data_c18126_2lr2 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c18126_2lr2 _Entry.Title ; Backbone Chemical Shifts of the designed protein Z-L2LBT ; _Entry.Version_type original _Entry.Submission_date 2011-12-08 _Entry.Accession_date 2011-12-08 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.31 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Adam Barb . W. . c18126_2lr2 2 Tienhuei Ho . G. . c18126_2lr2 3 James Prestegard . H. . c18126_2lr2 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c18126_2lr2 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 223 c18126_2lr2 '1H chemical shifts' 73 c18126_2lr2 '15N chemical shifts' 73 c18126_2lr2 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2012-09-10 2011-12-08 original author . c18126_2lr2 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID c18126_2lr2 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Designed IgG and lanthanide binding probe for solution NMR, MRI and luminescence microscopy' _Citation.Status submitted _Citation.Type journal _Citation.Journal_abbrev 'Not known' _Citation.Journal_name_full . _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 . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Adam Barb . W. . c18126_2lr2 1 2 Tienhuei Ho . G. . c18126_2lr2 1 3 Heather Flanagan-Steet . . . c18126_2lr2 1 4 James Prestegard . H. . c18126_2lr2 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c18126_2lr2 _Assembly.ID 1 _Assembly.Name Z-L2LBT _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 Z-L2LBT 1 $Z-L2LBT A . yes native no no . . . c18126_2lr2 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Z-L2LBT _Entity.Sf_category entity _Entity.Sf_framecode Z-L2LBT _Entity.Entry_ID c18126_2lr2 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Z-L2LBT _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MGSSHHHHHHSSGVDNKFNK EQQNAFYEILHLPNLNEEQR NAFIQSLKDDSYIDTNNDGA YEGDELSGSQSANLLAEAKK LNDAQAPK ; _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 88 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2012-09-17 loop_ _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 no PDB 2LR2 . 'Designed Igg And Lanthanide Binding Probe For Solution Nmr, Mri And Luminescence Microscopy' . . . . . 100.00 88 100.00 100.00 3.13e-56 . . . . c18126_2lr2 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 1 MET . c18126_2lr2 1 2 2 GLY . c18126_2lr2 1 3 3 SER . c18126_2lr2 1 4 4 SER . c18126_2lr2 1 5 5 HIS . c18126_2lr2 1 6 6 HIS . c18126_2lr2 1 7 7 HIS . c18126_2lr2 1 8 8 HIS . c18126_2lr2 1 9 9 HIS . c18126_2lr2 1 10 10 HIS . c18126_2lr2 1 11 11 SER . c18126_2lr2 1 12 12 SER . c18126_2lr2 1 13 13 GLY . c18126_2lr2 1 14 14 VAL . c18126_2lr2 1 15 15 ASP . c18126_2lr2 1 16 16 ASN . c18126_2lr2 1 17 17 LYS . c18126_2lr2 1 18 18 PHE . c18126_2lr2 1 19 19 ASN . c18126_2lr2 1 20 20 LYS . c18126_2lr2 1 21 21 GLU . c18126_2lr2 1 22 22 GLN . c18126_2lr2 1 23 23 GLN . c18126_2lr2 1 24 24 ASN . c18126_2lr2 1 25 25 ALA . c18126_2lr2 1 26 26 PHE . c18126_2lr2 1 27 27 TYR . c18126_2lr2 1 28 28 GLU . c18126_2lr2 1 29 29 ILE . c18126_2lr2 1 30 30 LEU . c18126_2lr2 1 31 31 HIS . c18126_2lr2 1 32 32 LEU . c18126_2lr2 1 33 33 PRO . c18126_2lr2 1 34 34 ASN . c18126_2lr2 1 35 35 LEU . c18126_2lr2 1 36 36 ASN . c18126_2lr2 1 37 37 GLU . c18126_2lr2 1 38 38 GLU . c18126_2lr2 1 39 39 GLN . c18126_2lr2 1 40 40 ARG . c18126_2lr2 1 41 41 ASN . c18126_2lr2 1 42 42 ALA . c18126_2lr2 1 43 43 PHE . c18126_2lr2 1 44 44 ILE . c18126_2lr2 1 45 45 GLN . c18126_2lr2 1 46 46 SER . c18126_2lr2 1 47 47 LEU . c18126_2lr2 1 48 48 LYS . c18126_2lr2 1 49 49 ASP . c18126_2lr2 1 50 50 ASP . c18126_2lr2 1 51 51 SER . c18126_2lr2 1 52 52 TYR . c18126_2lr2 1 53 53 ILE . c18126_2lr2 1 54 54 ASP . c18126_2lr2 1 55 55 THR . c18126_2lr2 1 56 56 ASN . c18126_2lr2 1 57 57 ASN . c18126_2lr2 1 58 58 ASP . c18126_2lr2 1 59 59 GLY . c18126_2lr2 1 60 60 ALA . c18126_2lr2 1 61 61 TYR . c18126_2lr2 1 62 62 GLU . c18126_2lr2 1 63 63 GLY . c18126_2lr2 1 64 64 ASP . c18126_2lr2 1 65 65 GLU . c18126_2lr2 1 66 66 LEU . c18126_2lr2 1 67 67 SER . c18126_2lr2 1 68 68 GLY . c18126_2lr2 1 69 69 SER . c18126_2lr2 1 70 70 GLN . c18126_2lr2 1 71 71 SER . c18126_2lr2 1 72 72 ALA . c18126_2lr2 1 73 73 ASN . c18126_2lr2 1 74 74 LEU . c18126_2lr2 1 75 75 LEU . c18126_2lr2 1 76 76 ALA . c18126_2lr2 1 77 77 GLU . c18126_2lr2 1 78 78 ALA . c18126_2lr2 1 79 79 LYS . c18126_2lr2 1 80 80 LYS . c18126_2lr2 1 81 81 LEU . c18126_2lr2 1 82 82 ASN . c18126_2lr2 1 83 83 ASP . c18126_2lr2 1 84 84 ALA . c18126_2lr2 1 85 85 GLN . c18126_2lr2 1 86 86 ALA . c18126_2lr2 1 87 87 PRO . c18126_2lr2 1 88 88 LYS . c18126_2lr2 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 c18126_2lr2 1 . GLY 2 2 c18126_2lr2 1 . SER 3 3 c18126_2lr2 1 . SER 4 4 c18126_2lr2 1 . HIS 5 5 c18126_2lr2 1 . HIS 6 6 c18126_2lr2 1 . HIS 7 7 c18126_2lr2 1 . HIS 8 8 c18126_2lr2 1 . HIS 9 9 c18126_2lr2 1 . HIS 10 10 c18126_2lr2 1 . SER 11 11 c18126_2lr2 1 . SER 12 12 c18126_2lr2 1 . GLY 13 13 c18126_2lr2 1 . VAL 14 14 c18126_2lr2 1 . ASP 15 15 c18126_2lr2 1 . ASN 16 16 c18126_2lr2 1 . LYS 17 17 c18126_2lr2 1 . PHE 18 18 c18126_2lr2 1 . ASN 19 19 c18126_2lr2 1 . LYS 20 20 c18126_2lr2 1 . GLU 21 21 c18126_2lr2 1 . GLN 22 22 c18126_2lr2 1 . GLN 23 23 c18126_2lr2 1 . ASN 24 24 c18126_2lr2 1 . ALA 25 25 c18126_2lr2 1 . PHE 26 26 c18126_2lr2 1 . TYR 27 27 c18126_2lr2 1 . GLU 28 28 c18126_2lr2 1 . ILE 29 29 c18126_2lr2 1 . LEU 30 30 c18126_2lr2 1 . HIS 31 31 c18126_2lr2 1 . LEU 32 32 c18126_2lr2 1 . PRO 33 33 c18126_2lr2 1 . ASN 34 34 c18126_2lr2 1 . LEU 35 35 c18126_2lr2 1 . ASN 36 36 c18126_2lr2 1 . GLU 37 37 c18126_2lr2 1 . GLU 38 38 c18126_2lr2 1 . GLN 39 39 c18126_2lr2 1 . ARG 40 40 c18126_2lr2 1 . ASN 41 41 c18126_2lr2 1 . ALA 42 42 c18126_2lr2 1 . PHE 43 43 c18126_2lr2 1 . ILE 44 44 c18126_2lr2 1 . GLN 45 45 c18126_2lr2 1 . SER 46 46 c18126_2lr2 1 . LEU 47 47 c18126_2lr2 1 . LYS 48 48 c18126_2lr2 1 . ASP 49 49 c18126_2lr2 1 . ASP 50 50 c18126_2lr2 1 . SER 51 51 c18126_2lr2 1 . TYR 52 52 c18126_2lr2 1 . ILE 53 53 c18126_2lr2 1 . ASP 54 54 c18126_2lr2 1 . THR 55 55 c18126_2lr2 1 . ASN 56 56 c18126_2lr2 1 . ASN 57 57 c18126_2lr2 1 . ASP 58 58 c18126_2lr2 1 . GLY 59 59 c18126_2lr2 1 . ALA 60 60 c18126_2lr2 1 . TYR 61 61 c18126_2lr2 1 . GLU 62 62 c18126_2lr2 1 . GLY 63 63 c18126_2lr2 1 . ASP 64 64 c18126_2lr2 1 . GLU 65 65 c18126_2lr2 1 . LEU 66 66 c18126_2lr2 1 . SER 67 67 c18126_2lr2 1 . GLY 68 68 c18126_2lr2 1 . SER 69 69 c18126_2lr2 1 . GLN 70 70 c18126_2lr2 1 . SER 71 71 c18126_2lr2 1 . ALA 72 72 c18126_2lr2 1 . ASN 73 73 c18126_2lr2 1 . LEU 74 74 c18126_2lr2 1 . LEU 75 75 c18126_2lr2 1 . ALA 76 76 c18126_2lr2 1 . GLU 77 77 c18126_2lr2 1 . ALA 78 78 c18126_2lr2 1 . LYS 79 79 c18126_2lr2 1 . LYS 80 80 c18126_2lr2 1 . LEU 81 81 c18126_2lr2 1 . ASN 82 82 c18126_2lr2 1 . ASP 83 83 c18126_2lr2 1 . ALA 84 84 c18126_2lr2 1 . GLN 85 85 c18126_2lr2 1 . ALA 86 86 c18126_2lr2 1 . PRO 87 87 c18126_2lr2 1 . LYS 88 88 c18126_2lr2 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 c18126_2lr2 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Z-L2LBT . . 'no natural source' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . c18126_2lr2 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 c18126_2lr2 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Z-L2LBT . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . . . . . . . . . . . . . . pET29 . . . . . . c18126_2lr2 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID c18126_2lr2 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Z-L2LBT '[U-98% 13C; U-98% 15N]' . . 1 $Z-L2LBT . . . 100 800 uM . . . . c18126_2lr2 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . c18126_2lr2 1 3 D2O [U-2H] . . . . . . 10 . . % . . . . c18126_2lr2 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID c18126_2lr2 _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 temperature 273 . K c18126_2lr2 1 pH 8.0 . pH c18126_2lr2 1 pressure 1 . atm c18126_2lr2 1 'ionic strength' 0.1 . M c18126_2lr2 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID c18126_2lr2 _Software.ID 1 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . c18126_2lr2 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' c18126_2lr2 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID c18126_2lr2 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model VXRS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID c18126_2lr2 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _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 c18126_2lr2 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian VXRS . 900 . . . c18126_2lr2 1 2 spectrometer_2 Varian INOVA . 600 . . . c18126_2lr2 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 c18126_2lr2 _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.X_ray_instrument_ID _Experiment.X_ray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c18126_2lr2 1 2 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c18126_2lr2 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c18126_2lr2 1 4 '3D HN(COCA)CB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c18126_2lr2 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 c18126_2lr2 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.07 internal direct 1.000000000 . . . . . . . . . c18126_2lr2 1 C 13 DSS 'methyl protons' . . . . ppm 0.07 internal indirect 0.251449530 . . . . . . . . . c18126_2lr2 1 N 15 DSS 'methyl protons' . . . . ppm 0.07 internal indirect 0.101329118 . . . . . . . . . c18126_2lr2 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID c18126_2lr2 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . c18126_2lr2 1 2 '3D HNCO' . . . c18126_2lr2 1 3 '3D HNCACB' . . . c18126_2lr2 1 4 '3D HN(COCA)CB' . . . c18126_2lr2 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 12 12 SER C C 13 175.01 0.1 . 1 . . . . 12 SER C . c18126_2lr2 1 2 . 1 1 12 12 SER CA C 13 58.43 0.2 . 1 . . . . 12 SER CA . c18126_2lr2 1 3 . 1 1 12 12 SER CB C 13 64.01 0.2 . 1 . . . . 12 SER CB . c18126_2lr2 1 4 . 1 1 13 13 GLY H H 1 8.38 0.01 . 1 . . . . 13 GLY HN . c18126_2lr2 1 5 . 1 1 13 13 GLY C C 13 174.24 0.1 . 1 . . . . 13 GLY C . c18126_2lr2 1 6 . 1 1 13 13 GLY CA C 13 45.02 0.2 . 1 . . . . 13 GLY CA . c18126_2lr2 1 7 . 1 1 13 13 GLY N N 15 110.55 0.1 . 1 . . . . 13 GLY N . c18126_2lr2 1 8 . 1 1 14 14 VAL H H 1 7.90 0.01 . 1 . . . . 14 VAL HN . c18126_2lr2 1 9 . 1 1 14 14 VAL C C 13 175.77 0.1 . 1 . . . . 14 VAL C . c18126_2lr2 1 10 . 1 1 14 14 VAL CA C 13 61.92 0.2 . 1 . . . . 14 VAL CA . c18126_2lr2 1 11 . 1 1 14 14 VAL CB C 13 31.99 0.2 . 1 . . . . 14 VAL CB . c18126_2lr2 1 12 . 1 1 14 14 VAL N N 15 118.64 0.1 . 1 . . . . 14 VAL N . c18126_2lr2 1 13 . 1 1 15 15 ASP H H 1 8.25 0.01 . 1 . . . . 15 ASP HN . c18126_2lr2 1 14 . 1 1 15 15 ASP C C 13 175.99 0.1 . 1 . . . . 15 ASP C . c18126_2lr2 1 15 . 1 1 15 15 ASP CA C 13 53.90 0.2 . 1 . . . . 15 ASP CA . c18126_2lr2 1 16 . 1 1 15 15 ASP CB C 13 40.72 0.2 . 1 . . . . 15 ASP CB . c18126_2lr2 1 17 . 1 1 15 15 ASP N N 15 122.78 0.1 . 1 . . . . 15 ASP N . c18126_2lr2 1 18 . 1 1 16 16 ASN H H 1 8.18 0.01 . 1 . . . . 16 ASN HN . c18126_2lr2 1 19 . 1 1 16 16 ASN C C 13 175.13 0.1 . 1 . . . . 16 ASN C . c18126_2lr2 1 20 . 1 1 16 16 ASN CA C 13 53.33 0.2 . 1 . . . . 16 ASN CA . c18126_2lr2 1 21 . 1 1 16 16 ASN CB C 13 38.26 0.2 . 1 . . . . 16 ASN CB . c18126_2lr2 1 22 . 1 1 16 16 ASN N N 15 119.37 0.1 . 1 . . . . 16 ASN N . c18126_2lr2 1 23 . 1 1 17 17 LYS H H 1 8.23 0.01 . 1 . . . . 17 LYS HN . c18126_2lr2 1 24 . 1 1 17 17 LYS C C 13 176.52 0.1 . 1 . . . . 17 LYS C . c18126_2lr2 1 25 . 1 1 17 17 LYS CA C 13 56.20 0.2 . 1 . . . . 17 LYS CA . c18126_2lr2 1 26 . 1 1 17 17 LYS CB C 13 31.40 0.2 . 1 . . . . 17 LYS CB . c18126_2lr2 1 27 . 1 1 17 17 LYS N N 15 120.44 0.1 . 1 . . . . 17 LYS N . c18126_2lr2 1 28 . 1 1 18 18 PHE H H 1 8.00 0.01 . 1 . . . . 18 PHE HN . c18126_2lr2 1 29 . 1 1 18 18 PHE C C 13 176.59 0.1 . 1 . . . . 18 PHE C . c18126_2lr2 1 30 . 1 1 18 18 PHE CA C 13 56.10 0.2 . 1 . . . . 18 PHE CA . c18126_2lr2 1 31 . 1 1 18 18 PHE CB C 13 39.20 0.2 . 1 . . . . 18 PHE CB . c18126_2lr2 1 32 . 1 1 18 18 PHE N N 15 119.69 0.1 . 1 . . . . 18 PHE N . c18126_2lr2 1 33 . 1 1 19 19 ASN H H 1 8.59 0.01 . 1 . . . . 19 ASN HN . c18126_2lr2 1 34 . 1 1 19 19 ASN C C 13 175.66 0.1 . 1 . . . . 19 ASN C . c18126_2lr2 1 35 . 1 1 19 19 ASN CA C 13 52.27 0.2 . 1 . . . . 19 ASN CA . c18126_2lr2 1 36 . 1 1 19 19 ASN CB C 13 38.12 0.2 . 1 . . . . 19 ASN CB . c18126_2lr2 1 37 . 1 1 19 19 ASN N N 15 120.44 0.1 . 1 . . . . 19 ASN N . c18126_2lr2 1 38 . 1 1 20 20 LYS H H 1 8.39 0.01 . 1 . . . . 20 LYS HN . c18126_2lr2 1 39 . 1 1 20 20 LYS C C 13 178.17 0.1 . 1 . . . . 20 LYS C . c18126_2lr2 1 40 . 1 1 20 20 LYS CA C 13 58.96 0.2 . 1 . . . . 20 LYS CA . c18126_2lr2 1 41 . 1 1 20 20 LYS CB C 13 31.64 0.2 . 1 . . . . 20 LYS CB . c18126_2lr2 1 42 . 1 1 20 20 LYS N N 15 119.91 0.1 . 1 . . . . 20 LYS N . c18126_2lr2 1 43 . 1 1 21 21 GLU H H 1 8.28 0.01 . 1 . . . . 21 GLU HN . c18126_2lr2 1 44 . 1 1 21 21 GLU C C 13 179.42 0.1 . 1 . . . . 21 GLU C . c18126_2lr2 1 45 . 1 1 21 21 GLU CA C 13 58.90 0.2 . 1 . . . . 21 GLU CA . c18126_2lr2 1 46 . 1 1 21 21 GLU CB C 13 28.40 0.2 . 1 . . . . 21 GLU CB . c18126_2lr2 1 47 . 1 1 21 21 GLU N N 15 119.62 0.1 . 1 . . . . 21 GLU N . c18126_2lr2 1 48 . 1 1 22 22 GLN H H 1 8.36 0.01 . 1 . . . . 22 GLN HN . c18126_2lr2 1 49 . 1 1 22 22 GLN C C 13 177.26 0.1 . 1 . . . . 22 GLN C . c18126_2lr2 1 50 . 1 1 22 22 GLN CA C 13 57.91 0.2 . 1 . . . . 22 GLN CA . c18126_2lr2 1 51 . 1 1 22 22 GLN CB C 13 28.40 0.2 . 1 . . . . 22 GLN CB . c18126_2lr2 1 52 . 1 1 22 22 GLN N N 15 120.26 0.1 . 1 . . . . 22 GLN N . c18126_2lr2 1 53 . 1 1 23 23 GLN H H 1 8.46 0.01 . 1 . . . . 23 GLN HN . c18126_2lr2 1 54 . 1 1 23 23 GLN C C 13 177.95 0.1 . 1 . . . . 23 GLN C . c18126_2lr2 1 55 . 1 1 23 23 GLN CA C 13 58.12 0.2 . 1 . . . . 23 GLN CA . c18126_2lr2 1 56 . 1 1 23 23 GLN CB C 13 27.97 0.2 . 1 . . . . 23 GLN CB . c18126_2lr2 1 57 . 1 1 23 23 GLN N N 15 118.30 0.1 . 1 . . . . 23 GLN N . c18126_2lr2 1 58 . 1 1 24 24 ASN H H 1 8.23 0.01 . 1 . . . . 24 ASN HN . c18126_2lr2 1 59 . 1 1 24 24 ASN C C 13 177.06 0.1 . 1 . . . . 24 ASN C . c18126_2lr2 1 60 . 1 1 24 24 ASN CA C 13 55.58 0.2 . 1 . . . . 24 ASN CA . c18126_2lr2 1 61 . 1 1 24 24 ASN CB C 13 37.90 0.2 . 1 . . . . 24 ASN CB . c18126_2lr2 1 62 . 1 1 24 24 ASN N N 15 117.75 0.1 . 1 . . . . 24 ASN N . c18126_2lr2 1 63 . 1 1 25 25 ALA H H 1 7.97 0.01 . 1 . . . . 25 ALA HN . c18126_2lr2 1 64 . 1 1 25 25 ALA C C 13 178.36 0.1 . 1 . . . . 25 ALA C . c18126_2lr2 1 65 . 1 1 25 25 ALA CA C 13 54.90 0.2 . 1 . . . . 25 ALA CA . c18126_2lr2 1 66 . 1 1 25 25 ALA CB C 13 17.83 0.2 . 1 . . . . 25 ALA CB . c18126_2lr2 1 67 . 1 1 25 25 ALA N N 15 122.41 0.1 . 1 . . . . 25 ALA N . c18126_2lr2 1 68 . 1 1 26 26 PHE H H 1 8.28 0.01 . 1 . . . . 26 PHE HN . c18126_2lr2 1 69 . 1 1 26 26 PHE C C 13 176.44 0.1 . 1 . . . . 26 PHE C . c18126_2lr2 1 70 . 1 1 26 26 PHE CA C 13 60.16 0.2 . 1 . . . . 26 PHE CA . c18126_2lr2 1 71 . 1 1 26 26 PHE CB C 13 38.19 0.2 . 1 . . . . 26 PHE CB . c18126_2lr2 1 72 . 1 1 26 26 PHE N N 15 117.36 0.1 . 1 . . . . 26 PHE N . c18126_2lr2 1 73 . 1 1 27 27 TYR H H 1 7.95 0.01 . 1 . . . . 27 TYR HN . c18126_2lr2 1 74 . 1 1 27 27 TYR C C 13 178.63 0.1 . 1 . . . . 27 TYR C . c18126_2lr2 1 75 . 1 1 27 27 TYR CA C 13 61.57 0.2 . 1 . . . . 27 TYR CA . c18126_2lr2 1 76 . 1 1 27 27 TYR CB C 13 37.83 0.2 . 1 . . . . 27 TYR CB . c18126_2lr2 1 77 . 1 1 27 27 TYR N N 15 117.02 0.1 . 1 . . . . 27 TYR N . c18126_2lr2 1 78 . 1 1 28 28 GLU H H 1 8.24 0.01 . 1 . . . . 28 GLU HN . c18126_2lr2 1 79 . 1 1 28 28 GLU C C 13 180.17 0.1 . 1 . . . . 28 GLU C . c18126_2lr2 1 80 . 1 1 28 28 GLU CA C 13 59.67 0.2 . 1 . . . . 28 GLU CA . c18126_2lr2 1 81 . 1 1 28 28 GLU CB C 13 29.17 0.2 . 1 . . . . 28 GLU CB . c18126_2lr2 1 82 . 1 1 28 28 GLU N N 15 118.29 0.1 . 1 . . . . 28 GLU N . c18126_2lr2 1 83 . 1 1 29 29 ILE H H 1 8.27 0.01 . 1 . . . . 29 ILE HN . c18126_2lr2 1 84 . 1 1 29 29 ILE C C 13 178.14 0.1 . 1 . . . . 29 ILE C . c18126_2lr2 1 85 . 1 1 29 29 ILE CA C 13 64.13 0.2 . 1 . . . . 29 ILE CA . c18126_2lr2 1 86 . 1 1 29 29 ILE CB C 13 36.21 0.2 . 1 . . . . 29 ILE CB . c18126_2lr2 1 87 . 1 1 29 29 ILE N N 15 119.00 0.1 . 1 . . . . 29 ILE N . c18126_2lr2 1 88 . 1 1 30 30 LEU H H 1 7.98 0.01 . 1 . . . . 30 LEU HN . c18126_2lr2 1 89 . 1 1 30 30 LEU C C 13 177.11 0.1 . 1 . . . . 30 LEU C . c18126_2lr2 1 90 . 1 1 30 30 LEU CA C 13 56.85 0.2 . 1 . . . . 30 LEU CA . c18126_2lr2 1 91 . 1 1 30 30 LEU CB C 13 40.72 0.2 . 1 . . . . 30 LEU CB . c18126_2lr2 1 92 . 1 1 30 30 LEU N N 15 117.98 0.1 . 1 . . . . 30 LEU N . c18126_2lr2 1 93 . 1 1 31 31 HIS H H 1 7.18 0.01 . 1 . . . . 31 HIS HN . c18126_2lr2 1 94 . 1 1 31 31 HIS C C 13 174.90 0.1 . 1 . . . . 31 HIS C . c18126_2lr2 1 95 . 1 1 31 31 HIS CA C 13 55.93 0.2 . 1 . . . . 31 HIS CA . c18126_2lr2 1 96 . 1 1 31 31 HIS CB C 13 29.10 0.2 . 1 . . . . 31 HIS CB . c18126_2lr2 1 97 . 1 1 31 31 HIS N N 15 112.37 0.1 . 1 . . . . 31 HIS N . c18126_2lr2 1 98 . 1 1 32 32 LEU H H 1 7.17 0.01 . 1 . . . . 32 LEU HN . c18126_2lr2 1 99 . 1 1 32 32 LEU CA C 13 52.84 0.2 . 1 . . . . 32 LEU CA . c18126_2lr2 1 100 . 1 1 32 32 LEU CB C 13 39.45 0.2 . 1 . . . . 32 LEU CB . c18126_2lr2 1 101 . 1 1 32 32 LEU N N 15 123.86 0.1 . 1 . . . . 32 LEU N . c18126_2lr2 1 102 . 1 1 33 33 PRO C C 13 178.07 0.1 . 1 . . . . 33 PRO C . c18126_2lr2 1 103 . 1 1 33 33 PRO CA C 13 64.56 0.2 . 1 . . . . 33 PRO CA . c18126_2lr2 1 104 . 1 1 33 33 PRO CB C 13 32.02 0.2 . 1 . . . . 33 PRO CB . c18126_2lr2 1 105 . 1 1 34 34 ASN H H 1 8.88 0.01 . 1 . . . . 34 ASN HN . c18126_2lr2 1 106 . 1 1 34 34 ASN C C 13 176.27 0.1 . 1 . . . . 34 ASN C . c18126_2lr2 1 107 . 1 1 34 34 ASN CA C 13 52.41 0.2 . 1 . . . . 34 ASN CA . c18126_2lr2 1 108 . 1 1 34 34 ASN CB C 13 38.26 0.2 . 1 . . . . 34 ASN CB . c18126_2lr2 1 109 . 1 1 34 34 ASN N N 15 113.55 0.1 . 1 . . . . 34 ASN N . c18126_2lr2 1 110 . 1 1 35 35 LEU H H 1 6.55 0.01 . 1 . . . . 35 LEU HN . c18126_2lr2 1 111 . 1 1 35 35 LEU C C 13 176.51 0.1 . 1 . . . . 35 LEU C . c18126_2lr2 1 112 . 1 1 35 35 LEU CA C 13 54.10 0.2 . 1 . . . . 35 LEU CA . c18126_2lr2 1 113 . 1 1 35 35 LEU CB C 13 42.06 0.2 . 1 . . . . 35 LEU CB . c18126_2lr2 1 114 . 1 1 35 35 LEU N N 15 117.55 0.1 . 1 . . . . 35 LEU N . c18126_2lr2 1 115 . 1 1 36 36 ASN H H 1 8.54 0.01 . 1 . . . . 36 ASN HN . c18126_2lr2 1 116 . 1 1 36 36 ASN C C 13 175.77 0.1 . 1 . . . . 36 ASN C . c18126_2lr2 1 117 . 1 1 36 36 ASN CA C 13 51.01 0.2 . 1 . . . . 36 ASN CA . c18126_2lr2 1 118 . 1 1 36 36 ASN CB C 13 38.33 0.2 . 1 . . . . 36 ASN CB . c18126_2lr2 1 119 . 1 1 36 36 ASN N N 15 119.01 0.1 . 1 . . . . 36 ASN N . c18126_2lr2 1 120 . 1 1 37 37 GLU H H 1 8.60 0.01 . 1 . . . . 37 GLU HN . c18126_2lr2 1 121 . 1 1 37 37 GLU C C 13 178.16 0.1 . 1 . . . . 37 GLU C . c18126_2lr2 1 122 . 1 1 37 37 GLU CA C 13 59.46 0.2 . 1 . . . . 37 GLU CA . c18126_2lr2 1 123 . 1 1 37 37 GLU CB C 13 28.89 0.2 . 1 . . . . 37 GLU CB . c18126_2lr2 1 124 . 1 1 37 37 GLU N N 15 118.29 0.1 . 1 . . . . 37 GLU N . c18126_2lr2 1 125 . 1 1 38 38 GLU H H 1 8.24 0.01 . 1 . . . . 38 GLU HN . c18126_2lr2 1 126 . 1 1 38 38 GLU C C 13 180.22 0.1 . 1 . . . . 38 GLU C . c18126_2lr2 1 127 . 1 1 38 38 GLU CA C 13 59.39 0.2 . 1 . . . . 38 GLU CA . c18126_2lr2 1 128 . 1 1 38 38 GLU CB C 13 28.26 0.2 . 1 . . . . 38 GLU CB . c18126_2lr2 1 129 . 1 1 38 38 GLU N N 15 119.54 0.1 . 1 . . . . 38 GLU N . c18126_2lr2 1 130 . 1 1 39 39 GLN H H 1 8.51 0.01 . 1 . . . . 39 GLN HN . c18126_2lr2 1 131 . 1 1 39 39 GLN C C 13 178.62 0.1 . 1 . . . . 39 GLN C . c18126_2lr2 1 132 . 1 1 39 39 GLN CA C 13 57.55 0.2 . 1 . . . . 39 GLN CA . c18126_2lr2 1 133 . 1 1 39 39 GLN CB C 13 28.20 0.2 . 1 . . . . 39 GLN CB . c18126_2lr2 1 134 . 1 1 39 39 GLN N N 15 119.72 0.1 . 1 . . . . 39 GLN N . c18126_2lr2 1 135 . 1 1 40 40 ARG H H 1 8.57 0.01 . 1 . . . . 40 ARG HN . c18126_2lr2 1 136 . 1 1 40 40 ARG C C 13 177.96 0.1 . 1 . . . . 40 ARG C . c18126_2lr2 1 137 . 1 1 40 40 ARG CA C 13 60.24 0.2 . 1 . . . . 40 ARG CA . c18126_2lr2 1 138 . 1 1 40 40 ARG CB C 13 29.52 0.2 . 1 . . . . 40 ARG CB . c18126_2lr2 1 139 . 1 1 40 40 ARG N N 15 118.59 0.1 . 1 . . . . 40 ARG N . c18126_2lr2 1 140 . 1 1 41 41 ASN H H 1 8.42 0.01 . 1 . . . . 41 ASN HN . c18126_2lr2 1 141 . 1 1 41 41 ASN C C 13 177.70 0.1 . 1 . . . . 41 ASN C . c18126_2lr2 1 142 . 1 1 41 41 ASN CA C 13 55.65 0.2 . 1 . . . . 41 ASN CA . c18126_2lr2 1 143 . 1 1 41 41 ASN CB C 13 37.55 0.2 . 1 . . . . 41 ASN CB . c18126_2lr2 1 144 . 1 1 41 41 ASN N N 15 115.05 0.1 . 1 . . . . 41 ASN N . c18126_2lr2 1 145 . 1 1 42 42 ALA H H 1 7.91 0.01 . 1 . . . . 42 ALA HN . c18126_2lr2 1 146 . 1 1 42 42 ALA C C 13 181.01 0.1 . 1 . . . . 42 ALA C . c18126_2lr2 1 147 . 1 1 42 42 ALA CA C 13 54.81 0.2 . 1 . . . . 42 ALA CA . c18126_2lr2 1 148 . 1 1 42 42 ALA CB C 13 17.37 0.2 . 1 . . . . 42 ALA CB . c18126_2lr2 1 149 . 1 1 42 42 ALA N N 15 123.13 0.1 . 1 . . . . 42 ALA N . c18126_2lr2 1 150 . 1 1 43 43 PHE H H 1 8.01 0.01 . 1 . . . . 43 PHE HN . c18126_2lr2 1 151 . 1 1 43 43 PHE C C 13 172.61 0.1 . 1 . . . . 43 PHE C . c18126_2lr2 1 152 . 1 1 43 43 PHE CA C 13 61.85 0.2 . 1 . . . . 43 PHE CA . c18126_2lr2 1 153 . 1 1 43 43 PHE CB C 13 39.03 0.2 . 1 . . . . 43 PHE CB . c18126_2lr2 1 154 . 1 1 43 43 PHE N N 15 116.85 0.1 . 1 . . . . 43 PHE N . c18126_2lr2 1 155 . 1 1 44 44 ILE H H 1 8.33 0.01 . 1 . . . . 44 ILE HN . c18126_2lr2 1 156 . 1 1 44 44 ILE C C 13 178.08 0.1 . 1 . . . . 44 ILE C . c18126_2lr2 1 157 . 1 1 44 44 ILE CA C 13 64.53 0.2 . 1 . . . . 44 ILE CA . c18126_2lr2 1 158 . 1 1 44 44 ILE CB C 13 39.07 0.2 . 1 . . . . 44 ILE CB . c18126_2lr2 1 159 . 1 1 44 44 ILE N N 15 118.89 0.1 . 1 . . . . 44 ILE N . c18126_2lr2 1 160 . 1 1 45 45 GLN H H 1 8.32 0.01 . 1 . . . . 45 GLN HN . c18126_2lr2 1 161 . 1 1 45 45 GLN C C 13 178.40 0.1 . 1 . . . . 45 GLN C . c18126_2lr2 1 162 . 1 1 45 45 GLN CA C 13 58.25 0.2 . 1 . . . . 45 GLN CA . c18126_2lr2 1 163 . 1 1 45 45 GLN CB C 13 27.39 0.2 . 1 . . . . 45 GLN CB . c18126_2lr2 1 164 . 1 1 45 45 GLN N N 15 118.92 0.1 . 1 . . . . 45 GLN N . c18126_2lr2 1 165 . 1 1 46 46 SER H H 1 7.98 0.01 . 1 . . . . 46 SER HN . c18126_2lr2 1 166 . 1 1 46 46 SER C C 13 176.42 0.1 . 1 . . . . 46 SER C . c18126_2lr2 1 167 . 1 1 46 46 SER CA C 13 61.71 0.2 . 1 . . . . 46 SER CA . c18126_2lr2 1 168 . 1 1 46 46 SER CB C 13 63.26 0.2 . 1 . . . . 46 SER CB . c18126_2lr2 1 169 . 1 1 46 46 SER N N 15 114.86 0.1 . 1 . . . . 46 SER N . c18126_2lr2 1 170 . 1 1 47 47 LEU H H 1 8.05 0.01 . 1 . . . . 47 LEU HN . c18126_2lr2 1 171 . 1 1 47 47 LEU C C 13 179.05 0.1 . 1 . . . . 47 LEU C . c18126_2lr2 1 172 . 1 1 47 47 LEU CA C 13 57.00 0.2 . 1 . . . . 47 LEU CA . c18126_2lr2 1 173 . 1 1 47 47 LEU CB C 13 41.57 0.2 . 1 . . . . 47 LEU CB . c18126_2lr2 1 174 . 1 1 47 47 LEU N N 15 122.25 0.1 . 1 . . . . 47 LEU N . c18126_2lr2 1 175 . 1 1 48 48 LYS H H 1 7.98 0.01 . 1 . . . . 48 LYS HN . c18126_2lr2 1 176 . 1 1 48 48 LYS C C 13 177.82 0.1 . 1 . . . . 48 LYS C . c18126_2lr2 1 177 . 1 1 48 48 LYS CA C 13 58.50 0.2 . 1 . . . . 48 LYS CA . c18126_2lr2 1 178 . 1 1 48 48 LYS CB C 13 32.02 0.2 . 1 . . . . 48 LYS CB . c18126_2lr2 1 179 . 1 1 48 48 LYS N N 15 118.11 0.1 . 1 . . . . 48 LYS N . c18126_2lr2 1 180 . 1 1 49 49 ASP H H 1 7.95 0.01 . 1 . . . . 49 ASP HN . c18126_2lr2 1 181 . 1 1 49 49 ASP C C 13 176.29 0.1 . 1 . . . . 49 ASP C . c18126_2lr2 1 182 . 1 1 49 49 ASP CA C 13 54.88 0.2 . 1 . . . . 49 ASP CA . c18126_2lr2 1 183 . 1 1 49 49 ASP CB C 13 40.80 0.2 . 1 . . . . 49 ASP CB . c18126_2lr2 1 184 . 1 1 49 49 ASP N N 15 118.39 0.1 . 1 . . . . 49 ASP N . c18126_2lr2 1 185 . 1 1 50 50 ASP H H 1 7.87 0.01 . 1 . . . . 50 ASP HN . c18126_2lr2 1 186 . 1 1 50 50 ASP C C 13 175.63 0.1 . 1 . . . . 50 ASP C . c18126_2lr2 1 187 . 1 1 50 50 ASP CA C 13 54.11 0.2 . 1 . . . . 50 ASP CA . c18126_2lr2 1 188 . 1 1 50 50 ASP CB C 13 40.80 0.2 . 1 . . . . 50 ASP CB . c18126_2lr2 1 189 . 1 1 50 50 ASP N N 15 120.45 0.1 . 1 . . . . 50 ASP N . c18126_2lr2 1 190 . 1 1 51 51 SER H H 1 7.94 0.01 . 1 . . . . 51 SER HN . c18126_2lr2 1 191 . 1 1 51 51 SER C C 13 173.70 0.1 . 1 . . . . 51 SER C . c18126_2lr2 1 192 . 1 1 51 51 SER CA C 13 58.47 0.2 . 1 . . . . 51 SER CA . c18126_2lr2 1 193 . 1 1 51 51 SER CB C 13 64.17 0.2 . 1 . . . . 51 SER CB . c18126_2lr2 1 194 . 1 1 51 51 SER N N 15 115.35 0.1 . 1 . . . . 51 SER N . c18126_2lr2 1 195 . 1 1 52 52 TYR H H 1 7.79 0.01 . 1 . . . . 52 TYR HN . c18126_2lr2 1 196 . 1 1 52 52 TYR C C 13 174.75 0.1 . 1 . . . . 52 TYR C . c18126_2lr2 1 197 . 1 1 52 52 TYR CA C 13 56.22 0.2 . 1 . . . . 52 TYR CA . c18126_2lr2 1 198 . 1 1 52 52 TYR CB C 13 38.47 0.2 . 1 . . . . 52 TYR CB . c18126_2lr2 1 199 . 1 1 52 52 TYR N N 15 120.60 0.1 . 1 . . . . 52 TYR N . c18126_2lr2 1 200 . 1 1 53 53 ILE H H 1 8.71 0.01 . 1 . . . . 53 ILE HN . c18126_2lr2 1 201 . 1 1 53 53 ILE C C 13 176.30 0.1 . 1 . . . . 53 ILE C . c18126_2lr2 1 202 . 1 1 53 53 ILE CA C 13 59.74 0.2 . 1 . . . . 53 ILE CA . c18126_2lr2 1 203 . 1 1 53 53 ILE CB C 13 39.07 0.2 . 1 . . . . 53 ILE CB . c18126_2lr2 1 204 . 1 1 53 53 ILE N N 15 120.82 0.1 . 1 . . . . 53 ILE N . c18126_2lr2 1 205 . 1 1 54 54 ASP H H 1 9.00 0.01 . 1 . . . . 54 ASP HN . c18126_2lr2 1 206 . 1 1 54 54 ASP C C 13 177.34 0.1 . 1 . . . . 54 ASP C . c18126_2lr2 1 207 . 1 1 54 54 ASP CA C 13 51.50 0.2 . 1 . . . . 54 ASP CA . c18126_2lr2 1 208 . 1 1 54 54 ASP CB C 13 38.61 0.2 . 1 . . . . 54 ASP CB . c18126_2lr2 1 209 . 1 1 54 54 ASP N N 15 124.96 0.1 . 1 . . . . 54 ASP N . c18126_2lr2 1 210 . 1 1 55 55 THR H H 1 8.04 0.01 . 1 . . . . 55 THR HN . c18126_2lr2 1 211 . 1 1 55 55 THR C C 13 175.62 0.1 . 1 . . . . 55 THR C . c18126_2lr2 1 212 . 1 1 55 55 THR CA C 13 64.41 0.2 . 1 . . . . 55 THR CA . c18126_2lr2 1 213 . 1 1 55 55 THR CB C 13 68.61 0.2 . 1 . . . . 55 THR CB . c18126_2lr2 1 214 . 1 1 55 55 THR N N 15 119.55 0.1 . 1 . . . . 55 THR N . c18126_2lr2 1 215 . 1 1 56 56 ASN H H 1 8.36 0.01 . 1 . . . . 56 ASN HN . c18126_2lr2 1 216 . 1 1 56 56 ASN C C 13 175.11 0.1 . 1 . . . . 56 ASN C . c18126_2lr2 1 217 . 1 1 56 56 ASN CA C 13 51.07 0.2 . 1 . . . . 56 ASN CA . c18126_2lr2 1 218 . 1 1 56 56 ASN CB C 13 36.57 0.2 . 1 . . . . 56 ASN CB . c18126_2lr2 1 219 . 1 1 56 56 ASN N N 15 115.63 0.1 . 1 . . . . 56 ASN N . c18126_2lr2 1 220 . 1 1 57 57 ASN H H 1 8.01 0.01 . 1 . . . . 57 ASN HN . c18126_2lr2 1 221 . 1 1 57 57 ASN C C 13 174.10 0.1 . 1 . . . . 57 ASN C . c18126_2lr2 1 222 . 1 1 57 57 ASN CA C 13 54.53 0.2 . 1 . . . . 57 ASN CA . c18126_2lr2 1 223 . 1 1 57 57 ASN CB C 13 37.27 0.2 . 1 . . . . 57 ASN CB . c18126_2lr2 1 224 . 1 1 57 57 ASN N N 15 115.14 0.1 . 1 . . . . 57 ASN N . c18126_2lr2 1 225 . 1 1 58 58 ASP H H 1 8.07 0.01 . 1 . . . . 58 ASP HN . c18126_2lr2 1 226 . 1 1 58 58 ASP C C 13 177.39 0.1 . 1 . . . . 58 ASP C . c18126_2lr2 1 227 . 1 1 58 58 ASP CA C 13 52.35 0.2 . 1 . . . . 58 ASP CA . c18126_2lr2 1 228 . 1 1 58 58 ASP CB C 13 40.16 0.2 . 1 . . . . 58 ASP CB . c18126_2lr2 1 229 . 1 1 58 58 ASP N N 15 115.21 0.1 . 1 . . . . 58 ASP N . c18126_2lr2 1 230 . 1 1 59 59 GLY H H 1 9.53 0.01 . 1 . . . . 59 GLY HN . c18126_2lr2 1 231 . 1 1 59 59 GLY C C 13 172.30 0.1 . 1 . . . . 59 GLY C . c18126_2lr2 1 232 . 1 1 59 59 GLY CA C 13 45.16 0.2 . 1 . . . . 59 GLY CA . c18126_2lr2 1 233 . 1 1 59 59 GLY N N 15 111.80 0.1 . 1 . . . . 59 GLY N . c18126_2lr2 1 234 . 1 1 60 60 ALA H H 1 7.76 0.01 . 1 . . . . 60 ALA HN . c18126_2lr2 1 235 . 1 1 60 60 ALA C C 13 177.34 0.1 . 1 . . . . 60 ALA C . c18126_2lr2 1 236 . 1 1 60 60 ALA CA C 13 49.53 0.2 . 1 . . . . 60 ALA CA . c18126_2lr2 1 237 . 1 1 60 60 ALA CB C 13 21.82 0.2 . 1 . . . . 60 ALA CB . c18126_2lr2 1 238 . 1 1 60 60 ALA N N 15 121.35 0.1 . 1 . . . . 60 ALA N . c18126_2lr2 1 239 . 1 1 61 61 TYR H H 1 9.24 0.01 . 1 . . . . 61 TYR HN . c18126_2lr2 1 240 . 1 1 61 61 TYR C C 13 174.71 0.1 . 1 . . . . 61 TYR C . c18126_2lr2 1 241 . 1 1 61 61 TYR CA C 13 55.30 0.2 . 1 . . . . 61 TYR CA . c18126_2lr2 1 242 . 1 1 61 61 TYR CB C 13 38.12 0.2 . 1 . . . . 61 TYR CB . c18126_2lr2 1 243 . 1 1 61 61 TYR N N 15 128.57 0.1 . 1 . . . . 61 TYR N . c18126_2lr2 1 244 . 1 1 62 62 GLU H H 1 8.54 0.01 . 1 . . . . 62 GLU HN . c18126_2lr2 1 245 . 1 1 62 62 GLU C C 13 174.62 0.1 . 1 . . . . 62 GLU C . c18126_2lr2 1 246 . 1 1 62 62 GLU CA C 13 54.81 0.2 . 1 . . . . 62 GLU CA . c18126_2lr2 1 247 . 1 1 62 62 GLU CB C 13 28.82 0.2 . 1 . . . . 62 GLU CB . c18126_2lr2 1 248 . 1 1 62 62 GLU N N 15 122.24 0.1 . 1 . . . . 62 GLU N . c18126_2lr2 1 249 . 1 1 63 63 GLY H H 1 8.86 0.01 . 1 . . . . 63 GLY HN . c18126_2lr2 1 250 . 1 1 63 63 GLY CA C 13 46.50 0.2 . 1 . . . . 63 GLY CA . c18126_2lr2 1 251 . 1 1 63 63 GLY N N 15 108.88 0.1 . 1 . . . . 63 GLY N . c18126_2lr2 1 252 . 1 1 64 64 ASP C C 13 177.97 0.1 . 1 . . . . 64 ASP C . c18126_2lr2 1 253 . 1 1 64 64 ASP CA C 13 55.74 0.2 . 1 . . . . 64 ASP CA . c18126_2lr2 1 254 . 1 1 64 64 ASP CB C 13 39.72 0.2 . 1 . . . . 64 ASP CB . c18126_2lr2 1 255 . 1 1 65 65 GLU H H 1 8.29 0.01 . 1 . . . . 65 GLU HN . c18126_2lr2 1 256 . 1 1 65 65 GLU C C 13 178.33 0.1 . 1 . . . . 65 GLU C . c18126_2lr2 1 257 . 1 1 65 65 GLU CA C 13 56.85 0.2 . 1 . . . . 65 GLU CA . c18126_2lr2 1 258 . 1 1 65 65 GLU CB C 13 27.62 0.2 . 1 . . . . 65 GLU CB . c18126_2lr2 1 259 . 1 1 65 65 GLU N N 15 118.11 0.1 . 1 . . . . 65 GLU N . c18126_2lr2 1 260 . 1 1 66 66 LEU H H 1 7.30 0.01 . 1 . . . . 66 LEU HN . c18126_2lr2 1 261 . 1 1 66 66 LEU C C 13 177.22 0.1 . 1 . . . . 66 LEU C . c18126_2lr2 1 262 . 1 1 66 66 LEU CA C 13 54.17 0.2 . 1 . . . . 66 LEU CA . c18126_2lr2 1 263 . 1 1 66 66 LEU CB C 13 40.44 0.2 . 1 . . . . 66 LEU CB . c18126_2lr2 1 264 . 1 1 66 66 LEU N N 15 115.04 0.1 . 1 . . . . 66 LEU N . c18126_2lr2 1 265 . 1 1 67 67 SER H H 1 7.49 0.01 . 1 . . . . 67 SER HN . c18126_2lr2 1 266 . 1 1 67 67 SER C C 13 175.09 0.1 . 1 . . . . 67 SER C . c18126_2lr2 1 267 . 1 1 67 67 SER CA C 13 58.47 0.2 . 1 . . . . 67 SER CA . c18126_2lr2 1 268 . 1 1 67 67 SER CB C 13 63.82 0.2 . 1 . . . . 67 SER CB . c18126_2lr2 1 269 . 1 1 67 67 SER N N 15 114.42 0.1 . 1 . . . . 67 SER N . c18126_2lr2 1 270 . 1 1 68 68 GLY H H 1 8.28 0.01 . 1 . . . . 68 GLY HN . c18126_2lr2 1 271 . 1 1 68 68 GLY C C 13 174.48 0.1 . 1 . . . . 68 GLY C . c18126_2lr2 1 272 . 1 1 68 68 GLY CA C 13 45.23 0.2 . 1 . . . . 68 GLY CA . c18126_2lr2 1 273 . 1 1 68 68 GLY N N 15 110.19 0.1 . 1 . . . . 68 GLY N . c18126_2lr2 1 274 . 1 1 69 69 SER H H 1 8.25 0.01 . 1 . . . . 69 SER HN . c18126_2lr2 1 275 . 1 1 69 69 SER C C 13 175.87 0.1 . 1 . . . . 69 SER C . c18126_2lr2 1 276 . 1 1 69 69 SER CA C 13 58.40 0.2 . 1 . . . . 69 SER CA . c18126_2lr2 1 277 . 1 1 69 69 SER CB C 13 63.82 0.2 . 1 . . . . 69 SER CB . c18126_2lr2 1 278 . 1 1 69 69 SER N N 15 115.77 0.1 . 1 . . . . 69 SER N . c18126_2lr2 1 279 . 1 1 70 70 GLN H H 1 9.42 0.01 . 1 . . . . 70 GLN HN . c18126_2lr2 1 280 . 1 1 70 70 GLN C C 13 177.72 0.1 . 1 . . . . 70 GLN C . c18126_2lr2 1 281 . 1 1 70 70 GLN CA C 13 56.64 0.2 . 1 . . . . 70 GLN CA . c18126_2lr2 1 282 . 1 1 70 70 GLN CB C 13 28.05 0.2 . 1 . . . . 70 GLN CB . c18126_2lr2 1 283 . 1 1 70 70 GLN N N 15 123.68 0.1 . 1 . . . . 70 GLN N . c18126_2lr2 1 284 . 1 1 71 71 SER H H 1 8.27 0.01 . 1 . . . . 71 SER HN . c18126_2lr2 1 285 . 1 1 71 71 SER C C 13 175.17 0.1 . 1 . . . . 71 SER C . c18126_2lr2 1 286 . 1 1 71 71 SER CA C 13 62.18 0.2 . 1 . . . . 71 SER CA . c18126_2lr2 1 287 . 1 1 71 71 SER CB C 13 70.44 0.2 . 1 . . . . 71 SER CB . c18126_2lr2 1 288 . 1 1 71 71 SER N N 15 116.31 0.1 . 1 . . . . 71 SER N . c18126_2lr2 1 289 . 1 1 72 72 ALA H H 1 8.15 0.01 . 1 . . . . 72 ALA HN . c18126_2lr2 1 290 . 1 1 72 72 ALA C C 13 180.88 0.1 . 1 . . . . 72 ALA C . c18126_2lr2 1 291 . 1 1 72 72 ALA CA C 13 54.81 0.2 . 1 . . . . 72 ALA CA . c18126_2lr2 1 292 . 1 1 72 72 ALA CB C 13 17.56 0.2 . 1 . . . . 72 ALA CB . c18126_2lr2 1 293 . 1 1 72 72 ALA N N 15 122.95 0.1 . 1 . . . . 72 ALA N . c18126_2lr2 1 294 . 1 1 73 73 ASN H H 1 8.12 0.01 . 1 . . . . 73 ASN HN . c18126_2lr2 1 295 . 1 1 73 73 ASN C C 13 177.67 0.1 . 1 . . . . 73 ASN C . c18126_2lr2 1 296 . 1 1 73 73 ASN CA C 13 55.51 0.2 . 1 . . . . 73 ASN CA . c18126_2lr2 1 297 . 1 1 73 73 ASN CB C 13 37.41 0.2 . 1 . . . . 73 ASN CB . c18126_2lr2 1 298 . 1 1 73 73 ASN N N 15 118.33 0.1 . 1 . . . . 73 ASN N . c18126_2lr2 1 299 . 1 1 74 74 LEU H H 1 8.25 0.01 . 1 . . . . 74 LEU HN . c18126_2lr2 1 300 . 1 1 74 74 LEU C C 13 178.64 0.1 . 1 . . . . 74 LEU C . c18126_2lr2 1 301 . 1 1 74 74 LEU CA C 13 57.70 0.2 . 1 . . . . 74 LEU CA . c18126_2lr2 1 302 . 1 1 74 74 LEU CB C 13 41.36 0.2 . 1 . . . . 74 LEU CB . c18126_2lr2 1 303 . 1 1 74 74 LEU N N 15 122.43 0.1 . 1 . . . . 74 LEU N . c18126_2lr2 1 304 . 1 1 75 75 LEU H H 1 8.20 0.01 . 1 . . . . 75 LEU HN . c18126_2lr2 1 305 . 1 1 75 75 LEU C C 13 178.31 0.1 . 1 . . . . 75 LEU C . c18126_2lr2 1 306 . 1 1 75 75 LEU CA C 13 57.41 0.2 . 1 . . . . 75 LEU CA . c18126_2lr2 1 307 . 1 1 75 75 LEU CB C 13 40.58 0.2 . 1 . . . . 75 LEU CB . c18126_2lr2 1 308 . 1 1 75 75 LEU N N 15 118.49 0.1 . 1 . . . . 75 LEU N . c18126_2lr2 1 309 . 1 1 76 76 ALA H H 1 7.82 0.01 . 1 . . . . 76 ALA HN . c18126_2lr2 1 310 . 1 1 76 76 ALA C C 13 181.20 0.1 . 1 . . . . 76 ALA C . c18126_2lr2 1 311 . 1 1 76 76 ALA CA C 13 54.81 0.2 . 1 . . . . 76 ALA CA . c18126_2lr2 1 312 . 1 1 76 76 ALA CB C 13 17.37 0.2 . 1 . . . . 76 ALA CB . c18126_2lr2 1 313 . 1 1 76 76 ALA N N 15 119.92 0.1 . 1 . . . . 76 ALA N . c18126_2lr2 1 314 . 1 1 77 77 GLU H H 1 8.03 0.01 . 1 . . . . 77 GLU HN . c18126_2lr2 1 315 . 1 1 77 77 GLU C C 13 179.09 0.1 . 1 . . . . 77 GLU C . c18126_2lr2 1 316 . 1 1 77 77 GLU CA C 13 58.60 0.2 . 1 . . . . 77 GLU CA . c18126_2lr2 1 317 . 1 1 77 77 GLU CB C 13 28.78 0.2 . 1 . . . . 77 GLU CB . c18126_2lr2 1 318 . 1 1 77 77 GLU N N 15 119.57 0.1 . 1 . . . . 77 GLU N . c18126_2lr2 1 319 . 1 1 78 78 ALA H H 1 8.23 0.01 . 1 . . . . 78 ALA HN . c18126_2lr2 1 320 . 1 1 78 78 ALA C C 13 179.47 0.1 . 1 . . . . 78 ALA C . c18126_2lr2 1 321 . 1 1 78 78 ALA CA C 13 54.88 0.2 . 1 . . . . 78 ALA CA . c18126_2lr2 1 322 . 1 1 78 78 ALA CB C 13 16.72 0.2 . 1 . . . . 78 ALA CB . c18126_2lr2 1 323 . 1 1 78 78 ALA N N 15 123.69 0.1 . 1 . . . . 78 ALA N . c18126_2lr2 1 324 . 1 1 79 79 LYS H H 1 8.37 0.01 . 1 . . . . 79 LYS HN . c18126_2lr2 1 325 . 1 1 79 79 LYS C C 13 178.68 0.1 . 1 . . . . 79 LYS C . c18126_2lr2 1 326 . 1 1 79 79 LYS CA C 13 59.67 0.2 . 1 . . . . 79 LYS CA . c18126_2lr2 1 327 . 1 1 79 79 LYS CB C 13 31.35 0.2 . 1 . . . . 79 LYS CB . c18126_2lr2 1 328 . 1 1 79 79 LYS N N 15 117.94 0.1 . 1 . . . . 79 LYS N . c18126_2lr2 1 329 . 1 1 80 80 LYS H H 1 7.80 0.01 . 1 . . . . 80 LYS HN . c18126_2lr2 1 330 . 1 1 80 80 LYS C C 13 179.82 0.1 . 1 . . . . 80 LYS C . c18126_2lr2 1 331 . 1 1 80 80 LYS CA C 13 59.17 0.2 . 1 . . . . 80 LYS CA . c18126_2lr2 1 332 . 1 1 80 80 LYS CB C 13 31.78 0.2 . 1 . . . . 80 LYS CB . c18126_2lr2 1 333 . 1 1 80 80 LYS N N 15 120.21 0.1 . 1 . . . . 80 LYS N . c18126_2lr2 1 334 . 1 1 81 81 LEU H H 1 7.89 0.01 . 1 . . . . 81 LEU HN . c18126_2lr2 1 335 . 1 1 81 81 LEU C C 13 178.09 0.1 . 1 . . . . 81 LEU C . c18126_2lr2 1 336 . 1 1 81 81 LEU CA C 13 57.13 0.2 . 1 . . . . 81 LEU CA . c18126_2lr2 1 337 . 1 1 81 81 LEU CB C 13 41.08 0.2 . 1 . . . . 81 LEU CB . c18126_2lr2 1 338 . 1 1 81 81 LEU N N 15 122.05 0.1 . 1 . . . . 81 LEU N . c18126_2lr2 1 339 . 1 1 82 82 ASN H H 1 8.46 0.01 . 1 . . . . 82 ASN HN . c18126_2lr2 1 340 . 1 1 82 82 ASN C C 13 177.63 0.1 . 1 . . . . 82 ASN C . c18126_2lr2 1 341 . 1 1 82 82 ASN CA C 13 57.48 0.2 . 1 . . . . 82 ASN CA . c18126_2lr2 1 342 . 1 1 82 82 ASN CB C 13 41.08 0.2 . 1 . . . . 82 ASN CB . c18126_2lr2 1 343 . 1 1 82 82 ASN N N 15 116.66 0.1 . 1 . . . . 82 ASN N . c18126_2lr2 1 344 . 1 1 83 83 ASP H H 1 8.30 0.01 . 1 . . . . 83 ASP HN . c18126_2lr2 1 345 . 1 1 83 83 ASP C C 13 178.92 0.1 . 1 . . . . 83 ASP C . c18126_2lr2 1 346 . 1 1 83 83 ASP CA C 13 56.57 0.2 . 1 . . . . 83 ASP CA . c18126_2lr2 1 347 . 1 1 83 83 ASP CB C 13 39.59 0.2 . 1 . . . . 83 ASP CB . c18126_2lr2 1 348 . 1 1 83 83 ASP N N 15 118.83 0.1 . 1 . . . . 83 ASP N . c18126_2lr2 1 349 . 1 1 84 84 ALA H H 1 8.04 0.01 . 1 . . . . 84 ALA HN . c18126_2lr2 1 350 . 1 1 84 84 ALA C C 13 179.34 0.1 . 1 . . . . 84 ALA C . c18126_2lr2 1 351 . 1 1 84 84 ALA CA C 13 53.90 0.2 . 1 . . . . 84 ALA CA . c18126_2lr2 1 352 . 1 1 84 84 ALA CB C 13 18.02 0.2 . 1 . . . . 84 ALA CB . c18126_2lr2 1 353 . 1 1 84 84 ALA N N 15 122.79 0.1 . 1 . . . . 84 ALA N . c18126_2lr2 1 354 . 1 1 85 85 GLN H H 1 7.52 0.01 . 1 . . . . 85 GLN HN . c18126_2lr2 1 355 . 1 1 85 85 GLN C C 13 174.21 0.1 . 1 . . . . 85 GLN C . c18126_2lr2 1 356 . 1 1 85 85 GLN CA C 13 54.67 0.2 . 1 . . . . 85 GLN CA . c18126_2lr2 1 357 . 1 1 85 85 GLN CB C 13 27.48 0.2 . 1 . . . . 85 GLN CB . c18126_2lr2 1 358 . 1 1 85 85 GLN N N 15 114.88 0.1 . 1 . . . . 85 GLN N . c18126_2lr2 1 359 . 1 1 86 86 ALA H H 1 7.12 0.01 . 1 . . . . 86 ALA HN . c18126_2lr2 1 360 . 1 1 86 86 ALA CA C 13 50.65 0.2 . 1 . . . . 86 ALA CA . c18126_2lr2 1 361 . 1 1 86 86 ALA CB C 13 17.35 0.2 . 1 . . . . 86 ALA CB . c18126_2lr2 1 362 . 1 1 86 86 ALA N N 15 124.27 0.1 . 1 . . . . 86 ALA N . c18126_2lr2 1 363 . 1 1 87 87 PRO C C 13 176.20 0.1 . 1 . . . . 87 PRO C . c18126_2lr2 1 364 . 1 1 87 87 PRO CA C 13 62.90 0.2 . 1 . . . . 87 PRO CA . c18126_2lr2 1 365 . 1 1 87 87 PRO CB C 13 31.30 0.2 . 1 . . . . 87 PRO CB . c18126_2lr2 1 366 . 1 1 88 88 LYS H H 1 8.06 0.01 . 1 . . . . 88 LYS HN . c18126_2lr2 1 367 . 1 1 88 88 LYS CA C 13 57.10 0.2 . 1 . . . . 88 LYS CA . c18126_2lr2 1 368 . 1 1 88 88 LYS CB C 13 33.10 0.2 . 1 . . . . 88 LYS CB . c18126_2lr2 1 369 . 1 1 88 88 LYS N N 15 127.28 0.1 . 1 . . . . 88 LYS N . c18126_2lr2 1 stop_ save_ ############################## # Structure determinations # ############################## ########################## # Conformer statistics # ########################## save_conformer_statistics _Conformer_stat_list.Sf_category conformer_statistics _Conformer_stat_list.Sf_framecode conformer_statistics _Conformer_stat_list.Entry_ID c18126_2lr2 _Conformer_stat_list.ID 1 _Conformer_stat_list.Conf_family_coord_set_ID 1 _Conformer_stat_list.Conf_family_coord_set_label $Original_constraints_and_structures _Conformer_stat_list.Conformer_submitted_total_num 2 save_ ##################################### # Conformer family coordinate set # ##################################### save_ensemble_of_conformers _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Sf_framecode ensemble_of_conformers _Conformer_family_coord_set.Entry_ID c18126_2lr2 _Conformer_family_coord_set.ID 1 loop_ _Conformer_family_refinement.Refine_method _Conformer_family_refinement.Refine_details _Conformer_family_refinement.Software_ID _Conformer_family_refinement.Software_label _Conformer_family_refinement.Entry_ID _Conformer_family_refinement.Conformer_family_coord_set_ID 1 . . . c18126_2lr2 1 stop_ loop_ _Conformer_family_software.Software_ID _Conformer_family_software.Software_label _Conformer_family_software.Method_ID _Conformer_family_software.Method_label _Conformer_family_software.Entry_ID _Conformer_family_software.Conformer_family_coord_set_ID . . . . c18126_2lr2 1 stop_ loop_ _Atom_site.Assembly_ID _Atom_site.Model_ID _Atom_site.Model_site_ID _Atom_site.ID _Atom_site.Assembly_atom_ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Cartn_x_esd _Atom_site.Cartn_y_esd _Atom_site.Cartn_z_esd _Atom_site.Occupancy _Atom_site.Occupancy_esd _Atom_site.Uncertainty _Atom_site.Ordered_flag _Atom_site.Footnote_ID _Atom_site.PDBX_label_asym_ID _Atom_site.PDBX_label_seq_ID _Atom_site.PDBX_label_comp_ID _Atom_site.PDBX_label_atom_ID _Atom_site.PDBX_formal_charge _Atom_site.PDBX_label_entity_ID _Atom_site.PDB_record_ID _Atom_site.PDB_model_num _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Auth_entity_assembly_ID _Atom_site.Auth_asym_ID _Atom_site.Auth_chain_ID _Atom_site.Auth_seq_ID _Atom_site.Auth_comp_ID _Atom_site.Auth_atom_ID _Atom_site.Auth_alt_ID _Atom_site.Auth_atom_name _Atom_site.Details _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID . 1 . 1 . 1 1 13 GLY C C 2.894 21.231 11.195 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . c18126_2lr2 1 . 1 . 2 . 1 1 13 GLY CA C 4.309 21.780 10.971 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . c18126_2lr2 1 . 1 . 3 . 1 1 13 GLY H H 4.005 23.475 9.798 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . c18126_2lr2 1 . 1 . 4 . 1 1 13 GLY HA2 H 5.017 20.961 10.957 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . c18126_2lr2 1 . 1 . 5 . 1 1 13 GLY HA3 H 4.566 22.459 11.772 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . c18126_2lr2 1 . 1 . 6 . 1 1 13 GLY N N 4.372 22.510 9.672 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . c18126_2lr2 1 . 1 . 7 . 1 1 13 GLY O O 2.307 21.435 12.268 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . c18126_2lr2 1 . 1 . 8 . 1 1 14 VAL C C 1.095 18.404 9.933 . . . 1.0 . . . . . . . . . . . . A . 14 VAL C . . . . . . . . . c18126_2lr2 1 . 1 . 9 . 1 1 14 VAL CA C 0.983 19.930 10.201 . . . 1.0 . . . . . . . . . . . . A . 14 VAL CA . . . . . . . . . c18126_2lr2 1 . 1 . 10 . 1 1 14 VAL CB C 0.042 20.664 9.126 . . . 1.0 . . . . . . . . . . . . A . 14 VAL CB . . . . . . . . . c18126_2lr2 1 . 1 . 11 . 1 1 14 VAL CG1 C -1.339 19.895 8.910 . . . 1.0 . . . . . . . . . . . . A . 14 VAL CG1 . . . . . . . . . c18126_2lr2 1 . 1 . 12 . 1 1 14 VAL CG2 C -0.239 22.179 9.557 . . . 1.0 . . . . . . . . . . . . A . 14 VAL CG2 . . . . . . . . . c18126_2lr2 1 . 1 . 13 . 1 1 14 VAL H H 2.886 20.423 9.343 . . . 1.0 . . . . . . . . . . . . A . 14 VAL H . . . . . . . . . c18126_2lr2 1 . 1 . 14 . 1 1 14 VAL HA H 0.556 20.056 11.195 . . . 1.0 . . . . . . . . . . . . A . 14 VAL HA . . . . . . . . . c18126_2lr2 1 . 1 . 15 . 1 1 14 VAL HB H 0.576 20.677 8.164 . . . 1.0 . . . . . . . . . . . . A . 14 VAL HB . . . . . . . . . c18126_2lr2 1 . 1 . 16 . 1 1 14 VAL HG11 H -1.784 19.647 9.870 . . . 1.0 . . . . . . . . . . . . A . 14 VAL HG11 . . . . . . . . . c18126_2lr2 1 . 1 . 17 . 1 1 14 VAL HG12 H -1.182 18.981 8.348 . . . 1.0 . . . . . . . . . . . . A . 14 VAL HG12 . . . . . . . . . c18126_2lr2 1 . 1 . 18 . 1 1 14 VAL HG13 H -2.033 20.520 8.355 . . . 1.0 . . . . . . . . . . . . A . 14 VAL HG13 . . . . . . . . . c18126_2lr2 1 . 1 . 19 . 1 1 14 VAL HG21 H -0.769 22.216 10.508 . . . 1.0 . . . . . . . . . . . . A . 14 VAL HG21 . . . . . . . . . c18126_2lr2 1 . 1 . 20 . 1 1 14 VAL HG22 H -0.846 22.672 8.802 . . . 1.0 . . . . . . . . . . . . A . 14 VAL HG22 . . . . . . . . . c18126_2lr2 1 . 1 . 21 . 1 1 14 VAL HG23 H 0.692 22.726 9.656 . . . 1.0 . . . . . . . . . . . . A . 14 VAL HG23 . . . . . . . . . c18126_2lr2 1 . 1 . 22 . 1 1 14 VAL N N 2.350 20.534 10.162 . . . 1.0 . . . . . . . . . . . . A . 14 VAL N . . . . . . . . . c18126_2lr2 1 . 1 . 23 . 1 1 14 VAL O O 1.759 17.989 8.978 . . . 1.0 . . . . . . . . . . . . A . 14 VAL O . . . . . . . . . c18126_2lr2 1 . 1 . 24 . 1 1 15 ASP C C -0.432 15.645 9.456 . . . 1.0 . . . . . . . . . . . . A . 15 ASP C . . . . . . . . . c18126_2lr2 1 . 1 . 25 . 1 1 15 ASP CA C 0.405 16.091 10.692 . . . 1.0 . . . . . . . . . . . . A . 15 ASP CA . . . . . . . . . c18126_2lr2 1 . 1 . 26 . 1 1 15 ASP CB C -0.147 15.447 12.030 . . . 1.0 . . . . . . . . . . . . A . 15 ASP CB . . . . . . . . . c18126_2lr2 1 . 1 . 27 . 1 1 15 ASP CG C 0.851 15.607 13.218 . . . 1.0 . . . . . . . . . . . . A . 15 ASP CG . . . . . . . . . c18126_2lr2 1 . 1 . 28 . 1 1 15 ASP H H -0.092 18.003 11.524 . . . 1.0 . . . . . . . . . . . . A . 15 ASP H . . . . . . . . . c18126_2lr2 1 . 1 . 29 . 1 1 15 ASP HA H 1.431 15.744 10.534 . . . 1.0 . . . . . . . . . . . . A . 15 ASP HA . . . . . . . . . c18126_2lr2 1 . 1 . 30 . 1 1 15 ASP HB2 H -1.091 15.916 12.300 . . . 1.0 . . . . . . . . . . . . A . 15 ASP HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 31 . 1 1 15 ASP HB3 H -0.325 14.386 11.880 . . . 1.0 . . . . . . . . . . . . A . 15 ASP HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 32 . 1 1 15 ASP N N 0.421 17.584 10.796 . . . 1.0 . . . . . . . . . . . . A . 15 ASP N . . . . . . . . . c18126_2lr2 1 . 1 . 33 . 1 1 15 ASP O O -1.438 16.288 9.118 . . . 1.0 . . . . . . . . . . . . A . 15 ASP O . . . . . . . . . c18126_2lr2 1 . 1 . 34 . 1 1 15 ASP OD1 O 2.011 15.939 12.986 . . . 1.0 . . . . . . . . . . . . A . 15 ASP OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 35 . 1 1 15 ASP OD2 O 0.436 15.390 14.345 . . . 1.0 . . . . . . . . . . . . A . 15 ASP OD2 . . . . . . . . . c18126_2lr2 1 . 1 . 36 . 1 1 16 ASN C C -1.453 12.741 7.897 . . . 1.0 . . . . . . . . . . . . A . 16 ASN C . . . . . . . . . c18126_2lr2 1 . 1 . 37 . 1 1 16 ASN CA C -0.590 13.988 7.552 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CA . . . . . . . . . c18126_2lr2 1 . 1 . 38 . 1 1 16 ASN CB C 0.548 13.615 6.528 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CB . . . . . . . . . c18126_2lr2 1 . 1 . 39 . 1 1 16 ASN CG C 1.247 14.872 5.930 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CG . . . . . . . . . c18126_2lr2 1 . 1 . 40 . 1 1 16 ASN H H 0.858 14.127 9.122 . . . 1.0 . . . . . . . . . . . . A . 16 ASN H . . . . . . . . . c18126_2lr2 1 . 1 . 41 . 1 1 16 ASN HA H -1.242 14.729 7.098 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HA . . . . . . . . . c18126_2lr2 1 . 1 . 42 . 1 1 16 ASN HB2 H 1.291 13.009 7.031 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 43 . 1 1 16 ASN HB3 H 0.131 13.036 5.705 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 44 . 1 1 16 ASN HD21 H 2.859 13.872 5.330 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 45 . 1 1 16 ASN HD22 H 2.868 15.536 4.991 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 46 . 1 1 16 ASN N N 0.038 14.557 8.784 . . . 1.0 . . . . . . . . . . . . A . 16 ASN N . . . . . . . . . c18126_2lr2 1 . 1 . 47 . 1 1 16 ASN ND2 N 2.424 14.750 5.371 . . . 1.0 . . . . . . . . . . . . A . 16 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 1 . 48 . 1 1 16 ASN O O -1.096 11.957 8.781 . . . 1.0 . . . . . . . . . . . . A . 16 ASN O . . . . . . . . . c18126_2lr2 1 . 1 . 49 . 1 1 16 ASN OD1 O 0.708 15.984 5.963 . . . 1.0 . . . . . . . . . . . . A . 16 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 50 . 1 1 17 LYS C C -3.529 10.519 6.161 . . . 1.0 . . . . . . . . . . . . A . 17 LYS C . . . . . . . . . c18126_2lr2 1 . 1 . 51 . 1 1 17 LYS CA C -3.607 11.516 7.342 . . . 1.0 . . . . . . . . . . . . A . 17 LYS CA . . . . . . . . . c18126_2lr2 1 . 1 . 52 . 1 1 17 LYS CB C -5.048 12.179 7.339 . . . 1.0 . . . . . . . . . . . . A . 17 LYS CB . . . . . . . . . c18126_2lr2 1 . 1 . 53 . 1 1 17 LYS CD C -6.706 13.811 8.609 . . . 1.0 . . . . . . . . . . . . A . 17 LYS CD . . . . . . . . . c18126_2lr2 1 . 1 . 54 . 1 1 17 LYS CE C -6.882 14.773 9.849 . . . 1.0 . . . . . . . . . . . . A . 17 LYS CE . . . . . . . . . c18126_2lr2 1 . 1 . 55 . 1 1 17 LYS CG C -5.274 13.106 8.612 . . . 1.0 . . . . . . . . . . . . A . 17 LYS CG . . . . . . . . . c18126_2lr2 1 . 1 . 56 . 1 1 17 LYS H H -2.781 13.302 6.497 . . . 1.0 . . . . . . . . . . . . A . 17 LYS H . . . . . . . . . c18126_2lr2 1 . 1 . 57 . 1 1 17 LYS HA H -3.458 10.981 8.278 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HA . . . . . . . . . c18126_2lr2 1 . 1 . 58 . 1 1 17 LYS HB2 H -5.157 12.778 6.432 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 59 . 1 1 17 LYS HB3 H -5.811 11.395 7.320 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 60 . 1 1 17 LYS HD2 H -6.827 14.391 7.688 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HD2 . . . . . . . . . c18126_2lr2 1 . 1 . 61 . 1 1 17 LYS HD3 H -7.487 13.051 8.634 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HD3 . . . . . . . . . c18126_2lr2 1 . 1 . 62 . 1 1 17 LYS HE2 H -6.072 15.495 9.893 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HE2 . . . . . . . . . c18126_2lr2 1 . 1 . 63 . 1 1 17 LYS HE3 H -7.820 15.312 9.771 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HE3 . . . . . . . . . c18126_2lr2 1 . 1 . 64 . 1 1 17 LYS HG2 H -5.174 12.503 9.515 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 65 . 1 1 17 LYS HG3 H -4.499 13.875 8.630 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 66 . 1 1 17 LYS HZ1 H -7.377 13.070 10.956 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HZ1 . . . . . . . . . c18126_2lr2 1 . 1 . 67 . 1 1 17 LYS HZ2 H -7.386 14.507 11.857 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HZ2 . . . . . . . . . c18126_2lr2 1 . 1 . 68 . 1 1 17 LYS HZ3 H -5.909 13.792 11.416 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HZ3 . . . . . . . . . c18126_2lr2 1 . 1 . 69 . 1 1 17 LYS N N -2.595 12.613 7.179 . . . 1.0 . . . . . . . . . . . . A . 17 LYS N . . . . . . . . . c18126_2lr2 1 . 1 . 70 . 1 1 17 LYS NZ N -6.889 13.975 11.116 . . . 1.0 . . . . . . . . . . . . A . 17 LYS NZ . . . . . . . . . c18126_2lr2 1 . 1 . 71 . 1 1 17 LYS O O -3.204 10.939 5.046 . . . 1.0 . . . . . . . . . . . . A . 17 LYS O . . . . . . . . . c18126_2lr2 1 . 1 . 72 . 1 1 18 PHE C C -5.091 8.796 4.369 . . . 1.0 . . . . . . . . . . . . A . 18 PHE C . . . . . . . . . c18126_2lr2 1 . 1 . 73 . 1 1 18 PHE CA C -3.978 8.249 5.219 . . . 1.0 . . . . . . . . . . . . A . 18 PHE CA . . . . . . . . . c18126_2lr2 1 . 1 . 74 . 1 1 18 PHE CB C -4.356 6.768 5.676 . . . 1.0 . . . . . . . . . . . . A . 18 PHE CB . . . . . . . . . c18126_2lr2 1 . 1 . 75 . 1 1 18 PHE CD1 C -6.622 6.769 6.980 . . . 1.0 . . . . . . . . . . . . A . 18 PHE CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 76 . 1 1 18 PHE CD2 C -4.533 6.660 8.254 . . . 1.0 . . . . . . . . . . . . A . 18 PHE CD2 . . . . . . . . . c18126_2lr2 1 . 1 . 77 . 1 1 18 PHE CE1 C -7.347 6.750 8.186 . . . 1.0 . . . . . . . . . . . . A . 18 PHE CE1 . . . . . . . . . c18126_2lr2 1 . 1 . 78 . 1 1 18 PHE CE2 C -5.271 6.637 9.448 . . . 1.0 . . . . . . . . . . . . A . 18 PHE CE2 . . . . . . . . . c18126_2lr2 1 . 1 . 79 . 