_600_MHz . . . . . . . . . . . . . . . . 18841 1 5 '2D 1H-13C HSQC/HMQC' no . . . . . . . . . . 1 $PaaA2 isotropic . . 1 $PaaA2_1 . . . 1 $Varian_600_MHz . . . . . . . . . . . . . . . . 18841 1 6 '3D HNCACB' no . . . . . . . . . . 1 $PaaA2 isotropic . . 1 $PaaA2_1 . . . 1 $Varian_600_MHz . . . . . . . . . . . . . . . . 18841 1 7 'cbcaconh (H[N[co[{CA|ca[C]}]]])' no . . . . . . . . . . 1 $PaaA2 isotropic . . 1 $PaaA2_1 . . . 1 $Varian_600_MHz . . . . . . . . . . . . . . . . 18841 1 8 'cconh (H[N[co[{CA|ca[C]}]]])' no . . . . . . . . . . 1 $PaaA2 isotropic . . 1 $PaaA2_1 . . . 1 $Varian_600_MHz . . . . . . . . . . . . . . . . 18841 1 9 'hbhaconh (H[N[ca[HA]]])' no . . . . . . . . . . 1 $PaaA2 isotropic . . 1 $PaaA2_1 . . . 1 $Varian_600_MHz . . . . . . . . . . . . . . . . 18841 1 10 'hbcbcgcdhd (hbCBcgcdceHE)' no . . . . . . . . . . 1 $PaaA2 isotropic . . 1 $PaaA2_1 . . . 1 $Varian_600_MHz . . . . . . . . . . . . . . . . 18841 1 11 'hbcbcgcdcehe (hbCBcgcdceHE)' no . . . . . . . . . . 1 $PaaA2 isotropic . . 1 $PaaA2_1 . . . 1 $Varian_600_MHz . . . . . . . . . . . . . . . . 18841 1 12 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $PaaA2 isotropic . . 1 $PaaA2_1 . . . 1 $Varian_600_MHz . . . . . . . . . . . . . . . . 18841 1 13 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $PaaA2 isotropic . . 1 $PaaA2_1 . . . 1 $Varian_600_MHz . . . . . . . . . . . . . . . . 18841 1 14 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $PaaA2 isotropic . . 1 $PaaA2_1 . . . 1 $Varian_600_MHz . . . . . . . . . . . . . . . . 18841 1 15 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $PaaA2 isotropic . . 1 $PaaA2_1 . . . 1 $Varian_600_MHz . . . . . . . . . . . . . . . . 18841 1 16 13CNOESY no . . . . . . . . . . 2 $sample_new_1 solution . . 1 $PaaA2_1 . . . 2 $VARIAN_VNS-600 . . . . . . . . . . . . . . . . 18841 1 17 15NNOESY no . . . . . . . . . . 2 $sample_new_1 solution . . 1 $PaaA2_1 . . . 2 $VARIAN_VNS-600 . . . . . . . . . . . . . . . . 18841 1 18 15NHSQC no . . . . . . . . . . 2 $sample_new_1 solution . . 1 $PaaA2_1 . . . 2 $VARIAN_VNS-600 . . . . . . . . . . . . . . . . 18841 1 19 15NHSQC2 no . . . . . . . . . . 2 $sample_new_1 solution . . 1 $PaaA2_1 . . . 2 $VARIAN_VNS-600 . . . . . . . . . . . . . . . . 18841 1 20 2DNOESY no . . . . . . . . . . 2 $sample_new_1 solution . . 1 $PaaA2_1 . . . 2 $VARIAN_VNS-600 . . . . . . . . . . . . . . . . 18841 1 21 HCCHTOCSY no . . . . . . . . . . 2 $sample_new_1 solution . . 1 $PaaA2_1 . . . 2 $VARIAN_VNS-600 . . . . . . . . . . . . . . . . 18841 1 22 PAAA2HNCO no . . . . . . . . . . 2 $sample_new_1 solution . . 1 $PaaA2_1 . . . 2 $VARIAN_VNS-600 . . . . . . . . . . . . . . . . 18841 1 23 ALIC13HSQC no . . . . . . . . . . 2 $sample_new_1 solution . . 1 $PaaA2_1 . . . 2 $VARIAN_VNS-600 . . . . . . . . . . . . . . . . 18841 1 24 AROC13HSQC no . . . . . . . . . . 2 $sample_new_1 solution . . 1 $PaaA2_1 . . . 2 $VARIAN_VNS-600 . . . . . . . . . . . . . . . . 18841 1 25 CBCACONH no . . . . . . . . . . 2 $sample_new_1 solution . . 1 $PaaA2_1 . . . 2 $VARIAN_VNS-600 . . . . . . . . . . . . . . . . 18841 1 26 CCONH no . . . . . . . . . . 2 $sample_new_1 solution . . 1 $PaaA2_1 . . . 2 $VARIAN_VNS-600 . . . . . . . . . . . . . . . . 18841 1 27 HBCBCGCDCEHE no . . . . . . . . . . 2 $sample_new_1 solution . . 1 $PaaA2_1 . . . 2 $VARIAN_VNS-600 . . . . . . . . . . . . . . . . 18841 1 28 HBCBCGCDHD no . . . . . . . . . . 2 $sample_new_1 solution . . 1 $PaaA2_1 . . . 2 $VARIAN_VNS-600 . . . . . . . . . . . . . . . . 18841 1 29 HBHACONH no . . . . . . . . . . 2 $sample_new_1 solution . . 1 $PaaA2_1 . . . 2 $VARIAN_VNS-600 . . . . . . . . . . . . . . . . 18841 1 30 HNCACB no . . . . . . . . . . 2 $sample_new_1 solution . . 1 $PaaA2_1 . . . 2 $VARIAN_VNS-600 . . . . . . . . . . . . . . . . 18841 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 18841 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 18841 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 18841 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 18841 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 18841 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $PaaA2_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 $PaaA2 isotropic 18841 1 1 '2D 1H-15N HSQC/HMQC' 1 $PaaA2 isotropic 18841 1 2 '3D HNCO' 1 $PaaA2 isotropic 18841 1 4 '2D 1H-13C HSQC/HMQC' 1 $PaaA2 isotropic 18841 1 4 '2D 1H-13C HSQC/HMQC' 1 $PaaA2 isotropic 18841 1 6 '3D HNCACB' 1 $PaaA2 isotropic 18841 1 7 'cbcaconh (H[N[co[{CA|ca[C]}]]])' 1 $PaaA2 isotropic 18841 1 8 'cconh (H[N[co[{CA|ca[C]}]]])' 1 $PaaA2 isotropic 18841 1 9 'hbhaconh (H[N[ca[HA]]])' 1 $PaaA2 isotropic 18841 1 10 'hbcbcgcdhd (hbCBcgcdceHE)' 1 $PaaA2 isotropic 18841 1 11 'hbcbcgcdcehe (hbCBcgcdceHE)' 1 $PaaA2 isotropic 18841 1 12 '2D 1H-1H NOESY' 1 $PaaA2 isotropic 18841 1 13 '3D 1H-15N NOESY' 1 $PaaA2 isotropic 18841 1 14 '3D 1H-13C NOESY' 1 $PaaA2 isotropic 18841 1 15 '3D HCCH-TOCSY' 1 $PaaA2 isotropic 18841 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.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 1 1 MET HA H 1 4.015 0.008 . 1 . . 792 . . 1 MET HA . 18841 1 2 . 1 1 1 1 MET HB2 H 1 2.047 0.008 . 1 . . 794 . . 1 MET HB2 . 18841 1 3 . 1 1 1 1 MET HB3 H 1 2.047 0.008 . 1 . . 795 . . 1 MET HB3 . 18841 1 4 . 1 1 1 1 MET HG2 H 1 2.421 0.008 . 2 . . 790 . . 1 MET HG2 . 18841 1 5 . 1 1 1 1 MET HG3 H 1 2.506 0.008 . 2 . . 789 . . 1 MET HG3 . 18841 1 6 . 1 1 1 1 MET CA C 13 55.181 0.04 . 1 . . 791 . . 1 MET CA . 18841 1 7 . 1 1 1 1 MET CB C 13 33.353 0.04 . 1 . . 793 . . 1 MET CB . 18841 1 8 . 1 1 1 1 MET CG C 13 31.054 0.04 . 1 . . 788 . . 1 MET CG . 18841 1 9 . 1 1 2 2 ASP HA H 1 4.677 0.008 . 1 . . 264 . . 2 ASP HA . 18841 1 10 . 1 1 2 2 ASP HB2 H 1 2.538 0.008 . 2 . . 266 . . 2 ASP HB2 . 18841 1 11 . 1 1 2 2 ASP HB3 H 1 2.657 0.008 . 2 . . 265 . . 2 ASP HB3 . 18841 1 12 . 1 1 2 2 ASP C C 13 175.304 0.04 . 1 . . 270 . . 2 ASP C . 18841 1 13 . 1 1 2 2 ASP CA C 13 54.131 0.04 . 1 . . 263 . . 2 ASP CA . 18841 1 14 . 1 1 2 2 ASP CB C 13 41.628 0.04 . 1 . . 262 . . 2 ASP CB . 18841 1 15 . 1 1 3 3 TYR H H 1 8.290 0.008 . 1 . . 15 . . 3 TYR H . 18841 1 16 . 1 1 3 3 TYR HA H 1 4.541 0.008 . 1 . . 267 . . 3 TYR HA . 18841 1 17 . 1 1 3 3 TYR HB2 H 1 3.053 0.008 . 2 . . 268 . . 3 TYR HB2 . 18841 1 18 . 1 1 3 3 TYR HB3 H 1 2.931 0.008 . 2 . . 269 . . 3 TYR HB3 . 18841 1 19 . 1 1 3 3 TYR HD1 H 1 7.125 0.008 . 3 . . 538 . . 3 TYR HD1 . 18841 1 20 . 1 1 3 3 TYR HD2 H 1 7.125 0.008 . 3 . . 538 . . 3 TYR HD2 . 18841 1 21 . 1 1 3 3 TYR HE1 H 1 6.836 0.008 . 3 . . 539 . . 3 TYR HE1 . 18841 1 22 . 1 1 3 3 TYR HE2 H 1 6.836 0.008 . 3 . . 539 . . 3 TYR HE2 . 18841 1 23 . 1 1 3 3 TYR C C 13 175.606 0.04 . 1 . . 271 . . 3 TYR C . 18841 1 24 . 1 1 3 3 TYR CA C 13 58.057 0.04 . 1 . . 254 . . 3 TYR CA . 18841 1 25 . 1 1 3 3 TYR CB C 13 38.904 0.04 . 1 . . 255 . . 3 TYR CB . 18841 1 26 . 1 1 3 3 TYR CD1 C 13 133.312 0.04 . 3 . . 627 . . 3 TYR CD1 . 18841 1 27 . 1 1 3 3 TYR CD2 C 13 133.312 0.04 . 3 . . 627 . . 3 TYR CD2 . 18841 1 28 . 1 1 3 3 TYR CE1 C 13 118.307 0.04 . 3 . . 551 . . 3 TYR CE1 . 18841 1 29 . 1 1 3 3 TYR CE2 C 13 118.307 0.04 . 3 . . 551 . . 3 TYR CE2 . 18841 1 30 . 1 1 3 3 TYR N N 15 121.124 0.04 . 1 . . 16 . . 3 TYR N . 18841 1 31 . 1 1 4 4 LYS H H 1 8.315 0.008 . 1 . . 118 . . 4 LYS H . 18841 1 32 . 1 1 4 4 LYS HA H 1 4.289 0.008 . 1 . . 273 . . 4 LYS HA . 18841 1 33 . 1 1 4 4 LYS HB2 H 1 1.730 0.008 . 2 . . 275 . . 4 LYS HB2 . 18841 1 34 . 1 1 4 4 LYS HB3 H 1 1.792 0.008 . 2 . . 274 . . 4 LYS HB3 . 18841 1 35 . 1 1 4 4 LYS HG2 H 1 1.365 0.008 . 1 . . 644 . . 4 LYS HG2 . 18841 1 36 . 1 1 4 4 LYS HG3 H 1 1.365 0.008 . 1 . . 643 . . 4 LYS HG3 . 18841 1 37 . 1 1 4 4 LYS HD2 H 1 1.690 0.008 . 1 . . 646 . . 4 LYS HD2 . 18841 1 38 . 1 1 4 4 LYS HD3 H 1 1.690 0.008 . 1 . . 645 . . 4 LYS HD3 . 18841 1 39 . 1 1 4 4 LYS HE2 H 1 3.005 0.008 . 1 . . 648 . . 4 LYS HE2 . 18841 1 40 . 1 1 4 4 LYS HE3 H 1 3.005 0.008 . 1 . . 647 . . 4 LYS HE3 . 18841 1 41 . 1 1 4 4 LYS C C 13 176.038 0.04 . 1 . . 272 . . 4 LYS C . 18841 1 42 . 1 1 4 4 LYS CA C 13 56.305 0.04 . 1 . . 260 . . 4 LYS CA . 18841 1 43 . 1 1 4 4 LYS CB C 13 33.295 0.04 . 1 . . 261 . . 4 LYS CB . 18841 1 44 . 1 1 4 4 LYS CG C 13 24.621 0.04 . 1 . . 531 . . 4 LYS CG . 18841 1 45 . 1 1 4 4 LYS CD C 13 29.057 0.04 . 1 . . 532 . . 4 LYS CD . 18841 1 46 . 1 1 4 4 LYS CE C 13 42.079 0.04 . 1 . . 533 . . 4 LYS CE . 18841 1 47 . 1 1 4 4 LYS N N 15 123.211 0.04 . 1 . . 119 . . 4 LYS N . 18841 1 48 . 1 1 5 5 ASP H H 1 8.280 0.008 . 1 . . 110 . . 5 ASP H . 18841 1 49 . 1 1 5 5 ASP HA H 1 4.578 0.008 . 1 . . 277 . . 5 ASP HA . 18841 1 50 . 1 1 5 5 ASP HB2 H 1 2.651 0.008 . 2 . . 279 . . 5 ASP HB2 . 18841 1 51 . 1 1 5 5 ASP HB3 H 1 2.738 0.008 . 2 . . 278 . . 5 ASP HB3 . 18841 1 52 . 1 1 5 5 ASP C C 13 176.061 0.04 . 1 . . 276 . . 5 ASP C . 18841 1 53 . 1 1 5 5 ASP CA C 13 54.461 0.04 . 1 . . 256 . . 5 ASP CA . 18841 1 54 . 1 1 5 5 ASP CB C 13 41.399 0.04 . 1 . . 257 . . 5 ASP CB . 18841 1 55 . 1 1 5 5 ASP N N 15 121.413 0.04 . 1 . . 111 . . 5 ASP N . 18841 1 56 . 1 1 6 6 ASP H H 1 8.282 0.008 . 1 . . 78 . . 6 ASP H . 18841 1 57 . 1 1 6 6 ASP HA H 1 4.577 0.008 . 1 . . 281 . . 6 ASP HA . 18841 1 58 . 1 1 6 6 ASP HB2 H 1 2.709 0.008 . 2 . . 282 . . 6 ASP HB2 . 18841 1 59 . 1 1 6 6 ASP HB3 H 1 2.645 0.008 . 2 . . 283 . . 6 ASP HB3 . 18841 1 60 . 1 1 6 6 ASP C C 13 176.565 0.04 . 1 . . 280 . . 6 ASP C . 18841 1 61 . 1 1 6 6 ASP CA C 13 54.856 0.04 . 1 . . 258 . . 6 ASP CA . 18841 1 62 . 1 1 6 6 ASP CB C 13 41.280 0.04 . 1 . . 259 . . 6 ASP CB . 18841 1 63 . 1 1 6 6 ASP N N 15 120.415 0.04 . 1 . . 79 . . 6 ASP N . 18841 1 64 . 1 1 7 7 ASP H H 1 8.292 0.008 . 1 . . 136 . . 7 ASP H . 18841 1 65 . 1 1 7 7 ASP CA C 13 55.018 0.04 . 1 . . 490 . . 7 ASP CA . 18841 1 66 . 1 1 7 7 ASP CB C 13 41.302 0.04 . 1 . . 489 . . 7 ASP CB . 18841 1 67 . 1 1 7 7 ASP N N 15 120.713 0.04 . 1 . . 137 . . 7 ASP N . 18841 1 68 . 1 1 8 8 ASP HA H 1 4.519 0.008 . 1 . . 285 . . 8 ASP HA . 18841 1 69 . 1 1 8 8 ASP HB2 H 1 2.708 0.008 . 1 . . 286 . . 8 ASP HB2 . 18841 1 70 . 1 1 8 8 ASP HB3 H 1 2.708 0.008 . 1 . . 493 . . 8 ASP HB3 . 18841 1 71 . 1 1 8 8 ASP C C 13 177.147 0.04 . 1 . . 284 . . 8 ASP C . 18841 1 72 . 1 1 8 8 ASP CA C 13 55.084 0.04 . 1 . . 491 . . 8 ASP CA . 18841 1 73 . 1 1 8 8 ASP CB C 13 41.078 0.04 . 1 . . 492 . . 8 ASP CB . 18841 1 74 . 1 1 9 9 LYS H H 1 8.175 0.008 . 1 . . 3 . . 9 LYS H . 18841 1 75 . 1 1 9 9 LYS HA H 1 4.167 0.008 . 1 . . 288 . . 9 LYS HA . 18841 1 76 . 1 1 9 9 LYS HB2 H 1 1.818 0.008 . 1 . . 289 . . 9 LYS HB2 . 18841 1 77 . 1 1 9 9 LYS HB3 H 1 1.818 0.008 . 1 . . 494 . . 9 LYS HB3 . 18841 1 78 . 1 1 9 9 LYS HG2 H 1 1.447 0.008 . 1 . . 653 . . 9 LYS HG2 . 18841 1 79 . 1 1 9 9 LYS HG3 H 1 1.447 0.008 . 1 . . 654 . . 9 LYS HG3 . 18841 1 80 . 1 1 9 9 LYS HD2 H 1 1.671 0.008 . 1 . . 651 . . 9 LYS HD2 . 18841 1 81 . 1 1 9 9 LYS HD3 H 1 1.671 0.008 . 1 . . 652 . . 9 LYS HD3 . 18841 1 82 . 1 1 9 9 LYS HE2 H 1 3.006 0.008 . 1 . . 650 . . 9 LYS HE2 . 18841 1 83 . 1 1 9 9 LYS HE3 H 1 3.006 0.008 . 1 . . 649 . . 9 LYS HE3 . 18841 1 84 . 1 1 9 9 LYS C C 13 177.063 0.04 . 1 . . 287 . . 9 LYS C . 18841 1 85 . 1 1 9 9 LYS CA C 13 57.293 0.04 . 1 . . 250 . . 9 LYS CA . 18841 1 86 . 1 1 9 9 LYS CB C 13 32.485 0.04 . 1 . . 251 . . 9 LYS CB . 18841 1 87 . 1 1 9 9 LYS CG C 13 24.769 0.04 . 1 . . 553 . . 9 LYS CG . 18841 1 88 . 1 1 9 9 LYS CD C 13 29.032 0.04 . 1 . . 554 . . 9 LYS CD . 18841 1 89 . 1 1 9 9 LYS CE C 13 42.165 0.04 . 1 . . 552 . . 9 LYS CE . 18841 1 90 . 1 1 9 9 LYS N N 15 120.855 0.04 . 1 . . 4 . . 9 LYS N . 18841 1 91 . 1 1 10 10 ASN H H 1 8.308 0.008 . 1 . . 11 . . 10 ASN H . 18841 1 92 . 1 1 10 10 ASN HA H 1 4.682 0.008 . 1 . . 291 . . 10 ASN HA . 18841 1 93 . 1 1 10 10 ASN HB2 H 1 2.864 0.008 . 2 . . 292 . . 10 ASN HB2 . 18841 1 94 . 1 1 10 10 ASN HB3 H 1 2.776 0.008 . 2 . . 293 . . 10 ASN HB3 . 18841 1 95 . 1 1 10 10 ASN HD21 H 1 7.742 0.008 . 1 . . 58 . . 10 ASN HD21 . 18841 1 96 . 1 1 10 10 ASN HD22 H 1 6.948 0.008 . 1 . . 105 . . 10 ASN HD22 . 18841 1 97 . 1 1 10 10 ASN C C 13 175.659 0.04 . 1 . . 290 . . 10 ASN C . 18841 1 98 . 1 1 10 10 ASN CA C 13 53.694 0.04 . 1 . . 249 . . 10 ASN CA . 18841 1 99 . 1 1 10 10 ASN CB C 13 38.743 0.04 . 1 . . 248 . . 10 ASN CB . 18841 1 100 . 1 1 10 10 ASN N N 15 118.057 0.04 . 1 . . 12 . . 10 ASN N . 18841 1 101 . 1 1 10 10 ASN ND2 N 15 113.577 0.04 . 1 . . 59 . . 10 ASN ND2 . 18841 1 102 . 1 1 11 11 ARG H H 1 8.022 0.008 . 1 . . 68 . . 11 ARG H . 18841 1 103 . 1 1 11 11 ARG HA H 1 4.255 0.008 . 1 . . 295 . . 11 ARG HA . 18841 1 104 . 1 1 11 11 ARG HB2 H 1 1.797 0.008 . 2 . . 297 . . 11 ARG HB2 . 18841 1 105 . 1 1 11 11 ARG HB3 H 1 1.869 0.008 . 2 . . 296 . . 11 ARG HB3 . 18841 1 106 . 1 1 11 11 ARG HG2 H 1 1.629 0.008 . 1 . . 657 . . 11 ARG HG2 . 18841 1 107 . 1 1 11 11 ARG HG3 H 1 1.629 0.008 . 1 . . 658 . . 11 ARG HG3 . 18841 1 108 . 1 1 11 11 ARG HD2 H 1 3.196 0.008 . 1 . . 655 . . 11 ARG HD2 . 18841 1 109 . 1 1 11 11 ARG HD3 H 1 3.196 0.008 . 1 . . 656 . . 11 ARG HD3 . 18841 1 110 . 1 1 11 11 ARG C C 13 176.191 0.04 . 1 . . 294 . . 11 ARG C . 18841 1 111 . 1 1 11 11 ARG CA C 13 56.699 0.04 . 1 . . 246 . . 11 ARG CA . 18841 1 112 . 1 1 11 11 ARG CB C 13 30.654 0.04 . 1 . . 247 . . 11 ARG CB . 18841 1 113 . 1 1 11 11 ARG CG C 13 27.201 0.04 . 1 . . 556 . . 11 ARG CG . 18841 1 114 . 1 1 11 11 ARG CD C 13 43.385 0.04 . 1 . . 555 . . 11 ARG CD . 18841 1 115 . 1 1 11 11 ARG N N 15 121.166 0.04 . 1 . . 69 . . 11 ARG N . 18841 1 116 . 1 1 12 12 ALA H H 1 8.178 0.008 . 1 . . 134 . . 12 ALA H . 18841 1 117 . 1 1 12 12 ALA HA H 1 4.310 0.008 . 1 . . 300 . . 12 ALA HA . 18841 1 118 . 1 1 12 12 ALA HB1 H 1 1.400 0.008 . 1 . . 299 . . 12 ALA HB1 . 18841 1 119 . 1 1 12 12 ALA HB2 H 1 1.400 0.008 . 1 . . 299 . . 12 ALA HB2 . 18841 1 120 . 1 1 12 12 ALA HB3 H 1 1.400 0.008 . 1 . . 299 . . 12 ALA HB3 . 18841 1 121 . 1 1 12 12 ALA C C 13 177.621 0.04 . 1 . . 298 . . 12 ALA C . 18841 1 122 . 1 1 12 12 ALA CA C 13 52.631 0.04 . 1 . . 244 . . 12 ALA CA . 18841 1 123 . 1 1 12 12 ALA CB C 13 19.140 0.04 . 1 . . 245 . . 12 ALA CB . 18841 1 124 . 1 1 12 12 ALA N N 15 124.159 0.04 . 1 . . 135 . . 12 ALA N . 18841 1 125 . 1 1 13 13 LEU H H 1 8.059 0.008 . 1 . . 9 . . 13 LEU H . 18841 1 126 . 1 1 13 13 LEU HA H 1 4.361 0.008 . 1 . . 304 . . 13 LEU HA . 18841 1 127 . 1 1 13 13 LEU HB2 H 1 1.652 0.008 . 2 . . 305 . . 13 LEU HB2 . 18841 1 128 . 1 1 13 13 LEU HB3 H 1 1.596 0.008 . 2 . . 306 . . 13 LEU HB3 . 18841 1 129 . 1 1 13 13 LEU HG H 1 1.667 0.008 . 1 . . 661 . . 13 LEU HG . 18841 1 130 . 1 1 13 13 LEU HD11 H 1 0.920 0.008 . 2 . . 660 . . 13 LEU HD11 . 18841 1 131 . 1 1 13 13 LEU HD12 H 1 0.920 0.008 . 2 . . 660 . . 13 LEU HD12 . 18841 1 132 . 1 1 13 13 LEU HD13 H 1 0.920 0.008 . 2 . . 660 . . 13 LEU HD13 . 18841 1 133 . 1 1 13 13 LEU HD21 H 1 0.863 0.008 . 2 . . 659 . . 13 LEU HD21 . 18841 1 134 . 1 1 13 13 LEU HD22 H 1 0.863 0.008 . 2 . . 659 . . 13 LEU HD22 . 18841 1 135 . 1 1 13 13 LEU HD23 H 1 0.863 0.008 . 2 . . 659 . . 13 LEU HD23 . 18841 1 136 . 1 1 13 13 LEU C C 13 177.214 0.04 . 1 . . 301 . . 13 LEU C . 18841 1 137 . 1 1 13 13 LEU CA C 13 55.004 0.04 . 1 . . 242 . . 13 LEU CA . 18841 1 138 . 1 1 13 13 LEU CB C 13 42.461 0.04 . 1 . . 243 . . 13 LEU CB . 18841 1 139 . 1 1 13 13 LEU CG C 13 27.133 0.04 . 1 . . 557 . . 13 LEU CG . 18841 1 140 . 1 1 13 13 LEU CD1 C 13 25.131 0.04 . 2 . . 558 . . 13 LEU CD1 . 18841 1 141 . 1 1 13 13 LEU CD2 C 13 23.409 0.04 . 2 . . 559 . . 13 LEU CD2 . 18841 1 142 . 1 1 13 13 LEU N N 15 120.732 0.04 . 1 . . 10 . . 13 LEU N . 18841 1 143 . 1 1 14 14 SER H H 1 8.178 0.008 . 1 . . 103 . . 14 SER H . 18841 1 144 . 1 1 14 14 SER HA H 1 4.752 0.008 . 1 . . 772 . . 14 SER HA . 18841 1 145 . 1 1 14 14 SER HB2 H 1 3.869 0.008 . 1 . . 770 . . 14 SER HB2 . 18841 1 146 . 1 1 14 14 SER HB3 H 1 3.869 0.008 . 1 . . 771 . . 14 SER HB3 . 18841 1 147 . 1 1 14 14 SER CA C 13 56.372 0.04 . 1 . . 302 . . 14 SER CA . 18841 1 148 . 1 1 14 14 SER CB C 13 63.465 0.04 . 1 . . 303 . . 14 SER CB . 18841 1 149 . 1 1 14 14 SER N N 15 117.563 0.04 . 1 . . 104 . . 14 SER N . 18841 1 150 . 1 1 15 15 PRO HA H 1 4.447 0.008 . 1 . . 308 . . 15 PRO HA . 18841 1 151 . 1 1 15 15 PRO HB2 H 1 1.913 0.008 . 2 . . 310 . . 15 PRO HB2 . 18841 1 152 . 1 1 15 15 PRO HB3 H 1 2.286 0.008 . 2 . . 309 . . 15 PRO HB3 . 18841 1 153 . 1 1 15 15 PRO HG2 H 1 1.999 0.008 . 1 . . 663 . . 15 PRO HG2 . 18841 1 154 . 1 1 15 15 PRO HG3 H 1 1.999 0.008 . 1 . . 662 . . 15 PRO HG3 . 18841 1 155 . 1 1 15 15 PRO HD2 H 1 3.720 0.008 . 2 . . 783 . . 15 PRO HD2 . 18841 1 156 . 1 1 15 15 PRO HD3 H 1 3.777 0.008 . 2 . . 664 . . 15 PRO HD3 . 18841 1 157 . 1 1 15 15 PRO C C 13 176.855 0.04 . 1 . . 307 . . 15 PRO C . 18841 1 158 . 1 1 15 15 PRO CA C 13 63.373 0.04 . 1 . . 496 . . 15 PRO CA . 18841 1 159 . 1 1 15 15 PRO CB C 13 32.180 0.04 . 1 . . 495 . . 15 PRO CB . 18841 1 160 . 1 1 15 15 PRO CG C 13 27.335 0.04 . 1 . . 561 . . 15 PRO CG . 18841 1 161 . 1 1 15 15 PRO CD C 13 50.794 0.04 . 1 . . 560 . . 15 PRO CD . 18841 1 162 . 1 1 16 16 MET H H 1 8.379 0.008 . 1 . . 7 . . 16 MET H . 18841 1 163 . 1 1 16 16 MET HA H 1 4.449 0.008 . 1 . . 312 . . 16 MET HA . 18841 1 164 . 1 1 16 16 MET HB2 H 1 2.037 0.008 . 2 . . 313 . . 16 MET HB2 . 18841 1 165 . 1 1 16 16 MET HB3 H 1 2.037 0.008 . 2 . . 314 . . 16 MET HB3 . 18841 1 166 . 1 1 16 16 MET HG2 H 1 2.590 0.008 . 2 . . 665 . . 16 MET HG2 . 18841 1 167 . 1 1 16 16 MET HG3 H 1 2.529 0.008 . 2 . . 666 . . 16 MET HG3 . 18841 1 168 . 1 1 16 16 MET HE1 H 1 2.087 0.008 . 1 . . 803 . . 16 MET HE1 . 18841 1 169 . 1 1 16 16 MET HE2 H 1 2.087 0.008 . 1 . . 803 . . 16 MET HE2 . 18841 1 170 . 1 1 16 16 MET HE3 H 1 2.087 0.008 . 1 . . 803 . . 16 MET HE3 . 18841 1 171 . 1 1 16 16 MET C C 13 176.235 0.04 . 1 . . 311 . . 16 MET C . 18841 1 172 . 1 1 16 16 MET CA C 13 55.768 0.04 . 1 . . 195 . . 16 MET CA . 18841 1 173 . 1 1 16 16 MET CB C 13 32.872 0.04 . 1 . . 194 . . 16 MET CB . 18841 1 174 . 1 1 16 16 MET CG C 13 32.176 0.04 . 1 . . 618 . . 16 MET CG . 18841 1 175 . 1 1 16 16 MET CE C 13 17.103 0.04 . 1 . . 802 . . 16 MET CE . 18841 1 176 . 1 1 16 16 MET N N 15 120.243 0.04 . 1 . . 8 . . 16 MET N . 18841 1 177 . 1 1 17 17 VAL H H 1 8.051 0.008 . 1 . . 128 . . 17 VAL H . 18841 1 178 . 1 1 17 17 VAL HA H 1 4.125 0.008 . 1 . . 316 . . 17 VAL HA . 18841 1 179 . 1 1 17 17 VAL HB H 1 2.069 0.008 . 1 . . 317 . . 17 VAL HB . 18841 1 180 . 1 1 17 17 VAL HG11 H 1 0.915 0.008 . 1 . . 668 . . 17 VAL HG11 . 18841 1 181 . 1 1 17 17 VAL HG12 H 1 0.915 0.008 . 1 . . 668 . . 17 VAL HG12 . 18841 1 182 . 1 1 17 17 VAL HG13 H 1 0.915 0.008 . 1 . . 668 . . 17 VAL HG13 . 18841 1 183 . 1 1 17 17 VAL HG21 H 1 0.915 0.008 . 1 . . 667 . . 17 VAL HG21 . 18841 1 184 . 1 1 17 17 VAL HG22 H 1 0.915 0.008 . 1 . . 667 . . 17 VAL HG22 . 18841 1 185 . 1 1 17 17 VAL HG23 H 1 0.915 0.008 . 1 . . 667 . . 17 VAL HG23 . 18841 1 186 . 1 1 17 17 VAL C C 13 175.969 0.04 . 1 . . 315 . . 17 VAL C . 18841 1 187 . 1 1 17 17 VAL CA C 13 62.303 0.04 . 1 . . 193 . . 17 VAL CA . 18841 1 188 . 1 1 17 17 VAL CB C 13 32.924 0.04 . 1 . . 192 . . 17 VAL CB . 18841 1 189 . 1 1 17 17 VAL CG1 C 13 21.267 0.04 . 2 . . 562 . . 17 VAL CG1 . 18841 1 190 . 1 1 17 17 VAL CG2 C 13 20.589 0.04 . 2 . . 563 . . 17 VAL CG2 . 18841 1 191 . 1 1 17 17 VAL N N 15 121.027 0.04 . 1 . . 129 . . 17 VAL N . 18841 1 192 . 1 1 18 18 SER H H 1 8.332 0.008 . 1 . . 122 . . 18 SER H . 18841 1 193 . 1 1 18 18 SER HA H 1 4.417 0.008 . 1 . . 319 . . 18 SER HA . 18841 1 194 . 1 1 18 18 SER HB2 H 1 3.852 0.008 . 2 . . 320 . . 18 SER HB2 . 18841 1 195 . 1 1 18 18 SER HB3 H 1 3.783 0.008 . 2 . . 321 . . 18 SER HB3 . 18841 1 196 . 1 1 18 18 SER C C 13 174.466 0.04 . 1 . . 318 . . 18 SER C . 18841 1 197 . 1 1 18 18 SER CA C 13 58.306 0.04 . 1 . . 191 . . 18 SER CA . 18841 1 198 . 1 1 18 18 SER CB C 13 63.972 0.04 . 1 . . 190 . . 18 SER CB . 18841 1 199 . 1 1 18 18 SER N N 15 118.998 0.04 . 1 . . 123 . . 18 SER N . 18841 1 200 . 1 1 19 19 GLU H H 1 8.353 0.008 . 1 . . 83 . . 19 GLU H . 18841 1 201 . 1 1 19 19 GLU HA H 1 4.187 0.008 . 1 . . 323 . . 19 GLU HA . 18841 1 202 . 1 1 19 19 GLU HB2 H 1 1.868 0.008 . 2 . . 324 . . 19 GLU HB2 . 18841 1 203 . 1 1 19 19 GLU HB3 H 1 1.804 0.008 . 2 . . 325 . . 19 GLU HB3 . 18841 1 204 . 1 1 19 19 GLU HG2 H 1 2.081 0.008 . 2 . . 670 . . 19 GLU HG2 . 18841 1 205 . 1 1 19 19 GLU HG3 H 1 2.023 0.008 . 2 . . 669 . . 19 GLU HG3 . 18841 1 206 . 1 1 19 19 GLU C C 13 176.103 0.04 . 1 . . 322 . . 19 GLU C . 18841 1 207 . 1 1 19 19 GLU CA C 13 56.948 0.04 . 1 . . 188 . . 19 GLU CA . 18841 1 208 . 1 1 19 19 GLU CB C 13 30.200 0.04 . 1 . . 189 . . 19 GLU CB . 18841 1 209 . 1 1 19 19 GLU CG C 13 36.106 0.04 . 1 . . 564 . . 19 GLU CG . 18841 1 210 . 1 1 19 19 GLU N N 15 122.706 0.04 . 1 . . 84 . . 19 GLU N . 18841 1 211 . 1 1 20 20 PHE H H 1 8.102 0.008 . 1 . . 53 . . 20 PHE H . 18841 1 212 . 1 1 20 20 PHE HA H 1 4.611 0.008 . 1 . . 327 . . 20 PHE HA . 18841 1 213 . 1 1 20 20 PHE HB2 H 1 3.199 0.008 . 2 . . 328 . . 20 PHE HB2 . 18841 1 214 . 1 1 20 20 PHE HB3 H 1 2.928 0.008 . 2 . . 329 . . 20 PHE HB3 . 18841 1 215 . 1 1 20 20 PHE HD1 H 1 7.198 0.008 . 3 . . 536 . . 20 PHE HD1 . 18841 1 216 . 1 1 20 20 PHE HD2 H 1 7.198 0.008 . 3 . . 536 . . 20 PHE HD2 . 18841 1 217 . 1 1 20 20 PHE HE1 H 1 7.248 0.008 . 3 . . 537 . . 20 PHE HE1 . 18841 1 218 . 1 1 20 20 PHE HE2 H 1 7.248 0.008 . 3 . . 537 . . 20 PHE HE2 . 18841 1 219 . 1 1 20 20 PHE HZ H 1 7.081 0.008 . 1 . . 639 . . 20 PHE HZ . 18841 1 220 . 1 1 20 20 PHE C C 13 175.962 0.04 . 1 . . 326 . . 20 PHE C . 18841 1 221 . 1 1 20 20 PHE CA C 13 57.757 0.04 . 1 . . 186 . . 20 PHE CA . 18841 1 222 . 1 1 20 20 PHE CB C 13 39.953 0.04 . 1 . . 187 . . 20 PHE CB . 18841 1 223 . 1 1 20 20 PHE CD1 C 13 131.664 0.04 . 3 . . 628 . . 20 PHE CD1 . 18841 1 224 . 1 1 20 20 PHE CD2 C 13 131.664 0.04 . 3 . . 628 . . 20 PHE CD2 . 18841 1 225 . 1 1 20 20 PHE CE1 C 13 131.518 0.04 . 3 . . 631 . . 20 PHE CE1 . 18841 1 226 . 1 1 20 20 PHE CE2 C 13 131.518 0.04 . 3 . . 631 . . 20 PHE CE2 . 18841 1 227 . 1 1 20 20 PHE CZ C 13 129.830 0.04 . 1 . . 640 . . 20 PHE CZ . 18841 1 228 . 1 1 20 20 PHE N N 15 119.361 0.04 . 1 . . 54 . . 20 PHE N . 18841 1 229 . 1 1 21 21 GLU H H 1 8.456 0.008 . 1 . . 33 . . 21 GLU H . 18841 1 230 . 1 1 21 21 GLU HA H 1 4.279 0.008 . 1 . . 331 . . 21 GLU HA . 18841 1 231 . 1 1 21 21 GLU HB2 H 1 2.058 0.008 . 1 . . 332 . . 21 GLU HB2 . 18841 1 232 . 1 1 21 21 GLU HB3 H 1 2.058 0.008 . 1 . . 502 . . 21 GLU HB3 . 18841 1 233 . 1 1 21 21 GLU HG2 H 1 2.316 0.008 . 2 . . 671 . . 21 GLU HG2 . 18841 1 234 . 1 1 21 21 GLU HG3 H 1 2.273 0.008 . 2 . . 672 . . 21 GLU HG3 . 18841 1 235 . 1 1 21 21 GLU C C 13 176.757 0.04 . 1 . . 330 . . 21 GLU C . 18841 1 236 . 1 1 21 21 GLU CA C 13 57.516 0.04 . 1 . . 184 . . 21 GLU CA . 18841 1 237 . 1 1 21 21 GLU CB C 13 30.659 0.04 . 1 . . 185 . . 21 GLU CB . 18841 1 238 . 1 1 21 21 GLU CG C 13 36.555 0.04 . 1 . . 565 . . 21 GLU CG . 18841 1 239 . 1 1 21 21 GLU N N 15 121.475 0.04 . 1 . . 34 . . 21 GLU N . 18841 1 240 . 1 1 22 22 THR H H 1 7.933 0.008 . 1 . . 13 . . 22 THR H . 18841 1 241 . 1 1 22 22 THR HA H 1 4.474 0.008 . 1 . . 334 . . 22 THR HA . 18841 1 242 . 1 1 22 22 THR HB H 1 4.378 0.008 . 1 . . 335 . . 22 THR HB . 18841 1 243 . 1 1 22 22 THR HG21 H 1 1.228 0.008 . 1 . . 674 . . 22 THR HG21 . 18841 1 244 . 1 1 22 22 THR HG22 H 1 1.228 0.008 . 1 . . 674 . . 22 THR HG22 . 18841 1 245 . 1 1 22 22 THR HG23 H 1 1.228 0.008 . 1 . . 674 . . 22 THR HG23 . 18841 1 246 . 1 1 22 22 THR C C 13 174.957 0.04 . 1 . . 333 . . 22 THR C . 18841 1 247 . 1 1 22 22 THR CA C 13 61.356 0.04 . 1 . . 182 . . 22 THR CA . 18841 1 248 . 1 1 22 22 THR CB C 13 70.790 0.04 . 1 . . 183 . . 22 THR CB . 18841 1 249 . 1 1 22 22 THR CG2 C 13 21.951 0.04 . 1 . . 673 . . 22 THR CG2 . 18841 1 250 . 1 1 22 22 THR N N 15 112.347 0.04 . 1 . . 14 . . 22 THR N . 18841 1 251 . 1 1 23 23 ILE H H 1 8.323 0.008 . 1 . . 45 . . 23 ILE H . 18841 1 252 . 1 1 23 23 ILE HA H 1 4.113 0.008 . 1 . . 337 . . 23 ILE HA . 18841 1 253 . 1 1 23 23 ILE HB H 1 1.873 0.008 . 1 . . 338 . . 23 ILE HB . 18841 1 254 . 1 1 23 23 ILE HG12 H 1 1.501 0.008 . 2 . . 677 . . 23 ILE HG12 . 18841 1 255 . 1 1 23 23 ILE HG13 H 1 1.228 0.008 . 2 . . 678 . . 23 ILE HG13 . 18841 1 256 . 1 1 23 23 ILE HG21 H 1 0.913 0.008 . 1 . . 676 . . 23 ILE HG21 . 18841 1 257 . 1 1 23 23 ILE HG22 H 1 0.913 0.008 . 1 . . 676 . . 23 ILE HG22 . 18841 1 258 . 1 1 23 23 ILE HG23 H 1 0.913 0.008 . 1 . . 676 . . 23 ILE HG23 . 18841 1 259 . 1 1 23 23 ILE HD11 H 1 0.860 0.008 . 1 . . 675 . . 23 ILE HD11 . 18841 1 260 . 1 1 23 23 ILE HD12 H 1 0.860 0.008 . 1 . . 675 . . 23 ILE HD12 . 18841 1 261 . 1 1 23 23 ILE HD13 H 1 0.860 0.008 . 1 . . 675 . . 23 ILE HD13 . 18841 1 262 . 1 1 23 23 ILE C C 13 176.814 0.04 . 1 . . 336 . . 23 ILE C . 18841 1 263 . 1 1 23 23 ILE CA C 13 62.105 0.04 . 1 . . 181 . . 23 ILE CA . 18841 1 264 . 1 1 23 23 ILE CB C 13 38.559 0.04 . 1 . . 180 . . 23 ILE CB . 18841 1 265 . 1 1 23 23 ILE CG1 C 13 27.923 0.04 . 1 . . 566 . . 23 ILE CG1 . 18841 1 266 . 1 1 23 23 ILE CG2 C 13 17.609 0.04 . 1 . . 567 . . 23 ILE CG2 . 18841 1 267 . 1 1 23 23 ILE CD1 C 13 13.162 0.04 . 1 . . 568 . . 23 ILE CD1 . 18841 1 268 . 1 1 23 23 ILE N N 15 122.874 0.04 . 1 . . 46 . . 23 ILE N . 18841 1 269 . 1 1 24 24 GLU H H 1 8.446 0.008 . 1 . . 35 . . 24 GLU H . 18841 1 270 . 1 1 24 24 GLU HA H 1 4.190 0.008 . 1 . . 340 . . 24 GLU HA . 18841 1 271 . 1 1 24 24 GLU HB2 H 1 2.013 0.008 . 1 . . 341 . . 24 GLU HB2 . 18841 1 272 . 1 1 24 24 GLU HB3 H 1 2.013 0.008 . 1 . . 503 . . 24 GLU HB3 . 18841 1 273 . 1 1 24 24 GLU HG2 H 1 2.293 0.008 . 1 . . 680 . . 24 GLU HG2 . 18841 1 274 . 1 1 24 24 GLU HG3 H 1 2.293 0.008 . 1 . . 679 . . 24 GLU HG3 . 18841 1 275 . 1 1 24 24 GLU C C 13 177.841 0.04 . 1 . . 339 . . 24 GLU C . 18841 1 276 . 1 1 24 24 GLU CA C 13 58.205 0.04 . 1 . . 179 . . 24 GLU CA . 18841 1 277 . 1 1 24 24 GLU CB C 13 29.654 0.04 . 1 . . 178 . . 24 GLU CB . 18841 1 278 . 1 1 24 24 GLU CG C 13 36.529 0.04 . 1 . . 569 . . 24 GLU CG . 18841 1 279 . 1 1 24 24 GLU N N 15 123.212 0.04 . 1 . . 36 . . 24 GLU N . 18841 1 280 . 1 1 25 25 GLN H H 1 8.183 0.008 . 1 . . 144 . . 25 GLN H . 18841 1 281 . 1 1 25 25 GLN HA H 1 4.217 0.008 . 1 . . 343 . . 25 GLN HA . 18841 1 282 . 1 1 25 25 GLN HB2 H 1 2.138 0.008 . 1 . . 504 . . 25 GLN HB2 . 18841 1 283 . 1 1 25 25 GLN HB3 H 1 2.138 0.008 . 1 . . 344 . . 25 GLN HB3 . 18841 1 284 . 1 1 25 25 GLN HG2 H 1 2.416 0.008 . 1 . . 625 . . 25 GLN HG2 . 18841 1 285 . 1 1 25 25 GLN HG3 H 1 2.416 0.008 . 1 . . 624 . . 25 GLN HG3 . 18841 1 286 . 1 1 25 25 GLN HE21 H 1 7.541 0.008 . 1 . . 55 . . 25 GLN HE21 . 18841 1 287 . 1 1 25 25 GLN HE22 H 1 6.950 0.008 . 1 . . 51 . . 25 GLN HE22 . 18841 1 288 . 1 1 25 25 GLN C C 13 177.044 0.04 . 1 . . 342 . . 25 GLN C . 18841 1 289 . 1 1 25 25 GLN CA C 13 57.192 0.04 . 1 . . 176 . . 25 GLN CA . 18841 1 290 . 1 1 25 25 GLN CB C 13 29.390 0.04 . 1 . . 177 . . 25 GLN CB . 18841 1 291 . 1 1 25 25 GLN CG C 13 34.090 0.04 . 1 . . 570 . . 25 GLN CG . 18841 1 292 . 1 1 25 25 GLN N N 15 120.567 0.04 . 1 . . 145 . . 25 GLN N . 18841 1 293 . 1 1 25 25 GLN NE2 N 15 112.258 0.04 . 1 . . 52 . . 25 GLN NE2 . 18841 1 294 . 1 1 26 26 GLU H H 1 8.176 0.008 . 1 . . 138 . . 26 GLU H . 18841 1 295 . 1 1 26 26 GLU HA H 1 3.804 0.008 . 1 . . 346 . . 26 GLU HA . 18841 1 296 . 1 1 26 26 GLU HB2 H 1 2.076 0.008 . 2 . . 347 . . 26 GLU HB2 . 18841 1 297 . 1 1 26 26 GLU HB3 H 1 1.919 0.008 . 2 . . 348 . . 26 GLU HB3 . 18841 1 298 . 1 1 26 26 GLU HG2 H 1 2.190 0.008 . 1 . . 682 . . 26 GLU HG2 . 18841 1 299 . 1 1 26 26 GLU HG3 H 1 2.190 0.008 . 1 . . 681 . . 26 GLU HG3 . 18841 1 300 . 1 1 26 26 GLU C C 13 177.244 0.04 . 1 . . 345 . . 26 GLU C . 18841 1 301 . 1 1 26 26 GLU CA C 13 58.035 0.04 . 1 . . 175 . . 26 GLU CA . 18841 1 302 . 1 1 26 26 GLU CB C 13 29.898 0.04 . 1 . . 174 . . 26 GLU CB . 18841 1 303 . 1 1 26 26 GLU CG C 13 36.112 0.04 . 1 . . 571 . . 26 GLU CG . 18841 1 304 . 1 1 26 26 GLU N N 15 121.801 0.04 . 1 . . 139 . . 26 GLU N . 18841 1 305 . 1 1 27 27 ASN H H 1 8.583 0.008 . 1 . . 114 . . 27 ASN H . 18841 1 306 . 1 1 27 27 ASN HA H 1 4.658 0.008 . 1 . . 350 . . 27 ASN HA . 18841 1 307 . 1 1 27 27 ASN HB2 H 1 2.866 0.008 . 1 . . 505 . . 27 ASN HB2 . 18841 1 308 . 1 1 27 27 ASN HB3 H 1 2.866 0.008 . 1 . . 351 . . 27 ASN HB3 . 18841 1 309 . 1 1 27 27 ASN HD21 H 1 6.921 0.008 . 1 . . 17 . . 27 ASN HD21 . 18841 1 310 . 1 1 27 27 ASN HD22 H 1 7.682 0.008 . 1 . . 87 . . 27 ASN HD22 . 18841 1 311 . 1 1 27 27 ASN C C 13 176.714 0.04 . 1 . . 349 . . 27 ASN C . 18841 1 312 . 1 1 27 27 ASN CA C 13 54.638 0.04 . 1 . . 172 . . 27 ASN CA . 18841 1 313 . 1 1 27 27 ASN CB C 13 38.588 0.04 . 1 . . 173 . . 27 ASN CB . 18841 1 314 . 1 1 27 27 ASN N N 15 118.872 0.04 . 1 . . 115 . . 27 ASN N . 18841 1 315 . 1 1 27 27 ASN ND2 N 15 112.736 0.04 . 1 . . 18 . . 27 ASN ND2 . 18841 1 316 . 1 1 28 28 SER H H 1 8.286 0.008 . 1 . . 74 . . 28 SER H . 18841 1 317 . 1 1 28 28 SER HA H 1 4.373 0.008 . 1 . . 353 . . 28 SER HA . 18841 1 318 . 1 1 28 28 SER HB2 H 1 3.990 0.008 . 2 . . 354 . . 28 SER HB2 . 18841 1 319 . 1 1 28 28 SER HB3 H 1 3.957 0.008 . 2 . . 355 . . 28 SER HB3 . 18841 1 320 . 1 1 28 28 SER C C 13 175.733 0.04 . 1 . . 352 . . 28 SER C . 18841 1 321 . 1 1 28 28 SER CA C 13 60.335 0.04 . 1 . . 170 . . 28 SER CA . 18841 1 322 . 1 1 28 28 SER CB C 13 63.350 0.04 . 1 . . 171 . . 28 SER CB . 18841 1 323 . 1 1 28 28 SER N N 15 116.204 0.04 . 1 . . 75 . . 28 SER N . 18841 1 324 . 1 1 29 29 TYR H H 1 8.237 0.008 . 1 . . 95 . . 29 TYR H . 18841 1 325 . 1 1 29 29 TYR HA H 1 4.295 0.008 . 1 . . 357 . . 29 TYR HA . 18841 1 326 . 1 1 29 29 TYR HB2 H 1 2.980 0.008 . 1 . . 358 . . 29 TYR HB2 . 18841 1 327 . 1 1 29 29 TYR HB3 H 1 2.980 0.008 . 1 . . 506 . . 29 TYR HB3 . 18841 1 328 . 1 1 29 29 TYR HD1 H 1 7.019 0.008 . 3 . . 534 . . 29 TYR HD1 . 18841 1 329 . 1 1 29 29 TYR HD2 H 1 7.019 0.008 . 3 . . 534 . . 29 TYR HD2 . 18841 1 330 . 1 1 29 29 TYR HE1 H 1 6.836 0.008 . 3 . . 535 . . 29 TYR HE1 . 18841 1 331 . 1 1 29 29 TYR HE2 H 1 6.836 0.008 . 3 . . 535 . . 29 TYR HE2 . 18841 1 332 . 1 1 29 29 TYR C C 13 176.441 0.04 . 1 . . 356 . . 29 TYR C . 18841 1 333 . 1 1 29 29 TYR CA C 13 60.446 0.04 . 1 . . 168 . . 29 TYR CA . 18841 1 334 . 1 1 29 29 TYR CB C 13 38.477 0.04 . 1 . . 169 . . 29 TYR CB . 18841 1 335 . 1 1 29 29 TYR CD1 C 13 133.239 0.04 . 3 . . 626 . . 29 TYR CD1 . 18841 1 336 . 1 1 29 29 TYR CD2 C 13 133.239 0.04 . 3 . . 626 . . 29 TYR CD2 . 18841 1 337 . 1 1 29 29 TYR CE1 C 13 118.307 0.04 . 3 . . 550 . . 29 TYR CE1 . 18841 1 338 . 1 1 29 29 TYR CE2 C 13 118.307 0.04 . 3 . . 550 . . 29 TYR CE2 . 18841 1 339 . 1 1 29 29 TYR N N 15 123.705 0.04 . 1 . . 96 . . 29 TYR N . 18841 1 340 . 1 1 30 30 ASN H H 1 8.317 0.008 . 1 . . 116 . . 30 ASN H . 18841 1 341 . 1 1 30 30 ASN HA H 1 4.428 0.008 . 1 . . 360 . . 30 ASN HA . 18841 1 342 . 1 1 30 30 ASN HB2 H 1 2.835 0.008 . 2 . . 361 . . 30 ASN HB2 . 18841 1 343 . 1 1 30 30 ASN HB3 H 1 2.721 0.008 . 2 . . 362 . . 30 ASN HB3 . 18841 1 344 . 1 1 30 30 ASN HD21 H 1 7.641 0.008 . 1 . . 76 . . 30 ASN HD21 . 18841 1 345 . 1 1 30 30 ASN HD22 H 1 7.059 0.008 . 1 . . 92 . . 30 ASN HD22 . 18841 1 346 . 1 1 30 30 ASN C C 13 177.386 0.04 . 1 . . 359 . . 30 ASN C . 18841 1 347 . 1 1 30 30 ASN CA C 13 55.452 0.04 . 1 . . 166 . . 30 ASN CA . 18841 1 348 . 1 1 30 30 ASN CB C 13 38.445 0.04 . 1 . . 167 . . 30 ASN CB . 18841 1 349 . 1 1 30 30 ASN N N 15 118.190 0.04 . 1 . . 117 . . 30 ASN N . 18841 1 350 . 1 1 30 30 ASN ND2 N 15 112.529 0.04 . 1 . . 77 . . 30 ASN ND2 . 18841 1 351 . 1 1 31 31 GLU H H 1 8.210 0.008 . 1 . . 124 . . 31 GLU H . 18841 1 352 . 1 1 31 31 GLU HA H 1 4.057 0.008 . 1 . . 364 . . 31 GLU HA . 18841 1 353 . 1 1 31 31 GLU HB2 H 1 2.078 0.008 . 1 . . 365 . . 31 GLU HB2 . 18841 1 354 . 1 1 31 31 GLU HB3 H 1 2.078 0.008 . 1 . . 507 . . 31 GLU HB3 . 18841 1 355 . 1 1 31 31 GLU HG2 H 1 2.258 0.008 . 1 . . 683 . . 31 GLU HG2 . 18841 1 356 . 1 1 31 31 GLU HG3 H 1 2.258 0.008 . 1 . . 684 . . 31 GLU HG3 . 18841 1 357 . 1 1 31 31 GLU C C 13 178.045 0.04 . 1 . . 363 . . 31 GLU C . 18841 1 358 . 1 1 31 31 GLU CA C 13 58.839 0.04 . 1 . . 165 . . 31 GLU CA . 18841 1 359 . 1 1 31 31 GLU CB C 13 29.631 0.04 . 1 . . 164 . . 31 GLU CB . 18841 1 360 . 1 1 31 31 GLU CG C 13 36.230 0.04 . 1 . . 572 . . 31 GLU CG . 18841 1 361 . 1 1 31 31 GLU N N 15 120.505 0.04 . 1 . . 125 . . 31 GLU N . 18841 1 362 . 1 1 32 32 TRP H H 1 8.031 0.008 . 1 . . 43 . . 32 TRP H . 18841 1 363 . 1 1 32 32 TRP HA H 1 4.316 0.008 . 1 . . 367 . . 32 TRP HA . 18841 1 364 . 1 1 32 32 TRP HB2 H 1 3.477 0.008 . 1 . . 368 . . 32 TRP HB2 . 18841 1 365 . 1 1 32 32 TRP HB3 H 1 3.265 0.008 . 2 . . 508 . . 32 TRP HB3 . 18841 1 366 . 1 1 32 32 TRP HD1 H 1 7.221 0.008 . 1 . . 542 . . 32 TRP HD1 . 18841 1 367 . 1 1 32 32 TRP HE1 H 1 10.177 0.008 . 1 . . 56 . . 32 TRP HE1 . 18841 1 368 . 1 1 32 32 TRP HE3 H 1 7.341 0.008 . 1 . . 637 . . 32 TRP HE3 . 18841 1 369 . 1 1 32 32 TRP HZ2 H 1 7.467 0.008 . 1 . . 548 . . 32 TRP HZ2 . 18841 1 370 . 1 1 32 32 TRP HZ3 H 1 7.066 0.008 . 1 . . 635 . . 32 TRP HZ3 . 18841 1 371 . 1 1 32 32 TRP HH2 H 1 7.187 0.008 . 1 . . 633 . . 32 TRP HH2 . 18841 1 372 . 1 1 32 32 TRP C C 13 177.638 0.04 . 1 . . 366 . . 32 TRP C . 18841 1 373 . 1 1 32 32 TRP CA C 13 60.090 0.04 . 1 . . 155 . . 32 TRP CA . 18841 1 374 . 1 1 32 32 TRP CB C 13 28.545 0.04 . 1 . . 154 . . 32 TRP CB . 18841 1 375 . 1 1 32 32 TRP CD1 C 13 127.245 0.04 . 1 . . 547 . . 32 TRP CD1 . 18841 1 376 . 1 1 32 32 TRP CE3 C 13 120.812 0.04 . 1 . . 636 . . 32 TRP CE3 . 18841 1 377 . 1 1 32 32 TRP CZ2 C 13 114.389 0.04 . 1 . . 549 . . 32 TRP CZ2 . 18841 1 378 . 1 1 32 32 TRP CZ3 C 13 122.081 0.04 . 1 . . 634 . . 32 TRP CZ3 . 18841 1 379 . 1 1 32 32 TRP CH2 C 13 124.353 0.04 . 1 . . 632 . . 32 TRP CH2 . 18841 1 380 . 1 1 32 32 TRP N N 15 122.277 0.04 . 1 . . 44 . . 32 TRP N . 18841 1 381 . 1 1 32 32 TRP NE1 N 15 129.581 0.04 . 1 . . 57 . . 32 TRP NE1 . 18841 1 382 . 1 1 33 33 LEU H H 1 8.206 0.008 . 1 . . 25 . . 33 LEU H . 18841 1 383 . 1 1 33 33 LEU HA H 1 3.661 0.008 . 1 . . 370 . . 33 LEU HA . 18841 1 384 . 1 1 33 33 LEU HB2 H 1 1.501 0.008 . 1 . . 509 . . 33 LEU HB2 . 18841 1 385 . 1 1 33 33 LEU HB3 H 1 1.501 0.008 . 1 . . 371 . . 33 LEU HB3 . 18841 1 386 . 1 1 33 33 LEU HG H 1 1.472 0.008 . 1 . . 687 . . 33 LEU HG . 18841 1 387 . 1 1 33 33 LEU HD11 H 1 0.829 0.008 . 1 . . 685 . . 33 LEU HD11 . 18841 1 388 . 1 1 33 33 LEU HD12 H 1 0.829 0.008 . 1 . . 685 . . 33 LEU HD12 . 18841 1 389 . 1 1 33 33 LEU HD13 H 1 0.829 0.008 . 1 . . 685 . . 33 LEU HD13 . 18841 1 390 . 1 1 33 33 LEU HD21 H 1 0.834 0.008 . 1 . . 686 . . 33 LEU HD21 . 18841 1 391 . 1 1 33 33 LEU HD22 H 1 0.834 0.008 . 1 . . 686 . . 33 LEU HD22 . 18841 1 392 . 1 1 33 33 LEU HD23 H 1 0.834 0.008 . 1 . . 686 . . 33 LEU HD23 . 18841 1 393 . 1 1 33 33 LEU C C 13 178.681 0.04 . 1 . . 369 . . 33 LEU C . 18841 1 394 . 1 1 33 33 LEU CA C 13 56.929 0.04 . 1 . . 153 . . 33 LEU CA . 18841 1 395 . 1 1 33 33 LEU CB C 13 42.202 0.04 . 1 . . 152 . . 33 LEU CB . 18841 1 396 . 1 1 33 33 LEU CG C 13 26.746 0.04 . 1 . . 573 . . 33 LEU CG . 18841 1 397 . 1 1 33 33 LEU CD1 C 13 24.097 0.04 . 2 . . 575 . . 33 LEU CD1 . 18841 1 398 . 1 1 33 33 LEU CD2 C 13 24.886 0.04 . 2 . . 574 . . 33 LEU CD2 . 18841 1 399 . 1 1 33 33 LEU N N 15 120.308 0.04 . 1 . . 26 . . 33 LEU N . 18841 1 400 . 1 1 34 34 ARG H H 1 7.821 0.008 . 1 . . 88 . . 34 ARG H . 18841 1 401 . 1 1 34 34 ARG HA H 1 4.012 0.008 . 1 . . 373 . . 34 ARG HA . 18841 1 402 . 1 1 34 34 ARG HB2 H 1 1.839 0.008 . 1 . . 374 . . 34 ARG HB2 . 18841 1 403 . 1 1 34 34 ARG HB3 H 1 1.839 0.008 . 1 . . 510 . . 34 ARG HB3 . 18841 1 404 . 1 1 34 34 ARG HG2 H 1 1.596 0.008 . 2 . . 690 . . 34 ARG HG2 . 18841 1 405 . 1 1 34 34 ARG HG3 H 1 1.721 0.008 . 2 . . 691 . . 34 ARG HG3 . 18841 1 406 . 1 1 34 34 ARG HD2 H 1 3.176 0.008 . 1 . . 688 . . 34 ARG HD2 . 18841 1 407 . 1 1 34 34 ARG HD3 H 1 3.176 0.008 . 1 . . 689 . . 34 ARG HD3 . 18841 1 408 . 1 1 34 34 ARG C C 13 177.566 0.04 . 