data_c25519_2n0b ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c25519_2n0b _Entry.Title ; NMR structure of Neuromedin C in aqueous solution. ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-03-05 _Entry.Accession_date 2015-03-05 _Entry.Last_release_date 2015-10-12 _Entry.Original_release_date 2015-10-12 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.81 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details 'This entry describes the solution structure of Neuromedin C in aqueous solution.' _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 Miquel Adrover . . . c25519_2n0b 2 Pilar Sanchis . . . c25519_2n0b 3 Bartolome Vilanova . . . c25519_2n0b 4 Kris Pauwels . . . c25519_2n0b 5 Gabriel Martorell . . . c25519_2n0b 6 'Juan Jesus' Perez . . . c25519_2n0b stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . c25519_2n0b stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Feeding regulation' . c25519_2n0b 'Growth and differentiation of human tumors' . c25519_2n0b Neuropeptide . c25519_2n0b stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c25519_2n0b heteronucl_NOEs 1 c25519_2n0b heteronucl_T1_relaxation 1 c25519_2n0b heteronucl_T2_relaxation 1 c25519_2n0b stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 34 c25519_2n0b '15N chemical shifts' 12 c25519_2n0b '1H chemical shifts' 69 c25519_2n0b 'chemical shifts' 10 c25519_2n0b 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 . . 2015-10-12 . original BMRB . c25519_2n0b stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 25520 'Neuromedin C in 10% TFE' c25519_2n0b BMRB 25521 'Neuromedin C in 25% TFE' c25519_2n0b BMRB 25522 'Neuromedin C in 40% TFE' c25519_2n0b BMRB 25523 'Neuromedin C in 60% TFE' c25519_2n0b BMRB 25524 'Neuromedin C in 90% TFE' c25519_2n0b BMRB 25525 'Neuromedin C in presence of SDS micelles' c25519_2n0b PDB 1C98 'SOLUTION STRUCTURE OF NEUROMEDIN B' c25519_2n0b PDB 1C9A 'SOLUTION STRUCTURE OF NEUROMEDIN B' c25519_2n0b PDB 2N0B 'BMRB Entry Tracking System' c25519_2n0b stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID c25519_2n0b _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 ; Conformational ensembles of neuromedin C reveal a progressive coil-helix transition within a binding-induced folding mechanism ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'RSC ADV' _Citation.Journal_name_full . _Citation.Journal_volume 5 _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 83074 _Citation.Page_last 83088 _Citation.Year 2015 _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 Miquel Adrover . . . c25519_2n0b 1 2 Pilar Sanchis . . . c25519_2n0b 1 3 Bartolome Vilanova . . . c25519_2n0b 1 4 Kris Pauwels . . . c25519_2n0b 1 5 Gabriel Martorell . . . c25519_2n0b 1 6 J. Perez . . . c25519_2n0b 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c25519_2n0b _Assembly.ID 1 _Assembly.Name 'Neuromedin C in water' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _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 'Neuromedin C' 1 $Neuromedin_C A . yes native no no . . . c25519_2n0b 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2n0b . . 'solution NMR' . . . c25519_2n0b 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Neuromedin_C _Entity.Sf_category entity _Entity.Sf_framecode Neuromedin_C _Entity.Entry_ID c25519_2n0b _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Neuromedin_C _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GNHWAVGHLMX ; _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 11 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 1123.295 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID . yes PDB 2n0b . . . . . . . . . . . . . . . . c25519_2n0b 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Elicits gastrin release and regulates gastric acid secretion and enteric motor function.' c25519_2n0b 1 'Mediates on neurotransmission and neuromodulation.' c25519_2n0b 1 'Plays a central role in regulation of the neuroendocrine and autonomic systems' c25519_2n0b 1 'Regulate growth and/or differentiation of different human tumors.' c25519_2n0b 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 GLY . c25519_2n0b 1 2 2 ASN . c25519_2n0b 1 3 3 HIS . c25519_2n0b 1 4 4 TRP . c25519_2n0b 1 5 5 ALA . c25519_2n0b 1 6 6 VAL . c25519_2n0b 1 7 7 GLY . c25519_2n0b 1 8 8 HIS . c25519_2n0b 1 9 9 LEU . c25519_2n0b 1 10 10 MET . c25519_2n0b 1 11 11 NH2 . c25519_2n0b 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 c25519_2n0b 1 . ASN 2 2 c25519_2n0b 1 . HIS 3 3 c25519_2n0b 1 . TRP 4 4 c25519_2n0b 1 . ALA 5 5 c25519_2n0b 1 . VAL 6 6 c25519_2n0b 1 . GLY 7 7 c25519_2n0b 1 . HIS 8 8 c25519_2n0b 1 . LEU 9 9 c25519_2n0b 1 . MET 10 10 c25519_2n0b 1 . NH2 11 11 c25519_2n0b 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 c25519_2n0b _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Neuromedin_C . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . c25519_2n0b 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 c25519_2n0b _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Neuromedin_C . 'obtained from a vendor' . . . . . . . . . . . . . . . 'Neuromedin C was purchased from Holzel Diagnostika Handels GmbH' c25519_2n0b 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_NH2 _Chem_comp.Entry_ID c25519_2n0b _Chem_comp.ID NH2 _Chem_comp.Provenance PDB _Chem_comp.Name 'AMINO GROUP' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code NH2 _Chem_comp.PDB_code NH2 _Chem_comp.Ambiguous_flag yes _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code NH2 _Chem_comp.Number_atoms_all 3 _Chem_comp.Number_atoms_nh 1 _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InCHi_code InChI=1/H3N/h1H3 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'H2 N' _Chem_comp.Formula_weight 16.023 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details 'OpenEye OEToolkits' _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code 2FLY _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1/H3N/h1H3 InChI InChI 1.02b c25519_2n0b NH2 N SMILES ACDLabs 10.04 c25519_2n0b NH2 QGZKDVFQNNGYKY-UHFFFAOYAF InChIKey InChI 1.02b c25519_2n0b NH2 [NH2] SMILES CACTVS 3.341 c25519_2n0b NH2 [NH2] SMILES 'OpenEye OEToolkits' 1.5.0 c25519_2n0b NH2 [NH2] SMILES_CANONICAL CACTVS 3.341 c25519_2n0b NH2 [NH2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c25519_2n0b NH2 stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID ammonia 'SYSTEMATIC NAME' ACDLabs 10.04 c25519_2n0b NH2 l^{2}-azane 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c25519_2n0b NH2 stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID N N N N . N . . N 0 . . . 