1 1 18 PHE CG C -5.199 6.728 6.996 . . . 1.0 . . . . . . . . . . . . A . 18 PHE CG . . . . . . . . . c18126_2lr2 1 . 1 . 80 . 1 1 18 PHE CZ C -6.674 6.686 9.416 . . . 1.0 . . . . . . . . . . . . A . 18 PHE CZ . . . . . . . . . c18126_2lr2 1 . 1 . 81 . 1 1 18 PHE H H -4.258 8.934 7.252 . . . 1.0 . . . . . . . . . . . . A . 18 PHE H . . . . . . . . . c18126_2lr2 1 . 1 . 82 . 1 1 18 PHE HA H -3.072 8.267 4.688 . . . 1.0 . . . . . . . . . . . . A . 18 PHE HA . . . . . . . . . c18126_2lr2 1 . 1 . 83 . 1 1 18 PHE HB2 H -4.909 6.282 4.882 . . . 1.0 . . . . . . . . . . . . A . 18 PHE HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 84 . 1 1 18 PHE HB3 H -3.469 6.205 5.828 . . . 1.0 . . . . . . . . . . . . A . 18 PHE HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 85 . 1 1 18 PHE HD1 H -7.156 6.816 6.043 . . . 1.0 . . . . . . . . . . . . A . 18 PHE HD1 . . . . . . . . . c18126_2lr2 1 . 1 . 86 . 1 1 18 PHE HD2 H -3.445 6.614 8.299 . . . 1.0 . . . . . . . . . . . . A . 18 PHE HD2 . . . . . . . . . c18126_2lr2 1 . 1 . 87 . 1 1 18 PHE HE1 H -8.435 6.781 8.165 . . . 1.0 . . . . . . . . . . . . A . 18 PHE HE1 . . . . . . . . . c18126_2lr2 1 . 1 . 88 . 1 1 18 PHE HE2 H -4.753 6.587 10.402 . . . 1.0 . . . . . . . . . . . . A . 18 PHE HE2 . . . . . . . . . c18126_2lr2 1 . 1 . 89 . 1 1 18 PHE HZ H -7.240 6.679 10.345 . . . 1.0 . . . . . . . . . . . . A . 18 PHE HZ . . . . . . . . . c18126_2lr2 1 . 1 . 90 . 1 1 18 PHE N N -3.926 9.212 6.368 . . . 1.0 . . . . . . . . . . . . A . 18 PHE N . . . . . . . . . c18126_2lr2 1 . 1 . 91 . 1 1 18 PHE O O -6.169 8.950 4.974 . . . 1.0 . . . . . . . . . . . . A . 18 PHE O . . . . . . . . . c18126_2lr2 1 . 1 . 92 . 1 1 19 ASN C C -7.199 8.717 2.034 . . . 1.0 . . . . . . . . . . . . A . 19 ASN C . . . . . . . . . c18126_2lr2 1 . 1 . 93 . 1 1 19 ASN CA C -6.312 9.779 2.677 . . . 1.0 . . . . . . . . . . . . A . 19 ASN CA . . . . . . . . . c18126_2lr2 1 . 1 . 94 . 1 1 19 ASN CB C -6.053 11.039 1.729 . . . 1.0 . . . . . . . . . . . . A . 19 ASN CB . . . . . . . . . c18126_2lr2 1 . 1 . 95 . 1 1 19 ASN CG C -5.418 12.230 2.504 . . . 1.0 . . . . . . . . . . . . A . 19 ASN CG . . . . . . . . . c18126_2lr2 1 . 1 . 96 . 1 1 19 ASN H H -4.275 9.267 2.397 . . . 1.0 . . . . . . . . . . . . A . 19 ASN H . . . . . . . . . c18126_2lr2 1 . 1 . 97 . 1 1 19 ASN HA H -6.796 10.146 3.570 . . . 1.0 . . . . . . . . . . . . A . 19 ASN HA . . . . . . . . . c18126_2lr2 1 . 1 . 98 . 1 1 19 ASN HB2 H -5.400 10.767 0.921 . . . 1.0 . . . . . . . . . . . . A . 19 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 99 . 1 1 19 ASN HB3 H -6.987 11.392 1.302 . . . 1.0 . . . . . . . . . . . . A . 19 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 100 . 1 1 19 ASN HD21 H -4.702 13.119 0.876 . . . 1.0 . . . . . . . . . . . . A . 19 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 101 . 1 1 19 ASN HD22 H -4.383 13.916 2.341 . . . 1.0 . . . . . . . . . . . . A . 19 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 102 . 1 1 19 ASN N N -5.016 9.216 3.036 . . . 1.0 . . . . . . . . . . . . A . 19 ASN N . . . . . . . . . c18126_2lr2 1 . 1 . 103 . 1 1 19 ASN ND2 N -4.780 13.165 1.851 . . . 1.0 . . . . . . . . . . . . A . 19 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 1 . 104 . 1 1 19 ASN O O -6.986 7.520 2.224 . . . 1.0 . . . . . . . . . . . . A . 19 ASN O . . . . . . . . . c18126_2lr2 1 . 1 . 105 . 1 1 19 ASN OD1 O -5.497 12.306 3.734 . . . 1.0 . . . . . . . . . . . . A . 19 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 106 . 1 1 20 LYS C C -8.499 7.739 -0.700 . . . 1.0 . . . . . . . . . . . . A . 20 LYS C . . . . . . . . . c18126_2lr2 1 . 1 . 107 . 1 1 20 LYS CA C -9.105 8.242 0.606 . . . 1.0 . . . . . . . . . . . . A . 20 LYS CA . . . . . . . . . c18126_2lr2 1 . 1 . 108 . 1 1 20 LYS CB C -10.492 8.979 0.365 . . . 1.0 . . . . . . . . . . . . A . 20 LYS CB . . . . . . . . . c18126_2lr2 1 . 1 . 109 . 1 1 20 LYS CD C -11.787 10.996 -0.835 . . . 1.0 . . . . . . . . . . . . A . 20 LYS CD . . . . . . . . . c18126_2lr2 1 . 1 . 110 . 1 1 20 LYS CE C -12.378 11.703 0.444 . . . 1.0 . . . . . . . . . . . . A . 20 LYS CE . . . . . . . . . c18126_2lr2 1 . 1 . 111 . 1 1 20 LYS CG C -10.380 10.298 -0.558 . . . 1.0 . . . . . . . . . . . . A . 20 LYS CG . . . . . . . . . c18126_2lr2 1 . 1 . 112 . 1 1 20 LYS H H -8.313 10.130 1.157 . . . 1.0 . . . . . . . . . . . . A . 20 LYS H . . . . . . . . . c18126_2lr2 1 . 1 . 113 . 1 1 20 LYS HA H -9.287 7.400 1.256 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HA . . . . . . . . . c18126_2lr2 1 . 1 . 114 . 1 1 20 LYS HB2 H -11.185 8.276 -0.105 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 115 . 1 1 20 LYS HB3 H -10.900 9.246 1.335 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 116 . 1 1 20 LYS HD2 H -11.662 11.740 -1.622 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HD2 . . . . . . . . . c18126_2lr2 1 . 1 . 117 . 1 1 20 LYS HD3 H -12.500 10.254 -1.195 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HD3 . . . . . . . . . c18126_2lr2 1 . 1 . 118 . 1 1 20 LYS HE2 H -12.608 10.977 1.211 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HE2 . . . . . . . . . c18126_2lr2 1 . 1 . 119 . 1 1 20 LYS HE3 H -11.669 12.426 0.842 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HE3 . . . . . . . . . c18126_2lr2 1 . 1 . 120 . 1 1 20 LYS HG2 H -9.708 11.015 -0.087 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 121 . 1 1 20 LYS HG3 H -9.950 10.038 -1.521 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 122 . 1 1 20 LYS HZ1 H -14.425 11.738 0.090 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HZ1 . . . . . . . . . c18126_2lr2 1 . 1 . 123 . 1 1 20 LYS HZ2 H -13.540 12.839 -0.851 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HZ2 . . . . . . . . . c18126_2lr2 1 . 1 . 124 . 1 1 20 LYS HZ3 H -13.814 13.158 0.795 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HZ3 . . . . . . . . . c18126_2lr2 1 . 1 . 125 . 1 1 20 LYS N N -8.192 9.164 1.273 . . . 1.0 . . . . . . . . . . . . A . 20 LYS N . . . . . . . . . c18126_2lr2 1 . 1 . 126 . 1 1 20 LYS NZ N -13.635 12.414 0.091 . . . 1.0 . . . . . . . . . . . . A . 20 LYS NZ . . . . . . . . . c18126_2lr2 1 . 1 . 127 . 1 1 20 LYS O O -8.479 6.537 -0.964 . . . 1.0 . . . . . . . . . . . . A . 20 LYS O . . . . . . . . . c18126_2lr2 1 . 1 . 128 . 1 1 21 GLU C C -6.351 7.219 -2.598 . . . 1.0 . . . . . . . . . . . . A . 21 GLU C . . . . . . . . . c18126_2lr2 1 . 1 . 129 . 1 1 21 GLU CA C -7.403 8.306 -2.792 . . . 1.0 . . . . . . . . . . . . A . 21 GLU CA . . . . . . . . . c18126_2lr2 1 . 1 . 130 . 1 1 21 GLU CB C -6.753 9.589 -3.459 . . . 1.0 . . . . . . . . . . . . A . 21 GLU CB . . . . . . . . . c18126_2lr2 1 . 1 . 131 . 1 1 21 GLU CD C -5.544 10.559 -5.579 . . . 1.0 . . . . . . . . . . . . A . 21 GLU CD . . . . . . . . . c18126_2lr2 1 . 1 . 132 . 1 1 21 GLU CG C -6.133 9.293 -4.906 . . . 1.0 . . . . . . . . . . . . A . 21 GLU CG . . . . . . . . . c18126_2lr2 1 . 1 . 133 . 1 1 21 GLU H H -8.051 9.611 -1.252 . . . 1.0 . . . . . . . . . . . . A . 21 GLU H . . . . . . . . . c18126_2lr2 1 . 1 . 134 . 1 1 21 GLU HA H -8.173 7.936 -3.451 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HA . . . . . . . . . c18126_2lr2 1 . 1 . 135 . 1 1 21 GLU HB2 H -7.516 10.364 -3.546 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 136 . 1 1 21 GLU HB3 H -5.974 9.966 -2.802 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 137 . 1 1 21 GLU HG2 H -5.331 8.568 -4.828 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 138 . 1 1 21 GLU HG3 H -6.904 8.883 -5.556 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 139 . 1 1 21 GLU N N -8.007 8.667 -1.514 . . . 1.0 . . . . . . . . . . . . A . 21 GLU N . . . . . . . . . c18126_2lr2 1 . 1 . 140 . 1 1 21 GLU O O -6.107 6.412 -3.495 . . . 1.0 . . . . . . . . . . . . A . 21 GLU O . . . . . . . . . c18126_2lr2 1 . 1 . 141 . 1 1 21 GLU OE1 O -5.387 11.568 -4.906 . . . 1.0 . . . . . . . . . . . . A . 21 GLU OE1 . . . . . . . . . c18126_2lr2 1 . 1 . 142 . 1 1 21 GLU OE2 O -5.250 10.491 -6.766 . . . 1.0 . . . . . . . . . . . . A . 21 GLU OE2 . . . . . . . . . c18126_2lr2 1 . 1 . 143 . 1 1 22 GLN C C -5.347 4.894 -0.690 . . . 1.0 . . . . . . . . . . . . A . 22 GLN C . . . . . . . . . c18126_2lr2 1 . 1 . 144 . 1 1 22 GLN CA C -4.708 6.210 -1.122 . . . 1.0 . . . . . . . . . . . . A . 22 GLN CA . . . . . . . . . c18126_2lr2 1 . 1 . 145 . 1 1 22 GLN CB C -3.773 6.784 0.027 . . . 1.0 . . . . . . . . . . . . A . 22 GLN CB . . . . . . . . . c18126_2lr2 1 . 1 . 146 . 1 1 22 GLN CD C -3.010 8.786 -1.478 . . . 1.0 . . . . . . . . . . . . A . 22 GLN CD . . . . . . . . . c18126_2lr2 1 . 1 . 147 . 1 1 22 GLN CG C -3.545 8.351 -0.106 . . . 1.0 . . . . . . . . . . . . A . 22 GLN CG . . . . . . . . . c18126_2lr2 1 . 1 . 148 . 1 1 22 GLN H H -5.968 7.871 -0.745 . . . 1.0 . . . . . . . . . . . . A . 22 GLN H . . . . . . . . . c18126_2lr2 1 . 1 . 149 . 1 1 22 GLN HA H -4.116 6.038 -2.009 . . . 1.0 . . . . . . . . . . . . A . 22 GLN HA . . . . . . . . . c18126_2lr2 1 . 1 . 150 . 1 1 22 GLN HB2 H -4.223 6.593 0.992 . . . 1.0 . . . . . . . . . . . . A . 22 GLN HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 151 . 1 1 22 GLN HB3 H -2.803 6.269 -0.003 . . . 1.0 . . . . . . . . . . . . A . 22 GLN HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 152 . 1 1 22 GLN HE21 H -4.053 10.460 -1.542 . . . 1.0 . . . . . . . . . . . . A . 22 GLN HE21 . . . . . . . . . c18126_2lr2 1 . 1 . 153 . 1 1 22 GLN HE22 H -3.070 10.166 -2.893 . . . 1.0 . . . . . . . . . . . . A . 22 GLN HE22 . . . . . . . . . c18126_2lr2 1 . 1 . 154 . 1 1 22 GLN HG2 H -4.480 8.858 0.075 . . . 1.0 . . . . . . . . . . . . A . 22 GLN HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 155 . 1 1 22 GLN HG3 H -2.844 8.676 0.645 . . . 1.0 . . . . . . . . . . . . A . 22 GLN HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 156 . 1 1 22 GLN N N -5.732 7.203 -1.422 . . . 1.0 . . . . . . . . . . . . A . 22 GLN N . . . . . . . . . c18126_2lr2 1 . 1 . 157 . 1 1 22 GLN NE2 N -3.407 9.899 -2.012 . . . 1.0 . . . . . . . . . . . . A . 22 GLN NE2 . . . . . . . . . c18126_2lr2 1 . 1 . 158 . 1 1 22 GLN O O -5.113 3.850 -1.298 . . . 1.0 . . . . . . . . . . . . A . 22 GLN O . . . . . . . . . c18126_2lr2 1 . 1 . 159 . 1 1 22 GLN OE1 O -2.194 8.112 -2.063 . . . 1.0 . . . . . . . . . . . . A . 22 GLN OE1 . . . . . . . . . c18126_2lr2 1 . 1 . 160 . 1 1 23 GLN C C -7.470 2.983 -0.275 . . . 1.0 . . . . . . . . . . . . A . 23 GLN C . . . . . . . . . c18126_2lr2 1 . 1 . 161 . 1 1 23 GLN CA C -6.824 3.759 0.868 . . . 1.0 . . . . . . . . . . . . A . 23 GLN CA . . . . . . . . . c18126_2lr2 1 . 1 . 162 . 1 1 23 GLN CB C -7.961 4.101 1.932 . . . 1.0 . . . . . . . . . . . . A . 23 GLN CB . . . . . . . . . c18126_2lr2 1 . 1 . 163 . 1 1 23 GLN CD C -8.524 5.049 4.284 . . . 1.0 . . . . . . . . . . . . A . 23 GLN CD . . . . . . . . . c18126_2lr2 1 . 1 . 164 . 1 1 23 GLN CG C -7.386 4.644 3.302 . . . 1.0 . . . . . . . . . . . . A . 23 GLN CG . . . . . . . . . c18126_2lr2 1 . 1 . 165 . 1 1 23 GLN H H -6.305 5.813 0.808 . . . 1.0 . . . . . . . . . . . . A . 23 GLN H . . . . . . . . . c18126_2lr2 1 . 1 . 166 . 1 1 23 GLN HA H -6.094 3.128 1.353 . . . 1.0 . . . . . . . . . . . . A . 23 GLN HA . . . . . . . . . c18126_2lr2 1 . 1 . 167 . 1 1 23 GLN HB2 H -8.628 4.846 1.505 . . . 1.0 . . . . . . . . . . . . A . 23 GLN HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 168 . 1 1 23 GLN HB3 H -8.551 3.202 2.129 . . . 1.0 . . . . . . . . . . . . A . 23 GLN HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 169 . 1 1 23 GLN HE21 H -7.998 3.750 5.703 . . . 1.0 . . . . . . . . . . . . A . 23 GLN HE21 . . . . . . . . . c18126_2lr2 1 . 1 . 170 . 1 1 23 GLN HE22 H -9.346 4.716 6.072 . . . 1.0 . . . . . . . . . . . . A . 23 GLN HE22 . . . . . . . . . c18126_2lr2 1 . 1 . 171 . 1 1 23 GLN HG2 H -6.782 3.875 3.776 . . . 1.0 . . . . . . . . . . . . A . 23 GLN HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 172 . 1 1 23 GLN HG3 H -6.757 5.501 3.124 . . . 1.0 . . . . . . . . . . . . A . 23 GLN HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 173 . 1 1 23 GLN N N -6.155 4.953 0.363 . . . 1.0 . . . . . . . . . . . . A . 23 GLN N . . . . . . . . . c18126_2lr2 1 . 1 . 174 . 1 1 23 GLN NE2 N -8.634 4.453 5.450 . . . 1.0 . . . . . . . . . . . . A . 23 GLN NE2 . . . . . . . . . c18126_2lr2 1 . 1 . 175 . 1 1 23 GLN O O -7.442 1.752 -0.296 . . . 1.0 . . . . . . . . . . . . A . 23 GLN O . . . . . . . . . c18126_2lr2 1 . 1 . 176 . 1 1 23 GLN OE1 O -9.314 5.948 3.985 . . . 1.0 . . . . . . . . . . . . A . 23 GLN OE1 . . . . . . . . . c18126_2lr2 1 . 1 . 177 . 1 1 24 ASN C C -7.705 2.234 -3.151 . . . 1.0 . . . . . . . . . . . . A . 24 ASN C . . . . . . . . . c18126_2lr2 1 . 1 . 178 . 1 1 24 ASN CA C -8.703 3.078 -2.365 . . . 1.0 . . . . . . . . . . . . A . 24 ASN CA . . . . . . . . . c18126_2lr2 1 . 1 . 179 . 1 1 24 ASN CB C -9.336 4.196 -3.282 . . . 1.0 . . . . . . . . . . . . A . 24 ASN CB . . . . . . . . . c18126_2lr2 1 . 1 . 180 . 1 1 24 ASN CG C -10.034 3.606 -4.535 . . . 1.0 . . . . . . . . . . . . A . 24 ASN CG . . . . . . . . . c18126_2lr2 1 . 1 . 181 . 1 1 24 ASN H H -8.044 4.687 -1.153 . . . 1.0 . . . . . . . . . . . . A . 24 ASN H . . . . . . . . . c18126_2lr2 1 . 1 . 182 . 1 1 24 ASN HA H -9.496 2.440 -2.007 . . . 1.0 . . . . . . . . . . . . A . 24 ASN HA . . . . . . . . . c18126_2lr2 1 . 1 . 183 . 1 1 24 ASN HB2 H -10.075 4.752 -2.713 . . . 1.0 . . . . . . . . . . . . A . 24 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 184 . 1 1 24 ASN HB3 H -8.558 4.889 -3.596 . . . 1.0 . . . . . . . . . . . . A . 24 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 185 . 1 1 24 ASN HD21 H -9.102 4.802 -5.820 . . . 1.0 . . . . . . . . . . . . A . 24 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 186 . 1 1 24 ASN HD22 H -10.192 3.702 -6.514 . . . 1.0 . . . . . . . . . . . . A . 24 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 187 . 1 1 24 ASN N N -8.052 3.710 -1.223 . . . 1.0 . . . . . . . . . . . . A . 24 ASN N . . . . . . . . . c18126_2lr2 1 . 1 . 188 . 1 1 24 ASN ND2 N -9.753 4.077 -5.723 . . . 1.0 . . . . . . . . . . . . A . 24 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 1 . 189 . 1 1 24 ASN O O -7.981 1.084 -3.490 . . . 1.0 . . . . . . . . . . . . A . 24 ASN O . . . . . . . . . c18126_2lr2 1 . 1 . 190 . 1 1 24 ASN OD1 O -10.855 2.693 -4.419 . . . 1.0 . . . . . . . . . . . . A . 24 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 191 . 1 1 25 ALA C C -4.924 0.973 -3.346 . . . 1.0 . . . . . . . . . . . . A . 25 ALA C . . . . . . . . . c18126_2lr2 1 . 1 . 192 . 1 1 25 ALA CA C -5.511 2.105 -4.184 . . . 1.0 . . . . . . . . . . . . A . 25 ALA CA . . . . . . . . . c18126_2lr2 1 . 1 . 193 . 1 1 25 ALA CB C -4.421 3.138 -4.563 . . . 1.0 . . . . . . . . . . . . A . 25 ALA CB . . . . . . . . . c18126_2lr2 1 . 1 . 194 . 1 1 25 ALA H H -6.378 3.733 -3.140 . . . 1.0 . . . . . . . . . . . . A . 25 ALA H . . . . . . . . . c18126_2lr2 1 . 1 . 195 . 1 1 25 ALA HA H -5.949 1.688 -5.078 . . . 1.0 . . . . . . . . . . . . A . 25 ALA HA . . . . . . . . . c18126_2lr2 1 . 1 . 196 . 1 1 25 ALA HB1 H -4.688 3.649 -5.477 . . . 1.0 . . . . . . . . . . . . A . 25 ALA HB1 . . . . . . . . . c18126_2lr2 1 . 1 . 197 . 1 1 25 ALA HB2 H -3.467 2.649 -4.688 . . . 1.0 . . . . . . . . . . . . A . 25 ALA HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 198 . 1 1 25 ALA HB3 H -4.334 3.872 -3.782 . . . 1.0 . . . . . . . . . . . . A . 25 ALA HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 199 . 1 1 25 ALA N N -6.543 2.814 -3.437 . . . 1.0 . . . . . . . . . . . . A . 25 ALA N . . . . . . . . . c18126_2lr2 1 . 1 . 200 . 1 1 25 ALA O O -4.584 -0.088 -3.869 . . . 1.0 . . . . . . . . . . . . A . 25 ALA O . . . . . . . . . c18126_2lr2 1 . 1 . 201 . 1 1 26 PHE C C -5.063 -1.095 -1.236 . . . 1.0 . . . . . . . . . . . . A . 26 PHE C . . . . . . . . . c18126_2lr2 1 . 1 . 202 . 1 1 26 PHE CA C -4.263 0.200 -1.141 . . . 1.0 . . . . . . . . . . . . A . 26 PHE CA . . . . . . . . . c18126_2lr2 1 . 1 . 203 . 1 1 26 PHE CB C -4.350 0.676 0.363 . . . 1.0 . . . . . . . . . . . . A . 26 PHE CB . . . . . . . . . c18126_2lr2 1 . 1 . 204 . 1 1 26 PHE CD1 C -2.532 -0.621 1.732 . . . 1.0 . . . . . . . . . . . . A . 26 PHE CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 205 . 1 1 26 PHE CD2 C -4.863 -1.315 1.978 . . . 1.0 . . . . . . . . . . . . A . 26 PHE CD2 . . . . . . . . . c18126_2lr2 1 . 1 . 206 . 1 1 26 PHE CE1 C -2.161 -1.628 2.643 . . . 1.0 . . . . . . . . . . . . A . 26 PHE CE1 . . . . . . . . . c18126_2lr2 1 . 1 . 207 . 1 1 26 PHE CE2 C -4.472 -2.317 2.883 . . . 1.0 . . . . . . . . . . . . A . 26 PHE CE2 . . . . . . . . . c18126_2lr2 1 . 1 . 208 . 1 1 26 PHE CG C -3.890 -0.439 1.387 . . . 1.0 . . . . . . . . . . . . A . 26 PHE CG . . . . . . . . . c18126_2lr2 1 . 1 . 209 . 1 1 26 PHE CZ C -3.125 -2.472 3.215 . . . 1.0 . . . . . . . . . . . . A . 26 PHE CZ . . . . . . . . . c18126_2lr2 1 . 1 . 210 . 1 1 26 PHE H H -5.097 2.072 -1.681 . . . 1.0 . . . . . . . . . . . . A . 26 PHE H . . . . . . . . . c18126_2lr2 1 . 1 . 211 . 1 1 26 PHE HA H -3.239 0.000 -1.418 . . . 1.0 . . . . . . . . . . . . A . 26 PHE HA . . . . . . . . . c18126_2lr2 1 . 1 . 212 . 1 1 26 PHE HB2 H -3.738 1.561 0.495 . . . 1.0 . . . . . . . . . . . . A . 26 PHE HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 213 . 1 1 26 PHE HB3 H -5.362 0.955 0.583 . . . 1.0 . . . . . . . . . . . . A . 26 PHE HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 214 . 1 1 26 PHE HD1 H -1.771 0.021 1.313 . . . 1.0 . . . . . . . . . . . . A . 26 PHE HD1 . . . . . . . . . c18126_2lr2 1 . 1 . 215 . 1 1 26 PHE HD2 H -5.917 -1.215 1.727 . . . 1.0 . . . . . . . . . . . . A . 26 PHE HD2 . . . . . . . . . c18126_2lr2 1 . 1 . 216 . 1 1 26 PHE HE1 H -1.127 -1.754 2.903 . . . 1.0 . . . . . . . . . . . . A . 26 PHE HE1 . . . . . . . . . c18126_2lr2 1 . 1 . 217 . 1 1 26 PHE HE2 H -5.220 -2.973 3.327 . . . 1.0 . . . . . . . . . . . . A . 26 PHE HE2 . . . . . . . . . c18126_2lr2 1 . 1 . 218 . 1 1 26 PHE HZ H -2.825 -3.246 3.918 . . . 1.0 . . . . . . . . . . . . A . 26 PHE HZ . . . . . . . . . c18126_2lr2 1 . 1 . 219 . 1 1 26 PHE N N -4.810 1.207 -2.042 . . . 1.0 . . . . . . . . . . . . A . 26 PHE N . . . . . . . . . c18126_2lr2 1 . 1 . 220 . 1 1 26 PHE O O -4.502 -2.189 -1.174 . . . 1.0 . . . . . . . . . . . . A . 26 PHE O . . . . . . . . . c18126_2lr2 1 . 1 . 221 . 1 1 27 TYR C C -7.030 -2.843 -2.820 . . . 1.0 . . . . . . . . . . . . A . 27 TYR C . . . . . . . . . c18126_2lr2 1 . 1 . 222 . 1 1 27 TYR CA C -7.245 -2.130 -1.489 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CA . . . . . . . . . c18126_2lr2 1 . 1 . 223 . 1 1 27 TYR CB C -8.765 -1.718 -1.327 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CB . . . . . . . . . c18126_2lr2 1 . 1 . 224 . 1 1 27 TYR CD1 C -9.279 -2.633 1.054 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 225 . 1 1 27 TYR CD2 C -9.439 -0.218 0.707 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CD2 . . . . . . . . . c18126_2lr2 1 . 1 . 226 . 1 1 27 TYR CE1 C -9.648 -2.454 2.400 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CE1 . . . . . . . . . c18126_2lr2 1 . 1 . 227 . 1 1 27 TYR CE2 C -9.806 -0.060 2.052 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CE2 . . . . . . . . . c18126_2lr2 1 . 1 . 228 . 1 1 27 TYR CG C -9.158 -1.507 0.181 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CG . . . . . . . . . c18126_2lr2 1 . 1 . 229 . 1 1 27 TYR CZ C -9.907 -1.170 2.895 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CZ . . . . . . . . . c18126_2lr2 1 . 1 . 230 . 1 1 27 TYR H H -6.769 -0.066 -1.430 . . . 1.0 . . . . . . . . . . . . A . 27 TYR H . . . . . . . . . c18126_2lr2 1 . 1 . 231 . 1 1 27 TYR HA H -7.013 -2.812 -0.685 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HA . . . . . . . . . c18126_2lr2 1 . 1 . 232 . 1 1 27 TYR HB2 H -8.922 -0.791 -1.873 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 233 . 1 1 27 TYR HB3 H -9.417 -2.470 -1.764 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 234 . 1 1 27 TYR HD1 H -9.079 -3.637 0.684 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HD1 . . . . . . . . . c18126_2lr2 1 . 1 . 235 . 1 1 27 TYR HD2 H -9.387 0.651 0.071 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HD2 . . . . . . . . . c18126_2lr2 1 . 1 . 236 . 1 1 27 TYR HE1 H -9.741 -3.314 3.059 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HE1 . . . . . . . . . c18126_2lr2 1 . 1 . 237 . 1 1 27 TYR HE2 H -10.012 0.928 2.442 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HE2 . . . . . . . . . c18126_2lr2 1 . 1 . 238 . 1 1 27 TYR HH H -11.114 -1.444 4.353 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HH . . . . . . . . . c18126_2lr2 1 . 1 . 239 . 1 1 27 TYR N N -6.377 -0.963 -1.387 . . . 1.0 . . . . . . . . . . . . A . 27 TYR N . . . . . . . . . c18126_2lr2 1 . 1 . 240 . 1 1 27 TYR O O -6.948 -4.070 -2.872 . . . 1.0 . . . . . . . . . . . . A . 27 TYR O . . . . . . . . . c18126_2lr2 1 . 1 . 241 . 1 1 27 TYR OH O -10.274 -1.000 4.219 . . . 1.0 . . . . . . . . . . . . A . 27 TYR OH . . . . . . . . . c18126_2lr2 1 . 1 . 242 . 1 1 28 GLU C C -5.502 -3.535 -5.233 . . . 1.0 . . . . . . . . . . . . A . 28 GLU C . . . . . . . . . c18126_2lr2 1 . 1 . 243 . 1 1 28 GLU CA C -6.733 -2.634 -5.221 . . . 1.0 . . . . . . . . . . . . A . 28 GLU CA . . . . . . . . . c18126_2lr2 1 . 1 . 244 . 1 1 28 GLU CB C -6.634 -1.487 -6.279 . . . 1.0 . . . . . . . . . . . . A . 28 GLU CB . . . . . . . . . c18126_2lr2 1 . 1 . 245 . 1 1 28 GLU CD C -9.148 -1.595 -7.061 . . . 1.0 . . . . . . . . . . . . A . 28 GLU CD . . . . . . . . . c18126_2lr2 1 . 1 . 246 . 1 1 28 GLU CG C -8.012 -0.704 -6.471 . . . 1.0 . . . . . . . . . . . . A . 28 GLU CG . . . . . . . . . c18126_2lr2 1 . 1 . 247 . 1 1 28 GLU H H -7.011 -1.094 -3.793 . . . 1.0 . . . . . . . . . . . . A . 28 GLU H . . . . . . . . . c18126_2lr2 1 . 1 . 248 . 1 1 28 GLU HA H -7.599 -3.220 -5.490 . . . 1.0 . . . . . . . . . . . . A . 28 GLU HA . . . . . . . . . c18126_2lr2 1 . 1 . 249 . 1 1 28 GLU HB2 H -5.885 -0.794 -5.951 . . . 1.0 . . . . . . . . . . . . A . 28 GLU HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 250 . 1 1 28 GLU HB3 H -6.321 -1.902 -7.240 . . . 1.0 . . . . . . . . . . . . A . 28 GLU HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 251 . 1 1 28 GLU HG2 H -8.347 -0.330 -5.510 . . . 1.0 . . . . . . . . . . . . A . 28 GLU HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 252 . 1 1 28 GLU HG3 H -7.863 0.145 -7.126 . . . 1.0 . . . . . . . . . . . . A . 28 GLU HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 253 . 1 1 28 GLU N N -6.939 -2.066 -3.894 . . . 1.0 . . . . . . . . . . . . A . 28 GLU N . . . . . . . . . c18126_2lr2 1 . 1 . 254 . 1 1 28 GLU O O -5.529 -4.632 -5.792 . . . 1.0 . . . . . . . . . . . . A . 28 GLU O . . . . . . . . . c18126_2lr2 1 . 1 . 255 . 1 1 28 GLU OE1 O -8.842 -2.603 -7.687 . . . 1.0 . . . . . . . . . . . . A . 28 GLU OE1 . . . . . . . . . c18126_2lr2 1 . 1 . 256 . 1 1 28 GLU OE2 O -10.306 -1.246 -6.880 . . . 1.0 . . . . . . . . . . . . A . 28 GLU OE2 . . . . . . . . . c18126_2lr2 1 . 1 . 257 . 1 1 29 ILE C C -3.385 -5.104 -3.733 . . . 1.0 . . . . . . . . . . . . A . 29 ILE C . . . . . . . . . c18126_2lr2 1 . 1 . 258 . 1 1 29 ILE CA C -3.189 -3.837 -4.559 . . . 1.0 . . . . . . . . . . . . A . 29 ILE CA . . . . . . . . . c18126_2lr2 1 . 1 . 259 . 1 1 29 ILE CB C -2.034 -2.911 -3.941 . . . 1.0 . . . . . . . . . . . . A . 29 ILE CB . . . . . . . . . c18126_2lr2 1 . 1 . 260 . 1 1 29 ILE CD1 C -2.011 -0.474 -4.951 . . . 1.0 . . . . . . . . . . . . A . 29 ILE CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 261 . 1 1 29 ILE CG1 C -1.458 -1.911 -5.069 . . . 1.0 . . . . . . . . . . . . A . 29 ILE CG1 . . . . . . . . . c18126_2lr2 1 . 1 . 262 . 1 1 29 ILE CG2 C -0.829 -3.759 -3.324 . . . 1.0 . . . . . . . . . . . . A . 29 ILE CG2 . . . . . . . . . c18126_2lr2 1 . 1 . 263 . 1 1 29 ILE H H -4.461 -2.184 -4.186 . . . 1.0 . . . . . . . . . . . . A . 29 ILE H . . . . . . . . . c18126_2lr2 1 . 1 . 264 . 1 1 29 ILE HA H -2.904 -4.114 -5.563 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HA . . . . . . . . . c18126_2lr2 1 . 1 . 265 . 1 1 29 ILE HB H -2.471 -2.325 -3.129 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HB . . . . . . . . . c18126_2lr2 1 . 1 . 266 . 1 1 29 ILE HD11 H -2.149 -0.180 -3.945 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HD11 . . . . . . . . . c18126_2lr2 1 . 1 . 267 . 1 1 29 ILE HD12 H -2.933 -0.418 -5.462 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HD12 . . . . . . . . . c18126_2lr2 1 . 1 . 268 . 1 1 29 ILE HD13 H -1.337 0.200 -5.394 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HD13 . . . . . . . . . c18126_2lr2 1 . 1 . 269 . 1 1 29 ILE HG12 H -0.389 -1.852 -4.987 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HG12 . . . . . . . . . c18126_2lr2 1 . 1 . 270 . 1 1 29 ILE HG13 H -1.697 -2.276 -6.063 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HG13 . . . . . . . . . c18126_2lr2 1 . 1 . 271 . 1 1 29 ILE HG21 H -0.008 -3.096 -3.062 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HG21 . . . . . . . . . c18126_2lr2 1 . 1 . 272 . 1 1 29 ILE HG22 H -0.468 -4.483 -4.037 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HG22 . . . . . . . . . c18126_2lr2 1 . 1 . 273 . 1 1 29 ILE HG23 H -1.147 -4.280 -2.429 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HG23 . . . . . . . . . c18126_2lr2 1 . 1 . 274 . 1 1 29 ILE N N -4.425 -3.065 -4.614 . . . 1.0 . . . . . . . . . . . . A . 29 ILE N . . . . . . . . . c18126_2lr2 1 . 1 . 275 . 1 1 29 ILE O O -2.724 -6.116 -3.964 . . . 1.0 . . . . . . . . . . . . A . 29 ILE O . . . . . . . . . c18126_2lr2 1 . 1 . 276 . 1 1 30 LEU C C -5.507 -7.168 -2.615 . . . 1.0 . . . . . . . . . . . . A . 30 LEU C . . . . . . . . . c18126_2lr2 1 . 1 . 277 . 1 1 30 LEU CA C -4.572 -6.189 -1.913 . . . 1.0 . . . . . . . . . . . . A . 30 LEU CA . . . . . . . . . c18126_2lr2 1 . 1 . 278 . 1 1 30 LEU CB C -5.213 -5.679 -0.547 . . . 1.0 . . . . . . . . . . . . A . 30 LEU CB . . . . . . . . . c18126_2lr2 1 . 1 . 279 . 1 1 30 LEU CD1 C -4.128 -7.582 0.967 . . . 1.0 . . . . . . . . . . . . A . 30 LEU CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 280 . 1 1 30 LEU CD2 C -6.164 -6.239 1.850 . . . 1.0 . . . . . . . . . . . . A . 30 LEU CD2 . . . . . . . . . c18126_2lr2 1 . 1 . 281 . 1 1 30 LEU CG C -5.462 -6.837 0.563 . . . 1.0 . . . . . . . . . . . . A . 30 LEU CG . . . . . . . . . c18126_2lr2 1 . 1 . 282 . 1 1 30 LEU H H -4.794 -4.207 -2.630 . . . 1.0 . . . . . . . . . . . . A . 30 LEU H . . . . . . . . . c18126_2lr2 1 . 1 . 283 . 1 1 30 LEU HA H -3.642 -6.690 -1.690 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HA . . . . . . . . . c18126_2lr2 1 . 1 . 284 . 1 1 30 LEU HB2 H -4.568 -4.909 -0.125 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 285 . 1 1 30 LEU HB3 H -6.163 -5.212 -0.779 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 286 . 1 1 30 LEU HD11 H -3.319 -6.873 1.099 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD11 . . . . . . . . . c18126_2lr2 1 . 1 . 287 . 1 1 30 LEU HD12 H -3.857 -8.286 0.193 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD12 . . . . . . . . . c18126_2lr2 1 . 1 . 288 . 1 1 30 LEU HD13 H -4.272 -8.131 1.888 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD13 . . . . . . . . . c18126_2lr2 1 . 1 . 289 . 1 1 30 LEU HD21 H -6.358 -7.037 2.557 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 290 . 1 1 30 LEU HD22 H -7.109 -5.786 1.577 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 291 . 1 1 30 LEU HD23 H -5.535 -5.491 2.324 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD23 . . . . . . . . . c18126_2lr2 1 . 1 . 292 . 1 1 30 LEU HG H -6.135 -7.585 0.155 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HG . . . . . . . . . c18126_2lr2 1 . 1 . 293 . 1 1 30 LEU N N -4.297 -5.040 -2.768 . . . 1.0 . . . . . . . . . . . . A . 30 LEU N . . . . . . . . . c18126_2lr2 1 . 1 . 294 . 1 1 30 LEU O O -5.777 -8.256 -2.107 . . . 1.0 . . . . . . . . . . . . A . 30 LEU O . . . . . . . . . c18126_2lr2 1 . 1 . 295 . 1 1 31 HIS C C -6.140 -8.384 -5.630 . . . 1.0 . . . . . . . . . . . . A . 31 HIS C . . . . . . . . . c18126_2lr2 1 . 1 . 296 . 1 1 31 HIS CA C -6.903 -7.626 -4.548 . . . 1.0 . . . . . . . . . . . . A . 31 HIS CA . . . . . . . . . c18126_2lr2 1 . 1 . 297 . 1 1 31 HIS CB C -8.065 -6.750 -5.180 . . . 1.0 . . . . . . . . . . . . A . 31 HIS CB . . . . . . . . . c18126_2lr2 1 . 1 . 298 . 1 1 31 HIS CD2 C -9.555 -5.030 -3.759 . . . 1.0 . . . . . . . . . . . . A . 31 HIS CD2 . . . . . . . . . c18126_2lr2 1 . 1 . 299 . 1 1 31 HIS CE1 C -10.514 -6.471 -2.467 . . . 1.0 . . . . . . . . . . . . A . 31 HIS CE1 . . . . . . . . . c18126_2lr2 1 . 1 . 300 . 1 1 31 HIS CG C -9.043 -6.268 -4.101 . . . 1.0 . . . . . . . . . . . . A . 31 HIS CG . . . . . . . . . c18126_2lr2 1 . 1 . 301 . 1 1 31 HIS H H -5.748 -5.896 -4.141 . . . 1.0 . . . . . . . . . . . . A . 31 HIS H . . . . . . . . . c18126_2lr2 1 . 1 . 302 . 1 1 31 HIS HA H -7.363 -8.337 -3.879 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HA . . . . . . . . . c18126_2lr2 1 . 1 . 303 . 1 1 31 HIS HB2 H -7.633 -5.891 -5.665 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 304 . 1 1 31 HIS HB3 H -8.623 -7.314 -5.928 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 305 . 1 1 31 HIS HD1 H -9.543 -8.134 -3.242 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HD1 . . . . . . . . . c18126_2lr2 1 . 1 . 306 . 1 1 31 HIS HD2 H -9.324 -4.105 -4.251 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HD2 . . . . . . . . . c18126_2lr2 1 . 1 . 307 . 1 1 31 HIS HE1 H -11.125 -6.916 -1.697 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HE1 . . . . . . . . . c18126_2lr2 1 . 1 . 308 . 1 1 31 HIS HE2 H -10.987 -4.457 -2.290 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HE2 . . . . . . . . . c18126_2lr2 1 . 1 . 309 . 1 1 31 HIS N N -5.998 -6.774 -3.785 . . . 1.0 . . . . . . . . . . . . A . 31 HIS N . . . . . . . . . c18126_2lr2 1 . 1 . 310 . 1 1 31 HIS ND1 N -9.677 -7.165 -3.257 . . . 1.0 . . . . . . . . . . . . A . 31 HIS ND1 . . . . . . . . . c18126_2lr2 1 . 1 . 311 . 1 1 31 HIS NE2 N -10.477 -5.168 -2.731 . . . 1.0 . . . . . . . . . . . . A . 31 HIS NE2 . . . . . . . . . c18126_2lr2 1 . 1 . 312 . 1 1 31 HIS O O -6.724 -9.159 -6.387 . . . 1.0 . . . . . . . . . . . . A . 31 HIS O . . . . . . . . . c18126_2lr2 1 . 1 . 313 . 1 1 32 LEU C C -4.134 -10.441 -6.772 . . . 1.0 . . . . . . . . . . . . A . 32 LEU C . . . . . . . . . c18126_2lr2 1 . 1 . 314 . 1 1 32 LEU CA C -4.066 -8.857 -6.839 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CA . . . . . . . . . c18126_2lr2 1 . 1 . 315 . 1 1 32 LEU CB C -2.555 -8.339 -6.808 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CB . . . . . . . . . c18126_2lr2 1 . 1 . 316 . 1 1 32 LEU CD1 C -0.929 -6.227 -6.934 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 317 . 1 1 32 LEU CD2 C -3.224 -6.125 -8.142 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CD2 . . . . . . . . . c18126_2lr2 1 . 1 . 318 . 1 1 32 LEU CG C -2.430 -6.738 -6.921 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CG . . . . . . . . . c18126_2lr2 1 . 1 . 319 . 1 1 32 LEU H H -4.388 -7.538 -5.170 . . . 1.0 . . . . . . . . . . . . A . 32 LEU H . . . . . . . . . c18126_2lr2 1 . 1 . 320 . 1 1 32 LEU HA H -4.507 -8.559 -7.758 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HA . . . . . . . . . c18126_2lr2 1 . 1 . 321 . 1 1 32 LEU HB2 H -2.101 -8.652 -5.862 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 322 . 1 1 32 LEU HB3 H -2.002 -8.804 -7.605 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 323 . 1 1 32 LEU HD11 H -0.232 -7.042 -6.812 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD11 . . . . . . . . . c18126_2lr2 1 . 1 . 324 . 1 1 32 LEU HD12 H -0.783 -5.537 -6.128 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD12 . . . . . . . . . c18126_2lr2 1 . 1 . 325 . 1 1 32 LEU HD13 H -0.717 -5.716 -7.865 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD13 . . . . . . . . . c18126_2lr2 1 . 1 . 326 . 1 1 32 LEU HD21 H -3.073 -6.711 -9.023 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 327 . 1 1 32 LEU HD22 H -2.899 -5.110 -8.335 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 328 . 1 1 32 LEU HD23 H -4.273 -6.098 -7.911 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD23 . . . . . . . . . c18126_2lr2 1 . 1 . 329 . 1 1 32 LEU HG H -2.876 -6.350 -6.046 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HG . . . . . . . . . c18126_2lr2 1 . 1 . 330 . 1 1 32 LEU N N -4.839 -8.175 -5.767 . . . 1.0 . . . . . . . . . . . . A . 32 LEU N . . . . . . . . . c18126_2lr2 1 . 1 . 331 . 1 1 32 LEU O O -3.608 -11.002 -5.831 . . . 1.0 . . . . . . . . . . . . A . 32 LEU O . . . . . . . . . c18126_2lr2 1 . 1 . 332 . 1 1 33 PRO C C -3.310 -13.294 -8.006 . . . 1.0 . . . . . . . . . . . . A . 33 PRO C . . . . . . . . . c18126_2lr2 1 . 1 . 333 . 1 1 33 PRO CA C -4.728 -12.721 -7.755 . . . 1.0 . . . . . . . . . . . . A . 33 PRO CA . . . . . . . . . c18126_2lr2 1 . 1 . 334 . 1 1 33 PRO CB C -5.764 -13.116 -8.844 . . . 1.0 . . . . . . . . . . . . A . 33 PRO CB . . . . . . . . . c18126_2lr2 1 . 1 . 335 . 1 1 33 PRO CD C -5.442 -10.702 -9.015 . . . 1.0 . . . . . . . . . . . . A . 33 PRO CD . . . . . . . . . c18126_2lr2 1 . 1 . 336 . 1 1 33 PRO CG C -5.691 -11.995 -9.854 . . . 1.0 . . . . . . . . . . . . A . 33 PRO CG . . . . . . . . . c18126_2lr2 1 . 1 . 337 . 1 1 33 PRO HA H -5.084 -13.073 -6.794 . . . 1.0 . . . . . . . . . . . . A . 33 PRO HA . . . . . . . . . c18126_2lr2 1 . 1 . 338 . 1 1 33 PRO HB2 H -5.493 -14.073 -9.301 . . . 1.0 . . . . . . . . . . . . A . 33 PRO HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 339 . 1 1 33 PRO HB3 H -6.766 -13.189 -8.419 . . . 1.0 . . . . . . . . . . . . A . 33 PRO HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 340 . 1 1 33 PRO HD2 H -4.835 -10.012 -9.585 . . . 1.0 . . . . . . . . . . . . A . 33 PRO HD2 . . . . . . . . . c18126_2lr2 1 . 1 . 341 . 1 1 33 PRO HD3 H -6.379 -10.230 -8.746 . . . 1.0 . . . . . . . . . . . . A . 33 PRO HD3 . . . . . . . . . c18126_2lr2 1 . 1 . 342 . 1 1 33 PRO HG2 H -4.877 -12.164 -10.571 . . . 1.0 . . . . . . . . . . . . A . 33 PRO HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 343 . 1 1 33 PRO HG3 H -6.629 -11.900 -10.396 . . . 1.0 . . . . . . . . . . . . A . 33 PRO HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 344 . 1 1 33 PRO N N -4.725 -11.189 -7.771 . . . 1.0 . . . . . . . . . . . . A . 33 PRO N . . . . . . . . . c18126_2lr2 1 . 1 . 345 . 1 1 33 PRO O O -2.454 -12.580 -8.551 . . . 1.0 . . . . . . . . . . . . A . 33 PRO O . . . . . . . . . c18126_2lr2 1 . 1 . 346 . 1 1 34 ASN C C -0.683 -14.376 -6.949 . . . 1.0 . . . . . . . . . . . . A . 34 ASN C . . . . . . . . . c18126_2lr2 1 . 1 . 347 . 1 1 34 ASN CA C -1.729 -15.239 -7.696 . . . 1.0 . . . . . . . . . . . . A . 34 ASN CA . . . . . . . . . c18126_2lr2 1 . 1 . 348 . 1 1 34 ASN CB C -1.329 -15.481 -9.217 . . . 1.0 . . . . . . . . . . . . A . 34 ASN CB . . . . . . . . . c18126_2lr2 1 . 1 . 349 . 1 1 34 ASN CG C -2.322 -16.433 -9.919 . . . 1.0 . . . . . . . . . . . . A . 34 ASN CG . . . . . . . . . c18126_2lr2 1 . 1 . 350 . 1 1 34 ASN H H -3.788 -15.056 -7.104 . . . 1.0 . . . . . . . . . . . . A . 34 ASN H . . . . . . . . . c18126_2lr2 1 . 1 . 351 . 1 1 34 ASN HA H -1.790 -16.206 -7.183 . . . 1.0 . . . . . . . . . . . . A . 34 ASN HA . . . . . . . . . c18126_2lr2 1 . 1 . 352 . 1 1 34 ASN HB2 H -1.305 -14.537 -9.753 . . . 1.0 . . . . . . . . . . . . A . 34 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 353 . 1 1 34 ASN HB3 H -0.338 -15.922 -9.270 . . . 1.0 . . . . . . . . . . . . A . 34 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 354 . 1 1 34 ASN HD21 H -2.634 -15.219 -11.460 . . . 1.0 . . . . . . . . . . . . A . 34 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 355 . 1 1 34 ASN HD22 H -3.490 -16.684 -11.510 . . . 1.0 . . . . . . . . . . . . A . 34 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 356 . 1 1 34 ASN N N -3.064 -14.572 -7.561 . . . 1.0 . . . . . . . . . . . . A . 34 ASN N . . . . . . . . . c18126_2lr2 1 . 1 . 357 . 1 1 34 ASN ND2 N -2.860 -16.085 -11.059 . . . 1.0 . . . . . . . . . . . . A . 34 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 1 . 358 . 1 1 34 ASN O O 0.240 -13.818 -7.558 . . . 1.0 . . . . . . . . . . . . A . 34 ASN O . . . . . . . . . c18126_2lr2 1 . 1 . 359 . 1 1 34 ASN OD1 O -2.604 -17.526 -9.419 . . . 1.0 . . . . . . . . . . . . A . 34 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 360 . 1 1 35 LEU C C 1.360 -13.711 -4.650 . . . 1.0 . . . . . . . . . . . . A . 35 LEU C . . . . . . . . . c18126_2lr2 1 . 1 . 361 . 1 1 35 LEU CA C -0.120 -13.260 -4.794 . . . 1.0 . . . . . . . . . . . . A . 35 LEU CA . . . . . . . . . c18126_2lr2 1 . 1 . 362 . 1 1 35 LEU CB C -0.771 -13.195 -3.323 . . . 1.0 . . . . . . . . . . . . A . 35 LEU CB . . . . . . . . . c18126_2lr2 1 . 1 . 363 . 1 1 35 LEU CD1 C -2.950 -12.664 -1.881 . . . 1.0 . . . . . . . . . . . . A . 35 LEU CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 364 . 1 1 35 LEU CD2 C -2.017 -10.867 -3.479 . . . 1.0 . . . . . . . . . . . . A . 35 LEU CD2 . . . . . . . . . c18126_2lr2 1 . 1 . 365 . 1 1 35 LEU CG C -2.196 -12.430 -3.262 . . . 1.0 . . . . . . . . . . . . A . 35 LEU CG . . . . . . . . . c18126_2lr2 1 . 1 . 366 . 1 1 35 LEU H H -1.740 -14.571 -5.243 . . . 1.0 . . . . . . . . . . . . A . 35 LEU H . . . . . . . . . c18126_2lr2 1 . 1 . 367 . 1 1 35 LEU HA H -0.135 -12.276 -5.239 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HA . . . . . . . . . c18126_2lr2 1 . 1 . 368 . 1 1 35 LEU HB2 H -0.900 -14.216 -2.957 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 369 . 1 1 35 LEU HB3 H -0.076 -12.695 -2.649 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 370 . 1 1 35 LEU HD11 H -3.174 -13.713 -1.754 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD11 . . . . . . . . . c18126_2lr2 1 . 1 . 371 . 1 1 35 LEU HD12 H -3.891 -12.117 -1.881 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD12 . . . . . . . . . c18126_2lr2 1 . 1 . 372 . 1 1 35 LEU HD13 H -2.342 -12.320 -1.046 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD13 . . . . . . . . . c18126_2lr2 1 . 1 . 373 . 1 1 35 LEU HD21 H -1.585 -10.677 -4.444 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 374 . 1 1 35 LEU HD22 H -1.376 -10.443 -2.721 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 375 . 1 1 35 LEU HD23 H -2.981 -10.375 -3.429 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD23 . . . . . . . . . c18126_2lr2 1 . 1 . 376 . 1 1 35 LEU HG H -2.836 -12.821 -4.050 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HG . . . . . . . . . c18126_2lr2 1 . 1 . 377 . 1 1 35 LEU N N -0.933 -14.170 -5.633 . . . 1.0 . . . . . . . . . . . . A . 35 LEU N . . . . . . . . . c18126_2lr2 1 . 1 . 378 . 1 1 35 LEU O O 1.649 -14.871 -4.339 . . . 1.0 . . . . . . . . . . . . A . 35 LEU O . . . . . . . . . c18126_2lr2 1 . 1 . 379 . 1 1 36 ASN C C 3.890 -11.873 -3.366 . . . 1.0 . . . . . . . . . . . . A . 36 ASN C . . . . . . . . . c18126_2lr2 1 . 1 . 380 . 1 1 36 ASN CA C 3.714 -12.821 -4.562 . . . 1.0 . . . . . . . . . . . . A . 36 ASN CA . . . . . . . . . c18126_2lr2 1 . 1 . 381 . 1 1 36 ASN CB C 4.528 -12.388 -5.836 . . . 1.0 . . . . . . . . . . . . A . 36 ASN CB . . . . . . . . . c18126_2lr2 1 . 1 . 382 . 1 1 36 ASN CG C 6.055 -12.590 -5.640 . . . 1.0 . . . . . . . . . . . . A . 36 ASN CG . . . . . . . . . c18126_2lr2 1 . 1 . 383 . 1 1 36 ASN H H 1.904 -11.800 -4.942 . . . 1.0 . . . . . . . . . . . . A . 36 ASN H . . . . . . . . . c18126_2lr2 1 . 1 . 384 . 1 1 36 ASN HA H 3.969 -13.845 -4.273 . . . 1.0 . . . . . . . . . . . . A . 36 ASN HA . . . . . . . . . c18126_2lr2 1 . 1 . 385 . 1 1 36 ASN HB2 H 4.205 -12.983 -6.682 . . . 1.0 . . . . . . . . . . . . A . 36 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 386 . 1 1 36 ASN HB3 H 4.335 -11.358 -6.070 . . . 1.0 . . . . . . . . . . . . A . 36 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 387 . 1 1 36 ASN HD21 H 6.479 -12.419 -7.570 . . . 1.0 . . . . . . . . . . . . A . 36 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 388 . 1 1 36 ASN HD22 H 7.813 -12.690 -6.557 . . . 1.0 . . . . . . . . . . . . A . 36 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 389 . 1 1 36 ASN N N 2.259 -12.696 -4.783 . . . 1.0 . . . . . . . . . . . . A . 36 ASN N . . . . . . . . . c18126_2lr2 1 . 1 . 390 . 1 1 36 ASN ND2 N 6.847 -12.565 -6.676 . . . 1.0 . . . . . . . . . . . . A . 36 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 1 . 391 . 1 1 36 ASN O O 3.484 -10.697 -3.431 . . . 1.0 . . . . . . . . . . . . A . 36 ASN O . . . . . . . . . c18126_2lr2 1 . 1 . 392 . 1 1 36 ASN OD1 O 6.538 -12.771 -4.516 . . . 1.0 . . . . . . . . . . . . A . 36 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 393 . 1 1 37 GLU C C 5.471 -10.631 -1.025 . . . 1.0 . . . . . . . . . . . . A . 37 GLU C . . . . . . . . . c18126_2lr2 1 . 1 . 394 . 1 1 37 GLU CA C 4.417 -11.733 -0.977 . . . 1.0 . . . . . . . . . . . . A . 37 GLU CA . . . . . . . . . c18126_2lr2 1 . 1 . 395 . 1 1 37 GLU CB C 4.749 -12.763 0.186 . . . 1.0 . . . . . . . . . . . . A . 37 GLU CB . . . . . . . . . c18126_2lr2 1 . 1 . 396 . 1 1 37 GLU CD C 3.571 -14.996 -0.576 . . . 1.0 . . . . . . . . . . . . A . 37 GLU CD . . . . . . . . . c18126_2lr2 1 . 1 . 397 . 1 1 37 GLU CG C 3.571 -13.811 0.436 . . . 1.0 . . . . . . . . . . . . A . 37 GLU CG . . . . . . . . . c18126_2lr2 1 . 1 . 398 . 1 1 37 GLU H H 4.581 -13.390 -2.287 . . . 1.0 . . . . . . . . . . . . A . 37 GLU H . . . . . . . . . c18126_2lr2 1 . 1 . 399 . 1 1 37 GLU HA H 3.454 -11.288 -0.774 . . . 1.0 . . . . . . . . . . . . A . 37 GLU HA . . . . . . . . . c18126_2lr2 1 . 1 . 400 . 1 1 37 GLU HB2 H 5.669 -13.306 -0.063 . . . 1.0 . . . . . . . . . . . . A . 37 GLU HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 401 . 1 1 37 GLU HB3 H 4.940 -12.223 1.116 . . . 1.0 . . . . . . . . . . . . A . 37 GLU HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 402 . 1 1 37 GLU HG2 H 3.655 -14.206 1.437 . . . 1.0 . . . . . . . . . . . . A . 37 GLU HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 403 . 1 1 37 GLU HG3 H 2.604 -13.303 0.362 . . . 1.0 . . . . . . . . . . . . A . 37 GLU HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 404 . 1 1 37 GLU N N 4.354 -12.438 -2.252 . . . 1.0 . . . . . . . . . . . . A . 37 GLU N . . . . . . . . . c18126_2lr2 1 . 1 . 405 . 1 1 37 GLU O O 5.219 -9.500 -0.609 . . . 1.0 . . . . . . . . . . . . A . 37 GLU O . . . . . . . . . c18126_2lr2 1 . 1 . 406 . 1 1 37 GLU OE1 O 4.382 -15.006 -1.493 . . . 1.0 . . . . . . . . . . . . A . 37 GLU OE1 . . . . . . . . . c18126_2lr2 1 . 1 . 407 . 1 1 37 GLU OE2 O 2.780 -15.908 -0.385 . . . 1.0 . . . . . . . . . . . . A . 37 GLU OE2 . . . . . . . . . c18126_2lr2 1 . 1 . 408 . 1 1 38 GLU C C 7.280 -8.760 -2.394 . . . 1.0 . . . . . . . . . . . . A . 38 GLU C . . . . . . . . . c18126_2lr2 1 . 1 . 409 . 1 1 38 GLU CA C 7.736 -10.000 -1.632 . . . 1.0 . . . . . . . . . . . . A . 38 GLU CA . . . . . . . . . c18126_2lr2 1 . 1 . 410 . 1 1 38 GLU CB C 8.977 -10.662 -2.366 . . . 1.0 . . . . . . . . . . . . A . 38 GLU CB . . . . . . . . . c18126_2lr2 1 . 1 . 411 . 1 1 38 GLU CD C 10.817 -12.526 -2.247 . . . 1.0 . . . . . . . . . . . . A . 38 GLU CD . . . . . . . . . c18126_2lr2 1 . 1 . 412 . 1 1 38 GLU CG C 9.645 -11.822 -1.500 . . . 1.0 . . . . . . . . . . . . A . 38 GLU CG . . . . . . . . . c18126_2lr2 1 . 1 . 413 . 1 1 38 GLU H H 6.794 -11.886 -1.850 . . . 1.0 . . . . . . . . . . . . A . 38 GLU H . . . . . . . . . c18126_2lr2 1 . 1 . 414 . 1 1 38 GLU HA H 8.036 -9.709 -0.636 . . . 1.0 . . . . . . . . . . . . A . 38 GLU HA . . . . . . . . . c18126_2lr2 1 . 1 . 415 . 1 1 38 GLU HB2 H 8.642 -11.074 -3.321 . . . 1.0 . . . . . . . . . . . . A . 38 GLU HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 416 . 1 1 38 GLU HB3 H 9.728 -9.893 -2.573 . . . 1.0 . . . . . . . . . . . . A . 38 GLU HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 417 . 1 1 38 GLU HG2 H 10.034 -11.412 -0.570 . . . 1.0 . . . . . . . . . . . . A . 38 GLU HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 418 . 1 1 38 GLU HG3 H 8.894 -12.573 -1.256 . . . 1.0 . . . . . . . . . . . . A . 38 GLU HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 419 . 1 1 38 GLU N N 6.651 -10.970 -1.534 . . . 1.0 . . . . . . . . . . . . A . 38 GLU N . . . . . . . . . c18126_2lr2 1 . 1 . 420 . 1 1 38 GLU O O 7.590 -7.633 -2.007 . . . 1.0 . . . . . . . . . . . . A . 38 GLU O . . . . . . . . . c18126_2lr2 1 . 1 . 421 . 1 1 38 GLU OE1 O 11.132 -12.133 -3.363 . . . 1.0 . . . . . . . . . . . . A . 38 GLU OE1 . . . . . . . . . c18126_2lr2 1 . 1 . 422 . 1 1 38 GLU OE2 O 11.385 -13.450 -1.679 . . . 1.0 . . . . . . . . . . . . A . 38 GLU OE2 . . . . . . . . . c18126_2lr2 1 . 1 . 423 . 1 1 39 GLN C C 4.981 -7.086 -3.530 . . . 1.0 . . . . . . . . . . . . A . 39 GLN C . . . . . . . . . c18126_2lr2 1 . 1 . 424 . 1 1 39 GLN CA C 6.049 -7.868 -4.287 . . . 1.0 . . . . . . . . . . . . A . 39 GLN CA . . . . . . . . . c18126_2lr2 1 . 1 . 425 . 1 1 39 GLN CB C 5.479 -8.416 -5.652 . . . 1.0 . . . . . . . . . . . . A . 39 GLN CB . . . . . . . . . c18126_2lr2 1 . 1 . 426 . 1 1 39 GLN CD C 6.042 -9.581 -7.923 . . . 1.0 . . . . . . . . . . . . A . 39 GLN CD . . . . . . . . . c18126_2lr2 1 . 1 . 427 . 1 1 39 GLN CG C 6.617 -9.000 -6.600 . . . 1.0 . . . . . . . . . . . . A . 39 GLN CG . . . . . . . . . c18126_2lr2 1 . 1 . 428 . 1 1 39 GLN H H 6.327 -9.896 -3.739 . . . 1.0 . . . . . . . . . . . . A . 39 GLN H . . . . . . . . . c18126_2lr2 1 . 1 . 429 . 1 1 39 GLN HA H 6.872 -7.207 -4.515 . . . 1.0 . . . . . . . . . . . . A . 39 GLN HA . . . . . . . . . c18126_2lr2 1 . 1 . 430 . 1 1 39 GLN HB2 H 4.748 -9.184 -5.438 . . . 1.0 . . . . . . . . . . . . A . 39 GLN HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 431 . 1 1 39 GLN HB3 H 4.972 -7.631 -6.163 . . . 1.0 . . . . . . . . . . . . A . 39 GLN HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 432 . 1 1 39 GLN HE21 H 7.803 -10.234 -8.577 . . . 1.0 . . . . . . . . . . . . A . 39 GLN HE21 . . . . . . . . . c18126_2lr2 1 . 1 . 433 . 1 1 39 GLN HE22 H 6.488 -10.525 -9.610 . . . 1.0 . . . . . . . . . . . . A . 39 GLN HE22 . . . . . . . . . c18126_2lr2 1 . 1 . 434 . 1 1 39 GLN HG2 H 7.324 -8.213 -6.859 . . . 1.0 . . . . . . . . . . . . A . 39 GLN HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 435 . 1 1 39 GLN HG3 H 7.155 -9.787 -6.079 . . . 1.0 . . . . . . . . . . . . A . 39 GLN HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 436 . 1 1 39 GLN N N 6.543 -8.976 -3.478 . . . 1.0 . . . . . . . . . . . . A . 39 GLN N . . . . . . . . . c18126_2lr2 1 . 1 . 437 . 1 1 39 GLN NE2 N 6.845 -10.162 -8.775 . . . 1.0 . . . . . . . . . . . . A . 39 GLN NE2 . . . . . . . . . c18126_2lr2 1 . 1 . 438 . 1 1 39 GLN O O 5.071 -5.866 -3.393 . . . 1.0 . . . . . . . . . . . . A . 39 GLN O . . . . . . . . . c18126_2lr2 1 . 1 . 439 . 1 1 39 GLN OE1 O 4.841 -9.482 -8.194 . . . 1.0 . . . . . . . . . . . . A . 39 GLN OE1 . . . . . . . . . c18126_2lr2 1 . 1 . 440 . 1 1 40 ARG C C 3.449 -6.204 -1.250 . . . 1.0 . . . . . . . . . . . . A . 40 ARG C . . . . . . . . . c18126_2lr2 1 . 1 . 441 . 1 1 40 ARG CA C 2.888 -7.158 -2.300 . . . 1.0 . . . . . . . . . . . . A . 40 ARG CA . . . . . . . . . c18126_2lr2 1 . 1 . 442 . 1 1 40 ARG CB C 2.003 -8.294 -1.613 . . . 1.0 . . . . . . . . . . . . A . 40 ARG CB . . . . . . . . . c18126_2lr2 1 . 1 . 443 . 1 1 40 ARG CD C -0.144 -8.873 -0.195 . . . 1.0 . . . . . . . . . . . . A . 40 ARG CD . . . . . . . . . c18126_2lr2 1 . 1 . 444 . 1 1 40 ARG CG C 0.737 -7.729 -0.832 . . . 1.0 . . . . . . . . . . . . A . 40 ARG CG . . . . . . . . . c18126_2lr2 1 . 1 . 445 . 1 1 40 ARG CZ C 0.676 -9.253 2.148 . . . 1.0 . . . . . . . . . . . . A . 40 ARG CZ . . . . . . . . . c18126_2lr2 1 . 1 . 446 . 1 1 40 ARG H H 3.950 -8.766 -3.182 . . . 1.0 . . . . . . . . . . . . A . 40 ARG H . . . . . . . . . c18126_2lr2 1 . 1 . 447 . 1 1 40 ARG HA H 2.273 -6.599 -2.988 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HA . . . . . . . . . c18126_2lr2 1 . 1 . 448 . 1 1 40 ARG HB2 H 1.670 -8.989 -2.380 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 449 . 1 1 40 ARG HB3 H 2.628 -8.845 -0.915 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 450 . 1 1 40 ARG HD2 H -1.051 -8.450 0.233 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HD2 . . . . . . . . . c18126_2lr2 1 . 1 . 451 . 1 1 40 ARG HD3 H -0.445 -9.567 -0.951 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HD3 . . . . . . . . . c18126_2lr2 1 . 1 . 452 . 1 1 40 ARG HE H 1.111 -10.418 0.567 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HE . . . . . . . . . c18126_2lr2 1 . 1 . 453 . 1 1 40 ARG HG2 H 1.102 -7.113 -0.036 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 454 . 1 1 40 ARG HG3 H 0.118 -7.112 -1.491 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 455 . 1 1 40 ARG HH11 H -0.477 -7.626 1.950 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HH11 . . . . . . . . . c18126_2lr2 1 . 1 . 456 . 1 1 40 ARG HH12 H 0.106 -7.937 3.548 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HH12 . . . . . . . . . c18126_2lr2 1 . 1 . 457 . 1 1 40 ARG HH21 H 1.860 -10.782 2.662 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HH21 . . . . . . . . . c18126_2lr2 1 . 1 . 458 . 1 1 40 ARG HH22 H 1.419 -9.708 3.947 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HH22 . . . . . . . . . c18126_2lr2 1 . 1 . 459 . 1 1 40 ARG N N 3.970 -7.797 -3.042 . . . 1.0 . . . . . . . . . . . . A . 40 ARG N . . . . . . . . . c18126_2lr2 1 . 1 . 460 . 1 1 40 ARG NE N 0.617 -9.616 0.847 . . . 1.0 . . . . . . . . . . . . A . 40 ARG NE . . . . . . . . . c18126_2lr2 1 . 