1 . . 372 . . 34 ARG C . 18841 1 409 . 1 1 34 34 ARG CA C 13 58.038 0.04 . 1 . . 150 . . 34 ARG CA . 18841 1 410 . 1 1 34 34 ARG CB C 13 30.368 0.04 . 1 . . 151 . . 34 ARG CB . 18841 1 411 . 1 1 34 34 ARG CG C 13 27.515 0.04 . 1 . . 577 . . 34 ARG CG . 18841 1 412 . 1 1 34 34 ARG CD C 13 43.482 0.04 . 1 . . 576 . . 34 ARG CD . 18841 1 413 . 1 1 34 34 ARG N N 15 118.304 0.04 . 1 . . 89 . . 34 ARG N . 18841 1 414 . 1 1 35 35 ALA H H 1 7.753 0.008 . 1 . . 99 . . 35 ALA H . 18841 1 415 . 1 1 35 35 ALA HA H 1 4.190 0.008 . 1 . . 376 . . 35 ALA HA . 18841 1 416 . 1 1 35 35 ALA HB1 H 1 1.399 0.008 . 1 . . 377 . . 35 ALA HB1 . 18841 1 417 . 1 1 35 35 ALA HB2 H 1 1.399 0.008 . 1 . . 377 . . 35 ALA HB2 . 18841 1 418 . 1 1 35 35 ALA HB3 H 1 1.399 0.008 . 1 . . 377 . . 35 ALA HB3 . 18841 1 419 . 1 1 35 35 ALA C C 13 178.657 0.04 . 1 . . 375 . . 35 ALA C . 18841 1 420 . 1 1 35 35 ALA CA C 13 53.504 0.04 . 1 . . 148 . . 35 ALA CA . 18841 1 421 . 1 1 35 35 ALA CB C 13 18.728 0.04 . 1 . . 149 . . 35 ALA CB . 18841 1 422 . 1 1 35 35 ALA N N 15 121.975 0.04 . 1 . . 100 . . 35 ALA N . 18841 1 423 . 1 1 36 36 LYS H H 1 7.865 0.008 . 1 . . 1 . . 36 LYS H . 18841 1 424 . 1 1 36 36 LYS HA H 1 4.050 0.008 . 1 . . 380 . . 36 LYS HA . 18841 1 425 . 1 1 36 36 LYS HB2 H 1 1.490 0.008 . 2 . . 382 . . 36 LYS HB2 . 18841 1 426 . 1 1 36 36 LYS HB3 H 1 1.605 0.008 . 2 . . 381 . . 36 LYS HB3 . 18841 1 427 . 1 1 36 36 LYS HG2 H 1 1.120 0.008 . 1 . . 696 . . 36 LYS HG2 . 18841 1 428 . 1 1 36 36 LYS HG3 H 1 1.120 0.008 . 1 . . 693 . . 36 LYS HG3 . 18841 1 429 . 1 1 36 36 LYS HD2 H 1 1.392 0.008 . 1 . . 757 . . 36 LYS HD2 . 18841 1 430 . 1 1 36 36 LYS HD3 H 1 1.392 0.008 . 1 . . 756 . . 36 LYS HD3 . 18841 1 431 . 1 1 36 36 LYS HE2 H 1 2.810 0.008 . 2 . . 692 . . 36 LYS HE2 . 18841 1 432 . 1 1 36 36 LYS HE3 H 1 2.726 0.008 . 2 . . 755 . . 36 LYS HE3 . 18841 1 433 . 1 1 36 36 LYS C C 13 177.677 0.04 . 1 . . 379 . . 36 LYS C . 18841 1 434 . 1 1 36 36 LYS CA C 13 57.190 0.04 . 1 . . 163 . . 36 LYS CA . 18841 1 435 . 1 1 36 36 LYS CB C 13 32.301 0.04 . 1 . . 162 . . 36 LYS CB . 18841 1 436 . 1 1 36 36 LYS CG C 13 24.244 0.04 . 1 . . 580 . . 36 LYS CG . 18841 1 437 . 1 1 36 36 LYS CD C 13 28.841 0.04 . 1 . . 579 . . 36 LYS CD . 18841 1 438 . 1 1 36 36 LYS CE C 13 42.006 0.04 . 1 . . 578 . . 36 LYS CE . 18841 1 439 . 1 1 36 36 LYS N N 15 119.364 0.04 . 1 . . 2 . . 36 LYS N . 18841 1 440 . 1 1 37 37 VAL H H 1 7.890 0.008 . 1 . . 142 . . 37 VAL H . 18841 1 441 . 1 1 37 37 VAL HA H 1 3.972 0.008 . 1 . . 384 . . 37 VAL HA . 18841 1 442 . 1 1 37 37 VAL HB H 1 2.089 0.008 . 1 . . 385 . . 37 VAL HB . 18841 1 443 . 1 1 37 37 VAL HG11 H 1 0.917 0.008 . 1 . . 698 . . 37 VAL HG11 . 18841 1 444 . 1 1 37 37 VAL HG12 H 1 0.917 0.008 . 1 . . 698 . . 37 VAL HG12 . 18841 1 445 . 1 1 37 37 VAL HG13 H 1 0.917 0.008 . 1 . . 698 . . 37 VAL HG13 . 18841 1 446 . 1 1 37 37 VAL HG21 H 1 0.917 0.008 . 1 . . 697 . . 37 VAL HG21 . 18841 1 447 . 1 1 37 37 VAL HG22 H 1 0.917 0.008 . 1 . . 697 . . 37 VAL HG22 . 18841 1 448 . 1 1 37 37 VAL HG23 H 1 0.917 0.008 . 1 . . 697 . . 37 VAL HG23 . 18841 1 449 . 1 1 37 37 VAL C C 13 176.618 0.04 . 1 . . 383 . . 37 VAL C . 18841 1 450 . 1 1 37 37 VAL CA C 13 63.240 0.04 . 1 . . 161 . . 37 VAL CA . 18841 1 451 . 1 1 37 37 VAL CB C 13 32.481 0.04 . 1 . . 378 . . 37 VAL CB . 18841 1 452 . 1 1 37 37 VAL CG1 C 13 21.110 0.04 . 1 . . 581 . . 37 VAL CG1 . 18841 1 453 . 1 1 37 37 VAL CG2 C 13 21.110 0.04 . 1 . . 582 . . 37 VAL CG2 . 18841 1 454 . 1 1 37 37 VAL N N 15 119.260 0.04 . 1 . . 143 . . 37 VAL N . 18841 1 455 . 1 1 38 38 ALA H H 1 8.113 0.008 . 1 . . 130 . . 38 ALA H . 18841 1 456 . 1 1 38 38 ALA HA H 1 4.310 0.008 . 1 . . 387 . . 38 ALA HA . 18841 1 457 . 1 1 38 38 ALA HB1 H 1 1.439 0.008 . 1 . . 388 . . 38 ALA HB1 . 18841 1 458 . 1 1 38 38 ALA HB2 H 1 1.439 0.008 . 1 . . 388 . . 38 ALA HB2 . 18841 1 459 . 1 1 38 38 ALA HB3 H 1 1.439 0.008 . 1 . . 388 . . 38 ALA HB3 . 18841 1 460 . 1 1 38 38 ALA C C 13 178.479 0.04 . 1 . . 386 . . 38 ALA C . 18841 1 461 . 1 1 38 38 ALA CA C 13 53.334 0.04 . 1 . . 157 . . 38 ALA CA . 18841 1 462 . 1 1 38 38 ALA CB C 13 19.089 0.04 . 1 . . 156 . . 38 ALA CB . 18841 1 463 . 1 1 38 38 ALA N N 15 125.467 0.04 . 1 . . 131 . . 38 ALA N . 18841 1 464 . 1 1 39 39 THR H H 1 8.007 0.008 . 1 . . 81 . . 39 THR H . 18841 1 465 . 1 1 39 39 THR HA H 1 4.296 0.008 . 1 . . 390 . . 39 THR HA . 18841 1 466 . 1 1 39 39 THR HB H 1 4.274 0.008 . 1 . . 500 . . 39 THR HB . 18841 1 467 . 1 1 39 39 THR HG21 H 1 1.233 0.008 . 1 . . 699 . . 39 THR HG21 . 18841 1 468 . 1 1 39 39 THR HG22 H 1 1.233 0.008 . 1 . . 699 . . 39 THR HG22 . 18841 1 469 . 1 1 39 39 THR HG23 H 1 1.233 0.008 . 1 . . 699 . . 39 THR HG23 . 18841 1 470 . 1 1 39 39 THR C C 13 174.926 0.04 . 1 . . 389 . . 39 THR C . 18841 1 471 . 1 1 39 39 THR CA C 13 62.564 0.04 . 1 . . 158 . . 39 THR CA . 18841 1 472 . 1 1 39 39 THR CB C 13 69.696 0.04 . 1 . . 159 . . 39 THR CB . 18841 1 473 . 1 1 39 39 THR CG2 C 13 21.703 0.04 . 1 . . 583 . . 39 THR CG2 . 18841 1 474 . 1 1 39 39 THR N N 15 112.458 0.04 . 1 . . 82 . . 39 THR N . 18841 1 475 . 1 1 40 40 SER H H 1 8.159 0.008 . 1 . . 62 . . 40 SER H . 18841 1 476 . 1 1 40 40 SER HA H 1 4.476 0.008 . 1 . . 392 . . 40 SER HA . 18841 1 477 . 1 1 40 40 SER HB2 H 1 3.917 0.008 . 1 . . 511 . . 40 SER HB2 . 18841 1 478 . 1 1 40 40 SER HB3 H 1 3.917 0.008 . 1 . . 393 . . 40 SER HB3 . 18841 1 479 . 1 1 40 40 SER C C 13 174.710 0.04 . 1 . . 391 . . 40 SER C . 18841 1 480 . 1 1 40 40 SER CA C 13 58.730 0.04 . 1 . . 232 . . 40 SER CA . 18841 1 481 . 1 1 40 40 SER CB C 13 63.853 0.04 . 1 . . 233 . . 40 SER CB . 18841 1 482 . 1 1 40 40 SER N N 15 117.702 0.04 . 1 . . 63 . . 40 SER N . 18841 1 483 . 1 1 41 41 LEU H H 1 8.134 0.008 . 1 . . 108 . . 41 LEU H . 18841 1 484 . 1 1 41 41 LEU HA H 1 4.321 0.008 . 1 . . 395 . . 41 LEU HA . 18841 1 485 . 1 1 41 41 LEU HB2 H 1 1.658 0.008 . 2 . . 758 . . 41 LEU HB2 . 18841 1 486 . 1 1 41 41 LEU HB3 H 1 1.595 0.008 . 2 . . 396 . . 41 LEU HB3 . 18841 1 487 . 1 1 41 41 LEU HG H 1 1.596 0.008 . 1 . . 702 . . 41 LEU HG . 18841 1 488 . 1 1 41 41 LEU HD11 H 1 0.865 0.008 . 2 . . 701 . . 41 LEU HD11 . 18841 1 489 . 1 1 41 41 LEU HD12 H 1 0.865 0.008 . 2 . . 701 . . 41 LEU HD12 . 18841 1 490 . 1 1 41 41 LEU HD13 H 1 0.865 0.008 . 2 . . 701 . . 41 LEU HD13 . 18841 1 491 . 1 1 41 41 LEU HD21 H 1 0.920 0.008 . 2 . . 700 . . 41 LEU HD21 . 18841 1 492 . 1 1 41 41 LEU HD22 H 1 0.920 0.008 . 2 . . 700 . . 41 LEU HD22 . 18841 1 493 . 1 1 41 41 LEU HD23 H 1 0.920 0.008 . 2 . . 700 . . 41 LEU HD23 . 18841 1 494 . 1 1 41 41 LEU C C 13 177.056 0.04 . 1 . . 394 . . 41 LEU C . 18841 1 495 . 1 1 41 41 LEU CA C 13 55.451 0.04 . 1 . . 234 . . 41 LEU CA . 18841 1 496 . 1 1 41 41 LEU CB C 13 42.324 0.04 . 1 . . 235 . . 41 LEU CB . 18841 1 497 . 1 1 41 41 LEU CG C 13 27.067 0.04 . 1 . . 584 . . 41 LEU CG . 18841 1 498 . 1 1 41 41 LEU CD1 C 13 23.396 0.04 . 2 . . 586 . . 41 LEU CD1 . 18841 1 499 . 1 1 41 41 LEU CD2 C 13 25.135 0.04 . 2 . . 585 . . 41 LEU CD2 . 18841 1 500 . 1 1 41 41 LEU N N 15 123.550 0.04 . 1 . . 109 . . 41 LEU N . 18841 1 501 . 1 1 42 42 ALA H H 1 8.029 0.008 . 1 . . 112 . . 42 ALA H . 18841 1 502 . 1 1 42 42 ALA HA H 1 4.296 0.008 . 1 . . 399 . . 42 ALA HA . 18841 1 503 . 1 1 42 42 ALA HB1 H 1 1.374 0.008 . 1 . . 400 . . 42 ALA HB1 . 18841 1 504 . 1 1 42 42 ALA HB2 H 1 1.374 0.008 . 1 . . 400 . . 42 ALA HB2 . 18841 1 505 . 1 1 42 42 ALA HB3 H 1 1.374 0.008 . 1 . . 400 . . 42 ALA HB3 . 18841 1 506 . 1 1 42 42 ALA C C 13 177.101 0.04 . 1 . . 398 . . 42 ALA C . 18841 1 507 . 1 1 42 42 ALA CA C 13 52.397 0.04 . 1 . . 237 . . 42 ALA CA . 18841 1 508 . 1 1 42 42 ALA CB C 13 19.396 0.04 . 1 . . 236 . . 42 ALA CB . 18841 1 509 . 1 1 42 42 ALA N N 15 123.393 0.04 . 1 . . 113 . . 42 ALA N . 18841 1 510 . 1 1 43 43 ASP H H 1 8.031 0.008 . 1 . . 120 . . 43 ASP H . 18841 1 511 . 1 1 43 43 ASP HA H 1 4.834 0.008 . 1 . . 773 . . 43 ASP HA . 18841 1 512 . 1 1 43 43 ASP HB2 H 1 2.746 0.008 . 2 . . 775 . . 43 ASP HB2 . 18841 1 513 . 1 1 43 43 ASP HB3 H 1 2.518 0.008 . 2 . . 774 . . 43 ASP HB3 . 18841 1 514 . 1 1 43 43 ASP CA C 13 52.223 0.04 . 1 . . 501 . . 43 ASP CA . 18841 1 515 . 1 1 43 43 ASP CB C 13 41.148 0.04 . 1 . . 397 . . 43 ASP CB . 18841 1 516 . 1 1 43 43 ASP N N 15 120.615 0.04 . 1 . . 121 . . 43 ASP N . 18841 1 517 . 1 1 44 44 PRO HA H 1 4.458 0.008 . 1 . . 404 . . 44 PRO HA . 18841 1 518 . 1 1 44 44 PRO HB2 H 1 1.949 0.008 . 2 . . 406 . . 44 PRO HB2 . 18841 1 519 . 1 1 44 44 PRO HB3 H 1 2.256 0.008 . 2 . . 405 . . 44 PRO HB3 . 18841 1 520 . 1 1 44 44 PRO HG2 H 1 2.000 0.008 . 1 . . 706 . . 44 PRO HG2 . 18841 1 521 . 1 1 44 44 PRO HG3 H 1 2.000 0.008 . 1 . . 705 . . 44 PRO HG3 . 18841 1 522 . 1 1 44 44 PRO HD2 H 1 3.614 0.008 . 2 . . 784 . . 44 PRO HD2 . 18841 1 523 . 1 1 44 44 PRO HD3 H 1 3.775 0.008 . 2 . . 707 . . 44 PRO HD3 . 18841 1 524 . 1 1 44 44 PRO C C 13 176.864 0.04 . 1 . . 401 . . 44 PRO C . 18841 1 525 . 1 1 44 44 PRO CA C 13 63.229 0.04 . 1 . . 512 . . 44 PRO CA . 18841 1 526 . 1 1 44 44 PRO CB C 13 32.164 0.04 . 1 . . 513 . . 44 PRO CB . 18841 1 527 . 1 1 44 44 PRO CG C 13 27.171 0.04 . 1 . . 588 . . 44 PRO CG . 18841 1 528 . 1 1 44 44 PRO CD C 13 50.574 0.04 . 1 . . 587 . . 44 PRO CD . 18841 1 529 . 1 1 45 45 ARG H H 1 8.357 0.008 . 1 . . 47 . . 45 ARG H . 18841 1 530 . 1 1 45 45 ARG CA C 13 54.131 0.04 . 1 . . 402 . . 45 ARG CA . 18841 1 531 . 1 1 45 45 ARG CB C 13 30.169 0.04 . 1 . . 403 . . 45 ARG CB . 18841 1 532 . 1 1 45 45 ARG N N 15 122.239 0.04 . 1 . . 48 . . 45 ARG N . 18841 1 533 . 1 1 46 46 PRO HA H 1 4.405 0.008 . 1 . . 408 . . 46 PRO HA . 18841 1 534 . 1 1 46 46 PRO HB2 H 1 1.897 0.008 . 2 . . 410 . . 46 PRO HB2 . 18841 1 535 . 1 1 46 46 PRO HB3 H 1 2.278 0.008 . 2 . . 409 . . 46 PRO HB3 . 18841 1 536 . 1 1 46 46 PRO HG2 H 1 2.002 0.008 . 1 . . 703 . . 46 PRO HG2 . 18841 1 537 . 1 1 46 46 PRO HG3 H 1 2.002 0.008 . 1 . . 704 . . 46 PRO HG3 . 18841 1 538 . 1 1 46 46 PRO HD2 H 1 3.772 0.008 . 2 . . 709 . . 46 PRO HD2 . 18841 1 539 . 1 1 46 46 PRO HD3 H 1 3.611 0.008 . 1 . . 708 . . 46 PRO HD3 . 18841 1 540 . 1 1 46 46 PRO C C 13 176.482 0.04 . 1 . . 407 . . 46 PRO C . 18841 1 541 . 1 1 46 46 PRO CA C 13 63.097 0.04 . 1 . . 515 . . 46 PRO CA . 18841 1 542 . 1 1 46 46 PRO CB C 13 32.153 0.04 . 1 . . 514 . . 46 PRO CB . 18841 1 543 . 1 1 46 46 PRO CG C 13 27.417 0.04 . 1 . . 590 . . 46 PRO CG . 18841 1 544 . 1 1 46 46 PRO CD C 13 50.487 0.04 . 1 . . 589 . . 46 PRO CD . 18841 1 545 . 1 1 47 47 ALA H H 1 8.352 0.008 . 1 . . 66 . . 47 ALA H . 18841 1 546 . 1 1 47 47 ALA HA H 1 4.313 0.008 . 1 . . 414 . . 47 ALA HA . 18841 1 547 . 1 1 47 47 ALA HB1 H 1 1.369 0.008 . 1 . . 415 . . 47 ALA HB1 . 18841 1 548 . 1 1 47 47 ALA HB2 H 1 1.369 0.008 . 1 . . 415 . . 47 ALA HB2 . 18841 1 549 . 1 1 47 47 ALA HB3 H 1 1.369 0.008 . 1 . . 415 . . 47 ALA HB3 . 18841 1 550 . 1 1 47 47 ALA C C 13 177.343 0.04 . 1 . . 411 . . 47 ALA C . 18841 1 551 . 1 1 47 47 ALA CA C 13 52.342 0.04 . 1 . . 253 . . 47 ALA CA . 18841 1 552 . 1 1 47 47 ALA CB C 13 19.191 0.04 . 1 . . 252 . . 47 ALA CB . 18841 1 553 . 1 1 47 47 ALA N N 15 124.297 0.04 . 1 . . 67 . . 47 ALA N . 18841 1 554 . 1 1 48 48 ILE H H 1 8.046 0.008 . 1 . . 41 . . 48 ILE H . 18841 1 555 . 1 1 48 48 ILE HA H 1 4.451 0.008 . 1 . . 765 . . 48 ILE HA . 18841 1 556 . 1 1 48 48 ILE HB H 1 1.814 0.008 . 1 . . 760 . . 48 ILE HB . 18841 1 557 . 1 1 48 48 ILE HG12 H 1 1.148 0.008 . 2 . . 762 . . 48 ILE HG12 . 18841 1 558 . 1 1 48 48 ILE HG13 H 1 1.480 0.008 . 2 . . 763 . . 48 ILE HG13 . 18841 1 559 . 1 1 48 48 ILE HG21 H 1 0.909 0.008 . 1 . . 769 . . 48 ILE HG21 . 18841 1 560 . 1 1 48 48 ILE HG22 H 1 0.909 0.008 . 1 . . 769 . . 48 ILE HG22 . 18841 1 561 . 1 1 48 48 ILE HG23 H 1 0.909 0.008 . 1 . . 769 . . 48 ILE HG23 . 18841 1 562 . 1 1 48 48 ILE HD11 H 1 0.839 0.008 . 1 . . 767 . . 48 ILE HD11 . 18841 1 563 . 1 1 48 48 ILE HD12 H 1 0.839 0.008 . 1 . . 767 . . 48 ILE HD12 . 18841 1 564 . 1 1 48 48 ILE HD13 H 1 0.839 0.008 . 1 . . 767 . . 48 ILE HD13 . 18841 1 565 . 1 1 48 48 ILE CA C 13 58.366 0.04 . 1 . . 412 . . 48 ILE CA . 18841 1 566 . 1 1 48 48 ILE CB C 13 38.854 0.04 . 1 . . 413 . . 48 ILE CB . 18841 1 567 . 1 1 48 48 ILE CG1 C 13 26.879 0.04 . 1 . . 761 . . 48 ILE CG1 . 18841 1 568 . 1 1 48 48 ILE CG2 C 13 17.314 0.04 . 1 . . 768 . . 48 ILE CG2 . 18841 1 569 . 1 1 48 48 ILE CD1 C 13 12.863 0.04 . 1 . . 766 . . 48 ILE CD1 . 18841 1 570 . 1 1 48 48 ILE N N 15 121.280 0.04 . 1 . . 42 . . 48 ILE N . 18841 1 571 . 1 1 49 49 PRO HA H 1 4.418 0.008 . 1 . . 417 . . 49 PRO HA . 18841 1 572 . 1 1 49 49 PRO HB2 H 1 1.950 0.008 . 2 . . 419 . . 49 PRO HB2 . 18841 1 573 . 1 1 49 49 PRO HB3 H 1 2.328 0.008 . 2 . . 418 . . 49 PRO HB3 . 18841 1 574 . 1 1 49 49 PRO HG2 H 1 2.056 0.008 . 2 . . 782 . . 49 PRO HG2 . 18841 1 575 . 1 1 49 49 PRO HG3 H 1 1.997 0.008 . 2 . . 710 . . 49 PRO HG3 . 18841 1 576 . 1 1 49 49 PRO HD2 H 1 3.651 0.008 . 2 . . 781 . . 49 PRO HD2 . 18841 1 577 . 1 1 49 49 PRO HD3 H 1 3.877 0.008 . 2 . . 711 . . 49 PRO HD3 . 18841 1 578 . 1 1 49 49 PRO C C 13 177.202 0.04 . 1 . . 416 . . 49 PRO C . 18841 1 579 . 1 1 49 49 PRO CA C 13 63.190 0.04 . 1 . . 517 . . 49 PRO CA . 18841 1 580 . 1 1 49 49 PRO CB C 13 32.360 0.04 . 1 . . 516 . . 49 PRO CB . 18841 1 581 . 1 1 49 49 PRO CG C 13 27.642 0.04 . 1 . . 591 . . 49 PRO CG . 18841 1 582 . 1 1 49 49 PRO CD C 13 51.102 0.04 . 1 . . 592 . . 49 PRO CD . 18841 1 583 . 1 1 50 50 HIS H H 1 8.661 0.008 . 1 . . 72 . . 50 HIS H . 18841 1 584 . 1 1 50 50 HIS HA H 1 4.504 0.008 . 1 . . 421 . . 50 HIS HA . 18841 1 585 . 1 1 50 50 HIS HB2 H 1 3.210 0.008 . 1 . . 422 . . 50 HIS HB2 . 18841 1 586 . 1 1 50 50 HIS HB3 H 1 3.210 0.008 . 1 . . 518 . . 50 HIS HB3 . 18841 1 587 . 1 1 50 50 HIS HD2 H 1 7.209 0.008 . 1 . . 543 . . 50 HIS HD2 . 18841 1 588 . 1 1 50 50 HIS HE1 H 1 8.209 0.008 . 1 . . 545 . . 50 HIS HE1 . 18841 1 589 . 1 1 50 50 HIS C C 13 175.463 0.04 . 1 . . 420 . . 50 HIS C . 18841 1 590 . 1 1 50 50 HIS CA C 13 57.487 0.04 . 1 . . 231 . . 50 HIS CA . 18841 1 591 . 1 1 50 50 HIS CB C 13 29.932 0.04 . 1 . . 230 . . 50 HIS CB . 18841 1 592 . 1 1 50 50 HIS CD2 C 13 120.151 0.04 . 1 . . 638 . . 50 HIS CD2 . 18841 1 593 . 1 1 50 50 HIS CE1 C 13 137.537 0.04 . 1 . . 544 . . 50 HIS CE1 . 18841 1 594 . 1 1 50 50 HIS N N 15 120.377 0.04 . 1 . . 73 . . 50 HIS N . 18841 1 595 . 1 1 51 51 ASP H H 1 8.447 0.008 . 1 . . 70 . . 51 ASP H . 18841 1 596 . 1 1 51 51 ASP HA H 1 4.522 0.008 . 1 . . 424 . . 51 ASP HA . 18841 1 597 . 1 1 51 51 ASP HB2 H 1 2.705 0.008 . 1 . . 425 . . 51 ASP HB2 . 18841 1 598 . 1 1 51 51 ASP HB3 H 1 2.705 0.008 . 1 . . 519 . . 51 ASP HB3 . 18841 1 599 . 1 1 51 51 ASP C C 13 176.950 0.04 . 1 . . 423 . . 51 ASP C . 18841 1 600 . 1 1 51 51 ASP CA C 13 54.980 0.04 . 1 . . 229 . . 51 ASP CA . 18841 1 601 . 1 1 51 51 ASP CB C 13 40.931 0.04 . 1 . . 228 . . 51 ASP CB . 18841 1 602 . 1 1 51 51 ASP N N 15 119.398 0.04 . 1 . . 71 . . 51 ASP N . 18841 1 603 . 1 1 52 52 GLU H H 1 8.194 0.008 . 1 . . 37 . . 52 GLU H . 18841 1 604 . 1 1 52 52 GLU HA H 1 4.230 0.008 . 1 . . 427 . . 52 GLU HA . 18841 1 605 . 1 1 52 52 GLU HB2 H 1 2.063 0.008 . 1 . . 520 . . 52 GLU HB2 . 18841 1 606 . 1 1 52 52 GLU HB3 H 1 2.063 0.008 . 1 . . 428 . . 52 GLU HB3 . 18841 1 607 . 1 1 52 52 GLU HG2 H 1 2.292 0.008 . 1 . . 712 . . 52 GLU HG2 . 18841 1 608 . 1 1 52 52 GLU HG3 H 1 2.292 0.008 . 1 . . 713 . . 52 GLU HG3 . 18841 1 609 . 1 1 52 52 GLU C C 13 177.645 0.04 . 1 . . 426 . . 52 GLU C . 18841 1 610 . 1 1 52 52 GLU CA C 13 58.012 0.04 . 1 . . 498 . . 52 GLU CA . 18841 1 611 . 1 1 52 52 GLU CB C 13 29.814 0.04 . 1 . . 497 . . 52 GLU CB . 18841 1 612 . 1 1 52 52 GLU CG C 13 35.976 0.04 . 1 . . 593 . . 52 GLU CG . 18841 1 613 . 1 1 52 52 GLU N N 15 121.363 0.04 . 1 . . 38 . . 52 GLU N . 18841 1 614 . 1 1 53 53 VAL H H 1 7.897 0.008 . 1 . . 85 . . 53 VAL H . 18841 1 615 . 1 1 53 53 VAL HA H 1 3.700 0.008 . 1 . . 429 . . 53 VAL HA . 18841 1 616 . 1 1 53 53 VAL HB H 1 2.146 0.008 . 1 . . 430 . . 53 VAL HB . 18841 1 617 . 1 1 53 53 VAL HG11 H 1 0.998 0.008 . 2 . . 776 . . 53 VAL HG11 . 18841 1 618 . 1 1 53 53 VAL HG12 H 1 0.998 0.008 . 2 . . 776 . . 53 VAL HG12 . 18841 1 619 . 1 1 53 53 VAL HG13 H 1 0.998 0.008 . 2 . . 776 . . 53 VAL HG13 . 18841 1 620 . 1 1 53 53 VAL HG21 H 1 0.935 0.008 . 2 . . 777 . . 53 VAL HG21 . 18841 1 621 . 1 1 53 53 VAL HG22 H 1 0.935 0.008 . 2 . . 777 . . 53 VAL HG22 . 18841 1 622 . 1 1 53 53 VAL HG23 H 1 0.935 0.008 . 2 . . 777 . . 53 VAL HG23 . 18841 1 623 . 1 1 53 53 VAL C C 13 176.307 0.04 . 1 . . 499 . . 53 VAL C . 18841 1 624 . 1 1 53 53 VAL CA C 13 65.527 0.04 . 1 . . 226 . . 53 VAL CA . 18841 1 625 . 1 1 53 53 VAL CB C 13 31.928 0.04 . 1 . . 227 . . 53 VAL CB . 18841 1 626 . 1 1 53 53 VAL CG1 C 13 22.197 0.04 . 2 . . 594 . . 53 VAL CG1 . 18841 1 627 . 1 1 53 53 VAL CG2 C 13 21.203 0.04 . 2 . . 595 . . 53 VAL CG2 . 18841 1 628 . 1 1 53 53 VAL N N 15 120.818 0.04 . 1 . . 86 . . 53 VAL N . 18841 1 629 . 1 1 54 54 GLU H H 1 8.264 0.008 . 1 . . 101 . . 54 GLU H . 18841 1 630 . 1 1 54 54 GLU HA H 1 4.054 0.008 . 1 . . 432 . . 54 GLU HA . 18841 1 631 . 1 1 54 54 GLU HB2 H 1 2.052 0.008 . 1 . . 433 . . 54 GLU HB2 . 18841 1 632 . 1 1 54 54 GLU HB3 H 1 2.052 0.008 . 1 . . 521 . . 54 GLU HB3 . 18841 1 633 . 1 1 54 54 GLU HG2 H 1 2.259 0.008 . 1 . . 715 . . 54 GLU HG2 . 18841 1 634 . 1 1 54 54 GLU HG3 H 1 2.259 0.008 . 1 . . 714 . . 54 GLU HG3 . 18841 1 635 . 1 1 54 54 GLU C C 13 178.579 0.04 . 1 . . 431 . . 54 GLU C . 18841 1 636 . 1 1 54 54 GLU CA C 13 58.850 0.04 . 1 . . 225 . . 54 GLU CA . 18841 1 637 . 1 1 54 54 GLU CB C 13 29.656 0.04 . 1 . . 224 . . 54 GLU CB . 18841 1 638 . 1 1 54 54 GLU CG C 13 36.535 0.04 . 1 . . 596 . . 54 GLU CG . 18841 1 639 . 1 1 54 54 GLU N N 15 120.842 0.04 . 1 . . 102 . . 54 GLU N . 18841 1 640 . 1 1 55 55 ARG H H 1 8.142 0.008 . 1 . . 60 . . 55 ARG H . 18841 1 641 . 1 1 55 55 ARG HA H 1 4.133 0.008 . 1 . . 435 . . 55 ARG HA . 18841 1 642 . 1 1 55 55 ARG HB2 H 1 1.889 0.008 . 1 . . 436 . . 55 ARG HB2 . 18841 1 643 . 1 1 55 55 ARG HB3 H 1 1.889 0.008 . 1 . . 522 . . 55 ARG HB3 . 18841 1 644 . 1 1 55 55 ARG HG2 H 1 1.595 0.008 . 2 . . 718 . . 55 ARG HG2 . 18841 1 645 . 1 1 55 55 ARG HG3 H 1 1.725 0.008 . 2 . . 797 . . 55 ARG HG3 . 18841 1 646 . 1 1 55 55 ARG HD2 H 1 3.212 0.008 . 1 . . 716 . . 55 ARG HD2 . 18841 1 647 . 1 1 55 55 ARG HD3 H 1 3.212 0.008 . 1 . . 717 . . 55 ARG HD3 . 18841 1 648 . 1 1 55 55 ARG C C 13 178.259 0.04 . 1 . . 434 . . 55 ARG C . 18841 1 649 . 1 1 55 55 ARG CA C 13 58.716 0.04 . 1 . . 222 . . 55 ARG CA . 18841 1 650 . 1 1 55 55 ARG CB C 13 30.318 0.04 . 1 . . 223 . . 55 ARG CB . 18841 1 651 . 1 1 55 55 ARG CG C 13 27.503 0.04 . 1 . . 597 . . 55 ARG CG . 18841 1 652 . 1 1 55 55 ARG CD C 13 43.328 0.04 . 1 . . 600 . . 55 ARG CD . 18841 1 653 . 1 1 55 55 ARG N N 15 120.837 0.04 . 1 . . 61 . . 55 ARG N . 18841 1 654 . 1 1 56 56 ARG H H 1 8.225 0.008 . 1 . . 39 . . 56 ARG H . 18841 1 655 . 1 1 56 56 ARG HA H 1 4.161 0.008 . 1 . . 438 . . 56 ARG HA . 18841 1 656 . 1 1 56 56 ARG HB2 H 1 1.906 0.008 . 1 . . 523 . . 56 ARG HB2 . 18841 1 657 . 1 1 56 56 ARG HB3 H 1 1.906 0.008 . 1 . . 439 . . 56 ARG HB3 . 18841 1 658 . 1 1 56 56 ARG HG2 H 1 1.785 0.008 . 2 . . 721 . . 56 ARG HG2 . 18841 1 659 . 1 1 56 56 ARG HG3 H 1 1.672 0.008 . 2 . . 798 . . 56 ARG HG3 . 18841 1 660 . 1 1 56 56 ARG HD2 H 1 3.208 0.008 . 1 . . 720 . . 56 ARG HD2 . 18841 1 661 . 1 1 56 56 ARG HD3 H 1 3.208 0.008 . 1 . . 719 . . 56 ARG HD3 . 18841 1 662 . 1 1 56 56 ARG C C 13 178.844 0.04 . 1 . . 437 . . 56 ARG C . 18841 1 663 . 1 1 56 56 ARG CA C 13 58.434 0.04 . 1 . . 221 . . 56 ARG CA . 18841 1 664 . 1 1 56 56 ARG CB C 13 30.237 0.04 . 1 . . 220 . . 56 ARG CB . 18841 1 665 . 1 1 56 56 ARG CG C 13 27.570 0.04 . 1 . . 599 . . 56 ARG CG . 18841 1 666 . 1 1 56 56 ARG CD C 13 43.518 0.04 . 1 . . 598 . . 56 ARG CD . 18841 1 667 . 1 1 56 56 ARG N N 15 119.633 0.04 . 1 . . 40 . . 56 ARG N . 18841 1 668 . 1 1 57 57 MET H H 1 8.241 0.008 . 1 . . 21 . . 57 MET H . 18841 1 669 . 1 1 57 57 MET HA H 1 4.227 0.008 . 1 . . 441 . . 57 MET HA . 18841 1 670 . 1 1 57 57 MET HB2 H 1 2.107 0.008 . 2 . . 442 . . 57 MET HB2 . 18841 1 671 . 1 1 57 57 MET HB3 H 1 2.014 0.008 . 2 . . 443 . . 57 MET HB3 . 18841 1 672 . 1 1 57 57 MET HG2 H 1 2.624 0.008 . 2 . . 778 . . 57 MET HG2 . 18841 1 673 . 1 1 57 57 MET HG3 H 1 2.538 0.008 . 2 . . 780 . . 57 MET HG3 . 18841 1 674 . 1 1 57 57 MET HE1 H 1 2.047 0.008 . 1 . . 799 . . 57 MET HE1 . 18841 1 675 . 1 1 57 57 MET HE2 H 1 2.047 0.008 . 1 . . 799 . . 57 MET HE2 . 18841 1 676 . 1 1 57 57 MET HE3 H 1 2.047 0.008 . 1 . . 799 . . 57 MET HE3 . 18841 1 677 . 1 1 57 57 MET C C 13 177.455 0.04 . 1 . . 440 . . 57 MET C . 18841 1 678 . 1 1 57 57 MET CA C 13 57.551 0.04 . 1 . . 219 . . 57 MET CA . 18841 1 679 . 1 1 57 57 MET CB C 13 32.234 0.04 . 1 . . 218 . . 57 MET CB . 18841 1 680 . 1 1 57 57 MET CG C 13 32.246 0.04 . 1 . . 779 . . 57 MET CG . 18841 1 681 . 1 1 57 57 MET CE C 13 17.072 0.04 . 1 . . 800 . . 57 MET CE . 18841 1 682 . 1 1 57 57 MET N N 15 119.782 0.04 . 1 . . 22 . . 57 MET N . 18841 1 683 . 1 1 58 58 ALA H H 1 8.141 0.008 . 1 . . 93 . . 58 ALA H . 18841 1 684 . 1 1 58 58 ALA HA H 1 4.204 0.008 . 1 . . 445 . . 58 ALA HA . 18841 1 685 . 1 1 58 58 ALA HB1 H 1 1.531 0.008 . 1 . . 446 . . 58 ALA HB1 . 18841 1 686 . 1 1 58 58 ALA HB2 H 1 1.531 0.008 . 1 . . 446 . . 58 ALA HB2 . 18841 1 687 . 1 1 58 58 ALA HB3 H 1 1.531 0.008 . 1 . . 446 . . 58 ALA HB3 . 18841 1 688 . 1 1 58 58 ALA C C 13 180.123 0.04 . 1 . . 444 . . 58 ALA C . 18841 1 689 . 1 1 58 58 ALA CA C 13 54.662 0.04 . 1 . . 216 . . 58 ALA CA . 18841 1 690 . 1 1 58 58 ALA CB C 13 18.391 0.04 . 1 . . 217 . . 58 ALA CB . 18841 1 691 . 1 1 58 58 ALA N N 15 122.698 0.04 . 1 . . 94 . . 58 ALA N . 18841 1 692 . 1 1 59 59 GLU H H 1 8.157 0.008 . 1 . . 29 . . 59 GLU H . 18841 1 693 . 1 1 59 59 GLU HA H 1 4.152 0.008 . 1 . . 448 . . 59 GLU HA . 18841 1 694 . 1 1 59 59 GLU HB2 H 1 2.095 0.008 . 1 . . 449 . . 59 GLU HB2 . 18841 1 695 . 1 1 59 59 GLU HB3 H 1 2.095 0.008 . 1 . . 524 . . 59 GLU HB3 . 18841 1 696 . 1 1 59 59 GLU HG2 H 1 2.419 0.008 . 2 . . 796 . . 59 GLU HG2 . 18841 1 697 . 1 1 59 59 GLU HG3 H 1 2.275 0.008 . 2 . . 722 . . 59 GLU HG3 . 18841 1 698 . 1 1 59 59 GLU C C 13 178.258 0.04 . 1 . . 447 . . 59 GLU C . 18841 1 699 . 1 1 59 59 GLU CA C 13 58.503 0.04 . 1 . . 215 . . 59 GLU CA . 18841 1 700 . 1 1 59 59 GLU CB C 13 29.779 0.04 . 1 . . 214 . . 59 GLU CB . 18841 1 701 . 1 1 59 59 GLU CG C 13 36.503 0.04 . 1 . . 601 . . 59 GLU CG . 18841 1 702 . 1 1 59 59 GLU N N 15 119.113 0.04 . 1 . . 30 . . 59 GLU N . 18841 1 703 . 1 1 60 60 ARG H H 1 7.932 0.008 . 1 . . 132 . . 60 ARG H . 18841 1 704 . 1 1 60 60 ARG HA H 1 4.102 0.008 . 1 . . 451 . . 60 ARG HA . 18841 1 705 . 1 1 60 60 ARG HB2 H 1 1.810 0.008 . 1 . . 525 . . 60 ARG HB2 . 18841 1 706 . 1 1 60 60 ARG HB3 H 1 1.810 0.008 . 1 . . 452 . . 60 ARG HB3 . 18841 1 707 . 1 1 60 60 ARG HG2 H 1 1.591 0.008 . 2 . . 723 . . 60 ARG HG2 . 18841 1 708 . 1 1 60 60 ARG HG3 H 1 1.465 0.008 . 2 . . 815 . . 60 ARG HG3 . 18841 1 709 . 1 1 60 60 ARG HD2 H 1 3.101 0.008 . 1 . . 724 . . 60 ARG HD2 . 18841 1 710 . 1 1 60 60 ARG HD3 H 1 3.101 0.008 . 1 . . 725 . . 60 ARG HD3 . 18841 1 711 . 1 1 60 60 ARG C C 13 178.066 0.04 . 1 . . 450 . . 60 ARG C . 18841 1 712 . 1 1 60 60 ARG CA C 13 58.437 0.04 . 1 . . 213 . . 60 ARG CA . 18841 1 713 . 1 1 60 60 ARG CB C 13 30.082 0.04 . 1 . . 212 . . 60 ARG CB . 18841 1 714 . 1 1 60 60 ARG CG C 13 27.170 0.04 . 1 . . 603 . . 60 ARG CG . 18841 1 715 . 1 1 60 60 ARG CD C 13 43.533 0.04 . 1 . . 602 . . 60 ARG CD . 18841 1 716 . 1 1 60 60 ARG N N 15 120.300 0.04 . 1 . . 133 . . 60 ARG N . 18841 1 717 . 1 1 61 61 PHE H H 1 8.192 0.008 . 1 . . 140 . . 61 PHE H . 18841 1 718 . 1 1 61 61 PHE HA H 1 4.504 0.008 . 1 . . 454 . . 61 PHE HA . 18841 1 719 . 1 1 61 61 PHE HB2 H 1 3.205 0.008 . 2 . . 455 . . 61 PHE HB2 . 18841 1 720 . 1 1 61 61 PHE HB3 H 1 3.066 0.008 . 2 . . 456 . . 61 PHE HB3 . 18841 1 721 . 1 1 61 61 PHE HD1 H 1 7.261 0.008 . 3 . . 540 . . 61 PHE HD1 . 18841 1 722 . 1 1 61 61 PHE HD2 H 1 7.261 0.008 . 3 . . 540 . . 61 PHE HD2 . 18841 1 723 . 1 1 61 61 PHE HE1 H 1 7.314 0.008 . 3 . . 541 . . 61 PHE HE1 . 18841 1 724 . 1 1 61 61 PHE HE2 H 1 7.314 0.008 . 3 . . 541 . . 61 PHE HE2 . 18841 1 725 . 1 1 61 61 PHE HZ H 1 7.270 0.008 . 1 . . 641 . . 61 PHE HZ . 18841 1 726 . 1 1 61 61 PHE C C 13 177.154 0.04 . 1 . . 453 . . 61 PHE C . 18841 1 727 . 1 1 61 61 PHE CA C 13 59.349 0.04 . 1 . . 211 . . 61 PHE CA . 18841 1 728 . 1 1 61 61 PHE CB C 13 38.790 0.04 . 1 . . 210 . . 61 PHE CB . 18841 1 729 . 1 1 61 61 PHE CD1 C 13 131.672 0.04 . 3 . . 630 . . 61 PHE CD1 . 18841 1 730 . 1 1 61 61 PHE CD2 C 13 131.672 0.04 . 3 . . 630 . . 61 PHE CD2 . 18841 1 731 . 1 1 61 61 PHE CE1 C 13 131.524 0.04 . 3 . . 546 . . 61 PHE CE1 . 18841 1 732 . 1 1 61 61 PHE CE2 C 13 131.524 0.04 . 3 . . 546 . . 61 PHE CE2 . 18841 1 733 . 1 1 61 61 PHE CZ C 13 129.808 0.04 . 1 . . 642 . . 61 PHE CZ . 18841 1 734 . 1 1 61 61 PHE N N 15 119.177 0.04 . 1 . . 141 . . 61 PHE N . 18841 1 735 . 1 1 62 62 ALA H H 1 8.069 0.008 . 1 . . 106 . . 62 ALA H . 18841 1 736 . 1 1 62 62 ALA HA H 1 4.183 0.008 . 1 . . 458 . . 62 ALA HA . 18841 1 737 . 1 1 62 62 ALA HB1 H 1 1.522 0.008 . 1 . . 459 . . 62 ALA HB1 . 18841 1 738 . 1 1 62 62 ALA HB2 H 1 1.522 0.008 . 1 . . 459 . . 62 ALA HB2 . 18841 1 739 . 1 1 62 62 ALA HB3 H 1 1.522 0.008 . 1 . . 459 . . 62 ALA HB3 . 18841 1 740 . 1 1 62 62 ALA C C 13 179.324 0.04 . 1 . . 457 . . 62 ALA C . 18841 1 741 . 1 1 62 62 ALA CA C 13 54.345 0.04 . 1 . . 209 . . 62 ALA CA . 18841 1 742 . 1 1 62 62 ALA CB C 13 18.680 0.04 . 1 . . 208 . . 62 ALA CB . 18841 1 743 . 1 1 62 62 ALA N N 15 122.604 0.04 . 1 . . 107 . . 62 ALA N . 18841 1 744 . 1 1 63 63 LYS H H 1 7.971 0.008 . 1 . . 97 . . 63 LYS H . 18841 1 745 . 1 1 63 63 LYS HA H 1 4.181 0.008 . 1 . . 461 . . 63 LYS HA . 18841 1 746 . 1 1 63 63 LYS HB2 H 1 1.909 0.008 . 1 . . 526 . . 63 LYS HB2 . 18841 1 747 . 1 1 63 63 LYS HB3 H 1 1.909 0.008 . 1 . . 462 . . 63 LYS HB3 . 18841 1 748 . 1 1 63 63 LYS HG2 H 1 1.551 0.008 . 2 . . 786 . . 63 LYS HG2 . 18841 1 749 . 1 1 63 63 LYS HG3 H 1 1.450 0.008 . 2 . . 728 . . 63 LYS HG3 . 18841 1 750 . 1 1 63 63 LYS HD2 H 1 1.706 0.008 . 1 . . 727 . . 63 LYS HD2 . 18841 1 751 . 1 1 63 63 LYS HD3 H 1 1.706 0.008 . 1 . . 726 . . 63 LYS HD3 . 18841 1 752 . 1 1 63 63 LYS HE2 H 1 3.006 0.008 . 1 . . 730 . . 63 LYS HE2 . 18841 1 753 . 1 1 63 63 LYS HE3 H 1 3.006 0.008 . 1 . . 729 . . 63 LYS HE3 . 18841 1 754 . 1 1 63 63 LYS C C 13 177.769 0.04 . 1 . . 460 . . 63 LYS C . 18841 1 755 . 1 1 63 63 LYS CA C 13 57.916 0.04 . 1 . . 206 . . 63 LYS CA . 18841 1 756 . 1 1 63 63 LYS CB C 13 32.748 0.04 . 1 . . 207 . . 63 LYS CB . 18841 1 757 . 1 1 63 63 LYS CG C 13 25.168 0.04 . 1 . . 606 . . 63 LYS CG . 18841 1 758 . 1 1 63 63 LYS CD C 13 29.313 0.04 . 1 . . 605 . . 63 LYS CD . 18841 1 759 . 1 1 63 63 LYS CE C 13 42.217 0.04 . 1 . . 604 . . 63 LYS CE . 18841 1 760 . 1 1 63 63 LYS N N 15 118.654 0.04 . 1 . . 98 . . 63 LYS N . 18841 1 761 . 1 1 64 64 MET H H 1 8.014 0.008 . 1 . . 27 . . 64 MET H . 18841 1 762 . 1 1 64 64 MET HA H 1 4.317 0.008 . 1 . . 464 . . 64 MET HA . 18841 1 763 . 1 1 64 64 MET HB2 H 1 2.117 0.008 . 1 . . 527 . . 64 MET HB2 . 18841 1 764 . 1 1 64 64 MET HB3 H 1 2.117 0.008 . 1 . . 465 . . 64 MET HB3 . 18841 1 765 . 1 1 64 64 MET HG2 H 1 2.567 0.008 . 2 . . 731 . . 64 MET HG2 . 18841 1 766 . 1 1 64 64 MET HG3 H 1 2.675 0.008 . 2 . . 759 . . 64 MET HG3 . 18841 1 767 . 1 1 64 64 MET C C 13 177.135 0.04 . 1 . . 463 . . 64 MET C . 18841 1 768 . 1 1 64 64 MET CA C 13 56.978 0.04 . 1 . . 204 . . 64 MET CA . 18841 1 769 . 1 1 64 64 MET CB C 13 32.882 0.04 . 1 . . 205 . . 64 MET CB . 18841 1 770 . 1 1 64 64 MET CG C 13 32.090 0.04 . 1 . . 607 . . 64 MET CG . 18841 1 771 . 1 1 64 64 MET N N 15 119.273 0.04 . 1 . . 28 . . 64 MET N . 18841 1 772 . 1 1 65 65 ARG H H 1 8.079 0.008 . 1 . . 23 . . 65 ARG H . 18841 1 773 . 1 1 65 65 ARG HA H 1 4.194 0.008 . 1 . . 467 . . 65 ARG HA . 18841 1 774 . 1 1 65 65 ARG HB2 H 1 1.832 0.008 . 1 . . 468 . . 65 ARG HB2 . 18841 1 775 . 1 1 65 65 ARG HB3 H 1 1.832 0.008 . 1 . . 528 . . 65 ARG HB3 . 18841 1 776 . 1 1 65 65 ARG HG2 H 1 1.570 0.008 . 1 . . 734 . . 65 ARG HG2 . 18841 1 777 . 1 1 65 65 ARG HG3 H 1 1.570 0.008 . 1 . . 735 . . 65 ARG HG3 . 18841 1 778 . 1 1 65 65 ARG HD2 H 1 3.162 0.008 . 1 . . 733 . . 65 ARG HD2 . 18841 1 779 . 1 1 65 65 ARG HD3 H 1 3.162 0.008 . 1 . . 732 . . 65 ARG HD3 . 18841 1 780 . 1 1 65 65 ARG C C 13 177.153 0.04 . 1 . . 466 . . 65 ARG C . 18841 1 781 . 1 1 65 65 ARG CA C 13 57.310 0.04 . 1 . . 203 . . 65 ARG CA . 18841 1 782 . 1 1 65 65 ARG CB C 13 30.476 0.04 . 1 . . 202 . . 65 ARG CB . 18841 1 783 . 1 1 65 65 ARG CG C 13 27.292 0.04 . 1 . . 609 . . 65 ARG CG . 18841 1 784 . 1 1 65 65 ARG CD C 13 43.459 0.04 . 1 . . 608 . . 65 ARG CD . 18841 1 785 . 1 1 65 65 ARG N N 15 120.566 0.04 . 1 . . 24 . . 65 ARG N . 18841 1 786 . 1 1 66 66 LYS H H 1 8.093 0.008 . 1 . . 49 . . 66 LYS H . 18841 1 787 . 1 1 66 66 LYS HA H 1 4.247 0.008 . 1 . . 470 . . 66 LYS HA . 18841 1 788 . 1 1 66 66 LYS HB2 H 1 1.871 0.008 . 1 . . 529 . . 66 LYS HB2 . 18841 1 789 . 1 1 66 66 LYS HB3 H 1 1.871 0.008 . 1 . . 471 . . 66 LYS HB3 . 18841 1 790 . 1 1 66 66 LYS HG2 H 1 1.447 0.008 . 1 . . 741 . . 66 LYS HG2 . 18841 1 791 . 1 1 66 66 LYS HG3 H 1 1.447 0.008 . 1 . . 740 . . 66 LYS HG3 . 18841 1 792 . 1 1 66 66 LYS HD2 H 1 1.703 0.008 . 1 . . 739 . . 66 LYS HD2 . 18841 1 793 . 1 1 66 66 LYS HD3 H 1 1.703 0.008 . 1 . . 738 . . 66 LYS HD3 . 18841 1 794 . 1 1 66 66 LYS HE2 H 1 3.006 0.008 . 1 . . 736 . . 66 LYS HE2 . 18841 1 795 . 1 1 66 66 LYS HE3 H 1 3.006 0.008 . 1 . . 737 . . 66 LYS HE3 . 18841 1 796 . 1 1 66 66 LYS C C 13 177.318 0.04 . 1 . . 469 . . 66 LYS C . 18841 1 797 . 1 1 66 66 LYS CA C 13 57.213 0.04 . 1 . . 201 . . 66 LYS CA . 18841 1 798 . 1 1 66 66 LYS CB C 13 32.913 0.04 . 1 . . 200 . . 66 LYS CB . 18841 1 799 . 1 1 66 66 LYS CG C 13 24.922 0.04 . 1 . . 611 . . 66 LYS CG . 18841 1 800 . 1 1 66 66 LYS CD C 13 29.181 0.04 . 1 . . 610 . . 66 LYS CD . 18841 1 801 . 1 1 66 66 LYS CE C 13 42.211 0.04 . 1 . . 742 . . 66 LYS CE . 18841 1 802 . 1 1 66 66 LYS N N 15 121.523 0.04 . 1 . . 50 . . 66 LYS N . 18841 1 803 . 1 1 67 67 GLU H H 1 8.289 0.008 . 1 . . 64 . . 67 GLU H . 18841 1 804 . 1 1 67 67 GLU HA H 1 4.253 0.008 . 1 . . 473 . . 67 GLU HA . 18841 1 805 . 1 1 67 67 GLU HB2 H 1 2.075 0.008 . 2 . . 474 . . 67 GLU HB2 . 18841 1 806 . 1 1 67 67 GLU HB3 H 1 2.011 0.008 . 2 . . 475 . . 67 GLU HB3 . 18841 1 807 . 1 1 67 67 GLU HG2 H 1 2.293 0.008 . 1 . . 743 . . 67 GLU HG2 . 18841 1 808 . 1 1 67 67 GLU HG3 H 1 2.293 0.008 . 1 . . 744 . . 67 GLU HG3 . 18841 1 809 . 1 1 67 67 GLU C C 13 177.003 0.04 . 1 . . 472 . . 67 GLU C . 18841 1 810 . 1 1 67 67 GLU CA C 13 57.110 0.04 . 1 . . 198 . . 67 GLU CA . 18841 1 811 . 1 1 67 67 GLU CB C 13 30.141 0.04 . 1 . . 199 . . 67 GLU CB . 18841 1 812 . 1 1 67 67 GLU CG C 13 36.309 0.04 . 1 . . 612 . . 67 GLU CG . 18841 1 813 . 1 1 67 67 GLU N N 15 121.026 0.04 . 1 . . 65 . . 67 GLU N . 18841 1 814 . 1 1 68 68 ARG H H 1 8.229 0.008 . 1 . . 19 . . 68 ARG H . 18841 1 815 . 1 1 68 68 ARG HA H 1 4.340 0.008 . 1 . . 477 . . 68 ARG HA . 18841 1 816 . 1 1 68 68 ARG HB2 H 1 1.828 0.008 . 2 . . 479 . . 68 ARG HB2 . 18841 1 817 . 1 1 68 68 ARG HB3 H 1 1.927 0.008 . 2 . . 478 . . 68 ARG HB3 . 18841 1 818 . 1 1 68 68 ARG HG2 H 1 1.619 0.008 . 1 . . 748 . . 68 ARG HG2 . 18841 1 819 . 1 1 68 68 ARG HG3 H 1 1.619 0.008 . 1 . . 747 . . 68 ARG HG3 . 18841 1 820 . 1 1 68 68 ARG HD2 H 1 3.204 0.008 . 1 . . 745 . . 68 ARG HD2 . 18841 1 821 . 1 1 68 68 ARG HD3 H 1 3.204 0.008 . 1 . . 746 . . 68 ARG HD3 . 18841 1 822 . 1 1 68 68 ARG C C 13 176.625 0.04 . 1 . . 476 . . 68 ARG C . 18841 1 823 . 1 1 68 68 ARG CA C 13 56.580 0.04 . 1 . . 196 . . 68 ARG CA . 18841 1 824 . 1 1 68 68 ARG CB C 13 30.695 0.04 . 1 . . 197 . . 68 ARG CB . 18841 1 825 . 1 1 68 68 ARG CG C 13 27.228 0.04 . 1 . . 614 . . 68 ARG CG . 18841 1 826 . 1 1 68 68 ARG CD C 13 43.470 0.04 . 1 . . 613 . . 68 ARG CD . 18841 1 827 . 1 1 68 68 ARG N N 15 121.090 0.04 . 1 . . 20 . . 68 ARG N . 18841 1 828 . 1 1 69 69 SER H H 1 8.233 0.008 . 1 . . 126 . . 69 SER H . 18841 1 829 . 1 1 69 69 SER HA H 1 4.447 0.008 . 1 . . 481 . . 69 SER HA . 18841 1 830 . 1 1 69 69 SER HB2 H 1 3.929 0.008 . 1 . . 530 . . 69 SER HB2 . 18841 1 831 . 1 1 69 69 SER HB3 H 1 3.929 0.008 . 1 . . 482 . . 69 SER HB3 . 18841 1 832 . 1 1 69 69 SER C C 13 174.411 0.04 . 1 . . 480 . . 69 SER C . 18841 1 833 . 1 1 69 69 SER CA C 13 58.750 0.04 . 1 . . 238 . . 69 SER CA . 18841 1 834 . 1 1 69 69 SER CB C 13 63.868 0.04 . 1 . . 239 . . 69 SER CB . 18841 1 835 . 1 1 69 69 SER N N 15 116.524 0.04 . 1 . . 127 . . 69 SER N . 18841 1 836 . 1 1 70 70 LYS H H 1 8.230 0.008 . 1 . . 90 . . 70 LYS H . 18841 1 837 . 1 1 70 70 LYS HA H 1 4.368 0.008 . 1 . . 486 . . 70 LYS HA . 18841 1 838 . 1 1 70 70 LYS HB2 H 1 1.793 0.008 . 2 . . 488 . . 70 LYS HB2 . 18841 1 839 . 1 1 70 70 LYS HB3 H 1 1.915 0.008 . 2 . . 487 . . 70 LYS HB3 . 18841 1 840 . 1 1 70 70 LYS HG2 H 1 1.485 0.008 . 1 . . 754 . . 70 LYS HG2 . 18841 1 841 . 1 1 70 70 LYS HG3 H 1 1.485 0.008 . 1 . . 753 . . 70 LYS HG3 . 18841 1 842 . 1 1 70 70 LYS HD2 H 1 1.708 0.008 . 1 . . 751 . . 70 LYS HD2 . 18841 1 843 . 1 1 70 70 LYS HD3 H 1 1.708 0.008 . 1 . . 752 . . 70 LYS HD3 . 18841 1 844 . 1 1 70 70 LYS HE2 H 1 3.022 0.008 . 1 . . 750 . . 70 LYS HE2 . 18841 1 845 . 1 1 70 70 LYS HE3 H 1 3.022 0.008 . 1 . . 749 . . 70 LYS HE3 . 18841 1 846 . 1 1 70 70 LYS C C 13 175.706 0.04 . 1 . . 483 . . 70 LYS C . 18841 1 847 . 1 1 70 70 LYS CA C 13 56.512 0.04 . 1 . . 240 . . 70 LYS CA . 18841 1 848 . 1 1 70 70 LYS CB C 13 33.009 0.04 . 1 . . 241 . . 70 LYS CB . 18841 1 849 . 1 1 70 70 LYS CG C 13 24.722 0.04 . 1 . . 617 . . 70 LYS CG . 18841 1 850 . 1 1 70 70 LYS CD C 13 29.116 0.04 . 1 . . 616 . . 70 LYS CD . 18841 1 851 . 1 1 70 70 LYS CE C 13 42.250 0.04 . 1 . . 615 . . 70 LYS CE . 18841 1 852 . 1 1 70 70 LYS N N 15 123.399 0.04 . 1 . . 91 . . 70 LYS N . 18841 1 853 . 1 1 71 71 GLN H H 1 7.978 0.008 . 1 . . 5 . . 71 GLN H . 18841 1 854 . 1 1 71 71 GLN HA H 1 4.164 0.008 . 1 . . 787 . . 71 GLN HA . 18841 1 855 . 1 1 71 71 GLN HB2 H 1 1.940 0.008 . 2 . . 623 . . 71 GLN HB2 . 18841 1 856 . 1 1 71 71 GLN HB3 H 1 2.119 0.008 . 2 . . 622 . . 71 GLN HB3 . 18841 1 857 . 1 1 71 71 GLN HG2 H 1 2.326 0.008 . 1 . . 621 . . 71 GLN HG2 . 18841 1 858 . 1 1 71 71 GLN HG3 H 1 2.326 0.008 . 1 . . 620 . . 71 GLN HG3 . 18841 1 859 . 1 1 71 71 GLN HE21 H 1 6.835 0.008 . 1 . . 31 . . 71 GLN HE21 . 18841 1 860 . 1 1 71 71 GLN HE22 H 1 7.517 0.008 . 1 . . 80 . . 71 GLN HE22 . 18841 1 861 . 1 1 71 71 GLN CA C 13 57.477 0.04 . 1 . . 484 . . 71 GLN CA . 18841 1 862 . 1 1 71 71 GLN CB C 13 30.496 0.04 . 1 . . 485 . . 71 GLN CB . 18841 1 863 . 1 1 71 71 GLN CG C 13 34.398 0.04 . 1 . . 619 . . 71 GLN CG . 18841 1 864 . 1 1 71 71 GLN N N 15 126.444 0.04 . 1 . . 6 . . 71 GLN N . 18841 1 865 . 1 1 71 71 GLN NE2 N 15 112.536 0.04 . 1 . . 32 . . 71 GLN NE2 . 18841 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 18841 _Spectral_peak_list.ID 1 _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $PaaA2 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $PaaA2_1 _Spectral_peak_list.Experiment_ID 12 _Spectral_peak_list.Experiment_name '2D 1H-1H NOESY' _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 . . 7225.43408203 . . . . . . . 18841 1 2 . . H 1 1H . . 7225.43408203 . . . . . . . 18841 1 stop_ loop_ _Peak.ID _Peak.Figure_of_merit _Peak.Restraint _Peak.Details _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 1.0 . . 18841 1 2 1.0 . . 18841 1 3 1.0 . . 18841 1 4 1.0 . . 18841 1 5 1.0 . . 18841 1 6 1.0 . . 18841 1 7 1.0 . . 18841 1 8 1.0 . . 18841 1 9 1.0 . . 18841 1 10 1.0 . . 18841 1 11 1.0 . . 18841 1 12 1.0 . . 18841 1 13 1.0 . . 18841 1 14 1.0 . . 18841 1 15 1.0 . . 18841 1 16 1.0 . . 18841 1 17 1.0 . . 18841 1 18 1.0 . . 18841 1 19 1.0 . . 