1 no no . . . . 10.091 . 8.978 . -7.810 . 0.000 0.000 0.000 1 . c25519_2n0b NH2 HN1 HN1 HN1 1HN . H . . N 0 . . . 1 no no . . . . 9.517 . 8.769 . -7.044 . -0.385 -0.545 -0.771 2 . c25519_2n0b NH2 HN2 HN2 HN2 2HN . H . . N 0 . . . 1 no no . . . . 10.323 . 9.890 . -8.082 . 1.020 0.000 0.000 3 . c25519_2n0b NH2 stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING N HN1 no N 1 . c25519_2n0b NH2 2 . SING N HN2 no N 2 . c25519_2n0b NH2 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID c25519_2n0b _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'The sample was prepared in 10mM acetate buffer at pH 4.0' _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 'Neuromedin C' 'natural abundance' . . 1 $Neuromedin_C . . 5.0 . . mM 0.1 . . . c25519_2n0b 1 2 'sodium acetate' 'natural abundance' . . . . . . 10 . . mM 0.1 . . . c25519_2n0b 1 3 DSS 'natural abundance' . . . . . . 1.6 . . mM 0.1 . . . c25519_2n0b 1 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . c25519_2n0b 1 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . c25519_2n0b 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 c25519_2n0b _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.01 . M c25519_2n0b 1 pH 4.0 . pH c25519_2n0b 1 pressure 1 . atm c25519_2n0b 1 temperature 273 . K c25519_2n0b 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID c25519_2n0b _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . c25519_2n0b 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing c25519_2n0b 1 stop_ save_ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID c25519_2n0b _Software.ID 2 _Software.Name XEASY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bartels et al.' . . c25519_2n0b 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' c25519_2n0b 2 'peak picking' c25519_2n0b 2 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID c25519_2n0b _Software.ID 3 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . c25519_2n0b 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' c25519_2n0b 3 refinement c25519_2n0b 3 'structure solution' c25519_2n0b 3 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 c25519_2n0b _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'Bruker Avance III spectrometer operating at 14.1T (600MHz) and equipped with a 5-mm 13C, 15N, 1H triple resonance cryoprobe.' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _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 c25519_2n0b _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 'Bruker Avance III spectrometer operating at 14.1T (600MHz) and equipped with a 5-mm 13C, 15N, 1H triple resonance cryoprobe.' . . c25519_2n0b 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 c25519_2n0b _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-1H TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25519_2n0b 1 2 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25519_2n0b 1 3 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25519_2n0b 1 4 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25519_2n0b 1 5 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25519_2n0b 1 6 '2D 15N-T1' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25519_2n0b 1 7 '2D 15N-T2' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25519_2n0b 1 8 '2D 15N-HET-NOE' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25519_2n0b 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 c25519_2n0b _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl carbons' . . . . ppm 0 internal direct 1.0 . . . . . . . . . c25519_2n0b 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1.0 . . . . . . . . . c25519_2n0b 1 N 15 water protons . . . . ppm 0 internal indirect 0.101329118 . . . . . . . . . c25519_2n0b 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 c25519_2n0b _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-1H TOCSY' . . . c25519_2n0b 1 3 '2D 1H-15N HSQC' . . . c25519_2n0b 1 4 '2D 1H-13C HSQC' . . . c25519_2n0b 1 5 '2D 1H-13C HSQC aromatic' . . . c25519_2n0b 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $XEASY . . c25519_2n0b 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 1 1 GLY HA2 H 1 3.804 0.010 . 2 . . . A 1 GLY HA2 . c25519_2n0b 1 2 . 1 1 1 1 GLY HA3 H 1 3.804 0.010 . 2 . . . A 1 GLY HA3 . c25519_2n0b 1 3 . 1 1 1 1 GLY CA C 13 43.286 0.100 . 1 . . . A 1 GLY CA . c25519_2n0b 1 4 . 1 1 2 2 ASN H H 1 8.681 0.010 . 1 . . . A 2 ASN H . c25519_2n0b 1 5 . 1 1 2 2 ASN HA H 1 4.617 0.010 . 1 . . . A 2 ASN HA . c25519_2n0b 1 6 . 1 1 2 2 ASN HB2 H 1 2.549 0.010 . 2 . . . A 2 ASN HB2 . c25519_2n0b 1 7 . 1 1 2 2 ASN HB3 H 1 2.498 0.010 . 2 . . . A 2 ASN HB3 . c25519_2n0b 1 8 . 1 1 2 2 ASN HD21 H 1 7.536 0.011 . 2 . . . A 2 ASN HD21 . c25519_2n0b 1 9 . 1 1 2 2 ASN HD22 H 1 6.934 0.010 . 2 . . . A 2 ASN HD22 . c25519_2n0b 1 10 . 1 1 2 2 ASN CA C 13 53.095 0.100 . 1 . . . A 2 ASN CA . c25519_2n0b 1 11 . 1 1 2 2 ASN CB C 13 38.985 0.100 . 1 . . . A 2 ASN CB . c25519_2n0b 1 12 . 1 1 2 2 ASN N N 15 118.375 0.100 . 1 . . . A 2 ASN N . c25519_2n0b 1 13 . 1 1 2 2 ASN ND2 N 15 113.295 0.100 . 1 . . . A 2 ASN ND2 . c25519_2n0b 1 14 . 1 1 3 3 HIS H H 1 8.584 0.010 . 1 . . . A 3 HIS H . c25519_2n0b 1 15 . 1 1 3 3 HIS HA H 1 4.607 0.010 . 1 . . . A 3 HIS HA . c25519_2n0b 1 16 . 1 1 3 3 HIS HB2 H 1 3.057 0.010 . 2 . . . A 3 HIS HB2 . c25519_2n0b 1 17 . 1 1 3 3 HIS HB3 H 1 3.111 0.010 . 2 . . . A 3 HIS HB3 . c25519_2n0b 1 18 . 1 1 3 3 HIS HD2 H 1 7.083 0.010 . 1 . . . A 3 HIS HD2 . c25519_2n0b 1 19 . 1 1 3 3 HIS HE1 H 1 8.419 0.010 . 1 . . . A 3 HIS HE1 . c25519_2n0b 1 20 . 1 1 3 3 HIS CA C 13 55.634 0.100 . 1 . . . A 3 HIS CA . c25519_2n0b 1 21 . 1 1 3 3 HIS CB C 13 28.993 0.100 . 1 . . . A 3 HIS CB . c25519_2n0b 1 22 . 1 1 3 3 HIS CD2 C 13 120.125 0.100 . 1 . . . A 3 HIS CD2 . c25519_2n0b 1 23 . 1 1 3 3 HIS CE1 C 13 136.611 0.100 . 1 . . . A 3 HIS CE1 . c25519_2n0b 1 24 . 1 1 3 3 HIS N N 15 119.590 0.100 . 1 . . . A 3 HIS N . c25519_2n0b 1 25 . 1 1 4 4 TRP H H 1 8.171 0.010 . 1 . . . A 4 TRP H . c25519_2n0b 1 26 . 1 1 4 4 TRP HA H 1 4.667 0.010 . 1 . . . A 4 TRP HA . c25519_2n0b 1 27 . 1 1 4 4 TRP HB2 H 1 3.250 0.010 . 2 . . . A 4 TRP HB2 . c25519_2n0b 1 28 . 1 1 4 4 TRP HB3 H 1 3.166 0.010 . 2 . . . A 4 TRP HB3 . c25519_2n0b 1 29 . 1 1 4 4 TRP HD1 H 1 7.206 0.010 . 1 . . . A 4 TRP HD1 . c25519_2n0b 1 30 . 1 1 4 4 TRP HE1 H 1 10.145 0.010 . 1 . . . A 4 TRP HE1 . c25519_2n0b 1 31 . 1 1 4 4 TRP HE3 H 1 7.555 0.010 . 