1 . 461 . 1 1 40 ARG NH1 N 0.052 -8.190 2.584 . . . 1.0 . . . . . . . . . . . . A . 40 ARG NH1 . . . . . . . . . c18126_2lr2 1 . 1 . 462 . 1 1 40 ARG NH2 N 1.372 -9.971 2.984 . . . 1.0 . . . . . . . . . . . . A . 40 ARG NH2 . . . . . . . . . c18126_2lr2 1 . 1 . 463 . 1 1 40 ARG O O 3.074 -5.033 -1.198 . . . 1.0 . . . . . . . . . . . . A . 40 ARG O . . . . . . . . . c18126_2lr2 1 . 1 . 464 . 1 1 41 ASN C C 5.594 -4.647 0.030 . . . 1.0 . . . . . . . . . . . . A . 41 ASN C . . . . . . . . . c18126_2lr2 1 . 1 . 465 . 1 1 41 ASN CA C 4.957 -5.896 0.629 . . . 1.0 . . . . . . . . . . . . A . 41 ASN CA . . . . . . . . . c18126_2lr2 1 . 1 . 466 . 1 1 41 ASN CB C 6.031 -6.756 1.420 . . . 1.0 . . . . . . . . . . . . A . 41 ASN CB . . . . . . . . . c18126_2lr2 1 . 1 . 467 . 1 1 41 ASN CG C 6.289 -6.199 2.845 . . . 1.0 . . . . . . . . . . . . A . 41 ASN CG . . . . . . . . . c18126_2lr2 1 . 1 . 468 . 1 1 41 ASN H H 4.612 -7.653 -0.505 . . . 1.0 . . . . . . . . . . . . A . 41 ASN H . . . . . . . . . c18126_2lr2 1 . 1 . 469 . 1 1 41 ASN HA H 4.191 -5.598 1.329 . . . 1.0 . . . . . . . . . . . . A . 41 ASN HA . . . . . . . . . c18126_2lr2 1 . 1 . 470 . 1 1 41 ASN HB2 H 5.676 -7.770 1.514 . . . 1.0 . . . . . . . . . . . . A . 41 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 471 . 1 1 41 ASN HB3 H 6.968 -6.783 0.872 . . . 1.0 . . . . . . . . . . . . A . 41 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 472 . 1 1 41 ASN HD21 H 8.233 -6.593 2.820 . . . 1.0 . . . . . . . . . . . . A . 41 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 473 . 1 1 41 ASN HD22 H 7.656 -5.865 4.241 . . . 1.0 . . . . . . . . . . . . A . 41 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 474 . 1 1 41 ASN N N 4.350 -6.713 -0.416 . . . 1.0 . . . . . . . . . . . . A . 41 ASN N . . . . . . . . . c18126_2lr2 1 . 1 . 475 . 1 1 41 ASN ND2 N 7.492 -6.226 3.345 . . . 1.0 . . . . . . . . . . . . A . 41 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 1 . 476 . 1 1 41 ASN O O 5.144 -3.529 0.278 . . . 1.0 . . . . . . . . . . . . A . 41 ASN O . . . . . . . . . c18126_2lr2 1 . 1 . 477 . 1 1 41 ASN OD1 O 5.367 -5.731 3.522 . . . 1.0 . . . . . . . . . . . . A . 41 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 478 . 1 1 42 ALA C C 6.341 -2.652 -1.817 . . . 1.0 . . . . . . . . . . . . A . 42 ALA C . . . . . . . . . c18126_2lr2 1 . 1 . 479 . 1 1 42 ALA CA C 7.336 -3.726 -1.389 . . . 1.0 . . . . . . . . . . . . A . 42 ALA CA . . . . . . . . . c18126_2lr2 1 . 1 . 480 . 1 1 42 ALA CB C 8.159 -4.243 -2.625 . . . 1.0 . . . . . . . . . . . . A . 42 ALA CB . . . . . . . . . c18126_2lr2 1 . 1 . 481 . 1 1 42 ALA H H 6.959 -5.759 -0.923 . . . 1.0 . . . . . . . . . . . . A . 42 ALA H . . . . . . . . . c18126_2lr2 1 . 1 . 482 . 1 1 42 ALA HA H 8.029 -3.299 -0.680 . . . 1.0 . . . . . . . . . . . . A . 42 ALA HA . . . . . . . . . c18126_2lr2 1 . 1 . 483 . 1 1 42 ALA HB1 H 7.492 -4.654 -3.375 . . . 1.0 . . . . . . . . . . . . A . 42 ALA HB1 . . . . . . . . . c18126_2lr2 1 . 1 . 484 . 1 1 42 ALA HB2 H 8.850 -5.020 -2.310 . . . 1.0 . . . . . . . . . . . . A . 42 ALA HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 485 . 1 1 42 ALA HB3 H 8.729 -3.432 -3.070 . . . 1.0 . . . . . . . . . . . . A . 42 ALA HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 486 . 1 1 42 ALA N N 6.645 -4.845 -0.760 . . . 1.0 . . . . . . . . . . . . A . 42 ALA N . . . . . . . . . c18126_2lr2 1 . 1 . 487 . 1 1 42 ALA O O 6.518 -1.472 -1.515 . . . 1.0 . . . . . . . . . . . . A . 42 ALA O . . . . . . . . . c18126_2lr2 1 . 1 . 488 . 1 1 43 PHE C C 3.473 -1.589 -1.808 . . . 1.0 . . . . . . . . . . . . A . 43 PHE C . . . . . . . . . c18126_2lr2 1 . 1 . 489 . 1 1 43 PHE CA C 4.276 -2.135 -2.985 . . . 1.0 . . . . . . . . . . . . A . 43 PHE CA . . . . . . . . . c18126_2lr2 1 . 1 . 490 . 1 1 43 PHE CB C 3.347 -2.876 -4.022 . . . 1.0 . . . . . . . . . . . . A . 43 PHE CB . . . . . . . . . c18126_2lr2 1 . 1 . 491 . 1 1 43 PHE CD1 C 5.549 -3.272 -5.422 . . . 1.0 . . . . . . . . . . . . A . 43 PHE CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 492 . 1 1 43 PHE CD2 C 3.539 -4.569 -5.973 . . . 1.0 . . . . . . . . . . . . A . 43 PHE CD2 . . . . . . . . . c18126_2lr2 1 . 1 . 493 . 1 1 43 PHE CE1 C 6.262 -3.967 -6.374 . . . 1.0 . . . . . . . . . . . . A . 43 PHE CE1 . . . . . . . . . c18126_2lr2 1 . 1 . 494 . 1 1 43 PHE CE2 C 4.274 -5.231 -6.958 . . . 1.0 . . . . . . . . . . . . A . 43 PHE CE2 . . . . . . . . . c18126_2lr2 1 . 1 . 495 . 1 1 43 PHE CG C 4.162 -3.562 -5.183 . . . 1.0 . . . . . . . . . . . . A . 43 PHE CG . . . . . . . . . c18126_2lr2 1 . 1 . 496 . 1 1 43 PHE CZ C 5.635 -4.937 -7.140 . . . 1.0 . . . . . . . . . . . . A . 43 PHE CZ . . . . . . . . . c18126_2lr2 1 . 1 . 497 . 1 1 43 PHE H H 5.205 -4.023 -2.732 . . . 1.0 . . . . . . . . . . . . A . 43 PHE H . . . . . . . . . c18126_2lr2 1 . 1 . 498 . 1 1 43 PHE HA H 4.759 -1.313 -3.491 . . . 1.0 . . . . . . . . . . . . A . 43 PHE HA . . . . . . . . . c18126_2lr2 1 . 1 . 499 . 1 1 43 PHE HB2 H 2.704 -3.596 -3.518 . . . 1.0 . . . . . . . . . . . . A . 43 PHE HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 500 . 1 1 43 PHE HB3 H 2.723 -2.154 -4.475 . . . 1.0 . . . . . . . . . . . . A . 43 PHE HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 501 . 1 1 43 PHE HD1 H 6.064 -2.506 -4.872 . . . 1.0 . . . . . . . . . . . . A . 43 PHE HD1 . . . . . . . . . c18126_2lr2 1 . 1 . 502 . 1 1 43 PHE HD2 H 2.483 -4.799 -5.844 . . . 1.0 . . . . . . . . . . . . A . 43 PHE HD2 . . . . . . . . . c18126_2lr2 1 . 1 . 503 . 1 1 43 PHE HE1 H 7.315 -3.732 -6.536 . . . 1.0 . . . . . . . . . . . . A . 43 PHE HE1 . . . . . . . . . c18126_2lr2 1 . 1 . 504 . 1 1 43 PHE HE2 H 3.793 -5.978 -7.585 . . . 1.0 . . . . . . . . . . . . A . 43 PHE HE2 . . . . . . . . . c18126_2lr2 1 . 1 . 505 . 1 1 43 PHE HZ H 6.211 -5.496 -7.847 . . . 1.0 . . . . . . . . . . . . A . 43 PHE HZ . . . . . . . . . c18126_2lr2 1 . 1 . 506 . 1 1 43 PHE N N 5.294 -3.070 -2.521 . . . 1.0 . . . . . . . . . . . . A . 43 PHE N . . . . . . . . . c18126_2lr2 1 . 1 . 507 . 1 1 43 PHE O O 3.235 -0.386 -1.712 . . . 1.0 . . . . . . . . . . . . A . 43 PHE O . . . . . . . . . c18126_2lr2 1 . 1 . 508 . 1 1 44 ILE C C 3.081 -1.106 1.114 . . . 1.0 . . . . . . . . . . . . A . 44 ILE C . . . . . . . . . c18126_2lr2 1 . 1 . 509 . 1 1 44 ILE CA C 2.284 -2.079 0.252 . . . 1.0 . . . . . . . . . . . . A . 44 ILE CA . . . . . . . . . c18126_2lr2 1 . 1 . 510 . 1 1 44 ILE CB C 1.812 -3.363 1.129 . . . 1.0 . . . . . . . . . . . . A . 44 ILE CB . . . . . . . . . c18126_2lr2 1 . 1 . 511 . 1 1 44 ILE CD1 C -0.164 -5.116 1.436 . . . 1.0 . . . . . . . . . . . . A . 44 ILE CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 512 . 1 1 44 ILE CG1 C 0.512 -4.078 0.477 . . . 1.0 . . . . . . . . . . . . A . 44 ILE CG1 . . . . . . . . . c18126_2lr2 1 . 1 . 513 . 1 1 44 ILE CG2 C 1.601 -3.052 2.679 . . . 1.0 . . . . . . . . . . . . A . 44 ILE CG2 . . . . . . . . . c18126_2lr2 1 . 1 . 514 . 1 1 44 ILE H H 3.279 -3.429 -1.044 . . . 1.0 . . . . . . . . . . . . A . 44 ILE H . . . . . . . . . c18126_2lr2 1 . 1 . 515 . 1 1 44 ILE HA H 1.379 -1.594 -0.080 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HA . . . . . . . . . c18126_2lr2 1 . 1 . 516 . 1 1 44 ILE HB H 2.620 -4.065 1.086 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HB . . . . . . . . . c18126_2lr2 1 . 1 . 517 . 1 1 44 ILE HD11 H -0.842 -5.737 0.873 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HD11 . . . . . . . . . c18126_2lr2 1 . 1 . 518 . 1 1 44 ILE HD12 H -0.728 -4.588 2.195 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HD12 . . . . . . . . . c18126_2lr2 1 . 1 . 519 . 1 1 44 ILE HD13 H 0.581 -5.743 1.920 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HD13 . . . . . . . . . c18126_2lr2 1 . 1 . 520 . 1 1 44 ILE HG12 H -0.235 -3.340 0.229 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HG12 . . . . . . . . . c18126_2lr2 1 . 1 . 521 . 1 1 44 ILE HG13 H 0.792 -4.582 -0.439 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HG13 . . . . . . . . . c18126_2lr2 1 . 1 . 522 . 1 1 44 ILE HG21 H 2.546 -2.832 3.156 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HG21 . . . . . . . . . c18126_2lr2 1 . 1 . 523 . 1 1 44 ILE HG22 H 1.175 -3.911 3.190 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HG22 . . . . . . . . . c18126_2lr2 1 . 1 . 524 . 1 1 44 ILE HG23 H 0.943 -2.218 2.803 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HG23 . . . . . . . . . c18126_2lr2 1 . 1 . 525 . 1 1 44 ILE N N 3.060 -2.483 -0.916 . . . 1.0 . . . . . . . . . . . . A . 44 ILE N . . . . . . . . . c18126_2lr2 1 . 1 . 526 . 1 1 44 ILE O O 2.530 -0.150 1.660 . . . 1.0 . . . . . . . . . . . . A . 44 ILE O . . . . . . . . . c18126_2lr2 1 . 1 . 527 . 1 1 45 GLN C C 5.277 0.917 1.453 . . . 1.0 . . . . . . . . . . . . A . 45 GLN C . . . . . . . . . c18126_2lr2 1 . 1 . 528 . 1 1 45 GLN CA C 5.245 -0.494 2.031 . . . 1.0 . . . . . . . . . . . . A . 45 GLN CA . . . . . . . . . c18126_2lr2 1 . 1 . 529 . 1 1 45 GLN CB C 6.724 -1.093 2.095 . . . 1.0 . . . . . . . . . . . . A . 45 GLN CB . . . . . . . . . c18126_2lr2 1 . 1 . 530 . 1 1 45 GLN CD C 8.243 -3.033 2.929 . . . 1.0 . . . . . . . . . . . . A . 45 GLN CD . . . . . . . . . c18126_2lr2 1 . 1 . 531 . 1 1 45 GLN CG C 6.812 -2.427 2.956 . . . 1.0 . . . . . . . . . . . . A . 45 GLN CG . . . . . . . . . c18126_2lr2 1 . 1 . 532 . 1 1 45 GLN H H 4.766 -2.132 0.774 . . . 1.0 . . . . . . . . . . . . A . 45 GLN H . . . . . . . . . c18126_2lr2 1 . 1 . 533 . 1 1 45 GLN HA H 4.862 -0.452 3.039 . . . 1.0 . . . . . . . . . . . . A . 45 GLN HA . . . . . . . . . c18126_2lr2 1 . 1 . 534 . 1 1 45 GLN HB2 H 7.058 -1.308 1.081 . . . 1.0 . . . . . . . . . . . . A . 45 GLN HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 535 . 1 1 45 GLN HB3 H 7.403 -0.349 2.519 . . . 1.0 . . . . . . . . . . . . A . 45 GLN HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 536 . 1 1 45 GLN HE21 H 8.544 -2.841 4.883 . . . 1.0 . . . . . . . . . . . . A . 45 GLN HE21 . . . . . . . . . c18126_2lr2 1 . 1 . 537 . 1 1 45 GLN HE22 H 9.833 -3.529 4.021 . . . 1.0 . . . . . . . . . . . . A . 45 GLN HE22 . . . . . . . . . c18126_2lr2 1 . 1 . 538 . 1 1 45 GLN HG2 H 6.551 -2.211 3.988 . . . 1.0 . . . . . . . . . . . . A . 45 GLN HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 539 . 1 1 45 GLN HG3 H 6.117 -3.163 2.583 . . . 1.0 . . . . . . . . . . . . A . 45 GLN HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 540 . 1 1 45 GLN N N 4.381 -1.356 1.232 . . . 1.0 . . . . . . . . . . . . A . 45 GLN N . . . . . . . . . c18126_2lr2 1 . 1 . 541 . 1 1 45 GLN NE2 N 8.931 -3.144 4.038 . . . 1.0 . . . . . . . . . . . . A . 45 GLN NE2 . . . . . . . . . c18126_2lr2 1 . 1 . 542 . 1 1 45 GLN O O 5.015 1.892 2.157 . . . 1.0 . . . . . . . . . . . . A . 45 GLN O . . . . . . . . . c18126_2lr2 1 . 1 . 543 . 1 1 45 GLN OE1 O 8.736 -3.421 1.870 . . . 1.0 . . . . . . . . . . . . A . 45 GLN OE1 . . . . . . . . . c18126_2lr2 1 . 1 . 544 . 1 1 46 SER C C 4.392 3.118 -0.222 . . . 1.0 . . . . . . . . . . . . A . 46 SER C . . . . . . . . . c18126_2lr2 1 . 1 . 545 . 1 1 46 SER CA C 5.660 2.315 -0.495 . . . 1.0 . . . . . . . . . . . . A . 46 SER CA . . . . . . . . . c18126_2lr2 1 . 1 . 546 . 1 1 46 SER CB C 5.883 2.093 -2.022 . . . 1.0 . . . . . . . . . . . . A . 46 SER CB . . . . . . . . . c18126_2lr2 1 . 1 . 547 . 1 1 46 SER H H 5.796 0.206 -0.345 . . . 1.0 . . . . . . . . . . . . A . 46 SER H . . . . . . . . . c18126_2lr2 1 . 1 . 548 . 1 1 46 SER HA H 6.510 2.862 -0.115 . . . 1.0 . . . . . . . . . . . . A . 46 SER HA . . . . . . . . . c18126_2lr2 1 . 1 . 549 . 1 1 46 SER HB2 H 5.146 1.419 -2.407 . . . 1.0 . . . . . . . . . . . . A . 46 SER HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 550 . 1 1 46 SER HB3 H 5.824 3.037 -2.569 . . . 1.0 . . . . . . . . . . . . A . 46 SER HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 551 . 1 1 46 SER HG H 7.262 1.295 -3.144 . . . 1.0 . . . . . . . . . . . . A . 46 SER HG . . . . . . . . . c18126_2lr2 1 . 1 . 552 . 1 1 46 SER N N 5.598 1.018 0.167 . . . 1.0 . . . . . . . . . . . . A . 46 SER N . . . . . . . . . c18126_2lr2 1 . 1 . 553 . 1 1 46 SER O O 4.434 4.343 -0.110 . . . 1.0 . . . . . . . . . . . . A . 46 SER O . . . . . . . . . c18126_2lr2 1 . 1 . 554 . 1 1 46 SER OG O 7.166 1.507 -2.217 . . . 1.0 . . . . . . . . . . . . A . 46 SER OG . . . . . . . . . c18126_2lr2 1 . 1 . 555 . 1 1 47 LEU C C 1.967 3.660 1.553 . . . 1.0 . . . . . . . . . . . . A . 47 LEU C . . . . . . . . . c18126_2lr2 1 . 1 . 556 . 1 1 47 LEU CA C 1.992 3.078 0.143 . . . 1.0 . . . . . . . . . . . . A . 47 LEU CA . . . . . . . . . c18126_2lr2 1 . 1 . 557 . 1 1 47 LEU CB C 0.856 2.017 -0.059 . . . 1.0 . . . . . . . . . . . . A . 47 LEU CB . . . . . . . . . c18126_2lr2 1 . 1 . 558 . 1 1 47 LEU CD1 C -0.176 0.332 -1.770 . . . 1.0 . . . . . . . . . . . . A . 47 LEU CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 559 . 1 1 47 LEU CD2 C 0.203 2.775 -2.446 . . . 1.0 . . . . . . . . . . . . A . 47 LEU CD2 . . . . . . . . . c18126_2lr2 1 . 1 . 560 . 1 1 47 LEU CG C 0.732 1.584 -1.588 . . . 1.0 . . . . . . . . . . . . A . 47 LEU CG . . . . . . . . . c18126_2lr2 1 . 1 . 561 . 1 1 47 LEU H H 3.294 1.445 -0.215 . . . 1.0 . . . . . . . . . . . . A . 47 LEU H . . . . . . . . . c18126_2lr2 1 . 1 . 562 . 1 1 47 LEU HA H 1.859 3.878 -0.569 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HA . . . . . . . . . c18126_2lr2 1 . 1 . 563 . 1 1 47 LEU HB2 H 1.097 1.152 0.538 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 564 . 1 1 47 LEU HB3 H -0.101 2.413 0.294 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 565 . 1 1 47 LEU HD11 H -0.608 0.029 -0.846 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HD11 . . . . . . . . . c18126_2lr2 1 . 1 . 566 . 1 1 47 LEU HD12 H 0.411 -0.477 -2.149 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HD12 . . . . . . . . . c18126_2lr2 1 . 1 . 567 . 1 1 47 LEU HD13 H -0.950 0.551 -2.461 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HD13 . . . . . . . . . c18126_2lr2 1 . 1 . 568 . 1 1 47 LEU HD21 H 1.048 3.341 -2.793 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 569 . 1 1 47 LEU HD22 H -0.416 3.403 -1.850 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 570 . 1 1 47 LEU HD23 H -0.365 2.433 -3.297 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HD23 . . . . . . . . . c18126_2lr2 1 . 1 . 571 . 1 1 47 LEU HG H 1.710 1.333 -1.959 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HG . . . . . . . . . c18126_2lr2 1 . 1 . 572 . 1 1 47 LEU N N 3.267 2.419 -0.117 . . . 1.0 . . . . . . . . . . . . A . 47 LEU N . . . . . . . . . c18126_2lr2 1 . 1 . 573 . 1 1 47 LEU O O 1.080 4.440 1.897 . . . 1.0 . . . . . . . . . . . . A . 47 LEU O . . . . . . . . . c18126_2lr2 1 . 1 . 574 . 1 1 48 LYS C C 4.138 4.803 3.869 . . . 1.0 . . . . . . . . . . . . A . 48 LYS C . . . . . . . . . c18126_2lr2 1 . 1 . 575 . 1 1 48 LYS CA C 3.027 3.765 3.735 . . . 1.0 . . . . . . . . . . . . A . 48 LYS CA . . . . . . . . . c18126_2lr2 1 . 1 . 576 . 1 1 48 LYS CB C 3.315 2.526 4.694 . . . 1.0 . . . . . . . . . . . . A . 48 LYS CB . . . . . . . . . c18126_2lr2 1 . 1 . 577 . 1 1 48 LYS CD C 3.698 1.694 7.188 . . . 1.0 . . . . . . . . . . . . A . 48 LYS CD . . . . . . . . . c18126_2lr2 1 . 1 . 578 . 1 1 48 LYS CE C 3.834 2.110 8.706 . . . 1.0 . . . . . . . . . . . . A . 48 LYS CE . . . . . . . . . c18126_2lr2 1 . 1 . 579 . 1 1 48 LYS CG C 3.447 2.941 6.240 . . . 1.0 . . . . . . . . . . . . A . 48 LYS CG . . . . . . . . . c18126_2lr2 1 . 1 . 580 . 1 1 48 LYS H H 3.627 2.651 2.035 . . . 1.0 . . . . . . . . . . . . A . 48 LYS H . . . . . . . . . c18126_2lr2 1 . 1 . 581 . 1 1 48 LYS HA H 2.086 4.223 4.000 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HA . . . . . . . . . c18126_2lr2 1 . 1 . 582 . 1 1 48 LYS HB2 H 2.478 1.823 4.587 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 583 . 1 1 48 LYS HB3 H 4.211 2.009 4.378 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 584 . 1 1 48 LYS HD2 H 2.888 1.011 7.078 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HD2 . . . . . . . . . c18126_2lr2 1 . 1 . 585 . 1 1 48 LYS HD3 H 4.611 1.175 6.886 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HD3 . . . . . . . . . c18126_2lr2 1 . 1 . 586 . 1 1 48 LYS HE2 H 4.679 2.759 8.834 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HE2 . . . . . . . . . c18126_2lr2 1 . 1 . 587 . 1 1 48 LYS HE3 H 2.934 2.631 9.049 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HE3 . . . . . . . . . c18126_2lr2 1 . 1 . 588 . 1 1 48 LYS HG2 H 4.296 3.618 6.353 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 589 . 1 1 48 LYS HG3 H 2.556 3.467 6.561 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 590 . 1 1 48 LYS HZ1 H 4.331 0.102 8.961 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HZ1 . . . . . . . . . c18126_2lr2 1 . 1 . 591 . 1 1 48 LYS HZ2 H 3.158 0.665 10.048 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HZ2 . . . . . . . . . c18126_2lr2 1 . 1 . 592 . 1 1 48 LYS HZ3 H 4.786 1.101 10.259 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HZ3 . . . . . . . . . c18126_2lr2 1 . 1 . 593 . 1 1 48 LYS N N 2.947 3.275 2.364 . . . 1.0 . . . . . . . . . . . . A . 48 LYS N . . . . . . . . . c18126_2lr2 1 . 1 . 594 . 1 1 48 LYS NZ N 4.042 0.901 9.557 . . . 1.0 . . . . . . . . . . . . A . 48 LYS NZ . . . . . . . . . c18126_2lr2 1 . 1 . 595 . 1 1 48 LYS O O 4.078 5.683 4.727 . . . 1.0 . . . . . . . . . . . . A . 48 LYS O . . . . . . . . . c18126_2lr2 1 . 1 . 596 . 1 1 49 ASP C C 6.641 6.854 3.271 . . . 1.0 . . . . . . . . . . . . A . 49 ASP C . . . . . . . . . c18126_2lr2 1 . 1 . 597 . 1 1 49 ASP CA C 6.571 5.298 3.420 . . . 1.0 . . . . . . . . . . . . A . 49 ASP CA . . . . . . . . . c18126_2lr2 1 . 1 . 598 . 1 1 49 ASP CB C 7.696 4.642 2.514 . . . 1.0 . . . . . . . . . . . . A . 49 ASP CB . . . . . . . . . c18126_2lr2 1 . 1 . 599 . 1 1 49 ASP CG C 8.054 3.190 2.958 . . . 1.0 . . . . . . . . . . . . A . 49 ASP CG . . . . . . . . . c18126_2lr2 1 . 1 . 600 . 1 1 49 ASP H H 5.311 3.767 2.594 . . . 1.0 . . . . . . . . . . . . A . 49 ASP H . . . . . . . . . c18126_2lr2 1 . 1 . 601 . 1 1 49 ASP HA H 6.807 5.096 4.427 . . . 1.0 . . . . . . . . . . . . A . 49 ASP HA . . . . . . . . . c18126_2lr2 1 . 1 . 602 . 1 1 49 ASP HB2 H 7.366 4.632 1.480 . . . 1.0 . . . . . . . . . . . . A . 49 ASP HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 603 . 1 1 49 ASP HB3 H 8.612 5.239 2.563 . . . 1.0 . . . . . . . . . . . . A . 49 ASP HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 604 . 1 1 49 ASP N N 5.274 4.572 3.157 . . . 1.0 . . . . . . . . . . . . A . 49 ASP N . . . . . . . . . c18126_2lr2 1 . 1 . 605 . 1 1 49 ASP O O 7.632 7.461 3.732 . . . 1.0 . . . . . . . . . . . . A . 49 ASP O . . . . . . . . . c18126_2lr2 1 . 1 . 606 . 1 1 49 ASP OD1 O 7.666 2.777 4.049 . . . 1.0 . . . . . . . . . . . . A . 49 ASP OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 607 . 1 1 49 ASP OD2 O 8.705 2.506 2.184 . . . 1.0 . . . . . . . . . . . . A . 49 ASP OD2 . . . . . . . . . c18126_2lr2 1 . 1 . 608 . 1 1 50 ASP C C 5.699 9.837 3.768 . . . 1.0 . . . . . . . . . . . . A . 50 ASP C . . . . . . . . . c18126_2lr2 1 . 1 . 609 . 1 1 50 ASP CA C 5.680 8.976 2.425 . . . 1.0 . . . . . . . . . . . . A . 50 ASP CA . . . . . . . . . c18126_2lr2 1 . 1 . 610 . 1 1 50 ASP CB C 4.427 9.348 1.595 . . . 1.0 . . . . . . . . . . . . A . 50 ASP CB . . . . . . . . . c18126_2lr2 1 . 1 . 611 . 1 1 50 ASP CG C 4.327 10.853 1.229 . . . 1.0 . . . . . . . . . . . . A . 50 ASP CG . . . . . . . . . c18126_2lr2 1 . 1 . 612 . 1 1 50 ASP H H 4.918 6.955 2.307 . . . 1.0 . . . . . . . . . . . . A . 50 ASP H . . . . . . . . . c18126_2lr2 1 . 1 . 613 . 1 1 50 ASP HA H 6.561 9.209 1.843 . . . 1.0 . . . . . . . . . . . . A . 50 ASP HA . . . . . . . . . c18126_2lr2 1 . 1 . 614 . 1 1 50 ASP HB2 H 4.450 8.780 0.680 . . . 1.0 . . . . . . . . . . . . A . 50 ASP HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 615 . 1 1 50 ASP HB3 H 3.549 9.068 2.161 . . . 1.0 . . . . . . . . . . . . A . 50 ASP HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 616 . 1 1 50 ASP N N 5.657 7.486 2.655 . . . 1.0 . . . . . . . . . . . . A . 50 ASP N . . . . . . . . . c18126_2lr2 1 . 1 . 617 . 1 1 50 ASP O O 6.468 10.791 3.857 . . . 1.0 . . . . . . . . . . . . A . 50 ASP O . . . . . . . . . c18126_2lr2 1 . 1 . 618 . 1 1 50 ASP OD1 O 5.142 11.627 1.698 . . . 1.0 . . . . . . . . . . . . A . 50 ASP OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 619 . 1 1 50 ASP OD2 O 3.421 11.208 0.488 . . . 1.0 . . . . . . . . . . . . A . 50 ASP OD2 . . . . . . . . . c18126_2lr2 1 . 1 . 620 . 1 1 51 SER C C 4.285 9.117 7.228 . . . 1.0 . . . . . . . . . . . . A . 51 SER C . . . . . . . . . c18126_2lr2 1 . 1 . 621 . 1 1 51 SER CA C 4.809 10.182 6.164 . . . 1.0 . . . . . . . . . . . . A . 51 SER CA . . . . . . . . . c18126_2lr2 1 . 1 . 622 . 1 1 51 SER CB C 3.877 11.430 6.074 . . . 1.0 . . . . . . . . . . . . A . 51 SER CB . . . . . . . . . c18126_2lr2 1 . 1 . 623 . 1 1 51 SER H H 4.323 8.677 4.675 . . . 1.0 . . . . . . . . . . . . A . 51 SER H . . . . . . . . . c18126_2lr2 1 . 1 . 624 . 1 1 51 SER HA H 5.829 10.492 6.437 . . . 1.0 . . . . . . . . . . . . A . 51 SER HA . . . . . . . . . c18126_2lr2 1 . 1 . 625 . 1 1 51 SER HB2 H 3.742 11.861 7.050 . . . 1.0 . . . . . . . . . . . . A . 51 SER HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 626 . 1 1 51 SER HB3 H 4.324 12.179 5.413 . . . 1.0 . . . . . . . . . . . . A . 51 SER HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 627 . 1 1 51 SER HG H 2.217 11.808 5.127 . . . 1.0 . . . . . . . . . . . . A . 51 SER HG . . . . . . . . . c18126_2lr2 1 . 1 . 628 . 1 1 51 SER N N 4.879 9.467 4.804 . . . 1.0 . . . . . . . . . . . . A . 51 SER N . . . . . . . . . c18126_2lr2 1 . 1 . 629 . 1 1 51 SER O O 3.783 8.123 6.778 . . . 1.0 . . . . . . . . . . . . A . 51 SER O . . . . . . . . . c18126_2lr2 1 . 1 . 630 . 1 1 51 SER OG O 2.614 11.040 5.545 . . . 1.0 . . . . . . . . . . . . A . 51 SER OG . . . . . . . . . c18126_2lr2 1 . 1 . 631 . 1 1 52 TYR C C 3.196 8.400 10.969 . . . 1.0 . . . . . . . . . . . . A . 52 TYR C . . . . . . . . . c18126_2lr2 1 . 1 . 632 . 1 1 52 TYR CA C 4.088 8.106 9.604 . . . 1.0 . . . . . . . . . . . . A . 52 TYR CA . . . . . . . . . c18126_2lr2 1 . 1 . 633 . 1 1 52 TYR CB C 5.510 7.632 10.101 . . . 1.0 . . . . . . . . . . . . A . 52 TYR CB . . . . . . . . . c18126_2lr2 1 . 1 . 634 . 1 1 52 TYR CD1 C 6.370 5.775 8.486 . . . 1.0 . . . . . . . . . . . . A . 52 TYR CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 635 . 1 1 52 TYR CD2 C 7.275 8.033 8.216 . . . 1.0 . . . . . . . . . . . . A . 52 TYR CD2 . . . . . . . . . c18126_2lr2 1 . 1 . 636 . 1 1 52 TYR CE1 C 7.188 5.344 7.417 . . . 1.0 . . . . . . . . . . . . A . 52 TYR CE1 . . . . . . . . . c18126_2lr2 1 . 1 . 637 . 1 1 52 TYR CE2 C 8.076 7.588 7.154 . . . 1.0 . . . . . . . . . . . . A . 52 TYR CE2 . . . . . . . . . c18126_2lr2 1 . 1 . 638 . 1 1 52 TYR CG C 6.403 7.131 8.905 . . . 1.0 . . . . . . . . . . . . A . 52 TYR CG . . . . . . . . . c18126_2lr2 1 . 1 . 639 . 1 1 52 TYR CZ C 8.036 6.252 6.758 . . . 1.0 . . . . . . . . . . . . A . 52 TYR CZ . . . . . . . . . c18126_2lr2 1 . 1 . 640 . 1 1 52 TYR H H 4.928 10.041 8.966 . . . 1.0 . . . . . . . . . . . . A . 52 TYR H . . . . . . . . . c18126_2lr2 1 . 1 . 641 . 1 1 52 TYR HA H 3.649 7.303 9.070 . . . 1.0 . . . . . . . . . . . . A . 52 TYR HA . . . . . . . . . c18126_2lr2 1 . 1 . 642 . 1 1 52 TYR HB2 H 6.012 8.471 10.595 . . . 1.0 . . . . . . . . . . . . A . 52 TYR HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 643 . 1 1 52 TYR HB3 H 5.400 6.843 10.839 . . . 1.0 . . . . . . . . . . . . A . 52 TYR HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 644 . 1 1 52 TYR HD1 H 5.718 5.072 8.980 . . . 1.0 . . . . . . . . . . . . A . 52 TYR HD1 . . . . . . . . . c18126_2lr2 1 . 1 . 645 . 1 1 52 TYR HD2 H 7.318 9.083 8.502 . . . 1.0 . . . . . . . . . . . . A . 52 TYR HD2 . . . . . . . . . c18126_2lr2 1 . 1 . 646 . 1 1 52 TYR HE1 H 7.160 4.307 7.096 . . . 1.0 . . . . . . . . . . . . A . 52 TYR HE1 . . . . . . . . . c18126_2lr2 1 . 1 . 647 . 1 1 52 TYR HE2 H 8.732 8.283 6.635 . . . 1.0 . . . . . . . . . . . . A . 52 TYR HE2 . . . . . . . . . c18126_2lr2 1 . 1 . 648 . 1 1 52 TYR HH H 9.623 5.416 6.077 . . . 1.0 . . . . . . . . . . . . A . 52 TYR HH . . . . . . . . . c18126_2lr2 1 . 1 . 649 . 1 1 52 TYR N N 4.472 9.247 8.612 . . . 1.0 . . . . . . . . . . . . A . 52 TYR N . . . . . . . . . c18126_2lr2 1 . 1 . 650 . 1 1 52 TYR O O 3.488 9.426 11.579 . . . 1.0 . . . . . . . . . . . . A . 52 TYR O . . . . . . . . . c18126_2lr2 1 . 1 . 651 . 1 1 52 TYR OH O 8.839 5.826 5.710 . . . 1.0 . . . . . . . . . . . . A . 52 TYR OH . . . . . . . . . c18126_2lr2 1 . 1 . 652 . 1 1 53 ILE C C 0.832 7.363 13.558 . . . 1.0 . . . . . . . . . . . . A . 53 ILE C . . . . . . . . . c18126_2lr2 1 . 1 . 653 . 1 1 53 ILE CA C 1.407 8.343 12.576 . . . 1.0 . . . . . . . . . . . . A . 53 ILE CA . . . . . . . . . c18126_2lr2 1 . 1 . 654 . 1 1 53 ILE CB C 0.274 9.312 12.132 . . . 1.0 . . . . . . . . . . . . A . 53 ILE CB . . . . . . . . . c18126_2lr2 1 . 1 . 655 . 1 1 53 ILE CD1 C -1.233 11.226 12.921 . . . 1.0 . . . . . . . . . . . . A . 53 ILE CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 656 . 1 1 53 ILE CG1 C -0.333 10.067 13.332 . . . 1.0 . . . . . . . . . . . . A . 53 ILE CG1 . . . . . . . . . c18126_2lr2 1 . 1 . 657 . 1 1 53 ILE CG2 C -0.798 8.580 11.318 . . . 1.0 . . . . . . . . . . . . A . 53 ILE CG2 . . . . . . . . . c18126_2lr2 1 . 1 . 658 . 1 1 53 ILE H H 1.489 7.031 10.955 . . . 1.0 . . . . . . . . . . . . A . 53 ILE H . . . . . . . . . c18126_2lr2 1 . 1 . 659 . 1 1 53 ILE HA H 2.178 8.934 13.094 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HA . . . . . . . . . c18126_2lr2 1 . 1 . 660 . 1 1 53 ILE HB H 0.727 10.067 11.476 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HB . . . . . . . . . c18126_2lr2 1 . 1 . 661 . 1 1 53 ILE HD11 H -2.129 10.873 12.401 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HD11 . . . . . . . . . c18126_2lr2 1 . 1 . 662 . 1 1 53 ILE HD12 H -0.703 11.924 12.265 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HD12 . . . . . . . . . c18126_2lr2 1 . 1 . 663 . 1 1 53 ILE HD13 H -1.561 11.779 13.808 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HD13 . . . . . . . . . c18126_2lr2 1 . 1 . 664 . 1 1 53 ILE HG12 H -0.912 9.389 13.967 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HG12 . . . . . . . . . c18126_2lr2 1 . 1 . 665 . 1 1 53 ILE HG13 H 0.478 10.471 13.951 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HG13 . . . . . . . . . c18126_2lr2 1 . 1 . 666 . 1 1 53 ILE HG21 H -1.477 9.293 10.839 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HG21 . . . . . . . . . c18126_2lr2 1 . 1 . 667 . 1 1 53 ILE HG22 H -1.401 7.919 11.946 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HG22 . . . . . . . . . c18126_2lr2 1 . 1 . 668 . 1 1 53 ILE HG23 H -0.356 7.975 10.520 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HG23 . . . . . . . . . c18126_2lr2 1 . 1 . 669 . 1 1 53 ILE N N 1.990 7.683 11.482 . . . 1.0 . . . . . . . . . . . . A . 53 ILE N . . . . . . . . . c18126_2lr2 1 . 1 . 670 . 1 1 53 ILE O O -0.090 6.611 13.255 . . . 1.0 . . . . . . . . . . . . A . 53 ILE O . . . . . . . . . c18126_2lr2 1 . 1 . 671 . 1 1 54 ASP C C -0.518 6.841 16.373 . . . 1.0 . . . . . . . . . . . . A . 54 ASP C . . . . . . . . . c18126_2lr2 1 . 1 . 672 . 1 1 54 ASP CA C 0.821 6.423 15.840 . . . 1.0 . . . . . . . . . . . . A . 54 ASP CA . . . . . . . . . c18126_2lr2 1 . 1 . 673 . 1 1 54 ASP CB C 1.821 6.336 16.991 . . . 1.0 . . . . . . . . . . . . A . 54 ASP CB . . . . . . . . . c18126_2lr2 1 . 1 . 674 . 1 1 54 ASP CG C 1.138 5.775 18.233 . . . 1.0 . . . . . . . . . . . . A . 54 ASP CG . . . . . . . . . c18126_2lr2 1 . 1 . 675 . 1 1 54 ASP H H 2.017 7.995 15.035 . . . 1.0 . . . . . . . . . . . . A . 54 ASP H . . . . . . . . . c18126_2lr2 1 . 1 . 676 . 1 1 54 ASP HA H 0.733 5.451 15.377 . . . 1.0 . . . . . . . . . . . . A . 54 ASP HA . . . . . . . . . c18126_2lr2 1 . 1 . 677 . 1 1 54 ASP HB2 H 2.639 5.689 16.708 . . . 1.0 . . . . . . . . . . . . A . 54 ASP HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 678 . 1 1 54 ASP HB3 H 2.207 7.322 17.209 . . . 1.0 . . . . . . . . . . . . A . 54 ASP HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 679 . 1 1 54 ASP N N 1.314 7.338 14.845 . . . 1.0 . . . . . . . . . . . . A . 54 ASP N . . . . . . . . . c18126_2lr2 1 . 1 . 680 . 1 1 54 ASP O O -0.681 7.207 17.539 . . . 1.0 . . . . . . . . . . . . A . 54 ASP O . . . . . . . . . c18126_2lr2 1 . 1 . 681 . 1 1 54 ASP OD1 O 0.316 4.886 18.080 . . . 1.0 . . . . . . . . . . . . A . 54 ASP OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 682 . 1 1 54 ASP OD2 O 1.445 6.242 19.319 . . . 1.0 . . . . . . . . . . . . A . 54 ASP OD2 . . . . . . . . . c18126_2lr2 1 . 1 . 683 . 1 1 55 THR C C -3.488 6.542 17.145 . . . 1.0 . . . . . . . . . . . . A . 55 THR C . . . . . . . . . c18126_2lr2 1 . 1 . 684 . 1 1 55 THR CA C -2.928 7.103 15.879 . . . 1.0 . . . . . . . . . . . . A . 55 THR CA . . . . . . . . . c18126_2lr2 1 . 1 . 685 . 1 1 55 THR CB C -3.918 6.870 14.733 . . . 1.0 . . . . . . . . . . . . A . 55 THR CB . . . . . . . . . c18126_2lr2 1 . 1 . 686 . 1 1 55 THR CG2 C -3.333 7.422 13.432 . . . 1.0 . . . . . . . . . . . . A . 55 THR CG2 . . . . . . . . . c18126_2lr2 1 . 1 . 687 . 1 1 55 THR H H -1.376 6.397 14.617 . . . 1.0 . . . . . . . . . . . . A . 55 THR H . . . . . . . . . c18126_2lr2 1 . 1 . 688 . 1 1 55 THR HA H -2.834 8.165 16.048 . . . 1.0 . . . . . . . . . . . . A . 55 THR HA . . . . . . . . . c18126_2lr2 1 . 1 . 689 . 1 1 55 THR HB H -4.845 7.377 14.950 . . . 1.0 . . . . . . . . . . . . A . 55 THR HB . . . . . . . . . c18126_2lr2 1 . 1 . 690 . 1 1 55 THR HG1 H -3.972 5.232 13.685 . . . 1.0 . . . . . . . . . . . . A . 55 THR HG1 . . . . . . . . . c18126_2lr2 1 . 1 . 691 . 1 1 55 THR HG21 H -3.134 6.607 12.754 . . . 1.0 . . . . . . . . . . . . A . 55 THR HG21 . . . . . . . . . c18126_2lr2 1 . 1 . 692 . 1 1 55 THR HG22 H -2.413 7.946 13.645 . . . 1.0 . . . . . . . . . . . . A . 55 THR HG22 . . . . . . . . . c18126_2lr2 1 . 1 . 693 . 1 1 55 THR HG23 H -4.040 8.103 12.980 . . . 1.0 . . . . . . . . . . . . A . 55 THR HG23 . . . . . . . . . c18126_2lr2 1 . 1 . 694 . 1 1 55 THR N N -1.558 6.775 15.503 . . . 1.0 . . . . . . . . . . . . A . 55 THR N . . . . . . . . . c18126_2lr2 1 . 1 . 695 . 1 1 55 THR O O -4.147 7.233 17.920 . . . 1.0 . . . . . . . . . . . . A . 55 THR O . . . . . . . . . c18126_2lr2 1 . 1 . 696 . 1 1 55 THR OG1 O -4.159 5.477 14.593 . . . 1.0 . . . . . . . . . . . . A . 55 THR OG1 . . . . . . . . . c18126_2lr2 1 . 1 . 697 . 1 1 56 ASN C C -2.950 4.740 19.824 . . . 1.0 . . . . . . . . . . . . A . 56 ASN C . . . . . . . . . c18126_2lr2 1 . 1 . 698 . 1 1 56 ASN CA C -3.744 4.668 18.531 . . . 1.0 . . . . . . . . . . . . A . 56 ASN CA . . . . . . . . . c18126_2lr2 1 . 1 . 699 . 1 1 56 ASN CB C -4.043 3.194 18.252 . . . 1.0 . . . . . . . . . . . . A . 56 ASN CB . . . . . . . . . c18126_2lr2 1 . 1 . 700 . 1 1 56 ASN CG C -4.685 3.044 16.877 . . . 1.0 . . . . . . . . . . . . A . 56 ASN CG . . . . . . . . . c18126_2lr2 1 . 1 . 701 . 1 1 56 ASN H H -2.698 4.732 16.737 . . . 1.0 . . . . . . . . . . . . A . 56 ASN H . . . . . . . . . c18126_2lr2 1 . 1 . 702 . 1 1 56 ASN HA H -4.672 5.177 18.748 . . . 1.0 . . . . . . . . . . . . A . 56 ASN HA . . . . . . . . . c18126_2lr2 1 . 1 . 703 . 1 1 56 ASN HB2 H -3.122 2.631 18.282 . . . 1.0 . . . . . . . . . . . . A . 56 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 704 . 1 1 56 ASN HB3 H -4.717 2.816 19.007 . . . 1.0 . . . . . . . . . . . . A . 56 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 705 . 1 1 56 ASN HD21 H -5.359 4.911 16.826 . . . 1.0 . . . . . . . . . . . . A . 56 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 706 . 1 1 56 ASN HD22 H -5.723 3.970 15.461 . . . 1.0 . . . . . . . . . . . . A . 56 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 707 . 1 1 56 ASN N N -3.232 5.258 17.370 . . . 1.0 . . . . . . . . . . . . A . 56 ASN N . . . . . . . . . c18126_2lr2 1 . 1 . 708 . 1 1 56 ASN ND2 N -5.307 4.059 16.345 . . . 1.0 . . . . . . . . . . . . A . 56 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 1 . 709 . 1 1 56 ASN O O -3.242 4.220 20.900 . . . 1.0 . . . . . . . . . . . . A . 56 ASN O . . . . . . . . . c18126_2lr2 1 . 1 . 710 . 1 1 56 ASN OD1 O -4.617 1.973 16.274 . . . 1.0 . . . . . . . . . . . . A . 56 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 711 . 1 1 57 ASN C C -0.421 4.613 21.551 . . . 1.0 . . . . . . . . . . . . A . 57 ASN C . . . . . . . . . c18126_2lr2 1 . 1 . 712 . 1 1 57 ASN CA C -0.947 5.845 20.826 . . . 1.0 . . . . . . . . . . . . A . 57 ASN CA . . . . . . . . . c18126_2lr2 1 . 1 . 713 . 1 1 57 ASN CB C -1.698 6.790 21.768 . . . 1.0 . . . . . . . . . . . . A . 57 ASN CB . . . . . . . . . c18126_2lr2 1 . 1 . 714 . 1 1 57 ASN CG C -0.723 7.771 22.406 . . . 1.0 . . . . . . . . . . . . A . 57 ASN CG . . . . . . . . . c18126_2lr2 1 . 1 . 715 . 1 1 57 ASN H H -1.674 5.924 18.790 . . . 1.0 . . . . . . . . . . . . A . 57 ASN H . . . . . . . . . c18126_2lr2 1 . 1 . 716 . 1 1 57 ASN HA H -0.096 6.367 20.415 . . . 1.0 . . . . . . . . . . . . A . 57 ASN HA . . . . . . . . . c18126_2lr2 1 . 1 . 717 . 1 1 57 ASN HB2 H -2.444 7.333 21.209 . . . 1.0 . . . . . . . . . . . . A . 57 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 718 . 1 1 57 ASN HB3 H -2.181 6.210 22.543 . . . 1.0 . . . . . . . . . . . . A . 57 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 719 . 1 1 57 ASN HD21 H 0.245 8.137 20.712 . . . 1.0 . . . . . . . . . . . . A . 57 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 720 . 1 1 57 ASN HD22 H 0.819 8.978 22.070 . . . 1.0 . . . . . . . . . . . . A . 57 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 721 . 1 1 57 ASN N N -1.863 5.553 19.676 . . . 1.0 . . . . . . . . . . . . A . 57 ASN N . . . . . . . . . c18126_2lr2 1 . 1 . 722 . 1 1 57 ASN ND2 N 0.189 8.344 21.668 . . . 1.0 . . . . . . . . . . . . A . 57 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 1 . 723 . 1 1 57 ASN O O -0.456 4.635 22.783 . . . 1.0 . . . . . . . . . . . . A . 57 ASN O . . . . . . . . . c18126_2lr2 1 . 1 . 724 . 1 1 57 ASN OD1 O -0.796 8.028 23.608 . . . 1.0 . . . . . . . . . . . . A . 57 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 725 . 1 1 58 ASP C C 2.185 2.288 21.366 . . . 1.0 . . . . . . . . . . . . A . 58 ASP C . . . . . . . . . c18126_2lr2 1 . 1 . 726 . 1 1 58 ASP CA C 0.682 2.516 21.544 . . . 1.0 . . . . . . . . . . . . A . 58 ASP CA . . . . . . . . . c18126_2lr2 1 . 1 . 727 . 1 1 58 ASP CB C -0.021 1.200 21.201 . . . 1.0 . . . . . . . . . . . . A . 58 ASP CB . . . . . . . . . c18126_2lr2 1 . 1 . 728 . 1 1 58 ASP CG C 0.017 0.966 19.696 . . . 1.0 . . . . . . . . . . . . A . 58 ASP CG . . . . . . . . . c18126_2lr2 1 . 1 . 729 . 1 1 58 ASP H H 0.213 3.708 19.859 . . . 1.0 . . . . . . . . . . . . A . 58 ASP H . . . . . . . . . c18126_2lr2 1 . 1 . 730 . 1 1 58 ASP HA H 0.550 2.718 22.596 . . . 1.0 . . . . . . . . . . . . A . 58 ASP HA . . . . . . . . . c18126_2lr2 1 . 1 . 731 . 1 1 58 ASP HB2 H 0.481 0.386 21.703 . . . 1.0 . . . . . . . . . . . . A . 58 ASP HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 732 . 1 1 58 ASP HB3 H -1.047 1.247 21.530 . . . 1.0 . . . . . . . . . . . . A . 58 ASP HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 733 . 1 1 58 ASP N N 0.167 3.649 20.837 . . . 1.0 . . . . . . . . . . . . A . 58 ASP N . . . . . . . . . c18126_2lr2 1 . 1 . 734 . 1 1 58 ASP O O 2.738 1.267 21.775 . . . 1.0 . . . . . . . . . . . . A . 58 ASP O . . . . . . . . . c18126_2lr2 1 . 1 . 735 . 1 1 58 ASP OD1 O 1.048 0.534 19.210 . . . 1.0 . . . . . . . . . . . . A . 58 ASP OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 736 . 1 1 58 ASP OD2 O -0.987 1.220 19.052 . . . 1.0 . . . . . . . . . . . . A . 58 ASP OD2 . . . . . . . . . c18126_2lr2 1 . 1 . 737 . 1 1 59 GLY C C 4.717 2.388 19.293 . . . 1.0 . . . . . . . . . . . . A . 59 GLY C . . . . . . . . . c18126_2lr2 1 . 1 . 738 . 1 1 59 GLY CA C 4.265 3.085 20.561 . . . 1.0 . . . . . . . . . . . . A . 59 GLY CA . . . . . . . . . c18126_2lr2 1 . 1 . 739 . 1 1 59 GLY H H 2.365 4.055 20.405 . . . 1.0 . . . . . . . . . . . . A . 59 GLY H . . . . . . . . . c18126_2lr2 1 . 1 . 740 . 1 1 59 GLY HA2 H 4.668 4.078 20.431 . . . 1.0 . . . . . . . . . . . . A . 59 GLY HA2 . . . . . . . . . c18126_2lr2 1 . 1 . 741 . 1 1 59 GLY HA3 H 4.733 2.620 21.416 . . . 1.0 . . . . . . . . . . . . A . 59 GLY HA3 . . . . . . . . . c18126_2lr2 1 . 1 . 742 . 1 1 59 GLY N N 2.847 3.279 20.753 . . . 1.0 . . . . . . . . . . . . A . 59 GLY N . . . . . . . . . c18126_2lr2 1 . 1 . 743 . 1 1 59 GLY O O 5.905 2.191 19.056 . . . 1.0 . . . . . . . . . . . . A . 59 GLY O . . . . . . . . . c18126_2lr2 1 . 1 . 744 . 1 1 60 ALA C C 3.192 1.719 16.113 . . . 1.0 . . . . . . . . . . . . A . 60 ALA C . . . . . . . . . c18126_2lr2 1 . 1 . 745 . 1 1 60 ALA CA C 4.007 1.205 17.300 . . . 1.0 . . . . . . . . . . . . A . 60 ALA CA . . . . . . . . . c18126_2lr2 1 . 1 . 746 . 1 1 60 ALA CB C 3.781 -0.304 17.402 . . . 1.0 . . . . . . . . . . . . A . 60 ALA CB . . . . . . . . . c18126_2lr2 1 . 1 . 747 . 1 1 60 ALA H H 2.823 2.132 18.767 . . . 1.0 . . . . . . . . . . . . A . 60 ALA H . . . . . . . . . c18126_2lr2 1 . 1 . 748 . 1 1 60 ALA HA H 5.056 1.389 17.130 . . . 1.0 . . . . . . . . . . . . A . 60 ALA HA . . . . . . . . . c18126_2lr2 1 . 1 . 749 . 1 1 60 ALA HB1 H 3.562 -0.567 18.426 . . . 1.0 . . . . . . . . . . . . A . 60 ALA HB1 . . . . . . . . . c18126_2lr2 1 . 1 . 750 . 1 1 60 ALA HB2 H 4.671 -0.823 17.077 . . . 1.0 . . . . . . . . . . . . A . 60 ALA HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 751 . 1 1 60 ALA HB3 H 2.948 -0.586 16.772 . . . 1.0 . . . . . . . . . . . . A . 60 ALA HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 752 . 1 1 60 ALA N N 3.737 1.914 18.487 . . . 1.0 . . . . . . . . . . . . A . 60 ALA N . . . . . . . . . c18126_2lr2 1 . 1 . 753 . 1 1 60 ALA O O 2.173 2.376 16.331 . . . 1.0 . . . . . . . . . . . . A . 60 ALA O . . . . . . . . . c18126_2lr2 1 . 1 . 754 . 1 1 61 TYR C C 2.363 0.509 13.185 . . . 1.0 . . . . . . . . . . . . A . 61 TYR C . . . . . . . . . c18126_2lr2 1 . 1 . 755 . 1 1 61 TYR CA C 2.892 1.870 13.677 . . . 1.0 . . . . . . . . . . . . A . 61 TYR CA . . . . . . . . . c18126_2lr2 1 . 1 . 756 . 1 1 61 TYR CB C 3.886 2.433 12.661 . . . 1.0 . . . . . . . . . . . . A . 61 TYR CB . . . . . . . . . c18126_2lr2 1 . 1 . 757 . 1 1 61 TYR CD1 C 3.853 4.652 13.852 . . . 1.0 . . . . . . . . . . . . A . 61 TYR CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 758 . 1 1 61 TYR CD2 C 5.991 3.709 13.208 . . . 1.0 . . . . . . . . . . . . A . 61 TYR CD2 . . . . . . . . . c18126_2lr2 1 . 1 . 759 . 1 1 61 TYR CE1 C 4.508 5.760 14.403 . . . 1.0 . . . . . . . . . . . . A . 61 TYR CE1 . . . . . . . . . c18126_2lr2 1 . 1 . 760 . 1 1 61 TYR CE2 C 6.647 4.815 13.760 . . . 1.0 . . . . . . . . . . . . A . 61 TYR CE2 . . . . . . . . . c18126_2lr2 1 . 1 . 761 . 1 1 61 TYR CG C 4.594 3.627 13.255 . . . 1.0 . . . . . . . . . . . . A . 61 TYR CG . . . . . . . . . c18126_2lr2 1 . 1 . 762 . 1 1 61 TYR CZ C 5.905 5.842 14.358 . . . 1.0 . . . . . . . . . . . . A . 61 TYR CZ . . . . . . . . . c18126_2lr2 1 . 1 . 763 . 1 1 61 TYR H H 4.479 0.979 14.813 . . . 1.0 . . . . . . . . . . . . A . 61 TYR H . . . . . . . . . c18126_2lr2 1 . 1 . 764 . 1 1 61 TYR HA H 2.119 2.604 13.852 . . . 1.0 . . . . . . . . . . . . A . 61 TYR HA . . . . . . . . . c18126_2lr2 1 . 1 . 765 . 1 1 61 TYR HB2 H 4.613 1.674 12.408 . . . 1.0 . . . . . . . . . . . . A . 61 TYR HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 766 . 1 1 61 TYR HB3 H 3.358 2.736 11.769 . . . 1.0 . . . . . . . . . . . . A . 61 TYR HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 767 . 1 1 61 TYR HD1 H 2.776 4.590 13.891 . . . 1.0 . . . . . . . . . . . . A . 61 TYR HD1 . . . . . . . . . c18126_2lr2 1 . 1 . 768 . 1 1 61 TYR HD2 H 6.563 2.917 12.746 . . . 1.0 . . . . . . . . . . . . A . 61 TYR HD2 . . . . . . . . . c18126_2lr2 1 . 1 . 769 . 1 1 61 TYR HE1 H 3.937 6.551 14.868 . . . 1.0 . . . . . . . . . . . . A . 61 TYR HE1 . . . . . . . . . c18126_2lr2 1 . 1 . 770 . 1 1 61 TYR HE2 H 7.723 4.877 13.725 . . . 1.0 . . . . . . . . . . . . A . 61 TYR HE2 . . . . . . . . . c18126_2lr2 1 . 1 . 771 . 1 1 61 TYR HH H 6.884 6.679 15.766 . . . 1.0 . . . . . . . . . . . . A . 61 TYR HH . . . . . . . . . c18126_2lr2 1 . 1 . 772 . 1 1 61 TYR N N 3.626 1.458 14.875 . . . 1.0 . . . . . . . . . . . . A . 61 TYR N . . . . . . . . . c18126_2lr2 1 . 1 . 773 . 1 1 61 TYR O O 3.123 -0.363 12.760 . . . 1.0 . . . . . . . . . . . . A . 61 TYR O . . . . . . . . . c18126_2lr2 1 . 1 . 774 . 1 1 61 TYR OH O 6.551 6.932 14.903 . . . 1.0 . . . . . . . . . . . . A . 61 TYR OH . . . . . . . . . c18126_2lr2 1 . 1 . 775 . 1 1 62 GLU C C -0.978 -0.724 12.147 . . . 1.0 . . . . . . . . . . . . A . 62 GLU C . . . . . . . . . c18126_2lr2 1 . 1 . 776 . 1 1 62 GLU CA C 0.432 -0.867 12.737 . . . 1.0 . . . . . . . . . . . . A . 62 GLU CA . . . . . . . . . c18126_2lr2 1 . 1 . 777 . 1 1 62 GLU CB C 0.346 -1.814 13.936 . . . 1.0 . . . . . . . . . . . . A . 62 GLU CB . . . . . . . . . c18126_2lr2 1 . 1 . 778 . 1 1 62 GLU CD C -1.017 0.076 14.846 . . . 1.0 . . . . . . . . . . . . A . 62 GLU CD . . . . . . . . . c18126_2lr2 1 . 1 . 779 . 1 1 62 GLU CG C -0.862 -1.440 14.795 . . . 1.0 . . . . . . . . . . . . A . 62 GLU CG . . . . . . . . . c18126_2lr2 1 . 1 . 780 . 1 1 62 GLU H H 0.444 1.161 13.459 . . . 1.0 . . . . . . . . . . . . A . 62 GLU H . . . . . . . . . c18126_2lr2 1 . 1 . 781 . 1 1 62 GLU HA H 1.096 -1.298 12.000 . . . 1.0 . . . . . . . . . . . . A . 62 GLU HA . . . . . . . . . c18126_2lr2 1 . 1 . 782 . 1 1 62 GLU HB2 H 0.237 -2.830 13.583 . . . 1.0 . . . . . . . . . . . . A . 62 GLU HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 783 . 1 1 62 GLU HB3 H 1.246 -1.731 14.526 . . . 1.0 . . . . . . . . . . . . A . 62 GLU HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 784 . 1 1 62 GLU HG2 H -1.755 -1.877 14.369 . . . 1.0 . . . . . . . . . . . . A . 62 GLU HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 785 . 1 1 62 GLU HG3 H -0.721 -1.817 15.796 . . . 1.0 . . . . . . . . . . . . A . 62 GLU HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 786 . 1 1 62 GLU N N 1.003 0.405 13.173 . . . 1.0 . . . . . . . . . . . . A . 62 GLU N . . . . . . . . . c18126_2lr2 1 . 1 . 787 . 1 1 62 GLU O O -1.626 0.319 12.230 . . . 1.0 . . . . . . . . . . . . A . 62 GLU O . . . . . . . . . c18126_2lr2 1 . 1 . 788 . 1 1 62 GLU OE1 O -0.144 0.722 15.406 . . . 1.0 . . . . . . . . . . . . A . 62 GLU OE1 . . . . . . . . . c18126_2lr2 1 . 1 . 789 . 1 1 62 GLU OE2 O -2.003 0.570 14.325 . . . 1.0 . . . . . . . . . . . . A . 62 GLU OE2 . . . . . . . . . c18126_2lr2 1 . 1 . 790 . 1 1 63 GLY C C -3.260 -0.668 10.188 . . . 1.0 . . . . . . . . . . . . A . 63 GLY C . . . . . . . . . c18126_2lr2 1 . 1 . 791 . 1 1 63 GLY CA C -2.749 -1.858 10.964 . . . 1.0 . . . . . . . . . . . . A . 63 GLY CA . . . . . . . . . c18126_2lr2 1 . 1 . 792 . 1 1 63 GLY H H -0.881 -2.599 11.524 . . . 1.0 . . . . . . . . . . . . A . 63 GLY H . . . . . . . . . c18126_2lr2 1 . 1 . 793 . 1 1 63 GLY HA2 H -2.745 -2.665 10.244 . . . 1.0 . . . . . . . . . . . . A . 63 GLY HA2 . . . . . . . . . c18126_2lr2 1 . 1 . 794 . 1 1 63 GLY HA3 H -3.471 -2.078 11.737 . . . 1.0 . . . . . . . . . . . . A . 63 GLY HA3 . . . . . . . . . c18126_2lr2 1 . 1 . 795 . 1 1 63 GLY N N -1.454 -1.804 11.564 . . . 1.0 . . . . . . . . . . . . A . 63 GLY N . . . . . . . . . c18126_2lr2 1 . 1 . 796 . 1 1 63 GLY O O -2.637 -0.269 9.204 . . . 1.0 . . . . . . . . . . . . A . 63 GLY O . . . . . . . . . c18126_2lr2 1 . 1 . 797 . 1 1 64 ASP C C -4.041 2.264 9.946 . . . 1.0 . . . . . . . . . . . . A . 64 ASP C . . . . . . . . . c18126_2lr2 1 . 1 . 798 . 1 1 64 ASP CA C -4.967 1.050 9.933 . . . 1.0 . . . . . . . . . . . . A . 64 ASP CA . . . . . . . . . c18126_2lr2 1 . 1 . 799 . 1 1 64 ASP CB C -6.301 1.425 10.582 . . . 1.0 . . . . . . . . . . . . A . 64 ASP CB . . . . . . . . . c18126_2lr2 1 . 1 . 800 . 1 1 64 ASP CG C -6.842 2.707 9.957 . . . 1.0 . . . . . . . . . . . . A . 64 ASP CG . . . . . . . . . c18126_2lr2 1 . 1 . 801 . 1 1 64 ASP H H -4.840 -0.490 11.427 . . . 1.0 . . . . . . . . . . . . A . 64 ASP H . . . . . . . . . c18126_2lr2 1 . 1 . 802 . 1 1 64 ASP HA H -5.151 0.737 8.916 . . . 1.0 . . . . . . . . . . . . A . 64 ASP HA . . . . . . . . . c18126_2lr2 1 . 1 . 803 . 1 1 64 ASP HB2 H -7.010 0.625 10.430 . . . 1.0 . . . . . . . . . . . . A . 64 ASP HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 804 . 1 1 64 ASP HB3 H -6.154 1.578 11.640 . . . 1.0 . . . . . . . . . . . . A . 64 ASP HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 805 . 1 1 64 ASP N N -4.383 -0.106 10.650 . . . 1.0 . . . . . . . . . . . . A . 64 ASP N . . . . . . . . . c18126_2lr2 1 . 1 . 806 . 1 1 64 ASP O O -4.304 3.174 9.162 . . . 1.0 . . . . . . . . . . . . A . 64 ASP O . . . . . . . . . c18126_2lr2 1 . 1 . 807 . 1 1 64 ASP OD1 O -6.776 2.827 8.745 . . . 1.0 . . . . . . . . . . . . A . 64 ASP OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 808 . 1 1 64 ASP OD2 O -7.313 3.551 10.701 . . . 1.0 . . . . . . . . . . . . A . 64 ASP OD2 . . . . . . . . . c18126_2lr2 1 . 1 . 809 . 1 1 65 GLU C C -1.125 3.199 9.457 . . . 1.0 . . . . . . . . . . . . A . 65 GLU C . . . . . . . . . c18126_2lr2 1 . 1 . 810 . 1 1 65 GLU CA C -2.067 3.306 10.674 . . . 1.0 . . . . . . . . . . . . A . 65 GLU CA . . . . . . . . . c18126_2lr2 1 . 1 . 811 . 1 1 65 GLU CB C -1.214 3.216 11.965 . . . 1.0 . . . . . . . . . . . . A . 65 GLU CB . . . . . . . . . c18126_2lr2 1 . 1 . 812 . 1 1 65 GLU CD C -2.886 3.395 14.035 . . . 1.0 . . . . . . . . . . . . A . 65 GLU CD . . . . . . . . . c18126_2lr2 1 . 1 . 813 . 1 1 65 GLU CG C -1.881 4.097 13.088 . . . 1.0 . . . . . . . . . . . . A . 65 GLU CG . . . . . . . . . c18126_2lr2 1 . 1 . 814 . 1 1 65 GLU H H -2.857 1.454 11.301 . . . 1.0 . . . . . . . . . . . . A . 65 GLU H . . . . . . . . . c18126_2lr2 1 . 1 . 815 . 1 1 65 GLU HA H -2.532 4.273 10.726 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HA . . . . . . . . . c18126_2lr2 1 . 1 . 816 . 1 1 65 GLU HB2 H -1.136 2.186 12.287 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 817 . 1 1 65 GLU HB3 H -0.215 3.602 11.771 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 818 . 1 1 65 GLU HG2 H -1.112 4.503 13.690 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 819 . 1 1 65 GLU HG3 H -2.395 4.916 12.617 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 820 . 1 1 65 GLU N N -2.970 2.198 10.698 . . . 1.0 . . . . . . . . . . . . A . 65 GLU N . . . . . . . . . c18126_2lr2 1 . 1 . 821 . 1 1 65 GLU O O -0.334 4.097 9.152 . . . 1.0 . . . . . . . . . . . . A . 65 GLU O . . . . . . . . . c18126_2lr2 1 . 1 . 822 . 1 1 65 GLU OE1 O -2.709 2.255 14.336 . . . 1.0 . . . . . . . . . . . . A . 65 GLU OE1 . . . . . . . . . c18126_2lr2 1 . 1 . 823 . 1 1 65 GLU OE2 O -3.805 4.066 14.494 . . . 1.0 . . . . . . . . . . . . A . 65 GLU OE2 . . . . . . . . . c18126_2lr2 1 . 1 . 824 . 1 1 66 LEU C C -0.446 2.690 6.186 . . . 1.0 . . . . . . . . . . . . A . 66 LEU C . . . . . . . . . c18126_2lr2 1 . 1 . 825 . 1 1 66 LEU CA C -0.351 1.738 7.498 . . . 1.0 . . . . . . . . . . . . A . 66 LEU CA . . . . . . . . . c18126_2lr2 1 . 1 . 826 . 1 1 66 LEU CB C -0.367 0.173 7.116 . . . 1.0 . . . . . . . . . . . . A . 66 LEU CB . . . . . . . . . c18126_2lr2 1 . 1 . 827 . 1 1 66 LEU CD1 C 0.525 -0.568 9.504 . . . 1.0 . . . . . . . . . . . . A . 66 LEU CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 828 . 1 1 66 LEU CD2 C 0.672 -2.249 7.595 . . . 1.0 . . . . . . . . . . . . A . 66 LEU CD2 . . . . . . . . . c18126_2lr2 1 . 1 . 829 . 1 1 66 LEU CG C 0.693 -0.715 7.982 . . . 1.0 . . . . . . . . . . . . A . 66 LEU CG . . . . . . . . . c18126_2lr2 1 . 1 . 830 . 1 1 66 LEU H H -1.856 1.304 8.986 . . . 1.0 . . . . . . . . . . . . A . 66 LEU H . . . . . . . . . c18126_2lr2 1 . 1 . 831 . 1 1 66 LEU HA H 0.649 1.914 7.897 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HA . . . . . . . . . c18126_2lr2 1 . 1 . 832 . 1 1 66 LEU HB2 H -1.365 -0.215 7.274 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 833 . 1 1 66 LEU HB3 H -0.141 0.062 6.060 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 834 . 1 1 66 LEU HD11 H 0.952 -1.430 9.988 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HD11 . . . . . . . . . c18126_2lr2 1 . 1 . 835 . 1 1 66 LEU HD12 H -0.491 -0.491 9.752 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HD12 . . . . . . . . . c18126_2lr2 1 . 1 . 836 . 1 1 66 LEU HD13 H 1.033 0.319 9.859 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HD13 . . . . . . . . . c18126_2lr2 1 . 1 . 837 . 1 1 66 LEU HD21 H 0.850 -2.358 6.536 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 838 . 1 1 66 LEU HD22 H -0.282 -2.705 7.856 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 839 . 1 1 66 LEU HD23 H 1.469 -2.762 8.130 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HD23 . . . . . . . . . c18126_2lr2 1 . 1 . 840 . 1 1 66 LEU HG H 1.677 -0.365 7.772 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HG . . . . . . . . . c18126_2lr2 1 . 1 . 841 . 1 1 66 LEU N N -1.202 2.014 8.709 . . . 1.0 . . . . . . . . . . . . A . 66 LEU N . . . . . . . . . c18126_2lr2 1 . 1 . 842 . 1 1 66 LEU O O 0.565 2.890 5.610 . . . 1.0 . . . . . . . . . . . . A . 66 LEU O . . . . . . . . . c18126_2lr2 1 . 1 . 843 . 1 1 67 SER C C -1.350 5.566 4.345 . . . 1.0 . . . . . . . . . . . . A . 67 SER C . . . . . . . . . c18126_2lr2 1 . 1 . 844 . 1 1 67 SER CA C -1.656 3.996 4.263 . . . 1.0 . . . . . . . . . . . . A . 