18841 1 20 1.0 . . 18841 1 21 1.0 . . 18841 1 22 1.0 . . 18841 1 23 1.0 . . 18841 1 24 1.0 . . 18841 1 25 1.0 . . 18841 1 26 1.0 . . 18841 1 27 1.0 . . 18841 1 28 1.0 . . 18841 1 29 1.0 . . 18841 1 30 1.0 . . 18841 1 31 1.0 . . 18841 1 32 1.0 . . 18841 1 33 1.0 . . 18841 1 34 1.0 . . 18841 1 35 1.0 . . 18841 1 36 1.0 . . 18841 1 37 1.0 . . 18841 1 38 1.0 . . 18841 1 39 1.0 . . 18841 1 40 1.0 . . 18841 1 41 1.0 . . 18841 1 42 1.0 . . 18841 1 43 1.0 . . 18841 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 287172.1875000 . height 18841 1 1 2454398.4687500 . volume 18841 1 2 52993.7460938 . height 18841 1 2 459864.4843750 . volume 18841 1 3 49614.3398438 . height 18841 1 3 416759.4375000 . volume 18841 1 4 100433.6015620 . height 18841 1 4 873296.5625000 . volume 18841 1 5 45087.4101562 . height 18841 1 5 362137.9726560 . volume 18841 1 6 24289.4121094 . height 18841 1 6 195460.4746090 . volume 18841 1 7 72351.0234375 . height 18841 1 7 586753.7070310 . volume 18841 1 8 105896.2578120 . height 18841 1 8 918061.0234380 . volume 18841 1 9 39173.1718750 . height 18841 1 9 329721.7500000 . volume 18841 1 10 780564.7500000 . height 18841 1 10 6346301.2500000 . volume 18841 1 11 68017.7968750 . height 18841 1 11 556996.3085940 . volume 18841 1 12 131408.6250000 . height 18841 1 12 1079712.1015600 . volume 18841 1 13 114288.8906250 . height 18841 1 13 955961.7500000 . volume 18841 1 14 275329.4687500 . height 18841 1 14 2301274.8437500 . volume 18841 1 15 267591.8750000 . height 18841 1 15 2250494.0625000 . volume 18841 1 16 38819.0937500 . height 18841 1 16 332395.3906250 . volume 18841 1 17 24593.0195312 . height 18841 1 17 209058.0312500 . volume 18841 1 18 33206.0117188 . height 18841 1 18 272920.5351560 . volume 18841 1 19 187144.7500000 . height 18841 1 19 1631467.5937500 . volume 18841 1 20 257874.7656250 . height 18841 1 20 2228952.1718800 . volume 18841 1 21 981952.8750000 . height 18841 1 21 8016403.5625000 . volume 18841 1 22 249774.6562500 . height 18841 1 22 2114489.5781200 . volume 18841 1 23 510036.9687500 . height 18841 1 23 4321044.8125000 . volume 18841 1 24 94462.6953125 . height 18841 1 24 794288.3281250 . volume 18841 1 25 102533.8984380 . height 18841 1 25 895300.7343750 . volume 18841 1 26 1005538.6250000 . height 18841 1 26 8280348.0625000 . volume 18841 1 27 487702.0937500 . height 18841 1 27 4178431.1562500 . volume 18841 1 28 281632.1562500 . height 18841 1 28 2381218.2031200 . volume 18841 1 29 420675.9375000 . height 18841 1 29 3608548.3750000 . volume 18841 1 30 1775979.6250000 . height 18841 1 30 13481027.2500000 . volume 18841 1 31 1282392.3750000 . height 18841 1 31 10219800.6875000 . volume 18841 1 32 1102677.5000000 . height 18841 1 32 8801665.8750000 . volume 18841 1 33 1309317.8750000 . height 18841 1 33 10252152.8750000 . volume 18841 1 34 1801982.5000000 . height 18841 1 34 13726402.5000000 . volume 18841 1 35 1390897.1250000 . height 18841 1 35 11099381.1250000 . volume 18841 1 36 802859.3125000 . height 18841 1 36 6525991.3125000 . volume 18841 1 37 1240679.6250000 . height 18841 1 37 9717949.2500000 . volume 18841 1 38 1012533.6250000 . height 18841 1 38 8145863.6250000 . volume 18841 1 39 57723.7968750 . height 18841 1 39 485901.6718750 . volume 18841 1 40 65076.5234375 . height 18841 1 40 503765.8125000 . volume 18841 1 41 34958.2617188 . height 18841 1 41 302027.9433590 . volume 18841 1 42 330001.6250000 . height 18841 1 42 2773394.6562500 . volume 18841 1 43 54080.4843750 . height 18841 1 43 458857.4960940 . volume 18841 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 7.466 . 20.6589973091 . . . . . . . . . . 8 18841 1 1 2 7.191 . 26.1459412050 . . . . . . . . . . 8 18841 1 2 1 7.465 . 21.3741239006 . . . . . . . . . . 8 18841 1 2 2 7.062 . 29.3938347250 . . . . . . . . . . 8 18841 1 3 1 7.470 . 24.3524183563 . . . . . . . . . . 8 18841 1 3 2 10.177 . 18.5487170932 . . . . . . . . . . 8 18841 1 4 1 7.465 . 211.0853006200 . . . . . . . . . . 8 18841 1 4 2 7.331 . 39.4488892841 . . . . . . . . . . 8 18841 1 8 1 7.342 . 26.4743266468 . . . . . . . . . . 8 18841 1 8 2 7.062 . 35.1241068499 . . . . . . . . . . 8 18841 1 9 1 7.067 . 28.7682873753 . . . . . . . . . . 8 18841 1 9 2 7.468 . 23.6082215781 . . . . . . . . . . 8 18841 1 21 1 7.125 . 16.3572556895 . . . . . . . . . . 8 18841 1 21 2 6.836 . 17.1359060222 . . . . . . . . . . 8 18841 1 22 1 7.190 . 26.5893153851 . . . . . . . . . . 8 18841 1 22 2 7.468 . 21.5929039720 . . . . . . . . . . 8 18841 1 23 1 7.015 . 26.0333211486 . . . . . . . . . . 8 18841 1 23 2 6.835 . 22.0306794494 . . . . . . . . . . 8 18841 1 24 1 7.221 . 29.3953420680 . . . . . . . . . . 8 18841 1 24 2 10.177 . 20.4768510563 . . . . . . . . . . 8 18841 1 25 1 7.071 . 36.1019417948 . . . . . . . . . . 8 18841 1 25 2 7.344 . 267.9592904500 . . . . . . . . . . 8 18841 1 26 1 6.836 . 16.1035913941 . . . . . . . . . . 8 18841 1 26 2 7.124 . 17.9335058099 . . . . . . . . . . 8 18841 1 27 1 6.837 . 18.5207235802 . . . . . . . . . . 8 18841 1 27 2 7.013 . 54.1355782476 . . . . . . . . . . 8 18841 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 . . 7.466 . . 1 . 1 1 32 TRP HZ2 . . . . . . . . . . 548 . 18841 1 2 1 1 . . 7.465 . . 1 . 1 1 32 TRP HZ2 . . . . . . . . . . 548 . 18841 1 2 2 1 . . 7.062 . . 1 . 1 1 32 TRP HZ3 . . . . . . . . . . 635 . 18841 1 3 1 1 . . 7.470 . . 1 . 1 1 32 TRP HZ2 . . . . . . . . . . 548 . 18841 1 3 2 1 . . 10.177 . . 1 . 1 1 32 TRP HE1 . . . . . . . . . . 56 . 18841 1 4 1 1 . . 7.465 . . 1 . 1 1 32 TRP HZ2 . . . . . . . . . . 548 . 18841 1 4 2 1 . . 7.331 . . 1 . 1 1 32 TRP HE3 . . . . . . . . . . 637 . 18841 1 8 1 1 . . 7.342 . . 1 . 1 1 32 TRP HE3 . . . . . . . . . . 637 . 18841 1 8 2 1 . . 7.062 . . 1 . 1 1 32 TRP HZ3 . . . . . . . . . . 635 . 18841 1 9 1 1 . . 7.067 . . 1 . 1 1 32 TRP HZ3 . . . . . . . . . . 635 . 18841 1 9 2 1 . . 7.468 . . 1 . 1 1 32 TRP HZ2 . . . . . . . . . . 548 . 18841 1 21 1 1 . . 7.125 . . 1 . 1 1 3 TYR QD . . . . . . . . . . 538 . 18841 1 21 2 1 . . 6.836 . . 1 . 1 1 3 TYR QE . . . . . . . . . . 539 . 18841 1 22 2 1 . . 7.468 . . 1 . 1 1 32 TRP HZ2 . . . . . . . . . . 548 . 18841 1 23 1 1 . . 7.015 . . 1 . 1 1 29 TYR QD . . . . . . . . . . 534 . 18841 1 23 2 1 . . 6.835 . . 1 . 1 1 29 TYR QE . . . . . . . . . . 535 . 18841 1 24 1 1 . . 7.221 . . 1 . 1 1 32 TRP HD1 . . . . . . . . . . 542 . 18841 1 24 2 1 . . 10.177 . . 1 . 1 1 32 TRP HE1 . . . . . . . . . . 56 . 18841 1 25 1 1 . . 7.071 . . 1 . 1 1 32 TRP HZ3 . . . . . . . . . . 635 . 18841 1 25 2 1 . . 7.344 . . 1 . 1 1 32 TRP HE3 . . . . . . . . . . 637 . 18841 1 26 1 1 . . 6.836 . . 1 . 1 1 3 TYR QE . . . . . . . . . . 539 . 18841 1 26 2 1 . . 7.124 . . 1 . 1 1 3 TYR QD . . . . . . . . . . 538 . 18841 1 27 1 1 . . 6.837 . . 1 . 1 1 29 TYR QE . . . . . . . . . . 535 . 18841 1 27 2 1 . . 7.013 . . 1 . 1 1 29 TYR QD . . . . . . . . . . 534 . 18841 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 18841 _Spectral_peak_list.ID 2 _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $PaaA2 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $PaaA2_1 _Spectral_peak_list.Experiment_ID 13 _Spectral_peak_list.Experiment_name '3D 1H-15N 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 . . 3612.71704102 . . . . . . . 18841 2 2 . . H 1 1H . . 7197.28076172 . . . . . . . 18841 2 3 . . N 15 15N . . 1215.43603516 . . . . . . . 18841 2 stop_ loop_ _Peak.ID _Peak.Figure_of_merit _Peak.Restraint _Peak.Details _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 1.0 . . 18841 2 2 1.0 . . 18841 2 3 1.0 . . 18841 2 4 1.0 . . 18841 2 5 1.0 . . 18841 2 6 1.0 . . 18841 2 7 1.0 . . 18841 2 8 1.0 . . 18841 2 9 1.0 . . 18841 2 10 1.0 . . 18841 2 11 1.0 . . 18841 2 12 1.0 . . 18841 2 13 1.0 . . 18841 2 14 1.0 . . 18841 2 15 1.0 . . 18841 2 16 1.0 . . 18841 2 17 1.0 . . 18841 2 18 1.0 . . 18841 2 19 1.0 . . 18841 2 20 1.0 . . 18841 2 21 1.0 . . 18841 2 22 1.0 . . 18841 2 23 1.0 . . 18841 2 24 1.0 . . 18841 2 25 1.0 . . 18841 2 26 1.0 . . 18841 2 27 1.0 . . 18841 2 28 1.0 . . 18841 2 29 1.0 . . 18841 2 30 1.0 . . 18841 2 31 1.0 . . 18841 2 32 1.0 . . 18841 2 33 1.0 . . 18841 2 34 1.0 . . 18841 2 35 1.0 . . 18841 2 36 1.0 . . 18841 2 37 1.0 . . 18841 2 38 1.0 . . 18841 2 39 1.0 . . 18841 2 40 1.0 . . 18841 2 41 1.0 . . 18841 2 42 1.0 . . 18841 2 43 1.0 . . 18841 2 44 1.0 . . 18841 2 45 1.0 . . 18841 2 46 1.0 . . 18841 2 47 1.0 . . 18841 2 48 1.0 . . 18841 2 49 1.0 . . 18841 2 50 1.0 . . 18841 2 51 1.0 . . 18841 2 52 1.0 . . 18841 2 53 1.0 . . 18841 2 54 1.0 . . 18841 2 55 1.0 . . 18841 2 56 1.0 . . 18841 2 57 1.0 . . 18841 2 58 1.0 . . 18841 2 59 1.0 . . 18841 2 60 1.0 . . 18841 2 61 1.0 . . 18841 2 62 1.0 . . 18841 2 63 1.0 . . 18841 2 64 1.0 . . 18841 2 65 1.0 . . 18841 2 66 1.0 . . 18841 2 67 1.0 . . 18841 2 68 1.0 . . 18841 2 69 1.0 . . 18841 2 70 1.0 . . 18841 2 71 1.0 . . 18841 2 72 1.0 . . 18841 2 73 1.0 . . 18841 2 74 1.0 . . 18841 2 75 1.0 . . 18841 2 76 1.0 . . 18841 2 77 1.0 . . 18841 2 78 1.0 . . 18841 2 79 1.0 . . 18841 2 80 1.0 . . 18841 2 81 1.0 . . 18841 2 82 1.0 . . 18841 2 83 1.0 . . 18841 2 84 1.0 . . 18841 2 85 1.0 . . 18841 2 86 1.0 . . 18841 2 87 1.0 . . 18841 2 88 1.0 . . 18841 2 89 1.0 . . 18841 2 90 1.0 . . 18841 2 91 1.0 . . 18841 2 92 1.0 . . 18841 2 93 1.0 . . 18841 2 94 1.0 . . 18841 2 95 1.0 . . 18841 2 96 1.0 . . 18841 2 97 1.0 . . 18841 2 98 1.0 . . 18841 2 99 1.0 . . 18841 2 100 1.0 . . 18841 2 101 1.0 . . 18841 2 102 1.0 . . 18841 2 103 1.0 . . 18841 2 104 1.0 . . 18841 2 105 1.0 . . 18841 2 106 1.0 . . 18841 2 107 1.0 . . 18841 2 108 1.0 . . 18841 2 109 1.0 . . 18841 2 110 1.0 . . 18841 2 111 1.0 . . 18841 2 112 1.0 . . 18841 2 113 1.0 . . 18841 2 114 1.0 . . 18841 2 115 1.0 . . 18841 2 116 1.0 . . 18841 2 117 1.0 . . 18841 2 118 1.0 . . 18841 2 119 1.0 . . 18841 2 120 1.0 . . 18841 2 121 1.0 . . 18841 2 122 1.0 . . 18841 2 123 1.0 . . 18841 2 124 1.0 . . 18841 2 125 1.0 . . 18841 2 126 1.0 . . 18841 2 127 1.0 . . 18841 2 128 1.0 . . 18841 2 129 1.0 . . 18841 2 130 1.0 . . 18841 2 131 1.0 . . 18841 2 132 1.0 . . 18841 2 133 1.0 . . 18841 2 134 1.0 . . 18841 2 135 1.0 . . 18841 2 136 1.0 . . 18841 2 137 1.0 . . 18841 2 138 1.0 . . 18841 2 139 1.0 . . 18841 2 140 1.0 . . 18841 2 141 1.0 . . 18841 2 142 1.0 . . 18841 2 143 1.0 . . 18841 2 144 1.0 . . 18841 2 145 1.0 . . 18841 2 146 1.0 . . 18841 2 147 1.0 . . 18841 2 148 1.0 . . 18841 2 149 1.0 . . 18841 2 150 1.0 . . 18841 2 151 1.0 . . 18841 2 152 1.0 . . 18841 2 153 1.0 . . 18841 2 154 1.0 . . 18841 2 155 1.0 . . 18841 2 156 1.0 . . 18841 2 157 1.0 . . 18841 2 158 1.0 . . 18841 2 159 1.0 . . 18841 2 160 1.0 . . 18841 2 161 1.0 . . 18841 2 162 1.0 . . 18841 2 163 1.0 . . 18841 2 164 1.0 . . 18841 2 165 1.0 . . 18841 2 166 1.0 . . 18841 2 167 1.0 . . 18841 2 168 1.0 . . 18841 2 169 1.0 . . 18841 2 170 1.0 . . 18841 2 171 1.0 . . 18841 2 172 1.0 . . 18841 2 173 1.0 . . 18841 2 174 1.0 . . 18841 2 175 1.0 . . 18841 2 176 1.0 . . 18841 2 177 1.0 . . 18841 2 178 1.0 . . 18841 2 179 1.0 . . 18841 2 180 1.0 . . 18841 2 181 1.0 . . 18841 2 182 1.0 . . 18841 2 183 1.0 . . 18841 2 184 1.0 . . 18841 2 185 1.0 . . 18841 2 186 1.0 . . 18841 2 187 1.0 . . 18841 2 188 1.0 . . 18841 2 189 1.0 . . 18841 2 190 1.0 . . 18841 2 191 1.0 . . 18841 2 192 1.0 . . 18841 2 193 1.0 . . 18841 2 194 1.0 . . 18841 2 195 1.0 . . 18841 2 196 1.0 . . 18841 2 197 1.0 . . 18841 2 198 1.0 . . 18841 2 199 1.0 . . 18841 2 200 1.0 . . 18841 2 201 1.0 . . 18841 2 202 1.0 . . 18841 2 203 1.0 . . 18841 2 204 1.0 . . 18841 2 205 1.0 . . 18841 2 206 1.0 . . 18841 2 207 1.0 . . 18841 2 208 1.0 . . 18841 2 209 1.0 . . 18841 2 210 1.0 . . 18841 2 211 1.0 . . 18841 2 212 1.0 . . 18841 2 213 1.0 . . 18841 2 214 1.0 . . 18841 2 215 1.0 . . 18841 2 216 1.0 . . 18841 2 217 1.0 . . 18841 2 218 1.0 . . 18841 2 219 1.0 . . 18841 2 220 1.0 . . 18841 2 221 1.0 . . 18841 2 222 1.0 . . 18841 2 223 1.0 . . 18841 2 224 1.0 . . 18841 2 225 1.0 . . 18841 2 226 1.0 . . 18841 2 227 1.0 . . 18841 2 228 1.0 . . 18841 2 229 1.0 . . 18841 2 230 1.0 . . 18841 2 231 1.0 . . 18841 2 232 1.0 . . 18841 2 233 1.0 . . 18841 2 234 1.0 . . 18841 2 235 1.0 . . 18841 2 236 1.0 . . 18841 2 237 1.0 . . 18841 2 238 1.0 . . 18841 2 239 1.0 . . 18841 2 240 1.0 . . 18841 2 241 1.0 . . 18841 2 242 1.0 . . 18841 2 243 1.0 . . 18841 2 244 1.0 . . 18841 2 245 1.0 . . 18841 2 246 1.0 . . 18841 2 247 1.0 . . 18841 2 248 1.0 . . 18841 2 249 1.0 . . 18841 2 250 1.0 . . 18841 2 251 1.0 . . 18841 2 252 1.0 . . 18841 2 253 1.0 . . 18841 2 254 1.0 . . 18841 2 255 1.0 . . 18841 2 256 1.0 . . 18841 2 257 1.0 . . 18841 2 258 1.0 . . 18841 2 259 1.0 . . 18841 2 260 1.0 . . 18841 2 261 1.0 . . 18841 2 262 1.0 . . 18841 2 263 1.0 . . 18841 2 264 1.0 . . 18841 2 265 1.0 . . 18841 2 266 1.0 . . 18841 2 267 1.0 . . 18841 2 268 1.0 . . 18841 2 269 1.0 . . 18841 2 270 1.0 . . 18841 2 271 1.0 . . 18841 2 272 1.0 . . 18841 2 273 1.0 . . 18841 2 274 1.0 . . 18841 2 275 1.0 . . 18841 2 276 1.0 . . 18841 2 277 1.0 . . 18841 2 278 1.0 . . 18841 2 279 1.0 . . 18841 2 280 1.0 . . 18841 2 281 1.0 . . 18841 2 282 1.0 . . 18841 2 283 1.0 . . 18841 2 284 1.0 . . 18841 2 285 1.0 . . 18841 2 286 1.0 . . 18841 2 287 1.0 . . 18841 2 288 1.0 . . 18841 2 289 1.0 . . 18841 2 290 1.0 . . 18841 2 291 1.0 . . 18841 2 292 1.0 . . 18841 2 293 1.0 . . 18841 2 294 1.0 . . 18841 2 295 1.0 . . 18841 2 296 1.0 . . 18841 2 297 1.0 . . 18841 2 298 1.0 . . 18841 2 299 1.0 . . 18841 2 300 1.0 . . 18841 2 301 1.0 . . 18841 2 302 1.0 . . 18841 2 303 1.0 . . 18841 2 304 1.0 . . 18841 2 305 1.0 . . 18841 2 306 1.0 . . 18841 2 307 1.0 . . 18841 2 308 1.0 . . 18841 2 309 1.0 . . 18841 2 310 1.0 . . 18841 2 311 1.0 . . 18841 2 312 1.0 . . 18841 2 313 1.0 . . 18841 2 314 1.0 . . 18841 2 315 1.0 . . 18841 2 316 1.0 . . 18841 2 317 1.0 . . 18841 2 318 1.0 . . 18841 2 319 1.0 . . 18841 2 320 1.0 . . 18841 2 321 1.0 . . 18841 2 322 1.0 . . 18841 2 323 1.0 . . 18841 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 193579.1093750 . height 18841 2 1 3600881.4531200 . volume 18841 2 2 59296.3750000 . height 18841 2 2 1135215.3261700 . volume 18841 2 3 84176.3671875 . height 18841 2 3 1625231.8085900 . volume 18841 2 4 87800.0078125 . height 18841 2 4 1709823.8632800 . volume 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3455060.3203100 . volume 18841 2 311 196417.7343750 . height 18841 2 311 4072005.5234400 . volume 18841 2 312 198195.7656250 . height 18841 2 312 4153130.3671900 . volume 18841 2 313 85859.3515625 . height 18841 2 313 1731320.7265600 . volume 18841 2 314 276535.0937500 . height 18841 2 314 5436053.6406200 . volume 18841 2 315 129900.9375000 . height 18841 2 315 2691930.2109400 . volume 18841 2 316 40975.5195312 . height 18841 2 316 1160983.1054700 . volume 18841 2 317 32385.4863281 . height 18841 2 317 1014877.9062500 . volume 18841 2 318 30686.6523438 . height 18841 2 318 593985.9072270 . volume 18841 2 319 24080.6132812 . height 18841 2 319 508227.4453120 . volume 18841 2 320 181008.7500000 . height 18841 2 320 3323081.9765600 . volume 18841 2 321 25853.1425781 . height 18841 2 321 501169.7343750 . volume 18841 2 322 68655.9218750 . height 18841 2 322 1221544.7539100 . volume 18841 2 323 984832.3125000 . height 18841 2 323 18910798.6562000 . volume 18841 2 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 8.314 . 15.98106594080 . . . . . . . . . . 8 18841 2 1 2 4.540 . 55.46772527270 . . . . . . . . . . 8 18841 2 1 3 123.218 . 15.19416752610 . . . . . . . . . . 8 18841 2 2 1 8.313 . 16.72084835730 . . . . . . . . . . 8 18841 2 2 2 4.284 . 54.20434570820 . . . . . . . . . . 8 18841 2 2 3 123.215 . 18.30349787690 . . . . . . . . . . 8 18841 2 3 1 8.015 . 16.36640741490 . . . . . . . . . . 8 18841 2 3 2 1.628 . 71.30994732250 . . . . . . . . . . 8 18841 2 3 3 121.157 . 16.09350761570 . . . . . . . . . . 8 18841 2 4 1 8.355 . 19.85827516800 . . . . . . . . . . 8 18841 2 4 2 3.765 . 59.88075942540 . . . . . . . . . . 8 18841 2 4 3 122.234 . 16.63348114220 . . . . . . . . . . 8 18841 2 5 1 8.177 . 16.57194440120 . . . . . . . . . . 8 18841 2 5 2 4.756 . 58.23150212980 . . . . . . . . . . 8 18841 2 5 3 117.574 . 16.58041471590 . . . . . . . . . . 8 18841 2 6 1 7.978 . 12.60300258510 . . . . . . . . . . 8 18841 2 6 2 4.164 . 56.70879728630 . . . . . . . . . . 8 18841 2 6 3 126.437 . 14.27733181610 . . . . . . . . . . 8 18841 2 9 1 8.290 . 15.70070014070 . . . . . . . . . . 8 18841 2 9 2 4.676 . 112.43992325600 . . . . . . . . . . 8 18841 2 9 3 121.146 . 16.36202735480 . . . . . . . . . . 8 18841 2 10 1 8.289 . 15.62737866990 . . . . . . . . . . 8 18841 2 10 2 2.924 . 56.46684615750 . . . . . . . . . . 8 18841 2 10 3 121.124 . 16.23774687120 . . . . . . . . . . 8 18841 2 11 1 8.290 . 11.73821836600 . . . . . . . . . . 8 18841 2 11 2 3.048 . 127.26843871500 . . . . . . . . . . 8 18841 2 11 3 121.111 . 12.35038664350 . . . . . . . . . . 8 18841 2 12 1 8.313 . 16.43197683590 . . . . . . . . . . 8 18841 2 12 2 1.360 . 70.37345917670 . . . . . . . . . . 8 18841 2 12 3 123.189 . 15.45566003880 . . . . . . . . . . 8 18841 2 13 1 8.318 . 16.97483565470 . . . . . . . . . . 8 18841 2 13 2 1.735 . 78.57105513520 . . . . . . . . . . 8 18841 2 13 3 123.218 . 14.94930128610 . . . . . . . . . . 8 18841 2 14 1 8.276 . 17.18392566380 . . . . . . . . . . 8 18841 2 14 2 4.568 . 56.05244050070 . . . . . . . . . . 8 18841 2 14 3 121.373 . 19.60281030700 . . . . . . . . . . 8 18841 2 15 1 8.277 . 17.12373961070 . . . . . . . . . . 8 18841 2 15 2 2.651 . 110.93716651100 . . . . . . . . . . 8 18841 2 15 3 121.390 . 21.32535012570 . . . . . . . . . . 8 18841 2 16 1 8.172 . 35.16179042520 . . . . . . . . . . 8 18841 2 16 2 4.159 . 63.16940721530 . . . . . . . . . . 8 18841 2 16 3 120.864 . 40.89287940930 . . . . . . . . . . 8 18841 2 17 1 8.174 . 12.65823593970 . . . . . . . . . . 8 18841 2 17 2 1.418 . 58.58777945690 . . . . . . . . . . 8 18841 2 17 3 120.852 . 15.35362036460 . . . . . . . . . . 8 18841 2 18 1 8.174 . 15.01356706220 . . . . . . . . . . 8 18841 2 18 2 1.808 . 81.57442366860 . . . . . . . . . . 8 18841 2 18 3 120.869 . 15.98904101270 . . . . . . . . . . 8 18841 2 19 1 7.739 . 14.56114882410 . . . . . . . . . . 8 18841 2 19 2 2.723 . 90.79430604550 . . . . . . . . . . 8 18841 2 19 3 113.584 . 15.46453462890 . . . . . . . . . . 8 18841 2 20 1 8.174 . 14.12552669390 . . . . . . . . . . 8 18841 2 20 2 1.399 . 55.98036995170 . . . . . . . . . . 8 18841 2 20 3 124.137 . 15.73801689390 . . . . . . . . . . 8 18841 2 21 1 8.174 . 12.17771652110 . . . . . . . . . . 8 18841 2 21 2 1.644 . 188.68155528900 . . . . . . . . . . 8 18841 2 21 3 124.132 . 17.65996331790 . . . . . . . . . . 8 18841 2 22 1 8.058 . 17.41088845440 . . . . . . . . . . 8 18841 2 22 2 1.644 . 77.54705275140 . . . . . . . . . . 8 18841 2 22 3 120.727 . 16.03620311990 . . . . . . . . . . 8 18841 2 23 1 8.178 . 15.58366572260 . . . . . . . . . . 8 18841 2 23 2 3.862 . 63.30582646880 . . . . . . . . . . 8 18841 2 23 3 117.583 . 15.62579860820 . . . . . . . . . . 8 18841 2 24 1 8.378 . 15.84648174340 . . . . . . . . . . 8 18841 2 24 2 2.006 . 90.90155388620 . . . . . . . . . . 8 18841 2 24 3 120.249 . 15.09469967180 . . . . . . . . . . 8 18841 2 25 1 8.052 . 17.07733497950 . . . . . . . . . . 8 18841 2 25 2 0.907 . 59.61221083210 . . . . . . . . . . 8 18841 2 25 3 121.101 . 20.15357823280 . . . . . . . . . . 8 18841 2 26 1 8.054 . 15.38092808760 . . . . . . . . . . 8 18841 2 26 2 4.117 . 55.89714562720 . . . . . . . . . . 8 18841 2 26 3 121.070 . 14.05064943010 . . . . . . . . . . 8 18841 2 27 1 8.332 . 14.35335082330 . . . . . . . . . . 8 18841 2 27 2 4.420 . 56.85208040160 . . . . . . . . . . 8 18841 2 27 3 119.008 . 16.21021753060 . . . . . . . . . . 8 18841 2 28 1 8.330 . 17.73292152200 . . . . . . . . . . 8 18841 2 28 2 3.813 . 86.93681570800 . . . . . . . . . . 8 18841 2 28 3 119.005 . 16.82644008600 . . . . . . . . . . 8 18841 2 29 1 8.331 . 15.38857247000 . . . . . . . . . . 8 18841 2 29 2 0.900 . 55.35833247510 . . . . . . . . . . 8 18841 2 29 3 118.990 . 15.32123716660 . . . . . . . . . . 8 18841 2 30 1 8.351 . 19.16715839730 . . . . . . . . . . 8 18841 2 30 2 2.011 . 73.82641065870 . . . . . . . . . . 8 18841 2 30 3 122.710 . 16.02573472590 . . . . . . . . . . 8 18841 2 31 1 8.351 . 23.92422527370 . . . . . . . . . . 8 18841 2 31 2 1.805 . 95.23908555910 . . . . . . . . . . 8 18841 2 31 3 122.710 . 19.43915562170 . . . . . . . . . . 8 18841 2 32 1 8.348 . 21.84269224240 . . . . . . . . . . 8 18841 2 32 2 4.173 . 63.73524682330 . . . . . . . . . . 8 18841 2 32 3 122.723 . 20.51631351780 . . . . . . . . . . 8 18841 2 33 1 8.103 . 15.67378330120 . . . . . . . . . . 8 18841 2 33 2 4.613 . 54.88258105340 . . . . . . . . . . 8 18841 2 33 3 119.374 . 15.16729019620 . . . . . . . . . . 8 18841 2 34 1 8.101 . 16.31935677950 . . . . . . . . . . 8 18841 2 34 2 2.925 . 61.31959645740 . . . . . . . . . . 8 18841 2 34 3 119.365 . 15.35644574430 . . . . . . . . . . 8 18841 2 35 1 8.100 . 16.12490953100 . . . . . . . . . . 8 18841 2 35 2 3.192 . 58.06269402840 . . . . . . . . . . 8 18841 2 35 3 119.389 . 16.14863874250 . . . . . . . . . . 8 18841 2 36 1 8.100 . 21.83192550660 . . . . . . . . . . 8 18841 2 36 2 2.051 . 67.18090545220 . . . . . . . . . . 8 18841 2 36 3 119.342 . 19.51663622640 . . . . . . . . . . 8 18841 2 37 1 8.457 . 19.73424237160 . . . . . . . . . . 8 18841 2 37 2 2.056 . 90.45583185990 . . . . . . . . . . 8 18841 2 37 3 121.479 . 16.45953917700 . . . . . . . . . . 8 18841 2 38 1 8.457 . 19.88056231110 . . . . . . . . . . 8 18841 2 38 2 2.290 . 75.61702060850 . . . . . . . . . . 8 18841 2 38 3 121.491 . 16.01772948340 . . . . . . . . . . 8 18841 2 39 1 8.455 . 22.79199533750 . . . . . . . . . . 8 18841 2 39 2 4.274 . 56.19272067640 . . . . . . . . . . 8 18841 2 39 3 121.469 . 17.17091907150 . . . . . . . . . . 8 18841 2 40 1 7.929 . 16.48677952110 . . . . . . . . . . 8 18841 2 40 2 4.458 . 181.99186397200 . . . . . . . . . . 8 18841 2 40 3 112.284 . 22.53906804020 . . . . . . . . . . 8 18841 2 41 1 7.926 . 15.78241966540 . . . . . . . . . . 8 18841 2 41 2 1.225 . 52.07225863340 . . . . . . . . . . 8 18841 2 41 3 112.269 . 17.67840073150 . . . . . . . . . . 8 18841 2 42 1 8.326 . 18.69546770210 . . . . . . . . . . 8 18841 2 42 2 4.111 . 63.40792641330 . . . . . . . . . . 8 18841 2 42 3 122.865 . 15.06941614590 . . . . . . . . . . 8 18841 2 43 1 8.326 . 19.28150113150 . . . . . . . . . . 8 18841 2 43 2 1.870 . 58.23686452180 . . . . . . . . . . 8 18841 2 43 3 122.857 . 15.50673421020 . . . . . . . . . . 8 18841 2 44 1 8.326 . 19.44127949070 . . . . . . . . . . 8 18841 2 44 2 1.494 . 58.05883310610 . . . . . . . . . . 8 18841 2 44 3 122.871 . 15.65564620910 . . . . . . . . . . 8 18841 2 45 1 8.326 . 20.63703316810 . . . . . . . . . . 8 18841 2 45 2 1.227 . 52.60635288050 . . . . . . . . . . 8 18841 2 45 3 122.862 . 15.62166920710 . . . . . . . . . . 8 18841 2 46 1 8.325 . 18.53192098540 . . . . . . . . . . 8 18841 2 46 2 0.901 . 60.52081453930 . . . . . . . . . . 8 18841 2 46 3 122.849 . 15.99374997890 . . . . . . . . . . 8 18841 2 47 1 8.444 . 15.46404728790 . . . . . . . . . . 8 18841 2 47 2 4.161 . 96.92802455580 . . . . . . . . . . 8 18841 2 47 3 123.217 . 18.04772856920 . . . . . . . . . . 8 18841 2 48 1 8.445 . 14.61541317250 . . . . . . . . . . 8 18841 2 48 2 4.386 . 68.84153101890 . . . . . . . . . . 8 18841 2 48 3 123.194 . 17.73038047330 . . . . . . . . . . 8 18841 2 49 1 8.445 . 15.41570464420 . . . . . . . . . . 8 18841 2 49 2 2.282 . 56.06831318110 . . . . . . . . . . 8 18841 2 49 3 123.198 . 17.37977983180 . . . . . . . . . . 8 18841 2 50 1 8.444 . 15.46232461020 . . . . . . . . . . 8 18841 2 50 2 2.007 . 67.36322678150 . . . . . . . . . . 8 18841 2 50 3 123.193 . 16.42215723030 . . . . . . . . . . 8 18841 2 51 1 8.448 . 14.55770346870 . . . . . . . . . . 8 18841 2 51 2 1.219 . 56.79287959350 . . . . . . . . . . 8 18841 2 51 3 123.242 . 17.32613384040 . . . . . . . . . . 8 18841 2 52 1 8.446 . 15.78866437210 . . . . . . . . . . 8 18841 2 52 2 0.907 . 53.80452575780 . . . . . . . . . . 8 18841 2 52 3 123.190 . 16.19909712600 . . . . . . . . . . 8 18841 2 53 1 8.179 . 19.02622182570 . . . . . . . . . . 8 18841 2 53 2 2.411 . 66.22725765190 . . . . . . . . . . 8 18841 2 53 3 120.564 . 17.04247296390 . . . . . . . . . . 8 18841 2 54 1 8.180 . 35.24932398720 . . . . . . . . . . 8 18841 2 54 2 2.123 . 123.44355172100 . . . . . . . . . . 8 18841 2 54 3 120.549 . 17.24024954240 . . . . . . . . . . 8 18841 2 55 1 6.949 . 14.92635650230 . . . . . . . . . . 8 18841 2 55 2 2.055 . 93.40343151610 . . . . . . . . . . 8 18841 2 55 3 112.241 . 17.26944513250 . . . . . . . . . . 8 18841 2 56 1 7.539 . 13.36345713430 . . . . . . . . . . 8 18841 2 56 2 2.101 . 88.51507493300 . . . . . . . . . . 8 18841 2 56 3 112.207 . 15.88841402830 . . . . . . . . . . 8 18841 2 57 1 8.164 . 24.35069567850 . . . . . . . . . . 8 18841 2 57 2 1.913 . 70.03069507760 . . . . . . . . . . 8 18841 2 57 3 121.782 . 17.10991984840 . . . . . . . . . . 8 18841 2 58 1 8.170 . 25.16283055960 . . . . . . . . . . 8 18841 2 58 2 3.795 . 60.64393506050 . . . . . . . . . . 8 18841 2 58 3 121.798 . 18.11532034490 . . . . . . . . . . 8 18841 2 59 1 8.585 . 13.98534379380 . . . . . . . . . . 8 18841 2 59 2 4.180 . 59.21753877800 . . . . . . . . . . 8 18841 2 59 3 118.870 . 15.69331793830 . . . . . . . . . . 8 18841 2 60 1 8.582 . 16.21524244430 . . . . . . . . . . 8 18841 2 60 2 4.637 . 136.15435131500 . . . . . . . . . . 8 18841 2 60 3 118.865 . 17.90725648650 . . . . . . . . . . 8 18841 2 61 1 8.584 . 16.64935723160 . . . . . . . . . . 8 18841 2 61 2 2.860 . 62.45041769070 . . . . . . . . . . 8 18841 2 61 3 118.867 . 16.51680745000 . . . . . . . . . . 8 18841 2 62 1 8.584 . 17.10780484180 . . . . . . . . . . 8 18841 2 62 2 2.182 . 216.18204662400 . . . . . . . . . . 8 18841 2 62 3 118.865 . 17.92899017650 . . . . . . . . . . 8 18841 2 63 1 6.921 . 14.12875671460 . . . . . . . . . . 8 18841 2 63 2 0.910 . 56.84221360020 . . . . . . . . . . 8 18841 2 63 3 112.753 . 16.38481150650 . . . . . . . . . . 8 18841 2 64 1 6.920 . 15.86736921080 . . . . . . . . . . 8 18841 2 64 2 2.860 . 60.69112411040 . . . . . . . . . . 8 18841 2 64 3 112.782 . 15.47112718150 . . . . . . . . . . 8 18841 2 65 1 7.682 . 16.98280303920 . . . . . . . . . . 8 18841 2 65 2 0.904 . 51.88779234720 . . . . . . . . . . 8 18841 2 65 3 112.791 . 13.53813279850 . . . . . . . . . . 8 18841 2 66 1 7.684 . 13.09471940880 . . . . . . . . . . 8 18841 2 66 2 4.188 . 59.65854189930 . . . . . . . . . . 8 18841 2 66 3 112.768 . 18.75334903580 . . . . . . . . . . 8 18841 2 67 1 8.284 . 14.41590555820 . . . . . . . . . . 8 18841 2 67 2 4.364 . 55.32487114880 . . . . . . . . . . 8 18841 2 67 3 116.213 . 15.82357518670 . . . . . . . . . . 8 18841 2 68 1 8.284 . 18.06895134620 . . . . . . . . . . 8 18841 2 68 2 3.962 . 67.07065467180 . . . . . . . . . . 8 18841 2 68 3 116.204 . 16.83853850670 . . . . . . . . . . 8 18841 2 69 1 8.233 . 15.37339137250 . . . . . . . . . . 8 18841 2 69 2 4.304 . 105.61080974600 . . . . . . . . . . 8 18841 2 69 3 123.688 . 18.46602965480 . . . . . . . . . . 8 18841 2 70 1 8.231 . 17.32421623120 . . . . . . . . . . 8 18841 2 70 2 2.976 . 69.13581909410 . . . . . . . . . . 8 18841 2 70 3 123.724 . 17.02696959850 . . . . . . . . . . 8 18841 2 71 1 8.317 . 18.09726786130 . . . . . . . . . . 8 18841 2 71 2 4.423 . 65.04838938590 . . . . . . . . . . 8 18841 2 71 3 118.183 . 17.50293740810 . . . . . . . . . . 8 18841 2 72 1 8.315 . 19.07833282700 . . . . . . . . . . 8 18841 2 72 2 2.840 . 201.47922563500 . . . . . . . . . . 8 18841 2 72 3 118.181 . 19.23250445320 . . . . . . . . . . 8 18841 2 73 1 8.315 . 18.03471312640 . . . . . . . . . . 8 18841 2 73 2 2.734 . 218.59083312800 . . . . . . . . . . 8 18841 2 73 3 118.157 . 20.76480203940 . . . . . . . . . . 8 18841 2 74 1 7.059 . 16.52801611920 . . . . . . . . . . 8 18841 2 74 2 2.177 . 68.26367965280 . . . . . . . . . . 8 18841 2 74 3 112.544 . 14.34090285920 . . . . . . . . . . 8 18841 2 75 1 7.059 . 18.55345445700 . . . . . . . . . . 8 18841 2 75 2 2.716 . 135.95422684400 . . . . . . . . . . 8 18841 2 75 3 112.518 . 18.79022386300 . . . . . . . . . . 8 18841 2 76 1 7.059 . 18.79226065690 . . . . . . . . . . 8 18841 2 76 2 2.836 . 112.58535132800 . . . . . . . . . . 8 18841 2 76 3 112.544 . 17.54213049560 . . . . . . . . . . 8 18841 2 77 1 7.640 . 11.96808817520 . . . . . . . . . . 8 18841 2 77 2 2.188 . 66.34094036310 . . . . . . . . . . 8 18841 2 77 3 112.544 . 18.19819814920 . . . . . . . . . . 8 18841 2 78 1 8.209 . 17.16982123990 . . . . . . . . . . 8 18841 2 78 2 2.275 . 79.79196455470 . . . . . . . . . . 8 18841 2 78 3 120.523 . 15.91847896610 . . . . . . . . . . 8 18841 2 79 1 8.209 . 20.79207416350 . . . . . . . . . . 8 18841 2 79 2 2.076 . 69.55708861270 . . . . . . . . . . 8 18841 2 79 3 120.517 . 16.15305792610 . . . . . . . . . . 8 18841 2 80 1 8.210 . 15.98817198640 . . . . . . . . . . 8 18841 2 80 2 4.049 . 56.60154944550 . . . . . . . . . . 8 18841 2 80 3 120.513 . 16.98321243610 . . . . . . . . . . 8 18841 2 81 1 8.030 . 15.54716648820 . . . . . . . . . . 8 18841 2 81 2 4.315 . 64.33797968860 . . . . . . . . . . 8 18841 2 81 3 122.249 . 18.33801822110 . . . . . . . . . . 8 18841 2 82 1 8.027 . 16.26304675130 . . . . . . . . . . 8 18841 2 82 2 3.264 . 71.22457804120 . . . . . . . . . . 8 18841 2 82 3 122.265 . 17.53550172020 . . . . . . . . . . 8 18841 2 83 1 8.030 . 17.03846706320 . . . . . . . . . . 8 18841 2 83 2 3.468 . 68.05304489350 . . . . . . . . . . 8 18841 2 83 3 122.278 . 18.21493309040 . . . . . . . . . . 8 18841 2 84 1 8.029 . 13.29390402100 . . . . . . . . . . 8 18841 2 84 2 2.286 . 55.13568595760 . . . . . . . . . . 8 18841 2 84 3 122.237 . 15.27382149970 . . . . . . . . . . 8 18841 2 85 1 8.030 . 16.19403197480 . . . . . . . . . . 8 18841 2 85 2 1.490 . 82.93132335030 . . . . . . . . . . 8 18841 2 85 3 122.314 . 33.46213081990 . . . . . . . . . . 8 18841 2 86 1 10.175 . 19.98564565250 . . . . . . . . . . 8 18841 2 86 2 4.313 . 55.89242672220 . . . . . . . . . . 8 18841 2 86 3 129.571 . 15.38845765840 . . . . . . . . . . 8 18841 2 87 1 10.181 . 17.32954576550 . . . . . . . . . . 8 18841 2 87 2 1.396 . 63.73353085790 . . . . . . . . . . 8 18841 2 87 3 129.586 . 14.17209547830 . . . . . . . . . . 8 18841 2 88 1 8.209 . 25.62676920500 . . . . . . . . . . 8 18841 2 88 2 0.829 . 51.42104974410 . . . . . . . . . . 8 18841 2 88 3 120.298 . 15.91261086980 . . . . . . . . . . 8 18841 2 89 1 8.205 . 20.89134346750 . . . . . . . . . . 8 18841 2 89 2 1.487 . 79.06954309920 . . . . . . . . . . 8 18841 2 89 3 120.322 . 16.16892351980 . . . . . . . . . . 8 18841 2 90 1 8.204 . 22.31535194380 . . . . . . . . . . 8 18841 2 90 2 3.656 . 58.70618107310 . . . . . . . . . . 8 18841 2 90 3 120.297 . 14.30989612820 . . . . . . . . . . 8 18841 2 91 1 7.817 . 16.44705026600 . . . . . . . . . . 8 18841 2 91 2 4.017 . 65.88578052680 . . . . . . . . . . 8 18841 2 91 3 118.309 . 16.62004247720 . . . . . . . . . . 8 18841 2 92 1 7.818 . 16.48850219880 . . . . . . . . . . 8 18841 2 92 2 1.833 . 67.84283912550 . . . . . . . . . . 8 18841 2 92 3 118.306 . 16.74544586810 . . . . . . . . . . 8 18841 2 93 1 7.750 . 18.38657005220 . . . . . . . . . . 8 18841 2 93 2 1.397 . 61.19904988440 . . . . . . . . . . 8 18841 2 93 3 121.963 . 16.81198718220 . . . . . . . . . . 8 18841 2 94 1 7.751 . 17.66476808440 . . . . . . . . . . 8 18841 2 94 2 4.186 . 63.04671568550 . . . . . . . . . . 8 18841 2 94 3 121.975 . 16.35145029240 . . . . . . . . . . 8 18841 2 95 1 7.749 . 16.05578708720 . . . . . . . . . . 8 18841 2 95 2 4.326 . 263.67954136100 . . . . . . . . . . 8 18841 2 95 3 122.022 . 21.14579362400 . . . . . . . . . . 8 18841 2 96 1 7.868 . 34.29065383200 . . . . . . . . . . 8 18841 2 96 2 4.036 . 69.66047553120 . . . . . . . . . . 8 18841 2 96 3 119.353 . 17.77728902070 . . . . . . . . . . 8 18841 2 97 1 7.866 . 15.55168851730 . . . . . . . . . . 8 18841 2 97 2 3.651 . 60.30417390090 . . . . . . . . . . 8 18841 2 97 3 119.354 . 18.76914218380 . . . . . . . . . . 8 18841 2 98 1 7.862 . 25.33660567530 . . . . . . . . . . 8 18841 2 98 2 1.458 . 157.51147183400 . . . . . . . . . . 8 18841 2 98 3 119.354 . 18.70270953820 . . . . . . . . . . 8 18841 2 99 1 7.861 . 16.22794719260 . . . . . . . . . . 8 18841 2 99 2 1.115 . 55.63717686110 . . . . . . . . . . 8 18841 2 99 3 119.386 . 17.41730666970 . . . . . . . . . . 8 18841 2 100 1 7.888 . 18.14819452170 . . . . . . . . . . 8 18841 2 100 2 0.912 . 58.03352261570 . . . . . . . . . . 8 18841 2 100 3 119.264 . 17.40904786750 . . . . . . . . . . 8 18841 2 101 1 7.889 . 18.00747328480 . . . . . . . . . . 8 18841 2 101 2 2.083 . 59.07768759360 . . . . . . . . . . 8 18841 2 101 3 119.273 . 16.84034964750 . . . . . . . . . . 8 18841 2 102 1 8.116 . 15.01507440530 . . . . . . . . . . 8 18841 2 102 2 4.306 . 61.98324609620 . . . . . . . . . . 8 18841 2 102 3 125.520 . 19.76660988340 . . . . . . . . . . 8 18841 2 103 1 8.116 . 17.35436309150 . . . . . . . . . . 8 18841 2 103 2 1.432 . 60.40284191440 . . . . . . . . . . 8 18841 2 103 3 125.528 . 17.86469467710 . . . . . . . . . . 8 18841 2 104 1 8.117 . 18.16639030510 . . . . . . . . . . 8 18841 2 104 2 0.910 . 54.88472601020 . . . . . . . . . . 8 18841 2 104 3 125.520 . 18.81300801470 . . . . . . . . . . 8 18841 2 105 1 8.009 . 14.42118125880 . . . . . . . . . . 8 18841 2 105 2 1.234 . 51.74493822330 . . . . . . . . . . 8 18841 2 105 3 112.465 . 16.51876348210 . . . . . . . . . . 8 18841 2 106 1 8.162 . 19.05055464860 . . . . . . . . . . 8 18841 2 106 2 4.473 . 179.11633486500 . . . . . . . . . . 8 18841 2 106 3 117.736 . 15.87877875910 . . . . . . . . . . 8 18841 2 107 1 8.161 . 23.29630924210 . . . . . . . . . . 8 18841 2 107 2 3.929 . 73.82941359830 . . . . . . . . . . 8 18841 2 107 3 117.677 . 15.92463684490 . . . . . . . . . . 8 18841 2 108 1 8.133 . 16.62179438800 . . . . . . . . . . 8 18841 2 108 2 1.652 . 73.03663755920 . . . . . . . . . . 8 18841 2 108 3 123.563 . 15.89515147220 . . . . . . . . . . 8 18841 2 109 1 8.133 . 19.51061726920 . . . . . . . . . . 8 18841 2 109 2 4.314 . 55.16786030990 . . . . . . . . . . 8 18841 2 109 3 123.555 . 18.17936228450 . . . . . . . . . . 8 18841 2 110 1 8.027 . 16.91260392180 . . . . . . . . . . 8 18841 2 110 2 1.366 . 58.20812210050 . . . . . . . . . . 8 18841 2 110 3 123.389 . 15.25911503620 . . . . . . . . . . 8 18841 2 111 1 8.030 . 14.96048705480 . . . . . . . . . . 8 18841 2 111 2 2.508 . 62.19988673460 . . . . . . . . . . 8 18841 2 111 3 120.605 . 14.42733049950 . . . . . . . . . . 8 18841 2 112 1 8.028 . 15.79264806440 . . . . . . . . . . 8 18841 2 112 2 2.746 . 54.30558766990 . . . . . . . . . . 8 18841 2 112 3 120.605 . 15.98425960090 . . . . . . . . . . 8 18841 2 113 1 8.026 . 9.44522664369 . . . . . . . . . . 8 18841 2 113 2 3.772 . 51.36999977190 . . . . . . . . . . 8 18841 2 113 3 120.612 . 15.72251352850 . . . . . . . . . . 8 18841 2 114 1 8.357 . 13.92515774070 . . . . . . . . . . 8 18841 2 114 2 4.576 . 147.12215900100 . . . . . . . . . . 8 18841 2 114 3 122.264 . 14.34358334760 . . . . . . . . . . 8 18841 2 115 1 8.355 . 15.26626235140 . . . . . . . . . . 8 18841 2 115 2 1.717 . 112.29706913200 . . . . . . . . . . 8 18841 2 115 3 122.237 . 14.73066036540 . . . . . . . . . . 8 18841 2 116 1 8.349 . 14.99892430160 . . . . . . . . . . 8 18841 2 116 2 1.359 . 58.56375594060 . . . . . . . . . . 8 18841 2 116 3 124.274 . 14.77756891280 . . . . . . . . . . 8 18841 2 117 1 8.047 . 17.44997170530 . . . . . . . . . . 8 18841 2 117 2 1.466 . 126.58548446500 . . . . . . . . . . 8 18841 2 117 3 121.307 . 16.07155658880 . . . . . . . . . . 8 18841 2 118 1 8.047 . 20.68300712990 . . . . . . . . . . 8 18841 2 118 2 1.815 . 63.80903333780 . . . . . . . . . . 8 18841 2 118 3 121.295 . 15.79256845570 . . . . . . . . . . 8 18841 2 119 1 8.047 . 16.97785034070 . . . . . . . . . . 