1 . . . A 4 TRP HE3 . c25519_2n0b 1 32 . 1 1 4 4 TRP HZ2 H 1 7.474 0.010 . 1 . . . A 4 TRP HZ2 . c25519_2n0b 1 33 . 1 1 4 4 TRP HZ3 H 1 7.128 0.010 . 1 . . . A 4 TRP HZ3 . c25519_2n0b 1 34 . 1 1 4 4 TRP HH2 H 1 7.232 0.010 . 1 . . . A 4 TRP HH2 . c25519_2n0b 1 35 . 1 1 4 4 TRP CA C 13 57.176 0.100 . 1 . . . A 4 TRP CA . c25519_2n0b 1 36 . 1 1 4 4 TRP CB C 13 29.948 0.100 . 1 . . . A 4 TRP CB . c25519_2n0b 1 37 . 1 1 4 4 TRP CD1 C 13 127.286 0.100 . 1 . . . A 4 TRP CD1 . c25519_2n0b 1 38 . 1 1 4 4 TRP CE3 C 13 120.972 0.100 . 1 . . . A 4 TRP CE3 . c25519_2n0b 1 39 . 1 1 4 4 TRP CZ2 C 13 114.709 0.100 . 1 . . . A 4 TRP CZ2 . c25519_2n0b 1 40 . 1 1 4 4 TRP CZ3 C 13 122.148 0.100 . 1 . . . A 4 TRP CZ3 . c25519_2n0b 1 41 . 1 1 4 4 TRP CH2 C 13 124.938 0.100 . 1 . . . A 4 TRP CH2 . c25519_2n0b 1 42 . 1 1 4 4 TRP N N 15 122.380 0.100 . 1 . . . A 4 TRP N . c25519_2n0b 1 43 . 1 1 4 4 TRP NE1 N 15 129.249 0.100 . 1 . . . A 4 TRP NE1 . c25519_2n0b 1 44 . 1 1 5 5 ALA H H 1 8.271 0.010 . 1 . . . A 5 ALA H . c25519_2n0b 1 45 . 1 1 5 5 ALA HA H 1 4.314 0.010 . 1 . . . A 5 ALA HA . c25519_2n0b 1 46 . 1 1 5 5 ALA HB1 H 1 1.321 0.010 . 1 . . . A 5 ALA HB1 . c25519_2n0b 1 47 . 1 1 5 5 ALA HB2 H 1 1.321 0.010 . 1 . . . A 5 ALA HB2 . c25519_2n0b 1 48 . 1 1 5 5 ALA HB3 H 1 1.321 0.010 . 1 . . . A 5 ALA HB3 . c25519_2n0b 1 49 . 1 1 5 5 ALA CA C 13 52.236 0.100 . 1 . . . A 5 ALA CA . c25519_2n0b 1 50 . 1 1 5 5 ALA CB C 13 19.605 0.100 . 1 . . . A 5 ALA CB . c25519_2n0b 1 51 . 1 1 5 5 ALA N N 15 125.787 0.100 . 1 . . . A 5 ALA N . c25519_2n0b 1 52 . 1 1 6 6 VAL H H 1 8.133 0.010 . 1 . . . A 6 VAL H . c25519_2n0b 1 53 . 1 1 6 6 VAL HA H 1 3.990 0.010 . 1 . . . A 6 VAL HA . c25519_2n0b 1 54 . 1 1 6 6 VAL HB H 1 2.047 0.010 . 1 . . . A 6 VAL HB . c25519_2n0b 1 55 . 1 1 6 6 VAL HG11 H 1 0.975 0.010 . 2 . . . A 6 VAL HG11 . c25519_2n0b 1 56 . 1 1 6 6 VAL HG12 H 1 0.975 0.010 . 2 . . . A 6 VAL HG12 . c25519_2n0b 1 57 . 1 1 6 6 VAL HG13 H 1 0.975 0.010 . 2 . . . A 6 VAL HG13 . c25519_2n0b 1 58 . 1 1 6 6 VAL HG21 H 1 0.946 0.010 . 2 . . . A 6 VAL HG21 . c25519_2n0b 1 59 . 1 1 6 6 VAL HG22 H 1 0.946 0.010 . 2 . . . A 6 VAL HG22 . c25519_2n0b 1 60 . 1 1 6 6 VAL HG23 H 1 0.946 0.010 . 2 . . . A 6 VAL HG23 . c25519_2n0b 1 61 . 1 1 6 6 VAL CA C 13 62.944 0.100 . 1 . . . A 6 VAL CA . c25519_2n0b 1 62 . 1 1 6 6 VAL CB C 13 32.564 0.100 . 1 . . . A 6 VAL CB . c25519_2n0b 1 63 . 1 1 6 6 VAL CG1 C 13 20.864 0.100 . 1 . . . A 6 VAL CG1 . c25519_2n0b 1 64 . 1 1 6 6 VAL CG2 C 13 21.036 0.100 . 1 . . . A 6 VAL CG2 . c25519_2n0b 1 65 . 1 1 6 6 VAL N N 15 119.815 0.100 . 1 . . . A 6 VAL N . c25519_2n0b 1 66 . 1 1 7 7 GLY H H 1 8.546 0.010 . 1 . . . A 7 GLY H . c25519_2n0b 1 67 . 1 1 7 7 GLY HA2 H 1 3.900 0.010 . 2 . . . A 7 GLY HA2 . c25519_2n0b 1 68 . 1 1 7 7 GLY HA3 H 1 3.943 0.010 . 2 . . . A 7 GLY HA3 . c25519_2n0b 1 69 . 1 1 7 7 GLY CA C 13 45.117 0.100 . 1 . . . A 7 GLY CA . c25519_2n0b 1 70 . 1 1 7 7 GLY N N 15 112.470 0.100 . 1 . . . A 7 GLY N . c25519_2n0b 1 71 . 1 1 8 8 HIS H H 1 8.316 0.011 . 1 . . . A 8 HIS H . c25519_2n0b 1 72 . 1 1 8 8 HIS HA H 1 4.617 0.010 . 1 . . . A 8 HIS HA . c25519_2n0b 1 73 . 1 1 8 8 HIS HB2 H 1 3.222 0.010 . 2 . . . A 8 HIS HB2 . c25519_2n0b 1 74 . 1 1 8 8 HIS HB3 H 1 3.113 0.010 . 2 . . . A 8 HIS HB3 . c25519_2n0b 1 75 . 1 1 8 8 HIS HD2 H 1 7.145 0.010 . 1 . . . A 8 HIS HD2 . c25519_2n0b 1 76 . 1 1 8 8 HIS HE1 H 1 8.432 0.010 . 1 . . . A 8 HIS HE1 . c25519_2n0b 1 77 . 1 1 8 8 HIS CA C 13 55.447 0.100 . 1 . . . A 8 HIS CA . c25519_2n0b 1 78 . 1 1 8 8 HIS CB C 13 29.234 0.100 . 1 . . . A 8 HIS CB . c25519_2n0b 1 79 . 1 1 8 8 HIS CD2 C 13 120.181 0.100 . 1 . . . A 8 HIS CD2 . c25519_2n0b 1 80 . 1 1 8 8 HIS CE1 C 13 136.607 0.100 . 1 . . . A 8 HIS CE1 . c25519_2n0b 1 81 . 1 1 8 8 HIS N N 15 118.586 0.100 . 1 . . . A 8 HIS N . c25519_2n0b 1 82 . 1 1 9 9 LEU H H 1 8.397 0.010 . 1 . . . A 9 LEU H . c25519_2n0b 1 83 . 1 1 9 9 LEU HA H 1 4.290 0.010 . 1 . . . A 9 LEU HA . c25519_2n0b 1 84 . 1 1 9 9 LEU HB2 H 1 1.609 0.010 . 2 . . . A 9 LEU HB2 . c25519_2n0b 1 85 . 1 1 9 9 LEU HB3 H 1 1.532 0.010 . 2 . . . A 9 LEU HB3 . c25519_2n0b 1 86 . 1 1 9 9 LEU HG H 1 1.538 0.010 . 1 . . . A 9 LEU HG . c25519_2n0b 1 87 . 1 1 9 9 LEU HD11 H 1 0.890 0.010 . 2 . . . A 9 LEU HD11 . c25519_2n0b 1 88 . 1 1 9 9 LEU HD12 H 1 0.890 0.010 . 2 . . . A 9 LEU HD12 . c25519_2n0b 1 89 . 1 1 9 9 LEU HD13 H 1 0.890 0.010 . 2 . . . A 9 LEU HD13 . c25519_2n0b 1 90 . 1 1 9 9 LEU HD21 H 1 0.844 0.010 . 2 . . . A 9 LEU HD21 . c25519_2n0b 1 91 . 1 1 9 9 LEU HD22 H 1 0.844 0.010 . 2 . . . A 9 LEU HD22 . c25519_2n0b 1 92 . 1 1 9 9 LEU HD23 H 1 0.844 0.010 . 2 . . . A 9 LEU HD23 . c25519_2n0b 1 93 . 1 1 9 9 LEU CA C 13 55.396 0.100 . 1 . . . A 9 LEU CA . c25519_2n0b 1 94 . 1 1 9 9 LEU CB C 13 42.197 0.100 . 1 . . . A 9 LEU CB . c25519_2n0b 1 95 . 1 1 9 9 LEU CG C 13 26.985 0.100 . 1 . . . A 9 LEU CG . c25519_2n0b 1 96 . 1 1 9 9 LEU CD1 C 13 24.829 0.100 . 1 . . . A 9 LEU CD1 . c25519_2n0b 1 97 . 1 1 9 9 LEU CD2 C 13 23.475 0.100 . 1 . . . A 9 LEU CD2 . c25519_2n0b 1 98 . 1 1 9 9 LEU N N 15 123.950 0.100 . 1 . . . A 9 LEU N . c25519_2n0b 1 99 . 1 1 10 10 MET H H 1 8.428 0.010 . 1 . . . A 10 MET H . c25519_2n0b 1 100 . 1 1 10 10 MET HA H 1 4.402 0.010 . 1 . . . A 10 MET HA . c25519_2n0b 1 101 . 1 1 10 10 MET HB2 H 1 2.069 0.010 . 2 . . . A 10 MET HB2 . c25519_2n0b 1 102 . 1 1 10 10 MET HB3 H 1 1.965 0.010 . 2 . . . A 10 MET HB3 . c25519_2n0b 1 103 . 1 1 10 10 MET HG2 H 1 2.496 0.010 . 2 . . . A 10 MET HG2 . c25519_2n0b 1 104 . 1 1 10 10 MET HG3 H 1 2.591 0.010 . 2 . . . A 10 MET HG3 . c25519_2n0b 1 105 . 1 1 10 10 MET HE1 H 1 2.082 0.010 . 1 . . . A 10 MET HE1 . c25519_2n0b 1 106 . 1 1 10 10 MET HE2 H 1 2.082 0.010 . 1 . . . A 10 MET HE2 . c25519_2n0b 1 107 . 1 1 10 10 MET HE3 H 1 2.082 0.010 . 1 . . . A 10 MET HE3 . c25519_2n0b 1 108 . 1 1 10 10 MET CA C 13 55.093 0.100 . 1 . . . A 10 MET CA . c25519_2n0b 1 109 . 1 1 10 10 MET CB C 13 32.799 0.100 . 1 . . . A 10 MET CB . c25519_2n0b 1 110 . 1 1 10 10 MET CG C 13 32.174 0.100 . 1 . . . A 10 MET CG . c25519_2n0b 1 111 . 1 1 10 10 MET CE C 13 16.801 0.100 . 1 . . . A 10 MET CE . c25519_2n0b 1 112 . 1 1 10 10 MET N N 15 121.757 0.100 . 1 . . . A 10 MET N . c25519_2n0b 1 113 . 1 1 11 11 NH2 HN1 H 1 7.548 0.010 . 2 . . . . 11 NH2 HN1 . c25519_2n0b 1 114 . 1 1 11 11 NH2 HN2 H 1 7.154 0.012 . 2 . . . . 11 NH2 HN2 . c25519_2n0b 1 115 . 1 1 11 11 NH2 N N 15 108.266 0.100 . 1 . . . . 