67 SER CA . . . . . . . . . c18126_2lr2 1 . 1 . 845 . 1 1 67 SER CB C -3.081 3.763 3.645 . . . 1.0 . . . . . . . . . . . . A . 67 SER CB . . . . . . . . . c18126_2lr2 1 . 1 . 846 . 1 1 67 SER H H -2.469 2.942 6.044 . . . 1.0 . . . . . . . . . . . . A . 67 SER H . . . . . . . . . c18126_2lr2 1 . 1 . 847 . 1 1 67 SER HA H -0.927 3.568 3.575 . . . 1.0 . . . . . . . . . . . . A . 67 SER HA . . . . . . . . . c18126_2lr2 1 . 1 . 848 . 1 1 67 SER HB2 H -3.197 2.723 3.387 . . . 1.0 . . . . . . . . . . . . A . 67 SER HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 849 . 1 1 67 SER HB3 H -3.844 4.011 4.372 . . . 1.0 . . . . . . . . . . . . A . 67 SER HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 850 . 1 1 67 SER HG H -4.213 4.671 2.343 . . . 1.0 . . . . . . . . . . . . A . 67 SER HG . . . . . . . . . c18126_2lr2 1 . 1 . 851 . 1 1 67 SER N N -1.619 3.193 5.634 . . . 1.0 . . . . . . . . . . . . A . 67 SER N . . . . . . . . . c18126_2lr2 1 . 1 . 852 . 1 1 67 SER O O -1.198 6.083 5.434 . . . 1.0 . . . . . . . . . . . . A . 67 SER O . . . . . . . . . c18126_2lr2 1 . 1 . 853 . 1 1 67 SER OG O -3.267 4.543 2.467 . . . 1.0 . . . . . . . . . . . . A . 67 SER OG . . . . . . . . . c18126_2lr2 1 . 1 . 854 . 1 1 68 GLY C C 0.357 8.149 2.332 . . . 1.0 . . . . . . . . . . . . A . 68 GLY C . . . . . . . . . c18126_2lr2 1 . 1 . 855 . 1 1 68 GLY CA C -0.881 7.816 3.164 . . . 1.0 . . . . . . . . . . . . A . 68 GLY CA . . . . . . . . . c18126_2lr2 1 . 1 . 856 . 1 1 68 GLY H H -1.301 5.864 2.285 . . . 1.0 . . . . . . . . . . . . A . 68 GLY H . . . . . . . . . c18126_2lr2 1 . 1 . 857 . 1 1 68 GLY HA2 H -1.713 8.388 2.772 . . . 1.0 . . . . . . . . . . . . A . 68 GLY HA2 . . . . . . . . . c18126_2lr2 1 . 1 . 858 . 1 1 68 GLY HA3 H -0.700 8.155 4.172 . . . 1.0 . . . . . . . . . . . . A . 68 GLY HA3 . . . . . . . . . c18126_2lr2 1 . 1 . 859 . 1 1 68 GLY N N -1.205 6.318 3.160 . . . 1.0 . . . . . . . . . . . . A . 68 GLY N . . . . . . . . . c18126_2lr2 1 . 1 . 860 . 1 1 68 GLY O O 1.390 8.517 2.902 . . . 1.0 . . . . . . . . . . . . A . 68 GLY O . . . . . . . . . c18126_2lr2 1 . 1 . 861 . 1 1 69 SER C C 0.842 8.440 -1.362 . . . 1.0 . . . . . . . . . . . . A . 69 SER C . . . . . . . . . c18126_2lr2 1 . 1 . 862 . 1 1 69 SER CA C 1.377 8.187 0.042 . . . 1.0 . . . . . . . . . . . . A . 69 SER CA . . . . . . . . . c18126_2lr2 1 . 1 . 863 . 1 1 69 SER CB C 2.309 6.933 0.022 . . . 1.0 . . . . . . . . . . . . A . 69 SER CB . . . . . . . . . c18126_2lr2 1 . 1 . 864 . 1 1 69 SER H H -0.592 7.623 0.638 . . . 1.0 . . . . . . . . . . . . A . 69 SER H . . . . . . . . . c18126_2lr2 1 . 1 . 865 . 1 1 69 SER HA H 1.915 9.064 0.341 . . . 1.0 . . . . . . . . . . . . A . 69 SER HA . . . . . . . . . c18126_2lr2 1 . 1 . 866 . 1 1 69 SER HB2 H 3.091 7.015 -0.732 . . . 1.0 . . . . . . . . . . . . A . 69 SER HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 867 . 1 1 69 SER HB3 H 2.770 6.788 0.990 . . . 1.0 . . . . . . . . . . . . A . 69 SER HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 868 . 1 1 69 SER HG H 0.965 6.008 -1.022 . . . 1.0 . . . . . . . . . . . . A . 69 SER HG . . . . . . . . . c18126_2lr2 1 . 1 . 869 . 1 1 69 SER N N 0.255 7.960 0.995 . . . 1.0 . . . . . . . . . . . . A . 69 SER N . . . . . . . . . c18126_2lr2 1 . 1 . 870 . 1 1 69 SER O O -0.291 8.148 -1.618 . . . 1.0 . . . . . . . . . . . . A . 69 SER O . . . . . . . . . c18126_2lr2 1 . 1 . 871 . 1 1 69 SER OG O 1.508 5.812 -0.263 . . . 1.0 . . . . . . . . . . . . A . 69 SER OG . . . . . . . . . c18126_2lr2 1 . 1 . 872 . 1 1 70 GLN C C 0.952 7.820 -4.412 . . . 1.0 . . . . . . . . . . . . A . 70 GLN C . . . . . . . . . c18126_2lr2 1 . 1 . 873 . 1 1 70 GLN CA C 1.433 9.152 -3.742 . . . 1.0 . . . . . . . . . . . . A . 70 GLN CA . . . . . . . . . c18126_2lr2 1 . 1 . 874 . 1 1 70 GLN CB C 2.738 9.647 -4.475 . . . 1.0 . . . . . . . . . . . . A . 70 GLN CB . . . . . . . . . c18126_2lr2 1 . 1 . 875 . 1 1 70 GLN CD C 4.536 11.500 -4.679 . . . 1.0 . . . . . . . . . . . . A . 70 GLN CD . . . . . . . . . c18126_2lr2 1 . 1 . 876 . 1 1 70 GLN CG C 3.214 11.067 -3.986 . . . 1.0 . . . . . . . . . . . . A . 70 GLN CG . . . . . . . . . c18126_2lr2 1 . 1 . 877 . 1 1 70 GLN H H 2.645 9.047 -1.974 . . . 1.0 . . . . . . . . . . . . A . 70 GLN H . . . . . . . . . c18126_2lr2 1 . 1 . 878 . 1 1 70 GLN HA H 0.649 9.905 -3.848 . . . 1.0 . . . . . . . . . . . . A . 70 GLN HA . . . . . . . . . c18126_2lr2 1 . 1 . 879 . 1 1 70 GLN HB2 H 3.535 8.920 -4.303 . . . 1.0 . . . . . . . . . . . . A . 70 GLN HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 880 . 1 1 70 GLN HB3 H 2.543 9.696 -5.552 . . . 1.0 . . . . . . . . . . . . A . 70 GLN HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 881 . 1 1 70 GLN HE21 H 4.701 13.170 -3.625 . . . 1.0 . . . . . . . . . . . . A . 70 GLN HE21 . . . . . . . . . c18126_2lr2 1 . 1 . 882 . 1 1 70 GLN HE22 H 5.938 12.899 -4.754 . . . 1.0 . . . . . . . . . . . . A . 70 GLN HE22 . . . . . . . . . c18126_2lr2 1 . 1 . 883 . 1 1 70 GLN HG2 H 2.454 11.809 -4.208 . . . 1.0 . . . . . . . . . . . . A . 70 GLN HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 884 . 1 1 70 GLN HG3 H 3.380 11.047 -2.912 . . . 1.0 . . . . . . . . . . . . A . 70 GLN HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 885 . 1 1 70 GLN N N 1.722 8.911 -2.278 . . . 1.0 . . . . . . . . . . . . A . 70 GLN N . . . . . . . . . c18126_2lr2 1 . 1 . 886 . 1 1 70 GLN NE2 N 5.108 12.615 -4.322 . . . 1.0 . . . . . . . . . . . . A . 70 GLN NE2 . . . . . . . . . c18126_2lr2 1 . 1 . 887 . 1 1 70 GLN O O 1.591 7.306 -5.342 . . . 1.0 . . . . . . . . . . . . A . 70 GLN O . . . . . . . . . c18126_2lr2 1 . 1 . 888 . 1 1 70 GLN OE1 O 5.052 10.806 -5.563 . . . 1.0 . . . . . . . . . . . . A . 70 GLN OE1 . . . . . . . . . c18126_2lr2 1 . 1 . 889 . 1 1 71 SER C C -0.944 5.662 -5.630 . . . 1.0 . . . . . . . . . . . . A . 71 SER C . . . . . . . . . c18126_2lr2 1 . 1 . 890 . 1 1 71 SER CA C -0.513 5.830 -4.181 . . . 1.0 . . . . . . . . . . . . A . 71 SER CA . . . . . . . . . c18126_2lr2 1 . 1 . 891 . 1 1 71 SER CB C -1.711 5.451 -3.285 . . . 1.0 . . . . . . . . . . . . A . 71 SER CB . . . . . . . . . c18126_2lr2 1 . 1 . 892 . 1 1 71 SER H H -0.417 7.557 -2.993 . . . 1.0 . . . . . . . . . . . . A . 71 SER H . . . . . . . . . c18126_2lr2 1 . 1 . 893 . 1 1 71 SER HA H 0.288 5.151 -3.984 . . . 1.0 . . . . . . . . . . . . A . 71 SER HA . . . . . . . . . c18126_2lr2 1 . 1 . 894 . 1 1 71 SER HB2 H -2.013 4.443 -3.467 . . . 1.0 . . . . . . . . . . . . A . 71 SER HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 895 . 1 1 71 SER HB3 H -1.448 5.544 -2.236 . . . 1.0 . . . . . . . . . . . . A . 71 SER HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 896 . 1 1 71 SER HG H -3.263 5.941 -4.345 . . . 1.0 . . . . . . . . . . . . A . 71 SER HG . . . . . . . . . c18126_2lr2 1 . 1 . 897 . 1 1 71 SER N N -0.052 7.176 -3.807 . . . 1.0 . . . . . . . . . . . . A . 71 SER N . . . . . . . . . c18126_2lr2 1 . 1 . 898 . 1 1 71 SER O O -0.909 4.538 -6.127 . . . 1.0 . . . . . . . . . . . . A . 71 SER O . . . . . . . . . c18126_2lr2 1 . 1 . 899 . 1 1 71 SER OG O -2.804 6.301 -3.586 . . . 1.0 . . . . . . . . . . . . A . 71 SER OG . . . . . . . . . c18126_2lr2 1 . 1 . 900 . 1 1 72 ALA C C -0.718 5.984 -8.573 . . . 1.0 . . . . . . . . . . . . A . 72 ALA C . . . . . . . . . c18126_2lr2 1 . 1 . 901 . 1 1 72 ALA CA C -1.834 6.625 -7.699 . . . 1.0 . . . . . . . . . . . . A . 72 ALA CA . . . . . . . . . c18126_2lr2 1 . 1 . 902 . 1 1 72 ALA CB C -2.192 8.057 -8.245 . . . 1.0 . . . . . . . . . . . . A . 72 ALA CB . . . . . . . . . c18126_2lr2 1 . 1 . 903 . 1 1 72 ALA H H -1.422 7.601 -5.839 . . . 1.0 . . . . . . . . . . . . A . 72 ALA H . . . . . . . . . c18126_2lr2 1 . 1 . 904 . 1 1 72 ALA HA H -2.722 5.990 -7.731 . . . 1.0 . . . . . . . . . . . . A . 72 ALA HA . . . . . . . . . c18126_2lr2 1 . 1 . 905 . 1 1 72 ALA HB1 H -1.324 8.712 -8.188 . . . 1.0 . . . . . . . . . . . . A . 72 ALA HB1 . . . . . . . . . c18126_2lr2 1 . 1 . 906 . 1 1 72 ALA HB2 H -2.986 8.482 -7.645 . . . 1.0 . . . . . . . . . . . . A . 72 ALA HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 907 . 1 1 72 ALA HB3 H -2.523 8.007 -9.281 . . . 1.0 . . . . . . . . . . . . A . 72 ALA HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 908 . 1 1 72 ALA N N -1.369 6.736 -6.298 . . . 1.0 . . . . . . . . . . . . A . 72 ALA N . . . . . . . . . c18126_2lr2 1 . 1 . 909 . 1 1 72 ALA O O -0.998 5.099 -9.392 . . . 1.0 . . . . . . . . . . . . A . 72 ALA O . . . . . . . . . c18126_2lr2 1 . 1 . 910 . 1 1 73 ASN C C 1.953 4.518 -8.850 . . . 1.0 . . . . . . . . . . . . A . 73 ASN C . . . . . . . . . c18126_2lr2 1 . 1 . 911 . 1 1 73 ASN CA C 1.660 5.974 -9.200 . . . 1.0 . . . . . . . . . . . . A . 73 ASN CA . . . . . . . . . c18126_2lr2 1 . 1 . 912 . 1 1 73 ASN CB C 2.918 6.883 -8.931 . . . 1.0 . . . . . . . . . . . . A . 73 ASN CB . . . . . . . . . c18126_2lr2 1 . 1 . 913 . 1 1 73 ASN CG C 2.824 8.234 -9.696 . . . 1.0 . . . . . . . . . . . . A . 73 ASN CG . . . . . . . . . c18126_2lr2 1 . 1 . 914 . 1 1 73 ASN H H 0.676 7.198 -7.777 . . . 1.0 . . . . . . . . . . . . A . 73 ASN H . . . . . . . . . c18126_2lr2 1 . 1 . 915 . 1 1 73 ASN HA H 1.415 6.039 -10.250 . . . 1.0 . . . . . . . . . . . . A . 73 ASN HA . . . . . . . . . c18126_2lr2 1 . 1 . 916 . 1 1 73 ASN HB2 H 3.005 7.085 -7.864 . . . 1.0 . . . . . . . . . . . . A . 73 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 917 . 1 1 73 ASN HB3 H 3.824 6.369 -9.263 . . . 1.0 . . . . . . . . . . . . A . 73 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 918 . 1 1 73 ASN HD21 H 4.189 9.142 -8.578 . . . 1.0 . . . . . . . . . . . . A . 73 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 919 . 1 1 73 ASN HD22 H 3.508 10.092 -9.809 . . . 1.0 . . . . . . . . . . . . A . 73 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 920 . 1 1 73 ASN N N 0.534 6.472 -8.420 . . . 1.0 . . . . . . . . . . . . A . 73 ASN N . . . . . . . . . c18126_2lr2 1 . 1 . 921 . 1 1 73 ASN ND2 N 3.569 9.239 -9.329 . . . 1.0 . . . . . . . . . . . . A . 73 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 1 . 922 . 1 1 73 ASN O O 2.116 3.677 -9.734 . . . 1.0 . . . . . . . . . . . . A . 73 ASN O . . . . . . . . . c18126_2lr2 1 . 1 . 923 . 1 1 73 ASN OD1 O 2.048 8.382 -10.647 . . . 1.0 . . . . . . . . . . . . A . 73 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 924 . 1 1 74 LEU C C 1.206 1.915 -7.583 . . . 1.0 . . . . . . . . . . . . A . 74 LEU C . . . . . . . . . c18126_2lr2 1 . 1 . 925 . 1 1 74 LEU CA C 2.291 2.871 -7.098 . . . 1.0 . . . . . . . . . . . . A . 74 LEU CA . . . . . . . . . c18126_2lr2 1 . 1 . 926 . 1 1 74 LEU CB C 2.385 2.823 -5.540 . . . 1.0 . . . . . . . . . . . . A . 74 LEU CB . . . . . . . . . c18126_2lr2 1 . 1 . 927 . 1 1 74 LEU CD1 C 1.630 0.391 -4.875 . . . 1.0 . . . . . . . . . . . . A . 74 LEU CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 928 . 1 1 74 LEU CD2 C 4.048 0.743 -5.756 . . . 1.0 . . . . . . . . . . . . A . 74 LEU CD2 . . . . . . . . . c18126_2lr2 1 . 1 . 929 . 1 1 74 LEU CG C 2.827 1.388 -4.956 . . . 1.0 . . . . . . . . . . . . A . 74 LEU CG . . . . . . . . . c18126_2lr2 1 . 1 . 930 . 1 1 74 LEU H H 1.879 4.940 -6.894 . . . 1.0 . . . . . . . . . . . . A . 74 LEU H . . . . . . . . . c18126_2lr2 1 . 1 . 931 . 1 1 74 LEU HA H 3.243 2.552 -7.496 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HA . . . . . . . . . c18126_2lr2 1 . 1 . 932 . 1 1 74 LEU HB2 H 3.079 3.572 -5.190 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 933 . 1 1 74 LEU HB3 H 1.412 3.084 -5.162 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 934 . 1 1 74 LEU HD11 H 1.789 -0.282 -4.064 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HD11 . . . . . . . . . c18126_2lr2 1 . 1 . 935 . 1 1 74 LEU HD12 H 1.543 -0.166 -5.775 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HD12 . . . . . . . . . c18126_2lr2 1 . 1 . 936 . 1 1 74 LEU HD13 H 0.723 0.902 -4.716 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HD13 . . . . . . . . . c18126_2lr2 1 . 1 . 937 . 1 1 74 LEU HD21 H 4.529 0.006 -5.152 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 938 . 1 1 74 LEU HD22 H 4.782 1.506 -6.010 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 939 . 1 1 74 LEU HD23 H 3.704 0.257 -6.656 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HD23 . . . . . . . . . c18126_2lr2 1 . 1 . 940 . 1 1 74 LEU HG H 3.162 1.535 -3.938 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HG . . . . . . . . . c18126_2lr2 1 . 1 . 941 . 1 1 74 LEU N N 2.018 4.229 -7.554 . . . 1.0 . . . . . . . . . . . . A . 74 LEU N . . . . . . . . . c18126_2lr2 1 . 1 . 942 . 1 1 74 LEU O O 1.498 0.810 -8.041 . . . 1.0 . . . . . . . . . . . . A . 74 LEU O . . . . . . . . . c18126_2lr2 1 . 1 . 943 . 1 1 75 LEU C C -1.015 1.136 -9.378 . . . 1.0 . . . . . . . . . . . . A . 75 LEU C . . . . . . . . . c18126_2lr2 1 . 1 . 944 . 1 1 75 LEU CA C -1.168 1.521 -7.911 . . . 1.0 . . . . . . . . . . . . A . 75 LEU CA . . . . . . . . . c18126_2lr2 1 . 1 . 945 . 1 1 75 LEU CB C -2.521 2.318 -7.755 . . . 1.0 . . . . . . . . . . . . A . 75 LEU CB . . . . . . . . . c18126_2lr2 1 . 1 . 946 . 1 1 75 LEU CD1 C -4.140 0.213 -8.012 . . . 1.0 . . . . . . . . . . . . A . 75 LEU CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 947 . 1 1 75 LEU CD2 C -5.061 2.584 -8.471 . . . 1.0 . . . . . . . . . . . . A . 75 LEU CD2 . . . . . . . . . c18126_2lr2 1 . 1 . 948 . 1 1 75 LEU CG C -3.784 1.642 -8.526 . . . 1.0 . . . . . . . . . . . . A . 75 LEU CG . . . . . . . . . c18126_2lr2 1 . 1 . 949 . 1 1 75 LEU H H -0.219 3.237 -7.106 . . . 1.0 . . . . . . . . . . . . A . 75 LEU H . . . . . . . . . c18126_2lr2 1 . 1 . 950 . 1 1 75 LEU HA H -1.191 0.622 -7.313 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HA . . . . . . . . . c18126_2lr2 1 . 1 . 951 . 1 1 75 LEU HB2 H -2.733 2.379 -6.712 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 952 . 1 1 75 LEU HB3 H -2.375 3.329 -8.122 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 953 . 1 1 75 LEU HD11 H -4.324 0.247 -6.962 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HD11 . . . . . . . . . c18126_2lr2 1 . 1 . 954 . 1 1 75 LEU HD12 H -3.331 -0.476 -8.213 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HD12 . . . . . . . . . c18126_2lr2 1 . 1 . 955 . 1 1 75 LEU HD13 H -5.021 -0.146 -8.520 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HD13 . . . . . . . . . c18126_2lr2 1 . 1 . 956 . 1 1 75 LEU HD21 H -5.798 2.223 -9.174 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 957 . 1 1 75 LEU HD22 H -4.795 3.601 -8.743 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 958 . 1 1 75 LEU HD23 H -5.494 2.588 -7.487 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HD23 . . . . . . . . . c18126_2lr2 1 . 1 . 959 . 1 1 75 LEU HG H -3.535 1.532 -9.571 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HG . . . . . . . . . c18126_2lr2 1 . 1 . 960 . 1 1 75 LEU N N -0.046 2.347 -7.479 . . . 1.0 . . . . . . . . . . . . A . 75 LEU N . . . . . . . . . c18126_2lr2 1 . 1 . 961 . 1 1 75 LEU O O -1.050 -0.044 -9.727 . . . 1.0 . . . . . . . . . . . . A . 75 LEU O . . . . . . . . . c18126_2lr2 1 . 1 . 962 . 1 1 76 ALA C C 0.512 0.988 -11.922 . . . 1.0 . . . . . . . . . . . . A . 76 ALA C . . . . . . . . . c18126_2lr2 1 . 1 . 963 . 1 1 76 ALA CA C -0.689 1.893 -11.663 . . . 1.0 . . . . . . . . . . . . A . 76 ALA CA . . . . . . . . . c18126_2lr2 1 . 1 . 964 . 1 1 76 ALA CB C -0.516 3.261 -12.411 . . . 1.0 . . . . . . . . . . . . A . 76 ALA CB . . . . . . . . . c18126_2lr2 1 . 1 . 965 . 1 1 76 ALA H H -0.826 3.059 -9.899 . . . 1.0 . . . . . . . . . . . . A . 76 ALA H . . . . . . . . . c18126_2lr2 1 . 1 . 966 . 1 1 76 ALA HA H -1.579 1.409 -12.035 . . . 1.0 . . . . . . . . . . . . A . 76 ALA HA . . . . . . . . . c18126_2lr2 1 . 1 . 967 . 1 1 76 ALA HB1 H -1.289 3.955 -12.097 . . . 1.0 . . . . . . . . . . . . A . 76 ALA HB1 . . . . . . . . . c18126_2lr2 1 . 1 . 968 . 1 1 76 ALA HB2 H -0.593 3.117 -13.484 . . . 1.0 . . . . . . . . . . . . A . 76 ALA HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 969 . 1 1 76 ALA HB3 H 0.451 3.695 -12.183 . . . 1.0 . . . . . . . . . . . . A . 76 ALA HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 970 . 1 1 76 ALA N N -0.846 2.139 -10.234 . . . 1.0 . . . . . . . . . . . . A . 76 ALA N . . . . . . . . . c18126_2lr2 1 . 1 . 971 . 1 1 76 ALA O O 0.526 0.219 -12.883 . . . 1.0 . . . . . . . . . . . . A . 76 ALA O . . . . . . . . . c18126_2lr2 1 . 1 . 972 . 1 1 77 GLU C C 2.439 -1.171 -10.789 . . . 1.0 . . . . . . . . . . . . A . 77 GLU C . . . . . . . . . c18126_2lr2 1 . 1 . 973 . 1 1 77 GLU CA C 2.717 0.270 -11.203 . . . 1.0 . . . . . . . . . . . . A . 77 GLU CA . . . . . . . . . c18126_2lr2 1 . 1 . 974 . 1 1 77 GLU CB C 3.918 0.891 -10.363 . . . 1.0 . . . . . . . . . . . . A . 77 GLU CB . . . . . . . . . c18126_2lr2 1 . 1 . 975 . 1 1 77 GLU CD C 6.470 0.721 -9.754 . . . 1.0 . . . . . . . . . . . . A . 77 GLU CD . . . . . . . . . c18126_2lr2 1 . 1 . 976 . 1 1 77 GLU CG C 5.292 0.088 -10.546 . . . 1.0 . . . . . . . . . . . . A . 77 GLU CG . . . . . . . . . c18126_2lr2 1 . 1 . 977 . 1 1 77 GLU H H 1.450 1.715 -10.310 . . . 1.0 . . . . . . . . . . . . A . 77 GLU H . . . . . . . . . c18126_2lr2 1 . 1 . 978 . 1 1 77 GLU HA H 3.028 0.284 -12.236 . . . 1.0 . . . . . . . . . . . . A . 77 GLU HA . . . . . . . . . c18126_2lr2 1 . 1 . 979 . 1 1 77 GLU HB2 H 4.064 1.928 -10.677 . . . 1.0 . . . . . . . . . . . . A . 77 GLU HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 980 . 1 1 77 GLU HB3 H 3.652 0.897 -9.319 . . . 1.0 . . . . . . . . . . . . A . 77 GLU HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 981 . 1 1 77 GLU HG2 H 5.172 -0.940 -10.200 . . . 1.0 . . . . . . . . . . . . A . 77 GLU HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 982 . 1 1 77 GLU HG3 H 5.567 0.066 -11.598 . . . 1.0 . . . . . . . . . . . . A . 77 GLU HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 983 . 1 1 77 GLU N N 1.517 1.085 -11.058 . . . 1.0 . . . . . . . . . . . . A . 77 GLU N . . . . . . . . . c18126_2lr2 1 . 1 . 984 . 1 1 77 GLU O O 2.607 -2.098 -11.581 . . . 1.0 . . . . . . . . . . . . A . 77 GLU O . . . . . . . . . c18126_2lr2 1 . 1 . 985 . 1 1 77 GLU OE1 O 6.349 1.857 -9.319 . . . 1.0 . . . . . . . . . . . . A . 77 GLU OE1 . . . . . . . . . c18126_2lr2 1 . 1 . 986 . 1 1 77 GLU OE2 O 7.482 0.049 -9.602 . . . 1.0 . . . . . . . . . . . . A . 77 GLU OE2 . . . . . . . . . c18126_2lr2 1 . 1 . 987 . 1 1 78 ALA C C 0.741 -3.407 -9.962 . . . 1.0 . . . . . . . . . . . . A . 78 ALA C . . . . . . . . . c18126_2lr2 1 . 1 . 988 . 1 1 78 ALA CA C 1.714 -2.686 -9.035 . . . 1.0 . . . . . . . . . . . . A . 78 ALA CA . . . . . . . . . c18126_2lr2 1 . 1 . 989 . 1 1 78 ALA CB C 1.102 -2.571 -7.613 . . . 1.0 . . . . . . . . . . . . A . 78 ALA CB . . . . . . . . . c18126_2lr2 1 . 1 . 990 . 1 1 78 ALA H H 1.897 -0.576 -8.956 . . . 1.0 . . . . . . . . . . . . A . 78 ALA H . . . . . . . . . c18126_2lr2 1 . 1 . 991 . 1 1 78 ALA HA H 2.631 -3.254 -8.979 . . . 1.0 . . . . . . . . . . . . A . 78 ALA HA . . . . . . . . . c18126_2lr2 1 . 1 . 992 . 1 1 78 ALA HB1 H 0.661 -3.509 -7.302 . . . 1.0 . . . . . . . . . . . . A . 78 ALA HB1 . . . . . . . . . c18126_2lr2 1 . 1 . 993 . 1 1 78 ALA HB2 H 0.341 -1.800 -7.602 . . . 1.0 . . . . . . . . . . . . A . 78 ALA HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 994 . 1 1 78 ALA HB3 H 1.875 -2.309 -6.919 . . . 1.0 . . . . . . . . . . . . A . 78 ALA HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 995 . 1 1 78 ALA N N 2.013 -1.352 -9.543 . . . 1.0 . . . . . . . . . . . . A . 78 ALA N . . . . . . . . . c18126_2lr2 1 . 1 . 996 . 1 1 78 ALA O O 0.861 -4.611 -10.189 . . . 1.0 . . . . . . . . . . . . A . 78 ALA O . . . . . . . . . c18126_2lr2 1 . 1 . 997 . 1 1 79 LYS C C -0.558 -3.651 -12.715 . . . 1.0 . . . . . . . . . . . . A . 79 LYS C . . . . . . . . . c18126_2lr2 1 . 1 . 998 . 1 1 79 LYS CA C -1.210 -3.241 -11.398 . . . 1.0 . . . . . . . . . . . . A . 79 LYS CA . . . . . . . . . c18126_2lr2 1 . 1 . 999 . 1 1 79 LYS CB C -2.377 -2.187 -11.646 . . . 1.0 . . . . . . . . . . . . A . 79 LYS CB . . . . . . . . . c18126_2lr2 1 . 1 . 1000 . 1 1 79 LYS CD C -4.771 -1.700 -12.709 . . . 1.0 . . . . . . . . . . . . A . 79 LYS CD . . . . . . . . . c18126_2lr2 1 . 1 . 1001 . 1 1 79 LYS CE C -5.975 -2.271 -13.559 . . . 1.0 . . . . . . . . . . . . A . 79 LYS CE . . . . . . . . . c18126_2lr2 1 . 1 . 1002 . 1 1 79 LYS CG C -3.589 -2.764 -12.530 . . . 1.0 . . . . . . . . . . . . A . 79 LYS CG . . . . . . . . . c18126_2lr2 1 . 1 . 1003 . 1 1 79 LYS H H -0.268 -1.708 -10.280 . . . 1.0 . . . . . . . . . . . . A . 79 LYS H . . . . . . . . . c18126_2lr2 1 . 1 . 1004 . 1 1 79 LYS HA H -1.640 -4.116 -10.933 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HA . . . . . . . . . c18126_2lr2 1 . 1 . 1005 . 1 1 79 LYS HB2 H -2.766 -1.872 -10.677 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 1006 . 1 1 79 LYS HB3 H -1.958 -1.308 -12.138 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 1007 . 1 1 79 LYS HD2 H -5.151 -1.410 -11.726 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HD2 . . . . . . . . . c18126_2lr2 1 . 1 . 1008 . 1 1 79 LYS HD3 H -4.386 -0.805 -13.197 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HD3 . . . . . . . . . c18126_2lr2 1 . 1 . 1009 . 1 1 79 LYS HE2 H -5.640 -2.527 -14.561 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HE2 . . . . . . . . . c18126_2lr2 1 . 1 . 1010 . 1 1 79 LYS HE3 H -6.389 -3.157 -13.090 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HE3 . . . . . . . . . c18126_2lr2 1 . 1 . 1011 . 1 1 79 LYS HG2 H -3.216 -3.042 -13.515 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 1012 . 1 1 79 LYS HG3 H -3.985 -3.663 -12.052 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 1013 . 1 1 79 LYS HZ1 H -7.958 -1.702 -13.874 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HZ1 . . . . . . . . . c18126_2lr2 1 . 1 . 1014 . 1 1 79 LYS HZ2 H -6.821 -0.579 -14.443 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HZ2 . . . . . . . . . c18126_2lr2 1 . 1 . 1015 . 1 1 79 LYS HZ3 H -7.121 -0.711 -12.776 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HZ3 . . . . . . . . . c18126_2lr2 1 . 1 . 1016 . 1 1 79 LYS N N -0.222 -2.662 -10.496 . . . 1.0 . . . . . . . . . . . . A . 79 LYS N . . . . . . . . . c18126_2lr2 1 . 1 . 1017 . 1 1 79 LYS NZ N -7.050 -1.236 -13.673 . . . 1.0 . . . . . . . . . . . . A . 79 LYS NZ . . . . . . . . . c18126_2lr2 1 . 1 . 1018 . 1 1 79 LYS O O -0.939 -4.652 -13.322 . . . 1.0 . . . . . . . . . . . . A . 79 LYS O . . . . . . . . . c18126_2lr2 1 . 1 . 1019 . 1 1 80 LYS C C 1.906 -4.465 -14.280 . . . 1.0 . . . . . . . . . . . . A . 80 LYS C . . . . . . . . . c18126_2lr2 1 . 1 . 1020 . 1 1 80 LYS CA C 1.123 -3.161 -14.397 . . . 1.0 . . . . . . . . . . . . A . 80 LYS CA . . . . . . . . . c18126_2lr2 1 . 1 . 1021 . 1 1 80 LYS CB C 2.103 -1.980 -14.831 . . . 1.0 . . . . . . . . . . . . A . 80 LYS CB . . . . . . . . . c18126_2lr2 1 . 1 . 1022 . 1 1 80 LYS CD C 2.315 0.518 -15.733 . . . 1.0 . . . . . . . . . . . . A . 80 LYS CD . . . . . . . . . c18126_2lr2 1 . 1 . 1023 . 1 1 80 LYS CE C 1.539 1.792 -16.252 . . . 1.0 . . . . . . . . . . . . A . 80 LYS CE . . . . . . . . . c18126_2lr2 1 . 1 . 1024 . 1 1 80 LYS CG C 1.325 -0.682 -15.337 . . . 1.0 . . . . . . . . . . . . A . 80 LYS CG . . . . . . . . . c18126_2lr2 1 . 1 . 1025 . 1 1 80 LYS H H 0.686 -2.085 -12.624 . . . 1.0 . . . . . . . . . . . . A . 80 LYS H . . . . . . . . . c18126_2lr2 1 . 1 . 1026 . 1 1 80 LYS HA H 0.398 -3.258 -15.191 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HA . . . . . . . . . c18126_2lr2 1 . 1 . 1027 . 1 1 80 LYS HB2 H 2.714 -1.714 -13.982 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 1028 . 1 1 80 LYS HB3 H 2.771 -2.327 -15.624 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 1029 . 1 1 80 LYS HD2 H 2.906 0.809 -14.861 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HD2 . . . . . . . . . c18126_2lr2 1 . 1 . 1030 . 1 1 80 LYS HD3 H 3.003 0.183 -16.505 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HD3 . . . . . . . . . c18126_2lr2 1 . 1 . 1031 . 1 1 80 LYS HE2 H 0.970 1.546 -17.144 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HE2 . . . . . . . . . c18126_2lr2 1 . 1 . 1032 . 1 1 80 LYS HE3 H 0.858 2.160 -15.496 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HE3 . . . . . . . . . c18126_2lr2 1 . 1 . 1033 . 1 1 80 LYS HG2 H 0.730 -0.944 -16.207 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 1034 . 1 1 80 LYS HG3 H 0.643 -0.353 -14.574 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 1035 . 1 1 80 LYS HZ1 H 2.870 2.722 -17.561 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HZ1 . . . . . . . . . c18126_2lr2 1 . 1 . 1036 . 1 1 80 LYS HZ2 H 3.301 2.860 -15.926 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HZ2 . . . . . . . . . c18126_2lr2 1 . 1 . 1037 . 1 1 80 LYS HZ3 H 2.029 3.797 -16.549 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HZ3 . . . . . . . . . c18126_2lr2 1 . 1 . 1038 . 1 1 80 LYS N N 0.425 -2.870 -13.150 . . . 1.0 . . . . . . . . . . . . A . 80 LYS N . . . . . . . . . c18126_2lr2 1 . 1 . 1039 . 1 1 80 LYS NZ N 2.509 2.874 -16.600 . . . 1.0 . . . . . . . . . . . . A . 80 LYS NZ . . . . . . . . . c18126_2lr2 1 . 1 . 1040 . 1 1 80 LYS O O 1.995 -5.235 -15.236 . . . 1.0 . . . . . . . . . . . . A . 80 LYS O . . . . . . . . . c18126_2lr2 1 . 1 . 1041 . 1 1 81 LEU C C 2.320 -7.125 -12.727 . . . 1.0 . . . . . . . . . . . . A . 81 LEU C . . . . . . . . . c18126_2lr2 1 . 1 . 1042 . 1 1 81 LEU CA C 3.245 -5.921 -12.870 . . . 1.0 . . . . . . . . . . . . A . 81 LEU CA . . . . . . . . . c18126_2lr2 1 . 1 . 1043 . 1 1 81 LEU CB C 4.175 -5.763 -11.586 . . . 1.0 . . . . . . . . . . . . A . 81 LEU CB . . . . . . . . . c18126_2lr2 1 . 1 . 1044 . 1 1 81 LEU CD1 C 6.126 -4.358 -10.491 . . . 1.0 . . . . . . . . . . . . A . 81 LEU CD1 . . . . . . . . . c18126_2lr2 1 . 1 . 1045 . 1 1 81 LEU CD2 C 6.422 -5.208 -12.906 . . . 1.0 . . . . . . . . . . . . A . 81 LEU CD2 . . . . . . . . . c18126_2lr2 1 . 1 . 1046 . 1 1 81 LEU CG C 5.373 -4.698 -11.824 . . . 1.0 . . . . . . . . . . . . A . 81 LEU CG . . . . . . . . . c18126_2lr2 1 . 1 . 1047 . 1 1 81 LEU H H 2.367 -4.056 -12.375 . . . 1.0 . . . . . . . . . . . . A . 81 LEU H . . . . . . . . . c18126_2lr2 1 . 1 . 1048 . 1 1 81 LEU HA H 3.903 -6.082 -13.711 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HA . . . . . . . . . c18126_2lr2 1 . 1 . 1049 . 1 1 81 LEU HB2 H 3.556 -5.438 -10.745 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 1050 . 1 1 81 LEU HB3 H 4.604 -6.734 -11.326 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 1051 . 1 1 81 LEU HD11 H 6.943 -3.676 -10.688 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HD11 . . . . . . . . . c18126_2lr2 1 . 1 . 1052 . 1 1 81 LEU HD12 H 6.530 -5.262 -10.046 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HD12 . . . . . . . . . c18126_2lr2 1 . 1 . 1053 . 1 1 81 LEU HD13 H 5.437 -3.878 -9.803 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HD13 . . . . . . . . . c18126_2lr2 1 . 1 . 1054 . 1 1 81 LEU HD21 H 6.611 -6.272 -12.794 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 1055 . 1 1 81 LEU HD22 H 7.358 -4.674 -12.797 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 1056 . 1 1 81 LEU HD23 H 6.038 -5.022 -13.891 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HD23 . . . . . . . . . c18126_2lr2 1 . 1 . 1057 . 1 1 81 LEU HG H 4.941 -3.766 -12.175 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HG . . . . . . . . . c18126_2lr2 1 . 1 . 1058 . 1 1 81 LEU N N 2.472 -4.706 -13.101 . . . 1.0 . . . . . . . . . . . . A . 81 LEU N . . . . . . . . . c18126_2lr2 1 . 1 . 1059 . 1 1 81 LEU O O 2.352 -8.046 -13.543 . . . 1.0 . . . . . . . . . . . . A . 81 LEU O . . . . . . . . . c18126_2lr2 1 . 1 . 1060 . 1 1 82 ASN C C -0.072 -8.666 -12.750 . . . 1.0 . . . . . . . . . . . . A . 82 ASN C . . . . . . . . . c18126_2lr2 1 . 1 . 1061 . 1 1 82 ASN CA C 0.566 -8.208 -11.443 . . . 1.0 . . . . . . . . . . . . A . 82 ASN CA . . . . . . . . . c18126_2lr2 1 . 1 . 1062 . 1 1 82 ASN CB C -0.551 -7.754 -10.461 . . . 1.0 . . . . . . . . . . . . A . 82 ASN CB . . . . . . . . . c18126_2lr2 1 . 1 . 1063 . 1 1 82 ASN CG C -1.646 -8.836 -10.331 . . . 1.0 . . . . . . . . . . . . A . 82 ASN CG . . . . . . . . . c18126_2lr2 1 . 1 . 1064 . 1 1 82 ASN H H 1.515 -6.350 -11.066 . . . 1.0 . . . . . . . . . . . . A . 82 ASN H . . . . . . . . . c18126_2lr2 1 . 1 . 1065 . 1 1 82 ASN HA H 1.105 -9.035 -11.007 . . . 1.0 . . . . . . . . . . . . A . 82 ASN HA . . . . . . . . . c18126_2lr2 1 . 1 . 1066 . 1 1 82 ASN HB2 H -0.109 -7.590 -9.492 . . . 1.0 . . . . . . . . . . . . A . 82 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 1067 . 1 1 82 ASN HB3 H -0.996 -6.820 -10.805 . . . 1.0 . . . . . . . . . . . . A . 82 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 1068 . 1 1 82 ASN HD21 H -3.043 -7.712 -11.180 . . . 1.0 . . . . . . . . . . . . A . 82 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 1 . 1069 . 1 1 82 ASN HD22 H -3.549 -9.257 -10.709 . . . 1.0 . . . . . . . . . . . . A . 82 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 1 . 1070 . 1 1 82 ASN N N 1.497 -7.111 -11.684 . . . 1.0 . . . . . . . . . . . . A . 82 ASN N . . . . . . . . . c18126_2lr2 1 . 1 . 1071 . 1 1 82 ASN ND2 N -2.848 -8.581 -10.772 . . . 1.0 . . . . . . . . . . . . A . 82 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 1 . 1072 . 1 1 82 ASN O O -0.484 -9.818 -12.881 . . . 1.0 . . . . . . . . . . . . A . 82 ASN O . . . . . . . . . c18126_2lr2 1 . 1 . 1073 . 1 1 82 ASN OD1 O -1.379 -9.951 -9.865 . . . 1.0 . . . . . . . . . . . . A . 82 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 1074 . 1 1 83 ASP C C 0.328 -8.584 -15.974 . . . 1.0 . . . . . . . . . . . . A . 83 ASP C . . . . . . . . . c18126_2lr2 1 . 1 . 1075 . 1 1 83 ASP CA C -0.739 -8.078 -15.010 . . . 1.0 . . . . . . . . . . . . A . 83 ASP CA . . . . . . . . . c18126_2lr2 1 . 1 . 1076 . 1 1 83 ASP CB C -1.451 -6.802 -15.602 . . . 1.0 . . . . . . . . . . . . A . 83 ASP CB . . . . . . . . . c18126_2lr2 1 . 1 . 1077 . 1 1 83 ASP CG C -2.740 -6.426 -14.812 . . . 1.0 . . . . . . . . . . . . A . 83 ASP CG . . . . . . . . . c18126_2lr2 1 . 1 . 1078 . 1 1 83 ASP H H 0.196 -6.853 -13.555 . . . 1.0 . . . . . . . . . . . . A . 83 ASP H . . . . . . . . . c18126_2lr2 1 . 1 . 1079 . 1 1 83 ASP HA H -1.483 -8.848 -14.874 . . . 1.0 . . . . . . . . . . . . A . 83 ASP HA . . . . . . . . . c18126_2lr2 1 . 1 . 1080 . 1 1 83 ASP HB2 H -0.766 -5.961 -15.576 . . . 1.0 . . . . . . . . . . . . A . 83 ASP HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 1081 . 1 1 83 ASP HB3 H -1.728 -6.981 -16.639 . . . 1.0 . . . . . . . . . . . . A . 83 ASP HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 1082 . 1 1 83 ASP N N -0.149 -7.756 -13.716 . . . 1.0 . . . . . . . . . . . . A . 83 ASP N . . . . . . . . . c18126_2lr2 1 . 1 . 1083 . 1 1 83 ASP O O 0.073 -9.473 -16.787 . . . 1.0 . . . . . . . . . . . . A . 83 ASP O . . . . . . . . . c18126_2lr2 1 . 1 . 1084 . 1 1 83 ASP OD1 O -3.221 -7.239 -14.031 . . . 1.0 . . . . . . . . . . . . A . 83 ASP OD1 . . . . . . . . . c18126_2lr2 1 . 1 . 1085 . 1 1 83 ASP OD2 O -3.229 -5.324 -15.010 . . . 1.0 . . . . . . . . . . . . A . 83 ASP OD2 . . . . . . . . . c18126_2lr2 1 . 1 . 1086 . 1 1 84 ALA C C 3.246 -9.718 -16.257 . . . 1.0 . . . . . . . . . . . . A . 84 ALA C . . . . . . . . . c18126_2lr2 1 . 1 . 1087 . 1 1 84 ALA CA C 2.624 -8.415 -16.747 . . . 1.0 . . . . . . . . . . . . A . 84 ALA CA . . . . . . . . . c18126_2lr2 1 . 1 . 1088 . 1 1 84 ALA CB C 3.720 -7.296 -16.816 . . . 1.0 . . . . . . . . . . . . A . 84 ALA CB . . . . . . . . . c18126_2lr2 1 . 1 . 1089 . 1 1 84 ALA H H 1.670 -7.309 -15.212 . . . 1.0 . . . . . . . . . . . . A . 84 ALA H . . . . . . . . . c18126_2lr2 1 . 1 . 1090 . 1 1 84 ALA HA H 2.245 -8.562 -17.747 . . . 1.0 . . . . . . . . . . . . A . 84 ALA HA . . . . . . . . . c18126_2lr2 1 . 1 . 1091 . 1 1 84 ALA HB1 H 4.128 -7.113 -15.835 . . . 1.0 . . . . . . . . . . . . A . 84 ALA HB1 . . . . . . . . . c18126_2lr2 1 . 1 . 1092 . 1 1 84 ALA HB2 H 3.285 -6.378 -17.194 . . . 1.0 . . . . . . . . . . . . A . 84 ALA HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 1093 . 1 1 84 ALA HB3 H 4.531 -7.593 -17.479 . . . 1.0 . . . . . . . . . . . . A . 84 ALA HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 1094 . 1 1 84 ALA N N 1.524 -8.013 -15.878 . . . 1.0 . . . . . . . . . . . . A . 84 ALA N . . . . . . . . . c18126_2lr2 1 . 1 . 1095 . 1 1 84 ALA O O 3.801 -10.487 -17.042 . . . 1.0 . . . . . . . . . . . . A . 84 ALA O . . . . . . . . . c18126_2lr2 1 . 1 . 1096 . 1 1 85 GLN C C 2.601 -12.189 -14.088 . . . 1.0 . . . . . . . . . . . . A . 85 GLN C . . . . . . . . . c18126_2lr2 1 . 1 . 1097 . 1 1 85 GLN CA C 3.705 -11.175 -14.368 . . . 1.0 . . . . . . . . . . . . A . 85 GLN CA . . . . . . . . . c18126_2lr2 1 . 1 . 1098 . 1 1 85 GLN CB C 4.484 -10.772 -13.031 . . . 1.0 . . . . . . . . . . . . A . 85 GLN CB . . . . . . . . . c18126_2lr2 1 . 1 . 1099 . 1 1 85 GLN CD C 6.830 -10.484 -14.149 . . . 1.0 . . . . . . . . . . . . A . 85 GLN CD . . . . . . . . . c18126_2lr2 1 . 1 . 1100 . 1 1 85 GLN CG C 5.728 -9.809 -13.294 . . . 1.0 . . . . . . . . . . . . A . 85 GLN CG . . . . . . . . . c18126_2lr2 1 . 1 . 1101 . 1 1 85 GLN H H 2.695 -9.312 -14.376 . . . 1.0 . . . . . . . . . . . . A . 85 GLN H . . . . . . . . . c18126_2lr2 1 . 1 . 1102 . 1 1 85 GLN HA H 4.410 -11.607 -15.062 . . . 1.0 . . . . . . . . . . . . A . 85 GLN HA . . . . . . . . . c18126_2lr2 1 . 1 . 1103 . 1 1 85 GLN HB2 H 3.789 -10.273 -12.353 . . . 1.0 . . . . . . . . . . . . A . 85 GLN HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 1104 . 1 1 85 GLN HB3 H 4.846 -11.678 -12.528 . . . 1.0 . . . . . . . . . . . . A . 85 GLN HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 1105 . 1 1 85 GLN HE21 H 6.934 -9.015 -15.483 . . . 1.0 . . . . . . . . . . . . A . 85 GLN HE21 . . . . . . . . . c18126_2lr2 1 . 1 . 1106 . 1 1 85 GLN HE22 H 7.987 -10.316 -15.759 . . . 1.0 . . . . . . . . . . . . A . 85 GLN HE22 . . . . . . . . . c18126_2lr2 1 . 1 . 1107 . 1 1 85 GLN HG2 H 5.390 -8.905 -13.806 . . . 1.0 . . . . . . . . . . . . A . 85 GLN HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 1108 . 1 1 85 GLN HG3 H 6.162 -9.517 -12.344 . . . 1.0 . . . . . . . . . . . . A . 85 GLN HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 1109 . 1 1 85 GLN N N 3.148 -9.960 -14.953 . . . 1.0 . . . . . . . . . . . . A . 85 GLN N . . . . . . . . . c18126_2lr2 1 . 1 . 1110 . 1 1 85 GLN NE2 N 7.290 -9.889 -15.219 . . . 1.0 . . . . . . . . . . . . A . 85 GLN NE2 . . . . . . . . . c18126_2lr2 1 . 1 . 1111 . 1 1 85 GLN O O 2.739 -13.046 -13.215 . . . 1.0 . . . . . . . . . . . . A . 85 GLN O . . . . . . . . . c18126_2lr2 1 . 1 . 1112 . 1 1 85 GLN OE1 O 7.297 -11.576 -13.812 . . . 1.0 . . . . . . . . . . . . A . 85 GLN OE1 . . . . . . . . . c18126_2lr2 1 . 1 . 1113 . 1 1 86 ALA C C 0.397 -14.080 -15.732 . . . 1.0 . . . . . . . . . . . . A . 86 ALA C . . . . . . . . . c18126_2lr2 1 . 1 . 1114 . 1 1 86 ALA CA C 0.383 -12.999 -14.656 . . . 1.0 . . . . . . . . . . . . A . 86 ALA CA . . . . . . . . . c18126_2lr2 1 . 1 . 1115 . 1 1 86 ALA CB C -0.973 -12.223 -14.732 . . . 1.0 . . . . . . . . . . . . A . 86 ALA CB . . . . . . . . . c18126_2lr2 1 . 1 . 1116 . 1 1 86 ALA H H 1.451 -11.382 -15.514 . . . 1.0 . . . . . . . . . . . . A . 86 ALA H . . . . . . . . . c18126_2lr2 1 . 1 . 1117 . 1 1 86 ALA HA H 0.463 -13.468 -13.687 . . . 1.0 . . . . . . . . . . . . A . 86 ALA HA . . . . . . . . . c18126_2lr2 1 . 1 . 1118 . 1 1 86 ALA HB1 H -0.799 -11.238 -15.087 . . . 1.0 . . . . . . . . . . . . A . 86 ALA HB1 . . . . . . . . . c18126_2lr2 1 . 1 . 1119 . 1 1 86 ALA HB2 H -1.426 -12.172 -13.748 . . . 1.0 . . . . . . . . . . . . A . 86 ALA HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 1120 . 1 1 86 ALA HB3 H -1.665 -12.707 -15.415 . . . 1.0 . . . . . . . . . . . . A . 86 ALA HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 1121 . 1 1 86 ALA N N 1.506 -12.085 -14.833 . . . 1.0 . . . . . . . . . . . . A . 86 ALA N . . . . . . . . . c18126_2lr2 1 . 1 . 1122 . 1 1 86 ALA O O 1.067 -13.945 -16.756 . . . 1.0 . . . . . . . . . . . . A . 86 ALA O . . . . . . . . . c18126_2lr2 1 . 1 . 1123 . 1 1 87 PRO C C -1.116 -15.934 -17.893 . . . 1.0 . . . . . . . . . . . . A . 87 PRO C . . . . . . . . . c18126_2lr2 1 . 1 . 1124 . 1 1 87 PRO CA C -0.354 -16.355 -16.610 . . . 1.0 . . . . . . . . . . . . A . 87 PRO CA . . . . . . . . . c18126_2lr2 1 . 1 . 1125 . 1 1 87 PRO CB C -1.003 -17.565 -15.872 . . . 1.0 . . . . . . . . . . . . A . 87 PRO CB . . . . . . . . . c18126_2lr2 1 . 1 . 1126 . 1 1 87 PRO CD C -1.205 -15.644 -14.378 . . . 1.0 . . . . . . . . . . . . A . 87 PRO CD . . . . . . . . . c18126_2lr2 1 . 1 . 1127 . 1 1 87 PRO CG C -1.935 -16.934 -14.862 . . . 1.0 . . . . . . . . . . . . A . 87 PRO CG . . . . . . . . . c18126_2lr2 1 . 1 . 1128 . 1 1 87 PRO HA H 0.665 -16.622 -16.878 . . . 1.0 . . . . . . . . . . . . A . 87 PRO HA . . . . . . . . . c18126_2lr2 1 . 1 . 1129 . 1 1 87 PRO HB2 H -1.555 -18.193 -16.576 . . . 1.0 . . . . . . . . . . . . A . 87 PRO HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 1130 . 1 1 87 PRO HB3 H -0.243 -18.167 -15.371 . . . 1.0 . . . . . . . . . . . . A . 87 PRO HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 1131 . 1 1 87 PRO HD2 H -1.940 -14.883 -14.137 . . . 1.0 . . . . . . . . . . . . A . 87 PRO HD2 . . . . . . . . . c18126_2lr2 1 . 1 . 1132 . 1 1 87 PRO HD3 H -0.590 -15.849 -13.510 . . . 1.0 . . . . . . . . . . . . A . 87 PRO HD3 . . . . . . . . . c18126_2lr2 1 . 1 . 1133 . 1 1 87 PRO HG2 H -2.900 -16.690 -15.321 . . . 1.0 . . . . . . . . . . . . A . 87 PRO HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 1134 . 1 1 87 PRO HG3 H -2.098 -17.600 -14.017 . . . 1.0 . . . . . . . . . . . . A . 87 PRO HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 1135 . 1 1 87 PRO N N -0.333 -15.242 -15.558 . . . 1.0 . . . . . . . . . . . . A . 87 PRO N . . . . . . . . . c18126_2lr2 1 . 1 . 1136 . 1 1 87 PRO O O -2.023 -15.099 -17.824 . . . 1.0 . . . . . . . . . . . . A . 87 PRO O . . . . . . . . . c18126_2lr2 1 . 1 . 1137 . 1 1 88 LYS C C -2.756 -16.969 -20.459 . . . 1.0 . . . . . . . . . . . . A . 88 LYS C . . . . . . . . . c18126_2lr2 1 . 1 . 1138 . 1 1 88 LYS CA C -1.377 -16.249 -20.367 . . . 1.0 . . . . . . . . . . . . A . 88 LYS CA . . . . . . . . . c18126_2lr2 1 . 1 . 1139 . 1 1 88 LYS CB C -0.421 -16.728 -21.542 . . . 1.0 . . . . . . . . . . . . A . 88 LYS CB . . . . . . . . . c18126_2lr2 1 . 1 . 1140 . 1 1 88 LYS CD C 1.898 -16.340 -22.793 . . . 1.0 . . . . . . . . . . . . A . 88 LYS CD . . . . . . . . . c18126_2lr2 1 . 1 . 1141 . 1 1 88 LYS CE C 3.218 -15.474 -22.864 . . . 1.0 . . . . . . . . . . . . A . 88 LYS CE . . . . . . . . . c18126_2lr2 1 . 1 . 1142 . 1 1 88 LYS CG C 0.920 -15.858 -21.618 . . . 1.0 . . . . . . . . . . . . A . 88 LYS CG . . . . . . . . . c18126_2lr2 1 . 1 . 1143 . 1 1 88 LYS H H -0.012 -17.199 -19.016 . . . 1.0 . . . . . . . . . . . . A . 88 LYS H . . . . . . . . . c18126_2lr2 1 . 1 . 1144 . 1 1 88 LYS HA H -1.550 -15.178 -20.459 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HA . . . . . . . . . c18126_2lr2 1 . 1 . 1145 . 1 1 88 LYS HB2 H -0.165 -17.780 -21.386 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HB2 . . . . . . . . . c18126_2lr2 1 . 1 . 1146 . 1 1 88 LYS HB3 H -0.953 -16.645 -22.494 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HB3 . . . . . . . . . c18126_2lr2 1 . 1 . 1147 . 1 1 88 LYS HD2 H 2.172 -17.385 -22.636 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HD2 . . . . . . . . . c18126_2lr2 1 . 1 . 1148 . 1 1 88 LYS HD3 H 1.380 -16.269 -23.750 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HD3 . . . . . . . . . c18126_2lr2 1 . 1 . 1149 . 1 1 88 LYS HE2 H 2.979 -14.432 -23.061 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HE2 . . . . . . . . . c18126_2lr2 1 . 1 . 1150 . 1 1 88 LYS HE3 H 3.765 -15.537 -21.927 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HE3 . . . . . . . . . c18126_2lr2 1 . 1 . 1151 . 1 1 88 LYS HG2 H 0.658 -14.810 -21.777 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HG2 . . . . . . . . . c18126_2lr2 1 . 1 . 1152 . 1 1 88 LYS HG3 H 1.446 -15.935 -20.662 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HG3 . . . . . . . . . c18126_2lr2 1 . 1 . 1153 . 1 1 88 LYS HZ1 H 4.657 -16.779 -23.625 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HZ1 . . . . . . . . . c18126_2lr2 1 . 1 . 1154 . 1 1 88 LYS HZ2 H 4.736 -15.212 -24.269 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HZ2 . . . . . . . . . c18126_2lr2 1 . 1 . 1155 . 1 1 88 LYS HZ3 H 3.508 -16.273 -24.771 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HZ3 . . . . . . . . . c18126_2lr2 1 . 1 . 1156 . 1 1 88 LYS N N -0.736 -16.536 -19.049 . . . 1.0 . . . . . . . . . . . . A . 88 LYS N . . . . . . . . . c18126_2lr2 1 . 1 . 1157 . 1 1 88 LYS NZ N 4.096 -15.973 -23.967 . . . 1.0 . . . . . . . . . . . . A . 88 LYS NZ . . . . . . . . . c18126_2lr2 1 . 1 . 1158 . 1 1 88 LYS O O -3.029 -17.808 -19.612 . . . 1.0 . . . . . . . . . . . . A . 88 LYS O . . . . . . . . . c18126_2lr2 1 . 1 . 1159 . 1 1 88 LYS OXT O -3.506 -16.666 -21.376 . . . 1.0 . . . . . . . . . . . . A . 88 LYS OXT . . . . . . . . . c18126_2lr2 1 . 2 . 1160 . 1 1 13 GLY C C 1.503 21.585 7.348 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . c18126_2lr2 1 . 2 . 1161 . 1 1 13 GLY CA C 2.023 22.677 6.402 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . c18126_2lr2 1 . 2 . 1162 . 1 1 13 GLY H H 2.286 21.149 5.012 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . c18126_2lr2 1 . 2 . 1163 . 1 1 13 GLY HA2 H 3.023 22.969 6.696 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . c18126_2lr2 1 . 2 . 1164 . 1 1 13 GLY HA3 H 1.370 23.535 6.455 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . c18126_2lr2 1 . 2 . 1165 . 1 1 13 GLY N N 2.060 22.163 5.002 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . c18126_2lr2 1 . 2 . 1166 . 1 1 13 GLY O O 1.910 21.527 8.515 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . c18126_2lr2 1 . 2 . 1167 . 1 1 14 VAL C C 0.258 18.269 6.849 . . . 1.0 . . . . . . . . . . . . A . 14 VAL C . . . . . . . . . c18126_2lr2 1 . 2 . 1168 . 1 1 14 VAL CA C -0.024 19.602 7.596 . . . 1.0 . . . . . . . . . . . . A . 14 VAL CA . . . . . . . . . c18126_2lr2 1 . 2 . 1169 . 1 1 14 VAL CB C -1.598 19.869 7.779 . . . 1.0 . . . . . . . . . . . . A . 14 VAL CB . . . . . . . . . c18126_2lr2 1 . 2 . 1170 . 1 1 14 VAL CG1 C -2.365 18.586 8.338 . . . 1.0 . . . . . . . . . . . . A . 14 VAL CG1 . . . . . . . . . c18126_2lr2 1 . 2 . 1171 . 1 1 14 VAL CG2 C -1.850 21.120 8.745 . . . 1.0 . . . . . . . . . . . . A . 14 VAL CG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1172 . 1 1 14 VAL H H 0.321 20.846 5.888 . . . 1.0 . . . . . . . . . . . . A . 14 VAL H . . . . . . . . . c18126_2lr2 1 . 2 . 1173 . 1 1 14 VAL HA H 0.444 19.533 8.578 . . . 1.0 . . . . . . . . . . . . A . 14 VAL HA . . . . . . . . . c18126_2lr2 1 . 2 . 1174 . 1 1 14 VAL HB H -2.015 20.110 6.791 . . . 1.0 . . . . . . . . . . . . A . 14 VAL HB . . . . . . . . . c18126_2lr2 1 . 2 . 1175 . 1 1 14 VAL HG11 H -1.839 18.176 9.195 . . . 1.0 . . . . . . . . . . . . A . 14 VAL HG11 . . . . . . . . . c18126_2lr2 1 . 2 . 1176 . 1 1 14 VAL HG12 H -2.437 17.823 7.571 . . . 1.0 . . . . . . . . . . . . A . 14 VAL HG12 . . . . . . . . . c18126_2lr2 1 . 2 . 1177 . 1 1 14 VAL HG13 H -3.373 18.856 8.642 . . . 1.0 . . . . . . . . . . . . A . 14 VAL HG13 . . . . . . . . . c18126_2lr2 1 . 2 . 1178 . 1 1 14 VAL HG21 H -1.367 22.012 8.351 . . . 1.0 . . . . . . . . . . . . A . 14 VAL HG21 . . . . . . . . . c18126_2lr2 1 . 2 . 1179 . 1 1 14 VAL HG22 H -1.459 20.920 9.740 . . . 1.0 . . . . . . . . . . . . A . 14 VAL HG22 . . . . . . . . . c18126_2lr2 1 . 2 . 1180 . 1 1 14 VAL HG23 H -2.913 21.318 8.826 . . . 1.0 . . . . . . . . . . . . A . 14 VAL HG23 . . . . . . . . . c18126_2lr2 1 . 2 . 1181 . 1 1 14 VAL N N 0.590 20.724 6.825 . . . 1.0 . . . . . . . . . . . . A . 14 VAL N . . . . . . . . . c18126_2lr2 1 . 2 . 1182 . 1 1 14 VAL O O 0.033 18.177 5.639 . . . 1.0 . . . . . . . . . . . . A . 14 VAL O . . . . . . . . . c18126_2lr2 1 . 2 . 1183 . 1 1 15 ASP C C -0.251 15.071 6.821 . . . 1.0 . . . . . . . . . . . . A . 15 ASP C . . . . . . . . . c18126_2lr2 1 . 2 . 1184 . 1 1 15 ASP CA C 1.059 15.879 7.076 . . . 1.0 . . . . . . . . . . . . A . 15 ASP CA . . . . . . . . . c18126_2lr2 1 . 2 . 1185 . 1 1 15 ASP CB C 2.037 15.118 8.063 . . . 1.0 . . . . . . . . . . . . A . 15 ASP CB . . . . . . . . . c18126_2lr2 1 . 2 . 1186 . 1 1 15 ASP CG C 1.438 14.899 9.480 . . . 1.0 . . . . . . . . . . . . A . 15 ASP CG . . . . . . . . . c18126_2lr2 1 . 2 . 1187 . 1 1 15 ASP H H 0.876 17.403 8.569 . . . 1.0 . . . . . . . . . . . . A . 15 ASP H . . . . . . . . . c18126_2lr2 1 . 2 . 1188 . 1 1 15 ASP HA H 1.574 15.998 6.114 . . . 1.0 . . . . . . . . . . . . A . 15 ASP HA . . . . . . . . . c18126_2lr2 1 . 2 . 1189 . 1 1 15 ASP HB2 H 2.294 14.148 7.646 . . . 1.0 . . . . . . . . . . . . A . 15 ASP HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1190 . 1 1 15 ASP HB3 H 2.951 15.697 8.167 . . . 1.0 . . . . . . . . . . . . A . 15 ASP HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1191 . 1 1 15 ASP N N 0.740 17.239 7.610 . . . 1.0 . . . . . . . . . . . . A . 15 ASP N . . . . . . . . . c18126_2lr2 1 . 2 . 1192 . 1 1 15 ASP O O -1.258 15.281 7.512 . . . 1.0 . . . . . . . . . . . . A . 15 ASP O . . . . . . . . . c18126_2lr2 1 . 2 . 1193 . 1 1 15 ASP OD1 O 0.359 15.412 9.762 . . . 1.0 . . . . . . . . . . . . A . 15 ASP OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1194 . 1 1 15 ASP OD2 O 2.081 14.227 10.274 . . . 1.0 . . . . . . . . . . . . A . 15 ASP OD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1195 . 1 1 16 ASN C C -1.309 11.927 6.099 . . . 1.0 . . . . . . . . . . . . A . 16 ASN C . . . . . . . . . c18126_2lr2 1 . 2 . 1196 . 1 1 16 ASN CA C -1.373 13.315 5.394 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CA . . . . . . . . . c18126_2lr2 1 . 2 . 1197 . 1 1 16 ASN CB C -1.343 13.162 3.829 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CB . . . . . . . . . c18126_2lr2 1 . 2 . 1198 . 1 1 16 ASN CG C -2.580 12.396 3.283 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CG . . . . . . . . . c18126_2lr2 1 . 2 . 1199 . 1 1 16 ASN H H 0.631 14.067 5.301 . . . 1.0 . . . . . . . . . . . . A . 16 ASN H . . . . . . . . . c18126_2lr2 1 . 2 . 1200 . 1 1 16 ASN HA H -2.303 13.809 5.673 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HA . . . . . . . . . c18126_2lr2 1 . 2 . 1201 . 1 1 16 ASN HB2 H -1.315 14.150 3.373 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1202 . 1 1 16 ASN HB3 H -0.446 12.635 3.535 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1203 . 1 1 16 ASN HD21 H -2.277 12.940 1.399 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 1204 . 1 1 16 ASN HD22 H -3.626 11.953 1.663 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 1205 . 1 1 16 ASN N N -0.211 14.164 5.805 . . . 1.0 . . . . . . . . . . . . A . 16 ASN N . . . . . . . . . c18126_2lr2 1 . 2 . 1206 . 1 1 16 ASN ND2 N -2.852 12.434 2.008 . . . 1.0 . . . . . . . . . . . . A . 16 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 2 . 1207 . 1 1 16 ASN O O -0.488 11.067 5.750 . . . 1.0 . . . . . . . . . . . . A . 16 ASN O . . . . . . . . . c18126_2lr2 1 . 2 . 1208 . 1 1 16 ASN OD1 O -3.308 11.740 4.036 . . . 1.0 . . . . . . . . . . . . A . 16 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1209 . 1 1 17 LYS C C -2.642 9.247 7.132 . . . 1.0 . . . . . . . . . . . . A . 17 LYS C . . . . . . . . . c18126_2lr2 1 . 2 . 1210 . 1 1 17 LYS CA C -2.245 10.512 7.955 . . . 1.0 . . . . . . . . . . . . A . 17 LYS CA . . . . . . . . . c18126_2lr2 1 . 2 . 1211 . 1 1 17 LYS CB C -3.344 10.773 9.071 . . . 1.0 . . . . . . . . . . . . A . 17 LYS CB . . . . . . . . . c18126_2lr2 1 . 2 . 1212 . 1 1 17 LYS CD C -4.006 12.223 11.198 . . . 1.0 . . . . . . . . . . . . A . 17 LYS CD . . . . . . . . . c18126_2lr2 1 . 2 . 1213 . 1 1 17 LYS CE C -3.558 13.390 12.164 . . . 1.0 . . . . . . . . . . . . A . 17 LYS CE . . . . . . . . . c18126_2lr2 1 . 2 . 1214 . 1 1 17 LYS CG C -2.907 11.931 10.072 . . . 1.0 . . . . . . . . . . . . A . 17 LYS CG . . . . . . . . . c18126_2lr2 1 . 2 . 1215 . 1 1 17 LYS H H -2.787 12.496 7.347 . . . 1.0 . . . . . . . . . . . . A . 17 LYS H . . . . . . . . . c18126_2lr2 1 . 2 . 1216 . 1 1 17 LYS HA H -1.288 10.332 8.428 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HA . . . . . . . . . c18126_2lr2 1 . 2 . 1217 . 1 1 17 LYS HB2 H -4.299 11.037 8.596 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1218 . 1 1 17 LYS HB3 H -3.491 9.863 9.641 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1219 . 1 1 17 LYS HD2 H -4.951 12.497 10.726 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1220 . 1 1 17 LYS HD3 H -4.175 11.319 11.786 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HD3 . . . . . . . . . c18126_2lr2 1 . 2 . 1221 . 1 1 17 LYS HE2 H -2.642 13.150 12.662 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1222 . 1 1 17 LYS HE3 H -3.406 14.301 11.599 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HE3 . . . . . . . . . c18126_2lr2 1 . 2 . 1223 . 1 1 17 LYS HG2 H -1.972 11.653 10.543 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1224 . 1 1 17 LYS HG3 H -2.731 12.844 9.504 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 1225 . 1 1 17 LYS HZ1 H -5.440 14.059 12.742 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HZ1 . . . . . . . . . c18126_2lr2 1 . 2 . 1226 . 1 1 17 LYS HZ2 H -4.231 14.301 13.905 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HZ2 . . . . . . . . . c18126_2lr2 1 . 