8 18841 2 119 2 1.144 . 55.91687922990 . . . . . . . . . . 8 18841 2 119 3 121.301 . 15.07847185000 . . . . . . . . . . 8 18841 2 120 1 8.665 . 17.59661464690 . . . . . . . . . . 8 18841 2 120 2 3.211 . 55.69895161740 . . . . . . . . . . 8 18841 2 120 3 120.418 . 19.04045107980 . . . . . . . . . . 8 18841 2 121 1 8.444 . 18.81519380420 . . . . . . . . . . 8 18841 2 121 2 2.700 . 59.24971313020 . . . . . . . . . . 8 18841 2 121 3 119.397 . 17.01552318840 . . . . . . . . . . 8 18841 2 122 1 8.194 . 16.92789268660 . . . . . . . . . . 8 18841 2 122 2 4.229 . 54.42055735520 . . . . . . . . . . 8 18841 2 122 3 121.362 . 20.58205792990 . . . . . . . . . . 8 18841 2 123 1 8.193 . 18.89949734540 . . . . . . . . . . 8 18841 2 123 2 2.284 . 58.60150718050 . . . . . . . . . . 8 18841 2 123 3 121.374 . 17.92471588410 . . . . . . . . . . 8 18841 2 124 1 8.194 . 17.31506450580 . . . . . . . . . . 8 18841 2 124 2 2.052 . 74.78048745040 . . . . . . . . . . 8 18841 2 124 3 121.363 . 16.77945909290 . . . . . . . . . . 8 18841 2 125 1 7.895 . 15.17560643600 . . . . . . . . . . 8 18841 2 125 2 0.988 . 70.30010165360 . . . . . . . . . . 8 18841 2 125 3 120.806 . 15.60065997350 . . . . . . . . . . 8 18841 2 126 1 7.895 . 16.41335038300 . . . . . . . . . . 8 18841 2 126 2 2.151 . 96.47200673680 . . . . . . . . . . 8 18841 2 126 3 120.866 . 19.78316371060 . . . . . . . . . . 8 18841 2 127 1 7.896 . 15.59712414230 . . . . . . . . . . 8 18841 2 127 2 3.690 . 56.57280702420 . . . . . . . . . . 8 18841 2 127 3 120.810 . 15.80691269100 . . . . . . . . . . 8 18841 2 128 1 7.895 . 12.46615737310 . . . . . . . . . . 8 18841 2 128 2 4.506 . 50.93157059870 . . . . . . . . . . 8 18841 2 128 3 120.807 . 17.94159571660 . . . . . . . . . . 8 18841 2 129 1 8.262 . 15.93412297270 . . . . . . . . . . 8 18841 2 129 2 4.048 . 55.68865582470 . . . . . . . . . . 8 18841 2 129 3 120.844 . 16.80006987550 . . . . . . . . . . 8 18841 2 130 1 8.261 . 17.60533570290 . . . . . . . . . . 8 18841 2 130 2 2.051 . 103.12008589200 . . . . . . . . . . 8 18841 2 130 3 120.842 . 17.84944487130 . . . . . . . . . . 8 18841 2 131 1 8.268 . 24.62600111280 . . . . . . . . . . 8 18841 2 131 2 2.329 . 311.68882279400 . . . . . . . . . . 8 18841 2 131 3 120.872 . 20.18697566960 . . . . . . . . . . 8 18841 2 132 1 8.260 . 13.30757777550 . . . . . . . . . . 8 18841 2 132 2 0.951 . 64.86306511710 . . . . . . . . . . 8 18841 2 132 3 120.838 . 14.25672103350 . . . . . . . . . . 8 18841 2 133 1 8.141 . 16.65430993010 . . . . . . . . . . 8 18841 2 133 2 1.896 . 69.65189570390 . . . . . . . . . . 8 18841 2 133 3 120.842 . 17.33486353920 . . . . . . . . . . 8 18841 2 134 1 8.142 . 34.18890817880 . . . . . . . . . . 8 18841 2 134 2 1.726 . 333.16756236400 . . . . . . . . . . 8 18841 2 134 3 120.842 . 16.17001020430 . . . . . . . . . . 8 18841 2 135 1 8.141 . 37.55297477800 . . . . . . . . . . 8 18841 2 135 2 4.164 . 126.08313557800 . . . . . . . . . . 8 18841 2 135 3 120.831 . 17.14722934940 . . . . . . . . . . 8 18841 2 136 1 8.145 . 12.76945632040 . . . . . . . . . . 8 18841 2 136 2 2.228 . 555.08608149600 . . . . . . . . . . 8 18841 2 136 3 120.868 . 22.17213090850 . . . . . . . . . . 8 18841 2 137 1 8.223 . 16.41808774670 . . . . . . . . . . 8 18841 2 137 2 3.695 . 48.81192427340 . . . . . . . . . . 8 18841 2 137 3 119.611 . 21.11225129590 . . . . . . . . . . 8 18841 2 138 1 8.239 . 15.28725748620 . . . . . . . . . . 8 18841 2 138 2 2.566 . 89.67120665670 . . . . . . . . . . 8 18841 2 138 3 119.788 . 14.68226668240 . . . . . . . . . . 8 18841 2 139 1 8.239 . 17.16389953530 . . . . . . . . . . 8 18841 2 139 2 2.085 . 189.34305997100 . . . . . . . . . . 8 18841 2 139 3 119.781 . 18.77609696460 . . . . . . . . . . 8 18841 2 140 1 8.138 . 15.83377699510 . . . . . . . . . . 8 18841 2 140 2 1.528 . 61.25653472710 . . . . . . . . . . 8 18841 2 140 3 122.682 . 15.94311048130 . . . . . . . . . . 8 18841 2 141 1 8.153 . 29.32029791950 . . . . . . . . . . 8 18841 2 141 2 4.127 . 87.21566009410 . . . . . . . . . . 8 18841 2 141 3 119.131 . 16.42690241930 . . . . . . . . . . 8 18841 2 142 1 8.155 . 17.25412478120 . . . . . . . . . . 8 18841 2 142 2 2.421 . 58.28705651130 . . . . . . . . . . 8 18841 2 142 3 119.110 . 15.40628833990 . . . . . . . . . . 8 18841 2 143 1 8.155 . 17.49659167130 . . . . . . . . . . 8 18841 2 143 2 2.262 . 204.48302316000 . . . . . . . . . . 8 18841 2 143 3 119.114 . 15.04768245590 . . . . . . . . . . 8 18841 2 144 1 8.155 . 17.51414145070 . . . . . . . . . . 8 18841 2 144 2 2.093 . 67.97496846540 . . . . . . . . . . 8 18841 2 144 3 119.115 . 15.38882894230 . . . . . . . . . . 8 18841 2 145 1 7.930 . 17.75779268170 . . . . . . . . . . 8 18841 2 145 2 1.813 . 73.56558390990 . . . . . . . . . . 8 18841 2 145 3 120.293 . 15.81618573210 . . . . . . . . . . 8 18841 2 146 1 7.928 . 14.46737055540 . . . . . . . . . . 8 18841 2 146 2 1.569 . 113.12201952300 . . . . . . . . . . 8 18841 2 146 3 120.282 . 13.76503252150 . . . . . . . . . . 8 18841 2 147 1 8.191 . 17.95826930220 . . . . . . . . . . 8 18841 2 147 2 4.503 . 57.53246070350 . . . . . . . . . . 8 18841 2 147 3 119.179 . 15.26023794350 . . . . . . . . . . 8 18841 2 148 1 8.191 . 17.29859140010 . . . . . . . . . . 8 18841 2 148 2 3.200 . 150.27781946900 . . . . . . . . . . 8 18841 2 148 3 119.184 . 15.60290578820 . . . . . . . . . . 8 18841 2 149 1 8.191 . 17.80861167470 . . . . . . . . . . 8 18841 2 149 2 3.063 . 69.58969195630 . . . . . . . . . . 8 18841 2 149 3 119.179 . 15.03703294780 . . . . . . . . . . 8 18841 2 150 1 8.192 . 41.12957674180 . . . . . . . . . . 8 18841 2 150 2 1.515 . 64.60652828190 . . . . . . . . . . 8 18841 2 150 3 119.178 . 14.05582929280 . . . . . . . . . . 8 18841 2 151 1 8.067 . 15.41807332610 . . . . . . . . . . 8 18841 2 151 2 1.516 . 59.69543515660 . . . . . . . . . . 8 18841 2 151 3 122.587 . 17.77848437370 . . . . . . . . . . 8 18841 2 152 1 8.067 . 15.66829226590 . . . . . . . . . . 8 18841 2 152 2 4.172 . 65.00506125830 . . . . . . . . . . 8 18841 2 152 3 122.586 . 18.63935583210 . . . . . . . . . . 8 18841 2 153 1 7.968 . 17.34628803960 . . . . . . . . . . 8 18841 2 153 2 1.898 . 76.28925007460 . . . . . . . . . . 8 18841 2 153 3 118.651 . 16.07293305590 . . . . . . . . . . 8 18841 2 154 1 8.011 . 17.38634029680 . . . . . . . . . . 8 18841 2 154 2 2.106 . 66.79481322530 . . . . . . . . . . 8 18841 2 154 3 119.276 . 15.69143435180 . . . . . . . . . . 8 18841 2 155 1 8.010 . 16.53738317930 . . . . . . . . . . 8 18841 2 155 2 2.674 . 71.58793372580 . . . . . . . . . . 8 18841 2 155 3 119.267 . 15.15461221040 . . . . . . . . . . 8 18841 2 156 1 8.012 . 16.07936623860 . . . . . . . . . . 8 18841 2 156 2 4.319 . 59.42173866690 . . . . . . . . . . 8 18841 2 156 3 119.265 . 16.37966786650 . . . . . . . . . . 8 18841 2 157 1 8.077 . 16.20361436970 . . . . . . . . . . 8 18841 2 157 2 4.185 . 140.63838353900 . . . . . . . . . . 8 18841 2 157 3 120.586 . 18.46450829650 . . . . . . . . . . 8 18841 2 158 1 8.078 . 18.52029291070 . . . . . . . . . . 8 18841 2 158 2 1.825 . 85.72963401210 . . . . . . . . . . 8 18841 2 158 3 120.571 . 19.81706826690 . . . . . . . . . . 8 18841 2 159 1 8.090 . 18.77341886930 . . . . . . . . . . 8 18841 2 159 2 1.517 . 81.16988481320 . . . . . . . . . . 8 18841 2 159 3 121.527 . 21.05632326710 . . . . . . . . . . 8 18841 2 160 1 8.288 . 28.50277967060 . . . . . . . . . . 8 18841 2 160 2 2.022 . 90.56179272660 . . . . . . . . . . 8 18841 2 160 3 121.024 . 22.77726928190 . . . . . . . . . . 8 18841 2 161 1 8.288 . 25.27857296940 . . . . . . . . . . 8 18841 2 161 2 2.315 . 64.84161554890 . . . . . . . . . . 8 18841 2 161 3 121.024 . 23.36262999760 . . . . . . . . . . 8 18841 2 162 1 8.225 . 19.03957257810 . . . . . . . . . . 8 18841 2 162 2 1.691 . 273.94873661200 . . . . . . . . . . 8 18841 2 162 3 121.074 . 21.09711015860 . . . . . . . . . . 8 18841 2 163 1 8.227 . 19.40940995270 . . . . . . . . . . 8 18841 2 163 2 1.844 . 123.44097777300 . . . . . . . . . . 8 18841 2 163 3 121.033 . 23.75506799220 . . . . . . . . . . 8 18841 2 164 1 8.232 . 14.83645425840 . . . . . . . . . . 8 18841 2 164 2 3.931 . 69.17657327360 . . . . . . . . . . 8 18841 2 164 3 116.503 . 21.49657537960 . . . . . . . . . . 8 18841 2 165 1 8.383 . 9.01294220151 . . . . . . . . . . 8 18841 2 165 2 2.542 . 61.98539105310 . . . . . . . . . . 8 18841 2 165 3 120.262 . 16.42885845140 . . . . . . . . . . 8 18841 2 166 1 8.288 . 9.76424502530 . . . . . . . . . . 8 18841 2 166 2 2.126 . 108.01916725900 . . . . . . . . . . 8 18841 2 166 3 116.219 . 13.54972409980 . . . . . . . . . . 8 18841 2 167 1 8.281 . 17.31721785300 . . . . . . . . . . 8 18841 2 167 2 4.206 . 44.51042787510 . . . . . . . . . . 8 18841 2 167 3 116.188 . 11.82131618480 . . . . . . . . . . 8 18841 2 168 1 8.209 . 19.86710389140 . . . . . . . . . . 8 18841 2 168 2 4.330 . 113.18551024500 . . . . . . . . . . 8 18841 2 168 3 120.374 . 21.79461671430 . . . . . . . . . . 8 18841 2 169 1 7.891 . 20.19710434350 . . . . . . . . . . 8 18841 2 169 2 3.986 . 94.08509879220 . . . . . . . . . . 8 18841 2 169 3 119.262 . 17.19779640140 . . . . . . . . . . 8 18841 2 170 1 7.889 . 29.62241252590 . . . . . . . . . . 8 18841 2 170 2 4.052 . 97.38275540070 . . . . . . . . . . 8 18841 2 170 3 119.262 . 18.14292213110 . . . . . . . . . . 8 18841 2 171 1 7.889 . 34.41285628330 . . . . . . . . . . 8 18841 2 171 2 1.495 . 154.16619718400 . . . . . . . . . . 8 18841 2 171 3 119.262 . 18.12075376730 . . . . . . . . . . 8 18841 2 172 1 7.889 . 30.39406448040 . . . . . . . . . . 8 18841 2 172 2 1.609 . 180.72719743400 . . . . . . . . . . 8 18841 2 172 3 119.262 . 19.04660895870 . . . . . . . . . . 8 18841 2 173 1 8.166 . 13.79272689040 . . . . . . . . . . 8 18841 2 173 2 0.910 . 72.52570884570 . . . . . . . . . . 8 18841 2 173 3 117.585 . 16.46471903980 . . . . . . . . . . 8 18841 2 174 1 8.350 . 14.39846344630 . . . . . . . . . . 8 18841 2 174 2 4.323 . 117.53162174500 . . . . . . . . . . 8 18841 2 174 3 124.236 . 15.42421863410 . . . . . . . . . . 8 18841 2 175 1 8.349 . 14.63608530530 . . . . . . . . . . 8 18841 2 175 2 4.398 . 66.51511085660 . . . . . . . . . . 8 18841 2 175 3 124.275 . 15.52857656860 . . . . . . . . . . 8 18841 2 176 1 8.141 . 17.31086547890 . . . . . . . . . . 8 18841 2 176 2 4.162 . 100.67869604400 . . . . . . . . . . 8 18841 2 176 3 122.714 . 18.56249101530 . . . . . . . . . . 8 18841 2 177 1 8.142 . 16.52693944560 . . . . . . . . . . 8 18841 2 177 2 4.227 . 86.10285649800 . . . . . . . . . . 8 18841 2 177 3 122.714 . 15.12393148480 . . . . . . . . . . 8 18841 2 178 1 7.932 . 18.61719353290 . . . . . . . . . . 8 18841 2 178 2 4.159 . 103.99951818600 . . . . . . . . . . 8 18841 2 178 3 120.358 . 17.01740677490 . . . . . . . . . . 8 18841 2 179 1 7.932 . 19.53118173450 . . . . . . . . . . 8 18841 2 179 2 4.090 . 96.39650425680 . . . . . . . . . . 8 18841 2 179 3 120.358 . 17.54140603930 . . . . . . . . . . 8 18841 2 180 1 8.229 . 19.93224264290 . . . . . . . . . . 8 18841 2 180 2 4.440 . 109.72998481500 . . . . . . . . . . 8 18841 2 180 3 123.396 . 18.08760989020 . . . . . . . . . . 8 18841 2 181 1 8.282 . 16.08001224280 . . . . . . . . . . 8 18841 2 181 2 2.652 . 82.82493349220 . . . . . . . . . . 8 18841 2 181 3 120.410 . 32.03850168340 . . . . . . . . . . 8 18841 2 182 1 8.282 . 16.87599702010 . . . . . . . . . . 8 18841 2 182 2 2.738 . 119.69588317200 . . . . . . . . . . 8 18841 2 182 3 120.410 . 34.27866555090 . . . . . . . . . . 8 18841 2 183 1 8.283 . 16.07322919920 . . . . . . . . . . 8 18841 2 183 2 4.577 . 60.22481049870 . . . . . . . . . . 8 18841 2 183 3 120.410 . 31.00839722610 . . . . . . . . . . 8 18841 2 184 1 8.291 . 25.60415905980 . . . . . . . . . . 8 18841 2 184 2 4.577 . 78.11975622120 . . . . . . . . . . 8 18841 2 184 3 120.715 . 24.08360893840 . . . . . . . . . . 8 18841 2 185 1 8.292 . 24.80548259850 . . . . . . . . . . 8 18841 2 185 2 2.652 . 79.77265994340 . . . . . . . . . . 8 18841 2 185 3 120.715 . 21.95551846540 . . . . . . . . . . 8 18841 2 186 1 8.292 . 23.01712778300 . . . . . . . . . . 8 18841 2 186 2 2.709 . 72.62180291100 . . . . . . . . . . 8 18841 2 186 3 120.715 . 19.41608168760 . . . . . . . . . . 8 18841 2 187 1 8.174 . 13.68215251380 . . . . . . . . . . 8 18841 2 187 2 4.520 . 59.74863008560 . . . . . . . . . . 8 18841 2 187 3 120.883 . 15.31942602580 . . . . . . . . . . 8 18841 2 188 1 8.307 . 17.72710748470 . . . . . . . . . . 8 18841 2 188 2 4.161 . 55.69423271240 . . . . . . . . . . 8 18841 2 188 3 118.050 . 14.57606138430 . . . . . . . . . . 8 18841 2 189 1 8.309 . 13.95702727870 . . . . . . . . . . 8 18841 2 189 2 1.817 . 60.14158617420 . . . . . . . . . . 8 18841 2 189 3 118.051 . 15.48300826530 . . . . . . . . . . 8 18841 2 190 1 6.943 . 12.44613124450 . . . . . . . . . . 8 18841 2 190 2 2.774 . 90.98091728840 . . . . . . . . . . 8 18841 2 190 3 113.637 . 14.40508969010 . . . . . . . . . . 8 18841 2 191 1 7.743 . 12.73747911510 . . . . . . . . . . 8 18841 2 191 2 2.780 . 78.86448522760 . . . . . . . . . . 8 18841 2 191 3 113.584 . 15.10585629930 . . . . . . . . . . 8 18841 2 192 1 8.023 . 20.99621147420 . . . . . . . . . . 8 18841 2 192 2 4.683 . 103.04351093300 . . . . . . . . . . 8 18841 2 192 3 121.125 . 13.46025374290 . . . . . . . . . . 8 18841 2 193 1 8.179 . 16.70028389190 . . . . . . . . . . 8 18841 2 193 2 4.258 . 68.84196001030 . . . . . . . . . . 8 18841 2 193 3 124.224 . 22.48314001150 . . . . . . . . . . 8 18841 2 194 1 8.174 . 10.25919186980 . . . . . . . . . . 8 18841 2 194 2 1.793 . 94.08853072310 . . . . . . . . . . 8 18841 2 194 3 124.152 . 16.70063824410 . . . . . . . . . . 8 18841 2 195 1 8.057 . 17.89969825950 . . . . . . . . . . 8 18841 2 195 2 1.396 . 56.99064461190 . . . . . . . . . . 8 18841 2 195 3 120.746 . 16.40842878290 . . . . . . . . . . 8 18841 2 196 1 8.060 . 21.23361799850 . . . . . . . . . . 8 18841 2 196 2 4.309 . 67.86900759870 . . . . . . . . . . 8 18841 2 196 3 120.755 . 17.60798357610 . . . . . . . . . . 8 18841 2 197 1 8.177 . 15.69596277690 . . . . . . . . . . 8 18841 2 197 2 4.357 . 59.78552334280 . . . . . . . . . . 8 18841 2 197 3 117.579 . 15.57805693600 . . . . . . . . . . 8 18841 2 198 1 8.180 . 15.21070599470 . . . . . . . . . . 8 18841 2 198 2 1.598 . 81.41569686420 . . . . . . . . . . 8 18841 2 198 3 117.540 . 14.88228907550 . . . . . . . . . . 8 18841 2 199 1 8.180 . 16.01562716270 . . . . . . . . . . 8 18841 2 199 2 1.649 . 87.96210506590 . . . . . . . . . . 8 18841 2 199 3 117.540 . 15.32623591530 . . . . . . . . . . 8 18841 2 200 1 8.384 . 17.70159032090 . . . . . . . . . . 8 18841 2 200 2 1.913 . 136.49132403100 . . . . . . . . . . 8 18841 2 200 3 120.297 . 17.45106633480 . . . . . . . . . . 8 18841 2 201 1 8.377 . 16.19683132610 . . . . . . . . . . 8 18841 2 201 2 4.445 . 56.33643278310 . . . . . . . . . . 8 18841 2 201 3 120.256 . 15.17547655270 . . . . . . . . . . 8 18841 2 202 1 8.051 . 16.51251201960 . . . . . . . . . . 8 18841 2 202 2 4.449 . 57.64013753570 . . . . . . . . . . 8 18841 2 202 3 120.989 . 25.48742419420 . . . . . . . . . . 8 18841 2 203 1 8.051 . 17.53255256890 . . . . . . . . . . 8 18841 2 203 2 2.019 . 76.33944206410 . . . . . . . . . . 8 18841 2 203 3 120.989 . 19.45962151310 . . . . . . . . . . 8 18841 2 204 1 8.051 . 17.42768456220 . . . . . . . . . . 8 18841 2 204 2 2.055 . 68.95692969560 . . . . . . . . . . 8 18841 2 204 3 120.989 . 18.93736094390 . . . . . . . . . . 8 18841 2 205 1 8.331 . 15.15148894780 . . . . . . . . . . 8 18841 2 205 2 2.058 . 59.90950184680 . . . . . . . . . . 8 18841 2 205 3 118.991 . 17.11890310690 . . . . . . . . . . 8 18841 2 206 1 8.331 . 16.84401981480 . . . . . . . . . . 8 18841 2 206 2 4.121 . 57.53074473810 . . . . . . . . . . 8 18841 2 206 3 119.011 . 15.52480939570 . . . . . . . . . . 8 18841 2 207 1 8.354 . 19.91135517550 . . . . . . . . . . 8 18841 2 207 2 3.786 . 88.06892391540 . . . . . . . . . . 8 18841 2 207 3 122.710 . 18.60871132920 . . . . . . . . . . 8 18841 2 208 1 8.354 . 21.23458700470 . . . . . . . . . . 8 18841 2 208 2 3.851 . 87.27872182440 . . . . . . . . . . 8 18841 2 208 3 122.710 . 16.61500750570 . . . . . . . . . . 8 18841 2 209 1 8.354 . 27.44742422800 . . . . . . . . . . 8 18841 2 209 2 4.418 . 61.60959461890 . . . . . . . . . . 8 18841 2 209 3 122.710 . 20.17288499400 . . . . . . . . . . 8 18841 2 210 1 8.101 . 17.28911667260 . . . . . . . . . . 8 18841 2 210 2 4.181 . 59.09870817040 . . . . . . . . . . 8 18841 2 210 3 119.366 . 15.84132436680 . . . . . . . . . . 8 18841 2 211 1 8.102 . 19.26696603810 . . . . . . . . . . 8 18841 2 211 2 1.804 . 113.85559475400 . . . . . . . . . . 8 18841 2 211 3 119.339 . 18.15147071580 . . . . . . . . . . 8 18841 2 212 1 8.102 . 20.96735662230 . . . . . . . . . . 8 18841 2 212 2 1.868 . 99.28919301860 . . . . . . . . . . 8 18841 2 212 3 119.339 . 19.26901705230 . . . . . . . . . . 8 18841 2 213 1 8.455 . 19.89628174540 . . . . . . . . . . 8 18841 2 213 2 2.927 . 55.46214838500 . . . . . . . . . . 8 18841 2 213 3 121.448 . 16.01461432120 . . . . . . . . . . 8 18841 2 214 1 8.457 . 17.06527623540 . . . . . . . . . . 8 18841 2 214 2 3.200 . 51.67973153610 . . . . . . . . . . 8 18841 2 214 3 121.468 . 18.47131818600 . . . . . . . . . . 8 18841 2 215 1 8.457 . 19.89972710080 . . . . . . . . . . 8 18841 2 215 2 4.611 . 56.24891854500 . . . . . . . . . . 8 18841 2 215 3 121.463 . 15.28305831790 . . . . . . . . . . 8 18841 2 216 1 7.928 . 19.11612406960 . . . . . . . . . . 8 18841 2 216 2 4.275 . 68.72055545450 . . . . . . . . . . 8 18841 2 216 3 112.308 . 19.29727084930 . . . . . . . . . . 8 18841 2 217 1 7.935 . 20.20065736630 . . . . . . . . . . 8 18841 2 217 2 2.119 . 100.21238243200 . . . . . . . . . . 8 18841 2 217 3 112.355 . 21.15926851180 . . . . . . . . . . 8 18841 2 218 1 7.935 . 19.70678719540 . . . . . . . . . . 8 18841 2 218 2 2.071 . 103.47915166200 . . . . . . . . . . 8 18841 2 218 3 112.355 . 22.62730682140 . . . . . . . . . . 8 18841 2 219 1 8.324 . 19.57640202490 . . . . . . . . . . 8 18841 2 219 2 4.371 . 123.49760463300 . . . . . . . . . . 8 18841 2 219 3 122.902 . 19.59705087910 . . . . . . . . . . 8 18841 2 220 1 8.324 . 19.53699577190 . . . . . . . . . . 8 18841 2 220 2 4.474 . 90.63686621520 . . . . . . . . . . 8 18841 2 220 3 122.902 . 18.00389896110 . . . . . . . . . . 8 18841 2 221 1 8.447 . 16.15204170520 . . . . . . . . . . 8 18841 2 221 2 4.116 . 94.15931429800 . . . . . . . . . . 8 18841 2 221 3 123.217 . 17.60562909300 . . . . . . . . . . 8 18841 2 222 1 8.444 . 14.37940632390 . . . . . . . . . . 8 18841 2 222 2 1.878 . 162.99612641200 . . . . . . . . . . 8 18841 2 222 3 123.184 . 16.64539844880 . . . . . . . . . . 8 18841 2 223 1 8.184 . 36.91967537850 . . . . . . . . . . 8 18841 2 223 2 2.014 . 144.99607780500 . . . . . . . . . . 8 18841 2 223 3 120.549 . 18.67445574130 . . . . . . . . . . 8 18841 2 224 1 8.180 . 17.95956131050 . . . . . . . . . . 8 18841 2 224 2 4.191 . 63.12736606180 . . . . . . . . . . 8 18841 2 224 3 120.567 . 20.69025548290 . . . . . . . . . . 8 18841 2 225 1 6.947 . 15.35078122730 . . . . . . . . . . 8 18841 2 225 2 2.414 . 62.97593211060 . . . . . . . . . . 8 18841 2 225 3 112.279 . 12.72601725120 . . . . . . . . . . 8 18841 2 226 1 7.542 . 11.12505276250 . . . . . . . . . . 8 18841 2 226 2 2.407 . 60.08367234020 . . . . . . . . . . 8 18841 2 226 3 112.277 . 14.66190945950 . . . . . . . . . . 8 18841 2 227 1 8.177 . 24.85867027340 . . . . . . . . . . 8 18841 2 227 2 2.081 . 116.19231070900 . . . . . . . . . . 8 18841 2 227 3 121.837 . 15.16200166500 . . . . . . . . . . 8 18841 2 228 1 8.177 . 29.01150793690 . . . . . . . . . . 8 18841 2 228 2 2.141 . 124.34185963500 . . . . . . . . . . 8 18841 2 228 3 121.837 . 19.31755562650 . . . . . . . . . . 8 18841 2 229 1 8.171 . 25.94288056790 . . . . . . . . . . 8 18841 2 229 2 4.203 . 65.25001532660 . . . . . . . . . . 8 18841 2 229 3 121.813 . 18.14904378710 . . . . . . . . . . 8 18841 2 230 1 8.584 . 15.57774401790 . . . . . . . . . . 8 18841 2 230 2 3.793 . 60.47319649790 . . . . . . . . . . 8 18841 2 230 3 118.877 . 15.45671050050 . . . . . . . . . . 8 18841 2 231 1 8.584 . 14.30156282410 . . . . . . . . . . 8 18841 2 231 2 2.073 . 103.51733189400 . . . . . . . . . . 8 18841 2 231 3 118.873 . 14.07017352820 . . . . . . . . . . 8 18841 2 232 1 8.582 . 16.20673672310 . . . . . . . . . . 8 18841 2 232 2 1.916 . 213.70934040700 . . . . . . . . . . 8 18841 2 232 3 118.864 . 16.81137139430 . . . . . . . . . . 8 18841 2 233 1 7.681 . 13.61798276850 . . . . . . . . . . 8 18841 2 233 2 2.870 . 67.68840223480 . . . . . . . . . . 8 18841 2 233 3 112.691 . 17.76004696000 . . . . . . . . . . 8 18841 2 234 1 8.283 . 19.31132498960 . . . . . . . . . . 8 18841 2 234 2 2.861 . 61.20419778080 . . . . . . . . . . 8 18841 2 234 3 116.195 . 15.24328566530 . . . . . . . . . . 8 18841 2 235 1 8.287 . 21.14156240740 . . . . . . . . . . 8 18841 2 235 2 4.653 . 147.15476234500 . . . . . . . . . . 8 18841 2 235 3 116.219 . 18.83274944970 . . . . . . . . . . 8 18841 2 236 1 8.238 . 18.91004874650 . . . . . . . . . . 8 18841 2 236 2 4.375 . 97.59038722050 . . . . . . . . . . 8 18841 2 236 3 123.688 . 19.30712345540 . . . . . . . . . . 8 18841 2 237 1 8.238 . 19.92868962010 . . . . . . . . . . 8 18841 2 237 2 3.993 . 80.47920871850 . . . . . . . . . . 8 18841 2 237 3 123.688 . 20.95058886560 . . . . . . . . . . 8 18841 2 238 1 8.238 . 19.56606595850 . . . . . . . . . . 8 18841 2 238 2 3.966 . 68.52150346200 . . . . . . . . . . 8 18841 2 238 3 123.688 . 18.33080988060 . . . . . . . . . . 8 18841 2 239 1 8.318 . 15.61715027090 . . . . . . . . . . 8 18841 2 239 2 4.293 . 149.23579944800 . . . . . . . . . . 8 18841 2 239 3 118.208 . 19.42636896750 . . . . . . . . . . 8 18841 2 240 1 8.317 . 16.67153670730 . . . . . . . . . . 8 18841 2 240 2 2.973 . 207.30836027700 . . . . . . . . . . 8 18841 2 240 3 118.187 . 16.57382216330 . . . . . . . . . . 8 18841 2 241 1 8.211 . 18.25058617910 . . . . . . . . . . 8 18841 2 241 2 4.427 . 85.37357118070 . . . . . . . . . . 8 18841 2 241 3 120.475 . 22.28645011750 . . . . . . . . . . 8 18841 2 242 1 8.211 . 28.74083219900 . . . . . . . . . . 8 18841 2 242 2 2.713 . 139.08243186400 . . . . . . . . . . 8 18841 2 242 3 120.514 . 21.68732473160 . . . . . . . . . . 8 18841 2 243 1 8.209 . 15.65817153430 . . . . . . . . . . 8 18841 2 243 2 2.843 . 60.74903794440 . . . . . . . . . . 8 18841 2 243 3 120.512 . 15.91319043480 . . . . . . . . . . 8 18841 2 244 1 8.029 . 16.88213405950 . . . . . . . . . . 8 18841 2 244 2 2.074 . 60.76748457310 . . . . . . . . . . 8 18841 2 244 3 122.282 . 19.60219451910 . . . . . . . . . . 8 18841 2 245 1 8.032 . 16.65172591350 . . . . . . . . . . 8 18841 2 245 2 4.057 . 59.54743313630 . . . . . . . . . . 8 18841 2 245 3 122.311 . 21.22142686500 . . . . . . . . . . 8 18841 2 246 1 8.204 . 23.98538033300 . . . . . . . . . . 8 18841 2 246 2 3.474 . 63.69277667840 . . . . . . . . . . 8 18841 2 246 3 120.309 . 14.60858947360 . . . . . . . . . . 8 18841 2 247 1 8.204 . 20.19656600670 . . . . . . . . . . 8 18841 2 247 2 3.272 . 56.64101665090 . . . . . . . . . . 8 18841 2 247 3 120.288 . 13.85001124910 . . . . . . . . . . 8 18841 2 248 1 8.207 . 21.39727238260 . . . . . . . . . . 8 18841 2 248 2 4.314 . 105.95872174100 . . . . . . . . . . 8 18841 2 248 3 120.246 . 23.07422393210 . . . . . . . . . . 8 18841 2 249 1 7.818 . 16.69005549290 . . . . . . . . . . 8 18841 2 249 2 3.655 . 55.67149617020 . . . . . . . . . . 8 18841 2 249 3 118.299 . 18.26644193560 . . . . . . . . . . 8 18841 2 250 1 7.818 . 17.01338056880 . . . . . . . . . . 8 18841 2 250 2 1.499 . 113.02249352700 . . . . . . . . . . 8 18841 2 250 3 118.293 . 17.27306741420 . . . . . . . . . . 8 18841 2 251 1 7.751 . 17.01294989940 . . . . . . . . . . 8 18841 2 251 2 1.832 . 61.84982978230 . . . . . . . . . . 8 18841 2 251 3 121.973 . 17.55495337270 . . . . . . . . . . 8 18841 2 252 1 7.750 . 15.33850714850 . . . . . . . . . . 8 18841 2 252 2 4.018 . 66.41000797260 . . . . . . . . . . 8 18841 2 252 3 121.980 . 15.03855430610 . . . . . . . . . . 8 18841 2 253 1 7.862 . 19.60234985810 . . . . . . . . . . 8 18841 2 253 2 4.188 . 63.63271788760 . . . . . . . . . . 8 18841 2 253 3 119.382 . 17.04652991940 . . . . . . . . . . 8 18841 2 254 1 7.866 . 25.65659306310 . . . . . . . . . . 8 18841 2 254 2 1.401 . 160.47108324800 . . . . . . . . . . 8 18841 2 254 3 119.354 . 18.40075613940 . . . . . . . . . . 8 18841 2 255 1 8.116 . 16.21416577080 . . . . . . . . . . 8 18841 2 255 2 3.974 . 63.91370723040 . . . . . . . . . . 8 18841 2 255 3 125.521 . 18.18034030060 . . . . . . . . . . 8 18841 2 256 1 8.115 . 14.87844452800 . . . . . . . . . . 8 18841 2 256 2 2.086 . 55.15198762940 . . . . . . . . . . 8 18841 2 256 3 125.518 . 15.55175917120 . . . . . . . . . . 8 18841 2 257 1 8.007 . 16.55256427680 . . . . . . . . . . 8 18841 2 257 2 1.432 . 59.10299808400 . . . . . . . . . . 8 18841 2 257 3 112.472 . 16.53919315060 . . . . . . . . . . 8 18841 2 258 1 8.007 . 17.40539741910 . . . . . . . . . . 8 18841 2 258 2 4.299 . 62.04845278340 . . . . . . . . . . 8 18841 2 258 3 112.473 . 16.91149125930 . . . . . . . . . . 8 18841 2 259 1 8.160 . 23.61091326210 . . . . . . . . . . 8 18841 2 259 2 4.273 . 88.98482047570 . . . . . . . . . . 8 18841 2 259 3 117.677 . 18.80167027310 . . . . . . . . . . 8 18841 2 260 1 8.160 . 26.40412752940 . . . . . . . . . . 8 18841 2 260 2 4.304 . 76.40421975990 . . . . . . . . . . 8 18841 2 260 3 117.677 . 21.89770685020 . . . . . . . . . . 8 18841 2 261 1 8.135 . 15.51615828920 . . . . . . . . . . 8 18841 2 261 2 3.924 . 53.66896448700 . . . . . . . . . . 8 18841 2 261 3 123.521 . 17.01045199410 . . . . . . . . . . 8 18841 2 262 1 8.133 . 17.56786746230 . . . . . . . . . . 8 18841 2 262 2 4.474 . 56.68348679590 . . . . . . . . . . 8 18841 2 262 3 123.558 . 15.37129709910 . . . . . . . . . . 8 18841 2 263 1 8.028 . 15.26034064670 . . . . . . . . . . 8 18841 2 263 2 4.278 . 67.73902321560 . . . . . . . . . . 8 18841 2 263 3 123.394 . 15.29435983670 . . . . . . . . . . 8 18841 2 264 1 8.028 . 15.15751831980 . . . . . . . . . . 8 18841 2 264 2 4.321 . 68.02859238580 . . . . . . . . . . 8 18841 2 264 3 123.394 . 15.25060267430 . . . . . . . . . . 8 18841 2 265 1 8.030 . 13.21993654610 . . . . . . . . . . 8 18841 2 265 2 1.595 . 84.03082821400 . . . . . . . . . . 8 18841 2 265 3 123.394 . 14.95716163730 . . . . . . . . . . 8 18841 2 266 1 8.031 . 16.78458743320 . . . . . . . . . . 8 18841 2 266 2 1.661 . 74.63720433510 . . . . . . . . . . 8 18841 2 266 3 123.394 . 17.02696959850 . . . . . . . . . . 8 18841 2 267 1 8.028 . 24.18628762290 . . . . . . . . . . 8 18841 2 267 2 1.371 . 54.61446145140 . . . . . . . . . . 8 18841 2 267 3 120.623 . 15.83900610650 . . . . . . . . . . 8 18841 2 268 1 8.036 . 37.05210622880 . . . . . . . . . . 8 18841 2 268 2 4.296 . 57.74867235060 . . . . . . . . . . 8 18841 2 268 3 120.665 . 15.96064232450 . . . . . . . . . . 8 18841 2 269 1 8.356 . 14.81319810910 . . . . . . . . . . 8 18841 2 269 2 4.451 . 60.40241292300 . . . . . . . . . . 8 18841 2 269 3 122.241 . 15.59888505550 . . . . . . . . . . 8 18841 2 270 1 8.355 . 13.55607403760 . . . . . . . . . . 8 18841 2 270 2 1.965 . 247.29979313300 . . . . . . . . . . 8 18841 2 270 3 122.234 . 16.19964046820 . . . . . . . . . . 8 18841 2 271 1 8.355 . 14.56362517340 . . . . . . . . . . 8 18841 2 271 2 2.260 . 46.04535897240 . . . . . . . . . . 8 18841 2 271 3 122.242 . 16.53198481010 . . . . . . . . . . 8 18841 2 272 1 8.348 . 14.22038163620 . . . . . . . . . . 8 18841 2 272 2 1.901 . 92.70589155970 . . . . . . . . . . 8 18841 2 272 3 124.282 . 17.08470876810 . . . . . . . . . . 8 18841 2 273 1 8.349 . 17.15571681610 . . . . . . . . . . 8 18841 2 273 2 2.270 . 56.30168448270 . . . . . . . . . . 8 18841 2 273 3 124.287 . 18.51717627180 . . . . . . . . . . 8 18841 2 274 1 8.047 . 17.58617091310 . . . . . . . . . . 8 18841 2 274 2 4.308 . 61.55725767260 . . . . . . . . . . 8 18841 2 274 3 121.294 . 15.92449195360 . . . . . . . . . . 8 18841 2 275 1 8.047 . 17.20265978410 . . . . . . . . . . 8 18841 2 275 2 1.365 . 118.92713065000 . . . . . . . . . . 8 18841 2 275 3 121.292 . 16.06174020560 . . . . . . . . . . 8 18841 2 276 1 8.659 . 19.56821930570 . . . . . . . . . . 8 18841 2 276 2 4.417 . 62.51905630880 . . . . . . . . . . 8 18841 2 276 3 120.362 . 15.53922607670 . . . . . . . . . . 8 18841 2 277 1 8.443 . 18.33187503430 . . . . . . . . . . 8 18841 2 277 2 4.511 . 60.29773903040 . . . . . . . . . . 8 18841 2 277 3 119.391 . 19.87842971820 . . . . . . . . . . 8 18841 2 278 1 8.445 . 14.85346570100 . . . . . . . . . . 8 18841 2 278 2 3.216 . 56.34544160170 . . . . . . . . . . 8 18841 2 278 3 119.397 . 14.70682575210 . . . . . . . . . . 8 18841 2 279 1 8.194 . 17.77286611180 . . . . . . . . . . 8 18841 2 279 2 2.701 . 59.96870265490 . . . . . . . . . . 8 18841 2 279 3 121.369 . 16.49058213080 . . . . . . . . . . 8 18841 2 280 1 8.193 . 17.85964600230 . . . . . . . . . . 8 18841 2 280 2 4.522 . 58.14720532690 . . . . . . . . . . 8 18841 2 280 3 121.374 . 15.64970566720 . . . . . . . . . . 8 18841 2 281 1 7.895 . 14.17300799870 . . . . . . . . . . 8 18841 2 281 2 4.224 . 57.87136388040 . . . . . . . . . . 8 18841 2 281 3 120.816 . 14.82049295040 . . . . . . . . . . 8 18841 2 282 1 7.896 . 15.84282105320 . . . . . . . . . . 8 18841 2 282 2 2.062 . 133.36097405400 . . . . . . . . . . 8 18841 2 282 3 120.866 . 18.91280187430 . . . . . . . . . . 8 18841 2 283 1 7.895 . 13.03324134740 . . . . . . . . . . 8 18841 2 283 2 2.279 . 255.53385335700 . . . . . . . . . . 8 18841 2 283 3 120.816 . 16.10922831810 . . . . . . . . . . 8 18841 2 284 1 8.263 . 16.89688448750 . . . . . . . . . . 8 18841 2 284 2 2.147 . 152.65142868100 . . . . . . . . . . 8 18841 2 284 3 120.866 . 19.57647631930 . . . . . . . . . . 8 18841 2 285 1 8.261 . 16.17023748870 . . . . . . . . . . 8 18841 2 285 2 3.697 . 49.12508796850 . . . . . . . . . . 8 18841 2 285 3 120.828 . 16.56867852330 . . . . . . . . . . 8 18841 2 286 1 8.142 . 15.42722505150 . . . . . . . . . . 8 18841 2 286 2 4.052 . 119.70360501700 . . . . . . . . . . 8 18841 2 286 3 120.831 . 15.25762990070 . . . . . . . . . . 8 18841 2 287 1 8.140 . 16.08787195990 . . . . . . . . . . 8 18841 2 287 2 2.043 . 173.02465750800 . . . . . . . . . . 8 18841 2 287 3 120.824 . 17.84401144880 . . . . . . . . . . 8 18841 2 288 1 8.223 . 19.05626101860 . . . . . . . . . . 8 18841 2 288 2 1.901 . 77.78642993200 . . . . . . . . . . 8 18841 2 288 3 119.634 . 19.08855498020 . . . . . . . . . . 8 18841 2 289 1 8.223 . 17.50671240300 . . . . . . . . . . 8 18841 2 289 2 1.684 . 317.82940516600 . . . . . . . . . . 8 18841 2 289 3 119.636 . 19.99354582920 . . . . . . . . . . 8 18841 2 290 1 8.229 . 21.31103082880 . . . . . . . . . . 8 18841 2 290 2 4.181 . 87.80380725290 . . . . . . . . . . 8 18841 2 290 3 119.652 . 22.57521841120 . . . . . . . . . . 8 18841 2 291 1 8.229 . 22.35508119890 . . . . . . . . . . 8 18841 2 291 2 4.133 . 86.43232186490 . . . . . . . . . . 8 18841 2 291 3 119.652 . 22.68961006590 . . . . . . . . . . 8 18841 2 292 1 8.230 . 22.47965233210 . . . . . . . . . . 8 18841 2 292 2 1.913 . 83.55421880960 . . . . . . . . . . 8 18841 2 292 3 119.760 . 23.36197798690 . . . . . . . . . . 8 18841 2 293 1 8.241 . 22.35346618850 . . . . . . . . . . 8 18841 2 293 2 4.162 . 92.00449068090 . . . . . . . . . . 8 18841 2 293 3 119.760 . 22.43691969750 . . . . . . . . . . 8 18841 2 294 1 8.141 . 17.35888512050 . . . . . . . . . . 8 18841 2 294 2 2.018 . 134.39827517000 . . . . . . . . . . 8 18841 2 294 3 122.714 . 16.32837635830 . . . . . . . . . . 8 18841 2 295 1 8.141 . 16.13686060780 . . . . . . . . . . 8 18841 2 295 2 2.108 . 111.08345256600 . . . . . . . . . . 8 18841 2 295 3 122.714 . 16.27360745960 . . . . . . . . . . 8 18841 2 296 1 8.155 . 18.62839093810 . . . . . . . . . . 8 18841 2 296 2 1.525 . 64.39632251400 . . . . . . . . . . 8 18841 2 296 3 119.108 . 15.24958843540 . . . . . . . . . . 8 18841 2 297 1 8.158 . 18.80152004970 . . . . . . . . . . 8 18841 2 297 2 4.205 . 94.51237418990 . . . . . . . . . . 8 18841 2 297 3 119.131 . 15.41940099950 . . . . . . . . . . 8 18841 2 298 1 7.928 . 16.57571275880 . . . . . . . . . . 8 18841 2 298 2 2.086 . 69.31299252700 . . . . . . . . . . 8 18841 2 298 3 120.287 . 14.52049558370 . . . . . . . . . . 8 18841 2 299 1 8.191 . 19.06659708500 . . . . . . . . . . 8 18841 2 299 2 1.809 . 73.05036528280 . . . . . . . . . . 8 18841 2 299 3 119.181 . 16.77058450280 . . . . . . . . . . 8 18841 2 300 1 8.194 . 39.35435734390 . . . . . . . . . . 8 18841 2 300 2 4.205 . 126.17751367800 . . . . . . . . . . 8 18841 2 300 3 119.178 . 17.76424880680 . . . . . . . . . . 8 18841 2 301 1 8.194 . 41.16090794290 . . . . . . . . . . 8 18841 2 301 2 4.105 . 113.40729878000 . . . . . . . . . . 8 18841 2 301 3 119.178 . 17.15519836910 . . . . . . . . . . 8 18841 2 302 1 8.067 . 13.45540505800 . . . . . . . . . . 8 18841 2 302 2 4.498 . 58.43377155750 . . . . . . . . . . 8 18841 2 302 3 122.593 . 16.90475381540 . . . . . . . . . . 8 18841 2 303 1 8.067 . 15.02207278350 . . . . . . . . . . 8 18841 2 303 2 3.199 . 141.83355347600 . . . . . . . . . . 8 18841 2 303 3 122.595 . 22.60332731680 . . . . . . . . . . 8 18841 2 304 1 8.067 . 15.31342065410 . . . . . . . . . . 8 18841 2 304 2 3.068 . 140.67699276100 . . . . . . . . . . 8 18841 2 304 3 122.599 . 18.51210507750 . . . . . . . . . . 8 18841 2 305 1 7.967 . 17.47075150540 . . . . . . . . . . 8 18841 2 305 2 1.518 . 68.87627931930 . . . . . . . . . . 8 18841 2 305 3 118.650 . 15.02247137560 . . . . . . . . . . 8 18841 2 306 1 7.968 . 18.67253455490 . . . . . . . . . . 8 18841 2 306 2 4.171 . 66.69314227230 . . . . . . . . . . 8 18841 2 306 3 118.649 . 15.64477936410 . . . . . . . . . . 8 18841 2 307 1 8.011 . 16.92240165140 . . . . . . . . . . 8 18841 2 307 2 4.169 . 59.60320201350 . . . . . . . . . . 8 18841 2 307 3 119.275 . 15.43859909220 . . . . . . . . . . 8 18841 2 308 1 8.011 . 18.01684034490 . . . . . . . . . . 8 18841 2 308 2 1.904 . 87.32977179660 . . . . . . . . . . 8 18841 2 308 3 119.278 . 17.61616993260 . . . . . . . . . . 8 18841 2 309 1 8.078 . 16.05427974420 . . . . . . . . . . 8 18841 2 309 2 2.109 . 70.91570425980 . . . . . . . . . . 8 18841 2 309 3 120.585 . 16.81991997900 . . . . . . . . . . 8 18841 2 310 1 8.077 . 45.59497274550 . . . . . . . . . . 8 18841 2 310 2 4.321 . 142.25954190000 . . . . . . . . . . 8 18841 2 310 3 120.551 . 24.10882001870 . . . . . . . . . . 8 18841 2 311 1 8.091 . 19.58447707670 . . . . . . . . . . 8 18841 2 311 2 4.209 . 73.00789513790 . . . . . . . . . . 8 18841 2 311 3 121.509 . 17.36583404740 . . . . . . . . . . 8 18841 2 312 1 8.088 . 19.00124299870 . . . . . . . . . . 8 18841 2 312 2 1.851 . 76.52948523800 . . . . . . . . . . 8 18841 2 312 3 121.515 . 17.22764400220 . . . . . . . . . . 8 18841 2 313 1 8.288 . 19.35848329240 . . . . . . . . . . 8 18841 2 313 2 1.866 . 196.46174265100 . . . . . . . . . . 8 18841 2 313 3 121.000 . 18.71372127450 . . . . . . . . . . 8 18841 2 314 1 8.285 . 18.07670339600 . . . . . . . . . . 8 18841 2 314 2 4.242 . 62.54951469560 . . . . . . . . . . 8 18841 2 314 3 121.009 . 16.40629163670 . . . . . . . . . . 8 18841 2 315 1 8.227 . 19.13012082620 . . . . . . . . . . 8 18841 2 315 2 4.244 . 96.23477451290 . . . . . . . . . . 8 18841 2 315 3 121.085 . 20.09138365670 . . . . . . . . . . 8 18841 2 316 1 8.229 . 72.87583557070 . . . . . . . . . . 8 18841 2 316 2 2.011 . 295.75651255800 . . . . . . . . . . 8 18841 2 316 3 121.033 . 62.86415480000 . . . . . . . . . . 8 18841 2 317 1 8.229 . 59.33935699220 . . . . . . . . . . 8 18841 2 317 2 2.075 . 309.60049283800 . . . . . . . . . . 8 18841 2 317 3 121.033 . 72.83821600860 . . . . . . . . . . 8 18841 2 318 1 8.237 . 23.35606462580 . . . . . . . . . . 8 18841 2 318 2 4.328 . 