11 NH2 N . c25519_2n0b 1 stop_ save_ ############################## # Heteronuclear NOE values # ############################## save_heteronuclear_noe_list_1 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronuclear_noe_list_1 _Heteronucl_NOE_list.Entry_ID c25519_2n0b _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 600 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak height' _Heteronucl_NOE_list.NOE_ref_val 1000 _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 8 '2D 15N-HET-NOE' . . . c25519_2n0b 1 stop_ loop_ _Heteronucl_NOE_software.Software_ID _Heteronucl_NOE_software.Software_label _Heteronucl_NOE_software.Method_ID _Heteronucl_NOE_software.Method_label _Heteronucl_NOE_software.Entry_ID _Heteronucl_NOE_software.Heteronucl_NOE_list_ID 1 $NMRPipe . . c25519_2n0b 1 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 2 2 ASN N N . . 1 1 2 2 ASN H H . -1.665 0.255 . . . 2 ASN N . 2 ASN H c25519_2n0b 1 2 . 1 1 3 3 HIS N N . . 1 1 3 3 HIS H H . -1.534 0.130 . . . 3 HIS N . 3 HIS H c25519_2n0b 1 3 . 1 1 4 4 TRP N N . . 1 1 4 4 TRP H H . -1.210 0.058 . . . 4 TRP N . 4 TRP H c25519_2n0b 1 4 . 1 1 4 4 TRP NE1 N . . 1 1 4 4 TRP HE1 H . 0.269 0.026 . . . 4 TRP NE1 . 4 TRP HE1 c25519_2n0b 1 5 . 1 1 5 5 ALA N N . . 1 1 5 5 ALA H H . -0.536 0.038 . . . 5 ALA N . 5 ALA H c25519_2n0b 1 6 . 1 1 6 6 VAL N N . . 1 1 6 6 VAL H H . -0.983 0.051 . . . 6 VAL N . 6 VAL H c25519_2n0b 1 7 . 1 1 7 7 GLY N N . . 1 1 7 7 GLY H H . -0.892 0.049 . . . 7 GLY N . 7 GLY H c25519_2n0b 1 8 . 1 1 8 8 HIS N N . . 1 1 8 8 HIS H H . -0.754 0.053 . . . 8 HIS N . 8 HIS H c25519_2n0b 1 9 . 1 1 9 9 LEU N N . . 1 1 9 9 LEU H H . -1.018 0.055 . . . 9 LEU N . 9 LEU H c25519_2n0b 1 10 . 1 1 10 10 MET N N . . 1 1 10 10 MET H H . -1.469 0.063 . . . 10 MET N . 10 MET H c25519_2n0b 1 stop_ save_ ######################################## # Heteronuclear T1 relaxation values # ######################################## save_heteronuclear_T1_list_1 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronuclear_T1_list_1 _Heteronucl_T1_list.Entry_ID c25519_2n0b _Heteronucl_T1_list.ID 1 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 600 _Heteronucl_T1_list.T1_coherence_type Iz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 6 '2D 15N-T1' . . . c25519_2n0b 1 stop_ loop_ _Heteronucl_T1_software.Software_ID _Heteronucl_T1_software.Software_label _Heteronucl_T1_software.Method_ID _Heteronucl_T1_software.Method_label _Heteronucl_T1_software.Entry_ID _Heteronucl_T1_software.Heteronucl_T1_list_ID 1 $NMRPipe . . c25519_2n0b 1 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 2 2 ASN N N 15 1.164 0.342 . . 2 ASN N c25519_2n0b 1 2 . 1 1 3 3 HIS N N 15 0.877 0.087 . . 3 HIS N c25519_2n0b 1 3 . 1 1 4 4 TRP N N 15 0.857 0.149 . . 4 TRP N c25519_2n0b 1 4 . 1 1 4 4 TRP NE1 N 15 1.105 0.085 . . 4 TRP NE1 c25519_2n0b 1 5 . 1 1 5 5 ALA N N 15 0.853 0.110 . . 5 ALA N c25519_2n0b 1 6 . 1 1 6 6 VAL N N 15 0.931 0.126 . . 6 VAL N c25519_2n0b 1 7 . 1 1 7 7 GLY N N 15 0.855 0.093 . . 7 GLY N c25519_2n0b 1 8 . 1 1 8 8 HIS N N 15 0.933 0.188 . . 8 HIS N c25519_2n0b 1 9 . 1 1 9 9 LEU N N 15 1.082 0.131 . . 9 LEU N c25519_2n0b 1 10 . 1 1 10 10 MET N N 15 0.949 0.100 . . 10 MET N c25519_2n0b 1 stop_ save_ ######################################## # Heteronuclear T2 relaxation values # ######################################## save_heteronuclear_T2_list_1 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronuclear_T2_list_1 _Heteronucl_T2_list.Entry_ID c25519_2n0b _Heteronucl_T2_list.ID 1 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method methanol _Heteronucl_T2_list.Temp_control_method 'temperature compensation block' _Heteronucl_T2_list.Spectrometer_frequency_1H 600 _Heteronucl_T2_list.T2_coherence_type I(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 7 '2D 15N-T2' . . . c25519_2n0b 1 stop_ loop_ _Heteronucl_T2_software.Software_ID _Heteronucl_T2_software.Software_label _Heteronucl_T2_software.Method_ID _Heteronucl_T2_software.Method_label _Heteronucl_T2_software.Entry_ID _Heteronucl_T2_software.Heteronucl_T2_list_ID 1 $NMRPipe . . c25519_2n0b 1 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 2 2 ASN N N 15 1.251 0.070 . . . . 2 ASN N c25519_2n0b 1 2 . 1 1 3 3 HIS N N 15 0.819 0.180 . . . . 3 HIS N c25519_2n0b 1 3 . 1 1 4 4 TRP N N 15 0.748 0.094 . . . . 4 TRP N c25519_2n0b 1 4 . 1 1 4 4 TRP NE1 N 15 0.981 0.072 . . . . 4 TRP NE1 c25519_2n0b 1 5 . 1 1 5 5 ALA N N 15 0.725 0.032 . . . . 5 ALA N c25519_2n0b 1 6 . 1 1 6 6 VAL N N 15 0.799 0.085 . . . . 6 VAL N c25519_2n0b 1 7 . 1 1 7 7 GLY N N 15 0.740 0.027 . . . . 7 GLY N c25519_2n0b 1 8 . 1 1 8 8 HIS N N 15 0.785 0.075 . . . . 8 HIS N c25519_2n0b 1 9 . 1 1 9 9 LEU N N 15 0.934 0.106 . . . . 9 LEU N c25519_2n0b 1 10 . 1 1 10 10 MET N N 15 0.793 0.148 . . . . 10 MET N c25519_2n0b 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 c25519_2n0b _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 18 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 c25519_2n0b _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 . . . c25519_2n0b 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 . . . . c25519_2n0b 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 1 GLY C C 11.136 2.111 6.305 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 1 . 2 . 1 1 1 GLY CA C 11.920 2.065 7.600 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 1 . 3 . 1 1 1 GLY H1 H 11.807 1.289 9.469 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 1 . 4 . 1 1 1 GLY H2 H 10.346 1.702 8.824 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 1 . 5 . 1 1 1 GLY H3 H 11.122 0.341 8.306 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 1 . 6 . 1 1 1 GLY HA2 H 12.056 3.083 7.962 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 1 . 7 . 1 1 1 GLY HA3 H 12.898 1.624 7.406 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 1 . 8 . 1 1 1 GLY N N 11.248 1.290 8.628 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 1 . 9 . 1 1 1 GLY O O 10.666 3.171 5.894 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 1 . 10 . 1 1 2 ASN C C 8.885 0.253 4.611 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 1 . 11 . 1 1 2 ASN CA C 10.264 0.872 4.398 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 1 . 12 . 1 1 2 ASN CB C 11.054 0.048 3.381 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 1 . 13 . 1 1 2 ASN CG C 10.727 0.426 1.950 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 1 . 14 . 1 1 2 ASN H H 11.405 0.121 6.047 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 1 . 15 . 1 1 2 ASN HA H 10.135 1.880 4.002 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 1 . 