2 . 1227 . 1 1 17 LYS HZ3 H -4.864 12.744 13.653 . . . 1.0 . . . . . . . . . . . . A . 17 LYS HZ3 . . . . . . . . . c18126_2lr2 1 . 2 . 1228 . 1 1 17 LYS N N -2.182 11.746 7.117 . . . 1.0 . . . . . . . . . . . . A . 17 LYS N . . . . . . . . . c18126_2lr2 1 . 2 . 1229 . 1 1 17 LYS NZ N -4.604 13.643 13.193 . . . 1.0 . . . . . . . . . . . . A . 17 LYS NZ . . . . . . . . . c18126_2lr2 1 . 2 . 1230 . 1 1 17 LYS O O -2.028 8.193 7.288 . . . 1.0 . . . . . . . . . . . . A . 17 LYS O . . . . . . . . . c18126_2lr2 1 . 2 . 1231 . 1 1 18 PHE C C -5.202 8.783 4.524 . . . 1.0 . . . . . . . . . . . . A . 18 PHE C . . . . . . . . . c18126_2lr2 1 . 2 . 1232 . 1 1 18 PHE CA C -4.129 8.213 5.403 . . . 1.0 . . . . . . . . . . . . A . 18 PHE CA . . . . . . . . . c18126_2lr2 1 . 2 . 1233 . 1 1 18 PHE CB C -4.747 7.016 6.317 . . . 1.0 . . . . . . . . . . . . A . 18 PHE CB . . . . . . . . . c18126_2lr2 1 . 2 . 1234 . 1 1 18 PHE CD1 C -5.800 8.021 8.465 . . . 1.0 . . . . . . . . . . . . A . 18 PHE CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1235 . 1 1 18 PHE CD2 C -7.330 7.304 6.693 . . . 1.0 . . . . . . . . . . . . A . 18 PHE CD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1236 . 1 1 18 PHE CE1 C -6.895 8.447 9.230 . . . 1.0 . . . . . . . . . . . . A . 18 PHE CE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1237 . 1 1 18 PHE CE2 C -8.415 7.748 7.466 . . . 1.0 . . . . . . . . . . . . A . 18 PHE CE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1238 . 1 1 18 PHE CG C -5.987 7.445 7.189 . . . 1.0 . . . . . . . . . . . . A . 18 PHE CG . . . . . . . . . c18126_2lr2 1 . 2 . 1239 . 1 1 18 PHE CZ C -8.200 8.319 8.730 . . . 1.0 . . . . . . . . . . . . A . 18 PHE CZ . . . . . . . . . c18126_2lr2 1 . 2 . 1240 . 1 1 18 PHE H H -4.129 10.205 6.182 . . . 1.0 . . . . . . . . . . . . A . 18 PHE H . . . . . . . . . c18126_2lr2 1 . 2 . 1241 . 1 1 18 PHE HA H -3.320 7.854 4.779 . . . 1.0 . . . . . . . . . . . . A . 18 PHE HA . . . . . . . . . c18126_2lr2 1 . 2 . 1242 . 1 1 18 PHE HB2 H -5.078 6.231 5.676 . . . 1.0 . . . . . . . . . . . . A . 18 PHE HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1243 . 1 1 18 PHE HB3 H -3.977 6.614 6.971 . . . 1.0 . . . . . . . . . . . . A . 18 PHE HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1244 . 1 1 18 PHE HD1 H -4.805 8.105 8.873 . . . 1.0 . . . . . . . . . . . . A . 18 PHE HD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1245 . 1 1 18 PHE HD2 H -7.518 6.849 5.722 . . . 1.0 . . . . . . . . . . . . A . 18 PHE HD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1246 . 1 1 18 PHE HE1 H -6.729 8.896 10.205 . . . 1.0 . . . . . . . . . . . . A . 18 PHE HE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1247 . 1 1 18 PHE HE2 H -9.429 7.646 7.082 . . . 1.0 . . . . . . . . . . . . A . 18 PHE HE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1248 . 1 1 18 PHE HZ H -9.043 8.670 9.317 . . . 1.0 . . . . . . . . . . . . A . 18 PHE HZ . . . . . . . . . c18126_2lr2 1 . 2 . 1249 . 1 1 18 PHE N N -3.661 9.353 6.255 . . . 1.0 . . . . . . . . . . . . A . 18 PHE N . . . . . . . . . c18126_2lr2 1 . 2 . 1250 . 1 1 18 PHE O O -6.276 9.009 5.081 . . . 1.0 . . . . . . . . . . . . A . 18 PHE O . . . . . . . . . c18126_2lr2 1 . 2 . 1251 . 1 1 19 ASN C C -7.261 8.737 2.154 . . . 1.0 . . . . . . . . . . . . A . 19 ASN C . . . . . . . . . c18126_2lr2 1 . 2 . 1252 . 1 1 19 ASN CA C -6.375 9.772 2.842 . . . 1.0 . . . . . . . . . . . . A . 19 ASN CA . . . . . . . . . c18126_2lr2 1 . 2 . 1253 . 1 1 19 ASN CB C -6.077 11.038 1.916 . . . 1.0 . . . . . . . . . . . . A . 19 ASN CB . . . . . . . . . c18126_2lr2 1 . 2 . 1254 . 1 1 19 ASN CG C -5.319 10.669 0.613 . . . 1.0 . . . . . . . . . . . . A . 19 ASN CG . . . . . . . . . c18126_2lr2 1 . 2 . 1255 . 1 1 19 ASN H H -4.340 9.232 2.609 . . . 1.0 . . . . . . . . . . . . A . 19 ASN H . . . . . . . . . c18126_2lr2 1 . 2 . 1256 . 1 1 19 ASN HA H -6.878 10.131 3.728 . . . 1.0 . . . . . . . . . . . . A . 19 ASN HA . . . . . . . . . c18126_2lr2 1 . 2 . 1257 . 1 1 19 ASN HB2 H -7.000 11.540 1.646 . . . 1.0 . . . . . . . . . . . . A . 19 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1258 . 1 1 19 ASN HB3 H -5.476 11.735 2.475 . . . 1.0 . . . . . . . . . . . . A . 19 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1259 . 1 1 19 ASN HD21 H -4.860 12.532 0.131 . . . 1.0 . . . . . . . . . . . . A . 19 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 1260 . 1 1 19 ASN HD22 H -4.302 11.346 -0.948 . . . 1.0 . . . . . . . . . . . . A . 19 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 1261 . 1 1 19 ASN N N -5.099 9.181 3.226 . . . 1.0 . . . . . . . . . . . . A . 19 ASN N . . . . . . . . . c18126_2lr2 1 . 2 . 1262 . 1 1 19 ASN ND2 N -4.786 11.597 -0.129 . . . 1.0 . . . . . . . . . . . . A . 19 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 2 . 1263 . 1 1 19 ASN O O -7.073 7.534 2.327 . . . 1.0 . . . . . . . . . . . . A . 19 ASN O . . . . . . . . . c18126_2lr2 1 . 2 . 1264 . 1 1 19 ASN OD1 O -5.208 9.504 0.253 . . . 1.0 . . . . . . . . . . . . A . 19 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1265 . 1 1 20 LYS C C -8.499 7.832 -0.633 . . . 1.0 . . . . . . . . . . . . A . 20 LYS C . . . . . . . . . c18126_2lr2 1 . 2 . 1266 . 1 1 20 LYS CA C -9.133 8.321 0.665 . . . 1.0 . . . . . . . . . . . . A . 20 LYS CA . . . . . . . . . c18126_2lr2 1 . 2 . 1267 . 1 1 20 LYS CB C -10.508 9.093 0.397 . . . 1.0 . . . . . . . . . . . . A . 20 LYS CB . . . . . . . . . c18126_2lr2 1 . 2 . 1268 . 1 1 20 LYS CD C -11.709 11.206 -0.708 . . . 1.0 . . . . . . . . . . . . A . 20 LYS CD . . . . . . . . . c18126_2lr2 1 . 2 . 1269 . 1 1 20 LYS CE C -11.526 12.504 -1.593 . . . 1.0 . . . . . . . . . . . . A . 20 LYS CE . . . . . . . . . c18126_2lr2 1 . 2 . 1270 . 1 1 20 LYS CG C -10.339 10.410 -0.515 . . . 1.0 . . . . . . . . . . . . A . 20 LYS CG . . . . . . . . . c18126_2lr2 1 . 2 . 1271 . 1 1 20 LYS H H -8.327 10.185 1.274 . . . 1.0 . . . . . . . . . . . . A . 20 LYS H . . . . . . . . . c18126_2lr2 1 . 2 . 1272 . 1 1 20 LYS HA H -9.347 7.470 1.294 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HA . . . . . . . . . c18126_2lr2 1 . 2 . 1273 . 1 1 20 LYS HB2 H -11.205 8.410 -0.099 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1274 . 1 1 20 LYS HB3 H -10.942 9.371 1.356 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1275 . 1 1 20 LYS HD2 H -12.440 10.555 -1.186 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1276 . 1 1 20 LYS HD3 H -12.103 11.500 0.266 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HD3 . . . . . . . . . c18126_2lr2 1 . 2 . 1277 . 1 1 20 LYS HE2 H -10.819 13.185 -1.130 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1278 . 1 1 20 LYS HE3 H -11.162 12.240 -2.586 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HE3 . . . . . . . . . c18126_2lr2 1 . 2 . 1279 . 1 1 20 LYS HG2 H -9.604 11.074 -0.056 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1280 . 1 1 20 LYS HG3 H -9.971 10.127 -1.497 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 1281 . 1 1 20 LYS HZ1 H -12.875 14.004 -1.076 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HZ1 . . . . . . . . . c18126_2lr2 1 . 2 . 1282 . 1 1 20 LYS HZ2 H -13.609 12.542 -1.522 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HZ2 . . . . . . . . . c18126_2lr2 1 . 2 . 1283 . 1 1 20 LYS HZ3 H -12.938 13.552 -2.712 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HZ3 . . . . . . . . . c18126_2lr2 1 . 2 . 1284 . 1 1 20 LYS N N -8.225 9.215 1.375 . . . 1.0 . . . . . . . . . . . . A . 20 LYS N . . . . . . . . . c18126_2lr2 1 . 2 . 1285 . 1 1 20 LYS NZ N -12.837 13.203 -1.738 . . . 1.0 . . . . . . . . . . . . A . 20 LYS NZ . . . . . . . . . c18126_2lr2 1 . 2 . 1286 . 1 1 20 LYS O O -8.491 6.635 -0.919 . . . 1.0 . . . . . . . . . . . . A . 20 LYS O . . . . . . . . . c18126_2lr2 1 . 2 . 1287 . 1 1 21 GLU C C -6.308 7.311 -2.480 . . . 1.0 . . . . . . . . . . . . A . 21 GLU C . . . . . . . . . c18126_2lr2 1 . 2 . 1288 . 1 1 21 GLU CA C -7.336 8.419 -2.682 . . . 1.0 . . . . . . . . . . . . A . 21 GLU CA . . . . . . . . . c18126_2lr2 1 . 2 . 1289 . 1 1 21 GLU CB C -6.643 9.703 -3.305 . . . 1.0 . . . . . . . . . . . . A . 21 GLU CB . . . . . . . . . c18126_2lr2 1 . 2 . 1290 . 1 1 21 GLU CD C -5.358 10.693 -5.371 . . . 1.0 . . . . . . . . . . . . A . 21 GLU CD . . . . . . . . . c18126_2lr2 1 . 2 . 1291 . 1 1 21 GLU CG C -5.996 9.426 -4.744 . . . 1.0 . . . . . . . . . . . . A . 21 GLU CG . . . . . . . . . c18126_2lr2 1 . 2 . 1292 . 1 1 21 GLU H H -8.006 9.706 -1.137 . . . 1.0 . . . . . . . . . . . . A . 21 GLU H . . . . . . . . . c18126_2lr2 1 . 2 . 1293 . 1 1 21 GLU HA H -8.093 8.074 -3.369 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HA . . . . . . . . . c18126_2lr2 1 . 2 . 1294 . 1 1 21 GLU HB2 H -7.393 10.491 -3.389 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1295 . 1 1 21 GLU HB3 H -5.866 10.054 -2.622 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1296 . 1 1 21 GLU HG2 H -5.220 8.673 -4.663 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1297 . 1 1 21 GLU HG3 H -6.759 9.057 -5.426 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 1298 . 1 1 21 GLU N N -7.970 8.767 -1.415 . . . 1.0 . . . . . . . . . . . . A . 21 GLU N . . . . . . . . . c18126_2lr2 1 . 2 . 1299 . 1 1 21 GLU O O -6.052 6.517 -3.385 . . . 1.0 . . . . . . . . . . . . A . 21 GLU O . . . . . . . . . c18126_2lr2 1 . 2 . 1300 . 1 1 21 GLU OE1 O -5.629 11.789 -4.900 . . . 1.0 . . . . . . . . . . . . A . 21 GLU OE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1301 . 1 1 21 GLU OE2 O -4.610 10.541 -6.328 . . . 1.0 . . . . . . . . . . . . A . 21 GLU OE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1302 . 1 1 22 GLN C C -5.395 4.935 -0.589 . . . 1.0 . . . . . . . . . . . . A . 22 GLN C . . . . . . . . . c18126_2lr2 1 . 2 . 1303 . 1 1 22 GLN CA C -4.723 6.248 -0.978 . . . 1.0 . . . . . . . . . . . . A . 22 GLN CA . . . . . . . . . c18126_2lr2 1 . 2 . 1304 . 1 1 22 GLN CB C -3.847 6.763 0.229 . . . 1.0 . . . . . . . . . . . . A . 22 GLN CB . . . . . . . . . c18126_2lr2 1 . 2 . 1305 . 1 1 22 GLN CD C -2.231 4.748 0.440 . . . 1.0 . . . . . . . . . . . . A . 22 GLN CD . . . . . . . . . c18126_2lr2 1 . 2 . 1306 . 1 1 22 GLN CG C -3.287 5.597 1.118 . . . 1.0 . . . . . . . . . . . . A . 22 GLN CG . . . . . . . . . c18126_2lr2 1 . 2 . 1307 . 1 1 22 GLN H H -5.966 7.922 -0.605 . . . 1.0 . . . . . . . . . . . . A . 22 GLN H . . . . . . . . . c18126_2lr2 1 . 2 . 1308 . 1 1 22 GLN HA H -4.109 6.082 -1.852 . . . 1.0 . . . . . . . . . . . . A . 22 GLN HA . . . . . . . . . c18126_2lr2 1 . 2 . 1309 . 1 1 22 GLN HB2 H -3.022 7.340 -0.162 . . . 1.0 . . . . . . . . . . . . A . 22 GLN HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1310 . 1 1 22 GLN HB3 H -4.450 7.411 0.859 . . . 1.0 . . . . . . . . . . . . A . 22 GLN HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1311 . 1 1 22 GLN HE21 H -3.368 3.134 0.419 . . . 1.0 . . . . . . . . . . . . A . 22 GLN HE21 . . . . . . . . . c18126_2lr2 1 . 2 . 1312 . 1 1 22 GLN HE22 H -1.837 2.941 -0.260 . . . 1.0 . . . . . . . . . . . . A . 22 GLN HE22 . . . . . . . . . c18126_2lr2 1 . 2 . 1313 . 1 1 22 GLN HG2 H -2.853 6.024 1.987 . . . 1.0 . . . . . . . . . . . . A . 22 GLN HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1314 . 1 1 22 GLN HG3 H -4.093 4.948 1.452 . . . 1.0 . . . . . . . . . . . . A . 22 GLN HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 1315 . 1 1 22 GLN N N -5.722 7.263 -1.288 . . . 1.0 . . . . . . . . . . . . A . 22 GLN N . . . . . . . . . c18126_2lr2 1 . 2 . 1316 . 1 1 22 GLN NE2 N -2.500 3.505 0.179 . . . 1.0 . . . . . . . . . . . . A . 22 GLN NE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1317 . 1 1 22 GLN O O -5.161 3.899 -1.210 . . . 1.0 . . . . . . . . . . . . A . 22 GLN O . . . . . . . . . c18126_2lr2 1 . 2 . 1318 . 1 1 22 GLN OE1 O -1.165 5.240 0.096 . . . 1.0 . . . . . . . . . . . . A . 22 GLN OE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1319 . 1 1 23 GLN C C -7.560 3.052 -0.269 . . . 1.0 . . . . . . . . . . . . A . 23 GLN C . . . . . . . . . c18126_2lr2 1 . 2 . 1320 . 1 1 23 GLN CA C -6.934 3.796 0.906 . . . 1.0 . . . . . . . . . . . . A . 23 GLN CA . . . . . . . . . c18126_2lr2 1 . 2 . 1321 . 1 1 23 GLN CB C -8.086 4.161 1.939 . . . 1.0 . . . . . . . . . . . . A . 23 GLN CB . . . . . . . . . c18126_2lr2 1 . 2 . 1322 . 1 1 23 GLN CD C -9.831 3.195 3.657 . . . 1.0 . . . . . . . . . . . . A . 23 GLN CD . . . . . . . . . c18126_2lr2 1 . 2 . 1323 . 1 1 23 GLN CG C -8.816 2.856 2.534 . . . 1.0 . . . . . . . . . . . . A . 23 GLN CG . . . . . . . . . c18126_2lr2 1 . 2 . 1324 . 1 1 23 GLN H H -6.380 5.842 0.899 . . . 1.0 . . . . . . . . . . . . A . 23 GLN H . . . . . . . . . c18126_2lr2 1 . 2 . 1325 . 1 1 23 GLN HA H -6.228 3.144 1.399 . . . 1.0 . . . . . . . . . . . . A . 23 GLN HA . . . . . . . . . c18126_2lr2 1 . 2 . 1326 . 1 1 23 GLN HB2 H -7.654 4.741 2.752 . . . 1.0 . . . . . . . . . . . . A . 23 GLN HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1327 . 1 1 23 GLN HB3 H -8.826 4.788 1.436 . . . 1.0 . . . . . . . . . . . . A . 23 GLN HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1328 . 1 1 23 GLN HE21 H -10.716 1.407 3.619 . . . 1.0 . . . . . . . . . . . . A . 23 GLN HE21 . . . . . . . . . c18126_2lr2 1 . 2 . 1329 . 1 1 23 GLN HE22 H -11.343 2.509 4.749 . . . 1.0 . . . . . . . . . . . . A . 23 GLN HE22 . . . . . . . . . c18126_2lr2 1 . 2 . 1330 . 1 1 23 GLN HG2 H -9.356 2.333 1.745 . . . 1.0 . . . . . . . . . . . . A . 23 GLN HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1331 . 1 1 23 GLN HG3 H -8.068 2.180 2.943 . . . 1.0 . . . . . . . . . . . . A . 23 GLN HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 1332 . 1 1 23 GLN N N -6.232 4.988 0.442 . . . 1.0 . . . . . . . . . . . . A . 23 GLN N . . . . . . . . . c18126_2lr2 1 . 2 . 1333 . 1 1 23 GLN NE2 N -10.703 2.296 4.040 . . . 1.0 . . . . . . . . . . . . A . 23 GLN NE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1334 . 1 1 23 GLN O O -7.551 1.822 -0.313 . . . 1.0 . . . . . . . . . . . . A . 23 GLN O . . . . . . . . . c18126_2lr2 1 . 2 . 1335 . 1 1 23 GLN OE1 O -9.813 4.289 4.219 . . . 1.0 . . . . . . . . . . . . A . 23 GLN OE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1336 . 1 1 24 ASN C C -7.726 2.361 -3.164 . . . 1.0 . . . . . . . . . . . . A . 24 ASN C . . . . . . . . . c18126_2lr2 1 . 2 . 1337 . 1 1 24 ASN CA C -8.732 3.207 -2.391 . . . 1.0 . . . . . . . . . . . . A . 24 ASN CA . . . . . . . . . c18126_2lr2 1 . 2 . 1338 . 1 1 24 ASN CB C -9.319 4.358 -3.300 . . . 1.0 . . . . . . . . . . . . A . 24 ASN CB . . . . . . . . . c18126_2lr2 1 . 2 . 1339 . 1 1 24 ASN CG C -10.637 4.948 -2.718 . . . 1.0 . . . . . . . . . . . . A . 24 ASN CG . . . . . . . . . c18126_2lr2 1 . 2 . 1340 . 1 1 24 ASN H H -8.081 4.782 -1.131 . . . 1.0 . . . . . . . . . . . . A . 24 ASN H . . . . . . . . . c18126_2lr2 1 . 2 . 1341 . 1 1 24 ASN HA H -9.545 2.576 -2.067 . . . 1.0 . . . . . . . . . . . . A . 24 ASN HA . . . . . . . . . c18126_2lr2 1 . 2 . 1342 . 1 1 24 ASN HB2 H -8.586 5.154 -3.394 . . . 1.0 . . . . . . . . . . . . A . 24 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1343 . 1 1 24 ASN HB3 H -9.530 3.969 -4.296 . . . 1.0 . . . . . . . . . . . . A . 24 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1344 . 1 1 24 ASN HD21 H -10.562 6.598 -3.819 . . . 1.0 . . . . . . . . . . . . A . 24 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 1345 . 1 1 24 ASN HD22 H -11.893 6.478 -2.773 . . . 1.0 . . . . . . . . . . . . A . 24 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 1346 . 1 1 24 ASN N N -8.103 3.806 -1.219 . . . 1.0 . . . . . . . . . . . . A . 24 ASN N . . . . . . . . . c18126_2lr2 1 . 2 . 1347 . 1 1 24 ASN ND2 N -11.067 6.105 -3.139 . . . 1.0 . . . . . . . . . . . . A . 24 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 2 . 1348 . 1 1 24 ASN O O -8.011 1.222 -3.533 . . . 1.0 . . . . . . . . . . . . A . 24 ASN O . . . . . . . . . c18126_2lr2 1 . 2 . 1349 . 1 1 24 ASN OD1 O -11.291 4.338 -1.866 . . . 1.0 . . . . . . . . . . . . A . 24 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1350 . 1 1 25 ALA C C -4.962 1.057 -3.306 . . . 1.0 . . . . . . . . . . . . A . 25 ALA C . . . . . . . . . c18126_2lr2 1 . 2 . 1351 . 1 1 25 ALA CA C -5.507 2.214 -4.139 . . . 1.0 . . . . . . . . . . . . A . 25 ALA CA . . . . . . . . . c18126_2lr2 1 . 2 . 1352 . 1 1 25 ALA CB C -4.391 3.235 -4.468 . . . 1.0 . . . . . . . . . . . . A . 25 ALA CB . . . . . . . . . c18126_2lr2 1 . 2 . 1353 . 1 1 25 ALA H H -6.376 3.837 -3.088 . . . 1.0 . . . . . . . . . . . . A . 25 ALA H . . . . . . . . . c18126_2lr2 1 . 2 . 1354 . 1 1 25 ALA HA H -5.926 1.821 -5.052 . . . 1.0 . . . . . . . . . . . . A . 25 ALA HA . . . . . . . . . c18126_2lr2 1 . 2 . 1355 . 1 1 25 ALA HB1 H -4.626 3.771 -5.376 . . . 1.0 . . . . . . . . . . . . A . 25 ALA HB1 . . . . . . . . . c18126_2lr2 1 . 2 . 1356 . 1 1 25 ALA HB2 H -3.441 2.733 -4.582 . . . 1.0 . . . . . . . . . . . . A . 25 ALA HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1357 . 1 1 25 ALA HB3 H -4.312 3.947 -3.667 . . . 1.0 . . . . . . . . . . . . A . 25 ALA HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1358 . 1 1 25 ALA N N -6.547 2.926 -3.407 . . . 1.0 . . . . . . . . . . . . A . 25 ALA N . . . . . . . . . c18126_2lr2 1 . 2 . 1359 . 1 1 25 ALA O O -4.624 0.001 -3.839 . . . 1.0 . . . . . . . . . . . . A . 25 ALA O . . . . . . . . . c18126_2lr2 1 . 2 . 1360 . 1 1 26 PHE C C -5.193 -1.047 -1.240 . . . 1.0 . . . . . . . . . . . . A . 26 PHE C . . . . . . . . . c18126_2lr2 1 . 2 . 1361 . 1 1 26 PHE CA C -4.375 0.233 -1.099 . . . 1.0 . . . . . . . . . . . . A . 26 PHE CA . . . . . . . . . c18126_2lr2 1 . 2 . 1362 . 1 1 26 PHE CB C -4.486 0.672 0.414 . . . 1.0 . . . . . . . . . . . . A . 26 PHE CB . . . . . . . . . c18126_2lr2 1 . 2 . 1363 . 1 1 26 PHE CD1 C -2.689 -0.797 1.574 . . . 1.0 . . . . . . . . . . . . A . 26 PHE CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1364 . 1 1 26 PHE CD2 C -5.029 -1.221 2.132 . . . 1.0 . . . . . . . . . . . . A . 26 PHE CD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1365 . 1 1 26 PHE CE1 C -2.324 -1.828 2.450 . . . 1.0 . . . . . . . . . . . . A . 26 PHE CE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1366 . 1 1 26 PHE CE2 C -4.641 -2.255 3.002 . . . 1.0 . . . . . . . . . . . . A . 26 PHE CE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1367 . 1 1 26 PHE CG C -4.053 -0.473 1.400 . . . 1.0 . . . . . . . . . . . . A . 26 PHE CG . . . . . . . . . c18126_2lr2 1 . 2 . 1368 . 1 1 26 PHE CZ C -3.288 -2.556 3.160 . . . 1.0 . . . . . . . . . . . . A . 26 PHE CZ . . . . . . . . . c18126_2lr2 1 . 2 . 1369 . 1 1 26 PHE H H -5.163 2.128 -1.626 . . . 1.0 . . . . . . . . . . . . A . 26 PHE H . . . . . . . . . c18126_2lr2 1 . 2 . 1370 . 1 1 26 PHE HA H -3.347 0.021 -1.351 . . . 1.0 . . . . . . . . . . . . A . 26 PHE HA . . . . . . . . . c18126_2lr2 1 . 2 . 1371 . 1 1 26 PHE HB2 H -3.870 1.539 0.580 . . . 1.0 . . . . . . . . . . . . A . 26 PHE HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1372 . 1 1 26 PHE HB3 H -5.495 0.948 0.628 . . . 1.0 . . . . . . . . . . . . A . 26 PHE HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1373 . 1 1 26 PHE HD1 H -1.912 -0.247 1.032 . . . 1.0 . . . . . . . . . . . . A . 26 PHE HD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1374 . 1 1 26 PHE HD2 H -6.075 -1.001 2.021 . . . 1.0 . . . . . . . . . . . . A . 26 PHE HD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1375 . 1 1 26 PHE HE1 H -1.294 -2.059 2.579 . . . 1.0 . . . . . . . . . . . . A . 26 PHE HE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1376 . 1 1 26 PHE HE2 H -5.394 -2.818 3.554 . . . 1.0 . . . . . . . . . . . . A . 26 PHE HE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1377 . 1 1 26 PHE HZ H -2.982 -3.360 3.829 . . . 1.0 . . . . . . . . . . . . A . 26 PHE HZ . . . . . . . . . c18126_2lr2 1 . 2 . 1378 . 1 1 26 PHE N N -4.880 1.265 -1.995 . . . 1.0 . . . . . . . . . . . . A . 26 PHE N . . . . . . . . . c18126_2lr2 1 . 2 . 1379 . 1 1 26 PHE O O -4.652 -2.151 -1.183 . . . 1.0 . . . . . . . . . . . . A . 26 PHE O . . . . . . . . . c18126_2lr2 1 . 2 . 1380 . 1 1 27 TYR C C -7.143 -2.732 -2.911 . . . 1.0 . . . . . . . . . . . . A . 27 TYR C . . . . . . . . . c18126_2lr2 1 . 2 . 1381 . 1 1 27 TYR CA C -7.384 -2.040 -1.573 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CA . . . . . . . . . c18126_2lr2 1 . 2 . 1382 . 1 1 27 TYR CB C -8.899 -1.603 -1.447 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CB . . . . . . . . . c18126_2lr2 1 . 2 . 1383 . 1 1 27 TYR CD1 C -8.945 -0.749 1.025 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1384 . 1 1 27 TYR CD2 C -10.354 -2.650 0.423 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1385 . 1 1 27 TYR CE1 C -9.421 -0.840 2.351 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1386 . 1 1 27 TYR CE2 C -10.816 -2.723 1.748 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1387 . 1 1 27 TYR CG C -9.406 -1.657 0.037 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CG . . . . . . . . . c18126_2lr2 1 . 2 . 1388 . 1 1 27 TYR CZ C -10.349 -1.821 2.706 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CZ . . . . . . . . . c18126_2lr2 1 . 2 . 1389 . 1 1 27 TYR H H -6.876 0.014 -1.462 . . . 1.0 . . . . . . . . . . . . A . 27 TYR H . . . . . . . . . c18126_2lr2 1 . 2 . 1390 . 1 1 27 TYR HA H -7.186 -2.741 -0.776 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HA . . . . . . . . . c18126_2lr2 1 . 2 . 1391 . 1 1 27 TYR HB2 H -8.998 -0.579 -1.804 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1392 . 1 1 27 TYR HB3 H -9.519 -2.229 -2.077 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1393 . 1 1 27 TYR HD1 H -8.227 0.014 0.768 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1394 . 1 1 27 TYR HD2 H -10.726 -3.366 -0.305 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1395 . 1 1 27 TYR HE1 H -9.068 -0.150 3.106 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1396 . 1 1 27 TYR HE2 H -11.533 -3.486 2.031 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1397 . 1 1 27 TYR HH H -10.062 -1.735 4.595 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HH . . . . . . . . . c18126_2lr2 1 . 2 . 1398 . 1 1 27 TYR N N -6.500 -0.890 -1.425 . . . 1.0 . . . . . . . . . . . . A . 27 TYR N . . . . . . . . . c18126_2lr2 1 . 2 . 1399 . 1 1 27 TYR O O -7.080 -3.959 -2.984 . . . 1.0 . . . . . . . . . . . . A . 27 TYR O . . . . . . . . . c18126_2lr2 1 . 2 . 1400 . 1 1 27 TYR OH O -10.806 -1.903 4.011 . . . 1.0 . . . . . . . . . . . . A . 27 TYR OH . . . . . . . . . c18126_2lr2 1 . 2 . 1401 . 1 1 28 GLU C C -5.560 -3.405 -5.293 . . . 1.0 . . . . . . . . . . . . A . 28 GLU C . . . . . . . . . c18126_2lr2 1 . 2 . 1402 . 1 1 28 GLU CA C -6.776 -2.484 -5.299 . . . 1.0 . . . . . . . . . . . . A . 28 GLU CA . . . . . . . . . c18126_2lr2 1 . 2 . 1403 . 1 1 28 GLU CB C -6.646 -1.319 -6.332 . . . 1.0 . . . . . . . . . . . . A . 28 GLU CB . . . . . . . . . c18126_2lr2 1 . 2 . 1404 . 1 1 28 GLU CD C -8.024 -2.414 -8.286 . . . 1.0 . . . . . . . . . . . . A . 28 GLU CD . . . . . . . . . c18126_2lr2 1 . 2 . 1405 . 1 1 28 GLU CG C -6.641 -1.859 -7.845 . . . 1.0 . . . . . . . . . . . . A . 28 GLU CG . . . . . . . . . c18126_2lr2 1 . 2 . 1406 . 1 1 28 GLU H H -7.069 -0.966 -3.850 . . . 1.0 . . . . . . . . . . . . A . 28 GLU H . . . . . . . . . c18126_2lr2 1 . 2 . 1407 . 1 1 28 GLU HA H -7.643 -3.050 -5.602 . . . 1.0 . . . . . . . . . . . . A . 28 GLU HA . . . . . . . . . c18126_2lr2 1 . 2 . 1408 . 1 1 28 GLU HB2 H -7.462 -0.601 -6.193 . . . 1.0 . . . . . . . . . . . . A . 28 GLU HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1409 . 1 1 28 GLU HB3 H -5.733 -0.810 -6.120 . . . 1.0 . . . . . . . . . . . . A . 28 GLU HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1410 . 1 1 28 GLU HG2 H -6.408 -1.053 -8.516 . . . 1.0 . . . . . . . . . . . . A . 28 GLU HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1411 . 1 1 28 GLU HG3 H -5.885 -2.638 -7.979 . . . 1.0 . . . . . . . . . . . . A . 28 GLU HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 1412 . 1 1 28 GLU N N -7.010 -1.937 -3.967 . . . 1.0 . . . . . . . . . . . . A . 28 GLU N . . . . . . . . . c18126_2lr2 1 . 2 . 1413 . 1 1 28 GLU O O -5.589 -4.491 -5.874 . . . 1.0 . . . . . . . . . . . . A . 28 GLU O . . . . . . . . . c18126_2lr2 1 . 2 . 1414 . 1 1 28 GLU OE1 O -8.994 -2.237 -7.559 . . . 1.0 . . . . . . . . . . . . A . 28 GLU OE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1415 . 1 1 28 GLU OE2 O -8.095 -2.970 -9.370 . . . 1.0 . . . . . . . . . . . . A . 28 GLU OE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1416 . 1 1 29 ILE C C -3.511 -5.036 -3.765 . . . 1.0 . . . . . . . . . . . . A . 29 ILE C . . . . . . . . . c18126_2lr2 1 . 2 . 1417 . 1 1 29 ILE CA C -3.272 -3.758 -4.561 . . . 1.0 . . . . . . . . . . . . A . 29 ILE CA . . . . . . . . . c18126_2lr2 1 . 2 . 1418 . 1 1 29 ILE CB C -2.110 -2.855 -3.892 . . . 1.0 . . . . . . . . . . . . A . 29 ILE CB . . . . . . . . . c18126_2lr2 1 . 2 . 1419 . 1 1 29 ILE CD1 C -0.843 -0.533 -4.194 . . . 1.0 . . . . . . . . . . . . A . 29 ILE CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1420 . 1 1 29 ILE CG1 C -1.747 -1.616 -4.863 . . . 1.0 . . . . . . . . . . . . A . 29 ILE CG1 . . . . . . . . . c18126_2lr2 1 . 2 . 1421 . 1 1 29 ILE CG2 C -0.793 -3.714 -3.566 . . . 1.0 . . . . . . . . . . . . A . 29 ILE CG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1422 . 1 1 29 ILE H H -4.527 -2.091 -4.193 . . . 1.0 . . . . . . . . . . . . A . 29 ILE H . . . . . . . . . c18126_2lr2 1 . 2 . 1423 . 1 1 29 ILE HA H -2.963 -4.021 -5.562 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HA . . . . . . . . . c18126_2lr2 1 . 2 . 1424 . 1 1 29 ILE HB H -2.502 -2.452 -2.950 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HB . . . . . . . . . c18126_2lr2 1 . 2 . 1425 . 1 1 29 ILE HD11 H -1.469 0.239 -3.783 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HD11 . . . . . . . . . c18126_2lr2 1 . 2 . 1426 . 1 1 29 ILE HD12 H -0.192 -0.100 -4.936 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HD12 . . . . . . . . . c18126_2lr2 1 . 2 . 1427 . 1 1 29 ILE HD13 H -0.233 -0.961 -3.410 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HD13 . . . . . . . . . c18126_2lr2 1 . 2 . 1428 . 1 1 29 ILE HG12 H -1.233 -1.984 -5.727 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HG12 . . . . . . . . . c18126_2lr2 1 . 2 . 1429 . 1 1 29 ILE HG13 H -2.652 -1.128 -5.205 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HG13 . . . . . . . . . c18126_2lr2 1 . 2 . 1430 . 1 1 29 ILE HG21 H -0.439 -4.211 -4.462 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HG21 . . . . . . . . . c18126_2lr2 1 . 2 . 1431 . 1 1 29 ILE HG22 H -0.995 -4.458 -2.805 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HG22 . . . . . . . . . c18126_2lr2 1 . 2 . 1432 . 1 1 29 ILE HG23 H -0.006 -3.070 -3.194 . . . 1.0 . . . . . . . . . . . . A . 29 ILE HG23 . . . . . . . . . c18126_2lr2 1 . 2 . 1433 . 1 1 29 ILE N N -4.493 -2.964 -4.636 . . . 1.0 . . . . . . . . . . . . A . 29 ILE N . . . . . . . . . c18126_2lr2 1 . 2 . 1434 . 1 1 29 ILE O O -2.860 -6.055 -3.997 . . . 1.0 . . . . . . . . . . . . A . 29 ILE O . . . . . . . . . c18126_2lr2 1 . 2 . 1435 . 1 1 30 LEU C C -5.697 -7.085 -2.746 . . . 1.0 . . . . . . . . . . . . A . 30 LEU C . . . . . . . . . c18126_2lr2 1 . 2 . 1436 . 1 1 30 LEU CA C -4.766 -6.135 -2.000 . . . 1.0 . . . . . . . . . . . . A . 30 LEU CA . . . . . . . . . c18126_2lr2 1 . 2 . 1437 . 1 1 30 LEU CB C -5.436 -5.640 -0.643 . . . 1.0 . . . . . . . . . . . . A . 30 LEU CB . . . . . . . . . c18126_2lr2 1 . 2 . 1438 . 1 1 30 LEU CD1 C -4.448 -7.608 0.853 . . . 1.0 . . . . . . . . . . . . A . 30 LEU CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1439 . 1 1 30 LEU CD2 C -6.466 -6.222 1.714 . . . 1.0 . . . . . . . . . . . . A . 30 LEU CD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1440 . 1 1 30 LEU CG C -5.749 -6.814 0.434 . . . 1.0 . . . . . . . . . . . . A . 30 LEU CG . . . . . . . . . c18126_2lr2 1 . 2 . 1441 . 1 1 30 LEU H H -4.936 -4.137 -2.685 . . . 1.0 . . . . . . . . . . . . A . 30 LEU H . . . . . . . . . c18126_2lr2 1 . 2 . 1442 . 1 1 30 LEU HA H -3.851 -6.655 -1.761 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HA . . . . . . . . . c18126_2lr2 1 . 2 . 1443 . 1 1 30 LEU HB2 H -4.785 -4.896 -0.185 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1444 . 1 1 30 LEU HB3 H -6.366 -5.145 -0.893 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1445 . 1 1 30 LEU HD11 H -4.199 -8.318 0.081 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD11 . . . . . . . . . c18126_2lr2 1 . 2 . 1446 . 1 1 30 LEU HD12 H -4.620 -8.152 1.771 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD12 . . . . . . . . . c18126_2lr2 1 . 2 . 1447 . 1 1 30 LEU HD13 H -3.611 -6.931 0.997 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD13 . . . . . . . . . c18126_2lr2 1 . 2 . 1448 . 1 1 30 LEU HD21 H -5.822 -5.506 2.221 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 1449 . 1 1 30 LEU HD22 H -6.709 -7.027 2.393 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 1450 . 1 1 30 LEU HD23 H -7.389 -5.728 1.429 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD23 . . . . . . . . . c18126_2lr2 1 . 2 . 1451 . 1 1 30 LEU HG H -6.433 -7.532 -0.010 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HG . . . . . . . . . c18126_2lr2 1 . 2 . 1452 . 1 1 30 LEU N N -4.449 -4.975 -2.825 . . . 1.0 . . . . . . . . . . . . A . 30 LEU N . . . . . . . . . c18126_2lr2 1 . 2 . 1453 . 1 1 30 LEU O O -5.999 -8.178 -2.266 . . . 1.0 . . . . . . . . . . . . A . 30 LEU O . . . . . . . . . c18126_2lr2 1 . 2 . 1454 . 1 1 31 HIS C C -6.265 -8.234 -5.800 . . . 1.0 . . . . . . . . . . . . A . 31 HIS C . . . . . . . . . c18126_2lr2 1 . 2 . 1455 . 1 1 31 HIS CA C -7.045 -7.484 -4.725 . . . 1.0 . . . . . . . . . . . . A . 31 HIS CA . . . . . . . . . c18126_2lr2 1 . 2 . 1456 . 1 1 31 HIS CB C -8.158 -6.558 -5.366 . . . 1.0 . . . . . . . . . . . . A . 31 HIS CB . . . . . . . . . c18126_2lr2 1 . 2 . 1457 . 1 1 31 HIS CD2 C -10.483 -7.870 -5.431 . . . 1.0 . . . . . . . . . . . . A . 31 HIS CD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1458 . 1 1 31 HIS CE1 C -10.443 -8.476 -7.512 . . . 1.0 . . . . . . . . . . . . A . 31 HIS CE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1459 . 1 1 31 HIS CG C -9.308 -7.377 -5.966 . . . 1.0 . . . . . . . . . . . . A . 31 HIS CG . . . . . . . . . c18126_2lr2 1 . 2 . 1460 . 1 1 31 HIS H H -5.874 -5.781 -4.254 . . . 1.0 . . . . . . . . . . . . A . 31 HIS H . . . . . . . . . c18126_2lr2 1 . 2 . 1461 . 1 1 31 HIS HA H -7.535 -8.199 -4.083 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HA . . . . . . . . . c18126_2lr2 1 . 2 . 1462 . 1 1 31 HIS HB2 H -8.561 -5.891 -4.608 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1463 . 1 1 31 HIS HB3 H -7.719 -5.952 -6.147 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1464 . 1 1 31 HIS HD1 H -8.615 -7.594 -7.957 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1465 . 1 1 31 HIS HD2 H -10.801 -7.744 -4.403 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1466 . 1 1 31 HIS HE1 H -10.714 -8.907 -8.465 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1467 . 1 1 31 HIS HE2 H -12.060 -9.009 -6.317 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1468 . 1 1 31 HIS N N -6.148 -6.661 -3.921 . . . 1.0 . . . . . . . . . . . . A . 31 HIS N . . . . . . . . . c18126_2lr2 1 . 2 . 1469 . 1 1 31 HIS ND1 N -9.312 -7.781 -7.296 . . . 1.0 . . . . . . . . . . . . A . 31 HIS ND1 . . . . . . . . . c18126_2lr2 1 . 2 . 1470 . 1 1 31 HIS NE2 N -11.193 -8.561 -6.412 . . . 1.0 . . . . . . . . . . . . A . 31 HIS NE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1471 . 1 1 31 HIS O O -6.840 -8.985 -6.587 . . . 1.0 . . . . . . . . . . . . A . 31 HIS O . . . . . . . . . c18126_2lr2 1 . 2 . 1472 . 1 1 32 LEU C C -4.023 -10.278 -6.727 . . . 1.0 . . . . . . . . . . . . A . 32 LEU C . . . . . . . . . c18126_2lr2 1 . 2 . 1473 . 1 1 32 LEU CA C -4.148 -8.724 -6.974 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CA . . . . . . . . . c18126_2lr2 1 . 2 . 1474 . 1 1 32 LEU CB C -2.757 -8.020 -7.048 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CB . . . . . . . . . c18126_2lr2 1 . 2 . 1475 . 1 1 32 LEU CD1 C -4.038 -5.764 -7.688 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1476 . 1 1 32 LEU CD2 C -1.448 -5.772 -7.531 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1477 . 1 1 32 LEU CG C -2.751 -6.621 -7.867 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CG . . . . . . . . . c18126_2lr2 1 . 2 . 1478 . 1 1 32 LEU H H -4.506 -7.438 -5.277 . . . 1.0 . . . . . . . . . . . . A . 32 LEU H . . . . . . . . . c18126_2lr2 1 . 2 . 1479 . 1 1 32 LEU HA H -4.635 -8.578 -7.919 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HA . . . . . . . . . c18126_2lr2 1 . 2 . 1480 . 1 1 32 LEU HB2 H -2.446 -7.836 -6.035 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1481 . 1 1 32 LEU HB3 H -2.039 -8.700 -7.505 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1482 . 1 1 32 LEU HD11 H -4.354 -5.803 -6.671 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD11 . . . . . . . . . c18126_2lr2 1 . 2 . 1483 . 1 1 32 LEU HD12 H -4.825 -6.146 -8.326 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD12 . . . . . . . . . c18126_2lr2 1 . 2 . 1484 . 1 1 32 LEU HD13 H -3.843 -4.736 -7.966 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD13 . . . . . . . . . c18126_2lr2 1 . 2 . 1485 . 1 1 32 LEU HD21 H -1.397 -4.909 -8.182 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 1486 . 1 1 32 LEU HD22 H -0.564 -6.366 -7.681 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 1487 . 1 1 32 LEU HD23 H -1.453 -5.442 -6.510 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD23 . . . . . . . . . c18126_2lr2 1 . 2 . 1488 . 1 1 32 LEU HG H -2.738 -6.843 -8.895 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HG . . . . . . . . . c18126_2lr2 1 . 2 . 1489 . 1 1 32 LEU N N -4.952 -8.048 -5.905 . . . 1.0 . . . . . . . . . . . . A . 32 LEU N . . . . . . . . . c18126_2lr2 1 . 2 . 1490 . 1 1 32 LEU O O -3.234 -10.683 -5.863 . . . 1.0 . . . . . . . . . . . . A . 32 LEU O . . . . . . . . . c18126_2lr2 1 . 2 . 1491 . 1 1 33 PRO C C -3.371 -13.264 -7.825 . . . 1.0 . . . . . . . . . . . . A . 33 PRO C . . . . . . . . . c18126_2lr2 1 . 2 . 1492 . 1 1 33 PRO CA C -4.696 -12.691 -7.264 . . . 1.0 . . . . . . . . . . . . A . 33 PRO CA . . . . . . . . . c18126_2lr2 1 . 2 . 1493 . 1 1 33 PRO CB C -5.946 -13.270 -7.999 . . . 1.0 . . . . . . . . . . . . A . 33 PRO CB . . . . . . . . . c18126_2lr2 1 . 2 . 1494 . 1 1 33 PRO CD C -5.798 -10.898 -8.542 . . . 1.0 . . . . . . . . . . . . A . 33 PRO CD . . . . . . . . . c18126_2lr2 1 . 2 . 1495 . 1 1 33 PRO CG C -6.796 -12.064 -8.355 . . . 1.0 . . . . . . . . . . . . A . 33 PRO CG . . . . . . . . . c18126_2lr2 1 . 2 . 1496 . 1 1 33 PRO HA H -4.762 -12.926 -6.204 . . . 1.0 . . . . . . . . . . . . A . 33 PRO HA . . . . . . . . . c18126_2lr2 1 . 2 . 1497 . 1 1 33 PRO HB2 H -5.655 -13.817 -8.898 . . . 1.0 . . . . . . . . . . . . A . 33 PRO HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1498 . 1 1 33 PRO HB3 H -6.497 -13.929 -7.338 . . . 1.0 . . . . . . . . . . . . A . 33 PRO HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1499 . 1 1 33 PRO HD2 H -5.328 -10.927 -9.529 . . . 1.0 . . . . . . . . . . . . A . 33 PRO HD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1500 . 1 1 33 PRO HD3 H -6.294 -9.957 -8.403 . . . 1.0 . . . . . . . . . . . . A . 33 PRO HD3 . . . . . . . . . c18126_2lr2 1 . 2 . 1501 . 1 1 33 PRO HG2 H -7.369 -12.241 -9.268 . . . 1.0 . . . . . . . . . . . . A . 33 PRO HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1502 . 1 1 33 PRO HG3 H -7.487 -11.825 -7.539 . . . 1.0 . . . . . . . . . . . . A . 33 PRO HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 1503 . 1 1 33 PRO N N -4.786 -11.175 -7.455 . . . 1.0 . . . . . . . . . . . . A . 33 PRO N . . . . . . . . . c18126_2lr2 1 . 2 . 1504 . 1 1 33 PRO O O -2.790 -12.668 -8.740 . . . 1.0 . . . . . . . . . . . . A . 33 PRO O . . . . . . . . . c18126_2lr2 1 . 2 . 1505 . 1 1 34 ASN C C -0.458 -14.162 -7.564 . . . 1.0 . . . . . . . . . . . . A . 34 ASN C . . . . . . . . . c18126_2lr2 1 . 2 . 1506 . 1 1 34 ASN CA C -1.665 -15.120 -7.729 . . . 1.0 . . . . . . . . . . . . A . 34 ASN CA . . . . . . . . . c18126_2lr2 1 . 2 . 1507 . 1 1 34 ASN CB C -1.805 -15.666 -9.225 . . . 1.0 . . . . . . . . . . . . A . 34 ASN CB . . . . . . . . . c18126_2lr2 1 . 2 . 1508 . 1 1 34 ASN CG C -2.802 -16.847 -9.322 . . . 1.0 . . . . . . . . . . . . A . 34 ASN CG . . . . . . . . . c18126_2lr2 1 . 2 . 1509 . 1 1 34 ASN H H -3.456 -14.854 -6.569 . . . 1.0 . . . . . . . . . . . . A . 34 ASN H . . . . . . . . . c18126_2lr2 1 . 2 . 1510 . 1 1 34 ASN HA H -1.487 -15.946 -7.050 . . . 1.0 . . . . . . . . . . . . A . 34 ASN HA . . . . . . . . . c18126_2lr2 1 . 2 . 1511 . 1 1 34 ASN HB2 H -2.141 -14.869 -9.885 . . . 1.0 . . . . . . . . . . . . A . 34 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1512 . 1 1 34 ASN HB3 H -0.842 -16.007 -9.579 . . . 1.0 . . . . . . . . . . . . A . 34 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1513 . 1 1 34 ASN HD21 H -3.046 -16.669 -11.285 . . . 1.0 . . . . . . . . . . . . A . 34 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 1514 . 1 1 34 ASN HD22 H -3.933 -17.917 -10.553 . . . 1.0 . . . . . . . . . . . . A . 34 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 1515 . 1 1 34 ASN N N -2.918 -14.434 -7.279 . . . 1.0 . . . . . . . . . . . . A . 34 ASN N . . . . . . . . . c18126_2lr2 1 . 2 . 1516 . 1 1 34 ASN ND2 N -3.303 -17.171 -10.483 . . . 1.0 . . . . . . . . . . . . A . 34 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 2 . 1517 . 1 1 34 ASN O O 0.461 -14.128 -8.394 . . . 1.0 . . . . . . . . . . . . A . 34 ASN O . . . . . . . . . c18126_2lr2 1 . 2 . 1518 . 1 1 34 ASN OD1 O -3.117 -17.502 -8.323 . . . 1.0 . . . . . . . . . . . . A . 34 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1519 . 1 1 35 LEU C C 1.519 -12.834 -5.107 . . . 1.0 . . . . . . . . . . . . A . 35 LEU C . . . . . . . . . c18126_2lr2 1 . 2 . 1520 . 1 1 35 LEU CA C 0.526 -12.346 -6.170 . . . 1.0 . . . . . . . . . . . . A . 35 LEU CA . . . . . . . . . c18126_2lr2 1 . 2 . 1521 . 1 1 35 LEU CB C -0.169 -11.008 -5.673 . . . 1.0 . . . . . . . . . . . . A . 35 LEU CB . . . . . . . . . c18126_2lr2 1 . 2 . 1522 . 1 1 35 LEU CD1 C 1.604 -9.370 -6.800 . . . 1.0 . . . . . . . . . . . . A . 35 LEU CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1523 . 1 1 35 LEU CD2 C 0.105 -8.495 -4.889 . . . 1.0 . . . . . . . . . . . . A . 35 LEU CD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1524 . 1 1 35 LEU CG C 0.848 -9.764 -5.463 . . . 1.0 . . . . . . . . . . . . A . 35 LEU CG . . . . . . . . . c18126_2lr2 1 . 2 . 1525 . 1 1 35 LEU H H -1.270 -13.446 -5.861 . . . 1.0 . . . . . . . . . . . . A . 35 LEU H . . . . . . . . . c18126_2lr2 1 . 2 . 1526 . 1 1 35 LEU HA H 1.066 -12.117 -7.076 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HA . . . . . . . . . c18126_2lr2 1 . 2 . 1527 . 1 1 35 LEU HB2 H -0.918 -10.723 -6.400 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1528 . 1 1 35 LEU HB3 H -0.679 -11.209 -4.731 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1529 . 1 1 35 LEU HD11 H 2.015 -8.372 -6.722 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD11 . . . . . . . . . c18126_2lr2 1 . 2 . 1530 . 1 1 35 LEU HD12 H 0.936 -9.406 -7.653 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD12 . . . . . . . . . c18126_2lr2 1 . 2 . 1531 . 1 1 35 LEU HD13 H 2.423 -10.063 -6.962 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD13 . . . . . . . . . c18126_2lr2 1 . 2 . 1532 . 1 1 35 LEU HD21 H 0.819 -7.838 -4.452 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 1533 . 1 1 35 LEU HD22 H -0.628 -8.768 -4.139 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 1534 . 1 1 35 LEU HD23 H -0.369 -7.972 -5.674 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD23 . . . . . . . . . c18126_2lr2 1 . 2 . 1535 . 1 1 35 LEU HG H 1.602 -10.039 -4.753 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HG . . . . . . . . . c18126_2lr2 1 . 2 . 1536 . 1 1 35 LEU N N -0.506 -13.364 -6.472 . . . 1.0 . . . . . . . . . . . . A . 35 LEU N . . . . . . . . . c18126_2lr2 1 . 2 . 1537 . 1 1 35 LEU O O 1.122 -13.285 -4.027 . . . 1.0 . . . . . . . . . . . . A . 35 LEU O . . . . . . . . . c18126_2lr2 1 . 2 . 1538 . 1 1 36 ASN C C 3.855 -11.997 -3.379 . . . 1.0 . . . . . . . . . . . . A . 36 ASN C . . . . . . . . . c18126_2lr2 1 . 2 . 1539 . 1 1 36 ASN CA C 3.920 -13.026 -4.552 . . . 1.0 . . . . . . . . . . . . A . 36 ASN CA . . . . . . . . . c18126_2lr2 1 . 2 . 1540 . 1 1 36 ASN CB C 5.311 -12.968 -5.316 . . . 1.0 . . . . . . . . . . . . A . 36 ASN CB . . . . . . . . . c18126_2lr2 1 . 2 . 1541 . 1 1 36 ASN CG C 6.439 -13.779 -4.615 . . . 1.0 . . . . . . . . . . . . A . 36 ASN CG . . . . . . . . . c18126_2lr2 1 . 2 . 1542 . 1 1 36 ASN H H 3.031 -12.306 -6.320 . . . 1.0 . . . . . . . . . . . . A . 36 ASN H . . . . . . . . . c18126_2lr2 1 . 2 . 1543 . 1 1 36 ASN HA H 3.741 -14.028 -4.164 . . . 1.0 . . . . . . . . . . . . A . 36 ASN HA . . . . . . . . . c18126_2lr2 1 . 2 . 1544 . 1 1 36 ASN HB2 H 5.191 -13.353 -6.318 . . . 1.0 . . . . . . . . . . . . A . 36 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1545 . 1 1 36 ASN HB3 H 5.622 -11.935 -5.398 . . . 1.0 . . . . . . . . . . . . A . 36 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1546 . 1 1 36 ASN HD21 H 7.926 -12.632 -5.286 . . . 1.0 . . . . . . . . . . . . A . 36 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 1547 . 1 1 36 ASN HD22 H 8.403 -13.937 -4.311 . . . 1.0 . . . . . . . . . . . . A . 36 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 1548 . 1 1 36 ASN N N 2.820 -12.684 -5.447 . . . 1.0 . . . . . . . . . . . . A . 36 ASN N . . . . . . . . . c18126_2lr2 1 . 2 . 1549 . 1 1 36 ASN ND2 N 7.693 -13.414 -4.747 . . . 1.0 . . . . . . . . . . . . A . 36 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 2 . 1550 . 1 1 36 ASN O O 3.668 -10.794 -3.570 . . . 1.0 . . . . . . . . . . . . A . 36 ASN O . . . . . . . . . c18126_2lr2 1 . 2 . 1551 . 1 1 36 ASN OD1 O 6.181 -14.803 -3.973 . . . 1.0 . . . . . . . . . . . . A . 36 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1552 . 1 1 37 GLU C C 5.175 -10.760 -0.918 . . . 1.0 . . . . . . . . . . . . A . 37 GLU C . . . . . . . . . c18126_2lr2 1 . 2 . 1553 . 1 1 37 GLU CA C 4.102 -11.845 -0.920 . . . 1.0 . . . . . . . . . . . . A . 37 GLU CA . . . . . . . . . c18126_2lr2 1 . 2 . 1554 . 1 1 37 GLU CB C 4.381 -12.909 0.228 . . . 1.0 . . . . . . . . . . . . A . 37 GLU CB . . . . . . . . . c18126_2lr2 1 . 2 . 1555 . 1 1 37 GLU CD C 4.595 -13.326 2.814 . . . 1.0 . . . . . . . . . . . . A . 37 GLU CD . . . . . . . . . c18126_2lr2 1 . 2 . 1556 . 1 1 37 GLU CG C 4.353 -12.273 1.696 . . . 1.0 . . . . . . . . . . . . A . 37 GLU CG . . . . . . . . . c18126_2lr2 1 . 2 . 1557 . 1 1 37 GLU H H 4.276 -13.480 -2.256 . . . 1.0 . . . . . . . . . . . . A . 37 GLU H . . . . . . . . . c18126_2lr2 1 . 2 . 1558 . 1 1 37 GLU HA H 3.141 -11.388 -0.735 . . . 1.0 . . . . . . . . . . . . A . 37 GLU HA . . . . . . . . . c18126_2lr2 1 . 2 . 1559 . 1 1 37 GLU HB2 H 3.620 -13.689 0.162 . . . 1.0 . . . . . . . . . . . . A . 37 GLU HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1560 . 1 1 37 GLU HB3 H 5.353 -13.376 0.053 . . . 1.0 . . . . . . . . . . . . A . 37 GLU HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1561 . 1 1 37 GLU HG2 H 5.125 -11.514 1.783 . . . 1.0 . . . . . . . . . . . . A . 37 GLU HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1562 . 1 1 37 GLU HG3 H 3.389 -11.798 1.871 . . . 1.0 . . . . . . . . . . . . A . 37 GLU HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 1563 . 1 1 37 GLU N N 4.063 -12.525 -2.209 . . . 1.0 . . . . . . . . . . . . A . 37 GLU N . . . . . . . . . c18126_2lr2 1 . 2 . 1564 . 1 1 37 GLU O O 4.930 -9.633 -0.488 . . . 1.0 . . . . . . . . . . . . A . 37 GLU O . . . . . . . . . c18126_2lr2 1 . 2 . 1565 . 1 1 37 GLU OE1 O 4.514 -14.516 2.535 . . . 1.0 . . . . . . . . . . . . A . 37 GLU OE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1566 . 1 1 37 GLU OE2 O 4.861 -12.917 3.936 . . . 1.0 . . . . . . . . . . . . A . 37 GLU OE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1567 . 1 1 38 GLU C C 7.052 -8.894 -2.200 . . . 1.0 . . . . . . . . . . . . A . 38 GLU C . . . . . . . . . c18126_2lr2 1 . 2 . 1568 . 1 1 38 GLU CA C 7.466 -10.156 -1.450 . . . 1.0 . . . . . . . . . . . . A . 38 GLU CA . . . . . . . . . c18126_2lr2 1 . 2 . 1569 . 1 1 38 GLU CB C 8.721 -10.820 -2.149 . . . 1.0 . . . . . . . . . . . . A . 38 GLU CB . . . . . . . . . c18126_2lr2 1 . 2 . 1570 . 1 1 38 GLU CD C 8.614 -13.326 -1.335 . . . 1.0 . . . . . . . . . . . . A . 38 GLU CD . . . . . . . . . c18126_2lr2 1 . 2 . 1571 . 1 1 38 GLU CG C 9.372 -11.975 -1.266 . . . 1.0 . . . . . . . . . . . . A . 38 GLU CG . . . . . . . . . c18126_2lr2 1 . 2 . 1572 . 1 1 38 GLU H H 6.500 -12.021 -1.729 . . . 1.0 . . . . . . . . . . . . A . 38 GLU H . . . . . . . . . c18126_2lr2 1 . 2 . 1573 . 1 1 38 GLU HA H 7.742 -9.888 -0.440 . . . 1.0 . . . . . . . . . . . . A . 38 GLU HA . . . . . . . . . c18126_2lr2 1 . 2 . 1574 . 1 1 38 GLU HB2 H 8.412 -11.235 -3.117 . . . 1.0 . . . . . . . . . . . . A . 38 GLU HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1575 . 1 1 38 GLU HB3 H 9.474 -10.059 -2.352 . . . 1.0 . . . . . . . . . . . . A . 38 GLU HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1576 . 1 1 38 GLU HG2 H 10.396 -12.130 -1.599 . . . 1.0 . . . . . . . . . . . . A . 38 GLU HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1577 . 1 1 38 GLU HG3 H 9.412 -11.665 -0.225 . . . 1.0 . . . . . . . . . . . . A . 38 GLU HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 1578 . 1 1 38 GLU N N 6.363 -11.109 -1.400 . . . 1.0 . . . . . . . . . . . . A . 38 GLU N . . . . . . . . . c18126_2lr2 1 . 2 . 1579 . 1 1 38 GLU O O 7.369 -7.780 -1.784 . . . 1.0 . . . . . . . . . . . . A . 38 GLU O . . . . . . . . . c18126_2lr2 1 . 2 . 1580 . 1 1 38 GLU OE1 O 7.570 -13.394 -1.953 . . . 1.0 . . . . . . . . . . . . A . 38 GLU OE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1581 . 1 1 38 GLU OE2 O 9.126 -14.298 -0.797 . . . 1.0 . . . . . . . . . . . . A . 38 GLU OE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1582 . 1 1 39 GLN C C 4.813 -7.162 -3.368 . . . 1.0 . . . . . . . . . . . . A . 39 GLN C . . . . . . . . . c18126_2lr2 1 . 2 . 1583 . 1 1 39 GLN CA C 5.889 -7.947 -4.110 . . . 1.0 . . . . . . . . . . . . A . 39 GLN CA . . . . . . . . . c18126_2lr2 1 . 2 . 1584 . 1 1 39 GLN CB C 5.350 -8.450 -5.513 . . . 1.0 . . . . . . . . . . . . A . 39 GLN CB . . . . . . . . . c18126_2lr2 1 . 2 . 1585 . 1 1 39 GLN CD C 7.617 -8.104 -6.752 . . . 1.0 . . . . . . . . . . . . A . 39 GLN CD . . . . . . . . . c18126_2lr2 1 . 2 . 1586 . 1 1 39 GLN CG C 6.492 -9.110 -6.401 . . . 1.0 . . . . . . . . . . . . A . 39 GLN CG . . . . . . . . . c18126_2lr2 1 . 2 . 1587 . 1 1 39 GLN H H 6.118 -9.989 -3.593 . . . 1.0 . . . . . . . . . . . . A . 39 GLN H . . . . . . . . . c18126_2lr2 1 . 2 . 1588 . 1 1 39 GLN HA H 6.728 -7.296 -4.302 . . . 1.0 . . . . . . . . . . . . A . 39 GLN HA . . . . . . . . . c18126_2lr2 1 . 2 . 1589 . 1 1 39 GLN HB2 H 4.563 -9.184 -5.351 . . . 1.0 . . . . . . . . . . . . A . 39 GLN HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1590 . 1 1 39 GLN HB3 H 4.914 -7.618 -6.054 . . . 1.0 . . . . . . . . . . . . A . 39 GLN HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1591 . 1 1 39 GLN HE21 H 9.086 -9.275 -6.101 . . . 1.0 . . . . . . . . . . . . A . 39 GLN HE21 . . . . . . . . . c18126_2lr2 1 . 2 . 1592 . 1 1 39 GLN HE22 H 9.576 -7.772 -6.722 . . . 1.0 . . . . . . . . . . . . A . 39 GLN HE22 . . . . . . . . . c18126_2lr2 1 . 2 . 1593 . 1 1 39 GLN HG2 H 6.932 -9.947 -5.873 . . . 1.0 . . . . . . . . . . . . A . 39 GLN HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1594 . 1 1 39 GLN HG3 H 6.060 -9.481 -7.328 . . . 1.0 . . . . . . . . . . . . A . 39 GLN HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 1595 . 1 1 39 GLN N N 6.342 -9.078 -3.308 . . . 1.0 . . . . . . . . . . . . A . 39 GLN N . . . . . . . . . c18126_2lr2 1 . 2 . 1596 . 1 1 39 GLN NE2 N 8.865 -8.409 -6.505 . . . 1.0 . . . . . . . . . . . . A . 39 GLN NE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1597 . 1 1 39 GLN O O 4.919 -5.946 -3.205 . . . 1.0 . . . . . . . . . . . . A . 39 GLN O . . . . . . . . . c18126_2lr2 1 . 2 . 1598 . 1 1 39 GLN OE1 O 7.349 -7.014 -7.249 . . . 1.0 . . . . . . . . . . . . A . 39 GLN OE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1599 . 1 1 40 ARG C C 3.232 -6.296 -1.115 . . . 1.0 . . . . . . . . . . . . A . 40 ARG C . . . . . . . . . c18126_2lr2 1 . 2 . 1600 . 1 1 40 ARG CA C 2.685 -7.221 -2.198 . . . 1.0 . . . . . . . . . . . . A . 40 ARG CA . . . . . . . . . c18126_2lr2 1 . 2 . 1601 . 1 1 40 ARG CB C 1.764 -8.360 -1.554 . . . 1.0 . . . . . . . . . . . . A . 40 ARG CB . . . . . . . . . c18126_2lr2 1 . 2 . 1602 . 1 1 40 ARG CD C -0.435 -8.933 -0.217 . . . 1.0 . . . . . . . . . . . . A . 40 ARG CD . . . . . . . . . c18126_2lr2 1 . 2 . 1603 . 1 1 40 ARG CG C 0.483 -7.791 -0.802 . . . 1.0 . . . . . . . . . . . . A . 40 ARG CG . . . . . . . . . c18126_2lr2 1 . 2 . 1604 . 1 1 40 ARG CZ C -1.854 -10.767 -1.157 . . . 1.0 . . . . . . . . . . . . A . 40 ARG CZ . . . . . . . . . c18126_2lr2 1 . 2 . 1605 . 1 1 40 ARG H H 3.745 -8.830 -3.080 . . . 1.0 . . . . . . . . . . . . A . 40 ARG H . . . . . . . . . c18126_2lr2 1 . 2 . 1606 . 1 1 40 ARG HA H 2.099 -6.639 -2.892 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HA . . . . . . . . . c18126_2lr2 1 . 