62.49889371470 . . . . . . . . . . 8 18841 2 318 3 116.545 . 16.46131409500 . . . . . . . . . . 8 18841 2 319 1 8.229 . 12.71971400110 . . . . . . . . . . 8 18841 2 319 2 3.931 . 52.17221362100 . . . . . . . . . . 8 18841 2 319 3 123.430 . 57.19626202420 . . . . . . . . . . 8 18841 2 320 1 7.977 . 15.54512080840 . . . . . . . . . . 8 18841 2 320 2 4.363 . 60.69155310180 . . . . . . . . . . 8 18841 2 320 3 126.449 . 13.83621035600 . . . . . . . . . . 8 18841 2 321 1 7.980 . 14.10367022020 . . . . . . . . . . 8 18841 2 321 2 1.789 . 160.78167299500 . . . . . . . . . . 8 18841 2 321 3 126.395 . 15.01772618660 . . . . . . . . . . 8 18841 2 322 1 7.977 . 14.17430000700 . . . . . . . . . . 8 18841 2 322 2 1.927 . 66.79567120810 . . . . . . . . . . 8 18841 2 322 3 126.441 . 13.28203748540 . . . . . . . . . . 8 18841 2 323 1 7.058 . 17.79267690570 . . . . . . . . . . 8 18841 2 323 2 7.637 . 59.94425014720 . . . . . . . . . . 8 18841 2 323 3 112.544 . 15.25784723760 . . . . . . . . . . 8 18841 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 . . 8.314 . . 1 . 1 1 4 LYS H . . . . . . . . . . 118 . 18841 2 1 2 1 . . 4.540 . . 1 . 1 1 3 TYR HA . . . . . . . . . . 267 . 18841 2 1 3 1 . . 123.218 . . 1 . 1 1 4 LYS N . . . . . . . . . . 119 . 18841 2 2 1 1 . . 8.313 . . 1 . 1 1 4 LYS H . . . . . . . . . . 118 . 18841 2 2 2 1 . . 4.284 . . 1 . 1 1 4 LYS HA . . . . . . . . . . 273 . 18841 2 2 3 1 . . 123.215 . . 1 . 1 1 4 LYS N . . . . . . . . . . 119 . 18841 2 3 1 1 . . 8.015 . . 1 . 1 1 11 ARG H . . . . . . . . . . 68 . 18841 2 3 3 1 . . 121.157 . . 1 . 1 1 11 ARG N . . . . . . . . . . 69 . 18841 2 4 1 1 . . 8.355 . . 1 . 1 1 45 ARG H . . . . . . . . . . 47 . 18841 2 4 3 1 . . 122.234 . . 1 . 1 1 45 ARG N . . . . . . . . . . 48 . 18841 2 5 1 1 . . 8.177 . . 1 . 1 1 14 SER H . . . . . . . . . . 103 . 18841 2 5 2 1 . . 4.756 . . 1 . 1 1 14 SER HA . . . . . . . . . . 772 . 18841 2 5 3 1 . . 117.574 . . 1 . 1 1 14 SER N . . . . . . . . . . 104 . 18841 2 6 1 1 . . 7.978 . . 1 . 1 1 71 GLN H . . . . . . . . . . 5 . 18841 2 6 2 1 . . 4.164 . . 1 . 1 1 71 GLN HA . . . . . . . . . . 787 . 18841 2 6 3 1 . . 126.437 . . 1 . 1 1 71 GLN N . . . . . . . . . . 6 . 18841 2 9 1 1 . . 8.290 . . 1 . 1 1 3 TYR H . . . . . . . . . . 15 . 18841 2 9 3 1 . . 121.146 . . 1 . 1 1 3 TYR N . . . . . . . . . . 16 . 18841 2 10 1 1 . . 8.289 . . 1 . 1 1 3 TYR H . . . . . . . . . . 15 . 18841 2 10 3 1 . . 121.124 . . 1 . 1 1 3 TYR N . . . . . . . . . . 16 . 18841 2 11 1 1 . . 8.290 . . 1 . 1 1 3 TYR H . . . . . . . . . . 15 . 18841 2 11 3 1 . . 121.111 . . 1 . 1 1 3 TYR N . . . . . . . . . . 16 . 18841 2 12 1 1 . . 8.313 . . 1 . 1 1 4 LYS H . . . . . . . . . . 118 . 18841 2 12 3 1 . . 123.189 . . 1 . 1 1 4 LYS N . . . . . . . . . . 119 . 18841 2 13 1 1 . . 8.318 . . 1 . 1 1 4 LYS H . . . . . . . . . . 118 . 18841 2 13 3 1 . . 123.218 . . 1 . 1 1 4 LYS N . . . . . . . . . . 119 . 18841 2 14 1 1 . . 8.276 . . 1 . 1 1 5 ASP H . . . . . . . . . . 110 . 18841 2 14 3 1 . . 121.373 . . 1 . 1 1 5 ASP N . . . . . . . . . . 111 . 18841 2 15 1 1 . . 8.277 . . 1 . 1 1 5 ASP H . . . . . . . . . . 110 . 18841 2 15 3 1 . . 121.390 . . 1 . 1 1 5 ASP N . . . . . . . . . . 111 . 18841 2 16 1 1 . . 8.172 . . 1 . 1 1 9 LYS H . . . . . . . . . . 3 . 18841 2 16 3 1 . . 120.864 . . 1 . 1 1 9 LYS N . . . . . . . . . . 4 . 18841 2 17 1 1 . . 8.174 . . 1 . 1 1 9 LYS H . . . . . . . . . . 3 . 18841 2 17 3 1 . . 120.852 . . 1 . 1 1 9 LYS N . . . . . . . . . . 4 . 18841 2 18 1 1 . . 8.174 . . 1 . 1 1 9 LYS H . . . . . . . . . . 3 . 18841 2 18 3 1 . . 120.869 . . 1 . 1 1 9 LYS N . . . . . . . . . . 4 . 18841 2 19 1 1 . . 7.739 . . 1 . 1 1 10 ASN HD21 . . . . . . . . . . 58 . 18841 2 19 3 1 . . 113.584 . . 1 . 1 1 10 ASN ND2 . . . . . . . . . . 59 . 18841 2 20 1 1 . . 8.174 . . 1 . 1 1 12 ALA H . . . . . . . . . . 134 . 18841 2 20 3 1 . . 124.137 . . 1 . 1 1 12 ALA N . . . . . . . . . . 135 . 18841 2 21 1 1 . . 8.174 . . 1 . 1 1 12 ALA H . . . . . . . . . . 134 . 18841 2 21 3 1 . . 124.132 . . 1 . 1 1 12 ALA N . . . . . . . . . . 135 . 18841 2 22 1 1 . . 8.058 . . 1 . 1 1 13 LEU H . . . . . . . . . . 9 . 18841 2 22 3 1 . . 120.727 . . 1 . 1 1 13 LEU N . . . . . . . . . . 10 . 18841 2 23 1 1 . . 8.178 . . 1 . 1 1 14 SER H . . . . . . . . . . 103 . 18841 2 23 3 1 . . 117.583 . . 1 . 1 1 14 SER N . . . . . . . . . . 104 . 18841 2 24 1 1 . . 8.378 . . 1 . 1 1 16 MET H . . . . . . . . . . 7 . 18841 2 24 3 1 . . 120.249 . . 1 . 1 1 16 MET N . . . . . . . . . . 8 . 18841 2 25 1 1 . . 8.052 . . 1 . 1 1 17 VAL H . . . . . . . . . . 128 . 18841 2 25 3 1 . . 121.101 . . 1 . 1 1 17 VAL N . . . . . . . . . . 129 . 18841 2 26 1 1 . . 8.054 . . 1 . 1 1 17 VAL H . . . . . . . . . . 128 . 18841 2 26 3 1 . . 121.070 . . 1 . 1 1 17 VAL N . . . . . . . . . . 129 . 18841 2 27 1 1 . . 8.332 . . 1 . 1 1 18 SER H . . . . . . . . . . 122 . 18841 2 27 3 1 . . 119.008 . . 1 . 1 1 18 SER N . . . . . . . . . . 123 . 18841 2 28 1 1 . . 8.330 . . 1 . 1 1 18 SER H . . . . . . . . . . 122 . 18841 2 28 3 1 . . 119.005 . . 1 . 1 1 18 SER N . . . . . . . . . . 123 . 18841 2 29 1 1 . . 8.331 . . 1 . 1 1 18 SER H . . . . . . . . . . 122 . 18841 2 29 3 1 . . 118.990 . . 1 . 1 1 18 SER N . . . . . . . . . . 123 . 18841 2 30 1 1 . . 8.351 . . 1 . 1 1 19 GLU H . . . . . . . . . . 83 . 18841 2 30 3 1 . . 122.710 . . 1 . 1 1 19 GLU N . . . . . . . . . . 84 . 18841 2 31 1 1 . . 8.351 . . 1 . 1 1 19 GLU H . . . . . . . . . . 83 . 18841 2 31 3 1 . . 122.710 . . 1 . 1 1 19 GLU N . . . . . . . . . . 84 . 18841 2 32 1 1 . . 8.348 . . 1 . 1 1 19 GLU H . . . . . . . . . . 83 . 18841 2 32 3 1 . . 122.723 . . 1 . 1 1 19 GLU N . . . . . . . . . . 84 . 18841 2 33 1 1 . . 8.103 . . 1 . 1 1 20 PHE H . . . . . . . . . . 53 . 18841 2 33 3 1 . . 119.374 . . 1 . 1 1 20 PHE N . . . . . . . . . . 54 . 18841 2 34 1 1 . . 8.101 . . 1 . 1 1 20 PHE H . . . . . . . . . . 53 . 18841 2 34 3 1 . . 119.365 . . 1 . 1 1 20 PHE N . . . . . . . . . . 54 . 18841 2 35 1 1 . . 8.100 . . 1 . 1 1 20 PHE H . . . . . . . . . . 53 . 18841 2 35 3 1 . . 119.389 . . 1 . 1 1 20 PHE N . . . . . . . . . . 54 . 18841 2 36 1 1 . . 8.100 . . 1 . 1 1 20 PHE H . . . . . . . . . . 53 . 18841 2 36 3 1 . . 119.342 . . 1 . 1 1 20 PHE N . . . . . . . . . . 54 . 18841 2 37 1 1 . . 8.457 . . 1 . 1 1 21 GLU H . . . . . . . . . . 33 . 18841 2 37 3 1 . . 121.479 . . 1 . 1 1 21 GLU N . . . . . . . . . . 34 . 18841 2 38 1 1 . . 8.457 . . 1 . 1 1 21 GLU H . . . . . . . . . . 33 . 18841 2 38 3 1 . . 121.491 . . 1 . 1 1 21 GLU N . . . . . . . . . . 34 . 18841 2 39 1 1 . . 8.455 . . 1 . 1 1 21 GLU H . . . . . . . . . . 33 . 18841 2 39 3 1 . . 121.469 . . 1 . 1 1 21 GLU N . . . . . . . . . . 34 . 18841 2 40 1 1 . . 7.929 . . 1 . 1 1 22 THR H . . . . . . . . . . 13 . 18841 2 40 3 1 . . 112.284 . . 1 . 1 1 22 THR N . . . . . . . . . . 14 . 18841 2 41 1 1 . . 7.926 . . 1 . 1 1 22 THR H . . . . . . . . . . 13 . 18841 2 41 3 1 . . 112.269 . . 1 . 1 1 22 THR N . . . . . . . . . . 14 . 18841 2 42 1 1 . . 8.326 . . 1 . 1 1 23 ILE H . . . . . . . . . . 45 . 18841 2 42 3 1 . . 122.865 . . 1 . 1 1 23 ILE N . . . . . . . . . . 46 . 18841 2 43 1 1 . . 8.326 . . 1 . 1 1 23 ILE H . . . . . . . . . . 45 . 18841 2 43 3 1 . . 122.857 . . 1 . 1 1 23 ILE N . . . . . . . . . . 46 . 18841 2 44 1 1 . . 8.326 . . 1 . 1 1 23 ILE H . . . . . . . . . . 45 . 18841 2 44 3 1 . . 122.871 . . 1 . 1 1 23 ILE N . . . . . . . . . . 46 . 18841 2 45 1 1 . . 8.326 . . 1 . 1 1 23 ILE H . . . . . . . . . . 45 . 18841 2 45 3 1 . . 122.862 . . 1 . 1 1 23 ILE N . . . . . . . . . . 46 . 18841 2 46 1 1 . . 8.325 . . 1 . 1 1 23 ILE H . . . . . . . . . . 45 . 18841 2 46 3 1 . . 122.849 . . 1 . 1 1 23 ILE N . . . . . . . . . . 46 . 18841 2 47 1 1 . . 8.444 . . 1 . 1 1 24 GLU H . . . . . . . . . . 35 . 18841 2 47 3 1 . . 123.217 . . 1 . 1 1 24 GLU N . . . . . . . . . . 36 . 18841 2 48 1 1 . . 8.445 . . 1 . 1 1 24 GLU H . . . . . . . . . . 35 . 18841 2 48 3 1 . . 123.194 . . 1 . 1 1 24 GLU N . . . . . . . . . . 36 . 18841 2 49 1 1 . . 8.445 . . 1 . 1 1 24 GLU H . . . . . . . . . . 35 . 18841 2 49 3 1 . . 123.198 . . 1 . 1 1 24 GLU N . . . . . . . . . . 36 . 18841 2 50 1 1 . . 8.444 . . 1 . 1 1 24 GLU H . . . . . . . . . . 35 . 18841 2 50 3 1 . . 123.193 . . 1 . 1 1 24 GLU N . . . . . . . . . . 36 . 18841 2 51 1 1 . . 8.448 . . 1 . 1 1 24 GLU H . . . . . . . . . . 35 . 18841 2 51 3 1 . . 123.242 . . 1 . 1 1 24 GLU N . . . . . . . . . . 36 . 18841 2 52 1 1 . . 8.446 . . 1 . 1 1 24 GLU H . . . . . . . . . . 35 . 18841 2 52 3 1 . . 123.190 . . 1 . 1 1 24 GLU N . . . . . . . . . . 36 . 18841 2 53 1 1 . . 8.179 . . 1 . 1 1 25 GLN H . . . . . . . . . . 144 . 18841 2 53 3 1 . . 120.564 . . 1 . 1 1 25 GLN N . . . . . . . . . . 145 . 18841 2 54 1 1 . . 8.180 . . 1 . 1 1 25 GLN H . . . . . . . . . . 144 . 18841 2 54 3 1 . . 120.549 . . 1 . 1 1 25 GLN N . . . . . . . . . . 145 . 18841 2 55 1 1 . . 6.949 . . 1 . 1 1 25 GLN HE22 . . . . . . . . . . 51 . 18841 2 55 3 1 . . 112.241 . . 1 . 1 1 25 GLN NE2 . . . . . . . . . . 52 . 18841 2 56 1 1 . . 7.539 . . 1 . 1 1 25 GLN HE21 . . . . . . . . . . 55 . 18841 2 56 3 1 . . 112.207 . . 1 . 1 1 25 GLN NE2 . . . . . . . . . . 52 . 18841 2 57 1 1 . . 8.164 . . 1 . 1 1 26 GLU H . . . . . . . . . . 138 . 18841 2 57 3 1 . . 121.782 . . 1 . 1 1 26 GLU N . . . . . . . . . . 139 . 18841 2 58 1 1 . . 8.170 . . 1 . 1 1 26 GLU H . . . . . . . . . . 138 . 18841 2 58 3 1 . . 121.798 . . 1 . 1 1 26 GLU N . . . . . . . . . . 139 . 18841 2 59 1 1 . . 8.585 . . 1 . 1 1 27 ASN H . . . . . . . . . . 114 . 18841 2 59 3 1 . . 118.870 . . 1 . 1 1 27 ASN N . . . . . . . . . . 115 . 18841 2 60 1 1 . . 8.582 . . 1 . 1 1 27 ASN H . . . . . . . . . . 114 . 18841 2 60 3 1 . . 118.865 . . 1 . 1 1 27 ASN N . . . . . . . . . . 115 . 18841 2 61 1 1 . . 8.584 . . 1 . 1 1 27 ASN H . . . . . . . . . . 114 . 18841 2 61 3 1 . . 118.867 . . 1 . 1 1 27 ASN N . . . . . . . . . . 115 . 18841 2 62 1 1 . . 8.584 . . 1 . 1 1 27 ASN H . . . . . . . . . . 114 . 18841 2 62 3 1 . . 118.865 . . 1 . 1 1 27 ASN N . . . . . . . . . . 115 . 18841 2 63 1 1 . . 6.921 . . 1 . 1 1 27 ASN HD21 . . . . . . . . . . 17 . 18841 2 63 3 1 . . 112.753 . . 1 . 1 1 27 ASN ND2 . . . . . . . . . . 18 . 18841 2 64 1 1 . . 6.920 . . 1 . 1 1 27 ASN HD21 . . . . . . . . . . 17 . 18841 2 64 3 1 . . 112.782 . . 1 . 1 1 27 ASN ND2 . . . . . . . . . . 18 . 18841 2 65 1 1 . . 7.682 . . 1 . 1 1 27 ASN HD22 . . . . . . . . . . 87 . 18841 2 65 3 1 . . 112.791 . . 1 . 1 1 27 ASN ND2 . . . . . . . . . . 18 . 18841 2 66 1 1 . . 7.684 . . 1 . 1 1 27 ASN HD22 . . . . . . . . . . 87 . 18841 2 66 3 1 . . 112.768 . . 1 . 1 1 27 ASN ND2 . . . . . . . . . . 18 . 18841 2 67 1 1 . . 8.284 . . 1 . 1 1 28 SER H . . . . . . . . . . 74 . 18841 2 67 3 1 . . 116.213 . . 1 . 1 1 28 SER N . . . . . . . . . . 75 . 18841 2 68 1 1 . . 8.284 . . 1 . 1 1 28 SER H . . . . . . . . . . 74 . 18841 2 68 3 1 . . 116.204 . . 1 . 1 1 28 SER N . . . . . . . . . . 75 . 18841 2 69 1 1 . . 8.233 . . 1 . 1 1 29 TYR H . . . . . . . . . . 95 . 18841 2 69 3 1 . . 123.688 . . 1 . 1 1 29 TYR N . . . . . . . . . . 96 . 18841 2 70 1 1 . . 8.231 . . 1 . 1 1 29 TYR H . . . . . . . . . . 95 . 18841 2 70 3 1 . . 123.724 . . 1 . 1 1 29 TYR N . . . . . . . . . . 96 . 18841 2 71 1 1 . . 8.317 . . 1 . 1 1 30 ASN H . . . . . . . . . . 116 . 18841 2 71 3 1 . . 118.183 . . 1 . 1 1 30 ASN N . . . . . . . . . . 117 . 18841 2 72 1 1 . . 8.315 . . 1 . 1 1 30 ASN H . . . . . . . . . . 116 . 18841 2 72 3 1 . . 118.181 . . 1 . 1 1 30 ASN N . . . . . . . . . . 117 . 18841 2 73 1 1 . . 8.315 . . 1 . 1 1 30 ASN H . . . . . . . . . . 116 . 18841 2 73 3 1 . . 118.157 . . 1 . 1 1 30 ASN N . . . . . . . . . . 117 . 18841 2 74 1 1 . . 7.059 . . 1 . 1 1 30 ASN HD22 . . . . . . . . . . 92 . 18841 2 74 3 1 . . 112.544 . . 1 . 1 1 30 ASN ND2 . . . . . . . . . . 77 . 18841 2 75 1 1 . . 7.059 . . 1 . 1 1 30 ASN HD22 . . . . . . . . . . 92 . 18841 2 75 3 1 . . 112.518 . . 1 . 1 1 30 ASN ND2 . . . . . . . . . . 77 . 18841 2 76 1 1 . . 7.059 . . 1 . 1 1 30 ASN HD22 . . . . . . . . . . 92 . 18841 2 76 3 1 . . 112.544 . . 1 . 1 1 30 ASN ND2 . . . . . . . . . . 77 . 18841 2 77 1 1 . . 7.640 . . 1 . 1 1 30 ASN HD21 . . . . . . . . . . 76 . 18841 2 77 3 1 . . 112.544 . . 1 . 1 1 30 ASN ND2 . . . . . . . . . . 77 . 18841 2 78 1 1 . . 8.209 . . 1 . 1 1 31 GLU H . . . . . . . . . . 124 . 18841 2 78 3 1 . . 120.523 . . 1 . 1 1 31 GLU N . . . . . . . . . . 125 . 18841 2 79 1 1 . . 8.209 . . 1 . 1 1 31 GLU H . . . . . . . . . . 124 . 18841 2 79 3 1 . . 120.517 . . 1 . 1 1 31 GLU N . . . . . . . . . . 125 . 18841 2 80 1 1 . . 8.210 . . 1 . 1 1 31 GLU H . . . . . . . . . . 124 . 18841 2 80 3 1 . . 120.513 . . 1 . 1 1 31 GLU N . . . . . . . . . . 125 . 18841 2 81 1 1 . . 8.030 . . 1 . 1 1 32 TRP H . . . . . . . . . . 43 . 18841 2 81 3 1 . . 122.249 . . 1 . 1 1 32 TRP N . . . . . . . . . . 44 . 18841 2 82 1 1 . . 8.027 . . 1 . 1 1 32 TRP H . . . . . . . . . . 43 . 18841 2 82 3 1 . . 122.265 . . 1 . 1 1 32 TRP N . . . . . . . . . . 44 . 18841 2 83 1 1 . . 8.030 . . 1 . 1 1 32 TRP H . . . . . . . . . . 43 . 18841 2 83 3 1 . . 122.278 . . 1 . 1 1 32 TRP N . . . . . . . . . . 44 . 18841 2 84 1 1 . . 8.029 . . 1 . 1 1 32 TRP H . . . . . . . . . . 43 . 18841 2 84 3 1 . . 122.237 . . 1 . 1 1 32 TRP N . . . . . . . . . . 44 . 18841 2 85 1 1 . . 8.030 . . 1 . 1 1 32 TRP H . . . . . . . . . . 43 . 18841 2 85 3 1 . . 122.314 . . 1 . 1 1 32 TRP N . . . . . . . . . . 44 . 18841 2 86 1 1 . . 10.175 . . 1 . 1 1 32 TRP HE1 . . . . . . . . . . 56 . 18841 2 86 3 1 . . 129.571 . . 1 . 1 1 32 TRP NE1 . . . . . . . . . . 57 . 18841 2 87 1 1 . . 10.181 . . 1 . 1 1 32 TRP HE1 . . . . . . . . . . 56 . 18841 2 87 3 1 . . 129.586 . . 1 . 1 1 32 TRP NE1 . . . . . . . . . . 57 . 18841 2 88 1 1 . . 8.209 . . 1 . 1 1 33 LEU H . . . . . . . . . . 25 . 18841 2 88 3 1 . . 120.298 . . 1 . 1 1 33 LEU N . . . . . . . . . . 26 . 18841 2 89 1 1 . . 8.205 . . 1 . 1 1 33 LEU H . . . . . . . . . . 25 . 18841 2 89 3 1 . . 120.322 . . 1 . 1 1 33 LEU N . . . . . . . . . . 26 . 18841 2 90 1 1 . . 8.204 . . 1 . 1 1 33 LEU H . . . . . . . . . . 25 . 18841 2 90 3 1 . . 120.297 . . 1 . 1 1 33 LEU N . . . . . . . . . . 26 . 18841 2 91 1 1 . . 7.817 . . 1 . 1 1 34 ARG H . . . . . . . . . . 88 . 18841 2 91 3 1 . . 118.309 . . 1 . 1 1 34 ARG N . . . . . . . . . . 89 . 18841 2 92 1 1 . . 7.818 . . 1 . 1 1 34 ARG H . . . . . . . . . . 88 . 18841 2 92 3 1 . . 118.306 . . 1 . 1 1 34 ARG N . . . . . . . . . . 89 . 18841 2 93 1 1 . . 7.750 . . 1 . 1 1 35 ALA H . . . . . . . . . . 99 . 18841 2 93 3 1 . . 121.963 . . 1 . 1 1 35 ALA N . . . . . . . . . . 100 . 18841 2 94 1 1 . . 7.751 . . 1 . 1 1 35 ALA H . . . . . . . . . . 99 . 18841 2 94 3 1 . . 121.975 . . 1 . 1 1 35 ALA N . . . . . . . . . . 100 . 18841 2 95 1 1 . . 7.749 . . 1 . 1 1 35 ALA H . . . . . . . . . . 99 . 18841 2 95 3 1 . . 122.022 . . 1 . 1 1 35 ALA N . . . . . . . . . . 100 . 18841 2 96 1 1 . . 7.868 . . 1 . 1 1 36 LYS H . . . . . . . . . . 1 . 18841 2 96 3 1 . . 119.353 . . 1 . 1 1 36 LYS N . . . . . . . . . . 2 . 18841 2 97 1 1 . . 7.866 . . 1 . 1 1 36 LYS H . . . . . . . . . . 1 . 18841 2 97 3 1 . . 119.354 . . 1 . 1 1 36 LYS N . . . . . . . . . . 2 . 18841 2 98 1 1 . . 7.862 . . 1 . 1 1 36 LYS H . . . . . . . . . . 1 . 18841 2 98 3 1 . . 119.354 . . 1 . 1 1 36 LYS N . . . . . . . . . . 2 . 18841 2 99 1 1 . . 7.861 . . 1 . 1 1 36 LYS H . . . . . . . . . . 1 . 18841 2 99 3 1 . . 119.386 . . 1 . 1 1 36 LYS N . . . . . . . . . . 2 . 18841 2 100 1 1 . . 7.888 . . 1 . 1 1 37 VAL H . . . . . . . . . . 142 . 18841 2 100 3 1 . . 119.264 . . 1 . 1 1 37 VAL N . . . . . . . . . . 143 . 18841 2 101 1 1 . . 7.889 . . 1 . 1 1 37 VAL H . . . . . . . . . . 142 . 18841 2 101 3 1 . . 119.273 . . 1 . 1 1 37 VAL N . . . . . . . . . . 143 . 18841 2 102 1 1 . . 8.116 . . 1 . 1 1 38 ALA H . . . . . . . . . . 130 . 18841 2 102 3 1 . . 125.520 . . 1 . 1 1 38 ALA N . . . . . . . . . . 131 . 18841 2 103 1 1 . . 8.116 . . 1 . 1 1 38 ALA H . . . . . . . . . . 130 . 18841 2 103 3 1 . . 125.528 . . 1 . 1 1 38 ALA N . . . . . . . . . . 131 . 18841 2 104 1 1 . . 8.117 . . 1 . 1 1 38 ALA H . . . . . . . . . . 130 . 18841 2 104 3 1 . . 125.520 . . 1 . 1 1 38 ALA N . . . . . . . . . . 131 . 18841 2 105 1 1 . . 8.009 . . 1 . 1 1 39 THR H . . . . . . . . . . 81 . 18841 2 105 3 1 . . 112.465 . . 1 . 1 1 39 THR N . . . . . . . . . . 82 . 18841 2 106 1 1 . . 8.162 . . 1 . 1 1 40 SER H . . . . . . . . . . 62 . 18841 2 106 3 1 . . 117.736 . . 1 . 1 1 40 SER N . . . . . . . . . . 63 . 18841 2 107 1 1 . . 8.161 . . 1 . 1 1 40 SER H . . . . . . . . . . 62 . 18841 2 107 3 1 . . 117.677 . . 1 . 1 1 40 SER N . . . . . . . . . . 63 . 18841 2 108 1 1 . . 8.133 . . 1 . 1 1 41 LEU H . . . . . . . . . . 108 . 18841 2 108 3 1 . . 123.563 . . 1 . 1 1 41 LEU N . . . . . . . . . . 109 . 18841 2 109 1 1 . . 8.133 . . 1 . 1 1 41 LEU H . . . . . . . . . . 108 . 18841 2 109 3 1 . . 123.555 . . 1 . 1 1 41 LEU N . . . . . . . . . . 109 . 18841 2 110 1 1 . . 8.027 . . 1 . 1 1 42 ALA H . . . . . . . . . . 112 . 18841 2 110 3 1 . . 123.389 . . 1 . 1 1 42 ALA N . . . . . . . . . . 113 . 18841 2 111 1 1 . . 8.030 . . 1 . 1 1 43 ASP H . . . . . . . . . . 120 . 18841 2 111 3 1 . . 120.605 . . 1 . 1 1 43 ASP N . . . . . . . . . . 121 . 18841 2 112 1 1 . . 8.028 . . 1 . 1 1 43 ASP H . . . . . . . . . . 120 . 18841 2 112 3 1 . . 120.605 . . 1 . 1 1 43 ASP N . . . . . . . . . . 121 . 18841 2 113 1 1 . . 8.026 . . 1 . 1 1 43 ASP H . . . . . . . . . . 120 . 18841 2 113 3 1 . . 120.612 . . 1 . 1 1 43 ASP N . . . . . . . . . . 121 . 18841 2 114 1 1 . . 8.357 . . 1 . 1 1 45 ARG H . . . . . . . . . . 47 . 18841 2 114 3 1 . . 122.264 . . 1 . 1 1 45 ARG N . . . . . . . . . . 48 . 18841 2 115 1 1 . . 8.355 . . 1 . 1 1 45 ARG H . . . . . . . . . . 47 . 18841 2 115 3 1 . . 122.237 . . 1 . 1 1 45 ARG N . . . . . . . . . . 48 . 18841 2 116 1 1 . . 8.349 . . 1 . 1 1 47 ALA H . . . . . . . . . . 66 . 18841 2 116 3 1 . . 124.274 . . 1 . 1 1 47 ALA N . . . . . . . . . . 67 . 18841 2 117 1 1 . . 8.047 . . 1 . 1 1 48 ILE H . . . . . . . . . . 41 . 18841 2 117 3 1 . . 121.307 . . 1 . 1 1 48 ILE N . . . . . . . . . . 42 . 18841 2 118 1 1 . . 8.047 . . 1 . 1 1 48 ILE H . . . . . . . . . . 41 . 18841 2 118 3 1 . . 121.295 . . 1 . 1 1 48 ILE N . . . . . . . . . . 42 . 18841 2 119 1 1 . . 8.047 . . 1 . 1 1 48 ILE H . . . . . . . . . . 41 . 18841 2 119 3 1 . . 121.301 . . 1 . 1 1 48 ILE N . . . . . . . . . . 42 . 18841 2 120 1 1 . . 8.665 . . 1 . 1 1 50 HIS H . . . . . . . . . . 72 . 18841 2 120 3 1 . . 120.418 . . 1 . 1 1 50 HIS N . . . . . . . . . . 73 . 18841 2 121 1 1 . . 8.444 . . 1 . 1 1 51 ASP H . . . . . . . . . . 70 . 18841 2 121 3 1 . . 119.397 . . 1 . 1 1 51 ASP N . . . . . . . . . . 71 . 18841 2 122 1 1 . . 8.194 . . 1 . 1 1 52 GLU H . . . . . . . . . . 37 . 18841 2 122 3 1 . . 121.362 . . 1 . 1 1 52 GLU N . . . . . . . . . . 38 . 18841 2 123 1 1 . . 8.193 . . 1 . 1 1 52 GLU H . . . . . . . . . . 37 . 18841 2 123 3 1 . . 121.374 . . 1 . 1 1 52 GLU N . . . . . . . . . . 38 . 18841 2 124 1 1 . . 8.194 . . 1 . 1 1 52 GLU H . . . . . . . . . . 37 . 18841 2 124 3 1 . . 121.363 . . 1 . 1 1 52 GLU N . . . . . . . . . . 38 . 18841 2 125 1 1 . . 7.895 . . 1 . 1 1 53 VAL H . . . . . . . . . . 85 . 18841 2 125 3 1 . . 120.806 . . 1 . 1 1 53 VAL N . . . . . . . . . . 86 . 18841 2 126 1 1 . . 7.895 . . 1 . 1 1 53 VAL H . . . . . . . . . . 85 . 18841 2 126 3 1 . . 120.866 . . 1 . 1 1 53 VAL N . . . . . . . . . . 86 . 18841 2 127 1 1 . . 7.896 . . 1 . 1 1 53 VAL H . . . . . . . . . . 85 . 18841 2 127 3 1 . . 120.810 . . 1 . 1 1 53 VAL N . . . . . . . . . . 86 . 18841 2 128 1 1 . . 7.895 . . 1 . 1 1 53 VAL H . . . . . . . . . . 85 . 18841 2 128 3 1 . . 120.807 . . 1 . 1 1 53 VAL N . . . . . . . . . . 86 . 18841 2 129 1 1 . . 8.262 . . 1 . 1 1 54 GLU H . . . . . . . . . . 101 . 18841 2 129 3 1 . . 120.844 . . 1 . 1 1 54 GLU N . . . . . . . . . . 102 . 18841 2 130 1 1 . . 8.261 . . 1 . 1 1 54 GLU H . . . . . . . . . . 101 . 18841 2 130 3 1 . . 120.842 . . 1 . 1 1 54 GLU N . . . . . . . . . . 102 . 18841 2 131 1 1 . . 8.268 . . 1 . 1 1 54 GLU H . . . . . . . . . . 101 . 18841 2 131 3 1 . . 120.872 . . 1 . 1 1 54 GLU N . . . . . . . . . . 102 . 18841 2 132 1 1 . . 8.260 . . 1 . 1 1 54 GLU H . . . . . . . . . . 101 . 18841 2 132 3 1 . . 120.838 . . 1 . 1 1 54 GLU N . . . . . . . . . . 102 . 18841 2 133 1 1 . . 8.141 . . 1 . 1 1 55 ARG H . . . . . . . . . . 60 . 18841 2 133 3 1 . . 120.842 . . 1 . 1 1 55 ARG N . . . . . . . . . . 61 . 18841 2 134 1 1 . . 8.142 . . 1 . 1 1 55 ARG H . . . . . . . . . . 60 . 18841 2 134 3 1 . . 120.842 . . 1 . 1 1 55 ARG N . . . . . . . . . . 61 . 18841 2 135 1 1 . . 8.141 . . 1 . 1 1 55 ARG H . . . . . . . . . . 60 . 18841 2 135 3 1 . . 120.831 . . 1 . 1 1 55 ARG N . . . . . . . . . . 61 . 18841 2 136 1 1 . . 8.145 . . 1 . 1 1 55 ARG H . . . . . . . . . . 60 . 18841 2 136 3 1 . . 120.868 . . 1 . 1 1 55 ARG N . . . . . . . . . . 61 . 18841 2 137 1 1 . . 8.223 . . 1 . 1 1 56 ARG H . . . . . . . . . . 39 . 18841 2 137 3 1 . . 119.611 . . 1 . 1 1 56 ARG N . . . . . . . . . . 40 . 18841 2 138 1 1 . . 8.239 . . 1 . 1 1 57 MET H . . . . . . . . . . 21 . 18841 2 138 3 1 . . 119.788 . . 1 . 1 1 57 MET N . . . . . . . . . . 22 . 18841 2 139 1 1 . . 8.239 . . 1 . 1 1 57 MET H . . . . . . . . . . 21 . 18841 2 139 3 1 . . 119.781 . . 1 . 1 1 57 MET N . . . . . . . . . . 22 . 18841 2 140 1 1 . . 8.138 . . 1 . 1 1 58 ALA H . . . . . . . . . . 93 . 18841 2 140 3 1 . . 122.682 . . 1 . 1 1 58 ALA N . . . . . . . . . . 94 . 18841 2 141 1 1 . . 8.153 . . 1 . 1 1 59 GLU H . . . . . . . . . . 29 . 18841 2 141 3 1 . . 119.131 . . 1 . 1 1 59 GLU N . . . . . . . . . . 30 . 18841 2 142 1 1 . . 8.155 . . 1 . 1 1 59 GLU H . . . . . . . . . . 29 . 18841 2 142 3 1 . . 119.110 . . 1 . 1 1 59 GLU N . . . . . . . . . . 30 . 18841 2 143 1 1 . . 8.155 . . 1 . 1 1 59 GLU H . . . . . . . . . . 29 . 18841 2 143 3 1 . . 119.114 . . 1 . 1 1 59 GLU N . . . . . . . . . . 30 . 18841 2 144 1 1 . . 8.155 . . 1 . 1 1 59 GLU H . . . . . . . . . . 29 . 18841 2 144 3 1 . . 119.115 . . 1 . 1 1 59 GLU N . . . . . . . . . . 30 . 18841 2 145 1 1 . . 7.930 . . 1 . 1 1 60 ARG H . . . . . . . . . . 132 . 18841 2 145 3 1 . . 120.293 . . 1 . 1 1 60 ARG N . . . . . . . . . . 133 . 18841 2 146 1 1 . . 7.928 . . 1 . 1 1 60 ARG H . . . . . . . . . . 132 . 18841 2 146 3 1 . . 120.282 . . 1 . 1 1 60 ARG N . . . . . . . . . . 133 . 18841 2 147 1 1 . . 8.191 . . 1 . 1 1 61 PHE H . . . . . . . . . . 140 . 18841 2 147 3 1 . . 119.179 . . 1 . 1 1 61 PHE N . . . . . . . . . . 141 . 18841 2 148 1 1 . . 8.191 . . 1 . 1 1 61 PHE H . . . . . . . . . . 140 . 18841 2 148 3 1 . . 119.184 . . 1 . 1 1 61 PHE N . . . . . . . . . . 141 . 18841 2 149 1 1 . . 8.191 . . 1 . 1 1 61 PHE H . . . . . . . . . . 140 . 18841 2 149 3 1 . . 119.179 . . 1 . 1 1 61 PHE N . . . . . . . . . . 141 . 18841 2 150 1 1 . . 8.192 . . 1 . 1 1 61 PHE H . . . . . . . . . . 140 . 18841 2 150 3 1 . . 119.178 . . 1 . 1 1 61 PHE N . . . . . . . . . . 141 . 18841 2 151 1 1 . . 8.067 . . 1 . 1 1 62 ALA H . . . . . . . . . . 106 . 18841 2 151 3 1 . . 122.587 . . 1 . 1 1 62 ALA N . . . . . . . . . . 107 . 18841 2 152 1 1 . . 8.067 . . 1 . 1 1 62 ALA H . . . . . . . . . . 106 . 18841 2 152 3 1 . . 122.586 . . 1 . 1 1 62 ALA N . . . . . . . . . . 107 . 18841 2 153 1 1 . . 7.968 . . 1 . 1 1 63 LYS H . . . . . . . . . . 97 . 18841 2 153 3 1 . . 118.651 . . 1 . 1 1 63 LYS N . . . . . . . . . . 98 . 18841 2 154 1 1 . . 8.011 . . 1 . 1 1 64 MET H . . . . . . . . . . 27 . 18841 2 154 3 1 . . 119.276 . . 1 . 1 1 64 MET N . . . . . . . . . . 28 . 18841 2 155 1 1 . . 8.010 . . 1 . 1 1 64 MET H . . . . . . . . . . 27 . 18841 2 155 3 1 . . 119.267 . . 1 . 1 1 64 MET N . . . . . . . . . . 28 . 18841 2 156 1 1 . . 8.012 . . 1 . 1 1 64 MET H . . . . . . . . . . 27 . 18841 2 156 3 1 . . 119.265 . . 1 . 1 1 64 MET N . . . . . . . . . . 28 . 18841 2 157 1 1 . . 8.077 . . 1 . 1 1 65 ARG H . . . . . . . . . . 23 . 18841 2 157 3 1 . . 120.586 . . 1 . 1 1 65 ARG N . . . . . . . . . . 24 . 18841 2 158 1 1 . . 8.078 . . 1 . 1 1 65 ARG H . . . . . . . . . . 23 . 18841 2 158 3 1 . . 120.571 . . 1 . 1 1 65 ARG N . . . . . . . . . . 24 . 18841 2 159 1 1 . . 8.090 . . 1 . 1 1 66 LYS H . . . . . . . . . . 49 . 18841 2 159 3 1 . . 121.527 . . 1 . 1 1 66 LYS N . . . . . . . . . . 50 . 18841 2 160 1 1 . . 8.288 . . 1 . 1 1 67 GLU H . . . . . . . . . . 64 . 18841 2 160 3 1 . . 121.024 . . 1 . 1 1 67 GLU N . . . . . . . . . . 65 . 18841 2 161 1 1 . . 8.288 . . 1 . 1 1 67 GLU H . . . . . . . . . . 64 . 18841 2 161 3 1 . . 121.024 . . 1 . 1 1 67 GLU N . . . . . . . . . . 65 . 18841 2 162 1 1 . . 8.225 . . 1 . 1 1 68 ARG H . . . . . . . . . . 19 . 18841 2 162 3 1 . . 121.074 . . 1 . 1 1 68 ARG N . . . . . . . . . . 20 . 18841 2 163 1 1 . . 8.227 . . 1 . 1 1 68 ARG H . . . . . . . . . . 19 . 18841 2 163 3 1 . . 121.033 . . 1 . 1 1 68 ARG N . . . . . . . . . . 20 . 18841 2 164 1 1 . . 8.232 . . 1 . 1 1 69 SER H . . . . . . . . . . 126 . 18841 2 164 3 1 . . 116.503 . . 1 . 1 1 69 SER N . . . . . . . . . . 127 . 18841 2 165 1 1 . . 8.383 . . 1 . 1 1 16 MET H . . . . . . . . . . 7 . 18841 2 165 3 1 . . 120.262 . . 1 . 1 1 16 MET N . . . . . . . . . . 8 . 18841 2 166 1 1 . . 8.288 . . 1 . 1 1 28 SER H . . . . . . . . . . 74 . 18841 2 166 3 1 . . 116.219 . . 1 . 1 1 28 SER N . . . . . . . . . . 75 . 18841 2 167 1 1 . . 8.281 . . 1 . 1 1 28 SER H . . . . . . . . . . 74 . 18841 2 167 3 1 . . 116.188 . . 1 . 1 1 28 SER N . . . . . . . . . . 75 . 18841 2 168 1 1 . . 8.209 . . 1 . 1 1 33 LEU H . . . . . . . . . . 25 . 18841 2 168 3 1 . . 120.374 . . 1 . 1 1 33 LEU N . . . . . . . . . . 26 . 18841 2 169 1 1 . . 7.891 . . 1 . 1 1 37 VAL H . . . . . . . . . . 142 . 18841 2 169 3 1 . . 119.262 . . 1 . 1 1 37 VAL N . . . . . . . . . . 143 . 18841 2 170 1 1 . . 7.889 . . 1 . 1 1 37 VAL H . . . . . . . . . . 142 . 18841 2 170 3 1 . . 119.262 . . 1 . 1 1 37 VAL N . . . . . . . . . . 143 . 18841 2 171 1 1 . . 7.889 . . 1 . 1 1 37 VAL H . . . . . . . . . . 142 . 18841 2 171 3 1 . . 119.262 . . 1 . 1 1 37 VAL N . . . . . . . . . . 143 . 18841 2 172 1 1 . . 7.889 . . 1 . 1 1 37 VAL H . . . . . . . . . . 142 . 18841 2 172 3 1 . . 119.262 . . 1 . 1 1 37 VAL N . . . . . . . . . . 143 . 18841 2 173 1 1 . . 8.166 . . 1 . 1 1 14 SER H . . . . . . . . . . 103 . 18841 2 173 3 1 . . 117.585 . . 1 . 1 1 14 SER N . . . . . . . . . . 104 . 18841 2 174 1 1 . . 8.350 . . 1 . 1 1 47 ALA H . . . . . . . . . . 66 . 18841 2 174 3 1 . . 124.236 . . 1 . 1 1 47 ALA N . . . . . . . . . . 67 . 18841 2 175 1 1 . . 8.349 . . 1 . 1 1 47 ALA H . . . . . . . . . . 66 . 18841 2 175 3 1 . . 124.275 . . 1 . 1 1 47 ALA N . . . . . . . . . . 67 . 18841 2 176 1 1 . . 8.141 . . 1 . 1 1 58 ALA H . . . . . . . . . . 93 . 18841 2 176 3 1 . . 122.714 . . 1 . 1 1 58 ALA N . . . . . . . . . . 94 . 18841 2 177 1 1 . . 8.142 . . 1 . 1 1 58 ALA H . . . . . . . . . . 93 . 18841 2 177 3 1 . . 122.714 . . 1 . 1 1 58 ALA N . . . . . . . . . . 94 . 18841 2 178 1 1 . . 7.932 . . 1 . 1 1 60 ARG H . . . . . . . . . . 132 . 18841 2 178 3 1 . . 120.358 . . 1 . 1 1 60 ARG N . . . . . . . . . . 133 . 18841 2 179 1 1 . . 7.932 . . 1 . 1 1 60 ARG H . . . . . . . . . . 132 . 18841 2 179 3 1 . . 120.358 . . 1 . 1 1 60 ARG N . . . . . . . . . . 133 . 18841 2 180 1 1 . . 8.229 . . 1 . 1 1 70 LYS H . . . . . . . . . . 90 . 18841 2 180 3 1 . . 123.396 . . 1 . 1 1 70 LYS N . . . . . . . . . . 91 . 18841 2 181 1 1 . . 8.282 . . 1 . 1 1 6 ASP H . . . . . . . . . . 78 . 18841 2 181 3 1 . . 120.410 . . 1 . 1 1 6 ASP N . . . . . . . . . . 79 . 18841 2 182 1 1 . . 8.282 . . 1 . 1 1 6 ASP H . . . . . . . . . . 78 . 18841 2 182 3 1 . . 120.410 . . 1 . 1 1 6 ASP N . . . . . . . . . . 79 . 18841 2 183 1 1 . . 8.283 . . 1 . 1 1 6 ASP H . . . . . . . . . . 78 . 18841 2 183 3 1 . . 120.410 . . 1 . 1 1 6 ASP N . . . . . . . . . . 79 . 18841 2 184 1 1 . . 8.291 . . 1 . 1 1 7 ASP H . . . . . . . . . . 136 . 18841 2 184 3 1 . . 120.715 . . 1 . 1 1 7 ASP N . . . . . . . . . . 137 . 18841 2 185 1 1 . . 8.292 . . 1 . 1 1 7 ASP H . . . . . . . . . . 136 . 18841 2 185 3 1 . . 120.715 . . 1 . 1 1 7 ASP N . . . . . . . . . . 137 . 18841 2 186 1 1 . . 8.292 . . 1 . 1 1 7 ASP H . . . . . . . . . . 136 . 18841 2 186 3 1 . . 120.715 . . 1 . 1 1 7 ASP N . . . . . . . . . . 137 . 18841 2 187 1 1 . . 8.174 . . 1 . 1 1 9 LYS H . . . . . . . . . . 3 . 18841 2 187 3 1 . . 120.883 . . 1 . 1 1 9 LYS N . . . . . . . . . . 4 . 18841 2 188 1 1 . . 8.307 . . 1 . 1 1 10 ASN H . . . . . . . . . . 11 . 18841 2 188 3 1 . . 118.050 . . 1 . 1 1 10 ASN N . . . . . . . . . . 12 . 18841 2 189 1 1 . . 8.309 . . 1 . 1 1 10 ASN H . . . . . . . . . . 11 . 18841 2 189 3 1 . . 118.051 . . 1 . 1 1 10 ASN N . . . . . . . . . . 12 . 18841 2 190 1 1 . . 6.943 . . 1 . 1 1 10 ASN HD22 . . . . . . . . . . 105 . 18841 2 190 3 1 . . 113.637 . . 1 . 1 1 10 ASN ND2 . . . . . . . . . . 59 . 18841 2 191 1 1 . . 7.743 . . 1 . 1 1 10 ASN HD21 . . . . . . . . . . 58 . 18841 2 191 3 1 . . 113.584 . . 1 . 1 1 10 ASN ND2 . . . . . . . . . . 59 . 18841 2 192 1 1 . . 8.023 . . 1 . 1 1 11 ARG H . . . . . . . . . . 68 . 18841 2 192 3 1 . . 121.125 . . 1 . 1 1 11 ARG N . . . . . . . . . . 69 . 18841 2 193 1 1 . . 8.179 . . 1 . 1 1 12 ALA H . . . . . . . . . . 134 . 18841 2 193 3 1 . . 124.224 . . 1 . 1 1 12 ALA N . . . . . . . . . . 135 . 18841 2 194 1 1 . . 8.174 . . 1 . 1 1 12 ALA H . . . . . . . . . . 134 . 18841 2 194 3 1 . . 124.152 . . 1 . 1 1 12 ALA N . . . . . . . . . . 135 . 18841 2 195 1 1 . . 8.057 . . 1 . 1 1 13 LEU H . . . . . . . . . . 9 . 18841 2 195 3 1 . . 120.746 . . 1 . 1 1 13 LEU N . . . . . . . . . . 10 . 18841 2 196 1 1 . . 8.060 . . 1 . 1 1 13 LEU H . . . . . . . . . . 9 . 18841 2 196 3 1 . . 120.755 . . 1 . 1 1 13 LEU N . . . . . . . . . . 10 . 18841 2 197 1 1 . . 8.177 . . 1 . 1 1 14 SER H . . . . . . . . . . 103 . 18841 2 197 3 1 . . 117.579 . . 1 . 1 1 14 SER N . . . . . . . . . . 104 . 18841 2 198 1 1 . . 8.180 . . 1 . 1 1 14 SER H . . . . . . . . . . 103 . 18841 2 198 3 1 . . 117.540 . . 1 . 1 1 14 SER N . . . . . . . . . . 104 . 18841 2 199 1 1 . . 8.180 . . 1 . 1 1 14 SER H . . . . . . . . . . 103 . 18841 2 199 3 1 . . 117.540 . . 1 . 1 1 14 SER N . . . . . . . . . . 104 . 18841 2 200 1 1 . . 8.384 . . 1 . 1 1 16 MET H . . . . . . . . . . 7 . 18841 2 200 3 1 . . 120.297 . . 1 . 1 1 16 MET N . . . . . . . . . . 8 . 18841 2 201 1 1 . . 8.377 . . 1 . 1 1 16 MET H . . . . . . . . . . 7 . 18841 2 201 3 1 . . 120.256 . . 1 . 1 1 16 MET N . . . . . . . . . . 8 . 18841 2 202 1 1 . . 8.051 . . 1 . 1 1 17 VAL H . . . . . . . . . . 128 . 18841 2 202 3 1 . . 120.989 . . 1 . 1 1 17 VAL N . . . . . . . . . . 129 . 18841 2 203 1 1 . . 8.051 . . 1 . 1 1 17 VAL H . . . . . . . . . . 128 . 18841 2 203 3 1 . . 120.989 . . 1 . 1 1 17 VAL N . . . . . . . . . . 129 . 18841 2 204 1 1 . . 8.051 . . 1 . 1 1 17 VAL H . . . . . . . . . . 128 . 18841 2 204 3 1 . . 120.989 . . 1 . 1 1 17 VAL N . . . . . . . . . . 129 . 18841 2 205 1 1 . . 8.331 . . 1 . 1 1 18 SER H . . . . . . . . . . 122 . 18841 2 205 3 1 . . 118.991 . . 1 . 1 1 18 SER N . . . . . . . . . . 123 . 18841 2 206 1 1 . . 8.331 . . 1 . 1 1 18 SER H . . . . . . . . . . 122 . 18841 2 206 3 1 . . 119.011 . . 1 . 1 1 18 SER N . . . . . . . . . . 123 . 18841 2 207 1 1 . . 8.354 . . 1 . 1 1 19 GLU H . . . . . . . . . . 83 . 18841 2 207 3 1 . . 122.710 . . 1 . 1 1 19 GLU N . . . . . . . . . . 84 . 18841 2 208 1 1 . . 8.354 . . 1 . 1 1 19 GLU H . . . . . . . . . . 83 . 18841 2 208 3 1 . . 122.710 . . 1 . 1 1 19 GLU N . . . . . . . . . . 84 . 18841 2 209 1 1 . . 8.354 . . 1 . 1 1 19 GLU H . . . . . . . . . . 83 . 18841 2 209 3 1 . . 122.710 . . 1 . 1 1 19 GLU N . . . . . . . . . . 84 . 18841 2 210 1 1 . . 8.101 . . 1 . 1 1 20 PHE H . . . . . . . . . . 53 . 18841 2 210 3 1 . . 119.366 . . 1 . 1 1 20 PHE N . . . . . . . . . . 54 . 18841 2 211 1 1 . . 8.102 . . 1 . 1 1 20 PHE H . . . . . . . . . . 53 . 18841 2 211 3 1 . . 119.339 . . 1 . 1 1 20 PHE N . . . . . . . . . . 54 . 18841 2 212 1 1 . . 8.102 . . 1 . 1 1 20 PHE H . . . . . . . . . . 53 . 18841 2 212 3 1 . . 119.339 . . 1 . 1 1 20 PHE N . . . . . . . . . . 54 . 18841 2 213 1 1 . . 8.455 . . 1 . 1 1 21 GLU H . . . . . . . . . . 33 . 18841 2 213 3 1 . . 121.448 . . 1 . 1 1 21 GLU N . . . . . . . . . . 34 . 18841 2 214 1 1 . . 8.457 . . 1 . 1 1 21 GLU H . . . . . . . . . . 33 . 18841 2 214 3 1 . . 121.468 . . 1 . 1 1 21 GLU N . . . . . . . . . . 34 . 18841 2 215 1 1 . . 8.457 . . 1 . 1 1 21 GLU H . . . . . . . . . . 33 . 18841 2 215 3 1 . . 121.463 . . 1 . 1 1 21 GLU N . . . . . . . . . . 34 . 18841 2 216 1 1 . . 7.928 . . 1 . 1 1 22 THR H . . . . . . . . . . 13 . 18841 2 216 3 1 . . 112.308 . . 1 . 1 1 22 THR N . . . . . . . . . . 14 . 18841 2 217 1 1 . . 7.935 . . 1 . 1 1 22 THR H . . . . . . . . . . 13 . 18841 2 217 3 1 . . 112.355 . . 1 . 1 1 22 THR N . . . . . . . . . . 14 . 18841 2 218 1 1 . . 7.935 . . 1 . 1 1 22 THR H . . . . . . . . . . 13 . 18841 2 218 3 1 . . 112.355 . . 1 . 1 1 22 THR N . . . . . . . . . . 14 . 18841 2 219 1 1 . . 8.324 . . 1 . 1 1 23 ILE H . . . . . . . . . . 45 . 18841 2 219 3 1 . . 122.902 . . 1 . 1 1 23 ILE N . . . . . . . . . . 46 . 18841 2 220 1 1 . . 8.324 . . 1 . 1 1 23 ILE H . . . . . . . . . . 45 . 18841 2 220 3 1 . . 122.902 . . 1 . 1 1 23 ILE N . . . . . . . . . . 46 . 18841 2 221 1 1 . . 8.447 . . 1 . 1 1 24 GLU H . . . . . . . . . . 35 . 18841 2 221 3 1 . . 123.217 . . 1 . 1 1 24 GLU N . . . . . . . . . . 36 . 18841 2 222 1 1 . . 8.444 . . 1 . 1 1 24 GLU H . . . . . . . . . . 35 . 18841 2 222 3 1 . . 123.184 . . 1 . 1 1 24 GLU N . . . . . . . . . . 36 . 18841 2 223 1 1 . . 8.184 . . 1 . 1 1 25 GLN H . . . . . . . . . . 144 . 18841 2 223 3 1 . . 120.549 . . 1 . 1 1 25 GLN N . . . . . . . . . . 145 . 18841 2 224 1 1 . . 8.180 . . 1 . 1 1 25 GLN H . . . . . . . . . . 144 . 18841 2 224 3 1 . . 120.567 . . 1 . 1 1 25 GLN N . . . . . . . . . . 145 . 18841 2 225 1 1 . . 6.947 . . 1 . 1 1 25 GLN HE22 . . . . . . . . . . 51 . 18841 2 225 3 1 . . 112.279 . . 1 . 1 1 25 GLN NE2 . . . . . . . . . . 52 . 18841 2 226 1 1 . . 7.542 . . 1 . 1 1 25 GLN HE21 . . . . . . . . . . 55 . 18841 2 226 3 1 . . 112.277 . . 1 . 1 1 25 GLN NE2 . . . . . . . . . . 52 . 18841 2 227 1 1 . . 8.177 . . 1 . 1 1 26 GLU H . . . . . . . . . . 138 . 18841 2 227 3 1 . . 121.837 . . 1 . 1 1 26 GLU N . . . . . . . . . . 139 . 18841 2 228 1 1 . . 8.177 . . 1 . 1 1 26 GLU H . . . . . . . . . . 138 . 18841 2 228 3 1 . . 121.837 . . 1 . 1 1 26 GLU N . . . . . . . . . . 139 . 18841 2 229 1 1 . . 8.171 . . 1 . 1 1 26 GLU H . . . . . . . . . . 138 . 18841 2 229 3 1 . . 121.813 . . 1 . 1 1 26 GLU N . . . . . . . . . . 139 . 18841 2 230 1 1 . . 8.584 . . 1 . 1 1 27 ASN H . . . . . . . . . . 114 . 18841 2 230 3 1 . . 118.877 . . 1 . 1 1 27 ASN N . . . . . . . . . . 115 . 18841 2 231 1 1 . . 8.584 . . 1 . 1 1 27 ASN H . . . . . . . . . . 114 . 18841 2 231 3 1 . . 118.873 . . 1 . 1 1 27 ASN N . . . . . . . . . . 115 . 18841 2 232 1 1 . . 8.582 . . 1 . 1 1 27 ASN H . . . . . . . . . . 114 . 18841 2 232 3 1 . . 118.864 . . 1 . 1 1 27 ASN N . . . . . . . . . . 115 . 18841 2 233 1 1 . . 7.681 . . 1 . 1 1 27 ASN HD22 . . . . . . . . . . 87 . 18841 2 233 3 1 . . 112.691 . . 1 . 1 1 27 ASN ND2 . . . . . . . . . . 18 . 18841 2 234 1 1 . . 8.283 . . 1 . 1 1 28 SER H . . . . . . . . . . 74 . 18841 2 234 3 1 . . 116.195 . . 1 . 1 1 28 SER N . . . . . . . . . . 75 . 18841 2 235 1 1 . . 8.287 . . 1 . 1 1 28 SER H . . . . . . . . . . 74 . 18841 2 235 3 1 . . 116.219 . . 1 . 1 1 28 SER N . . . . . . . . . . 75 . 18841 2 236 1 1 . . 8.238 . . 1 . 1 1 29 TYR H . . . . . . . . . . 95 . 18841 2 236 3 1 . . 123.688 . . 1 . 1 1 29 TYR N . . . . . . . . . . 96 . 18841 2 237 1 1 . . 8.238 . . 1 . 1 1 29 TYR H . . . . . . . . . . 95 . 18841 2 237 3 1 . . 123.688 . . 1 . 1 1 29 TYR N . . . . . . . . . . 96 . 18841 2 238 1 1 . . 8.238 . . 1 . 1 1 29 TYR H . . . . . . . . . . 95 . 18841 2 238 3 1 . . 123.688 . . 