16 . 1 1 2 ASN HB2 H 12.118 0.210 3.551 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 1 . 17 . 1 1 2 ASN HB3 H 10.828 -1.008 3.529 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 1 . 18 . 1 1 2 ASN HD21 H 12.112 -0.884 1.250 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 1 . 19 . 1 1 2 ASN HD22 H 11.239 0.013 0.028 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 1 . 20 . 1 1 2 ASN N N 10.995 0.958 5.657 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 1 . 21 . 1 1 2 ASN ND2 N 11.414 -0.198 1.000 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 1 . 22 . 1 1 2 ASN O O 8.735 -0.714 5.360 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 1 . 23 . 1 1 2 ASN OD1 O 9.866 1.270 1.701 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 1 . 24 . 1 1 3 HIS C C 6.193 -0.651 2.930 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 1 . 25 . 1 1 3 HIS CA C 6.514 0.320 4.062 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 1 . 26 . 1 1 3 HIS CB C 5.523 1.486 4.049 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 1 . 27 . 1 1 3 HIS CD2 C 5.433 3.700 5.403 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 1 . 28 . 1 1 3 HIS CE1 C 5.910 2.868 7.371 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 1 . 29 . 1 1 3 HIS CG C 5.612 2.357 5.273 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 1 . 30 . 1 1 3 HIS H H 8.069 1.608 3.348 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 1 . 31 . 1 1 3 HIS HA H 6.416 -0.209 5.011 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 1 . 32 . 1 1 3 HIS HB2 H 5.713 2.099 3.168 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 1 . 33 . 1 1 3 HIS HB3 H 4.513 1.081 3.985 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 1 . 34 . 1 1 3 HIS HD2 H 5.188 4.394 4.612 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 1 . 35 . 1 1 3 HIS HE1 H 6.110 2.788 8.429 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 1 . 36 . 1 1 3 HIS HE2 H 5.563 4.926 7.155 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 1 . 37 . 1 1 3 HIS N N 7.881 0.817 3.947 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 1 . 38 . 1 1 3 HIS ND1 N 5.912 1.847 6.525 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 1 . 39 . 1 1 3 HIS NE2 N 5.626 4.009 6.737 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 1 . 40 . 1 1 3 HIS O O 5.850 -0.236 1.822 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 1 . 41 . 1 1 4 TRP C C 4.580 -2.890 1.742 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 1 . 42 . 1 1 4 TRP CA C 6.025 -2.973 2.220 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 1 . 43 . 1 1 4 TRP CB C 6.307 -4.360 2.800 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 1 . 44 . 1 1 4 TRP CD1 C 8.466 -5.726 2.619 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 1 . 45 . 1 1 4 TRP CD2 C 7.483 -5.295 0.654 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 1 . 46 . 1 1 4 TRP CE2 C 8.650 -6.046 0.416 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 1 . 47 . 1 1 4 TRP CE3 C 6.698 -4.907 -0.435 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 1 . 48 . 1 1 4 TRP CG C 7.384 -5.101 2.069 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 1 . 49 . 1 1 4 TRP CH2 C 8.263 -6.024 -1.913 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 1 . 50 . 1 1 4 TRP CZ2 C 9.050 -6.416 -0.864 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 1 . 51 . 1 1 4 TRP CZ3 C 7.097 -5.276 -1.707 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 1 . 52 . 1 1 4 TRP H H 6.589 -2.220 4.143 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 1 . 53 . 1 1 4 TRP HA H 6.682 -2.815 1.365 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 1 . 54 . 1 1 4 TRP HB2 H 6.612 -4.244 3.840 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 1 . 55 . 1 1 4 TRP HB3 H 5.390 -4.948 2.766 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 1 . 56 . 1 1 4 TRP HD1 H 8.687 -5.767 3.676 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 1 . 57 . 1 1 4 TRP HE1 H 10.087 -6.816 1.778 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 1 . 58 . 1 1 4 TRP HE3 H 5.797 -4.331 -0.287 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 1 . 59 . 1 1 4 TRP HH2 H 8.548 -6.297 -2.918 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 1 . 60 . 1 1 4 TRP HZ2 H 9.949 -6.992 -1.024 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 1 . 61 . 1 1 4 TRP HZ3 H 6.499 -4.981 -2.557 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 1 . 62 . 1 1 4 TRP N N 6.304 -1.943 3.215 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 1 . 63 . 1 1 4 TRP NE1 N 9.233 -6.297 1.632 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 1 . 64 . 1 1 4 TRP O O 4.320 -2.645 0.565 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 1 . 65 . 1 1 5 ALA C C 1.405 -2.549 3.523 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 1 . 66 . 1 1 5 ALA CA C 2.225 -3.042 2.335 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 1 . 67 . 1 1 5 ALA CB C 1.736 -4.411 1.885 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 1 . 68 . 1 1 5 ALA H H 3.922 -3.294 3.614 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 1 . 69 . 1 1 5 ALA HA H 2.090 -2.342 1.510 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 1 . 70 . 1 1 5 ALA HB1 H 0.674 -4.357 1.643 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 1 . 71 . 1 1 5 ALA HB2 H 2.294 -4.725 1.003 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 1 . 72 . 1 1 5 ALA HB3 H 1.889 -5.133 2.687 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 1 . 73 . 1 1 5 ALA N N 3.643 -3.096 2.663 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 1 . 74 . 1 1 5 ALA O O 1.166 -3.291 4.476 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 1 . 75 . 1 1 6 VAL C C -1.211 -1.317 4.583 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 1 . 76 . 1 1 6 VAL CA C 0.181 -0.700 4.529 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 1 . 77 . 1 1 6 VAL CB C 0.053 0.822 4.352 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 1 . 78 . 1 1 6 VAL CG1 C -0.778 1.422 5.479 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 1 . 79 . 1 1 6 VAL CG2 C 1.426 1.473 4.291 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 1 . 80 . 1 1 6 VAL H H 1.206 -0.735 2.649 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 1 . 81 . 1 1 6 VAL HA H 0.681 -0.895 5.478 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 1 . 82 . 1 1 6 VAL HB H -0.460 1.015 3.410 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 1 . 