2 . 1607 . 1 1 40 ARG HB2 H 1.452 -9.051 -2.323 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1608 . 1 1 40 ARG HB3 H 2.361 -8.918 -0.845 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1609 . 1 1 40 ARG HD2 H 0.150 -9.598 0.415 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1610 . 1 1 40 ARG HD3 H -1.232 -8.489 0.386 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HD3 . . . . . . . . . c18126_2lr2 1 . 2 . 1611 . 1 1 40 ARG HE H -0.844 -9.419 -2.249 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HE . . . . . . . . . c18126_2lr2 1 . 2 . 1612 . 1 1 40 ARG HG2 H 0.831 -7.190 0.011 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1613 . 1 1 40 ARG HG3 H -0.106 -7.160 -1.474 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 1614 . 1 1 40 ARG HH11 H -1.772 -10.740 0.847 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HH11 . . . . . . . . . c18126_2lr2 1 . 2 . 1615 . 1 1 40 ARG HH12 H -2.753 -11.988 0.155 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HH12 . . . . . . . . . c18126_2lr2 1 . 2 . 1616 . 1 1 40 ARG HH21 H -2.124 -11.054 -3.120 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HH21 . . . . . . . . . c18126_2lr2 1 . 2 . 1617 . 1 1 40 ARG HH22 H -2.950 -12.166 -2.079 . . . 1.0 . . . . . . . . . . . . A . 40 ARG HH22 . . . . . . . . . c18126_2lr2 1 . 2 . 1618 . 1 1 40 ARG N N 3.777 -7.864 -2.922 . . . 1.0 . . . . . . . . . . . . A . 40 ARG N . . . . . . . . . c18126_2lr2 1 . 2 . 1619 . 1 1 40 ARG NE N -1.041 -9.703 -1.333 . . . 1.0 . . . . . . . . . . . . A . 40 ARG NE . . . . . . . . . c18126_2lr2 1 . 2 . 1620 . 1 1 40 ARG NH1 N -2.151 -11.200 0.042 . . . 1.0 . . . . . . . . . . . . A . 40 ARG NH1 . . . . . . . . . c18126_2lr2 1 . 2 . 1621 . 1 1 40 ARG NH2 N -2.348 -11.376 -2.201 . . . 1.0 . . . . . . . . . . . . A . 40 ARG NH2 . . . . . . . . . c18126_2lr2 1 . 2 . 1622 . 1 1 40 ARG O O 2.875 -5.120 -1.051 . . . 1.0 . . . . . . . . . . . . A . 40 ARG O . . . . . . . . . c18126_2lr2 1 . 2 . 1623 . 1 1 41 ASN C C 5.365 -4.799 0.253 . . . 1.0 . . . . . . . . . . . . A . 41 ASN C . . . . . . . . . c18126_2lr2 1 . 2 . 1624 . 1 1 41 ASN CA C 4.691 -6.048 0.811 . . . 1.0 . . . . . . . . . . . . A . 41 ASN CA . . . . . . . . . c18126_2lr2 1 . 2 . 1625 . 1 1 41 ASN CB C 5.723 -6.946 1.603 . . . 1.0 . . . . . . . . . . . . A . 41 ASN CB . . . . . . . . . c18126_2lr2 1 . 2 . 1626 . 1 1 41 ASN CG C 5.005 -7.991 2.503 . . . 1.0 . . . . . . . . . . . . A . 41 ASN CG . . . . . . . . . c18126_2lr2 1 . 2 . 1627 . 1 1 41 ASN H H 4.350 -7.778 -0.366 . . . 1.0 . . . . . . . . . . . . A . 41 ASN H . . . . . . . . . c18126_2lr2 1 . 2 . 1628 . 1 1 41 ASN HA H 3.911 -5.751 1.495 . . . 1.0 . . . . . . . . . . . . A . 41 ASN HA . . . . . . . . . c18126_2lr2 1 . 2 . 1629 . 1 1 41 ASN HB2 H 6.369 -7.466 0.902 . . . 1.0 . . . . . . . . . . . . A . 41 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1630 . 1 1 41 ASN HB3 H 6.344 -6.320 2.243 . . . 1.0 . . . . . . . . . . . . A . 41 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1631 . 1 1 41 ASN HD21 H 6.607 -9.145 2.708 . . . 1.0 . . . . . . . . . . . . A . 41 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 1632 . 1 1 41 ASN HD22 H 5.209 -9.687 3.504 . . . 1.0 . . . . . . . . . . . . A . 41 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 1633 . 1 1 41 ASN N N 4.101 -6.836 -0.266 . . . 1.0 . . . . . . . . . . . . A . 41 ASN N . . . . . . . . . c18126_2lr2 1 . 2 . 1634 . 1 1 41 ASN ND2 N 5.663 -9.026 2.942 . . . 1.0 . . . . . . . . . . . . A . 41 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 2 . 1635 . 1 1 41 ASN O O 4.926 -3.679 0.510 . . . 1.0 . . . . . . . . . . . . A . 41 ASN O . . . . . . . . . c18126_2lr2 1 . 2 . 1636 . 1 1 41 ASN OD1 O 3.817 -7.862 2.814 . . . 1.0 . . . . . . . . . . . . A . 41 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1637 . 1 1 42 ALA C C 6.196 -2.783 -1.534 . . . 1.0 . . . . . . . . . . . . A . 42 ALA C . . . . . . . . . c18126_2lr2 1 . 2 . 1638 . 1 1 42 ALA CA C 7.161 -3.882 -1.099 . . . 1.0 . . . . . . . . . . . . A . 42 ALA CA . . . . . . . . . c18126_2lr2 1 . 2 . 1639 . 1 1 42 ALA CB C 8.008 -4.387 -2.325 . . . 1.0 . . . . . . . . . . . . A . 42 ALA CB . . . . . . . . . c18126_2lr2 1 . 2 . 1640 . 1 1 42 ALA H H 6.738 -5.916 -0.682 . . . 1.0 . . . . . . . . . . . . A . 42 ALA H . . . . . . . . . c18126_2lr2 1 . 2 . 1641 . 1 1 42 ALA HA H 7.841 -3.479 -0.363 . . . 1.0 . . . . . . . . . . . . A . 42 ALA HA . . . . . . . . . c18126_2lr2 1 . 2 . 1642 . 1 1 42 ALA HB1 H 8.587 -3.570 -2.752 . . . 1.0 . . . . . . . . . . . . A . 42 ALA HB1 . . . . . . . . . c18126_2lr2 1 . 2 . 1643 . 1 1 42 ALA HB2 H 7.356 -4.795 -3.091 . . . 1.0 . . . . . . . . . . . . A . 42 ALA HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1644 . 1 1 42 ALA HB3 H 8.689 -5.166 -2.003 . . . 1.0 . . . . . . . . . . . . A . 42 ALA HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1645 . 1 1 42 ALA N N 6.434 -5.000 -0.511 . . . 1.0 . . . . . . . . . . . . A . 42 ALA N . . . . . . . . . c18126_2lr2 1 . 2 . 1646 . 1 1 42 ALA O O 6.383 -1.612 -1.205 . . . 1.0 . . . . . . . . . . . . A . 42 ALA O . . . . . . . . . c18126_2lr2 1 . 2 . 1647 . 1 1 43 PHE C C 3.346 -1.673 -1.585 . . . 1.0 . . . . . . . . . . . . A . 43 PHE C . . . . . . . . . c18126_2lr2 1 . 2 . 1648 . 1 1 43 PHE CA C 4.173 -2.210 -2.749 . . . 1.0 . . . . . . . . . . . . A . 43 PHE CA . . . . . . . . . c18126_2lr2 1 . 2 . 1649 . 1 1 43 PHE CB C 3.240 -2.843 -3.858 . . . 1.0 . . . . . . . . . . . . A . 43 PHE CB . . . . . . . . . c18126_2lr2 1 . 2 . 1650 . 1 1 43 PHE CD1 C 4.720 -2.088 -5.883 . . . 1.0 . . . . . . . . . . . . A . 43 PHE CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1651 . 1 1 43 PHE CD2 C 4.061 -4.435 -5.764 . . . 1.0 . . . . . . . . . . . . A . 43 PHE CD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1652 . 1 1 43 PHE CE1 C 5.413 -2.338 -7.067 . . . 1.0 . . . . . . . . . . . . A . 43 PHE CE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1653 . 1 1 43 PHE CE2 C 4.760 -4.661 -6.961 . . . 1.0 . . . . . . . . . . . . A . 43 PHE CE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1654 . 1 1 43 PHE CG C 4.025 -3.137 -5.198 . . . 1.0 . . . . . . . . . . . . A . 43 PHE CG . . . . . . . . . c18126_2lr2 1 . 2 . 1655 . 1 1 43 PHE CZ C 5.436 -3.615 -7.606 . . . 1.0 . . . . . . . . . . . . A . 43 PHE CZ . . . . . . . . . c18126_2lr2 1 . 2 . 1656 . 1 1 43 PHE H H 5.064 -4.118 -2.506 . . . 1.0 . . . . . . . . . . . . A . 43 PHE H . . . . . . . . . c18126_2lr2 1 . 2 . 1657 . 1 1 43 PHE HA H 4.683 -1.387 -3.226 . . . 1.0 . . . . . . . . . . . . A . 43 PHE HA . . . . . . . . . c18126_2lr2 1 . 2 . 1658 . 1 1 43 PHE HB2 H 2.816 -3.766 -3.475 . . . 1.0 . . . . . . . . . . . . A . 43 PHE HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1659 . 1 1 43 PHE HB3 H 2.416 -2.164 -4.078 . . . 1.0 . . . . . . . . . . . . A . 43 PHE HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1660 . 1 1 43 PHE HD1 H 4.714 -1.082 -5.494 . . . 1.0 . . . . . . . . . . . . A . 43 PHE HD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1661 . 1 1 43 PHE HD2 H 3.544 -5.258 -5.289 . . . 1.0 . . . . . . . . . . . . A . 43 PHE HD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1662 . 1 1 43 PHE HE1 H 5.946 -1.533 -7.559 . . . 1.0 . . . . . . . . . . . . A . 43 PHE HE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1663 . 1 1 43 PHE HE2 H 4.780 -5.643 -7.389 . . . 1.0 . . . . . . . . . . . . A . 43 PHE HE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1664 . 1 1 43 PHE HZ H 5.971 -3.798 -8.531 . . . 1.0 . . . . . . . . . . . . A . 43 PHE HZ . . . . . . . . . c18126_2lr2 1 . 2 . 1665 . 1 1 43 PHE N N 5.162 -3.171 -2.275 . . . 1.0 . . . . . . . . . . . . A . 43 PHE N . . . . . . . . . c18126_2lr2 1 . 2 . 1666 . 1 1 43 PHE O O 3.125 -0.468 -1.473 . . . 1.0 . . . . . . . . . . . . A . 43 PHE O . . . . . . . . . c18126_2lr2 1 . 2 . 1667 . 1 1 44 ILE C C 2.880 -1.237 1.334 . . . 1.0 . . . . . . . . . . . . A . 44 ILE C . . . . . . . . . c18126_2lr2 1 . 2 . 1668 . 1 1 44 ILE CA C 2.092 -2.181 0.432 . . . 1.0 . . . . . . . . . . . . A . 44 ILE CA . . . . . . . . . c18126_2lr2 1 . 2 . 1669 . 1 1 44 ILE CB C 1.577 -3.472 1.270 . . . 1.0 . . . . . . . . . . . . A . 44 ILE CB . . . . . . . . . c18126_2lr2 1 . 2 . 1670 . 1 1 44 ILE CD1 C -0.421 -5.226 1.483 . . . 1.0 . . . . . . . . . . . . A . 44 ILE CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1671 . 1 1 44 ILE CG1 C 0.275 -4.148 0.578 . . . 1.0 . . . . . . . . . . . . A . 44 ILE CG1 . . . . . . . . . c18126_2lr2 1 . 2 . 1672 . 1 1 44 ILE CG2 C 1.335 -3.186 2.824 . . . 1.0 . . . . . . . . . . . . A . 44 ILE CG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1673 . 1 1 44 ILE H H 3.101 -3.523 -0.861 . . . 1.0 . . . . . . . . . . . . A . 44 ILE H . . . . . . . . . c18126_2lr2 1 . 2 . 1674 . 1 1 44 ILE HA H 1.205 -1.675 0.084 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HA . . . . . . . . . c18126_2lr2 1 . 2 . 1675 . 1 1 44 ILE HB H 2.369 -4.192 1.235 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HB . . . . . . . . . c18126_2lr2 1 . 2 . 1676 . 1 1 44 ILE HD11 H -1.120 -5.793 0.889 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HD11 . . . . . . . . . c18126_2lr2 1 . 2 . 1677 . 1 1 44 ILE HD12 H -0.969 -4.728 2.270 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HD12 . . . . . . . . . c18126_2lr2 1 . 2 . 1678 . 1 1 44 ILE HD13 H 0.304 -5.902 1.931 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HD13 . . . . . . . . . c18126_2lr2 1 . 2 . 1679 . 1 1 44 ILE HG12 H -0.458 -3.397 0.348 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HG12 . . . . . . . . . c18126_2lr2 1 . 2 . 1680 . 1 1 44 ILE HG13 H 0.567 -4.623 -0.356 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HG13 . . . . . . . . . c18126_2lr2 1 . 2 . 1681 . 1 1 44 ILE HG21 H 0.840 -4.033 3.293 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HG21 . . . . . . . . . c18126_2lr2 1 . 2 . 1682 . 1 1 44 ILE HG22 H 0.725 -2.319 2.967 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HG22 . . . . . . . . . c18126_2lr2 1 . 2 . 1683 . 1 1 44 ILE HG23 H 2.282 -3.038 3.331 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HG23 . . . . . . . . . c18126_2lr2 1 . 2 . 1684 . 1 1 44 ILE N N 2.894 -2.576 -0.722 . . . 1.0 . . . . . . . . . . . . A . 44 ILE N . . . . . . . . . c18126_2lr2 1 . 2 . 1685 . 1 1 44 ILE O O 2.330 -0.283 1.882 . . . 1.0 . . . . . . . . . . . . A . 44 ILE O . . . . . . . . . c18126_2lr2 1 . 2 . 1686 . 1 1 45 GLN C C 5.099 0.742 1.772 . . . 1.0 . . . . . . . . . . . . A . 45 GLN C . . . . . . . . . c18126_2lr2 1 . 2 . 1687 . 1 1 45 GLN CA C 5.027 -0.679 2.322 . . . 1.0 . . . . . . . . . . . . A . 45 GLN CA . . . . . . . . . c18126_2lr2 1 . 2 . 1688 . 1 1 45 GLN CB C 6.489 -1.301 2.414 . . . 1.0 . . . . . . . . . . . . A . 45 GLN CB . . . . . . . . . c18126_2lr2 1 . 2 . 1689 . 1 1 45 GLN CD C 7.963 -3.288 3.252 . . . 1.0 . . . . . . . . . . . . A . 45 GLN CD . . . . . . . . . c18126_2lr2 1 . 2 . 1690 . 1 1 45 GLN CG C 6.539 -2.655 3.249 . . . 1.0 . . . . . . . . . . . . A . 45 GLN CG . . . . . . . . . c18126_2lr2 1 . 2 . 1691 . 1 1 45 GLN H H 4.557 -2.285 1.021 . . . 1.0 . . . . . . . . . . . . A . 45 GLN H . . . . . . . . . c18126_2lr2 1 . 2 . 1692 . 1 1 45 GLN HA H 4.617 -0.649 3.320 . . . 1.0 . . . . . . . . . . . . A . 45 GLN HA . . . . . . . . . c18126_2lr2 1 . 2 . 1693 . 1 1 45 GLN HB2 H 6.843 -1.501 1.403 . . . 1.0 . . . . . . . . . . . . A . 45 GLN HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1694 . 1 1 45 GLN HB3 H 7.166 -0.575 2.869 . . . 1.0 . . . . . . . . . . . . A . 45 GLN HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1695 . 1 1 45 GLN HE21 H 7.414 -4.908 4.268 . . . 1.0 . . . . . . . . . . . . A . 45 GLN HE21 . . . . . . . . . c18126_2lr2 1 . 2 . 1696 . 1 1 45 GLN HE22 H 9.054 -4.845 3.835 . . . 1.0 . . . . . . . . . . . . A . 45 GLN HE22 . . . . . . . . . c18126_2lr2 1 . 2 . 1697 . 1 1 45 GLN HG2 H 6.267 -2.454 4.282 . . . 1.0 . . . . . . . . . . . . A . 45 GLN HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1698 . 1 1 45 GLN HG3 H 5.837 -3.373 2.850 . . . 1.0 . . . . . . . . . . . . A . 45 GLN HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 1699 . 1 1 45 GLN N N 4.172 -1.511 1.483 . . . 1.0 . . . . . . . . . . . . A . 45 GLN N . . . . . . . . . c18126_2lr2 1 . 2 . 1700 . 1 1 45 GLN NE2 N 8.159 -4.443 3.833 . . . 1.0 . . . . . . . . . . . . A . 45 GLN NE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1701 . 1 1 45 GLN O O 4.833 1.708 2.487 . . . 1.0 . . . . . . . . . . . . A . 45 GLN O . . . . . . . . . c18126_2lr2 1 . 2 . 1702 . 1 1 45 GLN OE1 O 8.916 -2.715 2.715 . . . 1.0 . . . . . . . . . . . . A . 45 GLN OE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1703 . 1 1 46 SER C C 4.297 2.988 0.115 . . . 1.0 . . . . . . . . . . . . A . 46 SER C . . . . . . . . . c18126_2lr2 1 . 2 . 1704 . 1 1 46 SER CA C 5.559 2.169 -0.138 . . . 1.0 . . . . . . . . . . . . A . 46 SER CA . . . . . . . . . c18126_2lr2 1 . 2 . 1705 . 1 1 46 SER CB C 5.851 1.958 -1.640 . . . 1.0 . . . . . . . . . . . . A . 46 SER CB . . . . . . . . . c18126_2lr2 1 . 2 . 1706 . 1 1 46 SER H H 5.656 0.056 -0.024 . . . 1.0 . . . . . . . . . . . . A . 46 SER H . . . . . . . . . c18126_2lr2 1 . 2 . 1707 . 1 1 46 SER HA H 6.406 2.695 0.276 . . . 1.0 . . . . . . . . . . . . A . 46 SER HA . . . . . . . . . c18126_2lr2 1 . 2 . 1708 . 1 1 46 SER HB2 H 5.925 2.912 -2.141 . . . 1.0 . . . . . . . . . . . . A . 46 SER HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1709 . 1 1 46 SER HB3 H 6.789 1.426 -1.772 . . . 1.0 . . . . . . . . . . . . A . 46 SER HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1710 . 1 1 46 SER HG H 4.900 0.292 -1.933 . . . 1.0 . . . . . . . . . . . . A . 46 SER HG . . . . . . . . . c18126_2lr2 1 . 2 . 1711 . 1 1 46 SER N N 5.457 0.861 0.498 . . . 1.0 . . . . . . . . . . . . A . 46 SER N . . . . . . . . . c18126_2lr2 1 . 2 . 1712 . 1 1 46 SER O O 4.355 4.210 0.251 . . . 1.0 . . . . . . . . . . . . A . 46 SER O . . . . . . . . . c18126_2lr2 1 . 2 . 1713 . 1 1 46 SER OG O 4.803 1.209 -2.217 . . . 1.0 . . . . . . . . . . . . A . 46 SER OG . . . . . . . . . c18126_2lr2 1 . 2 . 1714 . 1 1 47 LEU C C 1.832 3.538 1.832 . . . 1.0 . . . . . . . . . . . . A . 47 LEU C . . . . . . . . . c18126_2lr2 1 . 2 . 1715 . 1 1 47 LEU CA C 1.887 2.981 0.413 . . . 1.0 . . . . . . . . . . . . A . 47 LEU CA . . . . . . . . . c18126_2lr2 1 . 2 . 1716 . 1 1 47 LEU CB C 0.747 1.931 0.156 . . . 1.0 . . . . . . . . . . . . A . 47 LEU CB . . . . . . . . . c18126_2lr2 1 . 2 . 1717 . 1 1 47 LEU CD1 C -0.353 2.822 -2.045 . . . 1.0 . . . . . . . . . . . . A . 47 LEU CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1718 . 1 1 47 LEU CD2 C 1.854 1.540 -2.180 . . . 1.0 . . . . . . . . . . . . A . 47 LEU CD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1719 . 1 1 47 LEU CG C 0.504 1.696 -1.407 . . . 1.0 . . . . . . . . . . . . A . 47 LEU CG . . . . . . . . . c18126_2lr2 1 . 2 . 1720 . 1 1 47 LEU H H 3.172 1.334 0.060 . . . 1.0 . . . . . . . . . . . . A . 47 LEU H . . . . . . . . . c18126_2lr2 1 . 2 . 1721 . 1 1 47 LEU HA H 1.787 3.797 -0.288 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HA . . . . . . . . . c18126_2lr2 1 . 2 . 1722 . 1 1 47 LEU HB2 H 1.017 0.994 0.621 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1723 . 1 1 47 LEU HB3 H -0.173 2.265 0.618 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1724 . 1 1 47 LEU HD11 H -0.236 2.819 -3.113 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HD11 . . . . . . . . . c18126_2lr2 1 . 2 . 1725 . 1 1 47 LEU HD12 H -0.048 3.778 -1.667 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HD12 . . . . . . . . . c18126_2lr2 1 . 2 . 1726 . 1 1 47 LEU HD13 H -1.383 2.653 -1.809 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HD13 . . . . . . . . . c18126_2lr2 1 . 2 . 1727 . 1 1 47 LEU HD21 H 2.529 0.968 -1.607 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 1728 . 1 1 47 LEU HD22 H 2.296 2.500 -2.373 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 1729 . 1 1 47 LEU HD23 H 1.690 1.021 -3.098 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HD23 . . . . . . . . . c18126_2lr2 1 . 2 . 1730 . 1 1 47 LEU HG H -0.041 0.774 -1.522 . . . 1.0 . . . . . . . . . . . . A . 47 LEU HG . . . . . . . . . c18126_2lr2 1 . 2 . 1731 . 1 1 47 LEU N N 3.158 2.306 0.176 . . . 1.0 . . . . . . . . . . . . A . 47 LEU N . . . . . . . . . c18126_2lr2 1 . 2 . 1732 . 1 1 47 LEU O O 0.948 4.326 2.166 . . . 1.0 . . . . . . . . . . . . A . 47 LEU O . . . . . . . . . c18126_2lr2 1 . 2 . 1733 . 1 1 48 LYS C C 3.955 4.601 4.229 . . . 1.0 . . . . . . . . . . . . A . 48 LYS C . . . . . . . . . c18126_2lr2 1 . 2 . 1734 . 1 1 48 LYS CA C 2.832 3.585 4.044 . . . 1.0 . . . . . . . . . . . . A . 48 LYS CA . . . . . . . . . c18126_2lr2 1 . 2 . 1735 . 1 1 48 LYS CB C 3.084 2.322 4.982 . . . 1.0 . . . . . . . . . . . . A . 48 LYS CB . . . . . . . . . c18126_2lr2 1 . 2 . 1736 . 1 1 48 LYS CD C 3.533 1.446 7.451 . . . 1.0 . . . . . . . . . . . . A . 48 LYS CD . . . . . . . . . c18126_2lr2 1 . 2 . 1737 . 1 1 48 LYS CE C 3.771 1.856 8.955 . . . 1.0 . . . . . . . . . . . . A . 48 LYS CE . . . . . . . . . c18126_2lr2 1 . 2 . 1738 . 1 1 48 LYS CG C 3.272 2.712 6.520 . . . 1.0 . . . . . . . . . . . . A . 48 LYS CG . . . . . . . . . c18126_2lr2 1 . 2 . 1739 . 1 1 48 LYS H H 3.461 2.492 2.341 . . . 1.0 . . . . . . . . . . . . A . 48 LYS H . . . . . . . . . c18126_2lr2 1 . 2 . 1740 . 1 1 48 LYS HA H 1.891 4.053 4.292 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HA . . . . . . . . . c18126_2lr2 1 . 2 . 1741 . 1 1 48 LYS HB2 H 2.227 1.664 4.890 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1742 . 1 1 48 LYS HB3 H 3.952 1.768 4.643 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1743 . 1 1 48 LYS HD2 H 2.691 0.781 7.401 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1744 . 1 1 48 LYS HD3 H 4.402 0.899 7.094 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HD3 . . . . . . . . . c18126_2lr2 1 . 2 . 1745 . 1 1 48 LYS HE2 H 3.948 0.969 9.559 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1746 . 1 1 48 LYS HE3 H 4.638 2.505 9.036 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HE3 . . . . . . . . . c18126_2lr2 1 . 2 . 1747 . 1 1 48 LYS HG2 H 4.126 3.377 6.624 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1748 . 1 1 48 LYS HG3 H 2.386 3.247 6.858 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 1749 . 1 1 48 LYS HZ1 H 1.860 1.872 9.790 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HZ1 . . . . . . . . . c18126_2lr2 1 . 2 . 1750 . 1 1 48 LYS HZ2 H 2.193 3.198 8.791 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HZ2 . . . . . . . . . c18126_2lr2 1 . 2 . 1751 . 1 1 48 LYS HZ3 H 2.869 3.123 10.336 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HZ3 . . . . . . . . . c18126_2lr2 1 . 2 . 1752 . 1 1 48 LYS N N 2.782 3.121 2.662 . . . 1.0 . . . . . . . . . . . . A . 48 LYS N . . . . . . . . . c18126_2lr2 1 . 2 . 1753 . 1 1 48 LYS NZ N 2.585 2.564 9.508 . . . 1.0 . . . . . . . . . . . . A . 48 LYS NZ . . . . . . . . . c18126_2lr2 1 . 2 . 1754 . 1 1 48 LYS O O 3.886 5.466 5.101 . . . 1.0 . . . . . . . . . . . . A . 48 LYS O . . . . . . . . . c18126_2lr2 1 . 2 . 1755 . 1 1 49 ASP C C 6.318 6.739 3.517 . . . 1.0 . . . . . . . . . . . . A . 49 ASP C . . . . . . . . . c18126_2lr2 1 . 2 . 1756 . 1 1 49 ASP CA C 6.371 5.192 3.750 . . . 1.0 . . . . . . . . . . . . A . 49 ASP CA . . . . . . . . . c18126_2lr2 1 . 2 . 1757 . 1 1 49 ASP CB C 7.535 4.548 2.881 . . . 1.0 . . . . . . . . . . . . A . 49 ASP CB . . . . . . . . . c18126_2lr2 1 . 2 . 1758 . 1 1 49 ASP CG C 7.982 3.152 3.404 . . . 1.0 . . . . . . . . . . . . A . 49 ASP CG . . . . . . . . . c18126_2lr2 1 . 2 . 1759 . 1 1 49 ASP H H 5.135 3.640 2.915 . . . 1.0 . . . . . . . . . . . . A . 49 ASP H . . . . . . . . . c18126_2lr2 1 . 2 . 1760 . 1 1 49 ASP HA H 6.640 5.061 4.793 . . . 1.0 . . . . . . . . . . . . A . 49 ASP HA . . . . . . . . . c18126_2lr2 1 . 2 . 1761 . 1 1 49 ASP HB2 H 7.183 4.440 1.861 . . . 1.0 . . . . . . . . . . . . A . 49 ASP HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1762 . 1 1 49 ASP HB3 H 8.405 5.199 2.867 . . . 1.0 . . . . . . . . . . . . A . 49 ASP HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1763 . 1 1 49 ASP N N 5.093 4.411 3.519 . . . 1.0 . . . . . . . . . . . . A . 49 ASP N . . . . . . . . . c18126_2lr2 1 . 2 . 1764 . 1 1 49 ASP O O 7.305 7.437 3.810 . . . 1.0 . . . . . . . . . . . . A . 49 ASP O . . . . . . . . . c18126_2lr2 1 . 2 . 1765 . 1 1 49 ASP OD1 O 7.556 2.754 4.483 . . . 1.0 . . . . . . . . . . . . A . 49 ASP OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1766 . 1 1 49 ASP OD2 O 8.770 2.510 2.723 . . . 1.0 . . . . . . . . . . . . A . 49 ASP OD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1767 . 1 1 50 ASP C C 5.188 9.673 3.938 . . . 1.0 . . . . . . . . . . . . A . 50 ASP C . . . . . . . . . c18126_2lr2 1 . 2 . 1768 . 1 1 50 ASP CA C 5.086 8.739 2.651 . . . 1.0 . . . . . . . . . . . . A . 50 ASP CA . . . . . . . . . c18126_2lr2 1 . 2 . 1769 . 1 1 50 ASP CB C 3.715 8.943 1.933 . . . 1.0 . . . . . . . . . . . . A . 50 ASP CB . . . . . . . . . c18126_2lr2 1 . 2 . 1770 . 1 1 50 ASP CG C 3.701 8.348 0.499 . . . 1.0 . . . . . . . . . . . . A . 50 ASP CG . . . . . . . . . c18126_2lr2 1 . 2 . 1771 . 1 1 50 ASP H H 4.479 6.663 2.739 . . . 1.0 . . . . . . . . . . . . A . 50 ASP H . . . . . . . . . c18126_2lr2 1 . 2 . 1772 . 1 1 50 ASP HA H 5.891 9.026 1.969 . . . 1.0 . . . . . . . . . . . . A . 50 ASP HA . . . . . . . . . c18126_2lr2 1 . 2 . 1773 . 1 1 50 ASP HB2 H 2.936 8.462 2.520 . . . 1.0 . . . . . . . . . . . . A . 50 ASP HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1774 . 1 1 50 ASP HB3 H 3.491 10.001 1.867 . . . 1.0 . . . . . . . . . . . . A . 50 ASP HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1775 . 1 1 50 ASP N N 5.221 7.267 2.961 . . . 1.0 . . . . . . . . . . . . A . 50 ASP N . . . . . . . . . c18126_2lr2 1 . 2 . 1776 . 1 1 50 ASP O O 5.890 10.677 3.903 . . . 1.0 . . . . . . . . . . . . A . 50 ASP O . . . . . . . . . c18126_2lr2 1 . 2 . 1777 . 1 1 50 ASP OD1 O 4.767 8.061 -0.037 . . . 1.0 . . . . . . . . . . . . A . 50 ASP OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1778 . 1 1 50 ASP OD2 O 2.618 8.187 -0.034 . . . 1.0 . . . . . . . . . . . . A . 50 ASP OD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1779 . 1 1 51 SER C C 4.177 8.980 7.548 . . . 1.0 . . . . . . . . . . . . A . 51 SER C . . . . . . . . . c18126_2lr2 1 . 2 . 1780 . 1 1 51 SER CA C 4.542 10.046 6.416 . . . 1.0 . . . . . . . . . . . . A . 51 SER CA . . . . . . . . . c18126_2lr2 1 . 2 . 1781 . 1 1 51 SER CB C 3.553 11.256 6.384 . . . 1.0 . . . . . . . . . . . . A . 51 SER CB . . . . . . . . . c18126_2lr2 1 . 2 . 1782 . 1 1 51 SER H H 4.007 8.452 5.036 . . . 1.0 . . . . . . . . . . . . A . 51 SER H . . . . . . . . . c18126_2lr2 1 . 2 . 1783 . 1 1 51 SER HA H 5.566 10.410 6.568 . . . 1.0 . . . . . . . . . . . . A . 51 SER HA . . . . . . . . . c18126_2lr2 1 . 2 . 1784 . 1 1 51 SER HB2 H 3.489 11.709 7.358 . . . 1.0 . . . . . . . . . . . . A . 51 SER HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1785 . 1 1 51 SER HB3 H 3.905 12.007 5.667 . . . 1.0 . . . . . . . . . . . . A . 51 SER HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1786 . 1 1 51 SER HG H 2.090 11.118 5.099 . . . 1.0 . . . . . . . . . . . . A . 51 SER HG . . . . . . . . . c18126_2lr2 1 . 2 . 1787 . 1 1 51 SER N N 4.508 9.294 5.075 . . . 1.0 . . . . . . . . . . . . A . 51 SER N . . . . . . . . . c18126_2lr2 1 . 2 . 1788 . 1 1 51 SER O O 3.640 7.978 7.179 . . . 1.0 . . . . . . . . . . . . A . 51 SER O . . . . . . . . . c18126_2lr2 1 . 2 . 1789 . 1 1 51 SER OG O 2.266 10.799 5.990 . . . 1.0 . . . . . . . . . . . . A . 51 SER OG . . . . . . . . . c18126_2lr2 1 . 2 . 1790 . 1 1 52 TYR C C 3.439 8.305 11.296 . . . 1.0 . . . . . . . . . . . . A . 52 TYR C . . . . . . . . . c18126_2lr2 1 . 2 . 1791 . 1 1 52 TYR CA C 4.289 8.023 9.930 . . . 1.0 . . . . . . . . . . . . A . 52 TYR CA . . . . . . . . . c18126_2lr2 1 . 2 . 1792 . 1 1 52 TYR CB C 5.772 7.709 10.398 . . . 1.0 . . . . . . . . . . . . A . 52 TYR CB . . . . . . . . . c18126_2lr2 1 . 2 . 1793 . 1 1 52 TYR CD1 C 6.607 5.781 8.861 . . . 1.0 . . . . . . . . . . . . A . 52 TYR CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1794 . 1 1 52 TYR CD2 C 7.479 8.037 8.457 . . . 1.0 . . . . . . . . . . . . A . 52 TYR CD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1795 . 1 1 52 TYR CE1 C 7.397 5.305 7.791 . . . 1.0 . . . . . . . . . . . . A . 52 TYR CE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1796 . 1 1 52 TYR CE2 C 8.257 7.542 7.394 . . . 1.0 . . . . . . . . . . . . A . 52 TYR CE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1797 . 1 1 52 TYR CG C 6.640 7.162 9.213 . . . 1.0 . . . . . . . . . . . . A . 52 TYR CG . . . . . . . . . c18126_2lr2 1 . 2 . 1798 . 1 1 52 TYR CZ C 8.218 6.185 7.066 . . . 1.0 . . . . . . . . . . . . A . 52 TYR CZ . . . . . . . . . c18126_2lr2 1 . 2 . 1799 . 1 1 52 TYR H H 5.012 9.967 9.176 . . . 1.0 . . . . . . . . . . . . A . 52 TYR H . . . . . . . . . c18126_2lr2 1 . 2 . 1800 . 1 1 52 TYR HA H 3.909 7.157 9.464 . . . 1.0 . . . . . . . . . . . . A . 52 TYR HA . . . . . . . . . c18126_2lr2 1 . 2 . 1801 . 1 1 52 TYR HB2 H 6.225 8.626 10.787 . . . 1.0 . . . . . . . . . . . . A . 52 TYR HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1802 . 1 1 52 TYR HB3 H 5.763 6.986 11.219 . . . 1.0 . . . . . . . . . . . . A . 52 TYR HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1803 . 1 1 52 TYR HD1 H 5.974 5.091 9.411 . . . 1.0 . . . . . . . . . . . . A . 52 TYR HD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1804 . 1 1 52 TYR HD2 H 7.521 9.100 8.692 . . . 1.0 . . . . . . . . . . . . A . 52 TYR HD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1805 . 1 1 52 TYR HE1 H 7.372 4.253 7.522 . . . 1.0 . . . . . . . . . . . . A . 52 TYR HE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1806 . 1 1 52 TYR HE2 H 8.895 8.215 6.827 . . . 1.0 . . . . . . . . . . . . A . 52 TYR HE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1807 . 1 1 52 TYR HH H 8.913 6.321 5.285 . . . 1.0 . . . . . . . . . . . . A . 52 TYR HH . . . . . . . . . c18126_2lr2 1 . 2 . 1808 . 1 1 52 TYR N N 4.526 9.143 8.887 . . . 1.0 . . . . . . . . . . . . A . 52 TYR N . . . . . . . . . c18126_2lr2 1 . 2 . 1809 . 1 1 52 TYR O O 3.796 9.286 11.966 . . . 1.0 . . . . . . . . . . . . A . 52 TYR O . . . . . . . . . c18126_2lr2 1 . 2 . 1810 . 1 1 52 TYR OH O 8.996 5.708 6.020 . . . 1.0 . . . . . . . . . . . . A . 52 TYR OH . . . . . . . . . c18126_2lr2 1 . 2 . 1811 . 1 1 53 ILE C C 1.125 7.245 13.883 . . . 1.0 . . . . . . . . . . . . A . 53 ILE C . . . . . . . . . c18126_2lr2 1 . 2 . 1812 . 1 1 53 ILE CA C 1.707 8.244 12.924 . . . 1.0 . . . . . . . . . . . . A . 53 ILE CA . . . . . . . . . c18126_2lr2 1 . 2 . 1813 . 1 1 53 ILE CB C 0.597 9.269 12.551 . . . 1.0 . . . . . . . . . . . . A . 53 ILE CB . . . . . . . . . c18126_2lr2 1 . 2 . 1814 . 1 1 53 ILE CD1 C -0.821 11.199 13.459 . . . 1.0 . . . . . . . . . . . . A . 53 ILE CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1815 . 1 1 53 ILE CG1 C 0.049 9.994 13.797 . . . 1.0 . . . . . . . . . . . . A . 53 ILE CG1 . . . . . . . . . c18126_2lr2 1 . 2 . 1816 . 1 1 53 ILE CG2 C -0.522 8.607 11.740 . . . 1.0 . . . . . . . . . . . . A . 53 ILE CG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1817 . 1 1 53 ILE H H 1.699 6.998 11.251 . . . 1.0 . . . . . . . . . . . . A . 53 ILE H . . . . . . . . . c18126_2lr2 1 . 2 . 1818 . 1 1 53 ILE HA H 2.511 8.787 13.443 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HA . . . . . . . . . c18126_2lr2 1 . 2 . 1819 . 1 1 53 ILE HB H 1.058 10.033 11.913 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HB . . . . . . . . . c18126_2lr2 1 . 2 . 1820 . 1 1 53 ILE HD11 H -1.742 10.898 12.952 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HD11 . . . . . . . . . c18126_2lr2 1 . 2 . 1821 . 1 1 53 ILE HD12 H -0.284 11.905 12.816 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HD12 . . . . . . . . . c18126_2lr2 1 . 2 . 1822 . 1 1 53 ILE HD13 H -1.104 11.725 14.376 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HD13 . . . . . . . . . c18126_2lr2 1 . 2 . 1823 . 1 1 53 ILE HG12 H -0.536 9.310 14.421 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HG12 . . . . . . . . . c18126_2lr2 1 . 2 . 1824 . 1 1 53 ILE HG13 H 0.891 10.345 14.408 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HG13 . . . . . . . . . c18126_2lr2 1 . 2 . 1825 . 1 1 53 ILE HG21 H -1.188 9.362 11.309 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HG21 . . . . . . . . . c18126_2lr2 1 . 2 . 1826 . 1 1 53 ILE HG22 H -1.130 7.942 12.359 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HG22 . . . . . . . . . c18126_2lr2 1 . 2 . 1827 . 1 1 53 ILE HG23 H -0.124 8.021 10.907 . . . 1.0 . . . . . . . . . . . . A . 53 ILE HG23 . . . . . . . . . c18126_2lr2 1 . 2 . 1828 . 1 1 53 ILE N N 2.236 7.611 11.787 . . . 1.0 . . . . . . . . . . . . A . 53 ILE N . . . . . . . . . c18126_2lr2 1 . 2 . 1829 . 1 1 53 ILE O O 0.170 6.538 13.575 . . . 1.0 . . . . . . . . . . . . A . 53 ILE O . . . . . . . . . c18126_2lr2 1 . 2 . 1830 . 1 1 54 ASP C C -0.166 6.655 16.712 . . . 1.0 . . . . . . . . . . . . A . 54 ASP C . . . . . . . . . c18126_2lr2 1 . 2 . 1831 . 1 1 54 ASP CA C 1.144 6.214 16.124 . . . 1.0 . . . . . . . . . . . . A . 54 ASP CA . . . . . . . . . c18126_2lr2 1 . 2 . 1832 . 1 1 54 ASP CB C 2.172 6.046 17.242 . . . 1.0 . . . . . . . . . . . . A . 54 ASP CB . . . . . . . . . c18126_2lr2 1 . 2 . 1833 . 1 1 54 ASP CG C 1.503 5.458 18.480 . . . 1.0 . . . . . . . . . . . . A . 54 ASP CG . . . . . . . . . c18126_2lr2 1 . 2 . 1834 . 1 1 54 ASP H H 2.371 7.776 15.349 . . . 1.0 . . . . . . . . . . . . A . 54 ASP H . . . . . . . . . c18126_2lr2 1 . 2 . 1835 . 1 1 54 ASP HA H 1.009 5.265 15.626 . . . 1.0 . . . . . . . . . . . . A . 54 ASP HA . . . . . . . . . c18126_2lr2 1 . 2 . 1836 . 1 1 54 ASP HB2 H 2.958 5.384 16.910 . . . 1.0 . . . . . . . . . . . . A . 54 ASP HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1837 . 1 1 54 ASP HB3 H 2.596 7.009 17.487 . . . 1.0 . . . . . . . . . . . . A . 54 ASP HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1838 . 1 1 54 ASP N N 1.641 7.152 15.153 . . . 1.0 . . . . . . . . . . . . A . 54 ASP N . . . . . . . . . c18126_2lr2 1 . 2 . 1839 . 1 1 54 ASP O O -0.283 6.979 17.895 . . . 1.0 . . . . . . . . . . . . A . 54 ASP O . . . . . . . . . c18126_2lr2 1 . 2 . 1840 . 1 1 54 ASP OD1 O 0.647 4.605 18.316 . . . 1.0 . . . . . . . . . . . . A . 54 ASP OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1841 . 1 1 54 ASP OD2 O 1.856 5.870 19.574 . . . 1.0 . . . . . . . . . . . . A . 54 ASP OD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1842 . 1 1 55 THR C C -3.121 6.425 17.556 . . . 1.0 . . . . . . . . . . . . A . 55 THR C . . . . . . . . . c18126_2lr2 1 . 2 . 1843 . 1 1 55 THR CA C -2.577 7.018 16.298 . . . 1.0 . . . . . . . . . . . . A . 55 THR CA . . . . . . . . . c18126_2lr2 1 . 2 . 1844 . 1 1 55 THR CB C -3.605 6.865 15.173 . . . 1.0 . . . . . . . . . . . . A . 55 THR CB . . . . . . . . . c18126_2lr2 1 . 2 . 1845 . 1 1 55 THR CG2 C -3.037 7.450 13.879 . . . 1.0 . . . . . . . . . . . . A . 55 THR CG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1846 . 1 1 55 THR H H -1.085 6.312 14.965 . . . 1.0 . . . . . . . . . . . . A . 55 THR H . . . . . . . . . c18126_2lr2 1 . 2 . 1847 . 1 1 55 THR HA H -2.440 8.069 16.506 . . . 1.0 . . . . . . . . . . . . A . 55 THR HA . . . . . . . . . c18126_2lr2 1 . 2 . 1848 . 1 1 55 THR HB H -4.508 7.395 15.436 . . . 1.0 . . . . . . . . . . . . A . 55 THR HB . . . . . . . . . c18126_2lr2 1 . 2 . 1849 . 1 1 55 THR HG1 H -3.746 5.275 14.062 . . . 1.0 . . . . . . . . . . . . A . 55 THR HG1 . . . . . . . . . c18126_2lr2 1 . 2 . 1850 . 1 1 55 THR HG21 H -2.886 6.657 13.163 . . . 1.0 . . . . . . . . . . . . A . 55 THR HG21 . . . . . . . . . c18126_2lr2 1 . 2 . 1851 . 1 1 55 THR HG22 H -2.094 7.934 14.085 . . . 1.0 . . . . . . . . . . . . A . 55 THR HG22 . . . . . . . . . c18126_2lr2 1 . 2 . 1852 . 1 1 55 THR HG23 H -3.732 8.172 13.474 . . . 1.0 . . . . . . . . . . . . A . 55 THR HG23 . . . . . . . . . c18126_2lr2 1 . 2 . 1853 . 1 1 55 THR N N -1.230 6.661 15.870 . . . 1.0 . . . . . . . . . . . . A . 55 THR N . . . . . . . . . c18126_2lr2 1 . 2 . 1854 . 1 1 55 THR O O -3.734 7.106 18.376 . . . 1.0 . . . . . . . . . . . . A . 55 THR O . . . . . . . . . c18126_2lr2 1 . 2 . 1855 . 1 1 55 THR OG1 O -3.898 5.488 14.984 . . . 1.0 . . . . . . . . . . . . A . 55 THR OG1 . . . . . . . . . c18126_2lr2 1 . 2 . 1856 . 1 1 56 ASN C C -2.573 4.499 20.146 . . . 1.0 . . . . . . . . . . . . A . 56 ASN C . . . . . . . . . c18126_2lr2 1 . 2 . 1857 . 1 1 56 ASN CA C -3.404 4.506 18.874 . . . 1.0 . . . . . . . . . . . . A . 56 ASN CA . . . . . . . . . c18126_2lr2 1 . 2 . 1858 . 1 1 56 ASN CB C -3.762 3.056 18.545 . . . 1.0 . . . . . . . . . . . . A . 56 ASN CB . . . . . . . . . c18126_2lr2 1 . 2 . 1859 . 1 1 56 ASN CG C -4.447 2.984 17.183 . . . 1.0 . . . . . . . . . . . . A . 56 ASN CG . . . . . . . . . c18126_2lr2 1 . 2 . 1860 . 1 1 56 ASN H H -2.405 4.608 17.055 . . . 1.0 . . . . . . . . . . . . A . 56 ASN H . . . . . . . . . c18126_2lr2 1 . 2 . 1861 . 1 1 56 ASN HA H -4.308 5.037 19.137 . . . 1.0 . . . . . . . . . . . . A . 56 ASN HA . . . . . . . . . c18126_2lr2 1 . 2 . 1862 . 1 1 56 ASN HB2 H -2.860 2.461 18.526 . . . 1.0 . . . . . . . . . . . . A . 56 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1863 . 1 1 56 ASN HB3 H -4.428 2.670 19.303 . . . 1.0 . . . . . . . . . . . . A . 56 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1864 . 1 1 56 ASN HD21 H -5.056 4.872 17.226 . . . 1.0 . . . . . . . . . . . . A . 56 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 1865 . 1 1 56 ASN HD22 H -5.489 4.001 15.836 . . . 1.0 . . . . . . . . . . . . A . 56 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 1866 . 1 1 56 ASN N N -2.905 5.125 17.724 . . . 1.0 . . . . . . . . . . . . A . 56 ASN N . . . . . . . . . c18126_2lr2 1 . 2 . 1867 . 1 1 56 ASN ND2 N -5.047 4.040 16.711 . . . 1.0 . . . . . . . . . . . . A . 56 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 2 . 1868 . 1 1 56 ASN O O -2.854 3.945 21.207 . . . 1.0 . . . . . . . . . . . . A . 56 ASN O . . . . . . . . . c18126_2lr2 1 . 2 . 1869 . 1 1 56 ASN OD1 O -4.433 1.936 16.537 . . . 1.0 . . . . . . . . . . . . A . 56 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1870 . 1 1 57 ASN C C -0.004 4.217 21.792 . . . 1.0 . . . . . . . . . . . . A . 57 ASN C . . . . . . . . . c18126_2lr2 1 . 2 . 1871 . 1 1 57 ASN CA C -0.507 5.493 21.132 . . . 1.0 . . . . . . . . . . . . A . 57 ASN CA . . . . . . . . . c18126_2lr2 1 . 2 . 1872 . 1 1 57 ASN CB C -1.197 6.423 22.133 . . . 1.0 . . . . . . . . . . . . A . 57 ASN CB . . . . . . . . . c18126_2lr2 1 . 2 . 1873 . 1 1 57 ASN CG C -0.171 7.345 22.781 . . . 1.0 . . . . . . . . . . . . A . 57 ASN CG . . . . . . . . . c18126_2lr2 1 . 2 . 1874 . 1 1 57 ASN H H -1.285 5.680 19.122 . . . 1.0 . . . . . . . . . . . . A . 57 ASN H . . . . . . . . . c18126_2lr2 1 . 2 . 1875 . 1 1 57 ASN HA H 0.351 6.002 20.718 . . . 1.0 . . . . . . . . . . . . A . 57 ASN HA . . . . . . . . . c18126_2lr2 1 . 2 . 1876 . 1 1 57 ASN HB2 H -1.940 7.014 21.618 . . . 1.0 . . . . . . . . . . . . A . 57 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1877 . 1 1 57 ASN HB3 H -1.679 5.830 22.898 . . . 1.0 . . . . . . . . . . . . A . 57 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1878 . 1 1 57 ASN HD21 H 0.761 7.747 21.076 . . . 1.0 . . . . . . . . . . . . A . 57 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 1879 . 1 1 57 ASN HD22 H 1.401 8.512 22.448 . . . 1.0 . . . . . . . . . . . . A . 57 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 1880 . 1 1 57 ASN N N -1.463 5.280 19.998 . . . 1.0 . . . . . . . . . . . . A . 57 ASN N . . . . . . . . . c18126_2lr2 1 . 2 . 1881 . 1 1 57 ASN ND2 N 0.739 7.916 22.040 . . . 1.0 . . . . . . . . . . . . A . 57 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 2 . 1882 . 1 1 57 ASN O O -0.005 4.188 23.025 . . . 1.0 . . . . . . . . . . . . A . 57 ASN O . . . . . . . . . c18126_2lr2 1 . 2 . 1883 . 1 1 57 ASN OD1 O -0.202 7.554 23.994 . . . 1.0 . . . . . . . . . . . . A . 57 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1884 . 1 1 58 ASP C C 2.514 1.814 21.440 . . . 1.0 . . . . . . . . . . . . A . 58 ASP C . . . . . . . . . c18126_2lr2 1 . 2 . 1885 . 1 1 58 ASP CA C 1.024 2.085 21.670 . . . 1.0 . . . . . . . . . . . . A . 58 ASP CA . . . . . . . . . c18126_2lr2 1 . 2 . 1886 . 1 1 58 ASP CB C 0.267 0.809 21.296 . . . 1.0 . . . . . . . . . . . . A . 58 ASP CB . . . . . . . . . c18126_2lr2 1 . 2 . 1887 . 1 1 58 ASP CG C 0.256 0.635 19.781 . . . 1.0 . . . . . . . . . . . . A . 58 ASP CG . . . . . . . . . c18126_2lr2 1 . 2 . 1888 . 1 1 58 ASP H H 0.551 3.360 20.048 . . . 1.0 . . . . . . . . . . . . A . 58 ASP H . . . . . . . . . c18126_2lr2 1 . 2 . 1889 . 1 1 58 ASP HA H 0.929 2.248 22.733 . . . 1.0 . . . . . . . . . . . . A . 58 ASP HA . . . . . . . . . c18126_2lr2 1 . 2 . 1890 . 1 1 58 ASP HB2 H 0.753 -0.042 21.750 . . . 1.0 . . . . . . . . . . . . A . 58 ASP HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1891 . 1 1 58 ASP HB3 H -0.748 0.876 21.656 . . . 1.0 . . . . . . . . . . . . A . 58 ASP HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1892 . 1 1 58 ASP N N 0.530 3.262 21.024 . . . 1.0 . . . . . . . . . . . . A . 58 ASP N . . . . . . . . . c18126_2lr2 1 . 2 . 1893 . 1 1 58 ASP O O 3.042 0.758 21.792 . . . 1.0 . . . . . . . . . . . . A . 58 ASP O . . . . . . . . . c18126_2lr2 1 . 2 . 1894 . 1 1 58 ASP OD1 O 1.258 0.188 19.249 . . . 1.0 . . . . . . . . . . . . A . 58 ASP OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1895 . 1 1 58 ASP OD2 O -0.757 0.948 19.177 . . . 1.0 . . . . . . . . . . . . A . 58 ASP OD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1896 . 1 1 59 GLY C C 4.989 1.912 19.300 . . . 1.0 . . . . . . . . . . . . A . 59 GLY C . . . . . . . . . c18126_2lr2 1 . 2 . 1897 . 1 1 59 GLY CA C 4.597 2.572 20.607 . . . 1.0 . . . . . . . . . . . . A . 59 GLY CA . . . . . . . . . c18126_2lr2 1 . 2 . 1898 . 1 1 59 GLY H H 2.729 3.612 20.545 . . . 1.0 . . . . . . . . . . . . A . 59 GLY H . . . . . . . . . c18126_2lr2 1 . 2 . 1899 . 1 1 59 GLY HA2 H 5.031 3.555 20.506 . . . 1.0 . . . . . . . . . . . . A . 59 GLY HA2 . . . . . . . . . c18126_2lr2 1 . 2 . 1900 . 1 1 59 GLY HA3 H 5.071 2.057 21.430 . . . 1.0 . . . . . . . . . . . . A . 59 GLY HA3 . . . . . . . . . c18126_2lr2 1 . 2 . 1901 . 1 1 59 GLY N N 3.193 2.805 20.848 . . . 1.0 . . . . . . . . . . . . A . 59 GLY N . . . . . . . . . c18126_2lr2 1 . 2 . 1902 . 1 1 59 GLY O O 6.164 1.685 19.022 . . . 1.0 . . . . . . . . . . . . A . 59 GLY O . . . . . . . . . c18126_2lr2 1 . 2 . 1903 . 1 1 60 ALA C C 3.356 1.425 16.142 . . . 1.0 . . . . . . . . . . . . A . 60 ALA C . . . . . . . . . c18126_2lr2 1 . 2 . 1904 . 1 1 60 ALA CA C 4.184 0.836 17.283 . . . 1.0 . . . . . . . . . . . . A . 60 ALA CA . . . . . . . . . c18126_2lr2 1 . 2 . 1905 . 1 1 60 ALA CB C 3.909 -0.668 17.332 . . . 1.0 . . . . . . . . . . . . A . 60 ALA CB . . . . . . . . . c18126_2lr2 1 . 2 . 1906 . 1 1 60 ALA H H 3.075 1.742 18.819 . . . 1.0 . . . . . . . . . . . . A . 60 ALA H . . . . . . . . . c18126_2lr2 1 . 2 . 1907 . 1 1 60 ALA HA H 5.234 0.992 17.091 . . . 1.0 . . . . . . . . . . . . A . 60 ALA HA . . . . . . . . . c18126_2lr2 1 . 2 . 1908 . 1 1 60 ALA HB1 H 3.709 -0.964 18.351 . . . 1.0 . . . . . . . . . . . . A . 60 ALA HB1 . . . . . . . . . c18126_2lr2 1 . 2 . 1909 . 1 1 60 ALA HB2 H 4.771 -1.202 16.961 . . . 1.0 . . . . . . . . . . . . A . 60 ALA HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1910 . 1 1 60 ALA HB3 H 3.050 -0.895 16.716 . . . 1.0 . . . . . . . . . . . . A . 60 ALA HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1911 . 1 1 60 ALA N N 3.972 1.506 18.505 . . . 1.0 . . . . . . . . . . . . A . 60 ALA N . . . . . . . . . c18126_2lr2 1 . 2 . 1912 . 1 1 60 ALA O O 2.367 2.106 16.415 . . . 1.0 . . . . . . . . . . . . A . 60 ALA O . . . . . . . . . c18126_2lr2 1 . 2 . 1913 . 1 1 61 TYR C C 2.405 0.364 13.192 . . . 1.0 . . . . . . . . . . . . A . 61 TYR C . . . . . . . . . c18126_2lr2 1 . 2 . 1914 . 1 1 61 TYR CA C 2.995 1.686 13.723 . . . 1.0 . . . . . . . . . . . . A . 61 TYR CA . . . . . . . . . c18126_2lr2 1 . 2 . 1915 . 1 1 61 TYR CB C 3.979 2.256 12.702 . . . 1.0 . . . . . . . . . . . . A . 61 TYR CB . . . . . . . . . c18126_2lr2 1 . 2 . 1916 . 1 1 61 TYR CD1 C 4.056 4.425 13.982 . . . 1.0 . . . . . . . . . . . . A . 61 TYR CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1917 . 1 1 61 TYR CD2 C 6.142 3.437 13.238 . . . 1.0 . . . . . . . . . . . . A . 61 TYR CD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1918 . 1 1 61 TYR CE1 C 4.764 5.487 14.557 . . . 1.0 . . . . . . . . . . . . A . 61 TYR CE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1919 . 1 1 61 TYR CE2 C 6.850 4.496 13.815 . . . 1.0 . . . . . . . . . . . . A . 61 TYR CE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1920 . 1 1 61 TYR CG C 4.745 3.400 13.323 . . . 1.0 . . . . . . . . . . . . A . 61 TYR CG . . . . . . . . . c18126_2lr2 1 . 2 . 1921 . 1 1 61 TYR CZ C 6.162 5.522 14.475 . . . 1.0 . . . . . . . . . . . . A . 61 TYR CZ . . . . . . . . . c18126_2lr2 1 . 2 . 1922 . 1 1 61 TYR H H 4.580 0.696 14.777 . . . 1.0 . . . . . . . . . . . . A . 61 TYR H . . . . . . . . . c18126_2lr2 1 . 2 . 1923 . 1 1 61 TYR HA H 2.253 2.437 13.949 . . . 1.0 . . . . . . . . . . . . A . 61 TYR HA . . . . . . . . . c18126_2lr2 1 . 2 . 1924 . 1 1 61 TYR HB2 H 4.672 1.483 12.399 . . . 1.0 . . . . . . . . . . . . A . 61 TYR HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1925 . 1 1 61 TYR HB3 H 3.439 2.612 11.839 . . . 1.0 . . . . . . . . . . . . A . 61 TYR HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1926 . 1 1 61 TYR HD1 H 2.979 4.397 14.048 . . . 1.0 . . . . . . . . . . . . A . 61 TYR HD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1927 . 1 1 61 TYR HD2 H 6.672 2.645 12.729 . . . 1.0 . . . . . . . . . . . . A . 61 TYR HD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1928 . 1 1 61 TYR HE1 H 4.234 6.276 15.068 . . . 1.0 . . . . . . . . . . . . A . 61 TYR HE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1929 . 1 1 61 TYR HE2 H 7.927 4.524 13.752 . . . 1.0 . . . . . . . . . . . . A . 61 TYR HE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1930 . 1 1 61 TYR HH H 7.208 6.268 15.886 . . . 1.0 . . . . . . . . . . . . A . 61 TYR HH . . . . . . . . . c18126_2lr2 1 . 2 . 1931 . 1 1 61 TYR N N 3.746 1.201 14.882 . . . 1.0 . . . . . . . . . . . . A . 61 TYR N . . . . . . . . . c18126_2lr2 1 . 2 . 1932 . 1 1 61 TYR O O 3.122 -0.514 12.712 . . . 1.0 . . . . . . . . . . . . A . 61 TYR O . . . . . . . . . c18126_2lr2 1 . 2 . 1933 . 1 1 61 TYR OH O 6.861 6.567 15.043 . . . 1.0 . . . . . . . . . . . . A . 61 TYR OH . . . . . . . . . c18126_2lr2 1 . 2 . 1934 . 1 1 62 GLU C C -1.004 -0.712 12.203 . . . 1.0 . . . . . . . . . . . . A . 62 GLU C . . . . . . . . . c18126_2lr2 1 . 2 . 1935 . 1 1 62 GLU CA C 0.416 -0.926 12.746 . . . 1.0 . . . . . . . . . . . . A . 62 GLU CA . . . . . . . . . c18126_2lr2 1 . 2 . 1936 . 1 1 62 GLU CB C 0.330 -1.917 13.908 . . . 1.0 . . . . . . . . . . . . A . 62 GLU CB . . . . . . . . . c18126_2lr2 1 . 2 . 1937 . 1 1 62 GLU CD C -0.940 -0.022 14.932 . . . 1.0 . . . . . . . . . . . . A . 62 GLU CD . . . . . . . . . c18126_2lr2 1 . 2 . 1938 . 1 1 62 GLU CG C -0.840 -1.538 14.816 . . . 1.0 . . . . . . . . . . . . A . 62 GLU CG . . . . . . . . . c18126_2lr2 1 . 2 . 1939 . 1 1 62 GLU H H 0.518 1.069 13.547 . . . 1.0 . . . . . . . . . . . . A . 62 GLU H . . . . . . . . . c18126_2lr2 1 . 2 . 1940 . 1 1 62 GLU HA H 1.044 -1.349 11.974 . . . 1.0 . . . . . . . . . . . . A . 62 GLU HA . . . . . . . . . c18126_2lr2 1 . 2 . 1941 . 1 1 62 GLU HB2 H 0.176 -2.915 13.519 . . . 1.0 . . . . . . . . . . . . A . 62 GLU HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1942 . 1 1 62 GLU HB3 H 1.247 -1.890 14.476 . . . 1.0 . . . . . . . . . . . . A . 62 GLU HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1943 . 1 1 62 GLU HG2 H -1.760 -1.928 14.398 . . . 1.0 . . . . . . . . . . . . A . 62 GLU HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1944 . 1 1 62 GLU HG3 H -0.686 -1.961 15.797 . . . 1.0 . . . . . . . . . . . . A . 62 GLU HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 1945 . 1 1 62 GLU N N 1.043 0.308 13.216 . . . 1.0 . . . . . . . . . . . . A . 62 GLU N . . . . . . . . . c18126_2lr2 1 . 2 . 1946 . 1 1 62 GLU O O -1.613 0.348 12.345 . . . 1.0 . . . . . . . . . . . . A . 62 GLU O . . . . . . . . . c18126_2lr2 1 . 2 . 1947 . 1 1 62 GLU OE1 O -0.031 0.571 15.492 . . . 1.0 . . . . . . . . . . . . A . 62 GLU OE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1948 . 1 1 62 GLU OE2 O -1.924 0.527 14.459 . . . 1.0 . . . . . . . . . . . . A . 62 GLU OE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1949 . 1 1 63 GLY C C -3.336 -0.498 10.314 . . . 1.0 . . . . . . . . . . . . A . 63 GLY C . . . . . . . . . c18126_2lr2 1 . 2 . 1950 . 1 1 63 GLY CA C -2.846 -1.736 11.027 . . . 1.0 . . . . . . . . . . . . A . 63 GLY CA . . . . . . . . . c18126_2lr2 1 . 2 . 1951 . 1 1 63 GLY H H -0.990 -2.563 11.503 . . . 1.0 . . . . . . . . . . . . A . 63 GLY H . . . . . . . . . c18126_2lr2 1 . 2 . 1952 . 1 1 63 GLY HA2 H -2.890 -2.513 10.276 . . . 1.0 . . . . . . . . . . . . A . 63 GLY HA2 . . . . . . . . . c18126_2lr2 1 . 2 . 1953 . 1 1 63 GLY HA3 H -3.554 -1.963 11.811 . . . 1.0 . . . . . . . . . . . . A . 63 GLY HA3 . . . . . . . . . c18126_2lr2 1 . 2 . 1954 . 1 1 63 GLY N N -1.534 -1.750 11.592 . . . 1.0 . . . . . . . . . . . . A . 63 GLY N . . . . . . . . . c18126_2lr2 1 . 2 . 1955 . 1 1 63 GLY O O -2.726 -0.082 9.330 . . . 1.0 . . . . . . . . . . . . A . 63 GLY O . . . . . . . . . c18126_2lr2 1 . 2 . 1956 . 1 1 64 ASP C C -4.019 2.466 10.212 . . . 1.0 . . . . . . . . . . . . A . 64 ASP C . . . . . . . . . c18126_2lr2 1 . 2 . 1957 . 1 1 64 ASP CA C -4.988 1.285 10.177 . . . 1.0 . . . . . . . . . . . . A . 64 ASP CA . . . . . . . . . c18126_2lr2 1 . 2 . 1958 . 1 1 64 ASP CB C -6.289 1.677 10.879 . . . 1.0 . . . . . . . . . . . . A . 64 ASP CB . . . . . . . . . c18126_2lr2 1 . 2 . 1959 . 1 1 64 ASP CG C -6.802 3.002 10.321 . . . 1.0 . . . . . . . . . . . . A . 64 ASP CG . . . . . . . . . c18126_2lr2 1 . 2 . 1960 . 1 1 64 ASP H H -4.873 -0.319 11.604 . . . 1.0 . . . . . . . . . . . . A . 64 ASP H . . . . . . . . . c18126_2lr2 1 . 2 . 1961 . 1 1 64 ASP HA H -5.211 1.019 9.154 . . . 1.0 . . . . . . . . . . . . A . 64 ASP HA . . . . . . . . . c18126_2lr2 1 . 2 . 1962 . 1 1 64 ASP HB2 H -7.030 0.909 10.716 . . . 1.0 . . . . . . . . . . . . A . 64 ASP HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1963 . 1 1 64 ASP HB3 H -6.109 1.783 11.937 . . . 1.0 . . . . . . . . . . . . A . 64 ASP HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1964 . 1 1 64 ASP N N -4.425 0.082 10.831 . . . 1.0 . . . . . . . . . . . . A . 64 ASP N . . . . . . . . . c18126_2lr2 1 . 2 . 1965 . 1 1 64 ASP O O -4.272 3.415 9.473 . . . 1.0 . . . . . . . . . . . . A . 64 ASP O . . . . . . . . . c18126_2lr2 1 . 2 . 1966 . 1 1 64 ASP OD1 O -6.766 3.168 9.113 . . . 1.0 . . . . . . . . . . . . A . 64 ASP OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1967 . 1 1 64 ASP OD2 O -7.223 3.830 11.111 . . . 1.0 . . . . . . . . . . . . A . 64 ASP OD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1968 . 1 1 65 GLU C C -1.088 3.320 9.677 . . . 1.0 . . . . . . . . . . . . A . 65 GLU C . . . . . . . . . c18126_2lr2 1 . 2 . 1969 . 1 1 65 GLU CA C -1.992 3.409 10.924 . . . 1.0 . . . . . . . . . . . . A . 65 GLU CA . . . . . . . . . c18126_2lr2 1 . 2 . 1970 . 1 1 65 GLU CB C -1.108 3.238 12.185 . . . 1.0 . . . . . . . . . . . . A . 65 GLU CB . . . . . . . . . c18126_2lr2 1 . 2 . 1971 . 1 1 65 GLU CD C -2.715 3.389 14.307 . . . 1.0 . . . . . . . . . . . . A . 65 GLU CD . . . . . . . . . c18126_2lr2 1 . 2 . 1972 . 1 1 65 GLU CG C -1.712 4.094 13.360 . . . 1.0 . . . . . . . . . . . . A . 65 GLU CG . . . . . . . . . c18126_2lr2 1 . 2 . 1973 . 1 1 65 GLU H H -2.828 1.562 11.498 . . . 1.0 . . . . . . . . . . . . A . 65 GLU H . . . . . . . . . c18126_2lr2 1 . 2 . 1974 . 1 1 65 GLU HA H -2.421 4.389 11.028 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HA . . . . . . . . . c18126_2lr2 1 . 2 . 1975 . 1 1 65 GLU HB2 H -1.057 2.194 12.463 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1976 . 1 1 65 GLU HB3 H -0.101 3.598 11.978 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1977 . 1 1 65 GLU HG2 H -0.913 4.450 13.956 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 1978 . 1 1 65 GLU HG3 H -2.210 4.949 12.938 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 1979 . 1 1 65 GLU N N -2.931 2.333 10.929 . . . 1.0 . . . . . . . . . . . . A . 65 GLU N . . . . . . . . . c18126_2lr2 1 . 2 . 1980 . 1 1 65 GLU O O -0.274 4.203 9.385 . . . 1.0 . . . . . . . . . . . . A . 65 GLU O . . . . . . . . . c18126_2lr2 1 . 2 . 1981 . 1 1 65 GLU OE1 O -2.569 2.233 14.558 . . . 1.0 . . . . . . . . . . . . A . 65 GLU OE1 . . . . . . . . . c18126_2lr2 1 . 2 . 1982 . 1 1 65 GLU OE2 O -3.596 4.071 14.819 . . . 1.0 . . . . . . . . . . . . A . 65 GLU OE2 . . . . . . . . . c18126_2lr2 1 . 2 . 1983 . 1 1 66 LEU C C -0.562 2.553 6.339 . . . 1.0 . . . . . . . . . . . . A . 66 LEU C . . . . . . . . . c18126_2lr2 1 . 2 . 1984 . 1 1 66 LEU CA C -0.331 1.825 7.780 . . . 1.0 . . . . . . . . . . . . A . 66 LEU CA . . . . . . . . . c18126_2lr2 1 . 2 . 1985 . 1 1 66 LEU CB C -0.171 0.227 7.652 . . . 