1 . 1 1 29 TYR N . . . . . . . . . . 96 . 18841 2 239 1 1 . . 8.318 . . 1 . 1 1 30 ASN H . . . . . . . . . . 116 . 18841 2 239 3 1 . . 118.208 . . 1 . 1 1 30 ASN N . . . . . . . . . . 117 . 18841 2 240 1 1 . . 8.317 . . 1 . 1 1 30 ASN H . . . . . . . . . . 116 . 18841 2 240 3 1 . . 118.187 . . 1 . 1 1 30 ASN N . . . . . . . . . . 117 . 18841 2 241 1 1 . . 8.211 . . 1 . 1 1 31 GLU H . . . . . . . . . . 124 . 18841 2 241 3 1 . . 120.475 . . 1 . 1 1 31 GLU N . . . . . . . . . . 125 . 18841 2 242 1 1 . . 8.211 . . 1 . 1 1 31 GLU H . . . . . . . . . . 124 . 18841 2 242 3 1 . . 120.514 . . 1 . 1 1 31 GLU N . . . . . . . . . . 125 . 18841 2 243 1 1 . . 8.209 . . 1 . 1 1 31 GLU H . . . . . . . . . . 124 . 18841 2 243 3 1 . . 120.512 . . 1 . 1 1 31 GLU N . . . . . . . . . . 125 . 18841 2 244 1 1 . . 8.029 . . 1 . 1 1 32 TRP H . . . . . . . . . . 43 . 18841 2 244 3 1 . . 122.282 . . 1 . 1 1 32 TRP N . . . . . . . . . . 44 . 18841 2 245 1 1 . . 8.032 . . 1 . 1 1 32 TRP H . . . . . . . . . . 43 . 18841 2 245 3 1 . . 122.311 . . 1 . 1 1 32 TRP N . . . . . . . . . . 44 . 18841 2 246 1 1 . . 8.204 . . 1 . 1 1 33 LEU H . . . . . . . . . . 25 . 18841 2 246 3 1 . . 120.309 . . 1 . 1 1 33 LEU N . . . . . . . . . . 26 . 18841 2 247 1 1 . . 8.204 . . 1 . 1 1 33 LEU H . . . . . . . . . . 25 . 18841 2 247 3 1 . . 120.288 . . 1 . 1 1 33 LEU N . . . . . . . . . . 26 . 18841 2 248 1 1 . . 8.207 . . 1 . 1 1 33 LEU H . . . . . . . . . . 25 . 18841 2 248 3 1 . . 120.246 . . 1 . 1 1 33 LEU N . . . . . . . . . . 26 . 18841 2 249 1 1 . . 7.818 . . 1 . 1 1 34 ARG H . . . . . . . . . . 88 . 18841 2 249 3 1 . . 118.299 . . 1 . 1 1 34 ARG N . . . . . . . . . . 89 . 18841 2 250 1 1 . . 7.818 . . 1 . 1 1 34 ARG H . . . . . . . . . . 88 . 18841 2 250 3 1 . . 118.293 . . 1 . 1 1 34 ARG N . . . . . . . . . . 89 . 18841 2 251 1 1 . . 7.751 . . 1 . 1 1 35 ALA H . . . . . . . . . . 99 . 18841 2 251 3 1 . . 121.973 . . 1 . 1 1 35 ALA N . . . . . . . . . . 100 . 18841 2 252 1 1 . . 7.750 . . 1 . 1 1 35 ALA H . . . . . . . . . . 99 . 18841 2 252 3 1 . . 121.980 . . 1 . 1 1 35 ALA N . . . . . . . . . . 100 . 18841 2 253 1 1 . . 7.862 . . 1 . 1 1 36 LYS H . . . . . . . . . . 1 . 18841 2 253 3 1 . . 119.382 . . 1 . 1 1 36 LYS N . . . . . . . . . . 2 . 18841 2 254 1 1 . . 7.866 . . 1 . 1 1 36 LYS H . . . . . . . . . . 1 . 18841 2 254 3 1 . . 119.354 . . 1 . 1 1 36 LYS N . . . . . . . . . . 2 . 18841 2 255 1 1 . . 8.116 . . 1 . 1 1 38 ALA H . . . . . . . . . . 130 . 18841 2 255 3 1 . . 125.521 . . 1 . 1 1 38 ALA N . . . . . . . . . . 131 . 18841 2 256 1 1 . . 8.115 . . 1 . 1 1 38 ALA H . . . . . . . . . . 130 . 18841 2 256 3 1 . . 125.518 . . 1 . 1 1 38 ALA N . . . . . . . . . . 131 . 18841 2 257 1 1 . . 8.007 . . 1 . 1 1 39 THR H . . . . . . . . . . 81 . 18841 2 257 3 1 . . 112.472 . . 1 . 1 1 39 THR N . . . . . . . . . . 82 . 18841 2 258 1 1 . . 8.007 . . 1 . 1 1 39 THR H . . . . . . . . . . 81 . 18841 2 258 3 1 . . 112.473 . . 1 . 1 1 39 THR N . . . . . . . . . . 82 . 18841 2 259 1 1 . . 8.160 . . 1 . 1 1 40 SER H . . . . . . . . . . 62 . 18841 2 259 3 1 . . 117.677 . . 1 . 1 1 40 SER N . . . . . . . . . . 63 . 18841 2 260 1 1 . . 8.160 . . 1 . 1 1 40 SER H . . . . . . . . . . 62 . 18841 2 260 3 1 . . 117.677 . . 1 . 1 1 40 SER N . . . . . . . . . . 63 . 18841 2 261 1 1 . . 8.135 . . 1 . 1 1 41 LEU H . . . . . . . . . . 108 . 18841 2 261 3 1 . . 123.521 . . 1 . 1 1 41 LEU N . . . . . . . . . . 109 . 18841 2 262 1 1 . . 8.133 . . 1 . 1 1 41 LEU H . . . . . . . . . . 108 . 18841 2 262 3 1 . . 123.558 . . 1 . 1 1 41 LEU N . . . . . . . . . . 109 . 18841 2 263 1 1 . . 8.028 . . 1 . 1 1 42 ALA H . . . . . . . . . . 112 . 18841 2 263 3 1 . . 123.394 . . 1 . 1 1 42 ALA N . . . . . . . . . . 113 . 18841 2 264 1 1 . . 8.028 . . 1 . 1 1 42 ALA H . . . . . . . . . . 112 . 18841 2 264 3 1 . . 123.394 . . 1 . 1 1 42 ALA N . . . . . . . . . . 113 . 18841 2 265 1 1 . . 8.030 . . 1 . 1 1 42 ALA H . . . . . . . . . . 112 . 18841 2 265 3 1 . . 123.394 . . 1 . 1 1 42 ALA N . . . . . . . . . . 113 . 18841 2 266 1 1 . . 8.031 . . 1 . 1 1 42 ALA H . . . . . . . . . . 112 . 18841 2 266 3 1 . . 123.394 . . 1 . 1 1 42 ALA N . . . . . . . . . . 113 . 18841 2 267 1 1 . . 8.028 . . 1 . 1 1 43 ASP H . . . . . . . . . . 120 . 18841 2 267 3 1 . . 120.623 . . 1 . 1 1 43 ASP N . . . . . . . . . . 121 . 18841 2 268 1 1 . . 8.036 . . 1 . 1 1 43 ASP H . . . . . . . . . . 120 . 18841 2 268 3 1 . . 120.665 . . 1 . 1 1 43 ASP N . . . . . . . . . . 121 . 18841 2 269 1 1 . . 8.356 . . 1 . 1 1 45 ARG H . . . . . . . . . . 47 . 18841 2 269 3 1 . . 122.241 . . 1 . 1 1 45 ARG N . . . . . . . . . . 48 . 18841 2 270 1 1 . . 8.355 . . 1 . 1 1 45 ARG H . . . . . . . . . . 47 . 18841 2 270 3 1 . . 122.234 . . 1 . 1 1 45 ARG N . . . . . . . . . . 48 . 18841 2 271 1 1 . . 8.355 . . 1 . 1 1 45 ARG H . . . . . . . . . . 47 . 18841 2 271 3 1 . . 122.242 . . 1 . 1 1 45 ARG N . . . . . . . . . . 48 . 18841 2 272 1 1 . . 8.348 . . 1 . 1 1 47 ALA H . . . . . . . . . . 66 . 18841 2 272 3 1 . . 124.282 . . 1 . 1 1 47 ALA N . . . . . . . . . . 67 . 18841 2 273 1 1 . . 8.349 . . 1 . 1 1 47 ALA H . . . . . . . . . . 66 . 18841 2 273 3 1 . . 124.287 . . 1 . 1 1 47 ALA N . . . . . . . . . . 67 . 18841 2 274 1 1 . . 8.047 . . 1 . 1 1 48 ILE H . . . . . . . . . . 41 . 18841 2 274 3 1 . . 121.294 . . 1 . 1 1 48 ILE N . . . . . . . . . . 42 . 18841 2 275 1 1 . . 8.047 . . 1 . 1 1 48 ILE H . . . . . . . . . . 41 . 18841 2 275 3 1 . . 121.292 . . 1 . 1 1 48 ILE N . . . . . . . . . . 42 . 18841 2 276 1 1 . . 8.659 . . 1 . 1 1 50 HIS H . . . . . . . . . . 72 . 18841 2 276 3 1 . . 120.362 . . 1 . 1 1 50 HIS N . . . . . . . . . . 73 . 18841 2 277 1 1 . . 8.443 . . 1 . 1 1 51 ASP H . . . . . . . . . . 70 . 18841 2 277 3 1 . . 119.391 . . 1 . 1 1 51 ASP N . . . . . . . . . . 71 . 18841 2 278 1 1 . . 8.445 . . 1 . 1 1 51 ASP H . . . . . . . . . . 70 . 18841 2 278 3 1 . . 119.397 . . 1 . 1 1 51 ASP N . . . . . . . . . . 71 . 18841 2 279 1 1 . . 8.194 . . 1 . 1 1 52 GLU H . . . . . . . . . . 37 . 18841 2 279 3 1 . . 121.369 . . 1 . 1 1 52 GLU N . . . . . . . . . . 38 . 18841 2 280 1 1 . . 8.193 . . 1 . 1 1 52 GLU H . . . . . . . . . . 37 . 18841 2 280 3 1 . . 121.374 . . 1 . 1 1 52 GLU N . . . . . . . . . . 38 . 18841 2 281 1 1 . . 7.895 . . 1 . 1 1 53 VAL H . . . . . . . . . . 85 . 18841 2 281 3 1 . . 120.816 . . 1 . 1 1 53 VAL N . . . . . . . . . . 86 . 18841 2 282 1 1 . . 7.896 . . 1 . 1 1 53 VAL H . . . . . . . . . . 85 . 18841 2 282 3 1 . . 120.866 . . 1 . 1 1 53 VAL N . . . . . . . . . . 86 . 18841 2 283 1 1 . . 7.895 . . 1 . 1 1 53 VAL H . . . . . . . . . . 85 . 18841 2 283 3 1 . . 120.816 . . 1 . 1 1 53 VAL N . . . . . . . . . . 86 . 18841 2 284 1 1 . . 8.263 . . 1 . 1 1 54 GLU H . . . . . . . . . . 101 . 18841 2 284 3 1 . . 120.866 . . 1 . 1 1 54 GLU N . . . . . . . . . . 102 . 18841 2 285 1 1 . . 8.261 . . 1 . 1 1 54 GLU H . . . . . . . . . . 101 . 18841 2 285 3 1 . . 120.828 . . 1 . 1 1 54 GLU N . . . . . . . . . . 102 . 18841 2 286 1 1 . . 8.142 . . 1 . 1 1 55 ARG H . . . . . . . . . . 60 . 18841 2 286 3 1 . . 120.831 . . 1 . 1 1 55 ARG N . . . . . . . . . . 61 . 18841 2 287 1 1 . . 8.140 . . 1 . 1 1 55 ARG H . . . . . . . . . . 60 . 18841 2 287 3 1 . . 120.824 . . 1 . 1 1 55 ARG N . . . . . . . . . . 61 . 18841 2 288 1 1 . . 8.223 . . 1 . 1 1 56 ARG H . . . . . . . . . . 39 . 18841 2 288 3 1 . . 119.634 . . 1 . 1 1 56 ARG N . . . . . . . . . . 40 . 18841 2 289 1 1 . . 8.223 . . 1 . 1 1 56 ARG H . . . . . . . . . . 39 . 18841 2 289 3 1 . . 119.636 . . 1 . 1 1 56 ARG N . . . . . . . . . . 40 . 18841 2 290 1 1 . . 8.229 . . 1 . 1 1 56 ARG H . . . . . . . . . . 39 . 18841 2 290 3 1 . . 119.652 . . 1 . 1 1 56 ARG N . . . . . . . . . . 40 . 18841 2 291 1 1 . . 8.229 . . 1 . 1 1 56 ARG H . . . . . . . . . . 39 . 18841 2 291 3 1 . . 119.652 . . 1 . 1 1 56 ARG N . . . . . . . . . . 40 . 18841 2 292 1 1 . . 8.230 . . 1 . 1 1 57 MET H . . . . . . . . . . 21 . 18841 2 292 3 1 . . 119.760 . . 1 . 1 1 57 MET N . . . . . . . . . . 22 . 18841 2 293 1 1 . . 8.241 . . 1 . 1 1 57 MET H . . . . . . . . . . 21 . 18841 2 293 3 1 . . 119.760 . . 1 . 1 1 57 MET N . . . . . . . . . . 22 . 18841 2 294 1 1 . . 8.141 . . 1 . 1 1 58 ALA H . . . . . . . . . . 93 . 18841 2 294 3 1 . . 122.714 . . 1 . 1 1 58 ALA N . . . . . . . . . . 94 . 18841 2 295 1 1 . . 8.141 . . 1 . 1 1 58 ALA H . . . . . . . . . . 93 . 18841 2 295 3 1 . . 122.714 . . 1 . 1 1 58 ALA N . . . . . . . . . . 94 . 18841 2 296 1 1 . . 8.155 . . 1 . 1 1 59 GLU H . . . . . . . . . . 29 . 18841 2 296 3 1 . . 119.108 . . 1 . 1 1 59 GLU N . . . . . . . . . . 30 . 18841 2 297 1 1 . . 8.158 . . 1 . 1 1 59 GLU H . . . . . . . . . . 29 . 18841 2 297 3 1 . . 119.131 . . 1 . 1 1 59 GLU N . . . . . . . . . . 30 . 18841 2 298 1 1 . . 7.928 . . 1 . 1 1 60 ARG H . . . . . . . . . . 132 . 18841 2 298 3 1 . . 120.287 . . 1 . 1 1 60 ARG N . . . . . . . . . . 133 . 18841 2 299 1 1 . . 8.191 . . 1 . 1 1 61 PHE H . . . . . . . . . . 140 . 18841 2 299 3 1 . . 119.181 . . 1 . 1 1 61 PHE N . . . . . . . . . . 141 . 18841 2 300 1 1 . . 8.194 . . 1 . 1 1 61 PHE H . . . . . . . . . . 140 . 18841 2 300 3 1 . . 119.178 . . 1 . 1 1 61 PHE N . . . . . . . . . . 141 . 18841 2 301 1 1 . . 8.194 . . 1 . 1 1 61 PHE H . . . . . . . . . . 140 . 18841 2 301 3 1 . . 119.178 . . 1 . 1 1 61 PHE N . . . . . . . . . . 141 . 18841 2 302 1 1 . . 8.067 . . 1 . 1 1 62 ALA H . . . . . . . . . . 106 . 18841 2 302 3 1 . . 122.593 . . 1 . 1 1 62 ALA N . . . . . . . . . . 107 . 18841 2 303 1 1 . . 8.067 . . 1 . 1 1 62 ALA H . . . . . . . . . . 106 . 18841 2 303 3 1 . . 122.595 . . 1 . 1 1 62 ALA N . . . . . . . . . . 107 . 18841 2 304 1 1 . . 8.067 . . 1 . 1 1 62 ALA H . . . . . . . . . . 106 . 18841 2 304 3 1 . . 122.599 . . 1 . 1 1 62 ALA N . . . . . . . . . . 107 . 18841 2 305 1 1 . . 7.967 . . 1 . 1 1 63 LYS H . . . . . . . . . . 97 . 18841 2 305 3 1 . . 118.650 . . 1 . 1 1 63 LYS N . . . . . . . . . . 98 . 18841 2 306 1 1 . . 7.968 . . 1 . 1 1 63 LYS H . . . . . . . . . . 97 . 18841 2 306 3 1 . . 118.649 . . 1 . 1 1 63 LYS N . . . . . . . . . . 98 . 18841 2 307 1 1 . . 8.011 . . 1 . 1 1 64 MET H . . . . . . . . . . 27 . 18841 2 307 3 1 . . 119.275 . . 1 . 1 1 64 MET N . . . . . . . . . . 28 . 18841 2 308 1 1 . . 8.011 . . 1 . 1 1 64 MET H . . . . . . . . . . 27 . 18841 2 308 3 1 . . 119.278 . . 1 . 1 1 64 MET N . . . . . . . . . . 28 . 18841 2 309 1 1 . . 8.078 . . 1 . 1 1 65 ARG H . . . . . . . . . . 23 . 18841 2 309 3 1 . . 120.585 . . 1 . 1 1 65 ARG N . . . . . . . . . . 24 . 18841 2 310 1 1 . . 8.077 . . 1 . 1 1 65 ARG H . . . . . . . . . . 23 . 18841 2 310 3 1 . . 120.551 . . 1 . 1 1 65 ARG N . . . . . . . . . . 24 . 18841 2 311 1 1 . . 8.091 . . 1 . 1 1 66 LYS H . . . . . . . . . . 49 . 18841 2 311 3 1 . . 121.509 . . 1 . 1 1 66 LYS N . . . . . . . . . . 50 . 18841 2 312 1 1 . . 8.088 . . 1 . 1 1 66 LYS H . . . . . . . . . . 49 . 18841 2 312 3 1 . . 121.515 . . 1 . 1 1 66 LYS N . . . . . . . . . . 50 . 18841 2 313 1 1 . . 8.288 . . 1 . 1 1 67 GLU H . . . . . . . . . . 64 . 18841 2 313 3 1 . . 121.000 . . 1 . 1 1 67 GLU N . . . . . . . . . . 65 . 18841 2 314 1 1 . . 8.285 . . 1 . 1 1 67 GLU H . . . . . . . . . . 64 . 18841 2 314 3 1 . . 121.009 . . 1 . 1 1 67 GLU N . . . . . . . . . . 65 . 18841 2 315 1 1 . . 8.227 . . 1 . 1 1 68 ARG H . . . . . . . . . . 19 . 18841 2 315 3 1 . . 121.085 . . 1 . 1 1 68 ARG N . . . . . . . . . . 20 . 18841 2 316 1 1 . . 8.229 . . 1 . 1 1 68 ARG H . . . . . . . . . . 19 . 18841 2 316 3 1 . . 121.033 . . 1 . 1 1 68 ARG N . . . . . . . . . . 20 . 18841 2 317 1 1 . . 8.229 . . 1 . 1 1 68 ARG H . . . . . . . . . . 19 . 18841 2 317 3 1 . . 121.033 . . 1 . 1 1 68 ARG N . . . . . . . . . . 20 . 18841 2 318 1 1 . . 8.237 . . 1 . 1 1 69 SER H . . . . . . . . . . 126 . 18841 2 318 3 1 . . 116.545 . . 1 . 1 1 69 SER N . . . . . . . . . . 127 . 18841 2 319 1 1 . . 8.229 . . 1 . 1 1 70 LYS H . . . . . . . . . . 90 . 18841 2 319 3 1 . . 123.430 . . 1 . 1 1 70 LYS N . . . . . . . . . . 91 . 18841 2 320 1 1 . . 7.977 . . 1 . 1 1 71 GLN H . . . . . . . . . . 5 . 18841 2 320 3 1 . . 126.449 . . 1 . 1 1 71 GLN N . . . . . . . . . . 6 . 18841 2 321 1 1 . . 7.980 . . 1 . 1 1 71 GLN H . . . . . . . . . . 5 . 18841 2 321 3 1 . . 126.395 . . 1 . 1 1 71 GLN N . . . . . . . . . . 6 . 18841 2 322 1 1 . . 7.977 . . 1 . 1 1 71 GLN H . . . . . . . . . . 5 . 18841 2 322 3 1 . . 126.441 . . 1 . 1 1 71 GLN N . . . . . . . . . . 6 . 18841 2 323 1 1 . . 7.058 . . 1 . 1 1 30 ASN HD22 . . . . . . . . . . 92 . 18841 2 323 2 1 . . 7.637 . . 1 . 1 1 30 ASN HD21 . . . . . . . . . . 76 . 18841 2 323 3 1 . . 112.544 . . 1 . 1 1 30 ASN ND2 . . . . . . . . . . 77 . 18841 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 18841 _Spectral_peak_list.ID 3 _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $PaaA2 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $PaaA2_1 _Spectral_peak_list.Experiment_ID 14 _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 . . 7225.43408203 . . . . . . . 18841 3 2 . . H 1 1H . . 7196.83300781 . . . . . . . 18841 3 3 . . C 13 13C . . 9652.50976562 . . . . . . . 18841 3 stop_ loop_ _Peak.ID _Peak.Figure_of_merit _Peak.Restraint _Peak.Details _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 1.0 . . 18841 3 2 1.0 . . 18841 3 3 1.0 . . 18841 3 4 1.0 . . 18841 3 5 1.0 . . 18841 3 6 1.0 . . 18841 3 7 1.0 . . 18841 3 8 1.0 . . 18841 3 9 1.0 . . 18841 3 10 1.0 . . 18841 3 11 1.0 . . 18841 3 12 1.0 . . 18841 3 13 1.0 . . 18841 3 14 1.0 . . 18841 3 15 1.0 . . 18841 3 16 1.0 . . 18841 3 17 1.0 . . 18841 3 18 1.0 . . 18841 3 19 1.0 . . 18841 3 20 1.0 . . 18841 3 21 1.0 . . 18841 3 22 1.0 . . 18841 3 23 1.0 . . 18841 3 24 1.0 . . 18841 3 25 1.0 . . 18841 3 26 1.0 . . 18841 3 27 1.0 . . 18841 3 28 1.0 . . 18841 3 29 1.0 . . 18841 3 30 1.0 . . 18841 3 31 1.0 . . 18841 3 32 1.0 . . 18841 3 33 1.0 . . 18841 3 34 1.0 . . 18841 3 35 1.0 . . 18841 3 36 1.0 . . 18841 3 37 1.0 . . 18841 3 38 1.0 . . 18841 3 39 1.0 . . 18841 3 40 1.0 . . 18841 3 41 1.0 . . 18841 3 42 1.0 . . 18841 3 43 1.0 . . 18841 3 44 1.0 . . 18841 3 45 1.0 . . 18841 3 46 1.0 . . 18841 3 47 1.0 . . 18841 3 48 1.0 . . 18841 3 49 1.0 . . 18841 3 50 1.0 . . 18841 3 51 1.0 . . 18841 3 52 1.0 . . 18841 3 53 1.0 . . 18841 3 54 1.0 . . 18841 3 55 1.0 . . 18841 3 56 1.0 . . 18841 3 57 1.0 . . 18841 3 58 1.0 . . 18841 3 59 1.0 . . 18841 3 60 1.0 . . 18841 3 61 1.0 . . 18841 3 62 1.0 . . 18841 3 63 1.0 . . 18841 3 64 1.0 . . 18841 3 65 1.0 . . 18841 3 66 1.0 . . 18841 3 67 1.0 . . 18841 3 68 1.0 . . 18841 3 69 1.0 . . 18841 3 70 1.0 . . 18841 3 71 1.0 . . 18841 3 72 1.0 . . 18841 3 73 1.0 . . 18841 3 74 1.0 . . 18841 3 75 1.0 . . 18841 3 76 1.0 . . 18841 3 77 1.0 . . 18841 3 78 1.0 . . 18841 3 79 1.0 . . 18841 3 80 1.0 . . 18841 3 81 1.0 . . 18841 3 82 1.0 . . 18841 3 83 1.0 . . 18841 3 84 1.0 . . 18841 3 85 1.0 . . 18841 3 86 1.0 . . 18841 3 87 1.0 . . 18841 3 88 1.0 . . 18841 3 89 1.0 . . 18841 3 90 1.0 . . 18841 3 91 1.0 . . 18841 3 92 1.0 . . 18841 3 93 1.0 . . 18841 3 94 1.0 . . 18841 3 95 1.0 . . 18841 3 96 1.0 . . 18841 3 97 1.0 . . 18841 3 98 1.0 . . 18841 3 99 1.0 . . 18841 3 100 1.0 . . 18841 3 101 1.0 . . 18841 3 102 1.0 . . 18841 3 103 1.0 . . 18841 3 104 1.0 . . 18841 3 105 1.0 . . 18841 3 106 1.0 . . 18841 3 107 1.0 . . 18841 3 108 1.0 . . 18841 3 109 1.0 . . 18841 3 110 1.0 . . 18841 3 111 1.0 . . 18841 3 112 1.0 . . 18841 3 113 1.0 . . 18841 3 114 1.0 . . 18841 3 115 1.0 . . 18841 3 116 1.0 . . 18841 3 117 1.0 . . 18841 3 118 1.0 . . 18841 3 119 1.0 . . 18841 3 120 1.0 . . 18841 3 121 1.0 . . 18841 3 122 1.0 . . 18841 3 123 1.0 . . 18841 3 124 1.0 . . 18841 3 125 1.0 . . 18841 3 126 1.0 . . 18841 3 127 1.0 . . 18841 3 128 1.0 . . 18841 3 129 1.0 . . 18841 3 130 1.0 . . 18841 3 131 1.0 . . 18841 3 132 1.0 . . 18841 3 133 1.0 . . 18841 3 134 1.0 . . 18841 3 135 1.0 . . 18841 3 136 1.0 . . 18841 3 137 1.0 . . 18841 3 138 1.0 . . 18841 3 139 1.0 . . 18841 3 140 1.0 . . 18841 3 141 1.0 . . 18841 3 142 1.0 . . 18841 3 143 1.0 . . 18841 3 144 1.0 . . 18841 3 145 1.0 . . 18841 3 146 1.0 . . 18841 3 147 1.0 . . 18841 3 148 1.0 . . 18841 3 149 1.0 . . 18841 3 150 1.0 . . 18841 3 151 1.0 . . 18841 3 152 1.0 . . 18841 3 153 1.0 . . 18841 3 154 1.0 . . 18841 3 155 1.0 . . 18841 3 156 1.0 . . 18841 3 157 1.0 . . 18841 3 158 1.0 . . 18841 3 159 1.0 . . 18841 3 160 1.0 . . 18841 3 161 1.0 . . 18841 3 162 1.0 . . 18841 3 163 1.0 . . 18841 3 164 1.0 . . 18841 3 165 1.0 . . 18841 3 166 1.0 . . 18841 3 167 1.0 . . 18841 3 168 1.0 . . 18841 3 169 1.0 . . 18841 3 170 1.0 . . 18841 3 171 1.0 . . 18841 3 172 1.0 . . 18841 3 173 1.0 . . 18841 3 174 1.0 . . 18841 3 175 1.0 . . 18841 3 176 1.0 . . 18841 3 177 1.0 . . 18841 3 178 1.0 . . 18841 3 179 1.0 . . 18841 3 180 1.0 . . 18841 3 181 1.0 . . 18841 3 182 1.0 . . 18841 3 183 1.0 . . 18841 3 184 1.0 . . 18841 3 185 1.0 . . 18841 3 186 1.0 . . 18841 3 187 1.0 . . 18841 3 188 1.0 . . 18841 3 189 1.0 . . 18841 3 190 1.0 . . 18841 3 191 1.0 . . 18841 3 192 1.0 . . 18841 3 193 1.0 . . 18841 3 194 1.0 . . 18841 3 195 1.0 . . 18841 3 196 1.0 . . 18841 3 197 1.0 . . 18841 3 198 1.0 . . 18841 3 199 1.0 . . 18841 3 200 1.0 . . 18841 3 201 1.0 . . 18841 3 202 1.0 . . 18841 3 203 1.0 . . 18841 3 204 1.0 . . 18841 3 205 1.0 . . 18841 3 206 1.0 . . 18841 3 207 1.0 . . 18841 3 208 1.0 . . 18841 3 209 1.0 . . 18841 3 210 1.0 . . 18841 3 211 1.0 . . 18841 3 212 1.0 . . 18841 3 213 1.0 . . 18841 3 214 1.0 . . 18841 3 215 1.0 . . 18841 3 216 1.0 . . 18841 3 217 1.0 . . 18841 3 218 1.0 . . 18841 3 219 1.0 . . 18841 3 220 1.0 . . 18841 3 221 1.0 . . 18841 3 222 1.0 . . 18841 3 223 1.0 . . 18841 3 224 1.0 . . 18841 3 225 1.0 . . 18841 3 226 1.0 . . 18841 3 227 1.0 . . 18841 3 228 1.0 . . 18841 3 229 1.0 . . 18841 3 230 1.0 . . 18841 3 231 1.0 . . 18841 3 232 1.0 . . 18841 3 233 1.0 . . 18841 3 234 1.0 . . 18841 3 235 1.0 . . 18841 3 236 1.0 . . 18841 3 237 1.0 . . 18841 3 238 1.0 . . 18841 3 239 1.0 . . 18841 3 240 1.0 . . 18841 3 241 1.0 . . 18841 3 242 1.0 . . 18841 3 243 1.0 . . 18841 3 244 1.0 . . 18841 3 245 1.0 . . 18841 3 246 1.0 . . 18841 3 247 1.0 . . 18841 3 248 1.0 . . 18841 3 249 1.0 . . 18841 3 250 1.0 . . 18841 3 251 1.0 . . 18841 3 252 1.0 . . 18841 3 253 1.0 . . 18841 3 254 1.0 . . 18841 3 255 1.0 . . 18841 3 256 1.0 . . 18841 3 257 1.0 . . 18841 3 258 1.0 . . 18841 3 259 1.0 . . 18841 3 260 1.0 . . 18841 3 261 1.0 . . 18841 3 262 1.0 . . 18841 3 263 1.0 . . 18841 3 264 1.0 . . 18841 3 265 1.0 . . 18841 3 266 1.0 . . 18841 3 267 1.0 . . 18841 3 268 1.0 . . 18841 3 269 1.0 . . 18841 3 270 1.0 . . 18841 3 271 1.0 . . 18841 3 272 1.0 . . 18841 3 273 1.0 . . 18841 3 274 1.0 . . 18841 3 275 1.0 . . 18841 3 276 1.0 . . 18841 3 277 1.0 . . 18841 3 278 1.0 . . 18841 3 279 1.0 . . 18841 3 280 1.0 . . 18841 3 281 1.0 . . 18841 3 282 1.0 . . 18841 3 283 1.0 . . 18841 3 284 1.0 . . 18841 3 285 1.0 . . 18841 3 286 1.0 . . 18841 3 287 1.0 . . 18841 3 288 1.0 . . 18841 3 289 1.0 . . 18841 3 290 1.0 . . 18841 3 291 1.0 . . 18841 3 292 1.0 . . 18841 3 293 1.0 . . 18841 3 294 1.0 . . 18841 3 295 1.0 . . 18841 3 296 1.0 . . 18841 3 297 1.0 . . 18841 3 298 1.0 . . 18841 3 299 1.0 . . 18841 3 300 1.0 . . 18841 3 301 1.0 . . 18841 3 302 1.0 . . 18841 3 303 1.0 . . 18841 3 304 1.0 . . 18841 3 305 1.0 . . 18841 3 306 1.0 . . 18841 3 307 1.0 . . 18841 3 308 1.0 . . 18841 3 309 1.0 . . 18841 3 310 1.0 . . 18841 3 311 1.0 . . 18841 3 312 1.0 . . 18841 3 313 1.0 . . 18841 3 314 1.0 . . 18841 3 315 1.0 . . 18841 3 316 1.0 . . 18841 3 317 1.0 . . 18841 3 318 1.0 . . 18841 3 319 1.0 . . 18841 3 320 1.0 . . 18841 3 321 1.0 . . 18841 3 322 1.0 . . 18841 3 323 1.0 . . 18841 3 324 1.0 . . 18841 3 325 1.0 . . 18841 3 326 1.0 . . 18841 3 327 1.0 . . 18841 3 328 1.0 . . 18841 3 329 1.0 . . 18841 3 330 1.0 . . 18841 3 331 1.0 . . 18841 3 332 1.0 . . 18841 3 333 1.0 . . 18841 3 334 1.0 . . 18841 3 335 1.0 . . 18841 3 336 1.0 . . 18841 3 337 1.0 . . 18841 3 338 1.0 . . 18841 3 339 1.0 . . 18841 3 340 1.0 . . 18841 3 341 1.0 . . 18841 3 342 1.0 . . 18841 3 343 1.0 . . 18841 3 344 1.0 . . 18841 3 345 1.0 . . 18841 3 346 1.0 . . 18841 3 347 1.0 . . 18841 3 348 1.0 . . 18841 3 349 1.0 . . 18841 3 350 1.0 . . 18841 3 351 1.0 . . 18841 3 352 1.0 . . 18841 3 353 1.0 . . 18841 3 354 1.0 . . 18841 3 355 1.0 . . 18841 3 356 1.0 . . 18841 3 357 1.0 . . 18841 3 358 1.0 . . 18841 3 359 1.0 . . 18841 3 360 1.0 . . 18841 3 361 1.0 . . 18841 3 362 1.0 . . 18841 3 363 1.0 . . 18841 3 364 1.0 . . 18841 3 365 1.0 . . 18841 3 366 1.0 . . 18841 3 367 1.0 . . 18841 3 368 1.0 . . 18841 3 369 1.0 . . 18841 3 370 1.0 . . 18841 3 371 1.0 . . 18841 3 372 1.0 . . 18841 3 373 1.0 . . 18841 3 374 1.0 . . 18841 3 375 1.0 . . 18841 3 376 1.0 . . 18841 3 377 1.0 . . 18841 3 378 1.0 . . 18841 3 379 1.0 . . 18841 3 380 1.0 . . 18841 3 381 1.0 . . 18841 3 382 1.0 . . 18841 3 383 1.0 . . 18841 3 384 1.0 . . 18841 3 385 1.0 . . 18841 3 386 1.0 . . 18841 3 387 1.0 . . 18841 3 388 1.0 . . 18841 3 389 1.0 . . 18841 3 390 1.0 . . 18841 3 391 1.0 . . 18841 3 392 1.0 . . 18841 3 393 1.0 . . 18841 3 394 1.0 . . 18841 3 395 1.0 . . 18841 3 396 1.0 . . 18841 3 397 1.0 . . 18841 3 398 1.0 . . 18841 3 399 1.0 . . 18841 3 400 1.0 . . 18841 3 401 1.0 . . 18841 3 402 1.0 . . 18841 3 403 1.0 . . 18841 3 404 1.0 . . 18841 3 405 1.0 . . 18841 3 406 1.0 . . 18841 3 407 1.0 . . 18841 3 408 1.0 . . 18841 3 409 1.0 . . 18841 3 410 1.0 . . 18841 3 411 1.0 . . 18841 3 412 1.0 . . 18841 3 413 1.0 . . 18841 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 -63755.3671875 . height 18841 3 1 -1496968.1132800 . volume 18841 3 2 -25530.1601562 . height 18841 3 2 -1011489.4838900 . volume 18841 3 3 10383.7587891 . height 18841 3 3 591675.9877930 . volume 18841 3 4 -80508.7421875 . height 18841 3 4 -1782890.2578100 . volume 18841 3 5 -33631.0234375 . height 18841 3 5 -499305.3779300 . volume 18841 3 6 91550.7890625 . height 18841 3 6 1270716.1386700 . volume 18841 3 7 113307.4765620 . height 18841 3 7 1392459.7675800 . 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_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 7 1 4.014 . 9.51607176522 . . . . . . . . . . 8 18841 3 7 2 2.022 . 55.72937470930 . . . . . . . . . . 8 18841 3 7 3 55.130 . 72.98260897660 . . . . . . . . . . 8 18841 3 8 1 4.387 . 23.56967666400 . . . . . . . . . . 8 18841 3 8 2 1.222 . 56.25485643610 . . . . . . . . . . 8 18841 3 8 3 70.828 . 87.54144636770 . . . . . . . . . . 8 18841 3 9 1 4.275 . 22.29101912090 . . . . . . . . . . 8 18841 3 9 2 1.233 . 52.14022727410 . . . . . . . . . . 8 18841 3 9 3 69.693 . 98.40361630380 . . . . . . . . . . 8 18841 3 10 1 4.475 . 30.03660885200 . . . . . . . . . . 8 18841 3 10 2 1.220 . 55.14726964540 . . . . . . . . . . 8 18841 3 10 3 61.380 . 104.54890703200 . . . . . . . . . . 8 18841 3 11 1 1.873 . 56.19719281770 . . . . . . . . . . 8 18841 3 11 2 1.501 . 55.95586805770 . . . . . . . . . . 8 18841 3 11 3 38.536 . 113.06011671200 . . . . . . . . . . 8 18841 3 12 1 1.872 . 32.42036415700 . . . . . . . . . . 8 18841 3 12 2 1.227 . 61.10730483900 . . . . . . . . . . 8 18841 3 12 3 38.552 . 113.31038718300 . . . . . . . . . . 8 18841 3 13 1 1.870 . 62.64819023670 . . . . . . . . . . 8 18841 3 13 2 0.901 . 65.87310237760 . . . . . . . . . . 8 18841 3 13 3 38.558 . 94.63963472230 . . . . . . . . . . 8 18841 3 14 1 1.873 . 28.36173543170 . . . . . . . . . . 8 18841 3 14 2 4.115 . 68.24785081800 . . . . . . . . . . 8 18841 3 14 3 38.550 . 104.42031979000 . . . . . . . . . . 8 18841 3 15 1 1.875 . 117.26654891700 . . . . . . . . . . 8 18841 3 15 2 4.433 . 120.64502793200 . . . . . . . . . . 8 18841 3 15 3 38.556 . 121.97664948800 . . . . . . . . . . 8 18841 3 16 1 3.699 . 24.19673135670 . . . . . . . . . . 8 18841 3 16 2 0.973 . 76.00696385830 . . . . . . . . . . 8 18841 3 16 3 65.580 . 111.33512030000 . . . . . . . . . . 8 18841 3 17 1 3.699 . 21.76258772810 . . . . . . . . . . 8 18841 3 17 2 2.141 . 70.55053319310 . . . . . . . . . . 8 18841 3 17 3 65.427 . 205.72621055500 . . . . . . . . . . 8 18841 3 18 1 3.777 . 23.38922617200 . . . . . . . . . . 8 18841 3 18 2 4.414 . 58.39024258790 . . . . . . . . . . 8 18841 3 18 3 63.969 . 90.22135407630 . . . . . . . . . . 8 18841 3 19 1 3.852 . 80.14327456510 . . . . . . . . . . 8 18841 3 19 2 4.417 . 59.71145378680 . . . . . . . . . . 8 18841 3 19 3 63.992 . 97.86208278500 . . . . . . . . . . 8 18841 3 21 1 3.968 . 30.23170210460 . . . . . . . . . . 8 18841 3 21 2 2.086 . 56.85583594570 . . . . . . . . . . 8 18841 3 21 3 63.346 . 126.35293072100 . . . . . . . . . . 8 18841 3 22 1 3.940 . 56.86171575100 . . . . . . . . . . 8 18841 3 22 2 4.364 . 71.88075265010 . . . . . . . . . . 8 18841 3 22 3 63.433 . 97.80627534670 . . . . . . . . . . 8 18841 3 23 1 3.985 . 55.35523407850 . . . . . . . . . . 8 18841 3 23 2 4.358 . 53.26411472240 . . . . . . . . . . 8 18841 3 23 3 63.383 . 96.13090152790 . . . . . . . . . . 8 18841 3 24 1 3.971 . 24.28415725130 . . . . . . . . . . 8 18841 3 24 2 0.915 . 58.75486256160 . . . . . . . . . . 8 18841 3 24 3 63.210 . 106.30971801200 . . . . . . . . . . 8 18841 3 25 1 4.120 . 19.61096324680 . . . . . . . . . . 8 18841 3 25 2 2.060 . 59.77022194720 . . . . . . . . . . 8 18841 3 25 3 62.231 . 110.90361948800 . . . . . . . . . . 8 18841 3 26 1 4.111 . 18.65229309160 . . . . . . . . . . 8 18841 3 26 2 1.883 . 54.10016687390 . . . . . . . . . . 8 18841 3 26 3 62.053 . 100.58988708400 . . . . . . . . . . 8 18841 3 27 1 4.111 . 21.90341663230 . . . . . . . . . . 8 18841 3 27 2 1.235 . 46.52936932590 . . . . . . . . . . 8 18841 3 27 3 62.170 . 106.53093409500 . . . . . . . . . . 8 18841 3 28 1 4.120 . 21.71952078490 . . . . . . . . . . 8 18841 3 28 2 0.905 . 60.70793872660 . . . . . . . . . . 8 18841 3 28 3 62.199 . 116.26041440000 . . . . . . . . . . 8 18841 3 29 1 4.371 . 22.12478072020 . . . . . . . . . . 8 18841 3 29 2 3.961 . 74.48671305030 . . . . . . . . . . 8 18841 3 29 3 60.336 . 103.57846170600 . . . . . . . . . . 8 18841 3 30 1 4.318 . 31.50217692840 . . . . . . . . . . 8 18841 3 30 2 3.478 . 46.67907799750 . . . . . . . . . . 8 18841 3 30 3 60.229 . 178.41451050300 . . . . . . . . . . 8 18841 3 31 1 4.319 . 40.16638455750 . . . . . . . . . . 8 18841 3 31 2 3.262 . 64.33483505320 . . . . . . . . . . 8 18841 3 31 3 59.987 . 147.97184056200 . . . . . . . . . . 8 18841 3 32 1 4.300 . 26.88970731380 . . . . . . . . . . 8 18841 3 32 2 2.981 . 65.97948561700 . . . . . . . . . . 8 18841 3 32 3 60.459 . 133.44594106600 . . . . . . . . . . 8 18841 3 33 1 4.302 . 20.36808010790 . . . . . . . . . . 8 18841 3 33 2 1.232 . 56.50408491220 . . . . . . . . . . 8 18841 3 33 3 62.568 . 111.11865072600 . . . . . . . . . . 8 18841 3 41 1 4.097 . 31.16970012710 . . . . . . . . . . 8 18841 3 41 2 3.099 . 63.16805113740 . . . . . . . . . . 8 18841 3 41 3 58.257 . 81.85627933820 . . . . . . . . . . 8 18841 3 42 1 4.100 . 27.49092184060 . . . . . . . . . . 8 18841 3 42 2 1.826 . 80.60503620900 . . . . . . . . . . 8 18841 3 42 3 58.457 . 109.87161338000 . . . . . . . . . . 8 18841 3 43 1 4.099 . 50.59762886530 . . . . . . . . . . 8 18841 3 43 2 1.460 . 51.83180167280 . . . . . . . . . . 8 18841 3 43 3 58.494 . 108.00379019900 . . . . . . . . . . 8 18841 3 44 1 4.105 . 42.96358251710 . . . . . . . . . . 8 18841 3 44 2 1.588 . 62.26679635540 . . . . . . . . . . 8 18841 3 44 3 58.448 . 163.83395423800 . . . . . . . . . . 8 18841 3 45 1 4.136 . 51.78842984430 . . . . . . . . . . 8 18841 3 45 2 1.897 . 71.23516081430 . . . . . . . . . . 8 18841 3 45 3 58.629 . 113.65731383600 . . . . . . . . . . 8 18841 3 46 1 4.137 . 31.98108133660 . . . . . . . . . . 8 18841 3 46 2 1.535 . 64.75822318740 . . . . . . . . . . 8 18841 3 46 3 58.671 . 116.94419935300 . . . . . . . . . . 8 18841 3 47 1 4.156 . 32.55257967260 . . . . . . . . . . 8 18841 3 47 2 1.679 . 330.61894666800 . . . . . . . . . . 8 18841 3 47 3 58.560 . 160.43200183800 . . . . . . . . . . 8 18841 3 48 1 4.152 . 27.04604031750 . . . . . . . . . . 8 18841 3 48 2 2.090 . 63.64548882060 . . . . . . . . . . 8 18841 3 48 3 58.475 . 111.30764808200 . . . . . . . . . . 8 18841 3 49 1 4.151 . 33.30582050880 . . . . . . . . . . 8 18841 3 49 2 1.930 . 87.06438628420 . . . . . . . . . . 8 18841 3 49 3 58.518 . 152.46074350700 . . . . . . . . . . 8 18841 3 50 1 4.162 . 38.11898207870 . . . . . . . . . . 8 18841 3 50 2 1.896 . 87.20465773290 . . . . . . . . . . 8 18841 3 50 3 58.438 . 160.03444575600 . . . . . . . . . . 8 18841 3 51 1 4.187 . 15.90806747210 . . . . . . . . . . 8 18841 3 51 2 2.856 . 42.26588942170 . . . . . . . . . . 8 18841 3 51 3 58.169 . 114.84192739800 . . . . . . . . . . 8 18841 3 52 1 4.186 . 58.26871278470 . . . . . . . . . . 8 18841 3 52 2 2.284 . 49.38584509630 . . . . . . . . . . 8 18841 3 52 3 58.304 . 137.72096344200 . . . . . . . . . . 8 18841 3 53 1 4.177 . 49.85687744260 . . . . . . . . . . 8 18841 3 53 2 1.896 . 96.53592630690 . . . . . . . . . . 8 18841 3 53 3 57.947 . 183.11542418100 . . . . . . . . . . 8 18841 3 54 1 4.179 . 27.92374461950 . . . . . . . . . . 8 18841 3 54 2 1.683 . 185.49462059600 . . . . . . . . . . 8 18841 3 54 3 57.949 . 101.37449939300 . . . . . . . . . . 8 18841 3 55 1 4.177 . 22.73805399110 . . . . . . . . . . 8 18841 3 55 2 1.529 . 190.10170120400 . . . . . . . . . . 8 18841 3 55 3 57.790 . 97.70271515180 . . . . . . . . . . 8 18841 3 56 1 4.507 . 36.09698909640 . . . . . . . . . . 8 18841 3 56 2 3.181 . 129.24491173600 . . . . . . . . . . 8 18841 3 56 3 59.491 . 131.92130486400 . . . . . . . . . . 8 18841 3 57 1 4.503 . 27.71185525910 . . . . . . . . . . 8 18841 3 57 2 3.068 . 138.30421670600 . . . . . . . . . . 8 18841 3 57 3 59.302 . 110.58804856100 . . . . . . . . . . 8 18841 3 62 1 4.503 . 18.67727191860 . . . . . . . . . . 8 18841 3 62 2 3.205 . 47.91278040260 . . . . . . . . . . 8 18841 3 62 3 57.398 . 112.31649698000 . . . . . . . . . . 8 18841 3 63 1 4.610 . 18.15142454240 . . . . . . . . . . 8 18841 3 63 2 3.201 . 53.90841966420 . . . . . . . . . . 8 18841 3 63 3 57.947 . 68.40438536310 . . . . . . . . . . 8 18841 3 64 1 4.614 . 106.22203133900 . . . . . . . . . . 8 18841 3 64 2 2.924 . 61.91676118060 . . . . . . . . . . 8 18841 3 64 3 57.615 . 89.46306331640 . . . . . . . . . . 8 18841 3 65 1 4.009 . 25.58477893540 . . . . . . . . . . 8 18841 3 65 2 1.832 . 60.45141785100 . . . . . . . . . . 8 18841 3 65 3 58.038 . 124.45979282600 . . . . . . . . . . 8 18841 3 66 1 4.008 . 25.55980010830 . . . . . . . . . . 8 18841 3 66 2 1.604 . 208.80756378400 . . . . . . . . . . 8 18841 3 66 3 58.021 . 120.81591230400 . . . . . . . . . . 8 18841 3 67 1 4.050 . 26.57617996740 . . . . . . . . . . 8 18841 3 67 2 1.609 . 64.55875461360 . . . . . . . . . . 8 18841 3 67 3 57.144 . 123.26424791000 . . . . . . . . . . 8 18841 3 68 1 4.045 . 26.15110923820 . . . . . . . . . . 8 18841 3 68 2 1.418 . 103.35260395600 . . . . . . . . . . 8 18841 3 68 3 57.058 . 129.50231131300 . . . . . . . . . . 8 18841 3 79 1 4.259 . 29.40653947320 . . . . . . . . . . 8 18841 3 79 2 1.618 . 58.92258774950 . . . . . . . . . . 8 18841 3 79 3 56.698 . 152.27778716300 . . . . . . . . . . 8 18841 3 80 1 4.259 . 31.03274724780 . . . . . . . . . . 8 18841 3 80 2 1.840 . 88.15524345260 . . . . . . . . . . 8 18841 3 80 3 56.698 . 243.15473480600 . . . . . . . . . . 8 18841 3 81 1 4.322 . 91.55902919400 . . . . . . . . . . 8 18841 3 81 2 2.102 . 70.85466914760 . . . . . . . . . . 8 18841 3 81 3 57.035 . 107.41867509800 . . . . . . . . . . 8 18841 3 84 1 4.324 . 23.60628356570 . . . . . . . . . . 8 18841 3 84 2 1.622 . 111.63376700600 . . . . . . . . . . 8 18841 3 84 3 55.343 . 179.99164597100 . . . . . . . . . . 8 18841 3 85 1 4.322 . 37.09485016990 . . . . . . . . . . 8 18841 3 85 2 0.877 . 59.18468516590 . . . . . . . . . . 8 18841 3 85 3 55.483 . 109.68204069000 . . . . . . . . . . 8 18841 3 86 1 4.363 . 49.23972814680 . . . . . . . . . . 8 18841 3 86 2 1.604 . 73.34909873240 . . . . . . . . . . 8 18841 3 86 3 55.030 . 87.25032715330 . . . . . . . . . . 8 18841 3 87 1 4.362 . 23.08861890860 . . . . . . . . . . 8 18841 3 87 2 0.867 . 58.05307635340 . . . . . . . . . . 8 18841 3 87 3 54.916 . 133.36021623800 . . . . . . . . . . 8 18841 3 88 1 4.426 . 32.93975149180 . . . . . . . . . . 8 18841 3 88 2 2.853 . 145.17837562200 . . . . . . . . . . 8 18841 3 88 3 55.420 . 93.91557636000 . . . . . . . . . . 8 18841 3 89 1 4.428 . 20.15360673090 . . . . . . . . . . 8 18841 3 89 2 2.714 . 146.41079113300 . . . . . . . . . . 8 18841 3 89 3 55.459 . 156.06837796100 . . . . . . . . . . 8 18841 3 90 1 4.427 . 25.11879461020 . . . . . . . . . . 8 18841 3 90 2 1.493 . 61.19867431480 . . . . . . . . . . 8 18841 3 90 3 55.438 . 81.51165402320 . . . . . . . . . . 8 18841 3 94 1 4.309 . 27.58868380160 . . . . . . . . . . 8 18841 3 94 2 1.432 . 58.38509501190 . . . . . . . . . . 8 18841 3 94 3 53.311 . 229.71434751900 . . . . . . . . . . 8 18841 3 95 1 4.309 . 27.67481768790 . . . . . . . . . . 8 18841 3 95 2 0.889 . 55.31027622190 . . . . . . . . . . 8 18841 3 95 3 53.350 . 134.42257123700 . . . . . . . . . . 8 18841 3 99 1 4.189 . 26.11493300590 . . . . . . . . . . 8 18841 3 99 2 1.402 . 59.97741188520 . . . . . . . . . . 8 18841 3 99 3 53.484 . 101.62333152800 . . . . . . . . . . 8 18841 3 100 1 4.187 . 32.63828288950 . . . . . . . . . . 8 18841 3 100 2 1.519 . 59.74019442000 . . . . . . . . . . 8 18841 3 100 3 54.442 . 111.70577949700 . . . . . . . . . . 8 18841 3 101 1 4.180 . 25.92759180310 . . . . . . . . . . 8 18841 3 101 2 1.851 . 64.69387848620 . . . . . . . . . . 8 18841 3 101 3 54.332 . 90.69571730220 . . . . . . . . . . 8 18841 3 102 1 3.798 . 32.90012990410 . . . . . . . . . . 8 18841 3 102 2 2.179 . 112.46510054600 . . . . . . . . . . 8 18841 3 102 3 58.027 . 92.79223591320 . . . . . . . . . . 8 18841 3 103 1 3.806 . 22.90816841670 . . . . . . . . . . 8 18841 3 103 2 1.912 . 67.36675737570 . . . . . . . . . . 8 18841 3 103 3 57.960 . 100.05554524500 . . . . . . . . . . 8 18841 3 104 1 3.793 . 29.70843874490 . . . . . . . . . . 8 18841 3 104 2 2.971 . 74.48757097970 . . . . . . . . . . 8 18841 3 104 3 58.141 . 115.42128915400 . . . . . . . . . . 8 18841 3 105 1 3.878 . 25.95127862190 . . . . . . . . . . 8 18841 3 105 2 4.448 . 60.83148055300 . . . . . . . . . . 8 18841 3 105 3 51.106 . 92.64725164040 . . . . . . . . . . 8 18841 3 106 1 3.878 . 25.13731339570 . . . . . . . . . . 8 18841 3 106 2 3.650 . 61.51653713890 . . . . . . . . . . 8 18841 3 106 3 51.097 . 79.55235267030 . . . . . . . . . . 8 18841 3 107 1 3.876 . 25.60717374580 . . . . . . . . . . 8 18841 3 107 2 2.023 . 85.85642175960 . . . . . . . . . . 8 18841 3 107 3 51.099 . 87.31073726700 . . . . . . . . . . 8 18841 3 108 1 3.877 . 18.53601234500 . . . . . . . . . . 8 18841 3 108 2 0.903 . 46.93731473180 . . . . . . . . . . 8 18841 3 108 3 51.104 . 159.98266565900 . . . . . . . . . . 8 18841 3 112 1 3.719 . 66.16719016400 . . . . . . . . . . 8 18841 3 112 2 1.996 . 67.29683613370 . . . . . . . . . . 8 18841 3 112 3 50.783 . 88.17143755300 . . . . . . . . . . 8 18841 3 113 1 3.718 . 20.36205073590 . . . . . . . . . . 8 18841 3 113 2 4.745 . 67.78435448680 . . . . . . . . . . 8 18841 3 113 3 50.821 . 88.45968009530 . . . . . . . . . . 8 18841 3 114 1 3.651 . 24.80698994150 . . . . . . . . . . 8 18841 3 114 2 3.875 . 61.20725360830 . . . . . . . . . . 8 18841 3 114 3 51.096 . 86.24493026170 . . . . . . . . . . 8 18841 3 115 1 3.650 . 24.34832699670 . . . . . . . . . . 8 18841 3 115 2 4.448 . 61.17979986910 . . . . . . . . . . 8 18841 3 115 3 51.109 . 96.17865428440 . . . . . . . . . . 8 18841 3 116 1 3.781 . 23.24064521810 . . . . . . . . . . 8 18841 3 116 2 4.756 . 104.84990515400 . . . . . . . . . . 8 18841 3 116 3 50.836 . 86.12468536880 . . . . . . . . . . 8 18841 3 117 1 3.651 . 24.47623581790 . . . . . . . . . . 8 18841 3 117 2 2.036 . 88.17840754500 . . . . . . . . . . 8 18841 3 117 3 51.088 . 89.39603685690 . . . . . . . . . . 8 18841 3 118 1 3.654 . 