83 . 1 1 6 VAL HG11 H -1.757 0.942 5.505 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 1 . 84 . 1 1 6 VAL HG12 H -0.270 1.262 6.430 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 1 . 85 . 1 1 6 VAL HG13 H -0.903 2.492 5.309 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 1 . 86 . 1 1 6 VAL HG21 H 2.003 1.029 3.479 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 1 . 87 . 1 1 6 VAL HG22 H 1.946 1.313 5.235 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 1 . 88 . 1 1 6 VAL HG23 H 1.314 2.543 4.114 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 1 . 89 . 1 1 6 VAL N N 0.976 -1.293 3.459 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 1 . 90 . 1 1 6 VAL O O -1.552 -2.025 5.531 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 1 . 91 . 1 1 7 GLY C C -4.172 -1.008 2.361 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 1 . 92 . 1 1 7 GLY CA C -3.364 -1.575 3.513 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 1 . 93 . 1 1 7 GLY H H -1.685 -0.453 2.811 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 1 . 94 . 1 1 7 GLY HA2 H -3.312 -2.659 3.409 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 1 . 95 . 1 1 7 GLY HA3 H -3.870 -1.333 4.447 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 1 . 96 . 1 1 7 GLY N N -2.016 -1.042 3.562 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 1 . 97 . 1 1 7 GLY O O -4.591 -1.744 1.466 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 1 . 98 . 1 1 8 HIS C C -4.338 2.083 0.691 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 1 . 99 . 1 1 8 HIS CA C -5.155 0.967 1.334 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 1 . 100 . 1 1 8 HIS CB C -6.457 1.532 1.900 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 1 . 101 . 1 1 8 HIS CD2 C -7.509 1.519 -0.475 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 1 . 102 . 1 1 8 HIS CE1 C -9.433 2.426 0.046 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 1 . 103 . 1 1 8 HIS CG C -7.517 1.779 0.863 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 1 . 104 . 1 1 8 HIS H H -4.022 0.851 3.146 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 1 . 105 . 1 1 8 HIS HA H -5.401 0.232 0.567 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 1 . 106 . 1 1 8 HIS HB2 H -6.849 0.825 2.630 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 1 . 107 . 1 1 8 HIS HB3 H -6.238 2.472 2.406 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 1 . 108 . 1 1 8 HIS HD2 H -6.702 1.073 -1.036 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 1 . 109 . 1 1 8 HIS HE1 H -10.432 2.829 -0.035 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 1 . 110 . 1 1 8 HIS HE2 H -9.031 1.876 -1.939 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 1 . 111 . 1 1 8 HIS N N -4.392 0.302 2.383 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 1 . 112 . 1 1 8 HIS ND1 N -8.740 2.351 1.174 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 1 . 113 . 1 1 8 HIS NE2 N -8.729 1.934 -0.977 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 1 . 114 . 1 1 8 HIS O O -4.872 3.137 0.346 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 1 . 115 . 1 1 9 LEU C C -1.669 2.366 -1.438 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 1 . 116 . 1 1 9 LEU CA C -2.149 2.830 -0.067 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 1 . 117 . 1 1 9 LEU CB C -0.948 3.084 0.847 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 1 . 118 . 1 1 9 LEU CD1 C 0.487 4.872 1.859 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 1 . 119 . 1 1 9 LEU CD2 C 0.889 4.135 -0.497 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 1 . 120 . 1 1 9 LEU CG C -0.162 4.368 0.579 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 1 . 121 . 1 1 9 LEU H H -2.662 0.958 0.837 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 1 . 122 . 1 1 9 LEU HA H -2.697 3.764 -0.188 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 1 . 123 . 1 1 9 LEU HB2 H -1.313 3.125 1.873 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 1 . 124 . 1 1 9 LEU HB3 H -0.266 2.239 0.759 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 1 . 125 . 1 1 9 LEU HD11 H -0.279 5.033 2.617 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 1 . 126 . 1 1 9 LEU HD12 H 1.003 5.812 1.659 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 1 . 127 . 1 1 9 LEU HD13 H 1.204 4.134 2.218 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 1 . 128 . 1 1 9 LEU HD21 H 0.406 3.775 -1.405 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 1 . 129 . 1 1 9 LEU HD22 H 1.406 5.072 -0.707 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 1 . 130 . 1 1 9 LEU HD23 H 1.608 3.394 -0.148 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 1 . 131 . 1 1 9 LEU HG H -0.856 5.129 0.223 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 1 . 132 . 1 1 9 LEU N N -3.040 1.844 0.534 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 1 . 133 . 1 1 9 LEU O O -1.298 1.207 -1.617 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 1 . 134 . 1 1 10 MET C C -0.001 3.773 -4.131 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 1 . 135 . 1 1 10 MET CA C -1.240 2.965 -3.759 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 1 . 136 . 1 1 10 MET CB C -2.365 3.242 -4.757 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 1 . 137 . 1 1 10 MET CE C -5.031 2.165 -6.250 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 1 . 138 . 1 1 10 MET CG C -2.278 2.398 -6.019 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 1 . 139 . 1 1 10 MET H H -1.995 4.216 -2.194 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 1 . 140 . 1 1 10 MET HA H -0.990 1.905 -3.804 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 1 . 141 . 1 1 10 MET HB2 H -3.318 3.037 -4.270 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 1 . 142 . 1 1 10 MET HB3 H -2.334 4.296 -5.037 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 1 . 143 . 1 1 10 MET HE1 H -5.937 2.313 -6.838 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 1 . 144 . 1 1 10 MET HE2 H -5.107 2.725 -5.318 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 1 . 145 . 1 1 10 MET HE3 H -4.910 1.104 -6.028 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 1 . 146 . 1 1 10 MET HG2 H -1.324 2.592 -6.509 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 1 . 147 . 1 1 10 MET HG3 H -2.325 1.346 -5.738 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 1 . 148 . 