1.0 . . . . . . . . . . . . A . 66 LEU CB . . . . . . . . . c18126_2lr2 1 . 2 . 1986 . 1 1 66 LEU CD1 C -0.414 -1.889 6.106 . . . 1.0 . . . . . . . . . . . . A . 66 LEU CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 1987 . 1 1 66 LEU CD2 C -2.460 -0.323 6.485 . . . 1.0 . . . . . . . . . . . . A . 66 LEU CD2 . . . . . . . . . c18126_2lr2 1 . 2 . 1988 . 1 1 66 LEU CG C -0.885 -0.414 6.375 . . . 1.0 . . . . . . . . . . . . A . 66 LEU CG . . . . . . . . . c18126_2lr2 1 . 2 . 1989 . 1 1 66 LEU H H -1.844 1.441 9.242 . . . 1.0 . . . . . . . . . . . . A . 66 LEU H . . . . . . . . . c18126_2lr2 1 . 2 . 1990 . 1 1 66 LEU HA H 0.607 2.161 8.112 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HA . . . . . . . . . c18126_2lr2 1 . 2 . 1991 . 1 1 66 LEU HB2 H 0.884 0.019 7.593 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 1992 . 1 1 66 LEU HB3 H -0.525 -0.263 8.557 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 1993 . 1 1 66 LEU HD11 H 0.643 -1.898 5.841 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HD11 . . . . . . . . . c18126_2lr2 1 . 2 . 1994 . 1 1 66 LEU HD12 H -0.971 -2.290 5.274 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HD12 . . . . . . . . . c18126_2lr2 1 . 2 . 1995 . 1 1 66 LEU HD13 H -0.570 -2.512 6.979 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HD13 . . . . . . . . . c18126_2lr2 1 . 2 . 1996 . 1 1 66 LEU HD21 H -2.840 -1.136 7.091 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 1997 . 1 1 66 LEU HD22 H -2.882 -0.398 5.500 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 1998 . 1 1 66 LEU HD23 H -2.774 0.625 6.916 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HD23 . . . . . . . . . c18126_2lr2 1 . 2 . 1999 . 1 1 66 LEU HG H -0.582 0.131 5.492 . . . 1.0 . . . . . . . . . . . . A . 66 LEU HG . . . . . . . . . c18126_2lr2 1 . 2 . 2000 . 1 1 66 LEU N N -1.217 2.145 8.931 . . . 1.0 . . . . . . . . . . . . A . 66 LEU N . . . . . . . . . c18126_2lr2 1 . 2 . 2001 . 1 1 66 LEU O O 0.203 2.273 5.464 . . . 1.0 . . . . . . . . . . . . A . 66 LEU O . . . . . . . . . c18126_2lr2 1 . 2 . 2002 . 1 1 67 SER C C -0.974 5.432 4.342 . . . 1.0 . . . . . . . . . . . . A . 67 SER C . . . . . . . . . c18126_2lr2 1 . 2 . 2003 . 1 1 67 SER CA C -1.806 4.089 4.637 . . . 1.0 . . . . . . . . . . . . A . 67 SER CA . . . . . . . . . c18126_2lr2 1 . 2 . 2004 . 1 1 67 SER CB C -3.329 4.356 4.503 . . . 1.0 . . . . . . . . . . . . A . 67 SER CB . . . . . . . . . c18126_2lr2 1 . 2 . 2005 . 1 1 67 SER H H -2.237 3.658 6.763 . . . 1.0 . . . . . . . . . . . . A . 67 SER H . . . . . . . . . c18126_2lr2 1 . 2 . 2006 . 1 1 67 SER HA H -1.536 3.361 3.869 . . . 1.0 . . . . . . . . . . . . A . 67 SER HA . . . . . . . . . c18126_2lr2 1 . 2 . 2007 . 1 1 67 SER HB2 H -3.687 4.640 5.451 . . . 1.0 . . . . . . . . . . . . A . 67 SER HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2008 . 1 1 67 SER HB3 H -3.546 5.150 3.817 . . . 1.0 . . . . . . . . . . . . A . 67 SER HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2009 . 1 1 67 SER HG H -4.872 3.177 4.594 . . . 1.0 . . . . . . . . . . . . A . 67 SER HG . . . . . . . . . c18126_2lr2 1 . 2 . 2010 . 1 1 67 SER N N -1.590 3.438 6.057 . . . 1.0 . . . . . . . . . . . . A . 67 SER N . . . . . . . . . c18126_2lr2 1 . 2 . 2011 . 1 1 67 SER O O -0.627 6.145 5.267 . . . 1.0 . . . . . . . . . . . . A . 67 SER O . . . . . . . . . c18126_2lr2 1 . 2 . 2012 . 1 1 67 SER OG O -4.027 3.174 4.130 . . . 1.0 . . . . . . . . . . . . A . 67 SER OG . . . . . . . . . c18126_2lr2 1 . 2 . 2013 . 1 1 68 GLY C C -0.697 8.082 1.911 . . . 1.0 . . . . . . . . . . . . A . 68 GLY C . . . . . . . . . c18126_2lr2 1 . 2 . 2014 . 1 1 68 GLY CA C 0.145 7.002 2.614 . . . 1.0 . . . . . . . . . . . . A . 68 GLY CA . . . . . . . . . c18126_2lr2 1 . 2 . 2015 . 1 1 68 GLY H H -0.946 5.160 2.289 . . . 1.0 . . . . . . . . . . . . A . 68 GLY H . . . . . . . . . c18126_2lr2 1 . 2 . 2016 . 1 1 68 GLY HA2 H 0.579 7.455 3.482 . . . 1.0 . . . . . . . . . . . . A . 68 GLY HA2 . . . . . . . . . c18126_2lr2 1 . 2 . 2017 . 1 1 68 GLY HA3 H 0.952 6.724 1.945 . . . 1.0 . . . . . . . . . . . . A . 68 GLY HA3 . . . . . . . . . c18126_2lr2 1 . 2 . 2018 . 1 1 68 GLY N N -0.649 5.760 3.016 . . . 1.0 . . . . . . . . . . . . A . 68 GLY N . . . . . . . . . c18126_2lr2 1 . 2 . 2019 . 1 1 68 GLY O O -1.758 8.470 2.413 . . . 1.0 . . . . . . . . . . . . A . 68 GLY O . . . . . . . . . c18126_2lr2 1 . 2 . 2020 . 1 1 69 SER C C -0.474 9.560 -1.529 . . . 1.0 . . . . . . . . . . . . A . 69 SER C . . . . . . . . . c18126_2lr2 1 . 2 . 2021 . 1 1 69 SER CA C -0.813 9.689 -0.030 . . . 1.0 . . . . . . . . . . . . A . 69 SER CA . . . . . . . . . c18126_2lr2 1 . 2 . 2022 . 1 1 69 SER CB C -0.321 11.072 0.495 . . . 1.0 . . . . . . . . . . . . A . 69 SER CB . . . . . . . . . c18126_2lr2 1 . 2 . 2023 . 1 1 69 SER H H 0.705 8.266 0.457 . . . 1.0 . . . . . . . . . . . . A . 69 SER H . . . . . . . . . c18126_2lr2 1 . 2 . 2024 . 1 1 69 SER HA H -1.898 9.626 0.083 . . . 1.0 . . . . . . . . . . . . A . 69 SER HA . . . . . . . . . c18126_2lr2 1 . 2 . 2025 . 1 1 69 SER HB2 H -0.895 11.874 0.050 . . . 1.0 . . . . . . . . . . . . A . 69 SER HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2026 . 1 1 69 SER HB3 H -0.440 11.108 1.563 . . . 1.0 . . . . . . . . . . . . A . 69 SER HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2027 . 1 1 69 SER HG H 1.217 12.194 0.081 . . . 1.0 . . . . . . . . . . . . A . 69 SER HG . . . . . . . . . c18126_2lr2 1 . 2 . 2028 . 1 1 69 SER N N -0.163 8.606 0.761 . . . 1.0 . . . . . . . . . . . . A . 69 SER N . . . . . . . . . c18126_2lr2 1 . 2 . 2029 . 1 1 69 SER O O -1.369 9.602 -2.381 . . . 1.0 . . . . . . . . . . . . A . 69 SER O . . . . . . . . . c18126_2lr2 1 . 2 . 2030 . 1 1 69 SER OG O 1.054 11.253 0.168 . . . 1.0 . . . . . . . . . . . . A . 69 SER OG . . . . . . . . . c18126_2lr2 1 . 2 . 2031 . 1 1 70 GLN C C 1.061 7.938 -3.835 . . . 1.0 . . . . . . . . . . . . A . 70 GLN C . . . . . . . . . c18126_2lr2 1 . 2 . 2032 . 1 1 70 GLN CA C 1.381 9.330 -3.233 . . . 1.0 . . . . . . . . . . . . A . 70 GLN CA . . . . . . . . . c18126_2lr2 1 . 2 . 2033 . 1 1 70 GLN CB C 2.961 9.522 -3.198 . . . 1.0 . . . . . . . . . . . . A . 70 GLN CB . . . . . . . . . c18126_2lr2 1 . 2 . 2034 . 1 1 70 GLN CD C 2.936 12.100 -3.537 . . . 1.0 . . . . . . . . . . . . A . 70 GLN CD . . . . . . . . . c18126_2lr2 1 . 2 . 2035 . 1 1 70 GLN CG C 3.414 10.932 -2.647 . . . 1.0 . . . . . . . . . . . . A . 70 GLN CG . . . . . . . . . c18126_2lr2 1 . 2 . 2036 . 1 1 70 GLN H H 1.491 9.439 -1.090 . . . 1.0 . . . . . . . . . . . . A . 70 GLN H . . . . . . . . . c18126_2lr2 1 . 2 . 2037 . 1 1 70 GLN HA H 0.931 10.083 -3.861 . . . 1.0 . . . . . . . . . . . . A . 70 GLN HA . . . . . . . . . c18126_2lr2 1 . 2 . 2038 . 1 1 70 GLN HB2 H 3.398 8.744 -2.573 . . . 1.0 . . . . . . . . . . . . A . 70 GLN HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2039 . 1 1 70 GLN HB3 H 3.360 9.397 -4.209 . . . 1.0 . . . . . . . . . . . . A . 70 GLN HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2040 . 1 1 70 GLN HE21 H 2.089 13.097 -2.041 . . . 1.0 . . . . . . . . . . . . A . 70 GLN HE21 . . . . . . . . . c18126_2lr2 1 . 2 . 2041 . 1 1 70 GLN HE22 H 1.972 13.842 -3.562 . . . 1.0 . . . . . . . . . . . . A . 70 GLN HE22 . . . . . . . . . c18126_2lr2 1 . 2 . 2042 . 1 1 70 GLN HG2 H 3.035 11.071 -1.640 . . . 1.0 . . . . . . . . . . . . A . 70 GLN HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 2043 . 1 1 70 GLN HG3 H 4.499 10.964 -2.597 . . . 1.0 . . . . . . . . . . . . A . 70 GLN HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 2044 . 1 1 70 GLN N N 0.843 9.432 -1.835 . . . 1.0 . . . . . . . . . . . . A . 70 GLN N . . . . . . . . . c18126_2lr2 1 . 2 . 2045 . 1 1 70 GLN NE2 N 2.276 13.096 -3.002 . . . 1.0 . . . . . . . . . . . . A . 70 GLN NE2 . . . . . . . . . c18126_2lr2 1 . 2 . 2046 . 1 1 70 GLN O O 1.857 7.355 -4.575 . . . 1.0 . . . . . . . . . . . . A . 70 GLN O . . . . . . . . . c18126_2lr2 1 . 2 . 2047 . 1 1 70 GLN OE1 O 3.174 12.104 -4.747 . . . 1.0 . . . . . . . . . . . . A . 70 GLN OE1 . . . . . . . . . c18126_2lr2 1 . 2 . 2048 . 1 1 71 SER C C -0.818 5.849 -5.346 . . . 1.0 . . . . . . . . . . . . A . 71 SER C . . . . . . . . . c18126_2lr2 1 . 2 . 2049 . 1 1 71 SER CA C -0.551 6.059 -3.868 . . . 1.0 . . . . . . . . . . . . A . 71 SER CA . . . . . . . . . c18126_2lr2 1 . 2 . 2050 . 1 1 71 SER CB C -1.809 5.714 -3.081 . . . 1.0 . . . . . . . . . . . . A . 71 SER CB . . . . . . . . . c18126_2lr2 1 . 2 . 2051 . 1 1 71 SER H H -0.655 7.888 -2.836 . . . 1.0 . . . . . . . . . . . . A . 71 SER H . . . . . . . . . c18126_2lr2 1 . 2 . 2052 . 1 1 71 SER HA H 0.222 5.366 -3.562 . . . 1.0 . . . . . . . . . . . . A . 71 SER HA . . . . . . . . . c18126_2lr2 1 . 2 . 2053 . 1 1 71 SER HB2 H -2.161 4.736 -3.340 . . . 1.0 . . . . . . . . . . . . A . 71 SER HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2054 . 1 1 71 SER HB3 H -1.601 5.728 -2.038 . . . 1.0 . . . . . . . . . . . . A . 71 SER HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2055 . 1 1 71 SER HG H -2.600 7.465 -2.902 . . . 1.0 . . . . . . . . . . . . A . 71 SER HG . . . . . . . . . c18126_2lr2 1 . 2 . 2056 . 1 1 71 SER N N -0.088 7.395 -3.459 . . . 1.0 . . . . . . . . . . . . A . 71 SER N . . . . . . . . . c18126_2lr2 1 . 2 . 2057 . 1 1 71 SER O O -0.773 4.704 -5.805 . . . 1.0 . . . . . . . . . . . . A . 71 SER O . . . . . . . . . c18126_2lr2 1 . 2 . 2058 . 1 1 71 SER OG O -2.826 6.659 -3.374 . . . 1.0 . . . . . . . . . . . . A . 71 SER OG . . . . . . . . . c18126_2lr2 1 . 2 . 2059 . 1 1 72 ALA C C -0.520 6.100 -8.316 . . . 1.0 . . . . . . . . . . . . A . 72 ALA C . . . . . . . . . c18126_2lr2 1 . 2 . 2060 . 1 1 72 ALA CA C -1.647 6.759 -7.474 . . . 1.0 . . . . . . . . . . . . A . 72 ALA CA . . . . . . . . . c18126_2lr2 1 . 2 . 2061 . 1 1 72 ALA CB C -1.988 8.177 -8.071 . . . 1.0 . . . . . . . . . . . . A . 72 ALA CB . . . . . . . . . c18126_2lr2 1 . 2 . 2062 . 1 1 72 ALA H H -1.367 7.768 -5.616 . . . 1.0 . . . . . . . . . . . . A . 72 ALA H . . . . . . . . . c18126_2lr2 1 . 2 . 2063 . 1 1 72 ALA HA H -2.520 6.125 -7.521 . . . 1.0 . . . . . . . . . . . . A . 72 ALA HA . . . . . . . . . c18126_2lr2 1 . 2 . 2064 . 1 1 72 ALA HB1 H -2.787 8.619 -7.496 . . . 1.0 . . . . . . . . . . . . A . 72 ALA HB1 . . . . . . . . . c18126_2lr2 1 . 2 . 2065 . 1 1 72 ALA HB2 H -2.300 8.091 -9.110 . . . 1.0 . . . . . . . . . . . . A . 72 ALA HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2066 . 1 1 72 ALA HB3 H -1.120 8.838 -8.024 . . . 1.0 . . . . . . . . . . . . A . 72 ALA HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2067 . 1 1 72 ALA N N -1.228 6.908 -6.065 . . . 1.0 . . . . . . . . . . . . A . 72 ALA N . . . . . . . . . c18126_2lr2 1 . 2 . 2068 . 1 1 72 ALA O O -0.796 5.223 -9.165 . . . 1.0 . . . . . . . . . . . . A . 72 ALA O . . . . . . . . . c18126_2lr2 1 . 2 . 2069 . 1 1 73 ASN C C 2.123 4.588 -8.549 . . . 1.0 . . . . . . . . . . . . A . 73 ASN C . . . . . . . . . c18126_2lr2 1 . 2 . 2070 . 1 1 73 ASN CA C 1.864 6.055 -8.880 . . . 1.0 . . . . . . . . . . . . A . 73 ASN CA . . . . . . . . . c18126_2lr2 1 . 2 . 2071 . 1 1 73 ASN CB C 3.129 6.938 -8.556 . . . 1.0 . . . . . . . . . . . . A . 73 ASN CB . . . . . . . . . c18126_2lr2 1 . 2 . 2072 . 1 1 73 ASN CG C 3.070 8.310 -9.287 . . . 1.0 . . . . . . . . . . . . A . 73 ASN CG . . . . . . . . . c18126_2lr2 1 . 2 . 2073 . 1 1 73 ASN H H 0.861 7.268 -7.462 . . . 1.0 . . . . . . . . . . . . A . 73 ASN H . . . . . . . . . c18126_2lr2 1 . 2 . 2074 . 1 1 73 ASN HA H 1.650 6.143 -9.935 . . . 1.0 . . . . . . . . . . . . A . 73 ASN HA . . . . . . . . . c18126_2lr2 1 . 2 . 2075 . 1 1 73 ASN HB2 H 3.194 7.109 -7.483 . . . 1.0 . . . . . . . . . . . . A . 73 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2076 . 1 1 73 ASN HB3 H 4.032 6.421 -8.880 . . . 1.0 . . . . . . . . . . . . A . 73 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2077 . 1 1 73 ASN HD21 H 4.424 9.166 -8.116 . . . 1.0 . . . . . . . . . . . . A . 73 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 2078 . 1 1 73 ASN HD22 H 3.783 10.160 -9.333 . . . 1.0 . . . . . . . . . . . . A . 73 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 2079 . 1 1 73 ASN N N 0.725 6.557 -8.122 . . . 1.0 . . . . . . . . . . . . A . 73 ASN N . . . . . . . . . c18126_2lr2 1 . 2 . 2080 . 1 1 73 ASN ND2 N 3.823 9.293 -8.877 . . . 1.0 . . . . . . . . . . . . A . 73 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 2 . 2081 . 1 1 73 ASN O O 2.298 3.761 -9.444 . . . 1.0 . . . . . . . . . . . . A . 73 ASN O . . . . . . . . . c18126_2lr2 1 . 2 . 2082 . 1 1 73 ASN OD1 O 2.319 8.494 -10.252 . . . 1.0 . . . . . . . . . . . . A . 73 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 2083 . 1 1 74 LEU C C 1.299 1.975 -7.353 . . . 1.0 . . . . . . . . . . . . A . 74 LEU C . . . . . . . . . c18126_2lr2 1 . 2 . 2084 . 1 1 74 LEU CA C 2.385 2.903 -6.820 . . . 1.0 . . . . . . . . . . . . A . 74 LEU CA . . . . . . . . . c18126_2lr2 1 . 2 . 2085 . 1 1 74 LEU CB C 2.451 2.846 -5.270 . . . 1.0 . . . . . . . . . . . . A . 74 LEU CB . . . . . . . . . c18126_2lr2 1 . 2 . 2086 . 1 1 74 LEU CD1 C 5.029 2.262 -5.022 . . . 1.0 . . . . . . . . . . . . A . 74 LEU CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 2087 . 1 1 74 LEU CD2 C 4.293 4.758 -5.101 . . . 1.0 . . . . . . . . . . . . A . 74 LEU CD2 . . . . . . . . . c18126_2lr2 1 . 2 . 2088 . 1 1 74 LEU CG C 3.886 3.297 -4.671 . . . 1.0 . . . . . . . . . . . . A . 74 LEU CG . . . . . . . . . c18126_2lr2 1 . 2 . 2089 . 1 1 74 LEU H H 2.002 4.975 -6.588 . . . 1.0 . . . . . . . . . . . . A . 74 LEU H . . . . . . . . . c18126_2lr2 1 . 2 . 2090 . 1 1 74 LEU HA H 3.343 2.576 -7.197 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HA . . . . . . . . . c18126_2lr2 1 . 2 . 2091 . 1 1 74 LEU HB2 H 1.667 3.464 -4.851 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2092 . 1 1 74 LEU HB3 H 2.256 1.818 -4.986 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2093 . 1 1 74 LEU HD11 H 5.956 2.555 -4.555 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HD11 . . . . . . . . . c18126_2lr2 1 . 2 . 2094 . 1 1 74 LEU HD12 H 5.191 2.208 -6.085 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HD12 . . . . . . . . . c18126_2lr2 1 . 2 . 2095 . 1 1 74 LEU HD13 H 4.756 1.288 -4.663 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HD13 . . . . . . . . . c18126_2lr2 1 . 2 . 2096 . 1 1 74 LEU HD21 H 3.445 5.421 -5.017 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 2097 . 1 1 74 LEU HD22 H 4.660 4.773 -6.120 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 2098 . 1 1 74 LEU HD23 H 5.070 5.115 -4.438 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HD23 . . . . . . . . . c18126_2lr2 1 . 2 . 2099 . 1 1 74 LEU HG H 3.812 3.311 -3.593 . . . 1.0 . . . . . . . . . . . . A . 74 LEU HG . . . . . . . . . c18126_2lr2 1 . 2 . 2100 . 1 1 74 LEU N N 2.147 4.274 -7.258 . . . 1.0 . . . . . . . . . . . . A . 74 LEU N . . . . . . . . . c18126_2lr2 1 . 2 . 2101 . 1 1 74 LEU O O 1.586 0.874 -7.823 . . . 1.0 . . . . . . . . . . . . A . 74 LEU O . . . . . . . . . c18126_2lr2 1 . 2 . 2102 . 1 1 75 LEU C C -0.883 1.266 -9.223 . . . 1.0 . . . . . . . . . . . . A . 75 LEU C . . . . . . . . . c18126_2lr2 1 . 2 . 2103 . 1 1 75 LEU CA C -1.071 1.627 -7.754 . . . 1.0 . . . . . . . . . . . . A . 75 LEU CA . . . . . . . . . c18126_2lr2 1 . 2 . 2104 . 1 1 75 LEU CB C -2.410 2.446 -7.616 . . . 1.0 . . . . . . . . . . . . A . 75 LEU CB . . . . . . . . . c18126_2lr2 1 . 2 . 2105 . 1 1 75 LEU CD1 C -3.998 0.367 -7.969 . . . 1.0 . . . . . . . . . . . . A . 75 LEU CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 2106 . 1 1 75 LEU CD2 C -4.941 2.738 -8.353 . . . 1.0 . . . . . . . . . . . . A . 75 LEU CD2 . . . . . . . . . c18126_2lr2 1 . 2 . 2107 . 1 1 75 LEU CG C -3.649 1.803 -8.431 . . . 1.0 . . . . . . . . . . . . A . 75 LEU CG . . . . . . . . . c18126_2lr2 1 . 2 . 2108 . 1 1 75 LEU H H -0.117 3.311 -6.891 . . . 1.0 . . . . . . . . . . . . A . 75 LEU H . . . . . . . . . c18126_2lr2 1 . 2 . 2109 . 1 1 75 LEU HA H -1.125 0.717 -7.174 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HA . . . . . . . . . c18126_2lr2 1 . 2 . 2110 . 1 1 75 LEU HB2 H -2.656 2.490 -6.578 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2111 . 1 1 75 LEU HB3 H -2.242 3.459 -7.959 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2112 . 1 1 75 LEU HD11 H -3.221 -0.328 -8.241 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HD11 . . . . . . . . . c18126_2lr2 1 . 2 . 2113 . 1 1 75 LEU HD12 H -4.882 0.072 -8.473 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HD12 . . . . . . . . . c18126_2lr2 1 . 2 . 2114 . 1 1 75 LEU HD13 H -4.158 0.335 -6.899 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HD13 . . . . . . . . . c18126_2lr2 1 . 2 . 2115 . 1 1 75 LEU HD21 H -5.630 2.465 -9.145 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 2116 . 1 1 75 LEU HD22 H -4.669 3.780 -8.482 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 2117 . 1 1 75 LEU HD23 H -5.443 2.623 -7.410 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HD23 . . . . . . . . . c18126_2lr2 1 . 2 . 2118 . 1 1 75 LEU HG H -3.393 1.733 -9.482 . . . 1.0 . . . . . . . . . . . . A . 75 LEU HG . . . . . . . . . c18126_2lr2 1 . 2 . 2119 . 1 1 75 LEU N N 0.052 2.426 -7.276 . . . 1.0 . . . . . . . . . . . . A . 75 LEU N . . . . . . . . . c18126_2lr2 1 . 2 . 2120 . 1 1 75 LEU O O -0.927 0.094 -9.595 . . . 1.0 . . . . . . . . . . . . A . 75 LEU O . . . . . . . . . c18126_2lr2 1 . 2 . 2121 . 1 1 76 ALA C C 0.712 1.140 -11.726 . . . 1.0 . . . . . . . . . . . . A . 76 ALA C . . . . . . . . . c18126_2lr2 1 . 2 . 2122 . 1 1 76 ALA CA C -0.481 2.060 -11.484 . . . 1.0 . . . . . . . . . . . . A . 76 ALA CA . . . . . . . . . c18126_2lr2 1 . 2 . 2123 . 1 1 76 ALA CB C -0.263 3.437 -12.203 . . . 1.0 . . . . . . . . . . . . A . 76 ALA CB . . . . . . . . . c18126_2lr2 1 . 2 . 2124 . 1 1 76 ALA H H -0.648 3.195 -9.702 . . . 1.0 . . . . . . . . . . . . A . 76 ALA H . . . . . . . . . c18126_2lr2 1 . 2 . 2125 . 1 1 76 ALA HA H -1.368 1.598 -11.889 . . . 1.0 . . . . . . . . . . . . A . 76 ALA HA . . . . . . . . . c18126_2lr2 1 . 2 . 2126 . 1 1 76 ALA HB1 H -1.117 4.085 -12.026 . . . 1.0 . . . . . . . . . . . . A . 76 ALA HB1 . . . . . . . . . c18126_2lr2 1 . 2 . 2127 . 1 1 76 ALA HB2 H -0.149 3.293 -13.277 . . . 1.0 . . . . . . . . . . . . A . 76 ALA HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2128 . 1 1 76 ALA HB3 H 0.626 3.926 -11.818 . . . 1.0 . . . . . . . . . . . . A . 76 ALA HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2129 . 1 1 76 ALA N N -0.674 2.282 -10.055 . . . 1.0 . . . . . . . . . . . . A . 76 ALA N . . . . . . . . . c18126_2lr2 1 . 2 . 2130 . 1 1 76 ALA O O 0.741 0.388 -12.701 . . . 1.0 . . . . . . . . . . . . A . 76 ALA O . . . . . . . . . c18126_2lr2 1 . 2 . 2131 . 1 1 77 GLU C C 2.571 -1.072 -10.581 . . . 1.0 . . . . . . . . . . . . A . 77 GLU C . . . . . . . . . c18126_2lr2 1 . 2 . 2132 . 1 1 77 GLU CA C 2.884 0.372 -10.960 . . . 1.0 . . . . . . . . . . . . A . 77 GLU CA . . . . . . . . . c18126_2lr2 1 . 2 . 2133 . 1 1 77 GLU CB C 4.076 0.965 -10.083 . . . 1.0 . . . . . . . . . . . . A . 77 GLU CB . . . . . . . . . c18126_2lr2 1 . 2 . 2134 . 1 1 77 GLU CD C 6.614 0.789 -9.460 . . . 1.0 . . . . . . . . . . . . A . 77 GLU CD . . . . . . . . . c18126_2lr2 1 . 2 . 2135 . 1 1 77 GLU CG C 5.454 0.176 -10.292 . . . 1.0 . . . . . . . . . . . . A . 77 GLU CG . . . . . . . . . c18126_2lr2 1 . 2 . 2136 . 1 1 77 GLU H H 1.616 1.821 -10.075 . . . 1.0 . . . . . . . . . . . . A . 77 GLU H . . . . . . . . . c18126_2lr2 1 . 2 . 2137 . 1 1 77 GLU HA H 3.224 0.400 -11.984 . . . 1.0 . . . . . . . . . . . . A . 77 GLU HA . . . . . . . . . c18126_2lr2 1 . 2 . 2138 . 1 1 77 GLU HB2 H 4.224 2.016 -10.338 . . . 1.0 . . . . . . . . . . . . A . 77 GLU HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2139 . 1 1 77 GLU HB3 H 3.798 0.912 -9.039 . . . 1.0 . . . . . . . . . . . . A . 77 GLU HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2140 . 1 1 77 GLU HG2 H 5.344 -0.863 -9.995 . . . 1.0 . . . . . . . . . . . . A . 77 GLU HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 2141 . 1 1 77 GLU HG3 H 5.732 0.201 -11.343 . . . 1.0 . . . . . . . . . . . . A . 77 GLU HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 2142 . 1 1 77 GLU N N 1.694 1.204 -10.833 . . . 1.0 . . . . . . . . . . . . A . 77 GLU N . . . . . . . . . c18126_2lr2 1 . 2 . 2143 . 1 1 77 GLU O O 2.746 -1.987 -11.386 . . . 1.0 . . . . . . . . . . . . A . 77 GLU O . . . . . . . . . c18126_2lr2 1 . 2 . 2144 . 1 1 77 GLU OE1 O 6.417 1.044 -8.277 . . . 1.0 . . . . . . . . . . . . A . 77 GLU OE1 . . . . . . . . . c18126_2lr2 1 . 2 . 2145 . 1 1 77 GLU OE2 O 7.680 0.988 -10.020 . . . 1.0 . . . . . . . . . . . . A . 77 GLU OE2 . . . . . . . . . c18126_2lr2 1 . 2 . 2146 . 1 1 78 ALA C C 0.815 -3.294 -9.844 . . . 1.0 . . . . . . . . . . . . A . 78 ALA C . . . . . . . . . c18126_2lr2 1 . 2 . 2147 . 1 1 78 ALA CA C 1.773 -2.607 -8.877 . . . 1.0 . . . . . . . . . . . . A . 78 ALA CA . . . . . . . . . c18126_2lr2 1 . 2 . 2148 . 1 1 78 ALA CB C 1.130 -2.510 -7.464 . . . 1.0 . . . . . . . . . . . . A . 78 ALA CB . . . . . . . . . c18126_2lr2 1 . 2 . 2149 . 1 1 78 ALA H H 1.988 -0.502 -8.753 . . . 1.0 . . . . . . . . . . . . A . 78 ALA H . . . . . . . . . c18126_2lr2 1 . 2 . 2150 . 1 1 78 ALA HA H 2.679 -3.191 -8.806 . . . 1.0 . . . . . . . . . . . . A . 78 ALA HA . . . . . . . . . c18126_2lr2 1 . 2 . 2151 . 1 1 78 ALA HB1 H 0.196 -1.976 -7.537 . . . 1.0 . . . . . . . . . . . . A . 78 ALA HB1 . . . . . . . . . c18126_2lr2 1 . 2 . 2152 . 1 1 78 ALA HB2 H 1.788 -1.971 -6.790 . . . 1.0 . . . . . . . . . . . . A . 78 ALA HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2153 . 1 1 78 ALA HB3 H 0.943 -3.503 -7.053 . . . 1.0 . . . . . . . . . . . . A . 78 ALA HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2154 . 1 1 78 ALA N N 2.108 -1.269 -9.351 . . . 1.0 . . . . . . . . . . . . A . 78 ALA N . . . . . . . . . c18126_2lr2 1 . 2 . 2155 . 1 1 78 ALA O O 0.922 -4.495 -10.091 . . . 1.0 . . . . . . . . . . . . A . 78 ALA O . . . . . . . . . c18126_2lr2 1 . 2 . 2156 . 1 1 79 LYS C C -0.410 -3.465 -12.636 . . . 1.0 . . . . . . . . . . . . A . 79 LYS C . . . . . . . . . c18126_2lr2 1 . 2 . 2157 . 1 1 79 LYS CA C -1.092 -3.069 -11.330 . . . 1.0 . . . . . . . . . . . . A . 79 LYS CA . . . . . . . . . c18126_2lr2 1 . 2 . 2158 . 1 1 79 LYS CB C -2.232 -1.990 -11.596 . . . 1.0 . . . . . . . . . . . . A . 79 LYS CB . . . . . . . . . c18126_2lr2 1 . 2 . 2159 . 1 1 79 LYS CD C -4.581 -1.441 -12.720 . . . 1.0 . . . . . . . . . . . . A . 79 LYS CD . . . . . . . . . c18126_2lr2 1 . 2 . 2160 . 1 1 79 LYS CE C -5.768 -1.976 -13.617 . . . 1.0 . . . . . . . . . . . . A . 79 LYS CE . . . . . . . . . c18126_2lr2 1 . 2 . 2161 . 1 1 79 LYS CG C -3.434 -2.533 -12.516 . . . 1.0 . . . . . . . . . . . . A . 79 LYS CG . . . . . . . . . c18126_2lr2 1 . 2 . 2162 . 1 1 79 LYS H H -0.157 -1.573 -10.158 . . . 1.0 . . . . . . . . . . . . A . 79 LYS H . . . . . . . . . c18126_2lr2 1 . 2 . 2163 . 1 1 79 LYS HA H -1.549 -3.945 -10.894 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HA . . . . . . . . . c18126_2lr2 1 . 2 . 2164 . 1 1 79 LYS HB2 H -2.644 -1.686 -10.629 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2165 . 1 1 79 LYS HB3 H -1.788 -1.111 -12.057 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2166 . 1 1 79 LYS HD2 H -4.989 -1.154 -11.743 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HD2 . . . . . . . . . c18126_2lr2 1 . 2 . 2167 . 1 1 79 LYS HD3 H -4.160 -0.550 -13.182 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HD3 . . . . . . . . . c18126_2lr2 1 . 2 . 2168 . 1 1 79 LYS HE2 H -6.373 -1.144 -13.963 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HE2 . . . . . . . . . c18126_2lr2 1 . 2 . 2169 . 1 1 79 LYS HE3 H -5.387 -2.507 -14.485 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HE3 . . . . . . . . . c18126_2lr2 1 . 2 . 2170 . 1 1 79 LYS HG2 H -3.034 -2.809 -13.495 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 2171 . 1 1 79 LYS HG3 H -3.866 -3.427 -12.064 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 2172 . 1 1 79 LYS HZ1 H -7.405 -2.350 -12.384 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HZ1 . . . . . . . . . c18126_2lr2 1 . 2 . 2173 . 1 1 79 LYS HZ2 H -6.071 -3.350 -12.079 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HZ2 . . . . . . . . . c18126_2lr2 1 . 2 . 2174 . 1 1 79 LYS HZ3 H -7.038 -3.623 -13.449 . . . 1.0 . . . . . . . . . . . . A . 79 LYS HZ3 . . . . . . . . . c18126_2lr2 1 . 2 . 2175 . 1 1 79 LYS N N -0.121 -2.523 -10.391 . . . 1.0 . . . . . . . . . . . . A . 79 LYS N . . . . . . . . . c18126_2lr2 1 . 2 . 2176 . 1 1 79 LYS NZ N -6.635 -2.895 -12.822 . . . 1.0 . . . . . . . . . . . . A . 79 LYS NZ . . . . . . . . . c18126_2lr2 1 . 2 . 2177 . 1 1 79 LYS O O -0.790 -4.448 -13.272 . . . 1.0 . . . . . . . . . . . . A . 79 LYS O . . . . . . . . . c18126_2lr2 1 . 2 . 2178 . 1 1 80 LYS C C 2.083 -4.291 -14.148 . . . 1.0 . . . . . . . . . . . . A . 80 LYS C . . . . . . . . . c18126_2lr2 1 . 2 . 2179 . 1 1 80 LYS CA C 1.325 -2.973 -14.261 . . . 1.0 . . . . . . . . . . . . A . 80 LYS CA . . . . . . . . . c18126_2lr2 1 . 2 . 2180 . 1 1 80 LYS CB C 2.338 -1.796 -14.624 . . . 1.0 . . . . . . . . . . . . A . 80 LYS CB . . . . . . . . . c18126_2lr2 1 . 2 . 2181 . 1 1 80 LYS CD C 4.033 -0.809 -16.437 . . . 1.0 . . . . . . . . . . . . A . 80 LYS CD . . . . . . . . . c18126_2lr2 1 . 2 . 2182 . 1 1 80 LYS CE C 4.725 -1.029 -17.842 . . . 1.0 . . . . . . . . . . . . A . 80 LYS CE . . . . . . . . . c18126_2lr2 1 . 2 . 2183 . 1 1 80 LYS CG C 3.066 -2.018 -16.044 . . . 1.0 . . . . . . . . . . . . A . 80 LYS CG . . . . . . . . . c18126_2lr2 1 . 2 . 2184 . 1 1 80 LYS H H 0.856 -1.922 -12.481 . . . 1.0 . . . . . . . . . . . . A . 80 LYS H . . . . . . . . . c18126_2lr2 1 . 2 . 2185 . 1 1 80 LYS HA H 0.621 -3.043 -15.077 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HA . . . . . . . . . c18126_2lr2 1 . 2 . 2186 . 1 1 80 LYS HB2 H 1.789 -0.861 -14.648 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2187 . 1 1 80 LYS HB3 H 3.096 -1.721 -13.846 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2188 . 1 1 80 LYS HD2 H 3.463 0.122 -16.474 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HD2 . . . . . . . . . c18126_2lr2 1 . 2 . 2189 . 1 1 80 LYS HD3 H 4.806 -0.702 -15.675 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HD3 . . . . . . . . . c18126_2lr2 1 . 2 . 2190 . 1 1 80 LYS HE2 H 5.339 -1.931 -17.824 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HE2 . . . . . . . . . c18126_2lr2 1 . 2 . 2191 . 1 1 80 LYS HE3 H 3.980 -1.130 -18.623 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HE3 . . . . . . . . . c18126_2lr2 1 . 2 . 2192 . 1 1 80 LYS HG2 H 3.648 -2.933 -16.018 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 2193 . 1 1 80 LYS HG3 H 2.300 -2.126 -16.823 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 2194 . 1 1 80 LYS HZ1 H 5.514 0.368 -19.169 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HZ1 . . . . . . . . . c18126_2lr2 1 . 2 . 2195 . 1 1 80 LYS HZ2 H 6.596 -0.111 -17.954 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HZ2 . . . . . . . . . c18126_2lr2 1 . 2 . 2196 . 1 1 80 LYS HZ3 H 5.323 0.951 -17.585 . . . 1.0 . . . . . . . . . . . . A . 80 LYS HZ3 . . . . . . . . . c18126_2lr2 1 . 2 . 2197 . 1 1 80 LYS N N 0.597 -2.693 -13.029 . . . 1.0 . . . . . . . . . . . . A . 80 LYS N . . . . . . . . . c18126_2lr2 1 . 2 . 2198 . 1 1 80 LYS NZ N 5.608 0.133 -18.160 . . . 1.0 . . . . . . . . . . . . A . 80 LYS NZ . . . . . . . . . c18126_2lr2 1 . 2 . 2199 . 1 1 80 LYS O O 2.186 -5.045 -15.115 . . . 1.0 . . . . . . . . . . . . A . 80 LYS O . . . . . . . . . c18126_2lr2 1 . 2 . 2200 . 1 1 81 LEU C C 2.410 -6.986 -12.634 . . . 1.0 . . . . . . . . . . . . A . 81 LEU C . . . . . . . . . c18126_2lr2 1 . 2 . 2201 . 1 1 81 LEU CA C 3.358 -5.795 -12.729 . . . 1.0 . . . . . . . . . . . . A . 81 LEU CA . . . . . . . . . c18126_2lr2 1 . 2 . 2202 . 1 1 81 LEU CB C 4.257 -5.695 -11.418 . . . 1.0 . . . . . . . . . . . . A . 81 LEU CB . . . . . . . . . c18126_2lr2 1 . 2 . 2203 . 1 1 81 LEU CD1 C 6.320 -7.067 -12.425 . . . 1.0 . . . . . . . . . . . . A . 81 LEU CD1 . . . . . . . . . c18126_2lr2 1 . 2 . 2204 . 1 1 81 LEU CD2 C 5.973 -6.983 -9.863 . . . 1.0 . . . . . . . . . . . . A . 81 LEU CD2 . . . . . . . . . c18126_2lr2 1 . 2 . 2205 . 1 1 81 LEU CG C 5.250 -6.976 -11.254 . . . 1.0 . . . . . . . . . . . . A . 81 LEU CG . . . . . . . . . c18126_2lr2 1 . 2 . 2206 . 1 1 81 LEU H H 2.497 -3.925 -12.223 . . . 1.0 . . . . . . . . . . . . A . 81 LEU H . . . . . . . . . c18126_2lr2 1 . 2 . 2207 . 1 1 81 LEU HA H 4.037 -5.952 -13.554 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HA . . . . . . . . . c18126_2lr2 1 . 2 . 2208 . 1 1 81 LEU HB2 H 4.846 -4.778 -11.469 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2209 . 1 1 81 LEU HB3 H 3.611 -5.620 -10.544 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2210 . 1 1 81 LEU HD11 H 5.838 -7.343 -13.347 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HD11 . . . . . . . . . c18126_2lr2 1 . 2 . 2211 . 1 1 81 LEU HD12 H 7.058 -7.823 -12.194 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HD12 . . . . . . . . . c18126_2lr2 1 . 2 . 2212 . 1 1 81 LEU HD13 H 6.825 -6.112 -12.559 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HD13 . . . . . . . . . c18126_2lr2 1 . 2 . 2213 . 1 1 81 LEU HD21 H 6.409 -6.018 -9.652 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 2214 . 1 1 81 LEU HD22 H 6.754 -7.733 -9.859 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 2215 . 1 1 81 LEU HD23 H 5.262 -7.234 -9.095 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HD23 . . . . . . . . . c18126_2lr2 1 . 2 . 2216 . 1 1 81 LEU HG H 4.656 -7.883 -11.305 . . . 1.0 . . . . . . . . . . . . A . 81 LEU HG . . . . . . . . . c18126_2lr2 1 . 2 . 2217 . 1 1 81 LEU N N 2.612 -4.564 -12.958 . . . 1.0 . . . . . . . . . . . . A . 81 LEU N . . . . . . . . . c18126_2lr2 1 . 2 . 2218 . 1 1 81 LEU O O 2.450 -7.892 -13.466 . . . 1.0 . . . . . . . . . . . . A . 81 LEU O . . . . . . . . . c18126_2lr2 1 . 2 . 2219 . 1 1 82 ASN C C -0.005 -8.486 -12.753 . . . 1.0 . . . . . . . . . . . . A . 82 ASN C . . . . . . . . . c18126_2lr2 1 . 2 . 2220 . 1 1 82 ASN CA C 0.604 -8.063 -11.420 . . . 1.0 . . . . . . . . . . . . A . 82 ASN CA . . . . . . . . . c18126_2lr2 1 . 2 . 2221 . 1 1 82 ASN CB C -0.522 -7.620 -10.474 . . . 1.0 . . . . . . . . . . . . A . 82 ASN CB . . . . . . . . . c18126_2lr2 1 . 2 . 2222 . 1 1 82 ASN CG C -1.594 -8.728 -10.315 . . . 1.0 . . . . . . . . . . . . A . 82 ASN CG . . . . . . . . . c18126_2lr2 1 . 2 . 2223 . 1 1 82 ASN H H 1.572 -6.229 -10.982 . . . 1.0 . . . . . . . . . . . . A . 82 ASN H . . . . . . . . . c18126_2lr2 1 . 2 . 2224 . 1 1 82 ASN HA H 1.117 -8.907 -10.985 . . . 1.0 . . . . . . . . . . . . A . 82 ASN HA . . . . . . . . . c18126_2lr2 1 . 2 . 2225 . 1 1 82 ASN HB2 H -0.086 -7.419 -9.515 . . . 1.0 . . . . . . . . . . . . A . 82 ASN HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2226 . 1 1 82 ASN HB3 H -0.986 -6.707 -10.848 . . . 1.0 . . . . . . . . . . . . A . 82 ASN HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2227 . 1 1 82 ASN HD21 H -3.070 -7.608 -11.030 . . . 1.0 . . . . . . . . . . . . A . 82 ASN HD21 . . . . . . . . . c18126_2lr2 1 . 2 . 2228 . 1 1 82 ASN HD22 H -3.519 -9.179 -10.570 . . . 1.0 . . . . . . . . . . . . A . 82 ASN HD22 . . . . . . . . . c18126_2lr2 1 . 2 . 2229 . 1 1 82 ASN N N 1.559 -6.978 -11.614 . . . 1.0 . . . . . . . . . . . . A . 82 ASN N . . . . . . . . . c18126_2lr2 1 . 2 . 2230 . 1 1 82 ASN ND2 N -2.832 -8.486 -10.669 . . . 1.0 . . . . . . . . . . . . A . 82 ASN ND2 . . . . . . . . . c18126_2lr2 1 . 2 . 2231 . 1 1 82 ASN O O -0.432 -9.629 -12.917 . . . 1.0 . . . . . . . . . . . . A . 82 ASN O . . . . . . . . . c18126_2lr2 1 . 2 . 2232 . 1 1 82 ASN OD1 O -1.286 -9.842 -9.878 . . . 1.0 . . . . . . . . . . . . A . 82 ASN OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 2233 . 1 1 83 ASP C C 0.487 -8.351 -15.962 . . . 1.0 . . . . . . . . . . . . A . 83 ASP C . . . . . . . . . c18126_2lr2 1 . 2 . 2234 . 1 1 83 ASP CA C -0.599 -7.846 -15.019 . . . 1.0 . . . . . . . . . . . . A . 83 ASP CA . . . . . . . . . c18126_2lr2 1 . 2 . 2235 . 1 1 83 ASP CB C -1.275 -6.547 -15.605 . . . 1.0 . . . . . . . . . . . . A . 83 ASP CB . . . . . . . . . c18126_2lr2 1 . 2 . 2236 . 1 1 83 ASP CG C -2.578 -6.170 -14.839 . . . 1.0 . . . . . . . . . . . . A . 83 ASP CG . . . . . . . . . c18126_2lr2 1 . 2 . 2237 . 1 1 83 ASP H H 0.315 -6.663 -13.516 . . . 1.0 . . . . . . . . . . . . A . 83 ASP H . . . . . . . . . c18126_2lr2 1 . 2 . 2238 . 1 1 83 ASP HA H -1.358 -8.605 -14.918 . . . 1.0 . . . . . . . . . . . . A . 83 ASP HA . . . . . . . . . c18126_2lr2 1 . 2 . 2239 . 1 1 83 ASP HB2 H -0.579 -5.714 -15.544 . . . 1.0 . . . . . . . . . . . . A . 83 ASP HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2240 . 1 1 83 ASP HB3 H -1.528 -6.701 -16.654 . . . 1.0 . . . . . . . . . . . . A . 83 ASP HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2241 . 1 1 83 ASP N N -0.040 -7.557 -13.703 . . . 1.0 . . . . . . . . . . . . A . 83 ASP N . . . . . . . . . c18126_2lr2 1 . 2 . 2242 . 1 1 83 ASP O O 0.240 -9.221 -16.799 . . . 1.0 . . . . . . . . . . . . A . 83 ASP O . . . . . . . . . c18126_2lr2 1 . 2 . 2243 . 1 1 83 ASP OD1 O -3.026 -6.946 -14.000 . . . 1.0 . . . . . . . . . . . . A . 83 ASP OD1 . . . . . . . . . c18126_2lr2 1 . 2 . 2244 . 1 1 83 ASP OD2 O -3.101 -5.099 -15.100 . . . 1.0 . . . . . . . . . . . . A . 83 ASP OD2 . . . . . . . . . c18126_2lr2 1 . 2 . 2245 . 1 1 84 ALA C C 3.393 -9.529 -16.186 . . . 1.0 . . . . . . . . . . . . A . 84 ALA C . . . . . . . . . c18126_2lr2 1 . 2 . 2246 . 1 1 84 ALA CA C 2.806 -8.207 -16.668 . . . 1.0 . . . . . . . . . . . . A . 84 ALA CA . . . . . . . . . c18126_2lr2 1 . 2 . 2247 . 1 1 84 ALA CB C 3.920 -7.103 -16.687 . . . 1.0 . . . . . . . . . . . . A . 84 ALA CB . . . . . . . . . c18126_2lr2 1 . 2 . 2248 . 1 1 84 ALA H H 1.827 -7.113 -15.139 . . . 1.0 . . . . . . . . . . . . A . 84 ALA H . . . . . . . . . c18126_2lr2 1 . 2 . 2249 . 1 1 84 ALA HA H 2.453 -8.329 -17.681 . . . 1.0 . . . . . . . . . . . . A . 84 ALA HA . . . . . . . . . c18126_2lr2 1 . 2 . 2250 . 1 1 84 ALA HB1 H 3.508 -6.167 -17.048 . . . 1.0 . . . . . . . . . . . . A . 84 ALA HB1 . . . . . . . . . c18126_2lr2 1 . 2 . 2251 . 1 1 84 ALA HB2 H 4.736 -7.398 -17.344 . . . 1.0 . . . . . . . . . . . . A . 84 ALA HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2252 . 1 1 84 ALA HB3 H 4.313 -6.951 -15.696 . . . 1.0 . . . . . . . . . . . . A . 84 ALA HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2253 . 1 1 84 ALA N N 1.689 -7.802 -15.822 . . . 1.0 . . . . . . . . . . . . A . 84 ALA N . . . . . . . . . c18126_2lr2 1 . 2 . 2254 . 1 1 84 ALA O O 3.957 -10.292 -16.969 . . . 1.0 . . . . . . . . . . . . A . 84 ALA O . . . . . . . . . c18126_2lr2 1 . 2 . 2255 . 1 1 85 GLN C C 2.647 -12.028 -14.083 . . . 1.0 . . . . . . . . . . . . A . 85 GLN C . . . . . . . . . c18126_2lr2 1 . 2 . 2256 . 1 1 85 GLN CA C 3.775 -11.028 -14.313 . . . 1.0 . . . . . . . . . . . . A . 85 GLN CA . . . . . . . . . c18126_2lr2 1 . 2 . 2257 . 1 1 85 GLN CB C 4.530 -10.659 -12.956 . . . 1.0 . . . . . . . . . . . . A . 85 GLN CB . . . . . . . . . c18126_2lr2 1 . 2 . 2258 . 1 1 85 GLN CD C 6.445 -12.426 -13.142 . . . 1.0 . . . . . . . . . . . . A . 85 GLN CD . . . . . . . . . c18126_2lr2 1 . 2 . 2259 . 1 1 85 GLN CG C 5.286 -11.886 -12.261 . . . 1.0 . . . . . . . . . . . . A . 85 GLN CG . . . . . . . . . c18126_2lr2 1 . 2 . 2260 . 1 1 85 GLN H H 2.796 -9.148 -14.313 . . . 1.0 . . . . . . . . . . . . A . 85 GLN H . . . . . . . . . c18126_2lr2 1 . 2 . 2261 . 1 1 85 GLN HA H 4.492 -11.459 -14.995 . . . 1.0 . . . . . . . . . . . . A . 85 GLN HA . . . . . . . . . c18126_2lr2 1 . 2 . 2262 . 1 1 85 GLN HB2 H 5.249 -9.870 -13.158 . . . 1.0 . . . . . . . . . . . . A . 85 GLN HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2263 . 1 1 85 GLN HB3 H 3.796 -10.257 -12.254 . . . 1.0 . . . . . . . . . . . . A . 85 GLN HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2264 . 1 1 85 GLN HE21 H 6.055 -14.339 -12.771 . . . 1.0 . . . . . . . . . . . . A . 85 GLN HE21 . . . . . . . . . c18126_2lr2 1 . 2 . 2265 . 1 1 85 GLN HE22 H 7.366 -14.054 -13.809 . . . 1.0 . . . . . . . . . . . . A . 85 GLN HE22 . . . . . . . . . c18126_2lr2 1 . 2 . 2266 . 1 1 85 GLN HG2 H 5.711 -11.556 -11.318 . . . 1.0 . . . . . . . . . . . . A . 85 GLN HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 2267 . 1 1 85 GLN HG3 H 4.597 -12.692 -12.045 . . . 1.0 . . . . . . . . . . . . A . 85 GLN HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 2268 . 1 1 85 GLN N N 3.254 -9.793 -14.890 . . . 1.0 . . . . . . . . . . . . A . 85 GLN N . . . . . . . . . c18126_2lr2 1 . 2 . 2269 . 1 1 85 GLN NE2 N 6.639 -13.714 -13.247 . . . 1.0 . . . . . . . . . . . . A . 85 GLN NE2 . . . . . . . . . c18126_2lr2 1 . 2 . 2270 . 1 1 85 GLN O O 2.747 -12.903 -13.222 . . . 1.0 . . . . . . . . . . . . A . 85 GLN O . . . . . . . . . c18126_2lr2 1 . 2 . 2271 . 1 1 85 GLN OE1 O 7.177 -11.650 -13.761 . . . 1.0 . . . . . . . . . . . . A . 85 GLN OE1 . . . . . . . . . c18126_2lr2 1 . 2 . 2272 . 1 1 86 ALA C C 0.460 -13.851 -15.823 . . . 1.0 . . . . . . . . . . . . A . 86 ALA C . . . . . . . . . c18126_2lr2 1 . 2 . 2273 . 1 1 86 ALA CA C 0.433 -12.790 -14.727 . . . 1.0 . . . . . . . . . . . . A . 86 ALA CA . . . . . . . . . c18126_2lr2 1 . 2 . 2274 . 1 1 86 ALA CB C -0.911 -11.998 -14.817 . . . 1.0 . . . . . . . . . . . . A . 86 ALA CB . . . . . . . . . c18126_2lr2 1 . 2 . 2275 . 1 1 86 ALA H H 1.551 -11.176 -15.524 . . . 1.0 . . . . . . . . . . . . A . 86 ALA H . . . . . . . . . c18126_2lr2 1 . 2 . 2276 . 1 1 86 ALA HA H 0.478 -13.278 -13.765 . . . 1.0 . . . . . . . . . . . . A . 86 ALA HA . . . . . . . . . c18126_2lr2 1 . 2 . 2277 . 1 1 86 ALA HB1 H -1.620 -12.505 -15.459 . . . 1.0 . . . . . . . . . . . . A . 86 ALA HB1 . . . . . . . . . c18126_2lr2 1 . 2 . 2278 . 1 1 86 ALA HB2 H -0.718 -11.029 -15.222 . . . 1.0 . . . . . . . . . . . . A . 86 ALA HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2279 . 1 1 86 ALA HB3 H -1.353 -11.888 -13.835 . . . 1.0 . . . . . . . . . . . . A . 86 ALA HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2280 . 1 1 86 ALA N N 1.575 -11.892 -14.856 . . . 1.0 . . . . . . . . . . . . A . 86 ALA N . . . . . . . . . c18126_2lr2 1 . 2 . 2281 . 1 1 86 ALA O O 1.160 -13.709 -16.825 . . . 1.0 . . . . . . . . . . . . A . 86 ALA O . . . . . . . . . c18126_2lr2 1 . 2 . 2282 . 1 1 87 PRO C C -0.817 -15.593 -18.109 . . . 1.0 . . . . . . . . . . . . A . 87 PRO C . . . . . . . . . c18126_2lr2 1 . 2 . 2283 . 1 1 87 PRO CA C -0.279 -16.097 -16.753 . . . 1.0 . . . . . . . . . . . . A . 87 PRO CA . . . . . . . . . c18126_2lr2 1 . 2 . 2284 . 1 1 87 PRO CB C -1.180 -17.231 -16.156 . . . 1.0 . . . . . . . . . . . . A . 87 PRO CB . . . . . . . . . c18126_2lr2 1 . 2 . 2285 . 1 1 87 PRO CD C -1.194 -15.391 -14.545 . . . 1.0 . . . . . . . . . . . . A . 87 PRO CD . . . . . . . . . c18126_2lr2 1 . 2 . 2286 . 1 1 87 PRO CG C -1.266 -16.931 -14.669 . . . 1.0 . . . . . . . . . . . . A . 87 PRO CG . . . . . . . . . c18126_2lr2 1 . 2 . 2287 . 1 1 87 PRO HA H 0.736 -16.473 -16.881 . . . 1.0 . . . . . . . . . . . . A . 87 PRO HA . . . . . . . . . c18126_2lr2 1 . 2 . 2288 . 1 1 87 PRO HB2 H -2.179 -17.205 -16.606 . . . 1.0 . . . . . . . . . . . . A . 87 PRO HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2289 . 1 1 87 PRO HB3 H -0.737 -18.208 -16.323 . . . 1.0 . . . . . . . . . . . . A . 87 PRO HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2290 . 1 1 87 PRO HD2 H -2.185 -14.945 -14.663 . . . 1.0 . . . . . . . . . . . . A . 87 PRO HD2 . . . . . . . . . c18126_2lr2 1 . 2 . 2291 . 1 1 87 PRO HD3 H -0.773 -15.116 -13.589 . . . 1.0 . . . . . . . . . . . . A . 87 PRO HD3 . . . . . . . . . c18126_2lr2 1 . 2 . 2292 . 1 1 87 PRO HG2 H -2.195 -17.319 -14.245 . . . 1.0 . . . . . . . . . . . . A . 87 PRO HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 2293 . 1 1 87 PRO HG3 H -0.419 -17.377 -14.143 . . . 1.0 . . . . . . . . . . . . A . 87 PRO HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 2294 . 1 1 87 PRO N N -0.285 -14.998 -15.685 . . . 1.0 . . . . . . . . . . . . A . 87 PRO N . . . . . . . . . c18126_2lr2 1 . 2 . 2295 . 1 1 87 PRO O O -1.713 -14.748 -18.125 . . . 1.0 . . . . . . . . . . . . A . 87 PRO O . . . . . . . . . c18126_2lr2 1 . 2 . 2296 . 1 1 88 LYS C C -0.552 -14.202 -20.816 . . . 1.0 . . . . . . . . . . . . A . 88 LYS C . . . . . . . . . c18126_2lr2 1 . 2 . 2297 . 1 1 88 LYS CA C -0.661 -15.748 -20.620 . . . 1.0 . . . . . . . . . . . . A . 88 LYS CA . . . . . . . . . c18126_2lr2 1 . 2 . 2298 . 1 1 88 LYS CB C -2.139 -16.272 -20.927 . . . 1.0 . . . . . . . . . . . . A . 88 LYS CB . . . . . . . . . c18126_2lr2 1 . 2 . 2299 . 1 1 88 LYS CD C -3.713 -18.381 -21.237 . . . 1.0 . . . . . . . . . . . . A . 88 LYS CD . . . . . . . . . c18126_2lr2 1 . 2 . 2300 . 1 1 88 LYS CE C -3.800 -19.956 -21.278 . . . 1.0 . . . . . . . . . . . . A . 88 LYS CE . . . . . . . . . c18126_2lr2 1 . 2 . 2301 . 1 1 88 LYS CG C -2.222 -17.864 -20.963 . . . 1.0 . . . . . . . . . . . . A . 88 LYS CG . . . . . . . . . c18126_2lr2 1 . 2 . 2302 . 1 1 88 LYS H H 0.457 -16.798 -19.124 . . . 1.0 . . . . . . . . . . . . A . 88 LYS H . . . . . . . . . c18126_2lr2 1 . 2 . 2303 . 1 1 88 LYS HA H 0.037 -16.224 -21.308 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HA . . . . . . . . . c18126_2lr2 1 . 2 . 2304 . 1 1 88 LYS HB2 H -2.824 -15.896 -20.169 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HB2 . . . . . . . . . c18126_2lr2 1 . 2 . 2305 . 1 1 88 LYS HB3 H -2.460 -15.878 -21.891 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HB3 . . . . . . . . . c18126_2lr2 1 . 2 . 2306 . 1 1 88 LYS HD2 H -4.377 -18.014 -20.450 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HD2 . . . . . . . . . c18126_2lr2 1 . 2 . 2307 . 1 1 88 LYS HD3 H -4.069 -17.982 -22.187 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HD3 . . . . . . . . . c18126_2lr2 1 . 2 . 2308 . 1 1 88 LYS HE2 H -3.179 -20.347 -22.078 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HE2 . . . . . . . . . c18126_2lr2 1 . 2 . 2309 . 1 1 88 LYS HE3 H -3.465 -20.378 -20.334 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HE3 . . . . . . . . . c18126_2lr2 1 . 2 . 2310 . 1 1 88 LYS HG2 H -1.560 -18.240 -21.745 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HG2 . . . . . . . . . c18126_2lr2 1 . 2 . 2311 . 1 1 88 LYS HG3 H -1.876 -18.260 -20.004 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HG3 . . . . . . . . . c18126_2lr2 1 . 2 . 2312 . 1 1 88 LYS HZ1 H -5.595 -19.865 -22.338 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HZ1 . . . . . . . . . c18126_2lr2 1 . 2 . 2313 . 1 1 88 LYS HZ2 H -5.787 -20.174 -20.681 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HZ2 . . . . . . . . . c18126_2lr2 1 . 2 . 2314 . 1 1 88 LYS HZ3 H -5.234 -21.403 -21.714 . . . 1.0 . . . . . . . . . . . . A . 88 LYS HZ3 . . . . . . . . . c18126_2lr2 1 . 2 . 2315 . 1 1 88 LYS N N -0.256 -16.124 -19.232 . . . 1.0 . . . . . . . . . . . . A . 88 LYS N . . . . . . . . . c18126_2lr2 1 . 2 . 2316 . 1 1 88 LYS NZ N -5.212 -20.381 -21.521 . . . 1.0 . . . . . . . . . . . . A . 88 LYS NZ . . . . . . . . . c18126_2lr2 1 . 2 . 2317 . 1 1 88 LYS O O 0.525 -13.735 -21.158 . . . 1.0 . . . . . . . . . . . . A . 88 LYS O . . . . . . . . . c18126_2lr2 1 . 2 . 2318 . 1 1 88 LYS OXT O -1.545 -13.518 -20.607 . . . 1.0 . . . . . . . . . . . . A . 88 LYS OXT . . . . . . . . . c18126_2lr2 1 stop_ save_ ########################### # Constraint Statistics # ########################### save_constraint_statistics _Constraint_stat_list.Sf_framecode constraint_statistics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID c18126_2lr2 _Constraint_stat_list.ID 1 loop_ _Constraint_file.ID _Constraint_file.Constraint_filename _Constraint_file.Software_ID _Constraint_file.Software_label _Constraint_file.Software_name _Constraint_file.Block_ID _Constraint_file.Constraint_type _Constraint_file.Constraint_subtype _Constraint_file.Constraint_subsubtype _Constraint_file.Constraint_number _Constraint_file.Entry_ID _Constraint_file.Constraint_stat_list_ID 1 2lr2.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c18126_2lr2 1 1 2lr2.mr . . XPLOR/CNS 2 'dihedral angle' 'Not applicable' 'Not applicable' 114 c18126_2lr2 1 1 2lr2.mr . . XPLOR/CNS 3 'dipolar coupling' 'Not applicable' 'Not applicable' 29 c18126_2lr2 1 1 2lr2.mr . . XPLOR/CNS 4 unknown 'Not applicable' 'Not applicable' 0 c18126_2lr2 1 1 2lr2.mr . . XPLOR/CNS 5 'dipolar coupling' 'Not applicable' 'Not applicable' 28 c18126_2lr2 1 1 2lr2.mr . . XPLOR/CNS 6 unknown 'Not applicable' 'Not applicable' 0 c18126_2lr2 1 1 2lr2.mr . . 'MR format' 7 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c18126_2lr2 1 stop_ save_ save_CNS/XPLOR_dihedral_2 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_2 _Torsion_angle_constraint_list.Entry_ID c18126_2lr2 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Details 'Generated by Wattos' _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 2 loop_ _Torsion_angle_constraint_software.Software_ID _Torsion_angle_constraint_software.Software_label _Torsion_angle_constraint_software.Method_ID _Torsion_angle_constraint_software.Method_label _Torsion_angle_constraint_software.Entry_ID _Torsion_angle_constraint_software.Torsion_angle_constraint_list_ID . . . . c18126_2lr2 1 stop_ loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Assembly_atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Seq_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Atom_type_1 _Torsion_angle_constraint.Resonance_ID_1 _Torsion_angle_constraint.Assembly_atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Seq_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Atom_type_2 _Torsion_angle_constraint.Resonance_ID_2 _Torsion_angle_constraint.Assembly_atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Seq_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Atom_type_3 _Torsion_angle_constraint.Resonance_ID_3 _Torsion_angle_constraint.Assembly_atom_ID_4 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Seq_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Atom_type_4 _Torsion_angle_constraint.Resonance_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Source_experiment_ID _Torsion_angle_constraint.PDB_record_ID_1 _Torsion_angle_constraint.PDB_model_num_1 _Torsion_angle_constraint.PDB_strand_ID_1 _Torsion_angle_constraint.PDB_ins_code_1 _Torsion_angle_constraint.PDB_residue_no_1 _Torsion_angle_constraint.PDB_residue_name_1 _Torsion_angle_constraint.PDB_atom_name_1 _Torsion_angle_constraint.PDB_record_ID_2 _Torsion_angle_constraint.PDB_model_num_2 _Torsion_angle_constraint.PDB_strand_ID_2 _Torsion_angle_constraint.PDB_ins_code_2 _Torsion_angle_constraint.PDB_residue_no_2 _Torsion_angle_constraint.PDB_residue_name_2 _Torsion_angle_constraint.PDB_atom_name_2 _Torsion_angle_constraint.PDB_record_ID_3 _Torsion_angle_constraint.PDB_model_num_3 _Torsion_angle_constraint.PDB_strand_ID_3 _Torsion_angle_constraint.PDB_ins_code_3 _Torsion_angle_constraint.PDB_residue_no_3 _Torsion_angle_constraint.PDB_residue_name_3 _Torsion_angle_constraint.PDB_atom_name_3 _Torsion_angle_constraint.PDB_record_ID_4 _Torsion_angle_constraint.PDB_model_num_4 _Torsion_angle_constraint.PDB_strand_ID_4 _Torsion_angle_constraint.PDB_ins_code_4 _Torsion_angle_constraint.PDB_residue_no_4 _Torsion_angle_constraint.PDB_residue_name_4 _Torsion_angle_constraint.PDB_atom_name_4 _Torsion_angle_constraint.Auth_entity_assembly_ID_1 _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_chain_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_alt_ID_1 _Torsion_angle_constraint.Auth_atom_name_1 _Torsion_angle_constraint.Auth_entity_assembly_ID_2 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_chain_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_alt_ID_2 _Torsion_angle_constraint.Auth_atom_name_2 _Torsion_angle_constraint.Auth_entity_assembly_ID_3 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_chain_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_alt_ID_3 _Torsion_angle_constraint.Auth_atom_name_3 _Torsion_angle_constraint.Auth_entity_assembly_ID_4 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_chain_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Auth_alt_ID_4 _Torsion_angle_constraint.Auth_atom_name_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . . 1 1 38 38 GLU N N . . 1 1 38 38 GLU CA C . . 1 1 8 8 HIS CB C . . 1 1 8 8 HIS CG C . -200.00 -160.00 . . . A . 38 GLU N . . A . 38 GLU CA . . . . . . . . . . . . . . . . . 50 . N . . . . . 50 . CA . . . . . 20 . CB . . . . . 20 . CG . . c18126_2lr2 1 2 . . 1 1 54 54 ASP C C . . 1 1 55 55 THR N N . . 1 1 55 55 THR CA C . . 1 1 55 55 THR C C . -140.00 -100.00 . . . A . 54 ASP C . . A . 55 THR N . . A . 55 THR CA . . A . 55 THR C . . . 66 . C . . . . . 67 . N . . . . . 67 . CA . . . . . 67 . C . . c18126_2lr2 1 3 . . 1 1 7 7 HIS C C . . 1 1 8 8 HIS N N . . 1 1 8 8 HIS CA C . . 1 1 8 8 HIS C C . -67.47 -52.97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 19 . C . . . . . 20 . N . . . . . 20 . CA . . . . . 20 . C . . c18126_2lr2 1 4 . . 1 1 8 8 HIS C C . . 1 1 9 9 HIS N N . . 1 1 9 9 HIS CA C . . 1 1 9 9 HIS C C . -80.93 -57.01 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20 . C . . . . . 21 . N . . . . . 21 . CA . . . . . 21 . C . . c18126_2lr2 1 5 . . 1 1 9 9 HIS C C . . 1 1 10 10 HIS N N . . 1 1 10 10 HIS CA C . . 1 1 10 10 HIS C C . -73.71 -59.21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 21 . C . . . . . 