59.19465206310 . . . . . . . . . . 8 18841 3 118 2 2.295 . 57.76052244510 . . . . . . . . . . 8 18841 3 118 3 51.142 . 85.21910899840 . . . . . . . . . . 8 18841 3 119 1 3.650 . 23.06105606500 . . . . . . . . . . 8 18841 3 119 2 0.908 . 53.43226887500 . . . . . . . . . . 8 18841 3 119 3 51.108 . 107.65686354600 . . . . . . . . . . 8 18841 3 129 1 3.102 . 93.93933914360 . . . . . . . . . . 8 18841 3 129 2 1.809 . 69.41420576920 . . . . . . . . . . 8 18841 3 129 3 43.528 . 88.45968009530 . . . . . . . . . . 8 18841 3 130 1 3.101 . 22.20833059000 . . . . . . . . . . 8 18841 3 130 2 1.588 . 141.96285641800 . . . . . . . . . . 8 18841 3 130 3 43.536 . 91.32542082020 . . . . . . . . . . 8 18841 3 131 1 3.100 . 20.84784585490 . . . . . . . . . . 8 18841 3 131 2 1.458 . 137.86066723200 . . . . . . . . . . 8 18841 3 131 3 43.553 . 88.70793689570 . . . . . . . . . . 8 18841 3 135 1 2.815 . 19.01276340600 . . . . . . . . . . 8 18841 3 135 2 3.005 . 59.65783320240 . . . . . . . . . . 8 18841 3 135 3 42.165 . 72.03474552660 . . . . . . . . . . 8 18841 3 136 1 2.807 . 27.60332656230 . . . . . . . . . . 8 18841 3 136 2 1.397 . 59.22586577470 . . . . . . . . . . 8 18841 3 136 3 42.030 . 104.59809812500 . . . . . . . . . . 8 18841 3 137 1 2.803 . 32.34198232040 . . . . . . . . . . 8 18841 3 137 2 1.106 . 54.64452304640 . . . . . . . . . . 8 18841 3 137 3 41.895 . 81.15034401010 . . . . . . . . . . 8 18841 3 138 1 2.724 . 20.16049744180 . . . . . . . . . . 8 18841 3 138 2 1.391 . 61.32907957600 . . . . . . . . . . 8 18841 3 138 3 42.009 . 102.40664933500 . . . . . . . . . . 8 18841 3 139 1 2.726 . 24.89570784450 . . . . . . . . . . 8 18841 3 139 2 1.115 . 56.01978379420 . . . . . . . . . . 8 18841 3 139 3 41.899 . 75.82850066420 . . . . . . . . . . 8 18841 3 143 1 2.653 . 21.34354637090 . . . . . . . . . . 8 18841 3 143 2 2.544 . 179.22487290700 . . . . . . . . . . 8 18841 3 143 3 41.618 . 114.96102162200 . . . . . . . . . . 8 18841 3 145 1 2.536 . 20.88316074830 . . . . . . . . . . 8 18841 3 145 2 2.652 . 126.12376476100 . . . . . . . . . . 8 18841 3 145 3 41.636 . 106.00939344700 . . . . . . . . . . 8 18841 3 146 1 2.537 . 17.32066320840 . . . . . . . . . . 8 18841 3 146 2 4.680 . 65.70366133100 . . . . . . . . . . 8 18841 3 146 3 41.600 . 91.15195749390 . . . . . . . . . . 8 18841 3 147 1 2.514 . 23.56235528360 . . . . . . . . . . 8 18841 3 147 2 2.749 . 62.75967676690 . . . . . . . . . . 8 18841 3 147 3 41.115 . 105.93690131000 . . . . . . . . . . 8 18841 3 148 1 2.929 . 29.19723412940 . . . . . . . . . . 8 18841 3 148 2 3.200 . 60.34160289420 . . . . . . . . . . 8 18841 3 148 3 39.947 . 89.93972787980 . . . . . . . . . . 8 18841 3 149 1 3.198 . 27.40737197080 . . . . . . . . . . 8 18841 3 149 2 2.926 . 62.92868884880 . . . . . . . . . . 8 18841 3 149 3 39.927 . 96.28221447930 . . . . . . . . . . 8 18841 3 150 1 2.930 . 19.49812785570 . . . . . . . . . . 8 18841 3 150 2 4.609 . 48.16157991400 . . . . . . . . . . 8 18841 3 150 3 39.979 . 82.29353349420 . . . . . . . . . . 8 18841 3 151 1 3.196 . 20.38444554630 . . . . . . . . . . 8 18841 3 151 2 4.612 . 48.75140634210 . . . . . . . . . . 8 18841 3 151 3 39.962 . 74.64273643330 . . . . . . . . . . 8 18841 3 152 1 2.919 . 31.43068580270 . . . . . . . . . . 8 18841 3 152 2 2.136 . 85.15206176330 . . . . . . . . . . 8 18841 3 152 3 39.966 . 94.31974878710 . . . . . . . . . . 8 18841 3 153 1 3.196 . 28.17999293150 . . . . . . . . . . 8 18841 3 153 2 2.139 . 76.17726283430 . . . . . . . . . . 8 18841 3 153 3 40.051 . 108.12719943100 . . . . . . . . . . 8 18841 3 154 1 3.202 . 35.87304099180 . . . . . . . . . . 8 18841 3 154 2 3.062 . 151.92598995800 . . . . . . . . . . 8 18841 3 154 3 38.778 . 103.18795347200 . . . . . . . . . . 8 18841 3 155 1 3.065 . 34.28128677190 . . . . . . . . . . 8 18841 3 155 2 3.203 . 238.74457948400 . . . . . . . . . . 8 18841 3 155 3 38.791 . 102.24325436100 . . . . . . . . . . 8 18841 3 156 1 3.204 . 34.54528713360 . . . . . . . . . . 8 18841 3 156 2 4.496 . 64.89463395400 . . . . . . . . . . 8 18841 3 156 3 38.713 . 106.39601817400 . . . . . . . . . . 8 18841 3 158 1 3.207 . 36.42042183970 . . . . . . . . . . 8 18841 3 158 2 4.180 . 69.07532367600 . . . . . . . . . . 8 18841 3 158 3 38.824 . 111.86399646200 . . . . . . . . . . 8 18841 3 159 1 3.065 . 37.36660258130 . . . . . . . . . . 8 18841 3 159 2 4.204 . 83.27190959310 . . . . . . . . . . 8 18841 3 159 3 38.692 . 108.00580386900 . . . . . . . . . . 8 18841 3 160 1 3.205 . 29.44271570550 . . . . . . . . . . 8 18841 3 160 2 7.255 . 73.11617091390 . . . . . . . . . . 8 18841 3 160 3 38.825 . 75.76751521610 . . . . . . . . . . 8 18841 3 161 1 3.065 . 35.23005153010 . . . . . . . . . . 8 18841 3 161 2 7.263 . 72.04397370890 . . . . . . . . . . 8 18841 3 161 3 38.835 . 83.08691965360 . . . . . . . . . . 8 18841 3 162 1 3.199 . 30.42205799340 . . . . . . . . . . 8 18841 3 162 2 7.191 . 65.18847475640 . . . . . . . . . . 8 18841 3 162 3 39.946 . 90.31772259100 . . . . . . . . . . 8 18841 3 163 1 2.930 . 32.24809638430 . . . . . . . . . . 8 18841 3 163 2 7.195 . 73.29268987760 . . . . . . . . . . 8 18841 3 163 3 39.961 . 95.31795399850 . . . . . . . . . . 8 18841 3 164 1 3.053 . 22.59076504550 . . . . . . . . . . 8 18841 3 164 2 2.927 . 147.06367536800 . . . . . . . . . . 8 18841 3 164 3 38.894 . 103.50956541000 . . . . . . . . . . 8 18841 3 165 1 2.927 . 23.44822788420 . . . . . . . . . . 8 18841 3 165 2 3.053 . 149.49118646300 . . . . . . . . . . 8 18841 3 165 3 38.897 . 105.20967860900 . . . . . . . . . . 8 18841 3 167 1 2.980 . 34.09566824680 . . . . . . . . . . 8 18841 3 167 2 4.296 . 67.91411630090 . . . . . . . . . . 8 18841 3 167 3 38.453 . 105.55372858900 . . . . . . . . . . 8 18841 3 168 1 2.979 . 34.05303197300 . . . . . . . . . . 8 18841 3 168 2 7.028 . 60.24572928940 . . . . . . . . . . 8 18841 3 168 3 38.445 . 103.27252763100 . . . . . . . . . . 8 18841 3 169 1 2.934 . 26.38237872310 . . . . . . . . . . 8 18841 3 169 2 4.536 . 60.88510113740 . . . . . . . . . . 8 18841 3 169 3 38.868 . 106.34769008300 . . . . . . . . . . 8 18841 3 170 1 2.933 . 28.43322655740 . . . . . . . . . . 8 18841 3 170 2 7.119 . 55.00142165590 . . . . . . . . . . 8 18841 3 170 3 38.889 . 102.19722760800 . . . . . . . . . . 8 18841 3 174 1 2.778 . 27.89015240390 . . . . . . . . . . 8 18841 3 174 2 4.680 . 58.46145072400 . . . . . . . . . . 8 18841 3 174 3 38.829 . 106.74064348900 . . . . . . . . . . 8 18841 3 175 1 2.774 . 29.85701969890 . . . . . . . . . . 8 18841 3 175 2 2.853 . 104.88743956300 . . . . . . . . . . 8 18841 3 175 3 38.705 . 102.75817866300 . . . . . . . . . . 8 18841 3 176 1 2.726 . 140.21520026100 . . . . . . . . . . 8 18841 3 176 2 2.825 . 137.90699541700 . . . . . . . . . . 8 18841 3 176 3 38.429 . 105.63542607600 . . . . . . . . . . 8 18841 3 177 1 2.720 . 36.46951815490 . . . . . . . . . . 8 18841 3 177 2 4.427 . 61.19695845610 . . . . . . . . . . 8 18841 3 177 3 38.419 . 111.20581389000 . . . . . . . . . . 8 18841 3 182 1 1.501 . 43.48598453790 . . . . . . . . . . 8 18841 3 182 2 0.831 . 60.00100494230 . . . . . . . . . . 8 18841 3 182 3 42.177 . 84.47635226770 . . . . . . . . . . 8 18841 3 183 1 1.504 . 45.35336719420 . . . . . . . . . . 8 18841 3 183 2 3.658 . 66.77864680640 . . . . . . . . . . 8 18841 3 183 3 42.184 . 92.92456282880 . . . . . . . . . . 8 18841 3 184 1 1.493 . 48.50759011280 . . . . . . . . . . 8 18841 3 184 2 4.424 . 65.52435409690 . . . . . . . . . . 8 18841 3 184 3 42.189 . 110.22774538300 . . . . . . . . . . 8 18841 3 185 1 1.816 . 31.74765850460 . . . . . . . . . . 8 18841 3 185 2 1.476 . 56.45303811590 . . . . . . . . . . 8 18841 3 185 3 38.865 . 103.38299183900 . . . . . . . . . . 8 18841 3 186 1 1.817 . 33.64518802110 . . . . . . . . . . 8 18841 3 186 2 1.156 . 57.07160517720 . . . . . . . . . . 8 18841 3 186 3 38.847 . 104.19536403400 . . . . . . . . . . 8 18841 3 187 1 1.815 . 39.52554844300 . . . . . . . . . . 8 18841 3 187 2 0.899 . 79.88566244910 . . . . . . . . . . 8 18841 3 187 3 38.857 . 97.00886184640 . . . . . . . . . . 8 18841 3 188 1 1.814 . 37.62715758760 . . . . . . . . . . 8 18841 3 188 2 4.445 . 59.09288672550 . . . . . . . . . . 8 18841 3 188 3 38.855 . 104.61305682000 . . . . . . . . . . 8 18841 3 189 1 1.804 . 33.24165076350 . . . . . . . . . . 8 18841 3 189 2 3.644 . 66.43890678380 . . . . . . . . . . 8 18841 3 189 3 38.868 . 83.70655481940 . . . . . . . . . . 8 18841 3 190 1 2.022 . 26.63647368790 . . . . . . . . . . 8 18841 3 190 2 1.854 . 91.48829897690 . . . . . . . . . . 8 18841 3 190 3 36.120 . 101.01951805900 . . . . . . . . . . 8 18841 3 191 1 2.023 . 17.37320487910 . . . . . . . . . . 8 18841 3 191 2 4.178 . 49.37126029740 . . . . . . . . . . 8 18841 3 191 3 36.071 . 112.31505864400 . . . . . . . . . . 8 18841 3 192 1 2.080 . 25.35480145880 . . . . . . . . . . 8 18841 3 192 2 1.826 . 97.43718108890 . . . . . . . . . . 8 18841 3 192 3 36.144 . 101.11214690000 . . . . . . . . . . 8 18841 3 193 1 2.020 . 25.14377343720 . . . . . . . . . . 8 18841 3 193 2 2.068 . 74.59095146640 . . . . . . . . . . 8 18841 3 193 3 36.121 . 100.42232093500 . . . . . . . . . . 8 18841 3 194 1 2.080 . 18.66047581080 . . . . . . . . . . 8 18841 3 194 2 4.180 . 50.49128706360 . . . . . . . . . . 8 18841 3 194 3 36.101 . 96.09177878770 . . . . . . . . . . 8 18841 3 195 1 2.189 . 24.21051277850 . . . . . . . . . . 8 18841 3 195 2 1.915 . 70.50935258430 . . . . . . . . . . 8 18841 3 195 3 36.129 . 100.32796609100 . . . . . . . . . . 8 18841 3 196 1 2.190 . 23.28974153330 . . . . . . . . . . 8 18841 3 196 2 3.795 . 66.73961102100 . . . . . . . . . . 8 18841 3 196 3 36.112 . 112.08550021200 . . . . . . . . . . 8 18841 3 203 1 2.421 . 27.80617186460 . . . . . . . . . . 8 18841 3 203 2 2.094 . 66.59462096080 . . . . . . . . . . 8 18841 3 203 3 36.464 . 109.69671171700 . . . . . . . . . . 8 18841 3 204 1 2.421 . 28.34450865440 . . . . . . . . . . 8 18841 3 204 2 2.274 . 153.11293521400 . . . . . . . . . . 8 18841 3 204 3 36.489 . 121.19419468200 . . . . . . . . . . 8 18841 3 205 1 2.411 . 30.83593131740 . . . . . . . . . . 8 18841 3 205 2 1.545 . 98.73565715990 . . . . . . . . . . 8 18841 3 205 3 36.521 . 130.86729221500 . . . . . . . . . . 8 18841 3 206 1 2.425 . 25.96161468820 . . . . . . . . . . 8 18841 3 206 2 4.148 . 60.86065015090 . . . . . . . . . . 8 18841 3 206 3 36.522 . 107.75956074000 . . . . . . . . . . 8 18841 3 207 1 2.415 . 34.03192917090 . . . . . . . . . . 8 18841 3 207 2 2.139 . 66.23085891650 . . . . . . . . . . 8 18841 3 207 3 34.091 . 104.95710680000 . . . . . . . . . . 8 18841 3 208 1 2.419 . 31.42724044730 . . . . . . . . . . 8 18841 3 208 2 4.207 . 56.83567460600 . . . . . . . . . . 8 18841 3 208 3 34.107 . 94.09939570590 . . . . . . . . . . 8 18841 3 209 1 2.323 . 19.97574025550 . . . . . . . . . . 8 18841 3 209 2 2.125 . 63.78833405740 . . . . . . . . . . 8 18841 3 209 3 34.393 . 106.55078313200 . . . . . . . . . . 8 18841 3 210 1 2.324 . 16.78577177410 . . . . . . . . . . 8 18841 3 210 2 1.959 . 181.65281296700 . . . . . . . . . . 8 18841 3 210 3 34.430 . 123.42764288400 . . . . . . . . . . 8 18841 3 211 1 3.209 . 23.10283099990 . . . . . . . . . . 8 18841 3 211 2 4.505 . 61.13733236630 . . . . . . . . . . 8 18841 3 211 3 29.919 . 94.92212392040 . . . . . . . . . . 8 18841 3 212 1 3.208 . 24.87202102570 . . . . . . . . . . 8 18841 3 212 2 7.207 . 60.86386738600 . . . . . . . . . . 8 18841 3 212 3 29.920 . 97.35866517120 . . . . . . . . . . 8 18841 3 229 1 2.145 . 32.60210665730 . . . . . . . . . . 8 18841 3 229 2 0.965 . 77.55595529950 . . . . . . . . . . 8 18841 3 229 3 31.931 . 98.87927403210 . . . . . . . . . . 8 18841 3 230 1 2.144 . 26.25662324900 . . . . . . . . . . 8 18841 3 230 2 3.699 . 66.77478612430 . . . . . . . . . . 8 18841 3 230 3 31.936 . 96.01065663500 . . . . . . . . . . 8 18841 3 231 1 2.143 . 30.31352929660 . . . . . . . . . . 8 18841 3 231 2 4.504 . 59.85730177620 . . . . . . . . . . 8 18841 3 231 3 31.972 . 99.05302502560 . . . . . . . . . . 8 18841 3 234 1 2.106 . 52.15148417530 . . . . . . . . . . 8 18841 3 234 2 4.217 . 70.27942751850 . . . . . . . . . . 8 18841 3 234 3 32.225 . 114.12218404400 . . . . . . . . . . 8 18841 3 235 1 2.082 . 36.38812163230 . . . . . . . . . . 8 18841 3 235 2 0.912 . 59.20012789420 . . . . . . . . . . 8 18841 3 235 3 32.512 . 126.49475065500 . . . . . . . . . . 8 18841 3 240 1 2.009 . 30.20241658320 . . . . . . . . . . 8 18841 3 240 2 2.563 . 103.49158851100 . . . . . . . . . . 8 18841 3 240 3 32.326 . 86.12295936560 . . . . . . . . . . 8 18841 3 241 1 2.008 . 51.13295096910 . . . . . . . . . . 8 18841 3 241 2 4.222 . 69.12036496690 . . . . . . . . . . 8 18841 3 241 3 32.181 . 107.51907095400 . . . . . . . . . . 8 18841 3 248 1 1.805 . 110.28022939500 . . . . . . . . . . 8 18841 3 248 2 4.167 . 66.05369650570 . . . . . . . . . . 8 18841 3 248 3 32.403 . 119.50098549700 . . . . . . . . . . 8 18841 3 249 1 1.798 . 99.85286111170 . . . . . . . . . . 8 18841 3 249 2 1.440 . 71.44363764630 . . . . . . . . . . 8 18841 3 249 3 32.571 . 176.27901298600 . . . . . . . . . . 8 18841 3 250 1 1.797 . 22.83280126610 . . . . . . . . . . 8 18841 3 250 2 1.368 . 62.56578473380 . . . . . . . . . . 8 18841 3 250 3 33.332 . 98.66409896060 . . . . . . . . . . 8 18841 3 251 1 1.726 . 25.64162730040 . . . . . . . . . . 8 18841 3 251 2 1.374 . 63.44516231740 . . . . . . . . . . 8 18841 3 251 3 33.342 . 103.07633859500 . . . . . . . . . . 8 18841 3 252 1 1.604 . 31.83163904380 . . . . . . . . . . 8 18841 3 252 2 1.490 . 141.50257732200 . . . . . . . . . . 8 18841 3 252 3 32.309 . 91.76008597130 . . . . . . . . . . 8 18841 3 253 1 1.491 . 31.99098673350 . . . . . . . . . . 8 18841 3 253 2 1.599 . 138.34282352600 . . . . . . . . . . 8 18841 3 253 3 32.300 . 92.88026207880 . . . . . . . . . . 8 18841 3 254 1 1.603 . 28.48361488090 . . . . . . . . . . 8 18841 3 254 2 1.120 . 58.85223754290 . . . . . . . . . . 8 18841 3 254 3 32.292 . 95.14995634910 . . . . . . . . . . 8 18841 3 255 1 1.487 . 32.03362300730 . . . . . . . . . . 8 18841 3 255 2 1.117 . 62.24406122760 . . . . . . . . . . 8 18841 3 255 3 32.300 . 92.08630058510 . . . . . . . . . . 8 18841 3 256 1 1.607 . 33.64561869050 . . . . . . . . . . 8 18841 3 256 2 4.042 . 63.29759846920 . . . . . . . . . . 8 18841 3 256 3 32.324 . 88.54396658720 . . . . . . . . . . 8 18841 3 257 1 1.491 . 31.93844506280 . . . . . . . . . . 8 18841 3 257 2 4.043 . 62.25006673300 . . . . . . . . . . 8 18841 3 257 3 32.327 . 90.21013505520 . . . . . . . . . . 8 18841 3 258 1 1.598 . 36.35280673890 . . . . . . . . . . 8 18841 3 258 2 3.666 . 59.60721537080 . . . . . . . . . . 8 18841 3 258 3 32.333 . 91.37403657830 . . . . . . . . . . 8 18841 3 259 1 1.494 . 44.17161027330 . . . . . . . . . . 8 18841 3 259 2 3.665 . 60.88981974880 . . . . . . . . . . 8 18841 3 259 3 32.289 . 101.87446500100 . . . . . . . . . . 8 18841 3 267 1 1.916 . 34.89412937330 . . . . . . . . . . 8 18841 3 267 2 3.809 . 84.47815825900 . . . . . . . . . . 8 18841 3 267 3 29.859 . 99.24806339260 . . . . . . . . . . 8 18841 3 270 1 1.918 . 185.67235878800 . . . . . . . . . . 8 18841 3 270 2 2.072 . 218.91525842000 . . . . . . . . . . 8 18841 3 270 3 29.955 . 157.20495110000 . . . . . . . . . . 8 18841 3 273 1 2.032 . 79.81725780520 . . . . . . . . . . 8 18841 3 273 2 2.287 . 71.34926541780 . . . . . . . . . . 8 18841 3 273 3 30.635 . 271.71951321500 . . . . . . . . . . 8 18841 3 274 1 2.033 . 66.04143468990 . . . . . . . . . . 8 18841 3 274 2 4.276 . 62.63527701110 . . . . . . . . . . 8 18841 3 274 3 30.654 . 223.48232512800 . . . . . . . . . . 8 18841 3 275 1 2.086 . 65.71283391350 . . . . . . . . . . 8 18841 3 275 2 4.277 . 60.41452688900 . . . . . . . . . . 8 18841 3 275 3 30.659 . 234.44474708600 . . . . . . . . . . 8 18841 3 285 1 2.119 . 21.18936671440 . . . . . . . . . . 8 18841 3 285 2 1.942 . 184.42220890800 . . . . . . . . . . 8 18841 3 285 3 30.629 . 155.40012703700 . . . . . . . . . . 8 18841 3 286 1 2.074 . 69.87137794700 . . . . . . . . . . 8 18841 3 286 2 4.232 . 113.90599288900 . . . . . . . . . . 8 18841 3 286 3 30.138 . 147.31034981700 . . . . . . . . . . 8 18841 3 287 1 2.011 . 74.85379260360 . . . . . . . . . . 8 18841 3 287 2 4.232 . 80.36481599100 . . . . . . . . . . 8 18841 3 287 3 30.138 . 186.44804878500 . . . . . . . . . . 8 18841 3 288 1 2.136 . 38.61166790870 . . . . . . . . . . 8 18841 3 288 2 2.406 . 67.41394349000 . . . . . . . . . . 8 18841 3 288 3 29.364 . 95.13960032960 . . . . . . . . . . 8 18841 3 289 1 2.136 . 46.78706573270 . . . . . . . . . . 8 18841 3 289 2 4.202 . 63.08054234370 . . . . . . . . . . 8 18841 3 289 3 29.405 . 107.91720236900 . . . . . . . . . . 8 18841 3 290 1 2.135 . 35.39973528630 . . . . . . . . . . 8 18841 3 290 2 7.216 . 62.02314442000 . . . . . . . . . . 8 18841 3 290 3 29.409 . 125.41139595000 . . . . . . . . . . 8 18841 3 296 1 1.392 . 25.28244899430 . . . . . . . . . . 8 18841 3 296 2 1.120 . 61.47964617690 . . . . . . . . . . 8 18841 3 296 3 28.841 . 87.10102787240 . . . . . . . . . . 8 18841 3 297 1 1.394 . 23.35175793150 . . . . . . . . . . 8 18841 3 297 2 2.796 . 94.64848173710 . . . . . . . . . . 8 18841 3 297 3 28.834 . 97.62562034010 . . . . . . . . . . 8 18841 3 298 1 1.394 . 24.72559341890 . . . . . . . . . . 8 18841 3 298 2 4.044 . 54.62307481260 . . . . . . . . . . 8 18841 3 298 3 28.845 . 79.47669619460 . . . . . . . . . . 8 18841 3 299 1 1.228 . 31.01164444560 . . . . . . . . . . 8 18841 3 299 2 0.880 . 64.16753883000 . . . . . . . . . . 8 18841 3 299 3 27.923 . 87.85126395060 . . . . . . . . . . 8 18841 3 300 1 1.499 . 22.30006317900 . . . . . . . . . . 8 18841 3 300 2 0.876 . 66.06956819870 . . . . . . . . . . 8 18841 3 300 3 27.905 . 82.78371841650 . . . . . . . . . . 8 18841 3 301 1 1.229 . 24.90647458030 . . . . . . . . . . 8 18841 3 301 2 1.497 . 60.70793872660 . . . . . . . . . . 8 18841 3 301 3 27.920 . 80.22405560070 . . . . . . . . . . 8 18841 3 302 1 1.498 . 23.01454376640 . . . . . . . . . . 8 18841 3 302 2 1.228 . 60.94515619190 . . . . . . . . . . 8 18841 3 302 3 27.906 . 81.45066857510 . . . . . . . . . . 8 18841 3 303 1 1.223 . 29.08655208540 . . . . . . . . . . 8 18841 3 303 2 1.865 . 66.10688812540 . . . . . . . . . . 8 18841 3 303 3 27.953 . 95.64186727450 . . . . . . . . . . 8 18841 3 304 1 1.499 . 33.14948750510 . . . . . . . . . . 8 18841 3 304 2 1.864 . 65.29056834900 . . . . . . . . . . 8 18841 3 304 3 27.900 . 131.98113964300 . . . . . . . . . . 8 18841 3 305 1 1.229 . 25.10372118010 . . . . . . . . . . 8 18841 3 305 2 4.119 . 57.27579236250 . . . . . . . . . . 8 18841 3 305 3 27.922 . 86.31972373580 . . . . . . . . . . 8 18841 3 306 1 1.501 . 28.14037134370 . . . . . . . . . . 8 18841 3 306 2 4.116 . 62.49157384500 . . . . . . . . . . 8 18841 3 306 3 27.939 . 101.02354540000 . . . . . . . . . . 8 18841 3 307 1 1.144 . 32.23431496250 . . . . . . . . . . 8 18841 3 307 2 0.853 . 74.52231711840 . . . . . . . . . . 8 18841 3 307 3 26.871 . 93.70759296870 . . . . . . . . . . 8 18841 3 310 1 1.147 . 27.30056595170 . . . . . . . . . . 8 18841 3 310 2 1.475 . 61.93391976760 . . . . . . . . . . 8 18841 3 310 3 26.880 . 82.44657244880 . . . . . . . . . . 8 18841 3 311 1 1.148 . 28.90480958520 . . . . . . . . . . 8 18841 3 311 2 1.815 . 61.24543146430 . . . . . . . . . . 8 18841 3 311 3 26.875 . 96.25114642080 . . . . . . . . . . 8 18841 3 312 1 1.467 . 28.39618898620 . . . . . . . . . . 8 18841 3 312 2 1.808 . 67.53662738700 . . . . . . . . . . 8 18841 3 312 3 27.122 . 109.32331968200 . . . . . . . . . . 8 18841 3 313 1 1.148 . 29.94272291580 . . . . . . . . . . 8 18841 3 313 2 4.446 . 57.57006212950 . . . . . . . . . . 8 18841 3 313 3 26.926 . 89.84422236680 . . . . . . . . . . 8 18841 3 315 1 1.463 . 27.28118582730 . . . . . . . . . . 8 18841 3 315 2 3.100 . 58.64161588750 . . . . . . . . . . 8 18841 3 315 3 27.209 . 91.21179227310 . . . . . . . . . . 8 18841 3 316 1 1.460 . 31.21276707020 . . . . . . . . . . 8 18841 3 316 2 4.099 . 67.52418741140 . . . . . . . . . . 8 18841 3 316 3 27.171 . 87.93583810970 . . . . . . . . . . 8 18841 3 323 1 1.671 . 54.74066879930 . . . . . . . . . . 8 18841 3 323 2 0.913 . 65.02847093260 . . . . . . . . . . 8 18841 3 323 3 27.572 . 78.75350083400 . . . . . . . . . . 8 18841 3 325 1 1.785 . 159.56733117900 . . . . . . . . . . 8 18841 3 325 2 3.179 . 76.96827369490 . . . . . . . . . . 8 18841 3 325 3 27.617 . 106.66297334300 . . . . . . . . . . 8 18841 3 326 1 1.785 . 32.81830271200 . . . . . . . . . . 8 18841 3 326 2 4.162 . 61.21411704310 . . . . . . . . . . 8 18841 3 326 3 27.611 . 100.22267989300 . . . . . . . . . . 8 18841 3 327 1 1.786 . 146.01933219300 . . . . . . . . . . 8 18841 3 327 2 1.904 . 220.35958248100 . . . . . . . . . . 8 18841 3 327 3 27.621 . 98.69976969440 . . . . . . . . . . 8 18841 3 328 1 1.995 . 26.76955054230 . . . . . . . . . . 8 18841 3 328 2 2.285 . 68.55541849000 . . . . . . . . . . 8 18841 3 328 3 27.651 . 126.92625146700 . . . . . . . . . . 8 18841 3 330 1 2.054 . 69.09660363920 . . . . . . . . . . 8 18841 3 330 2 2.313 . 61.03952842040 . . . . . . . . . . 8 18841 3 330 3 27.616 . 91.42984401670 . . . . . . . . . . 8 18841 3 331 1 2.057 . 71.77235281900 . . . . . . . . . . 8 18841 3 331 2 3.645 . 60.12411780410 . . . . . . . . . . 8 18841 3 331 3 27.653 . 86.91864686260 . . . . . . . . . . 8 18841 3 332 1 2.057 . 66.03325197070 . . . . . . . . . . 8 18841 3 332 2 3.875 . 59.90191410240 . . . . . . . . . . 8 18841 3 332 3 27.654 . 96.88286360940 . . . . . . . . . . 8 18841 3 333 1 1.996 . 26.86688183390 . . . . . . . . . . 8 18841 3 333 2 3.645 . 188.21039595300 . . . . . . . . . . 8 18841 3 333 3 27.639 . 103.08439327700 . . . . . . . . . . 8 18841 3 334 1 1.999 . 60.93843259250 . . . . . . . . . . 8 18841 3 334 2 3.876 . 218.06333457600 . . . . . . . . . . 8 18841 3 334 3 27.639 . 107.00011931100 . . . . . . . . . . 8 18841 3 337 1 2.054 . 70.28051390720 . . . . . . . . . . 8 18841 3 337 2 4.426 . 58.22294636470 . . . . . . . . . . 8 18841 3 337 3 27.633 . 89.61811594140 . . . . . . . . . . 8 18841 3 338 1 1.552 . 98.28651638820 . . . . . . . . . . 8 18841 3 338 2 1.894 . 66.13133911190 . . . . . . . . . . 8 18841 3 338 3 25.161 . 92.57073216310 . . . . . . . . . . 8 18841 3 339 1 1.550 . 102.41878958600 . . . . . . . . . . 8 18841 3 339 2 1.702 . 227.09089616000 . . . . . . . . . . 8 18841 3 339 3 25.173 . 98.70955037940 . . . . . . . . . . 8 18841 3 340 1 1.553 . 24.62567811080 . . . . . . . . . . 8 18841 3 340 2 4.169 . 59.38115098710 . . . . . . . . . . 8 18841 3 340 3 25.131 . 97.53644350570 . . . . . . . . . . 8 18841 3 341 1 1.450 . 47.83746847690 . . . . . . . . . . 8 18841 3 341 2 1.702 . 67.14112195670 . . . . . . . . . . 8 18841 3 341 3 25.173 . 132.13590460100 . . . . . . . . . . 8 18841 3 342 1 1.451 . 26.84104166800 . . . . . . . . . . 8 18841 3 342 2 1.897 . 83.04112659800 . . . . . . . . . . 8 18841 3 342 3 25.173 . 108.57596027500 . . . . . . . . . . 8 18841 3 343 1 1.450 . 30.76142550570 . . . . . . . . . . 8 18841 3 343 2 4.170 . 91.75683086340 . . . . . . . . . . 8 18841 3 343 3 25.173 . 115.11233457300 . . . . . . . . . . 8 18841 3 346 1 1.378 . 104.37618215400 . . . . . . . . . . 8 18841 3 346 2 1.668 . 62.35602100780 . . . . . . . . . . 8 18841 3 346 3 24.699 . 90.06112344160 . . . . . . . . . . 8 18841 3 347 1 1.118 . 29.41902888680 . . . . . . . . . . 8 18841 3 347 2 1.394 . 69.75995129720 . . . . . . . . . . 8 18841 3 347 3 24.226 . 96.93004103140 . . . . . . . . . . 8 18841 3 348 1 1.119 . 26.50899553600 . . . . . . . . . . 8 18841 3 348 2 1.597 . 206.07162708800 . . . . . . . . . . 8 18841 3 348 3 24.208 . 88.40070831760 . . . . . . . . . . 8 18841 3 349 1 1.119 . 31.65032721300 . . . . . . . . . . 8 18841 3 349 2 4.044 . 63.69524872290 . . . . . . . . . . 8 18841 3 349 3 24.295 . 82.31309486440 . . . . . . . . . . 8 18841 3 350 1 1.119 . 39.09961637490 . . . . . . . . . . 8 18841 3 350 2 2.766 . 103.79014792500 . . . . . . . . . . 8 18841 3 350 3 24.282 . 129.42090149300 . . . . . . . . . . 8 18841 3 352 1 0.836 . 18.74704036660 . . . . . . . . . . 8 18841 3 352 2 1.488 . 94.02047745300 . . . . . . . . . . 8 18841 3 352 3 24.894 . 188.43467852200 . . . . . . . . . . 8 18841 3 353 1 0.835 . 15.50668356170 . . . . . . . . . . 8 18841 3 353 2 3.658 . 61.81681241140 . . . . . . . . . . 8 18841 3 353 3 24.870 . 113.62221843600 . . . . . . . . . . 8 18841 3 354 1 0.834 . 18.30818821560 . . . . . . . . . . 8 18841 3 354 2 4.428 . 58.71067920010 . . . . . . . . . . 8 18841 3 354 3 24.875 . 105.86268317100 . . . . . . . . . . 8 18841 3 355 1 0.823 . 15.50969824770 . . . . . . . . . . 8 18841 3 355 2 1.467 . 96.07950789270 . . . . . . . . . . 8 18841 3 355 3 24.101 . 93.88191929670 . . . . . . . . . . 8 18841 3 356 1 0.823 . 15.64406711040 . . . . . . . . . . 8 18841 3 356 2 3.658 . 61.80008278900 . . . . . . . . . . 8 18841 3 356 3 24.100 . 83.01557818600 . . . . . . . . . . 8 18841 3 367 1 0.997 . 15.38695745960 . . . . . . . . . . 8 18841 3 367 2 2.142 . 65.31030072410 . . . . . . . . . . 8 18841 3 367 3 22.181 . 83.34869681280 . . . . . . . . . . 8 18841 3 368 1 0.997 . 13.79132721480 . . . . . . . . . . 8 18841 3 368 2 3.699 . 62.09950013210 . . . . . . . . . . 8 18841 3 368 3 22.191 . 81.89310074090 . . . . . . . . . . 8 18841 3 369 1 0.996 . 12.38045415620 . . . . . . . . . . 8 18841 3 369 2 4.498 . 63.48891671430 . . . . . . . . . . 8 18841 3 369 3 22.205 . 87.20228672960 . . . . . . . . . . 8 18841 3 370 1 1.000 . 12.46443469540 . . . . . . . . . . 8 18841 3 370 2 1.821 . 79.51675282870 . . . . . . . . . . 8 18841 3 370 3 22.185 . 105.60953602800 . . . . . . . . . . 8 18841 3 371 1 0.996 . 14.41665922980 . . . . . . . . . . 8 18841 3 371 2 2.297 . 228.53822297300 . . . . . . . . . . 8 18841 3 371 3 22.183 . 83.36653217960 . . . . . . . . . . 8 18841 3 373 1 1.223 . 11.74263272770 . . . . . . . . . . 8 18841 3 373 2 2.287 . 51.47361616920 . . . . . . . . . . 8 18841 3 373 3 21.936 . 92.09090326040 . . . . . . . . . . 8 18841 3 374 1 1.233 . 12.82576634870 . . . . . . . . . . 8 18841 3 374 2 4.284 . 71.26733316490 . . . . . . . . . . 8 18841 3 374 3 21.658 . 81.56285878620 . . . . . . . . . . 8 18841 3 377 1 1.234 . 12.62464372400 . . . . . . . . . . 8 18841 3 377 2 4.029 . 381.70906841800 . . . . . . . . . . 8 18841 3 377 3 21.642 . 70.91284341590 . . . . . . . . . . 8 18841 3 380 1 1.398 . 17.82583845190 . . . . . . . . . . 8 18841 3 380 2 4.188 . 63.67980599460 . . . . . . . . . . 8 18841 3 380 3 18.731 . 88.81034642170 . . . . . . . . . . 8 18841 3 381 1 1.396 . 17.16562221300 . . . . . . . . . . 8 18841 3 381 2 4.032 . 250.99323681200 . . . . . . . . . . 8 18841 3 381 3 18.717 . 97.96967032070 . . . . . . . . . . 8 18841 3 387 1 1.529 . 19.94559339530 . . . . . . . . . . 8 18841 3 387 2 2.067 . 89.90241657360 . . . . . . . . . . 8 18841 3 387 3 18.395 . 105.69698685900 . . . . . . . . . . 8 18841 3 396 1 0.913 . 14.81330577640 . . . . . . . . . . 8 18841 3 396 2 1.231 . 74.94999489930 . . . . . . . . . . 8 18841 3 396 3 17.663 . 79.30006852900 . . . . . . . . . . 8 18841 3 397 1 0.912 . 14.49719441350 . . . . . . . . . . 8 18841 3 397 2 1.493 . 59.24516918510 . . . . . . . . . . 8 18841 3 397 3 17.518 . 113.02847331900 . . . . . . . . . . 8 18841 3 398 1 0.918 . 19.36031363750 . . . . . . . . . . 8 18841 3 398 2 1.864 . 64.34641709950 . . . . . . . . . . 8 18841 3 398 3 17.600 . 95.33406336210 . . . . . . . . . . 8 18841 3 400 1 0.910 . 12.72369769330 . . . . . . . . . . 8 18841 3 400 2 2.289 . 48.81317725530 . . . . . . . . . . 8 18841 3 400 3 17.357 . 108.14906213900 . . . . . . . . . . 8 18841 3 401 1 0.909 . 13.74955227990 . . . . . . . . . . 8 18841 3 401 2 3.651 . 62.42594224980 . . . . . . . . . . 8 18841 3 401 3 17.314 . 78.71610409700 . . . . . . . . . . 8 18841 3 402 1 0.910 . 12.99932612970 . . . . . . . . . . 8 18841 3 402 2 3.873 . 55.58910326060 . . . . . . . . . . 8 18841 3 402 3 17.313 . 91.74742861420 . . . . . . . . . . 8 18841 3 403 1 0.913 . 14.54198403440 . . . . . . . . . . 8 18841 3 403 2 4.118 . 70.22709382820 . . . . . . . . . . 8 18841 3 403 3 17.692 . 85.70814325180 . . . . . . . . . . 8 18841 3 404 1 0.910 . 14.76808548610 . . . . . . . . . . 8 18841 3 404 2 4.449 . 62.80514702240 . . . . . . . . . . 8 18841 3 404 3 17.324 . 85.12532948870 . . . . . . . . . . 8 18841 3 405 1 0.911 . 18.47701063280 . . . . . . . . . . 8 18841 3 405 2 1.808 . 79.10666259940 . . . . . . . . . . 8 18841 3 405 3 17.273 . 81.27921891920 . . . . . . . . . . 8 18841 3 406 1 0.862 . 16.10316072470 . . . . . . . . . . 8 18841 3 406 2 1.217 . 58.32117927530 . . . . . . . . . . 8 18841 3 406 3 13.162 . 78.77363753850 . . . . . . . . . . 8 18841 3 407 1 0.860 . 26.89229133040 . . . . . . . . . . 8 18841 3 407 2 1.491 . 59.39015924520 . . . . . . . . . . 8 18841 3 407 3 13.151 . 84.94064714120 . . . . . . . . . . 8 18841 3 408 1 0.859 . 19.63981809870 . . . . . . . . . . 8 18841 3 408 2 1.873 . 58.45759004190 . . . . . . . . . . 8 18841 3 408 3 13.139 . 85.83356615450 . . . . . . . . . . 8 18841 3 409 1 0.862 . 14.23061003520 . . . . . . . . . . 8 18841 3 409 2 4.115 . 61.80265657710 . . . . . . . . . . 8 18841 3 409 3 13.180 . 81.54790009140 . . . . . . . . . . 8 18841 3 410 1 0.837 . 16.61565734860 . . . . . . . . . . 8 18841 3 410 2 1.137 . 62.34229413820 . . . . . . . . . . 8 18841 3 410 3 12.852 . 82.76991039050 . . . . . . . . . . 8 18841 3 411 1 0.838 . 20.01708452100 . . . . . . . . . . 8 18841 3 411 2 1.472 . 62.64600112800 . . . . . . . . . . 8 18841 3 411 3 12.869 . 86.29440902150 . . . . . . . . . . 8 18841 3 412 1 0.838 . 20.73070376950 . . . . . . . . . . 8 18841 3 412 2 1.819 . 65.87653409500 . . . . . . . . . . 8 18841 3 412 3 12.848 . 88.52210387940 . . . . . . . . . . 8 18841 3 413 1 0.838 . 13.98125243420 . . . . . . . . . . 8 18841 3 413 2 4.447 . 49.47206699600 . . . . . . . . . . 8 18841 3 413 3 12.811 . 110.76625839600 . . . . . . . . . . 8 18841 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 7 1 1 . . 4.014 . . 1 . 1 1 1 MET HA . . . . . . . . . . 792 . 18841 3 7 3 1 . . 55.130 . . 1 . 1 1 1 MET CA . . . . . . . . . . 791 . 18841 3 8 1 1 . . 4.387 . . 1 . 1 1 22 THR HB . . . . . . . . . . 335 . 18841 3 8 3 1 . . 70.828 . . 1 . 1 1 22 THR CB . . . . . . . . . . 183 . 18841 3 9 1 1 . . 4.275 . . 1 . 1 1 39 THR HB . . . . . . . . . . 500 . 18841 3 9 3 1 . . 69.693 . . 1 . 1 1 39 THR CB . . . . . . . . . . 159 . 18841 3 10 1 1 . . 4.475 . . 1 . 1 1 22 THR HA . . . . . . . . . . 334 . 18841 3 10 3 1 . . 61.380 . . 1 . 1 1 22 THR CA . . . . . . . . . . 182 . 18841 3 11 1 1 . . 1.873 . . 1 . 1 1 23 ILE HB . . . . . . . . . . 338 . 18841 3 11 3 1 . . 38.536 . . 1 . 1 1 23 ILE CB . . . . . . . . . . 180 . 18841 3 12 1 1 . . 1.872 . . 1 . 1 1 23 ILE HB . . . . . . . . . . 338 . 18841 3 12 3 1 . . 38.552 . . 1 . 1 1 23 ILE CB . . . . . . . . . . 180 . 18841 3 13 1 1 . . 1.870 . . 1 . 1 1 23 ILE HB . . . . . . . . . . 338 . 18841 3 13 3 1 . . 38.558 . . 1 . 1 1 23 ILE CB . . . . . . . . . . 180 . 18841 3 14 1 1 . . 1.873 . . 1 . 1 1 23 ILE HB . . . . . . . . . . 338 . 18841 3 14 3 1 . . 38.550 . . 1 . 1 1 23 ILE CB . . . . . . . . . . 180 . 18841 3 15 1 1 . . 1.875 . . 1 . 1 1 23 ILE HB . . . . . . . . . . 338 . 18841 3 15 3 1 . . 38.556 . . 1 . 1 1 23 ILE CB . . . . . . . . . . 180 . 18841 3 16 1 1 . . 3.699 . . 1 . 1 1 53 VAL HA . . . . . . . . . . 429 . 18841 3 16 3 1 . . 65.580 . . 1 . 1 1 53 VAL CA . . . . . . . . . . 226 . 18841 3 17 1 1 . . 3.699 . . 1 . 1 1 53 VAL HA . . . . . . . . . . 429 . 18841 3 17 3 1 . . 65.427 . . 1 . 1 1 53 VAL CA . . . . . . . . . . 226 . 18841 3 18 1 1 . . 3.777 . . 1 . 1 1 18 SER HB3 . . . . . . . . . . 321 . 18841 3 18 3 1 . . 63.969 . . 1 . 1 1 18 SER CB . . . . . . . . . . 190 . 18841 3 19 1 1 . . 3.852 . . 1 . 1 1 18 SER HB2 . . . . . . . . . . 320 . 18841 3 19 3 1 . . 63.992 . . 1 . 1 1 18 SER CB . . . . . . . . . . 190 . 18841 3 21 1 1 . . 3.968 . . 1 . 1 1 37 VAL HA . . . . . . . . . . 384 . 18841 3 21 3 1 . . 63.346 . . 1 . 1 1 37 VAL CA . . . . . . . . . . 161 . 18841 3 22 1 1 . . 3.940 . . 1 . 1 1 28 SER HB3 . . . . . . . . . . 355 . 18841 3 22 3 1 . . 63.433 . . 1 . 1 1 28 SER CB . . . . . . . . . . 171 . 18841 3 23 1 1 . . 3.985 . . 1 . 1 1 28 SER HB2 . . . . . . . . . . 354 . 18841 3 23 3 1 . . 63.383 . . 1 . 1 1 28 SER CB . . . . . . . . . . 171 . 18841 3 24 1 1 . . 3.971 . . 1 . 1 1 37 VAL HA . . . . . . . . . . 384 . 18841 3 24 3 1 . . 63.210 . . 1 . 1 1 37 VAL CA . . . . . . . . . . 161 . 18841 3 25 1 1 . . 4.120 . . 1 . 1 1 17 VAL HA . . . . . . . . . . 316 . 18841 3 25 3 1 . . 62.231 . . 1 . 1 1 17 VAL CA . . . . . . . . . . 193 . 18841 3 26 1 1 . . 4.111 . . 1 . 1 1 23 ILE HA . . . . . . . . . . 337 . 18841 3 26 3 1 . . 62.053 . . 1 . 1 1 23 ILE CA . . . . . . . . . . 181 . 18841 3 27 1 1 . . 4.111 . . 1 . 1 1 23 ILE HA . . . . . . . . . . 337 . 18841 3 27 3 2 . . 62.170 . . 1 . 1 1 23 ILE CA . . . . . . . . . . 181 . 18841 3 28 1 1 . . 4.120 . . 1 . 1 1 17 VAL HA . . . . . . . . . . 316 . 18841 3 28 3 1 . . 62.199 . . 1 . 1 1 17 VAL CA . . . . . . . . . . 193 . 18841 3 29 1 1 . . 4.371 . . 1 . 1 1 28 SER HA . . . . . . . . . . 353 . 18841 3 29 3 1 . . 60.336 . . 1 . 1 1 28 SER CA . . . . . . . . . . 170 . 18841 3 30 1 1 . . 4.318 . . 1 . 1 1 32 TRP HA . . . . . . . . . . 367 . 18841 3 30 2 1 . . 3.478 . . 1 . 1 1 32 TRP HB2 . . . . . . . . . . 804 . 18841 3 30 3 1 . . 60.229 . . 1 . 1 1 32 TRP CA . . . . . . . . . . 155 . 18841 3 31 1 1 . . 4.319 . . 1 . 1 1 32 TRP HA . . . . . . . . . . 367 . 18841 3 31 2 1 . . 3.262 . . 1 . 1 1 32 TRP HB3 . . . . . . . . . . 508 . 18841 3 31 3 1 . . 59.987 . . 1 . 1 1 32 TRP CA . . . . . . . . . . 155 . 18841 3 32 1 1 . . 4.300 . . 1 . 1 1 29 TYR HA . . . . . . . . . . 357 . 18841 3 32 3 1 . . 60.459 . . 1 . 1 1 29 TYR CA . . . . . . . . . . 168 . 18841 3 33 1 1 . . 4.302 . . 1 . 1 1 39 THR HA . . . . . . . . . . 390 . 18841 3 33 3 1 . . 62.568 . . 1 . 1 1 39 THR CA . . . . . . . . . . 158 . 18841 3 41 1 1 . . 4.097 . . 1 . 1 1 60 ARG HA . . . . . . . . . . 451 . 18841 3 41 3 1 . . 58.257 . . 1 . 1 1 60 ARG CA . . . . . . . . . . 213 . 18841 3 42 1 1 . . 4.100 . . 1 . 1 1 60 ARG HA . . . . . . . . . . 451 . 18841 3 42 3 1 . . 58.457 . . 1 . 1 1 60 ARG CA . . . . . . . . . . 213 . 18841 3 43 1 1 . . 4.099 . . 1 . 1 1 60 ARG HA . . . . . . . . . . 451 . 18841 3 43 3 1 . . 58.494 . . 1 . 1 1 60 ARG CA . . . . . . . . . . 213 . 18841 3 44 1 1 . . 4.105 . . 1 . 1 1 60 ARG HA . . . . . . . . . . 451 . 18841 3 44 3 1 . . 58.448 . . 1 . 1 1 60 ARG CA . . . . . . . . . . 213 . 18841 3 45 1 1 . . 4.136 . . 1 . 1 1 55 ARG HA . . . . . . . . . . 435 . 18841 3 45 3 1 . . 58.629 . . 1 . 1 1 55 ARG CA . . . . . . . . . . 222 . 18841 3 46 1 1 . . 4.137 . . 1 . 1 1 55 ARG HA . . . . . . . . . . 435 . 18841 3 46 3 1 . . 58.671 . . 1 . 1 1 55 ARG CA . . . . . . . . . . 222 . 18841 3 47 1 1 . . 4.156 . . 1 . 1 1 59 GLU HA . . . . . . . . . . 448 . 18841 3 47 3 1 . . 58.560 . . 1 . 1 1 59 GLU CA . . . . . . . . . . 215 . 18841 3 48 1 1 . . 4.152 . . 1 . 1 1 59 GLU HA . . . . . . . . . . 448 . 18841 3 48 3 1 . . 58.475 . . 1 . 1 1 59 GLU CA . . . . . . . . . . 215 . 18841 3 49 1 1 . . 4.151 . . 1 . 1 1 59 GLU HA . . . . . . . . . . 448 . 18841 3 49 3 1 . . 58.518 . . 1 . 1 1 59 GLU CA . . . . . . . . . . 215 . 18841 3 50 1 1 . . 4.162 . . 1 . 1 1 56 ARG HA . . . . . . . . . . 438 . 18841 3 50 3 1 . . 58.438 . . 1 . 1 1 56 ARG CA . . . . . . . . . . 221 . 18841 3 51 1 1 . . 4.187 . . 1 . 1 1 24 GLU HA . . . . . . . . . . 340 . 18841 3 51 3 1 . . 58.169 . . 1 . 1 1 24 GLU CA . . . . . . . . . . 179 . 18841 3 52 1 1 . . 4.186 . . 1 . 1 1 24 GLU HA . . . . . . . . . . 340 . 18841 3 52 3 1 . . 58.304 . . 1 . 1 1 24 GLU CA . . . . . . . . . . 179 . 18841 3 53 1 1 . . 4.177 . . 1 . 1 1 63 LYS HA . . . . . . . . . . 461 . 18841 3 53 3 1 . . 57.947 . . 1 . 1 1 63 LYS CA . . . . . . . . . . 