1 1 10 MET N N -1.678 3.281 -2.404 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 1 . 149 . 1 1 10 MET O O 0.121 4.256 -5.258 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 1 . 150 . 1 1 10 MET SD S -3.613 2.745 -7.179 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 2 . 151 . 1 1 1 GLY C C 11.319 0.326 2.693 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 2 . 152 . 1 1 1 GLY CA C 11.395 0.793 1.253 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 2 . 153 . 1 1 1 GLY H1 H 12.652 0.765 -0.335 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 2 . 154 . 1 1 1 GLY H2 H 13.415 0.855 1.124 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 2 . 155 . 1 1 1 GLY H3 H 12.754 -0.571 0.626 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 2 . 156 . 1 1 1 GLY HA2 H 11.283 1.877 1.226 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 2 . 157 . 1 1 1 GLY HA3 H 10.578 0.338 0.694 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 2 . 158 . 1 1 1 GLY N N 12.649 0.433 0.618 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 2 . 159 . 1 1 1 GLY O O 11.965 -0.652 3.070 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 2 . 160 . 1 1 2 ASN C C 9.061 -0.060 5.144 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 2 . 161 . 1 1 2 ASN CA C 10.374 0.679 4.908 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 2 . 162 . 1 1 2 ASN CB C 10.426 1.940 5.774 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 2 . 163 . 1 1 2 ASN CG C 10.948 1.661 7.171 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 2 . 164 . 1 1 2 ASN H H 10.027 1.820 3.131 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 2 . 165 . 1 1 2 ASN HA H 11.197 0.025 5.198 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 2 . 166 . 1 1 2 ASN HB2 H 11.073 2.674 5.293 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 2 . 167 . 1 1 2 ASN HB3 H 9.420 2.352 5.852 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 2 . 168 . 1 1 2 ASN HD21 H 9.094 1.928 7.954 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 2 . 169 . 1 1 2 ASN HD22 H 10.350 1.535 9.107 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 2 . 170 . 1 1 2 ASN N N 10.530 1.027 3.501 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 2 . 171 . 1 1 2 ASN ND2 N 10.060 1.712 8.156 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 2 . 172 . 1 1 2 ASN O O 8.960 -0.897 6.042 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 2 . 173 . 1 1 2 ASN OD1 O 12.137 1.403 7.360 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 2 . 174 . 1 1 3 HIS C C 6.234 -0.823 3.084 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 2 . 175 . 1 1 3 HIS CA C 6.750 -0.382 4.451 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 2 . 176 . 1 1 3 HIS CB C 5.751 0.573 5.100 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 2 . 177 . 1 1 3 HIS CD2 C 6.192 -0.157 7.553 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 2 . 178 . 1 1 3 HIS CE1 C 6.174 1.833 8.467 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 2 . 179 . 1 1 3 HIS CG C 5.966 0.766 6.577 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 2 . 180 . 1 1 3 HIS H H 8.203 0.950 3.614 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 2 . 181 . 1 1 3 HIS HA H 6.849 -1.263 5.085 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 2 . 182 . 1 1 3 HIS HB2 H 5.837 1.544 4.611 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 2 . 183 . 1 1 3 HIS HB3 H 4.744 0.188 4.941 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 2 . 184 . 1 1 3 HIS HD2 H 6.257 -1.227 7.422 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 2 . 185 . 1 1 3 HIS HE1 H 6.224 2.626 9.199 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 2 . 186 . 1 1 3 HIS HE2 H 6.496 0.133 9.655 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 2 . 187 . 1 1 3 HIS N N 8.058 0.254 4.332 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 2 . 188 . 1 1 3 HIS ND1 N 5.959 2.017 7.173 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 2 . 189 . 1 1 3 HIS NE2 N 6.322 0.535 8.745 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 2 . 190 . 1 1 3 HIS O O 6.006 0.002 2.199 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 2 . 191 . 1 1 4 TRP C C 4.141 -2.212 1.376 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 2 . 192 . 1 1 4 TRP CA C 5.565 -2.680 1.660 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 2 . 193 . 1 1 4 TRP CB C 5.615 -4.208 1.695 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 2 . 194 . 1 1 4 TRP CD1 C 7.450 -5.722 0.741 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 2 . 195 . 1 1 4 TRP CD2 C 6.361 -4.511 -0.798 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 2 . 196 . 1 1 4 TRP CE2 C 7.335 -5.293 -1.449 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 2 . 197 . 1 1 4 TRP CE3 C 5.551 -3.668 -1.565 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 2 . 198 . 1 1 4 TRP CG C 6.450 -4.800 0.601 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 2 . 199 . 1 1 4 TRP CH2 C 6.714 -4.422 -3.555 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 2 . 200 . 1 1 4 TRP CZ2 C 7.521 -5.256 -2.829 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 2 . 201 . 1 1 4 TRP CZ3 C 5.737 -3.632 -2.934 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 2 . 202 . 1 1 4 TRP H H 6.257 -2.755 3.685 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 2 . 203 . 1 1 4 TRP HA H 6.212 -2.330 0.856 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 2 . 204 . 1 1 4 TRP HB2 H 6.019 -4.525 2.657 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 2 . 205 . 1 1 4 TRP HB3 H 4.598 -4.589 1.599 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 2 . 206 . 1 1 4 TRP HD1 H 7.771 -6.150 1.679 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 2 . 207 . 1 1 4 TRP HE1 H 8.737 -6.676 -0.657 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 2 . 208 . 1 1 4 TRP HE3 H 4.794 -3.057 -1.096 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 2 . 209 . 1 1 4 TRP HH2 H 6.832 -4.372 -4.627 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 2 . 210 . 1 1 4 TRP HZ2 H 8.275 -5.862 -3.309 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 2 . 211 . 1 1 4 TRP HZ3 H 5.118 -2.983 -3.536 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 2 . 212 . 1 1 4 TRP N N 6.053 -2.129 2.920 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 2 . 213 . 1 1 4 TRP NE1 N 7.986 -6.022 -0.488 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 2 . 214 . 1 1 4 TRP O O 3.899 -1.481 0.417 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 2 . 