22 . N . . . . . 22 . CA . . . . . 22 . C . . c18126_2lr2 1 6 . . 1 1 10 10 HIS C C . . 1 1 11 11 SER N N . . 1 1 11 11 SER CA C . . 1 1 11 11 SER C C . -74.98 -56.44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 22 . C . . . . . 23 . N . . . . . 23 . CA . . . . . 23 . C . . c18126_2lr2 1 7 . . 1 1 11 11 SER C C . . 1 1 12 12 SER N N . . 1 1 12 12 SER CA C . . 1 1 12 12 SER C C . -76.44 -56.00 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 23 . C . . . . . 24 . N . . . . . 24 . CA . . . . . 24 . C . . c18126_2lr2 1 8 . . 1 1 12 12 SER C C . . 1 1 13 13 GLY N N . . 1 1 13 13 GLY CA C . . 1 1 13 13 GLY C C . -69.64 -57.20 . . . . . . . . . . A . 13 GLY N . . A . 13 GLY CA . . A . 13 GLY C . . . 24 . C . . . . . 25 . N . . . . . 25 . CA . . . . . 25 . C . . c18126_2lr2 1 9 . . 1 1 13 13 GLY C C . . 1 1 14 14 VAL N N . . 1 1 14 14 VAL CA C . . 1 1 14 14 VAL C C . -74.05 -53.57 . . . A . 13 GLY C . . A . 14 VAL N . . A . 14 VAL CA . . A . 14 VAL C . . . 25 . C . . . . . 26 . N . . . . . 26 . CA . . . . . 26 . C . . c18126_2lr2 1 10 . . 1 1 14 14 VAL C C . . 1 1 15 15 ASP N N . . 1 1 15 15 ASP CA C . . 1 1 15 15 ASP C C . -68.36 -53.00 . . . A . 14 VAL C . . A . 15 ASP N . . A . 15 ASP CA . . A . 15 ASP C . . . 26 . C . . . . . 27 . N . . . . . 27 . CA . . . . . 27 . C . . c18126_2lr2 1 11 . . 1 1 15 15 ASP C C . . 1 1 16 16 ASN N N . . 1 1 16 16 ASN CA C . . 1 1 16 16 ASN C C . -71.25 -55.51 . . . A . 15 ASP C . . A . 16 ASN N . . A . 16 ASN CA . . A . 16 ASN C . . . 27 . C . . . . . 28 . N . . . . . 28 . CA . . . . . 28 . C . . c18126_2lr2 1 12 . . 1 1 16 16 ASN C C . . 1 1 17 17 LYS N N . . 1 1 17 17 LYS CA C . . 1 1 17 17 LYS C C . -73.69 -53.91 . . . A . 16 ASN C . . A . 17 LYS N . . A . 17 LYS CA . . A . 17 LYS C . . . 28 . C . . . . . 29 . N . . . . . 29 . CA . . . . . 29 . C . . c18126_2lr2 1 13 . . 1 1 17 17 LYS C C . . 1 1 18 18 PHE N N . . 1 1 18 18 PHE CA C . . 1 1 18 18 PHE C C . -89.11 -45.99 . . . A . 17 LYS C . . A . 18 PHE N . . A . 18 PHE CA . . A . 18 PHE C . . . 29 . C . . . . . 30 . N . . . . . 30 . CA . . . . . 30 . C . . c18126_2lr2 1 14 . . 1 1 18 18 PHE C C . . 1 1 19 19 ASN N N . . 1 1 19 19 ASN CA C . . 1 1 19 19 ASN C C . -107.48 -78.00 . . . A . 18 PHE C . . A . 19 ASN N . . A . 19 ASN CA . . A . 19 ASN C . . . 30 . C . . . . . 31 . N . . . . . 31 . CA . . . . . 31 . C . . c18126_2lr2 1 15 . . 1 1 19 19 ASN C C . . 1 1 20 20 LYS N N . . 1 1 20 20 LYS CA C . . 1 1 20 20 LYS C C . -124.82 -29.58 . . . A . 19 ASN C . . A . 20 LYS N . . A . 20 LYS CA . . A . 20 LYS C . . . 31 . C . . . . . 32 . N . . . . . 32 . CA . . . . . 32 . C . . c18126_2lr2 1 16 . . 1 1 20 20 LYS C C . . 1 1 21 21 GLU N N . . 1 1 21 21 GLU CA C . . 1 1 21 21 GLU C C . -87.10 -47.38 . . . A . 20 LYS C . . A . 21 GLU N . . A . 21 GLU CA . . A . 21 GLU C . . . 32 . C . . . . . 33 . N . . . . . 33 . CA . . . . . 33 . C . . c18126_2lr2 1 17 . . 1 1 22 22 GLN C C . . 1 1 23 23 GLN N N . . 1 1 23 23 GLN CA C . . 1 1 23 23 GLN C C . -156.74 -18.98 . . . A . 22 GLN C . . A . 23 GLN N . . A . 23 GLN CA . . A . 23 GLN C . . . 34 . C . . . . . 35 . N . . . . . 35 . CA . . . . . 35 . C . . c18126_2lr2 1 18 . . 1 1 23 23 GLN C C . . 1 1 24 24 ASN N N . . 1 1 24 24 ASN CA C . . 1 1 24 24 ASN C C . -165.57 -32.95 . . . A . 23 GLN C . . A . 24 ASN N . . A . 24 ASN CA . . A . 24 ASN C . . . 35 . C . . . . . 36 . N . . . . . 36 . CA . . . . . 36 . C . . c18126_2lr2 1 19 . . 1 1 24 24 ASN C C . . 1 1 25 25 ALA N N . . 1 1 25 25 ALA CA C . . 1 1 25 25 ALA C C . -65.86 -52.42 . . . A . 24 ASN C . . A . 25 ALA N . . A . 25 ALA CA . . A . 25 ALA C . . . 36 . C . . . . . 37 . N . . . . . 37 . CA . . . . . 37 . C . . c18126_2lr2 1 20 . . 1 1 25 25 ALA C C . . 1 1 26 26 PHE N N . . 1 1 26 26 PHE CA C . . 1 1 26 26 PHE C C . -69.53 -52.79 . . . A . 25 ALA C . . A . 26 PHE N . . A . 26 PHE CA . . A . 26 PHE C . . . 37 . C . . . . . 38 . N . . . . . 38 . CA . . . . . 38 . C . . c18126_2lr2 1 21 . . 1 1 26 26 PHE C C . . 1 1 27 27 TYR N N . . 1 1 27 27 TYR CA C . . 1 1 27 27 TYR C C . -77.54 -55.48 . . . A . 26 PHE C . . A . 27 TYR N . . A . 27 TYR CA . . A . 27 TYR C . . . 38 . C . . . . . 39 . N . . . . . 39 . CA . . . . . 39 . C . . c18126_2lr2 1 22 . . 1 1 27 27 TYR C C . . 1 1 28 28 GLU N N . . 1 1 28 28 GLU CA C . . 1 1 28 28 GLU C C . -73.67 -53.03 . . . A . 27 TYR C . . A . 28 GLU N . . A . 28 GLU CA . . A . 28 GLU C . . . 39 . C . . . . . 40 . N . . . . . 40 . CA . . . . . 40 . C . . c18126_2lr2 1 23 . . 1 1 28 28 GLU C C . . 1 1 29 29 ILE N N . . 1 1 29 29 ILE CA C . . 1 1 29 29 ILE C C . -69.07 -53.41 . . . A . 28 GLU C . . A . 29 ILE N . . A . 29 ILE CA . . A . 29 ILE C . . . 40 . C . . . . . 41 . N . . . . . 41 . CA . . . . . 41 . C . . c18126_2lr2 1 24 . . 1 1 29 29 ILE C C . . 1 1 30 30 LEU N N . . 1 1 30 30 LEU CA C . . 1 1 30 30 LEU C C . -70.66 -56.30 . . . A . 29 ILE C . . A . 30 LEU N . . A . 30 LEU CA . . A . 30 LEU C . . . 41 . C . . . . . 42 . N . . . . . 42 . CA . . . . . 42 . C . . c18126_2lr2 1 25 . . 1 1 30 30 LEU C C . . 1 1 31 31 HIS N N . . 1 1 31 31 HIS CA C . . 1 1 31 31 HIS C C . -68.95 -54.51 . . . A . 30 LEU C . . A . 31 HIS N . . A . 31 HIS CA . . A . 31 HIS C . . . 42 . C . . . . . 43 . N . . . . . 43 . CA . . . . . 43 . C . . c18126_2lr2 1 26 . . 1 1 31 31 HIS C C . . 1 1 32 32 LEU N N . . 1 1 32 32 LEU CA C . . 1 1 32 32 LEU C C . -69.05 -54.75 . . . A . 31 HIS C . . A . 32 LEU N . . A . 32 LEU CA . . A . 32 LEU C . . . 43 . C . . . . . 44 . N . . . . . 44 . CA . . . . . 44 . C . . c18126_2lr2 1 27 . . 1 1 32 32 LEU C C . . 1 1 33 33 PRO N N . . 1 1 33 33 PRO CA C . . 1 1 33 33 PRO C C . -79.09 -50.97 . . . A . 32 LEU C . . A . 33 PRO N . . A . 33 PRO CA . . A . 33 PRO C . . . 44 . C . . . . . 45 . N . . . . . 45 . CA . . . . . 45 . C . . c18126_2lr2 1 28 . . 1 1 33 33 PRO C C . . 1 1 34 34 ASN N N . . 1 1 34 34 ASN CA C . . 1 1 34 34 ASN C C . -74.50 -55.00 . . . A . 33 PRO C . . A . 34 ASN N . . A . 34 ASN CA . . A . 34 ASN C . . . 45 . C . . . . . 46 . N . . . . . 46 . CA . . . . . 46 . C . . c18126_2lr2 1 29 . . 1 1 34 34 ASN C C . . 1 1 35 35 LEU N N . . 1 1 35 35 LEU CA C . . 1 1 35 35 LEU C C . -72.04 -53.98 . . . A . 34 ASN C . . A . 35 LEU N . . A . 35 LEU CA . . A . 35 LEU C . . . 46 . C . . . . . 47 . N . . . . . 47 . CA . . . . . 47 . C . . c18126_2lr2 1 30 . . 1 1 35 35 LEU C C . . 1 1 36 36 ASN N N . . 1 1 36 36 ASN CA C . . 1 1 36 36 ASN C C . -78.81 -50.71 . . . A . 35 LEU C . . A . 36 ASN N . . A . 36 ASN CA . . A . 36 ASN C . . . 47 . C . . . . . 48 . N . . . . . 48 . CA . . . . . 48 . C . . c18126_2lr2 1 31 . . 1 1 36 36 ASN C C . . 1 1 37 37 GLU N N . . 1 1 37 37 GLU CA C . . 1 1 37 37 GLU C C . -102.23 -48.19 . . . A . 36 ASN C . . A . 37 GLU N . . A . 37 GLU CA . . A . 37 GLU C . . . 48 . C . . . . . 49 . N . . . . . 49 . CA . . . . . 49 . C . . c18126_2lr2 1 32 . . 1 1 41 41 ASN C C . . 1 1 42 42 ALA N N . . 1 1 42 42 ALA CA C . . 1 1 42 42 ALA C C . -103.47 -52.75 . . . A . 41 ASN C . . A . 42 ALA N . . A . 42 ALA CA . . A . 42 ALA C . . . 53 . C . . . . . 54 . N . . . . . 54 . CA . . . . . 54 . C . . c18126_2lr2 1 33 . . 1 1 42 42 ALA C C . . 1 1 43 43 PHE N N . . 1 1 43 43 PHE CA C . . 1 1 43 43 PHE C C . -98.43 -35.67 . . . A . 42 ALA C . . A . 43 PHE N . . A . 43 PHE CA . . A . 43 PHE C . . . 54 . C . . . . . 55 . N . . . . . 55 . CA . . . . . 55 . C . . c18126_2lr2 1 34 . . 1 1 43 43 PHE C C . . 1 1 44 44 ILE N N . . 1 1 44 44 ILE CA C . . 1 1 44 44 ILE C C . -109.47 -82.93 . . . A . 43 PHE C . . A . 44 ILE N . . A . 44 ILE CA . . A . 44 ILE C . . . 55 . C . . . . . 56 . N . . . . . 56 . CA . . . . . 56 . C . . c18126_2lr2 1 35 . . 1 1 44 44 ILE C C . . 1 1 45 45 GLN N N . . 1 1 45 45 GLN CA C . . 1 1 45 45 GLN C C . 32.77 76.13 . . . A . 44 ILE C . . A . 45 GLN N . . A . 45 GLN CA . . A . 45 GLN C . . . 56 . C . . . . . 57 . N . . . . . 57 . CA . . . . . 57 . C . . c18126_2lr2 1 36 . . 1 1 45 45 GLN C C . . 1 1 46 46 SER N N . . 1 1 46 46 SER CA C . . 1 1 46 46 SER C C . -121.95 -75.47 . . . A . 45 GLN C . . A . 46 SER N . . A . 46 SER CA . . A . 46 SER C . . . 57 . C . . . . . 58 . N . . . . . 58 . CA . . . . . 58 . C . . c18126_2lr2 1 37 . . 1 1 48 48 LYS C C . . 1 1 49 49 ASP N N . . 1 1 49 49 ASP CA C . . 1 1 49 49 ASP C C . -136.24 -65.82 . . . A . 48 LYS C . . A . 49 ASP N . . A . 49 ASP CA . . A . 49 ASP C . . . 60 . C . . . . . 61 . N . . . . . 61 . CA . . . . . 61 . C . . c18126_2lr2 1 38 . . 1 1 51 51 SER C C . . 1 1 52 52 TYR N N . . 1 1 52 52 TYR CA C . . 1 1 52 52 TYR C C . -80.85 -53.43 . . . A . 51 SER C . . A . 52 TYR N . . A . 52 TYR CA . . A . 52 TYR C . . . 63 . C . . . . . 64 . N . . . . . 64 . CA . . . . . 64 . C . . c18126_2lr2 1 39 . . 1 1 52 52 TYR C C . . 1 1 53 53 ILE N N . . 1 1 53 53 ILE CA C . . 1 1 53 53 ILE C C . -111.23 -43.19 . . . A . 52 TYR C . . A . 53 ILE N . . A . 53 ILE CA . . A . 53 ILE C . . . 64 . C . . . . . 65 . N . . . . . 65 . CA . . . . . 65 . C . . c18126_2lr2 1 40 . . 1 1 53 53 ILE C C . . 1 1 54 54 ASP N N . . 1 1 54 54 ASP CA C . . 1 1 54 54 ASP C C . -123.23 -47.49 . . . A . 53 ILE C . . A . 54 ASP N . . A . 54 ASP CA . . A . 54 ASP C . . . 65 . C . . . . . 66 . N . . . . . 66 . CA . . . . . 66 . C . . c18126_2lr2 1 41 . . 1 1 57 57 ASN C C . . 1 1 58 58 ASP N N . . 1 1 58 58 ASP CA C . . 1 1 58 58 ASP C C . -117.37 -24.85 . . . A . 57 ASN C . . A . 58 ASP N . . A . 58 ASP CA . . A . 58 ASP C . . . 69 . C . . . . . 70 . N . . . . . 70 . CA . . . . . 70 . C . . c18126_2lr2 1 42 . . 1 1 58 58 ASP C C . . 1 1 59 59 GLY N N . . 1 1 59 59 GLY CA C . . 1 1 59 59 GLY C C . -69.34 -55.94 . . . A . 58 ASP C . . A . 59 GLY N . . A . 59 GLY CA . . A . 59 GLY C . . . 70 . C . . . . . 71 . N . . . . . 71 . CA . . . . . 71 . C . . c18126_2lr2 1 43 . . 1 1 59 59 GLY C C . . 1 1 60 60 ALA N N . . 1 1 60 60 ALA CA C . . 1 1 60 60 ALA C C . -72.54 -53.64 . . . A . 59 GLY C . . A . 60 ALA N . . A . 60 ALA CA . . A . 60 ALA C . . . 71 . C . . . . . 72 . N . . . . . 72 . CA . . . . . 72 . C . . c18126_2lr2 1 44 . . 1 1 60 60 ALA C C . . 1 1 61 61 TYR N N . . 1 1 61 61 TYR CA C . . 1 1 61 61 TYR C C . -82.67 -58.35 . . . A . 60 ALA C . . A . 61 TYR N . . A . 61 TYR CA . . A . 61 TYR C . . . 72 . C . . . . . 73 . N . . . . . 73 . CA . . . . . 73 . C . . c18126_2lr2 1 45 . . 1 1 61 61 TYR C C . . 1 1 62 62 GLU N N . . 1 1 62 62 GLU CA C . . 1 1 62 62 GLU C C . -72.92 -57.56 . . . A . 61 TYR C . . A . 62 GLU N . . A . 62 GLU CA . . A . 62 GLU C . . . 73 . C . . . . . 74 . N . . . . . 74 . CA . . . . . 74 . C . . c18126_2lr2 1 46 . . 1 1 62 62 GLU C C . . 1 1 63 63 GLY N N . . 1 1 63 63 GLY CA C . . 1 1 63 63 GLY C C . -71.15 -50.03 . . . A . 62 GLU C . . A . 63 GLY N . . A . 63 GLY CA . . A . 63 GLY C . . . 74 . C . . . . . 75 . N . . . . . 75 . CA . . . . . 75 . C . . c18126_2lr2 1 47 . . 1 1 63 63 GLY C C . . 1 1 64 64 ASP N N . . 1 1 64 64 ASP CA C . . 1 1 64 64 ASP C C . -71.52 -50.54 . . . A . 63 GLY C . . A . 64 ASP N . . A . 64 ASP CA . . A . 64 ASP C . . . 75 . C . . . . . 76 . N . . . . . 76 . CA . . . . . 76 . C . . c18126_2lr2 1 48 . . 1 1 64 64 ASP C C . . 1 1 65 65 GLU N N . . 1 1 65 65 GLU CA C . . 1 1 65 65 GLU C C . -75.34 -51.58 . . . A . 64 ASP C . . A . 65 GLU N . . A . 65 GLU CA . . A . 65 GLU C . . . 76 . C . . . . . 77 . N . . . . . 77 . CA . . . . . 77 . C . . c18126_2lr2 1 49 . . 1 1 65 65 GLU C C . . 1 1 66 66 LEU N N . . 1 1 66 66 LEU CA C . . 1 1 66 66 LEU C C . -74.17 -53.11 . . . A . 65 GLU C . . A . 66 LEU N . . A . 66 LEU CA . . A . 66 LEU C . . . 77 . C . . . . . 78 . N . . . . . 78 . CA . . . . . 78 . C . . c18126_2lr2 1 50 . . 1 1 66 66 LEU C C . . 1 1 67 67 SER N N . . 1 1 67 67 SER CA C . . 1 1 67 67 SER C C . -71.13 -57.57 . . . A . 66 LEU C . . A . 67 SER N . . A . 67 SER CA . . A . 67 SER C . . . 78 . C . . . . . 79 . N . . . . . 79 . CA . . . . . 79 . C . . c18126_2lr2 1 51 . . 1 1 67 67 SER C C . . 1 1 68 68 GLY N N . . 1 1 68 68 GLY CA C . . 1 1 68 68 GLY C C . -75.01 -55.07 . . . A . 67 SER C . . A . 68 GLY N . . A . 68 GLY CA . . A . 68 GLY C . . . 79 . C . . . . . 80 . N . . . . . 80 . CA . . . . . 80 . C . . c18126_2lr2 1 52 . . 1 1 68 68 GLY C C . . 1 1 69 69 SER N N . . 1 1 69 69 SER CA C . . 1 1 69 69 SER C C . -72.01 -55.25 . . . A . 68 GLY C . . A . 69 SER N . . A . 69 SER CA . . A . 69 SER C . . . 80 . C . . . . . 81 . N . . . . . 81 . CA . . . . . 81 . C . . c18126_2lr2 1 53 . . 1 1 69 69 SER C C . . 1 1 70 70 GLN N N . . 1 1 70 70 GLN CA C . . 1 1 70 70 GLN C C . -73.34 -50.82 . . . A . 69 SER C . . A . 70 GLN N . . A . 70 GLN CA . . A . 70 GLN C . . . 81 . C . . . . . 82 . N . . . . . 82 . CA . . . . . 82 . C . . c18126_2lr2 1 54 . . 1 1 70 70 GLN C C . . 1 1 71 71 SER N N . . 1 1 71 71 SER CA C . . 1 1 71 71 SER C C . -76.22 -52.70 . . . A . 70 GLN C . . A . 71 SER N . . A . 71 SER CA . . A . 71 SER C . . . 82 . C . . . . . 83 . N . . . . . 83 . CA . . . . . 83 . C . . c18126_2lr2 1 55 . . 1 1 71 71 SER C C . . 1 1 72 72 ALA N N . . 1 1 72 72 ALA CA C . . 1 1 72 72 ALA C C . -89.10 -50.70 . . . A . 71 SER C . . A . 72 ALA N . . A . 72 ALA CA . . A . 72 ALA C . . . 83 . C . . . . . 84 . N . . . . . 84 . CA . . . . . 84 . C . . c18126_2lr2 1 56 . . 1 1 72 72 ALA C C . . 1 1 73 73 ASN N N . . 1 1 73 73 ASN CA C . . 1 1 73 73 ASN C C . -112.05 -79.11 . . . A . 72 ALA C . . A . 73 ASN N . . A . 73 ASN CA . . A . 73 ASN C . . . 84 . C . . . . . 85 . N . . . . . 85 . CA . . . . . 85 . C . . c18126_2lr2 1 57 . . 1 1 73 73 ASN C C . . 1 1 74 74 LEU N N . . 1 1 74 74 LEU CA C . . 1 1 74 74 LEU C C . -123.11 -25.67 . . . A . 73 ASN C . . A . 74 LEU N . . A . 74 LEU CA . . A . 74 LEU C . . . 85 . C . . . . . 86 . N . . . . . 86 . CA . . . . . 86 . C . . c18126_2lr2 1 58 . . 1 1 74 74 LEU C C . . 1 1 75 75 LEU N N . . 1 1 75 75 LEU CA C . . 1 1 75 75 LEU C C . -87.88 -48.24 . . . A . 74 LEU C . . A . 75 LEU N . . A . 75 LEU CA . . A . 75 LEU C . . . 86 . C . . . . . 87 . N . . . . . 87 . CA . . . . . 87 . C . . c18126_2lr2 1 59 . . 1 1 8 8 HIS N N . . 1 1 8 8 HIS CA C . . 1 1 8 8 HIS C C . . 1 1 9 9 HIS N N . -49.65 -14.07 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20 . N . . . . . 20 . CA . . . . . 20 . C . . . . . 21 . N . . c18126_2lr2 1 60 . . 1 1 9 9 HIS N N . . 1 1 9 9 HIS CA C . . 1 1 9 9 HIS C C . . 1 1 10 10 HIS N N . -46.99 -27.39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 21 . N . . . . . 21 . CA . . . . . 21 . C . . . . . 22 . N . . c18126_2lr2 1 61 . . 1 1 10 10 HIS N N . . 1 1 10 10 HIS CA C . . 1 1 10 10 HIS C C . . 1 1 11 11 SER N N . -50.07 -29.83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 22 . N . . . . . 22 . CA . . . . . 22 . C . . . . . 23 . N . . c18126_2lr2 1 62 . . 1 1 11 11 SER N N . . 1 1 11 11 SER CA C . . 1 1 11 11 SER C C . . 1 1 12 12 SER N N . -46.79 -33.03 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 23 . N . . . . . 23 . CA . . . . . 23 . C . . . . . 24 . N . . c18126_2lr2 1 63 . . 1 1 12 12 SER N N . . 1 1 12 12 SER CA C . . 1 1 12 12 SER C C . . 1 1 13 13 GLY N N . -47.29 -30.75 . . . . . . . . . . . . . . . . . . . . . . . . A . 13 GLY N . . . 24 . N . . . . . 24 . CA . . . . . 24 . C . . . . . 25 . N . . c18126_2lr2 1 64 . . 1 1 13 13 GLY N N . . 1 1 13 13 GLY CA C . . 1 1 13 13 GLY C C . . 1 1 14 14 VAL N N . -48.78 -21.58 . . . A . 13 GLY N . . A . 13 GLY CA . . A . 13 GLY C . . A . 14 VAL N . . . 25 . N . . . . . 25 . CA . . . . . 25 . C . . . . . 26 . N . . c18126_2lr2 1 65 . . 1 1 14 14 VAL N N . . 1 1 14 14 VAL CA C . . 1 1 14 14 VAL C C . . 1 1 15 15 ASP N N . -47.68 -40.56 . . . A . 14 VAL N . . A . 14 VAL CA . . A . 14 VAL C . . A . 15 ASP N . . . 26 . N . . . . . 26 . CA . . . . . 26 . C . . . . . 27 . N . . c18126_2lr2 1 66 . . 1 1 15 15 ASP N N . . 1 1 15 15 ASP CA C . . 1 1 15 15 ASP C C . . 1 1 16 16 ASN N N . -54.70 -29.48 . . . A . 15 ASP N . . A . 15 ASP CA . . A . 15 ASP C . . A . 16 ASN N . . . 27 . N . . . . . 27 . CA . . . . . 27 . C . . . . . 28 . N . . c18126_2lr2 1 67 . . 1 1 16 16 ASN N N . . 1 1 16 16 ASN CA C . . 1 1 16 16 ASN C C . . 1 1 17 17 LYS N N . -57.39 -28.99 . . . A . 16 ASN N . . A . 16 ASN CA . . A . 16 ASN C . . A . 17 LYS N . . . 28 . N . . . . . 28 . CA . . . . . 28 . C . . . . . 29 . N . . c18126_2lr2 1 68 . . 1 1 17 17 LYS N N . . 1 1 17 17 LYS CA C . . 1 1 17 17 LYS C C . . 1 1 18 18 PHE N N . -54.73 -30.49 . . . A . 17 LYS N . . A . 17 LYS CA . . A . 17 LYS C . . A . 18 PHE N . . . 29 . N . . . . . 29 . CA . . . . . 29 . C . . . . . 30 . N . . c18126_2lr2 1 69 . . 1 1 18 18 PHE N N . . 1 1 18 18 PHE CA C . . 1 1 18 18 PHE C C . . 1 1 19 19 ASN N N . -48.49 -0.47 . . . A . 18 PHE N . . A . 18 PHE CA . . A . 18 PHE C . . A . 19 ASN N . . . 30 . N . . . . . 30 . CA . . . . . 30 . C . . . . . 31 . N . . c18126_2lr2 1 70 . . 1 1 19 19 ASN N N . . 1 1 19 19 ASN CA C . . 1 1 19 19 ASN C C . . 1 1 20 20 LYS N N . -42.68 23.14 . . . A . 19 ASN N . . A . 19 ASN CA . . A . 19 ASN C . . A . 20 LYS N . . . 31 . N . . . . . 31 . CA . . . . . 31 . C . . . . . 32 . N . . c18126_2lr2 1 71 . . 1 1 20 20 LYS N N . . 1 1 20 20 LYS CA C . . 1 1 20 20 LYS C C . . 1 1 21 21 GLU N N . 68.55 186.77 . . . A . 20 LYS N . . A . 20 LYS CA . . A . 20 LYS C . . A . 21 GLU N . . . 32 . N . . . . . 32 . CA . . . . . 32 . C . . . . . 33 . N . . c18126_2lr2 1 72 . . 1 1 21 21 GLU N N . . 1 1 21 21 GLU CA C . . 1 1 21 21 GLU C C . . 1 1 22 22 GLN N N . 128.20 179.52 . . . A . 21 GLU N . . A . 21 GLU CA . . A . 21 GLU C . . A . 22 GLN N . . . 33 . N . . . . . 33 . CA . . . . . 33 . C . . . . . 34 . N . . c18126_2lr2 1 73 . . 1 1 23 23 GLN N N . . 1 1 23 23 GLN CA C . . 1 1 23 23 GLN C C . . 1 1 24 24 ASN N N . 108.58 181.78 . . . A . 23 GLN N . . A . 23 GLN CA . . A . 23 GLN C . . A . 24 ASN N . . . 35 . N . . . . . 35 . CA . . . . . 35 . C . . . . . 36 . N . . c18126_2lr2 1 74 . . 1 1 24 24 ASN N N . . 1 1 24 24 ASN CA C . . 1 1 24 24 ASN C C . . 1 1 25 25 ALA N N . 131.52 194.30 . . . A . 24 ASN N . . A . 24 ASN CA . . A . 24 ASN C . . A . 25 ALA N . . . 36 . N . . . . . 36 . CA . . . . . 36 . C . . . . . 37 . N . . c18126_2lr2 1 75 . . 1 1 25 25 ALA N N . . 1 1 25 25 ALA CA C . . 1 1 25 25 ALA C C . . 1 1 26 26 PHE N N . -48.56 -19.32 . . . A . 25 ALA N . . A . 25 ALA CA . . A . 25 ALA C . . A . 26 PHE N . . . 37 . N . . . . . 37 . CA . . . . . 37 . C . . . . . 38 . N . . c18126_2lr2 1 76 . . 1 1 26 26 PHE N N . . 1 1 26 26 PHE CA C . . 1 1 26 26 PHE C C . . 1 1 27 27 TYR N N . -58.00 -29.78 . . . A . 26 PHE N . . A . 26 PHE CA . . A . 26 PHE C . . A . 27 TYR N . . . 38 . N . . . . . 38 . CA . . . . . 38 . C . . . . . 39 . N . . c18126_2lr2 1 77 . . 1 1 27 27 TYR N N . . 1 1 27 27 TYR CA C . . 1 1 27 27 TYR C C . . 1 1 28 28 GLU N N . -57.19 -24.95 . . . A . 27 TYR N . . A . 27 TYR CA . . A . 27 TYR C . . A . 28 GLU N . . . 39 . N . . . . . 39 . CA . . . . . 39 . C . . . . . 40 . N . . c18126_2lr2 1 78 . . 1 1 28 28 GLU N N . . 1 1 28 28 GLU CA C . . 1 1 28 28 GLU C C . . 1 1 29 29 ILE N N . -53.13 -31.99 . . . A . 28 GLU N . . A . 28 GLU CA . . A . 28 GLU C . . A . 29 ILE N . . . 40 . N . . . . . 40 . CA . . . . . 40 . C . . . . . 41 . N . . c18126_2lr2 1 79 . . 1 1 29 29 ILE N N . . 1 1 29 29 ILE CA C . . 1 1 29 29 ILE C C . . 1 1 30 30 LEU N N . -51.90 -36.04 . . . A . 29 ILE N . . A . 29 ILE CA . . A . 29 ILE C . . A . 30 LEU N . . . 41 . N . . . . . 41 . CA . . . . . 41 . C . . . . . 42 . N . . c18126_2lr2 1 80 . . 1 1 30 30 LEU N N . . 1 1 30 30 LEU CA C . . 1 1 30 30 LEU C C . . 1 1 31 31 HIS N N . -52.04 -27.60 . . . A . 30 LEU N . . A . 30 LEU CA . . A . 30 LEU C . . A . 31 HIS N . . . 42 . N . . . . . 42 . CA . . . . . 42 . C . . . . . 43 . N . . c18126_2lr2 1 81 . . 1 1 31 31 HIS N N . . 1 1 31 31 HIS CA C . . 1 1 31 31 HIS C C . . 1 1 32 32 LEU N N . -56.49 -33.31 . . . A . 31 HIS N . . A . 31 HIS CA . . A . 31 HIS C . . A . 32 LEU N . . . 43 . N . . . . . 43 . CA . . . . . 43 . C . . . . . 44 . N . . c18126_2lr2 1 82 . . 1 1 32 32 LEU N N . . 1 1 32 32 LEU CA C . . 1 1 32 32 LEU C C . . 1 1 33 33 PRO N N . -57.01 -35.13 . . . A . 32 LEU N . . A . 32 LEU CA . . A . 32 LEU C . . A . 33 PRO N . . . 44 . N . . . . . 44 . CA . . . . . 44 . C . . . . . 45 . N . . c18126_2lr2 1 83 . . 1 1 33 33 PRO N N . . 1 1 33 33 PRO CA C . . 1 1 33 33 PRO C C . . 1 1 34 34 ASN N N . -44.08 -24.36 . . . A . 33 PRO N . . A . 33 PRO CA . . A . 33 PRO C . . A . 34 ASN N . . . 45 . N . . . . . 45 . CA . . . . . 45 . C . . . . . 46 . N . . c18126_2lr2 1 84 . . 1 1 34 34 ASN N N . . 1 1 34 34 ASN CA C . . 1 1 34 34 ASN C C . . 1 1 35 35 LEU N N . -52.49 -29.03 . . . A . 34 ASN N . . A . 34 ASN CA . . A . 34 ASN C . . A . 35 LEU N . . . 46 . N . . . . . 46 . CA . . . . . 46 . C . . . . . 47 . N . . c18126_2lr2 1 85 . . 1 1 35 35 LEU N N . . 1 1 35 35 LEU CA C . . 1 1 35 35 LEU C C . . 1 1 36 36 ASN N N . -56.24 -25.60 . . . A . 35 LEU N . . A . 35 LEU CA . . A . 35 LEU C . . A . 36 ASN N . . . 47 . N . . . . . 47 . CA . . . . . 47 . C . . . . . 48 . N . . c18126_2lr2 1 86 . . 1 1 36 36 ASN N N . . 1 1 36 36 ASN CA C . . 1 1 36 36 ASN C C . . 1 1 37 37 GLU N N . -58.02 -9.12 . . . A . 36 ASN N . . A . 36 ASN CA . . A . 36 ASN C . . A . 37 GLU N . . . 48 . N . . . . . 48 . CA . . . . . 48 . C . . . . . 49 . N . . c18126_2lr2 1 87 . . 1 1 37 37 GLU N N . . 1 1 37 37 GLU CA C . . 1 1 37 37 GLU C C . . 1 1 38 38 GLU N N . -57.41 5.39 . . . A . 37 GLU N . . A . 37 GLU CA . . A . 37 GLU C . . A . 38 GLU N . . . 49 . N . . . . . 49 . CA . . . . . 49 . C . . . . . 50 . N . . c18126_2lr2 1 88 . . 1 1 42 42 ALA N N . . 1 1 42 42 ALA CA C . . 1 1 42 42 ALA C C . . 1 1 43 43 PHE N N . 70.79 155.91 . . . A . 42 ALA N . . A . 42 ALA CA . . A . 42 ALA C . . A . 43 PHE N . . . 54 . N . . . . . 54 . CA . . . . . 54 . C . . . . . 55 . N . . c18126_2lr2 1 89 . . 1 1 43 43 PHE N N . . 1 1 43 43 PHE CA C . . 1 1 43 43 PHE C C . . 1 1 44 44 ILE N N . -56.72 4.04 . . . A . 43 PHE N . . A . 43 PHE CA . . A . 43 PHE C . . A . 44 ILE N . . . 55 . N . . . . . 55 . CA . . . . . 55 . C . . . . . 56 . N . . c18126_2lr2 1 90 . . 1 1 44 44 ILE N N . . 1 1 44 44 ILE CA C . . 1 1 44 44 ILE C C . . 1 1 45 45 GLN N N . -10.61 29.65 . . . A . 44 ILE N . . A . 44 ILE CA . . A . 44 ILE C . . A . 45 GLN N . . . 56 . N . . . . . 56 . CA . . . . . 56 . C . . . . . 57 . N . . c18126_2lr2 1 91 . . 1 1 45 45 GLN N N . . 1 1 45 45 GLN CA C . . 1 1 45 45 GLN C C . . 1 1 46 46 SER N N . 18.11 63.15 . . . A . 45 GLN N . . A . 45 GLN CA . . A . 45 GLN C . . A . 46 SER N . . . 57 . N . . . . . 57 . CA . . . . . 57 . C . . . . . 58 . N . . c18126_2lr2 1 92 . . 1 1 46 46 SER N N . . 1 1 46 46 SER CA C . . 1 1 46 46 SER C C . . 1 1 47 47 LEU N N . -14.86 23.30 . . . A . 46 SER N . . A . 46 SER CA . . A . 46 SER C . . A . 47 LEU N . . . 58 . N . . . . . 58 . CA . . . . . 58 . C . . . . . 59 . N . . c18126_2lr2 1 93 . . 1 1 49 49 ASP N N . . 1 1 49 49 ASP CA C . . 1 1 49 49 ASP C C . . 1 1 50 50 ASP N N . 72.26 155.66 . . . A . 49 ASP N . . A . 49 ASP CA . . A . 49 ASP C . . A . 50 ASP N . . . 61 . N . . . . . 61 . CA . . . . . 61 . C . . . . . 62 . N . . c18126_2lr2 1 94 . . 1 1 52 52 TYR N N . . 1 1 52 52 TYR CA C . . 1 1 52 52 TYR C C . . 1 1 53 53 ILE N N . -58.02 -12.02 . . . A . 52 TYR N . . A . 52 TYR CA . . A . 52 TYR C . . A . 53 ILE N . . . 64 . N . . . . . 64 . CA . . . . . 64 . C . . . . . 65 . N . . c18126_2lr2 1 95 . . 1 1 53 53 ILE N N . . 1 1 53 53 ILE CA C . . 1 1 53 53 ILE C C . . 1 1 54 54 ASP N N . -50.25 1.11 . . . A . 53 ILE N . . A . 53 ILE CA . . A . 53 ILE C . . A . 54 ASP N . . . 65 . N . . . . . 65 . CA . . . . . 65 . C . . . . . 66 . N . . c18126_2lr2 1 96 . . 1 1 54 54 ASP N N . . 1 1 54 54 ASP CA C . . 1 1 54 54 ASP C C . . 1 1 55 55 THR N N . -45.39 20.75 . . . A . 54 ASP N . . A . 54 ASP CA . . A . 54 ASP C . . A . 55 THR N . . . 66 . N . . . . . 66 . CA . . . . . 66 . C . . . . . 67 . N . . c18126_2lr2 1 97 . . 1 1 58 58 ASP N N . . 1 1 58 58 ASP CA C . . 1 1 58 58 ASP C C . . 1 1 59 59 GLY N N . -60.59 32.89 . . . A . 58 ASP N . . A . 58 ASP CA . . A . 58 ASP C . . A . 59 GLY N . . . 70 . N . . . . . 70 . CA . . . . . 70 . C . . . . . 71 . N . . c18126_2lr2 1 98 . . 1 1 59 59 GLY N N . . 1 1 59 59 GLY CA C . . 1 1 59 59 GLY C C . . 1 1 60 60 ALA N N . -50.04 -32.44 . . . A . 59 GLY N . . A . 59 GLY CA . . A . 59 GLY C . . A . 60 ALA N . . . 71 . N . . . . . 71 . CA . . . . . 71 . C . . . . . 72 . N . . c18126_2lr2 1 99 . . 1 1 60 60 ALA N N . . 1 1 60 60 ALA CA C . . 1 1 60 60 ALA C C . . 1 1 61 61 TYR N N . -53.92 -28.98 . . . A . 60 ALA N . . A . 60 ALA CA . . A . 60 ALA C . . A . 61 TYR N . . . 72 . N . . . . . 72 . CA . . . . . 72 . C . . . . . 73 . N . . c18126_2lr2 1 100 . . 1 1 61 61 TYR N N . . 1 1 61 61 TYR CA C . . 1 1 61 61 TYR C C . . 1 1 62 62 GLU N N . -43.22 -27.30 . . . A . 61 TYR N . . A . 61 TYR CA . . A . 61 TYR C . . A . 62 GLU N . . . 73 . N . . . . . 73 . CA . . . . . 73 . C . . . . . 74 . N . . c18126_2lr2 1 101 . . 1 1 62 62 GLU N N . . 1 1 62 62 GLU CA C . . 1 1 62 62 GLU C C . . 1 1 63 63 GLY N N . -51.51 -36.31 . . . A . 62 GLU N . . A . 62 GLU CA . . A . 62 GLU C . . A . 63 GLY N . . . 74 . N . . . . . 74 . CA . . . . . 74 . C . . . . . 75 . N . . c18126_2lr2 1 102 . . 1 1 63 63 GLY N N . . 1 1 63 63 GLY CA C . . 1 1 63 63 GLY C C . . 1 1 64 64 ASP N N . -56.73 -32.83 . . . A . 63 GLY N . . A . 63 GLY CA . . A . 63 GLY C . . A . 64 ASP N . . . 75 . N . . . . . 75 . CA . . . . . 75 . C . . . . . 76 . N . . c18126_2lr2 1 103 . . 1 1 64 64 ASP N N . . 1 1 64 64 ASP CA C . . 1 1 64 64 ASP C C . . 1 1 65 65 GLU N N . -52.64 -28.88 . . . A . 64 ASP N . . A . 64 ASP CA . . A . 64 ASP C . . A . 65 GLU N . . . 76 . N . . . . . 76 . CA . . . . . 76 . C . . . . . 77 . N . . c18126_2lr2 1 104 . . 1 1 65 65 GLU N N . . 1 1 65 65 GLU CA C . . 1 1 65 65 GLU C C . . 1 1 66 66 LEU N N . -48.10 -32.46 . . . A . 65 GLU N . . A . 65 GLU CA . . A . 65 GLU C . . A . 66 LEU N . . . 77 . N . . . . . 77 . CA . . . . . 77 . C . . . . . 78 . N . . c18126_2lr2 1 105 . . 1 1 66 66 LEU N N . . 1 1 66 66 LEU CA C . . 1 1 66 66 LEU C C . . 1 1 67 67 SER N N . -47.17 -31.97 . . . A . 66 LEU N . . A . 66 LEU CA . . A . 66 LEU C . . A . 67 SER N . . . 78 . N . . . . . 78 . CA . . . . . 78 . C . . . . . 79 . N . . c18126_2lr2 1 106 . . 1 1 67 67 SER N N . . 1 1 67 67 SER CA C . . 1 1 67 67 SER C C . . 1 1 68 68 GLY N N . -45.87 -35.13 . . . A . 67 SER N . . A . 67 SER CA . . A . 67 SER C . . A . 68 GLY N . . . 79 . N . . . . . 79 . CA . . . . . 79 . C . . . . . 80 . N . . c18126_2lr2 1 107 . . 1 1 68 68 GLY N N . . 1 1 68 68 GLY CA C . . 1 1 68 68 GLY C C . . 1 1 69 69 SER N N . -51.85 -23.49 . . . A . 68 GLY N . . A . 68 GLY CA . . A . 68 GLY C . . A . 69 SER N . . . 80 . N . . . . . 80 . CA . . . . . 80 . C . . . . . 81 . N . . c18126_2lr2 1 108 . . 1 1 69 69 SER N N . . 1 1 69 69 SER CA C . . 1 1 69 69 SER C C . . 1 1 70 70 GLN N N . -49.23 -36.17 . . . A . 69 SER N . . A . 69 SER CA . . A . 69 SER C . . A . 70 GLN N . . . 81 . N . . . . . 81 . CA . . . . . 81 . C . . . . . 82 . N . . c18126_2lr2 1 109 . . 1 1 70 70 GLN N N . . 1 1 70 70 GLN CA C . . 1 1 70 70 GLN C C . . 1 1 71 71 SER N N . -51.69 -31.75 . . . A . 70 GLN N . . A . 70 GLN CA . . A . 70 GLN C . . A . 71 SER N . . . 82 . N . . . . . 82 . CA . . . . . 82 . C . . . . . 83 . N . . c18126_2lr2 1 110 . . 1 1 71 71 SER N N . . 1 1 71 71 SER CA C . . 1 1 71 71 SER C C . . 1 1 72 72 ALA N N . -54.69 -23.19 . . . A . 71 SER N . . A . 71 SER CA . . A . 71 SER C . . A . 72 ALA N . . . 83 . N . . . . . 83 . CA . . . . . 83 . C . . . . . 84 . N . . c18126_2lr2 1 111 . . 1 1 72 72 ALA N N . . 1 1 72 72 ALA CA C . . 1 1 72 72 ALA C C . . 1 1 73 73 ASN N N . -42.57 1.31 . . . A . 72 ALA N . . A . 72 ALA CA . . A . 72 ALA C . . A . 73 ASN N . . . 84 . N . . . . . 84 . CA . . . . . 84 . C . . . . . 85 . N . . c18126_2lr2 1 112 . . 1 1 73 73 ASN N N . . 1 1 73 73 ASN CA C . . 1 1 73 73 ASN C C . . 1 1 74 74 LEU N N . -32.85 36.85 . . . A . 73 ASN N . . A . 73 ASN CA . . A . 73 ASN C . . A . 74 LEU N . . . 85 . N . . . . . 85 . CA . . . . . 85 . C . . . . . 86 . N . . c18126_2lr2 1 113 . . 1 1 74 74 LEU N N . . 1 1 74 74 LEU CA C . . 1 1 74 74 LEU C C . . 1 1 75 75 LEU N N . 87.32 173.00 . . . A . 74 LEU N . . A . 74 LEU CA . . A . 74 LEU C . . A . 75 LEU N . . . 86 . N . . . . . 86 . CA . . . . . 86 . C . . . . . 87 . N . . c18126_2lr2 1 114 . . 1 1 75 75 LEU N N . . 1 1 75 75 LEU CA C . . 1 1 75 75 LEU C C . . 1 1 76 76 ALA N N . 98.80 189.14 . . . A . 75 LEU N . . A . 75 LEU CA . . A . 75 LEU C . . A . 76 ALA N . . . 87 . N . . . . . 87 . CA . . . . . 87 . C . . . . . 88 . N . . c18126_2lr2 1 stop_ loop_ _TA_constraint_comment_org.ID _TA_constraint_comment_org.Comment_text _TA_constraint_comment_org.Comment_begin_line _TA_constraint_comment_org.Comment_begin_column _TA_constraint_comment_org.Comment_end_line _TA_constraint_comment_org.Comment_end_column _TA_constraint_comment_org.Entry_ID _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 1 '0. D 50 Chi1 -180 +/- 20; wholly artificial' 1 1 1 46 c18126_2lr2 1 2 '0. 67 Phi -120 +/- 20; wholly artificial' 6 1 6 43 c18126_2lr2 1 3 '1. K 20 Phi -60.22 +/- 7.25 (-67.47 to -52.96)' 11 1 11 49 c18126_2lr2 1 4 '2. E 21 Phi -68.97 +/- 11.96 (-80.93 to -57.01)' 16 1 16 50 c18126_2lr2 1 5 '3. Q 22 Phi -66.46 +/- 7.25 (-73.70 to -59.21)' 21 1 21 49 c18126_2lr2 1 6 '4. Q 23 Phi -65.71 +/- 9.27 (-74.98 to -56.44)' 26 1 26 49 c18126_2lr2 1 7 '5. N 24 Phi -66.22 +/- 10.22 (-76.44 to -56.00)' 31 1 31 50 c18126_2lr2 1 8 '6. A 25 Phi -63.42 +/- 6.22 (-69.64 to -57.20)' 36 1 36 49 c18126_2lr2 1 9 '7. F 26 Phi -63.81 +/- 10.24 (-74.06 to -53.57)' 41 1 41 50 c18126_2lr2 1 10 '8. Y 27 Phi -60.68 +/- 7.68 (-68.36 to -53.01)' 46 1 46 49 c18126_2lr2 1 11 '9. E 28 Phi -63.38 +/- 7.87 (-71.25 to -55.51)' 51 1 51 49 c18126_2lr2 1 12 '10. I 29 Phi -63.80 +/- 9.89 (-73.68 to -53.91)' 56 1 56 50 c18126_2lr2 1 13 '11. L 30 Phi -67.55 +/- 21.56 (-89.11 to -45.99)' 61 1 61 51 c18126_2lr2 1 14 '12. H 31 Phi -92.74 +/- 14.74 (-107.48 to -77.99)' 66 1 66 52 c18126_2lr2 1 15 '13. L 32 Phi -77.20 +/- 47.62 (-124.82 to -29.58)' 71 1 71 52 c18126_2lr2 1 16 '14. P 33 Phi -67.24 +/- 19.86 (-87.10 to -47.38)' 76 1 76 51 c18126_2lr2 1 17 '15. L 35 Phi -87.86 +/- 68.88 (-156.74 to -18.98)' 81 1 81 52 c18126_2lr2 1 18 '16. N 36 Phi -99.26 +/- 66.31 (-165.57 to -32.95)' 86 1 86 52 c18126_2lr2 1 19 '17. E 37 Phi -59.14 +/- 6.72 (-65.86 to -52.42)' 91 1 91 50 c18126_2lr2 1 20 '18. E 38 Phi -61.16 +/- 8.37 (-69.52 to -52.79)' 96 1 96 50 c18126_2lr2 1 21 '19. Q 39 Phi -66.51 +/- 11.03 (-77.54 to -55.48)' 101 1 101 51 c18126_2lr2 1 22 '20. R 40 Phi -63.35 +/- 10.32 (-73.68 to -53.03)' 106 1 106 51 c18126_2lr2 1 23 '21. N 41 Phi -61.24 +/- 7.83 (-69.07 to -53.41)' 111 1 111 50 c18126_2lr2 1 24 '22. A 42 Phi -63.48 +/- 7.18 (-70.66 to -56.30)' 116 1 116 50 c18126_2lr2 1 25 '23. F 43 Phi -61.73 +/- 7.22 (-68.96 to -54.51)' 121 1 121 50 c18126_2lr2 1 26 '24. I 44 Phi -61.90 +/- 7.15 (-69.05 to -54.75)' 126 1 126 50 c18126_2lr2 1 27 '25. Q 45 Phi -65.03 +/- 14.06 (-79.09 to -50.97)' 131 1 131 51 c18126_2lr2 1 28 '26. S 46 Phi -64.75 +/- 9.75 (-74.50 to -55.01)' 136 1 136 50 c18126_2lr2 1 29 '27. L 47 Phi -63.01 +/- 9.03 (-72.04 to -53.98)' 141 1 141 50 c18126_2lr2 1 30 '28. K 48 Phi -64.76 +/- 14.05 (-78.82 to -50.71)' 146 1 146 51 c18126_2lr2 1 31 '29. D 49 Phi -75.21 +/- 27.02 (-102.23 to -48.18)' 151 1 151 52 c18126_2lr2 1 32 '30. D 50 Phi -90.82 +/- 45.55 (-136.37 to -45.27)' 156 1 156 52 c18126_2lr2 1 33 '31. D 54 Phi -78.11 +/- 25.36 (-103.47 to -52.75)' 161 1 161 52 c18126_2lr2 1 34 '32. T 55 Phi -67.05 +/- 31.38 (-98.43 to -35.68)' 166 1 166 51 c18126_2lr2 1 35 '33. N 56 Phi -96.20 +/- 13.27 (-109.47 to -82.92)' 171 1 171 52 c18126_2lr2 1 36 '34. N 57 Phi 54.45 +/- 21.68 (32.77 to 76.13)' 176 1 176 48 c18126_2lr2 1 37 '35. D 58 Phi -98.71 +/- 23.24 (-121.96 to -75.47)' 181 1 181 52 c18126_2lr2 1 38 '36. Y 61 Phi -101.03 +/- 35.21 (-136.24 to -65.83)' 186 1 186 53 c18126_2lr2 1 39 '37. D 64 Phi -67.14 +/- 13.71 (-80.85 to -53.42)' 191 1 191 51 c18126_2lr2 1 40 '38. E 65 Phi -77.21 +/- 34.02 (-111.22 to -43.19)' 196 1 196 52 c18126_2lr2 1 41 '39. L 66 Phi -85.36 +/- 37.87 (-123.22 to -47.49)' 201 1 201 52 c18126_2lr2 1 42 '40. Q 70 Phi -71.11 +/- 46.26 (-117.37 to -24.85)' 206 1 206 52 c18126_2lr2 1 43 '41. S 71 Phi -62.64 +/- 6.70 (-69.35 to -55.94)' 211 1 211 50 c18126_2lr2 1 44 '42. A 72 Phi -63.09 +/- 9.45 (-72.54 to -53.65)' 216 1 216 50 c18126_2lr2 1 45 '43. N 73 Phi -70.51 +/- 12.16 (-82.67 to -58.35)' 221 1 221 51 c18126_2lr2 1 46 '44. L 74 Phi -65.24 +/- 7.68 (-72.92 to -57.56)' 226 1 226 50 c18126_2lr2 1 47 '45. L 75 Phi -60.59 +/- 10.56 (-71.14 to -50.03)' 231 1 231 51 c18126_2lr2 1 48 '46. A 76 Phi -61.03 +/- 10.49 (-71.52 to -50.54)' 236 1 236 51 c18126_2lr2 1 49 '47. E 77 Phi -63.46 +/- 11.88 (-75.34 to -51.58)' 241 1 241 51 c18126_2lr2 1 50 '48. A 78 Phi -63.64 +/- 10.53 (-74.17 to -53.11)' 246 1 246 51 c18126_2lr2 1 51 '49. K 79 Phi -64.35 +/- 6.78 (-71.13 to -57.57)' 251 1 251 50 c18126_2lr2 1 52 '50. K 80 Phi -65.04 +/- 9.97 (-75.01 to -55.06)' 256 1 256 50 c18126_2lr2 1 53 '51. L 81 Phi -63.63 +/- 8.38 (-72.01 to -55.25)' 261 1 261 50 c18126_2lr2 1 54 '52. N 82 Phi -62.08 +/- 11.26 (-73.33 to -50.82)' 266 1 266 51 c18126_2lr2 1 55 '53. D 83 Phi -64.46 +/- 11.76 (-76.22 to -52.69)' 271 1 271 51 c18126_2lr2 1 56 '54. A 84 Phi -69.90 +/- 19.20 (-89.11 to -50.70)' 276 1 276 51 c18126_2lr2 1 57 '55. Q 85 Phi -95.58 +/- 16.47 (-112.05 to -79.12)' 281 1 281 52 c18126_2lr2 1 58 '56. A 86 Phi -74.39 +/- 48.72 (-123.12 to -25.67)' 286 1 286 52 c18126_2lr2 1 59 '57. P 87 Phi -68.06 +/- 19.82 (-87.88 to -48.24)' 291 1 291 51 c18126_2lr2 1 60 '58. K 20 Psi -31.86 +/- 17.79 (-49.64 to -14.07)' 297 1 297 51 c18126_2lr2 1 61 '59. E 21 Psi -37.19 +/- 9.80 (-46.99 to -27.38)' 302 1 302 50 c18126_2lr2 1 62 '60. Q 22 Psi -39.95 +/- 10.12 (-50.07 to -29.83)' 307 1 307 51 c18126_2lr2 1 63 '61. Q 23 Psi -39.91 +/- 6.88 (-46.79 to -33.03)' 312 1 312 50 c18126_2lr2 1 64 '62. N 24 Psi -39.02 +/- 8.27 (-47.29 to -30.76)' 317 1 317 50 c18126_2lr2 1 65 '63. A 25 Psi -35.18 +/- 13.60 (-48.78 to -21.58)' 322 1 322 51 c18126_2lr2 1 66 '64. F 26 Psi -44.12 +/- 3.56 (-47.67 to -40.56)' 327 1 327 50 c18126_2lr2 1 67 '65. Y 27 Psi -42.09 +/- 12.61 (-54.71 to -29.48)' 332 1 332 51 c18126_2lr2 1 68 '66. E 28 Psi -43.19 +/- 14.20 (-57.39 to -28.99)' 337 1 337 51 c18126_2lr2 1 69 '67. I 29 Psi -42.61 +/- 12.12 (-54.73 to -30.48)' 342 1 342 51 c18126_2lr2 1 70 '68. L 30 Psi -24.48 +/- 24.01 (-48.49 to -0.48)' 347 1 347 50 c18126_2lr2 1 71 '69. H 31 Psi -9.77 +/- 32.91 (-42.68 to 23.14)' 352 1 352 49 c18126_2lr2 1 72 '70. L 32 Psi 127.66 +/- 59.11 (68.55 to 186.76)' 357 1 357 50 c18126_2lr2 1 73 '71. P 33 Psi 153.86 +/- 25.66 (128.20 to 179.51)' 362 1 362 51 c18126_2lr2 1 74 '72. L 35 Psi 145.18 +/- 36.60 (108.58 to 181.78)' 367 1 367 51 c18126_2lr2 1 75 '73. N 36 Psi 162.91 +/- 31.39 (131.53 to 194.30)' 372 1 372 51 c18126_2lr2 1 76 '74. E 37 Psi -33.94 +/- 14.62 (-48.56 to -19.33)' 377 1 377 51 c18126_2lr2 1 77 '75. E 38 Psi -43.89 +/- 14.11 (-58.00 to -29.78)' 382 1 382 51 c18126_2lr2 1 78 '76. Q 39 Psi -41.07 +/- 16.12 (-57.19 to -24.94)' 387 1 387 51 c18126_2lr2 1 79 '77. R 40 Psi -42.56 +/- 10.57 (-53.13 to -31.99)' 392 1 392 51 c18126_2lr2 1 80 '78. N 41 Psi -43.97 +/- 7.93 (-51.90 to -36.04)' 397 1 397 50 c18126_2lr2 1 81 '79. A 42 Psi -39.82 +/- 12.22 (-52.03 to -27.60)' 402 1 402 51 c18126_2lr2 1 82 '80. F 43 Psi -44.90 +/- 11.59 (-56.49 to -33.30)' 407 1 407 51 c18126_2lr2 1 83 '81. I 44 Psi -46.07 +/- 10.94 (-57.01 to -35.13)' 412 1 412 51 c18126_2lr2 1 84 '82. Q 45 Psi -34.22 +/- 9.86 (-44.08 to -24.36)' 417 1 417 50 c18126_2lr2 1 85 '83. S 46 Psi -40.76 +/- 11.73 (-52.49 to -29.03)' 422 1 422 51 c18126_2lr2 1 86 '84. L 47 Psi -40.92 +/- 15.32 (-56.24 to -25.60)' 427 1 427 51 c18126_2lr2 1 87 '85. K 48 Psi -33.57 +/- 24.45 (-58.03 to -9.12)' 432 1 432 50 c18126_2lr2 1 88 '86. D 49 Psi -26.01 +/- 31.40 (-57.41 to 5.39)' 437 1 437 49 c18126_2lr2 1 89 '87. D 50 Psi -15.06 +/- 51.27 (-66.33 to 36.21)' 442 1 442 50 c18126_2lr2 1 90 '88. D 54 Psi 113.35 +/- 42.56 (70.79 to 155.91)' 447 1 447 50 c18126_2lr2 1 91 '89. T 55 Psi -26.34 +/- 30.38 (-56.72 to 4.04)' 452 1 452 49 c18126_2lr2 1 92 '90. N 56 Psi 9.52 +/- 20.13 (-10.61 to 29.65)' 457 1 457 48 c18126_2lr2 1 93 '91. N 57 Psi 40.63 +/- 22.52 (18.11 to 63.14)' 462 1 462 48 c18126_2lr2 1 94 '92. D 58 Psi 4.22 +/- 19.08 (-14.85 to 23.30)' 467 1 467 48 c18126_2lr2 1 95 '93. Y 61 Psi 113.96 +/- 41.70 (72.26 to 155.66)' 472 1 472 50 c18126_2lr2 1 96 '94. D 64 Psi -35.02 +/- 23.00 (-58.02 to -12.03)' 477 1 477 51 c18126_2lr2 1 97 '95. E 65 Psi -24.57 +/- 25.68 (-50.25 to 1.11)' 482 1 482 49 c18126_2lr2 1 98 '96. L 66 Psi -12.32 +/- 33.07 (-45.40 to 20.75)' 487 1 487 50 c18126_2lr2 1 99 '97. Q 70 Psi -13.85 +/- 46.74 (-60.59 to 32.90)' 492 1 492 50 c18126_2lr2 1 100 '98. S 71 Psi -41.24 +/- 8.80 (-50.03 to -32.44)' 497 1 497 50 c18126_2lr2 1 101 '99. A 72 Psi -41.45 +/- 12.47 (-53.92 to -28.98)' 502 1 502 51 c18126_2lr2 1 102 '100. N 73 Psi -35.26 +/- 7.96 (-43.22 to -27.30)' 507 1 507 51 c18126_2lr2 1 103 '101. L 74 Psi -43.91 +/- 7.60 (-51.52 to -36.31)' 512 1 512 51 c18126_2lr2 1 104 '102. L 75 Psi -44.78 +/- 11.95 (-56.73 to -32.84)' 517 1 517 52 c18126_2lr2 1 105 '103. A 76 Psi -40.76 +/- 11.88 (-52.65 to -28.88)' 522 1 522 52 c18126_2lr2 1 106 '104. E 77 Psi -40.28 +/- 7.82 (-48.10 to -32.47)' 527 1 527 51 c18126_2lr2 1 107 '105. A 78 Psi -39.57 +/- 7.60 (-47.17 to -31.97)' 532 1 532 51 c18126_2lr2 1 108 '106. K 79 Psi -40.50 +/- 5.37 (-45.87 to -35.13)' 537 1 537 51 c18126_2lr2 1 109 '107. K 80 Psi -37.67 +/- 14.18 (-51.84 to -23.49)' 542 1 542 52 c18126_2lr2 1 110 '108. L 81 Psi -42.70 +/- 6.53 (-49.23 to -36.16)' 547 1 547 51 c18126_2lr2 1 111 '109. N 82 Psi -41.72 +/- 9.97 (-51.69 to -31.74)' 552 1 552 51 c18126_2lr2 1 112 '110. D 83 Psi -38.94 +/- 15.75 (-54.69 to -23.19)' 557 1 557 52 c18126_2lr2 1 113 '111. A 84 Psi -20.63 +/- 21.94 (-42.57 to 1.30)' 562 1 562 50 c18126_2lr2 1 114 '112. Q 85 Psi 2.00 +/- 34.85 (-32.84 to 36.85)' 567 1 567 49 c18126_2lr2 1 115 '113. A 86 Psi 130.16 +/- 42.84 (87.32 to 173.00)' 572 1 572 51 c18126_2lr2 1 116 '114. P 87 Psi 143.97 +/- 45.17 (98.80 to 189.14)' 577 1 577 51 c18126_2lr2 1 stop_ loop_ _TA_constraint_parse_err.ID _TA_constraint_parse_err.Content _TA_constraint_parse_err.Begin_line _TA_constraint_parse_err.Begin_column _TA_constraint_parse_err.End_line _TA_constraint_parse_err.End_column _TA_constraint_parse_err.Entry_ID _TA_constraint_parse_err.Torsion_angle_constraint_list_ID 1 '#assign (resid 49 and name C) (resid 50 and name N) # (resid 50 and name CA) (resid 50 and name C) 1.0 -90.82 45.55 2' 158 1 159 79 c18126_2lr2 1 2 '#assign (resid 50 and name N) (resid 50 and name CA) # (resid 50 and name C) (resid 51 and name N) 1.0 -15.06 51.27 2' 444 1 445 79 c18126_2lr2 1 stop_ save_ save_CNS/XPLOR_dipolar_coupling_3 _RDC_constraint_list.Sf_category RDC_constraints _RDC_constraint_list.Sf_framecode CNS/XPLOR_dipolar_coupling_3 _RDC_constraint_list.Entry_ID c18126_2lr2 _RDC_constraint_list.ID 1 _RDC_constraint_list.Details 'Generated by Wattos' _RDC_constraint_list.Constraint_file_ID 1 _RDC_constraint_list.Block_ID 3 loop_ _RDC_constraint_software.Software_ID _RDC_constraint_software.Software_label _RDC_constraint_software.Method_ID _RDC_constraint_software.Method_label _RDC_constraint_software.Entry_ID _RDC_constraint_software.RDC_constraint_list_ID . . . . c18126_2lr2 1 stop_ loop_ _RDC_constraint_parse_err.ID _RDC_constraint_parse_err.Content _RDC_constraint_parse_err.Begin_line _RDC_constraint_parse_err.Begin_column _RDC_constraint_parse_err.End_line _RDC_constraint_parse_err.End_column _RDC_constraint_parse_err.Entry_ID _RDC_constraint_parse_err.RDC_constraint_list_ID 1 ; #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 43 and name HN ) -1.22 0.05 ; 78 1 83 50 c18126_2lr2 1 2 ; #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 43 and name N ) -1.11 0.10 ; 183 1 188 49 c18126_2lr2 1 stop_ loop_ _RDC_constraint_conv_err.ID _RDC_constraint_conv_err.RDC_constr_parse_file_ID _RDC_constraint_conv_err.Parse_file_constraint_ID _RDC_constraint_conv_err.Conv_error_type _RDC_constraint_conv_err.Conv_error_note _RDC_constraint_conv_err.Entry_ID _RDC_constraint_conv_err.RDC_constraint_list_ID 1 3 1 1 "Not handling restraint 1, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 2 3 2 1 "Not handling restraint 2, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 3 3 3 1 "Not handling restraint 3, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 4 3 4 1 "Not handling restraint 4, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 5 3 5 1 "Not handling restraint 5, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 6 3 6 1 "Not handling restraint 6, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 7 3 7 1 "Not handling restraint 7, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 8 3 8 1 "Not handling restraint 8, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 9 3 9 1 "Not handling restraint 9, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 10 3 10 1 "Not handling restraint 10, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 11 3 11 1 "Not handling restraint 11, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 12 3 12 1 "Not handling restraint 12, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 13 3 13 1 "Not handling restraint 13, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 14 3 14 1 "Not handling restraint 14, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 15 3 15 1 "Not handling restraint 15, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 16 3 16 1 "Not handling restraint 16, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 17 3 17 1 "Not handling restraint 17, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 18 3 18 1 "Not handling restraint 18, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 19 3 19 1 "Not handling restraint 19, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 20 3 20 1 "Not handling restraint 20, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 21 3 21 1 "Not handling restraint 21, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 22 3 22 1 "Not handling restraint 22, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 23 3 23 1 "Not handling restraint 23, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 24 3 24 1 "Not handling restraint 24, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 25 3 25 1 "Not handling restraint 25, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 26 3 26 1 "Not handling restraint 26, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 27 3 27 1 "Not handling restraint 27, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 28 3 28 1 "Not handling restraint 28, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 29 3 29 1 "Not handling restraint 29, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 1 stop_ save_ save_CNS/XPLOR_dipolar_coupling_5 _RDC_constraint_list.Sf_category RDC_constraints _RDC_constraint_list.Sf_framecode CNS/XPLOR_dipolar_coupling_5 _RDC_constraint_list.Entry_ID c18126_2lr2 _RDC_constraint_list.ID 2 _RDC_constraint_list.Details 'Generated by Wattos' _RDC_constraint_list.Constraint_file_ID 1 _RDC_constraint_list.Block_ID 5 loop_ _RDC_constraint_software.Software_ID _RDC_constraint_software.Software_label _RDC_constraint_software.Method_ID _RDC_constraint_software.Method_label _RDC_constraint_software.Entry_ID _RDC_constraint_software.RDC_constraint_list_ID . . . . c18126_2lr2 2 stop_ loop_ _RDC_constraint_parse_err.ID _RDC_constraint_parse_err.Content _RDC_constraint_parse_err.Begin_line _RDC_constraint_parse_err.Begin_column _RDC_constraint_parse_err.End_line _RDC_constraint_parse_err.End_column _RDC_constraint_parse_err.Entry_ID _RDC_constraint_parse_err.RDC_constraint_list_ID 1 ; #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 59 and name HN ) -1.05 0.05 #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 59 and name N ) -1.18 0.10 #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 56 and name HN ) 0.59 0.05 #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 56 and name N ) 0.59 0.10 ; 15 1 41 48 c18126_2lr2 2 2 ; #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 47 and name HN ) 0.28 0.05 ; 85 1 90 49 c18126_2lr2 2 3 ; #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 15 and name HN ) 0.14 0.05 ; 99 1 104 49 c18126_2lr2 2 4 ; #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 52 and name HN ) 2.38 0.05 #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 17 and name HN ) 0.25 0.05 ; 141 1 153 49 c18126_2lr2 2 5 ; #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 16 and name HN ) 0.18 0.05 ; 169 1 174 49 c18126_2lr2 2 6 ; #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 14 and name HN ) 0.13 0.05 #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 57 and name HN ) -1.55 0.05 ; 197 1 209 50 c18126_2lr2 2 7 ; #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 47 and name N ) 0.27 0.10 #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 15 and name N ) 0.10 0.10 ; 218 1 230 48 c18126_2lr2 2 8 ; #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 52 and name N ) 2.28 0.10 #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 17 and name N ) 0.19 0.10 ; 260 1 272 48 c18126_2lr2 2 9 ; #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 16 and name N ) 0.17 0.10 ; 288 1 293 48 c18126_2lr2 2 10 ; #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 14 and name N ) 0.10 0.10 #assign ( resid 600 and name OO ) # ( resid 600 and name Z ) # ( resid 600 and name X ) # ( resid 600 and name Y ) # ( resid 100 and name YB ) # ( resid 57 and name N ) -1.54 0.10 ; 309 1 321 49 c18126_2lr2 2 stop_ loop_ _RDC_constraint_conv_err.ID _RDC_constraint_conv_err.RDC_constr_parse_file_ID _RDC_constraint_conv_err.Parse_file_constraint_ID _RDC_constraint_conv_err.Conv_error_type _RDC_constraint_conv_err.Conv_error_note _RDC_constraint_conv_err.Entry_ID _RDC_constraint_conv_err.RDC_constraint_list_ID 1 5 1 1 "Not handling restraint 1, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 2 5 2 1 "Not handling restraint 2, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 3 5 3 1 "Not handling restraint 3, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 4 5 4 1 "Not handling restraint 4, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 5 5 5 1 "Not handling restraint 5, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 6 5 6 1 "Not handling restraint 6, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 7 5 7 1 "Not handling restraint 7, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 8 5 8 1 "Not handling restraint 8, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 9 5 9 1 "Not handling restraint 9, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 10 5 10 1 "Not handling restraint 10, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 11 5 11 1 "Not handling restraint 11, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 12 5 12 1 "Not handling restraint 12, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 13 5 13 1 "Not handling restraint 13, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 14 5 14 1 "Not handling restraint 14, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 15 5 15 1 "Not handling restraint 15, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 16 5 16 1 "Not handling restraint 16, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 17 5 17 1 "Not handling restraint 17, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 18 5 18 1 "Not handling restraint 18, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 19 5 19 1 "Not handling restraint 19, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 20 5 20 1 "Not handling restraint 20, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 21 5 21 1 "Not handling restraint 21, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 22 5 22 1 "Not handling restraint 22, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 23 5 23 1 "Not handling restraint 23, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 24 5 24 1 "Not handling restraint 24, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 25 5 25 1 "Not handling restraint 25, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 26 5 26 1 "Not handling restraint 26, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 27 5 27 1 "Not handling restraint 27, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 28 5 28 1 "Not handling restraint 28, item 1, resonance(s) ' .100.YB' (nmrStar names) not linked" c18126_2lr2 2 stop_ save_ save_MR_file_comment_1 _Org_constr_file_comment.Sf_framecode MR_file_comment_1 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID c18126_2lr2 _Org_constr_file_comment.ID 1 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 1 _Org_constr_file_comment.Details 'Generated by Wattos' _Org_constr_file_comment.Comment '*HEADER DE NOVO PROTEIN 21-MAR-12 2LR2 *TITLE DESIGNED IGG AND LANTHANIDE BINDING PROBE FOR SOLUTION NMR, MRI AND *TITLE 2 LUMINESCENCE MICROSCOPY *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: IMMUNOGLOBULIN G-BINDING PROTEIN A; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 ORGANISM_SCIENTIFIC: ARTIFICIAL GENE; *SOURCE 3 ORGANISM_TAXID: 32630; *SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; *SOURCE 5 EXPRESSION_SYSTEM_TAXID: 469008; *SOURCE 6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); *SOURCE 7 EXPRESSION_SYSTEM_VECTOR: PET29 *KEYWDS Z DOMAIN, LANTHANIDE BINDING TAG, DE NOVO PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 2 *AUTHOR A.W.BARB, T.G.HO, J.H.PRESTEGARD *REVDAT 1 12-SEP-12 2LR2 0' save_