206 . 18841 3 54 1 1 . . 4.179 . . 1 . 1 1 63 LYS HA . . . . . . . . . . 461 . 18841 3 54 3 1 . . 57.949 . . 1 . 1 1 63 LYS CA . . . . . . . . . . 206 . 18841 3 55 1 1 . . 4.177 . . 1 . 1 1 63 LYS HA . . . . . . . . . . 461 . 18841 3 55 3 1 . . 57.790 . . 1 . 1 1 63 LYS CA . . . . . . . . . . 206 . 18841 3 56 1 1 . . 4.507 . . 1 . 1 1 61 PHE HA . . . . . . . . . . 454 . 18841 3 56 3 1 . . 59.491 . . 1 . 1 1 61 PHE CA . . . . . . . . . . 211 . 18841 3 57 1 1 . . 4.503 . . 1 . 1 1 61 PHE HA . . . . . . . . . . 454 . 18841 3 57 3 1 . . 59.302 . . 1 . 1 1 61 PHE CA . . . . . . . . . . 211 . 18841 3 62 1 1 . . 4.503 . . 1 . 1 1 50 HIS HA . . . . . . . . . . 421 . 18841 3 62 3 1 . . 57.398 . . 1 . 1 1 50 HIS CA . . . . . . . . . . 231 . 18841 3 63 1 1 . . 4.610 . . 1 . 1 1 20 PHE HA . . . . . . . . . . 327 . 18841 3 63 3 1 . . 57.947 . . 1 . 1 1 20 PHE CA . . . . . . . . . . 186 . 18841 3 64 1 1 . . 4.614 . . 1 . 1 1 20 PHE HA . . . . . . . . . . 327 . 18841 3 64 3 1 . . 57.615 . . 1 . 1 1 20 PHE CA . . . . . . . . . . 186 . 18841 3 65 1 1 . . 4.009 . . 1 . 1 1 34 ARG HA . . . . . . . . . . 373 . 18841 3 65 3 1 . . 58.038 . . 1 . 1 1 34 ARG CA . . . . . . . . . . 150 . 18841 3 66 1 1 . . 4.008 . . 1 . 1 1 34 ARG HA . . . . . . . . . . 373 . 18841 3 66 3 1 . . 58.021 . . 1 . 1 1 34 ARG CA . . . . . . . . . . 150 . 18841 3 67 1 1 . . 4.050 . . 1 . 1 1 36 LYS HA . . . . . . . . . . 380 . 18841 3 67 3 1 . . 57.144 . . 1 . 1 1 36 LYS CA . . . . . . . . . . 163 . 18841 3 68 1 1 . . 4.045 . . 1 . 1 1 36 LYS HA . . . . . . . . . . 380 . 18841 3 68 3 1 . . 57.058 . . 1 . 1 1 36 LYS CA . . . . . . . . . . 163 . 18841 3 79 1 1 . . 4.259 . . 1 . 1 1 11 ARG HA . . . . . . . . . . 295 . 18841 3 79 3 1 . . 56.698 . . 1 . 1 1 11 ARG CA . . . . . . . . . . 246 . 18841 3 80 1 1 . . 4.259 . . 1 . 1 1 11 ARG HA . . . . . . . . . . 295 . 18841 3 80 3 1 . . 56.698 . . 1 . 1 1 11 ARG CA . . . . . . . . . . 246 . 18841 3 81 1 1 . . 4.322 . . 1 . 1 1 64 MET HA . . . . . . . . . . 464 . 18841 3 81 3 1 . . 57.035 . . 1 . 1 1 64 MET CA . . . . . . . . . . 204 . 18841 3 84 1 1 . . 4.324 . . 1 . 1 1 41 LEU HA . . . . . . . . . . 395 . 18841 3 84 3 1 . . 55.343 . . 1 . 1 1 41 LEU CA . . . . . . . . . . 234 . 18841 3 85 1 1 . . 4.322 . . 1 . 1 1 41 LEU HA . . . . . . . . . . 395 . 18841 3 85 3 1 . . 55.483 . . 1 . 1 1 41 LEU CA . . . . . . . . . . 234 . 18841 3 86 1 1 . . 4.363 . . 1 . 1 1 13 LEU HA . . . . . . . . . . 304 . 18841 3 86 3 1 . . 55.030 . . 1 . 1 1 13 LEU CA . . . . . . . . . . 242 . 18841 3 87 1 1 . . 4.362 . . 1 . 1 1 13 LEU HA . . . . . . . . . . 304 . 18841 3 87 3 1 . . 54.916 . . 1 . 1 1 13 LEU CA . . . . . . . . . . 242 . 18841 3 88 1 1 . . 4.426 . . 1 . 1 1 30 ASN HA . . . . . . . . . . 360 . 18841 3 88 3 1 . . 55.420 . . 1 . 1 1 30 ASN CA . . . . . . . . . . 166 . 18841 3 89 1 1 . . 4.428 . . 1 . 1 1 30 ASN HA . . . . . . . . . . 360 . 18841 3 89 3 1 . . 55.459 . . 1 . 1 1 30 ASN CA . . . . . . . . . . 166 . 18841 3 90 1 1 . . 4.427 . . 1 . 1 1 30 ASN HA . . . . . . . . . . 360 . 18841 3 90 3 1 . . 55.438 . . 1 . 1 1 30 ASN CA . . . . . . . . . . 166 . 18841 3 94 1 1 . . 4.309 . . 1 . 1 1 38 ALA HA . . . . . . . . . . 387 . 18841 3 94 3 1 . . 53.311 . . 1 . 1 1 38 ALA CA . . . . . . . . . . 157 . 18841 3 95 1 1 . . 4.309 . . 1 . 1 1 38 ALA HA . . . . . . . . . . 387 . 18841 3 95 3 1 . . 53.350 . . 1 . 1 1 38 ALA CA . . . . . . . . . . 157 . 18841 3 99 1 1 . . 4.189 . . 1 . 1 1 35 ALA HA . . . . . . . . . . 376 . 18841 3 99 3 1 . . 53.484 . . 1 . 1 1 35 ALA CA . . . . . . . . . . 148 . 18841 3 100 1 1 . . 4.187 . . 1 . 1 1 62 ALA HA . . . . . . . . . . 458 . 18841 3 100 3 1 . . 54.442 . . 1 . 1 1 62 ALA CA . . . . . . . . . . 209 . 18841 3 101 1 1 . . 4.180 . . 1 . 1 1 62 ALA HA . . . . . . . . . . 458 . 18841 3 101 3 1 . . 54.332 . . 1 . 1 1 62 ALA CA . . . . . . . . . . 209 . 18841 3 102 1 1 . . 3.798 . . 1 . 1 1 26 GLU HA . . . . . . . . . . 346 . 18841 3 102 3 1 . . 58.027 . . 1 . 1 1 26 GLU CA . . . . . . . . . . 175 . 18841 3 103 1 1 . . 3.806 . . 1 . 1 1 26 GLU HA . . . . . . . . . . 346 . 18841 3 103 3 1 . . 57.960 . . 1 . 1 1 26 GLU CA . . . . . . . . . . 175 . 18841 3 104 1 1 . . 3.793 . . 1 . 1 1 26 GLU HA . . . . . . . . . . 346 . 18841 3 104 3 1 . . 58.141 . . 1 . 1 1 26 GLU CA . . . . . . . . . . 175 . 18841 3 105 1 1 . . 3.878 . . 1 . 1 1 49 PRO HD3 . . . . . . . . . . 711 . 18841 3 105 3 1 . . 51.106 . . 1 . 1 1 49 PRO CD . . . . . . . . . . 592 . 18841 3 106 1 1 . . 3.878 . . 1 . 1 1 49 PRO HD3 . . . . . . . . . . 711 . 18841 3 106 3 1 . . 51.097 . . 1 . 1 1 49 PRO CD . . . . . . . . . . 592 . 18841 3 107 1 1 . . 3.876 . . 1 . 1 1 49 PRO HD3 . . . . . . . . . . 711 . 18841 3 107 3 1 . . 51.099 . . 1 . 1 1 49 PRO CD . . . . . . . . . . 592 . 18841 3 108 1 1 . . 3.877 . . 1 . 1 1 49 PRO HD3 . . . . . . . . . . 711 . 18841 3 108 3 1 . . 51.104 . . 1 . 1 1 49 PRO CD . . . . . . . . . . 592 . 18841 3 112 1 1 . . 3.719 . . 1 . 1 1 15 PRO HD2 . . . . . . . . . . 783 . 18841 3 112 3 1 . . 50.783 . . 1 . 1 1 15 PRO CD . . . . . . . . . . 560 . 18841 3 113 1 1 . . 3.718 . . 1 . 1 1 15 PRO HD2 . . . . . . . . . . 783 . 18841 3 113 2 1 . . 4.745 . . 1 . 1 1 14 SER HA . . . . . . . . . . 772 . 18841 3 113 3 1 . . 50.821 . . 1 . 1 1 15 PRO CD . . . . . . . . . . 560 . 18841 3 114 1 1 . . 3.651 . . 1 . 1 1 49 PRO HD2 . . . . . . . . . . 781 . 18841 3 114 2 1 . . 3.875 . . 1 . 1 1 49 PRO HD3 . . . . . . . . . . 711 . 18841 3 114 3 1 . . 51.096 . . 1 . 1 1 49 PRO CD . . . . . . . . . . 592 . 18841 3 115 1 1 . . 3.650 . . 1 . 1 1 49 PRO HD2 . . . . . . . . . . 781 . 18841 3 115 3 1 . . 51.109 . . 1 . 1 1 49 PRO CD . . . . . . . . . . 592 . 18841 3 116 1 1 . . 3.781 . . 1 . 1 1 15 PRO HD3 . . . . . . . . . . 664 . 18841 3 116 2 1 . . 4.756 . . 1 . 1 1 14 SER HA . . . . . . . . . . 772 . 18841 3 116 3 1 . . 50.836 . . 1 . 1 1 15 PRO CD . . . . . . . . . . 560 . 18841 3 117 1 1 . . 3.651 . . 1 . 1 1 49 PRO HD2 . . . . . . . . . . 781 . 18841 3 117 3 1 . . 51.088 . . 1 . 1 1 49 PRO CD . . . . . . . . . . 592 . 18841 3 118 1 1 . . 3.654 . . 1 . 1 1 49 PRO HD2 . . . . . . . . . . 781 . 18841 3 118 3 1 . . 51.142 . . 1 . 1 1 49 PRO CD . . . . . . . . . . 592 . 18841 3 119 1 1 . . 3.650 . . 1 . 1 1 49 PRO HD2 . . . . . . . . . . 781 . 18841 3 119 3 1 . . 51.108 . . 1 . 1 1 49 PRO CD . . . . . . . . . . 592 . 18841 3 129 1 1 . . 3.102 . . 1 . 1 1 60 ARG HD3 . . . . . . . . . . 725 . 18841 3 129 1 2 . . 3.102 . . 1 . 1 1 60 ARG HD2 . . . . . . . . . . 724 . 18841 3 129 2 1 . . 1.809 . . 1 . 1 1 60 ARG HB3 . . . . . . . . . . 452 . 18841 3 129 2 2 . . 1.809 . . 1 . 1 1 60 ARG HB2 . . . . . . . . . . 525 . 18841 3 129 3 1 . . 43.528 . . 1 . 1 1 60 ARG CD . . . . . . . . . . 602 . 18841 3 130 1 1 . . 3.101 . . 1 . 1 1 60 ARG HD3 . . . . . . . . . . 725 . 18841 3 130 1 2 . . 3.101 . . 1 . 1 1 60 ARG HD2 . . . . . . . . . . 724 . 18841 3 130 2 1 . . 1.588 . . 1 . 1 1 60 ARG HG2 . . . . . . . . . . 723 . 18841 3 130 3 1 . . 43.536 . . 1 . 1 1 60 ARG CD . . . . . . . . . . 602 . 18841 3 131 1 1 . . 3.100 . . 1 . 1 1 60 ARG HD3 . . . . . . . . . . 725 . 18841 3 131 1 2 . . 3.100 . . 1 . 1 1 60 ARG HD2 . . . . . . . . . . 724 . 18841 3 131 2 1 . . 1.458 . . 1 . 1 1 60 ARG HG3 . . . . . . . . . . 815 . 18841 3 131 3 1 . . 43.553 . . 1 . 1 1 60 ARG CD . . . . . . . . . . 602 . 18841 3 135 1 1 . . 2.815 . . 1 . 1 1 36 LYS HE2 . . . . . . . . . . 692 . 18841 3 135 3 1 . . 42.165 . . 1 . 1 1 36 LYS CE . . . . . . . . . . 578 . 18841 3 136 1 1 . . 2.807 . . 1 . 1 1 36 LYS HE2 . . . . . . . . . . 692 . 18841 3 136 3 1 . . 42.030 . . 1 . 1 1 36 LYS CE . . . . . . . . . . 578 . 18841 3 137 1 1 . . 2.803 . . 1 . 1 1 36 LYS HE2 . . . . . . . . . . 692 . 18841 3 137 3 1 . . 41.895 . . 1 . 1 1 36 LYS CE . . . . . . . . . . 578 . 18841 3 138 1 1 . . 2.724 . . 1 . 1 1 36 LYS HE3 . . . . . . . . . . 755 . 18841 3 138 3 1 . . 42.009 . . 1 . 1 1 36 LYS CE . . . . . . . . . . 578 . 18841 3 139 1 1 . . 2.726 . . 1 . 1 1 36 LYS HE3 . . . . . . . . . . 755 . 18841 3 139 3 1 . . 41.899 . . 1 . 1 1 36 LYS CE . . . . . . . . . . 578 . 18841 3 143 1 1 . . 2.653 . . 1 . 1 1 2 ASP HB3 . . . . . . . . . . 265 . 18841 3 143 3 1 . . 41.618 . . 1 . 1 1 2 ASP CB . . . . . . . . . . 262 . 18841 3 145 1 1 . . 2.536 . . 1 . 1 1 2 ASP HB2 . . . . . . . . . . 266 . 18841 3 145 3 1 . . 41.636 . . 1 . 1 1 2 ASP CB . . . . . . . . . . 262 . 18841 3 146 1 1 . . 2.537 . . 1 . 1 1 2 ASP HB2 . . . . . . . . . . 266 . 18841 3 146 3 1 . . 41.600 . . 1 . 1 1 2 ASP CB . . . . . . . . . . 262 . 18841 3 147 1 1 . . 2.514 . . 1 . 1 1 43 ASP HB3 . . . . . . . . . . 774 . 18841 3 147 3 1 . . 41.115 . . 1 . 1 1 43 ASP CB . . . . . . . . . . 397 . 18841 3 148 1 1 . . 2.929 . . 1 . 1 1 20 PHE HB3 . . . . . . . . . . 329 . 18841 3 148 2 1 . . 3.200 . . 1 . 1 1 20 PHE HB2 . . . . . . . . . . 328 . 18841 3 148 3 1 . . 39.947 . . 1 . 1 1 20 PHE CB . . . . . . . . . . 187 . 18841 3 149 1 1 . . 3.198 . . 1 . 1 1 20 PHE HB2 . . . . . . . . . . 328 . 18841 3 149 2 1 . . 2.926 . . 1 . 1 1 20 PHE HB3 . . . . . . . . . . 329 . 18841 3 149 3 1 . . 39.927 . . 1 . 1 1 20 PHE CB . . . . . . . . . . 187 . 18841 3 150 1 1 . . 2.930 . . 1 . 1 1 20 PHE HB3 . . . . . . . . . . 329 . 18841 3 150 2 1 . . 4.609 . . 1 . 1 1 20 PHE HA . . . . . . . . . . 327 . 18841 3 150 3 1 . . 39.979 . . 1 . 1 1 20 PHE CB . . . . . . . . . . 187 . 18841 3 151 1 1 . . 3.196 . . 1 . 1 1 20 PHE HB2 . . . . . . . . . . 328 . 18841 3 151 2 1 . . 4.612 . . 1 . 1 1 20 PHE HA . . . . . . . . . . 327 . 18841 3 151 3 1 . . 39.962 . . 1 . 1 1 20 PHE CB . . . . . . . . . . 187 . 18841 3 152 1 1 . . 2.919 . . 1 . 1 1 20 PHE HB3 . . . . . . . . . . 329 . 18841 3 152 3 1 . . 39.966 . . 1 . 1 1 20 PHE CB . . . . . . . . . . 187 . 18841 3 153 1 1 . . 3.196 . . 1 . 1 1 20 PHE HB2 . . . . . . . . . . 328 . 18841 3 153 3 1 . . 40.051 . . 1 . 1 1 20 PHE CB . . . . . . . . . . 187 . 18841 3 154 1 1 . . 3.202 . . 1 . 1 1 61 PHE HB2 . . . . . . . . . . 455 . 18841 3 154 2 1 . . 3.062 . . 1 . 1 1 61 PHE HB3 . . . . . . . . . . 456 . 18841 3 154 3 1 . . 38.778 . . 1 . 1 1 61 PHE CB . . . . . . . . . . 210 . 18841 3 155 1 1 . . 3.065 . . 1 . 1 1 61 PHE HB3 . . . . . . . . . . 456 . 18841 3 155 2 1 . . 3.203 . . 1 . 1 1 61 PHE HB2 . . . . . . . . . . 455 . 18841 3 155 3 1 . . 38.791 . . 1 . 1 1 61 PHE CB . . . . . . . . . . 210 . 18841 3 156 1 2 . . 3.204 . . 1 . 1 1 61 PHE HB2 . . . . . . . . . . 455 . 18841 3 156 3 2 . . 38.713 . . 1 . 1 1 61 PHE CB . . . . . . . . . . 210 . 18841 3 158 1 1 . . 3.207 . . 1 . 1 1 61 PHE HB2 . . . . . . . . . . 455 . 18841 3 158 3 1 . . 38.824 . . 1 . 1 1 61 PHE CB . . . . . . . . . . 210 . 18841 3 159 1 1 . . 3.065 . . 1 . 1 1 61 PHE HB3 . . . . . . . . . . 456 . 18841 3 159 3 1 . . 38.692 . . 1 . 1 1 61 PHE CB . . . . . . . . . . 210 . 18841 3 160 1 1 . . 3.205 . . 1 . 1 1 61 PHE HB2 . . . . . . . . . . 455 . 18841 3 160 2 1 . . 7.255 . . 1 . 1 1 61 PHE QD . . . . . . . . . . 540 . 18841 3 160 3 1 . . 38.825 . . 1 . 1 1 61 PHE CB . . . . . . . . . . 210 . 18841 3 161 1 1 . . 3.065 . . 1 . 1 1 61 PHE HB3 . . . . . . . . . . 456 . 18841 3 161 2 1 . . 7.263 . . 1 . 1 1 61 PHE QD . . . . . . . . . . 540 . 18841 3 161 3 1 . . 38.835 . . 1 . 1 1 61 PHE CB . . . . . . . . . . 210 . 18841 3 162 1 1 . . 3.199 . . 1 . 1 1 20 PHE HB2 . . . . . . . . . . 328 . 18841 3 162 2 1 . . 7.191 . . 1 . 1 1 20 PHE QD . . . . . . . . . . 536 . 18841 3 162 3 1 . . 39.946 . . 1 . 1 1 20 PHE CB . . . . . . . . . . 187 . 18841 3 163 1 1 . . 2.930 . . 1 . 1 1 20 PHE HB3 . . . . . . . . . . 329 . 18841 3 163 2 1 . . 7.195 . . 1 . 1 1 20 PHE QD . . . . . . . . . . 536 . 18841 3 163 3 1 . . 39.961 . . 1 . 1 1 20 PHE CB . . . . . . . . . . 187 . 18841 3 164 1 1 . . 3.053 . . 1 . 1 1 3 TYR HB2 . . . . . . . . . . 268 . 18841 3 164 2 1 . . 2.927 . . 1 . 1 1 3 TYR HB3 . . . . . . . . . . 269 . 18841 3 164 3 1 . . 38.894 . . 1 . 1 1 3 TYR CB . . . . . . . . . . 255 . 18841 3 165 1 1 . . 2.927 . . 1 . 1 1 3 TYR HB3 . . . . . . . . . . 269 . 18841 3 165 2 1 . . 3.053 . . 1 . 1 1 3 TYR HB2 . . . . . . . . . . 268 . 18841 3 165 3 1 . . 38.897 . . 1 . 1 1 3 TYR CB . . . . . . . . . . 255 . 18841 3 167 1 1 . . 2.980 . . 1 . 1 1 29 TYR HB2 . . . . . . . . . . 358 . 18841 3 167 1 2 . . 2.980 . . 1 . 1 1 29 TYR HB3 . . . . . . . . . . 506 . 18841 3 167 3 1 . . 38.453 . . 1 . 1 1 29 TYR CB . . . . . . . . . . 169 . 18841 3 168 1 1 . . 2.979 . . 1 . 1 1 29 TYR HB2 . . . . . . . . . . 358 . 18841 3 168 1 2 . . 2.979 . . 1 . 1 1 29 TYR HB3 . . . . . . . . . . 506 . 18841 3 168 2 1 . . 7.028 . . 1 . 1 1 29 TYR QD . . . . . . . . . . 534 . 18841 3 168 3 1 . . 38.445 . . 1 . 1 1 29 TYR CB . . . . . . . . . . 169 . 18841 3 169 1 1 . . 2.934 . . 1 . 1 1 3 TYR HB3 . . . . . . . . . . 269 . 18841 3 169 3 1 . . 38.868 . . 1 . 1 1 3 TYR CB . . . . . . . . . . 255 . 18841 3 170 1 1 . . 2.933 . . 1 . 1 1 3 TYR HB3 . . . . . . . . . . 269 . 18841 3 170 2 1 . . 7.119 . . 1 . 1 1 3 TYR QD . . . . . . . . . . 538 . 18841 3 170 3 1 . . 38.889 . . 1 . 1 1 3 TYR CB . . . . . . . . . . 255 . 18841 3 174 1 1 . . 2.778 . . 1 . 1 1 10 ASN HB3 . . . . . . . . . . 293 . 18841 3 174 2 1 . . 4.680 . . 1 . 1 1 10 ASN HA . . . . . . . . . . 291 . 18841 3 174 3 1 . . 38.829 . . 1 . 1 1 10 ASN CB . . . . . . . . . . 248 . 18841 3 175 1 1 . . 2.774 . . 1 . 1 1 10 ASN HB3 . . . . . . . . . . 293 . 18841 3 175 2 1 . . 2.853 . . 1 . 1 1 10 ASN HB2 . . . . . . . . . . 292 . 18841 3 175 3 1 . . 38.705 . . 1 . 1 1 10 ASN CB . . . . . . . . . . 248 . 18841 3 176 1 1 . . 2.726 . . 1 . 1 1 30 ASN HB3 . . . . . . . . . . 362 . 18841 3 176 2 1 . . 2.825 . . 1 . 1 1 30 ASN HB2 . . . . . . . . . . 361 . 18841 3 176 3 1 . . 38.429 . . 1 . 1 1 30 ASN CB . . . . . . . . . . 167 . 18841 3 177 1 1 . . 2.720 . . 1 . 1 1 30 ASN HB3 . . . . . . . . . . 362 . 18841 3 177 2 1 . . 4.427 . . 1 . 1 1 30 ASN HA . . . . . . . . . . 360 . 18841 3 177 3 1 . . 38.419 . . 1 . 1 1 30 ASN CB . . . . . . . . . . 167 . 18841 3 182 1 1 . . 1.501 . . 1 . 1 1 33 LEU HB3 . . . . . . . . . . 371 . 18841 3 182 1 2 . . 1.501 . . 1 . 1 1 33 LEU HB2 . . . . . . . . . . 509 . 18841 3 182 2 1 . . 0.831 . . 1 . 1 1 33 LEU MD1 . . . . . . . . . . 685 . 18841 3 182 2 2 . . 0.831 . . 1 . 1 1 33 LEU MD2 . . . . . . . . . . 686 . 18841 3 182 3 1 . . 42.177 . . 1 . 1 1 33 LEU CB . . . . . . . . . . 152 . 18841 3 183 1 1 . . 1.504 . . 1 . 1 1 33 LEU HB2 . . . . . . . . . . 509 . 18841 3 183 1 2 . . 1.504 . . 1 . 1 1 33 LEU HB3 . . . . . . . . . . 371 . 18841 3 183 2 1 . . 3.658 . . 1 . 1 1 33 LEU HA . . . . . . . . . . 370 . 18841 3 183 3 1 . . 42.184 . . 1 . 1 1 33 LEU CB . . . . . . . . . . 152 . 18841 3 184 1 1 . . 1.493 . . 1 . 1 1 33 LEU HB3 . . . . . . . . . . 371 . 18841 3 184 1 2 . . 1.493 . . 1 . 1 1 33 LEU HB2 . . . . . . . . . . 509 . 18841 3 184 3 1 . . 42.189 . . 1 . 1 1 33 LEU CB . . . . . . . . . . 152 . 18841 3 185 1 1 . . 1.816 . . 1 . 1 1 48 ILE HB . . . . . . . . . . 760 . 18841 3 185 2 1 . . 1.476 . . 1 . 1 1 48 ILE HG13 . . . . . . . . . . 763 . 18841 3 185 3 1 . . 38.865 . . 1 . 1 1 48 ILE CB . . . . . . . . . . 413 . 18841 3 186 1 1 . . 1.817 . . 1 . 1 1 48 ILE HB . . . . . . . . . . 760 . 18841 3 186 2 2 . . 1.156 . . 1 . 1 1 48 ILE HG12 . . . . . . . . . . 762 . 18841 3 186 3 1 . . 38.847 . . 1 . 1 1 48 ILE CB . . . . . . . . . . 413 . 18841 3 187 1 1 . . 1.815 . . 1 . 1 1 48 ILE HB . . . . . . . . . . 760 . 18841 3 187 2 1 . . 0.899 . . 1 . 1 1 48 ILE MG . . . . . . . . . . 769 . 18841 3 187 3 1 . . 38.857 . . 1 . 1 1 48 ILE CB . . . . . . . . . . 413 . 18841 3 188 1 1 . . 1.814 . . 1 . 1 1 48 ILE HB . . . . . . . . . . 760 . 18841 3 188 3 1 . . 38.855 . . 1 . 1 1 48 ILE CB . . . . . . . . . . 413 . 18841 3 189 1 1 . . 1.804 . . 1 . 1 1 48 ILE HB . . . . . . . . . . 760 . 18841 3 189 3 1 . . 38.868 . . 1 . 1 1 48 ILE CB . . . . . . . . . . 413 . 18841 3 190 1 1 . . 2.022 . . 1 . 1 1 19 GLU HG3 . . . . . . . . . . 669 . 18841 3 190 3 1 . . 36.120 . . 1 . 1 1 19 GLU CG . . . . . . . . . . 564 . 18841 3 191 1 1 . . 2.023 . . 1 . 1 1 19 GLU HG3 . . . . . . . . . . 669 . 18841 3 191 3 1 . . 36.071 . . 1 . 1 1 19 GLU CG . . . . . . . . . . 564 . 18841 3 192 1 1 . . 2.080 . . 1 . 1 1 19 GLU HG2 . . . . . . . . . . 670 . 18841 3 192 3 1 . . 36.144 . . 1 . 1 1 19 GLU CG . . . . . . . . . . 564 . 18841 3 193 1 1 . . 2.020 . . 1 . 1 1 19 GLU HG3 . . . . . . . . . . 669 . 18841 3 193 3 1 . . 36.121 . . 1 . 1 1 19 GLU CG . . . . . . . . . . 564 . 18841 3 194 1 1 . . 2.080 . . 1 . 1 1 19 GLU HG2 . . . . . . . . . . 670 . 18841 3 194 3 1 . . 36.101 . . 1 . 1 1 19 GLU CG . . . . . . . . . . 564 . 18841 3 195 1 1 . . 2.189 . . 1 . 1 1 26 GLU HG2 . . . . . . . . . . 682 . 18841 3 195 1 2 . . 2.189 . . 1 . 1 1 26 GLU HG3 . . . . . . . . . . 681 . 18841 3 195 3 1 . . 36.129 . . 1 . 1 1 26 GLU CG . . . . . . . . . . 571 . 18841 3 196 1 1 . . 2.190 . . 1 . 1 1 26 GLU HG2 . . . . . . . . . . 682 . 18841 3 196 1 2 . . 2.190 . . 1 . 1 1 26 GLU HG3 . . . . . . . . . . 681 . 18841 3 196 3 1 . . 36.112 . . 1 . 1 1 26 GLU CG . . . . . . . . . . 571 . 18841 3 203 1 1 . . 2.421 . . 1 . 1 1 59 GLU HG2 . . . . . . . . . . 796 . 18841 3 203 3 1 . . 36.464 . . 1 . 1 1 59 GLU CG . . . . . . . . . . 601 . 18841 3 204 1 1 . . 2.421 . . 1 . 1 1 59 GLU HG2 . . . . . . . . . . 796 . 18841 3 204 3 1 . . 36.489 . . 1 . 1 1 59 GLU CG . . . . . . . . . . 601 . 18841 3 205 1 1 . . 2.411 . . 1 . 1 1 59 GLU HG2 . . . . . . . . . . 796 . 18841 3 205 3 1 . . 36.521 . . 1 . 1 1 59 GLU CG . . . . . . . . . . 601 . 18841 3 206 1 1 . . 2.425 . . 1 . 1 1 59 GLU HG2 . . . . . . . . . . 796 . 18841 3 206 3 1 . . 36.522 . . 1 . 1 1 59 GLU CG . . . . . . . . . . 601 . 18841 3 207 1 1 . . 2.415 . . 1 . 1 1 25 GLN HG2 . . . . . . . . . . 625 . 18841 3 207 1 2 . . 2.415 . . 1 . 1 1 25 GLN HG3 . . . . . . . . . . 624 . 18841 3 207 3 1 . . 34.091 . . 1 . 1 1 25 GLN CG . . . . . . . . . . 570 . 18841 3 208 1 1 . . 2.419 . . 1 . 1 1 25 GLN HG2 . . . . . . . . . . 625 . 18841 3 208 1 2 . . 2.419 . . 1 . 1 1 25 GLN HG3 . . . . . . . . . . 624 . 18841 3 208 3 1 . . 34.107 . . 1 . 1 1 25 GLN CG . . . . . . . . . . 570 . 18841 3 209 1 1 . . 2.323 . . 1 . 1 1 71 GLN HG2 . . . . . . . . . . 621 . 18841 3 209 1 2 . . 2.323 . . 1 . 1 1 71 GLN HG3 . . . . . . . . . . 620 . 18841 3 209 3 1 . . 34.393 . . 1 . 1 1 71 GLN CG . . . . . . . . . . 619 . 18841 3 210 1 1 . . 2.324 . . 1 . 1 1 71 GLN HG3 . . . . . . . . . . 620 . 18841 3 210 1 2 . . 2.324 . . 1 . 1 1 71 GLN HG2 . . . . . . . . . . 621 . 18841 3 210 3 1 . . 34.430 . . 1 . 1 1 71 GLN CG . . . . . . . . . . 619 . 18841 3 211 1 1 . . 3.209 . . 1 . 1 1 50 HIS HB3 . . . . . . . . . . 518 . 18841 3 211 1 2 . . 3.209 . . 1 . 1 1 50 HIS HB2 . . . . . . . . . . 422 . 18841 3 211 3 1 . . 29.919 . . 1 . 1 1 50 HIS CB . . . . . . . . . . 230 . 18841 3 212 1 1 . . 3.208 . . 1 . 1 1 50 HIS HB3 . . . . . . . . . . 518 . 18841 3 212 1 2 . . 3.208 . . 1 . 1 1 50 HIS HB2 . . . . . . . . . . 422 . 18841 3 212 3 1 . . 29.920 . . 1 . 1 1 50 HIS CB . . . . . . . . . . 230 . 18841 3 229 1 1 . . 2.145 . . 1 . 1 1 53 VAL HB . . . . . . . . . . 430 . 18841 3 229 3 1 . . 31.931 . . 1 . 1 1 53 VAL CB . . . . . . . . . . 227 . 18841 3 230 1 1 . . 2.144 . . 1 . 1 1 53 VAL HB . . . . . . . . . . 430 . 18841 3 230 3 1 . . 31.936 . . 1 . 1 1 53 VAL CB . . . . . . . . . . 227 . 18841 3 231 1 1 . . 2.143 . . 1 . 1 1 53 VAL HB . . . . . . . . . . 430 . 18841 3 231 3 1 . . 31.972 . . 1 . 1 1 53 VAL CB . . . . . . . . . . 227 . 18841 3 234 1 1 . . 2.106 . . 1 . 1 1 57 MET HB2 . . . . . . . . . . 442 . 18841 3 234 3 1 . . 32.225 . . 1 . 1 1 57 MET CB . . . . . . . . . . 218 . 18841 3 235 1 1 . . 2.082 . . 1 . 1 1 37 VAL HB . . . . . . . . . . 385 . 18841 3 235 3 1 . . 32.512 . . 1 . 1 1 37 VAL CB . . . . . . . . . . 378 . 18841 3 240 1 1 . . 2.009 . . 1 . 1 1 57 MET HB3 . . . . . . . . . . 443 . 18841 3 240 3 1 . . 32.326 . . 1 . 1 1 57 MET CB . . . . . . . . . . 218 . 18841 3 241 1 1 . . 2.008 . . 1 . 1 1 57 MET HB3 . . . . . . . . . . 443 . 18841 3 241 3 1 . . 32.181 . . 1 . 1 1 57 MET CB . . . . . . . . . . 218 . 18841 3 248 1 1 . . 1.805 . . 1 . 1 1 9 LYS HB2 . . . . . . . . . . 289 . 18841 3 248 1 2 . . 1.805 . . 1 . 1 1 9 LYS HB3 . . . . . . . . . . 494 . 18841 3 248 3 1 . . 32.403 . . 1 . 1 1 9 LYS CB . . . . . . . . . . 251 . 18841 3 249 1 1 . . 1.798 . . 1 . 1 1 9 LYS HB3 . . . . . . . . . . 494 . 18841 3 249 1 2 . . 1.798 . . 1 . 1 1 9 LYS HB2 . . . . . . . . . . 289 . 18841 3 249 3 1 . . 32.571 . . 1 . 1 1 9 LYS CB . . . . . . . . . . 251 . 18841 3 250 1 1 . . 1.797 . . 1 . 1 1 4 LYS HB3 . . . . . . . . . . 274 . 18841 3 250 3 1 . . 33.332 . . 1 . 1 1 4 LYS CB . . . . . . . . . . 261 . 18841 3 251 1 1 . . 1.726 . . 1 . 1 1 4 LYS HB2 . . . . . . . . . . 275 . 18841 3 251 3 1 . . 33.342 . . 1 . 1 1 4 LYS CB . . . . . . . . . . 261 . 18841 3 252 1 1 . . 1.604 . . 1 . 1 1 36 LYS HB3 . . . . . . . . . . 381 . 18841 3 252 2 1 . . 1.490 . . 1 . 1 1 36 LYS HB2 . . . . . . . . . . 382 . 18841 3 252 3 1 . . 32.309 . . 1 . 1 1 36 LYS CB . . . . . . . . . . 162 . 18841 3 253 1 1 . . 1.491 . . 1 . 1 1 36 LYS HB2 . . . . . . . . . . 382 . 18841 3 253 2 1 . . 1.599 . . 1 . 1 1 36 LYS HB3 . . . . . . . . . . 381 . 18841 3 253 3 1 . . 32.300 . . 1 . 1 1 36 LYS CB . . . . . . . . . . 162 . 18841 3 254 1 1 . . 1.603 . . 1 . 1 1 36 LYS HB3 . . . . . . . . . . 381 . 18841 3 254 3 1 . . 32.292 . . 1 . 1 1 36 LYS CB . . . . . . . . . . 162 . 18841 3 255 1 1 . . 1.487 . . 1 . 1 1 36 LYS HB2 . . . . . . . . . . 382 . 18841 3 255 3 1 . . 32.300 . . 1 . 1 1 36 LYS CB . . . . . . . . . . 162 . 18841 3 256 1 1 . . 1.607 . . 1 . 1 1 36 LYS HB3 . . . . . . . . . . 381 . 18841 3 256 3 1 . . 32.324 . . 1 . 1 1 36 LYS CB . . . . . . . . . . 162 . 18841 3 257 1 1 . . 1.491 . . 1 . 1 1 36 LYS HB2 . . . . . . . . . . 382 . 18841 3 257 3 1 . . 32.327 . . 1 . 1 1 36 LYS CB . . . . . . . . . . 162 . 18841 3 258 1 1 . . 1.598 . . 1 . 1 1 36 LYS HB3 . . . . . . . . . . 381 . 18841 3 258 3 1 . . 32.333 . . 1 . 1 1 36 LYS CB . . . . . . . . . . 162 . 18841 3 259 1 1 . . 1.494 . . 1 . 1 1 36 LYS HB2 . . . . . . . . . . 382 . 18841 3 259 3 1 . . 32.289 . . 1 . 1 1 36 LYS CB . . . . . . . . . . 162 . 18841 3 267 1 1 . . 1.916 . . 1 . 1 1 26 GLU HB3 . . . . . . . . . . 348 . 18841 3 267 3 1 . . 29.859 . . 1 . 1 1 26 GLU CB . . . . . . . . . . 174 . 18841 3 270 1 1 . . 1.918 . . 1 . 1 1 26 GLU HB3 . . . . . . . . . . 348 . 18841 3 270 3 1 . . 29.955 . . 1 . 1 1 26 GLU CB . . . . . . . . . . 174 . 18841 3 273 1 1 . . 2.032 . . 1 . 1 1 21 GLU HB2 . . . . . . . . . . 332 . 18841 3 273 1 2 . . 2.032 . . 1 . 1 1 21 GLU HB3 . . . . . . . . . . 502 . 18841 3 273 3 1 . . 30.635 . . 1 . 1 1 21 GLU CB . . . . . . . . . . 185 . 18841 3 274 1 1 . . 2.033 . . 1 . 1 1 21 GLU HB2 . . . . . . . . . . 332 . 18841 3 274 1 2 . . 2.033 . . 1 . 1 1 21 GLU HB3 . . . . . . . . . . 502 . 18841 3 274 3 1 . . 30.654 . . 1 . 1 1 21 GLU CB . . . . . . . . . . 185 . 18841 3 275 1 1 . . 2.086 . . 1 . 1 1 21 GLU HB2 . . . . . . . . . . 332 . 18841 3 275 1 2 . . 2.086 . . 1 . 1 1 21 GLU HB3 . . . . . . . . . . 502 . 18841 3 275 3 1 . . 30.659 . . 1 . 1 1 21 GLU CB . . . . . . . . . . 185 . 18841 3 285 1 1 . . 2.119 . . 1 . 1 1 71 GLN HB3 . . . . . . . . . . 622 . 18841 3 285 3 1 . . 30.629 . . 1 . 1 1 71 GLN CB . . . . . . . . . . 485 . 18841 3 286 1 1 . . 2.074 . . 1 . 1 1 67 GLU HB2 . . . . . . . . . . 474 . 18841 3 286 3 1 . . 30.138 . . 1 . 1 1 67 GLU CB . . . . . . . . . . 199 . 18841 3 287 1 1 . . 2.011 . . 1 . 1 1 67 GLU HB3 . . . . . . . . . . 475 . 18841 3 287 3 1 . . 30.138 . . 1 . 1 1 67 GLU CB . . . . . . . . . . 199 . 18841 3 288 1 1 . . 2.136 . . 1 . 1 1 25 GLN HB3 . . . . . . . . . . 344 . 18841 3 288 1 2 . . 2.136 . . 1 . 1 1 25 GLN HB2 . . . . . . . . . . 504 . 18841 3 288 3 1 . . 29.364 . . 1 . 1 1 25 GLN CB . . . . . . . . . . 177 . 18841 3 289 1 1 . . 2.136 . . 1 . 1 1 25 GLN HB3 . . . . . . . . . . 344 . 18841 3 289 1 2 . . 2.136 . . 1 . 1 1 25 GLN HB2 . . . . . . . . . . 504 . 18841 3 289 3 1 . . 29.405 . . 1 . 1 1 25 GLN CB . . . . . . . . . . 177 . 18841 3 290 1 1 . . 2.135 . . 1 . 1 1 25 GLN HB3 . . . . . . . . . . 344 . 18841 3 290 1 2 . . 2.135 . . 1 . 1 1 25 GLN HB2 . . . . . . . . . . 504 . 18841 3 290 3 1 . . 29.409 . . 1 . 1 1 25 GLN CB . . . . . . . . . . 177 . 18841 3 296 1 1 . . 1.392 . . 1 . 1 1 36 LYS HD2 . . . . . . . . . . 757 . 18841 3 296 1 2 . . 1.392 . . 1 . 1 1 36 LYS HD3 . . . . . . . . . . 756 . 18841 3 296 3 1 . . 28.841 . . 1 . 1 1 36 LYS CD . . . . . . . . . . 579 . 18841 3 297 1 1 . . 1.394 . . 1 . 1 1 36 LYS HD3 . . . . . . . . . . 756 . 18841 3 297 1 2 . . 1.394 . . 1 . 1 1 36 LYS HD2 . . . . . . . . . . 757 . 18841 3 297 3 1 . . 28.834 . . 1 . 1 1 36 LYS CD . . . . . . . . . . 579 . 18841 3 298 1 1 . . 1.394 . . 1 . 1 1 36 LYS HD3 . . . . . . . . . . 756 . 18841 3 298 1 2 . . 1.394 . . 1 . 1 1 36 LYS HD2 . . . . . . . . . . 757 . 18841 3 298 3 1 . . 28.845 . . 1 . 1 1 36 LYS CD . . . . . . . . . . 579 . 18841 3 299 1 1 . . 1.228 . . 1 . 1 1 23 ILE HG13 . . . . . . . . . . 678 . 18841 3 299 3 1 . . 27.923 . . 1 . 1 1 23 ILE CG1 . . . . . . . . . . 566 . 18841 3 300 1 1 . . 1.499 . . 1 . 1 1 23 ILE HG12 . . . . . . . . . . 677 . 18841 3 300 3 1 . . 27.905 . . 1 . 1 1 23 ILE CG1 . . . . . . . . . . 566 . 18841 3 301 1 1 . . 1.229 . . 1 . 1 1 23 ILE HG13 . . . . . . . . . . 678 . 18841 3 301 3 1 . . 27.920 . . 1 . 1 1 23 ILE CG1 . . . . . . . . . . 566 . 18841 3 302 1 1 . . 1.498 . . 1 . 1 1 23 ILE HG12 . . . . . . . . . . 677 . 18841 3 302 3 1 . . 27.906 . . 1 . 1 1 23 ILE CG1 . . . . . . . . . . 566 . 18841 3 303 1 1 . . 1.223 . . 1 . 1 1 23 ILE HG13 . . . . . . . . . . 678 . 18841 3 303 3 1 . . 27.953 . . 1 . 1 1 23 ILE CG1 . . . . . . . . . . 566 . 18841 3 304 1 1 . . 1.499 . . 1 . 1 1 23 ILE HG12 . . . . . . . . . . 677 . 18841 3 304 3 1 . . 27.900 . . 1 . 1 1 23 ILE CG1 . . . . . . . . . . 566 . 18841 3 305 1 1 . . 1.229 . . 1 . 1 1 23 ILE HG13 . . . . . . . . . . 678 . 18841 3 305 3 1 . . 27.922 . . 1 . 1 1 23 ILE CG1 . . . . . . . . . . 566 . 18841 3 306 1 1 . . 1.501 . . 1 . 1 1 23 ILE HG12 . . . . . . . . . . 677 . 18841 3 306 3 1 . . 27.939 . . 1 . 1 1 23 ILE CG1 . . . . . . . . . . 566 . 18841 3 307 1 1 . . 1.144 . . 1 . 1 1 48 ILE HG12 . . . . . . . . . . 762 . 18841 3 307 3 1 . . 26.871 . . 1 . 1 1 48 ILE CG1 . . . . . . . . . . 761 . 18841 3 310 1 1 . . 1.147 . . 1 . 1 1 48 ILE HG12 . . . . . . . . . . 762 . 18841 3 310 3 1 . . 26.880 . . 1 . 1 1 48 ILE CG1 . . . . . . . . . . 761 . 18841 3 311 1 1 . . 1.148 . . 1 . 1 1 48 ILE HG12 . . . . . . . . . . 762 . 18841 3 311 3 1 . . 26.875 . . 1 . 1 1 48 ILE CG1 . . . . . . . . . . 761 . 18841 3 312 1 1 . . 1.467 . . 1 . 1 1 60 ARG HG3 . . . . . . . . . . 815 . 18841 3 312 3 1 . . 27.122 . . 1 . 1 1 60 ARG CG . . . . . . . . . . 603 . 18841 3 313 1 1 . . 1.148 . . 1 . 1 1 48 ILE HG12 . . . . . . . . . . 762 . 18841 3 313 3 1 . . 26.926 . . 1 . 1 1 48 ILE CG1 . . . . . . . . . . 761 . 18841 3 315 1 1 . . 1.463 . . 1 . 1 1 60 ARG HG3 . . . . . . . . . . 815 . 18841 3 315 3 1 . . 27.209 . . 1 . 1 1 60 ARG CG . . . . . . . . . . 603 . 18841 3 316 1 1 . . 1.460 . . 1 . 1 1 60 ARG HG3 . . . . . . . . . . 815 . 18841 3 316 3 1 . . 27.171 . . 1 . 1 1 60 ARG CG . . . . . . . . . . 603 . 18841 3 323 1 1 . . 1.671 . . 1 . 1 1 56 ARG HG3 . . . . . . . . . . 798 . 18841 3 323 3 1 . . 27.572 . . 1 . 1 1 56 ARG CG . . . . . . . . . . 599 . 18841 3 325 1 1 . . 1.785 . . 1 . 1 1 56 ARG HG2 . . . . . . . . . . 721 . 18841 3 325 3 1 . . 27.617 . . 1 . 1 1 56 ARG CG . . . . . . . . . . 599 . 18841 3 326 1 1 . . 1.785 . . 1 . 1 1 56 ARG HG2 . . . . . . . . . . 721 . 18841 3 326 3 1 . . 27.611 . . 1 . 1 1 56 ARG CG . . . . . . . . . . 599 . 18841 3 327 1 1 . . 1.786 . . 1 . 1 1 56 ARG HG2 . . . . . . . . . . 721 . 18841 3 327 3 1 . . 27.621 . . 1 . 1 1 56 ARG CG . . . . . . . . . . 599 . 18841 3 328 1 1 . . 1.995 . . 1 . 1 1 49 PRO HG3 . . . . . . . . . . 710 . 18841 3 328 3 1 . . 27.651 . . 1 . 1 1 49 PRO CG . . . . . . . . . . 591 . 18841 3 330 1 1 . . 2.054 . . 1 . 1 1 49 PRO HG2 . . . . . . . . . . 782 . 18841 3 330 3 1 . . 27.616 . . 1 . 1 1 49 PRO CG . . . . . . . . . . 591 . 18841 3 331 1 1 . . 2.057 . . 1 . 1 1 49 PRO HG2 . . . . . . . . . . 782 . 18841 3 331 3 1 . . 27.653 . . 1 . 1 1 49 PRO CG . . . . . . . . . . 591 . 18841 3 332 1 1 . . 2.057 . . 1 . 1 1 49 PRO HG2 . . . . . . . . . . 782 . 18841 3 332 3 1 . . 27.654 . . 1 . 1 1 49 PRO CG . . . . . . . . . . 591 . 18841 3 333 1 1 . . 1.996 . . 1 . 1 1 49 PRO HG3 . . . . . . . . . . 710 . 18841 3 333 3 1 . . 27.639 . . 1 . 1 1 49 PRO CG . . . . . . . . . . 591 . 18841 3 334 1 1 . . 1.999 . . 1 . 1 1 49 PRO HG3 . . . . . . . . . . 710 . 18841 3 334 3 1 . . 27.639 . . 1 . 1 1 49 PRO CG . . . . . . . . . . 591 . 18841 3 337 1 1 . . 2.054 . . 1 . 1 1 49 PRO HG2 . . . . . . . . . . 782 . 18841 3 337 3 1 . . 27.633 . . 1 . 1 1 49 PRO CG . . . . . . . . . . 591 . 18841 3 338 1 1 . . 1.552 . . 1 . 1 1 63 LYS HG2 . . . . . . . . . . 786 . 18841 3 338 3 1 . . 25.161 . . 1 . 1 1 63 LYS CG . . . . . . . . . . 606 . 18841 3 339 1 1 . . 1.550 . . 1 . 1 1 63 LYS HG2 . . . . . . . . . . 786 . 18841 3 339 3 1 . . 25.173 . . 1 . 1 1 63 LYS CG . . . . . . . . . . 606 . 18841 3 340 1 1 . . 1.553 . . 1 . 1 1 63 LYS HG2 . . . . . . . . . . 786 . 18841 3 340 3 1 . . 25.131 . . 1 . 1 1 63 LYS CG . . . . . . . . . . 606 . 18841 3 341 1 1 . . 1.450 . . 1 . 1 1 63 LYS HG3 . . . . . . . . . . 728 . 18841 3 341 3 1 . . 25.173 . . 1 . 1 1 63 LYS CG . . . . . . . . . . 606 . 18841 3 342 1 1 . . 1.451 . . 1 . 1 1 63 LYS HG3 . . . . . . . . . . 728 . 18841 3 342 3 1 . . 25.173 . . 1 . 1 1 63 LYS CG . . . . . . . . . . 606 . 18841 3 343 1 1 . . 1.450 . . 1 . 1 1 63 LYS HG3 . . . . . . . . . . 728 . 18841 3 343 3 1 . . 25.173 . . 1 . 1 1 63 LYS CG . . . . . . . . . . 606 . 18841 3 346 1 1 . . 1.378 . . 1 . 1 1 4 LYS HG2 . . . . . . . . . . 644 . 18841 3 346 1 2 . . 1.378 . . 1 . 1 1 4 LYS HG3 . . . . . . . . . . 643 . 18841 3 346 3 1 . . 24.699 . . 1 . 1 1 4 LYS CG . . . . . . . . . . 531 . 18841 3 347 1 1 . . 1.118 . . 1 . 1 1 36 LYS HG3 . . . . . . . . . . 693 . 18841 3 347 1 2 . . 1.118 . . 1 . 1 1 36 LYS HG2 . . . . . . . . . . 696 . 18841 3 347 3 1 . . 24.226 . . 1 . 1 1 36 LYS CG . . . . . . . . . . 580 . 18841 3 348 1 1 . . 1.119 . . 1 . 1 1 36 LYS HG2 . . . . . . . . . . 696 . 18841 3 348 1 2 . . 1.119 . . 1 . 1 1 36 LYS HG3 . . . . . . . . . . 693 . 18841 3 348 3 1 . . 24.208 . . 1 . 1 1 36 LYS CG . . . . . . . . . . 580 . 18841 3 349 1 1 . . 1.119 . . 1 . 1 1 36 LYS HG3 . . . . . . . . . . 693 . 18841 3 349 1 2 . . 1.119 . . 1 . 1 1 36 LYS HG2 . . . . . . . . . . 696 . 18841 3 349 3 1 . . 24.295 . . 1 . 1 1 36 LYS CG . . . . . . . . . . 580 . 18841 3 350 1 1 . . 1.119 . . 1 . 1 1 36 LYS HG3 . . . . . . . . . . 693 . 18841 3 350 1 2 . . 1.119 . . 1 . 1 1 36 LYS HG2 . . . . . . . . . . 696 . 18841 3 350 3 1 . . 24.282 . . 1 . 1 1 36 LYS CG . . . . . . . . . . 580 . 18841 3 352 1 1 . . 0.836 . . 1 . 1 1 33 LEU MD2 . . . . . . . . . . 686 . 18841 3 352 3 1 . . 24.894 . . 1 . 1 1 33 LEU CD2 . . . . . . . . . . 574 . 18841 3 353 1 1 . . 0.835 . . 1 . 1 1 33 LEU MD2 . . . . . . . . . . 686 . 18841 3 353 3 1 . . 24.870 . . 1 . 1 1 33 LEU CD2 . . . . . . . . . . 574 . 18841 3 354 1 1 . . 0.834 . . 1 . 1 1 33 LEU MD2 . . . . . . . . . . 686 . 18841 3 354 3 1 . . 24.875 . . 1 . 1 1 33 LEU CD2 . . . . . . . . . . 574 . 18841 3 355 1 1 . . 0.823 . . 1 . 1 1 33 LEU MD1 . . . . . . . . . . 685 . 18841 3 355 3 1 . . 24.101 . . 1 . 1 1 33 LEU CD1 . . . . . . . . . . 575 . 18841 3 356 1 1 . . 0.823 . . 1 . 1 1 33 LEU MD1 . . . . . . . . . . 685 . 18841 3 356 3 1 . . 24.100 . . 1 . 1 1 33 LEU CD1 . . . . . . . . . . 575 . 18841 3 367 1 1 . . 0.997 . . 1 . 1 1 53 VAL MG1 . . . . . . . . . . 776 . 18841 3 367 3 1 . . 22.181 . . 1 . 1 1 53 VAL CG1 . . . . . . . . . . 594 . 18841 3 368 1 1 . . 0.997 . . 1 . 1 1 53 VAL MG1 . . . . . . . . . . 776 . 18841 3 368 3 1 . . 22.191 . . 1 . 1 1 53 VAL CG1 . . . . . . . . . . 594 . 18841 3 369 1 1 . . 0.996 . . 1 . 1 1 53 VAL MG1 . . . . . . . . . . 776 . 18841 3 369 3 1 . . 22.205 . . 1 . 1 1 53 VAL CG1 . . . . . . . . . . 594 . 18841 3 370 1 1 . . 1.000 . . 1 . 1 1 53 VAL MG1 . . . . . . . . . . 776 . 18841 3 370 3 1 . . 22.185 . . 1 . 1 1 53 VAL CG1 . . . . . . . . . . 594 . 18841 3 371 1 1 . . 0.996 . . 1 . 1 1 53 VAL MG1 . . . . . . . . . . 776 . 18841 3 371 3 1 . . 22.183 . . 1 . 1 1 53 VAL CG1 . . . . . . . . . . 594 . 18841 3 373 1 1 . . 1.223 . . 1 . 1 1 22 THR MG . . . . . . . . . . 674 . 18841 3 373 3 1 . . 21.936 . . 1 . 1 1 22 THR CG2 . . . . . . . . . . 673 . 18841 3 374 1 1 . . 1.233 . . 1 . 1 1 39 THR MG . . . . . . . . . . 699 . 18841 3 374 3 1 . . 21.658 . . 1 . 1 1 39 THR CG2 . . . . . . . . . . 583 . 18841 3 377 1 1 . . 1.234 . . 1 . 1 1 39 THR MG . . . . . . . . . . 699 . 18841 3 377 3 1 . . 21.642 . . 1 . 1 1 39 THR CG2 . . . . . . . . . . 583 . 18841 3 380 1 1 . . 1.398 . . 1 . 1 1 35 ALA MB . . . . . . . . . . 377 . 18841 3 380 3 1 . . 18.731 . . 1 . 1 1 35 ALA CB . . . . . . . . . . 149 . 18841 3 381 1 1 . . 1.396 . . 1 . 1 1 35 ALA MB . . . . . . . . . . 377 . 18841 3 381 3 1 . . 18.717 . . 1 . 1 1 35 ALA CB . . . . . . . . . . 149 . 18841 3 387 1 1 . . 1.529 . . 1 . 1 1 58 ALA MB . . . . . . . . . . 446 . 18841 3 387 3 1 . . 18.395 . . 1 . 1 1 58 ALA CB . . . . . . . . . . 217 . 18841 3 396 1 1 . . 0.913 . . 1 . 1 1 23 ILE MG . . . . . . . . . . 676 . 18841 3 396 3 1 . . 17.663 . . 1 . 1 1 23 ILE CG2 . . . . . . . . . . 567 . 18841 3 397 1 1 . . 0.912 . . 1 . 1 1 23 ILE MG . . . . . . . . . . 676 . 18841 3 397 3 1 . . 17.518 . . 1 . 1 1 23 ILE CG2 . . . . . . . . . . 567 . 18841 3 398 1 1 . . 0.918 . . 1 . 1 1 23 ILE MG . . . . . . . . . . 676 . 18841 3 398 3 1 . . 17.600 . . 1 . 1 1 23 ILE CG2 . . . . . . . . . . 567 . 18841 3 400 1 1 . . 0.910 . . 1 . 1 1 48 ILE MG . . . . . . . . . . 769 . 18841 3 400 3 1 . . 17.357 . . 1 . 1 1 48 ILE CG2 . . . . . . . . . . 768 . 18841 3 401 1 1 . . 0.909 . . 1 . 1 1 48 ILE MG . . . . . . . . . . 769 . 18841 3 401 3 1 . . 17.314 . . 1 . 1 1 48 ILE CG2 . . . . . . . . . . 768 . 18841 3 402 1 1 . . 0.910 . . 1 . 1 1 48 ILE MG . . . . . . . . . . 769 . 18841 3 402 3 1 . . 17.313 . . 1 . 1 1 48 ILE CG2 . . . . . . . . . . 768 . 18841 3 403 1 1 . . 0.913 . . 1 . 1 1 23 ILE MG . . . . . . . . . . 676 . 18841 3 403 3 1 . . 17.692 . . 1 . 1 1 23 ILE CG2 . . . . . . . . . . 567 . 18841 3 404 1 1 . . 0.910 . . 1 . 1 1 48 ILE MG . . . . . . . . . . 769 . 18841 3 404 3 1 . . 17.324 . . 1 . 1 1 48 ILE CG2 . . . . . . . . . . 768 . 18841 3 405 1 1 . . 0.911 . . 1 . 1 1 48 ILE MG . . . . . . . . . . 769 . 18841 3 405 3 1 . . 17.273 . . 1 . 1 1 48 ILE CG2 . . . . . . . . . . 768 . 18841 3 406 1 1 . . 0.862 . . 1 . 1 1 23 ILE MD . . . . . . . . . . 675 . 18841 3 406 3 1 . . 13.162 . . 1 . 1 1 23 ILE CD1 . . . . . . . . . . 568 . 18841 3 407 1 1 . . 0.860 . . 1 . 1 1 23 ILE MD . . . . . . . . . . 675 . 18841 3 407 3 1 . . 13.151 . . 1 . 1 1 23 ILE CD1 . . . . . . . . . . 568 . 18841 3 408 1 1 . . 0.859 . . 1 . 1 1 23 ILE MD . . . . . . . . . . 675 . 18841 3 408 3 1 . . 13.139 . . 1 . 1 1 23 ILE CD1 . . . . . . . . . . 568 . 18841 3 409 1 1 . . 0.862 . . 1 . 1 1 23 ILE MD . . . . . . . . . . 675 . 18841 3 409 3 1 . . 13.180 . . 1 . 1 1 23 ILE CD1 . . . . . . . . . . 568 . 18841 3 410 1 1 . . 0.837 . . 1 . 1 1 48 ILE MD . . . . . . . . . . 767 . 18841 3 410 3 1 . . 12.852 . . 1 . 1 1 48 ILE CD1 . . . . . . . . . . 766 . 18841 3 411 1 1 . . 0.838 . . 1 . 1 1 48 ILE MD . . . . . . . . . . 767 . 18841 3 411 3 1 . . 12.869 . . 1 . 1 1 48 ILE CD1 . . . . . . . . . . 766 . 18841 3 412 1 1 . . 0.838 . . 1 . 1 1 48 ILE MD . . . . . . . . . . 767 . 18841 3 412 3 1 . . 12.848 . . 1 . 1 1 48 ILE CD1 . . . . . . . . . . 766 . 18841 3 413 1 1 . . 0.838 . . 1 . 1 1 48 ILE MD . . . . . . . . . . 767 . 18841 3 413 3 1 . . 12.811 . . 1 . 1 1 48 ILE CD1 . . . . . . . . . . 766 . 18841 3 stop_ save_