215 . 1 1 5 ALA C C 1.118 -2.116 3.410 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 2 . 216 . 1 1 5 ALA CA C 1.806 -2.259 2.056 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 2 . 217 . 1 1 5 ALA CB C 1.077 -3.282 1.198 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 2 . 218 . 1 1 5 ALA H H 3.468 -3.238 2.986 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 2 . 219 . 1 1 5 ALA HA H 1.768 -1.296 1.548 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 2 . 220 . 1 1 5 ALA HB1 H 0.034 -2.986 1.086 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 2 . 221 . 1 1 5 ALA HB2 H 1.548 -3.333 0.216 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 2 . 222 . 1 1 5 ALA HB3 H 1.128 -4.260 1.676 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 2 . 223 . 1 1 5 ALA N N 3.205 -2.638 2.217 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 2 . 224 . 1 1 5 ALA O O 0.733 -3.108 4.030 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 2 . 225 . 1 1 6 VAL C C -1.139 -1.032 5.127 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 2 . 226 . 1 1 6 VAL CA C 0.323 -0.603 5.145 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 2 . 227 . 1 1 6 VAL CB C 0.408 0.891 5.505 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 2 . 228 . 1 1 6 VAL CG1 C -0.264 1.154 6.846 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 2 . 229 . 1 1 6 VAL CG2 C 1.855 1.355 5.525 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 2 . 230 . 1 1 6 VAL H H 1.306 -0.104 3.310 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 2 . 231 . 1 1 6 VAL HA H 0.839 -1.173 5.917 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 2 . 232 . 1 1 6 VAL HB H -0.123 1.458 4.740 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 2 . 233 . 1 1 6 VAL HG11 H -1.298 0.814 6.808 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 2 . 234 . 1 1 6 VAL HG12 H 0.267 0.615 7.630 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 2 . 235 . 1 1 6 VAL HG13 H -0.240 2.223 7.060 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 2 . 236 . 1 1 6 VAL HG21 H 2.314 1.157 4.557 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 2 . 237 . 1 1 6 VAL HG22 H 2.399 0.817 6.302 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 2 . 238 . 1 1 6 VAL HG23 H 1.891 2.425 5.732 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 2 . 239 . 1 1 6 VAL N N 0.967 -0.877 3.865 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 2 . 240 . 1 1 6 VAL O O -1.700 -1.401 6.157 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 2 . 241 . 1 1 7 GLY C C -3.683 -1.132 2.420 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 2 . 242 . 1 1 7 GLY CA C -3.144 -1.365 3.817 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 2 . 243 . 1 1 7 GLY H H -1.243 -0.666 3.135 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 2 . 244 . 1 1 7 GLY HA2 H -3.237 -2.425 4.055 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 2 . 245 . 1 1 7 GLY HA3 H -3.740 -0.790 4.526 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 2 . 246 . 1 1 7 GLY N N -1.753 -0.979 3.949 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 2 . 247 . 1 1 7 GLY O O -3.483 -1.956 1.526 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 2 . 248 . 1 1 8 HIS C C -3.918 1.065 0.065 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 2 . 249 . 1 1 8 HIS CA C -4.936 0.327 0.929 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 2 . 250 . 1 1 8 HIS CB C -6.190 1.183 1.103 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 2 . 251 . 1 1 8 HIS CD2 C -6.981 0.563 -1.292 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 2 . 252 . 1 1 8 HIS CE1 C -8.623 2.002 -1.446 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 2 . 253 . 1 1 8 HIS CG C -7.043 1.276 -0.132 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 2 . 254 . 1 1 8 HIS H H -4.497 0.626 3.003 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 2 . 255 . 1 1 8 HIS HA H -5.215 -0.597 0.423 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 2 . 256 . 1 1 8 HIS HB2 H -6.790 0.765 1.912 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 2 . 257 . 1 1 8 HIS HB3 H -5.881 2.191 1.383 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 2 . 258 . 1 1 8 HIS HD2 H -6.278 -0.223 -1.526 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 2 . 259 . 1 1 8 HIS HE1 H -9.462 2.564 -1.832 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 2 . 260 . 1 1 8 HIS HE2 H -8.203 0.708 -3.044 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 2 . 261 . 1 1 8 HIS N N -4.367 -0.010 2.229 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 2 . 262 . 1 1 8 HIS ND1 N -8.086 2.180 -0.250 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 2 . 263 . 1 1 8 HIS NE2 N -7.988 1.035 -2.113 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 2 . 264 . 1 1 8 HIS O O -4.196 2.148 -0.451 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 2 . 265 . 1 1 9 LEU C C -1.235 2.405 -0.293 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 2 . 266 . 1 1 9 LEU CA C -1.679 1.074 -0.890 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 2 . 267 . 1 1 9 LEU CB C -2.155 1.279 -2.329 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 2 . 268 . 1 1 9 LEU CD1 C -0.512 -0.074 -3.652 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 2 . 269 . 1 1 9 LEU CD2 C -1.598 1.929 -4.686 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 2 . 270 . 1 1 9 LEU CG C -1.061 1.321 -3.397 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 2 . 271 . 1 1 9 LEU H H -2.573 -0.417 0.361 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 2 . 272 . 1 1 9 LEU HA H -0.826 0.396 -0.900 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 2 . 273 . 1 1 9 LEU HB2 H -2.831 0.461 -2.577 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 2 . 274 . 1 1 9 LEU HB3 H -2.715 2.213 -2.375 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 2 . 275 . 1 1 9 LEU HD11 H -0.133 -0.492 -2.720 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 2 . 276 . 1 1 9 LEU HD12 H -1.307 -0.712 -4.040 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 2 . 277 . 1 1 9 LEU HD13 H 0.297 -0.018 -4.381 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 2 . 278 . 1 1 9 LEU HD21 H -1.987 2.927 -4.483 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 2 . 279 . 1 1 9 LEU HD22 H -2.398 1.300 -5.078 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 2 . 280 . 1 1 9 LEU HD23 H -0.794 1.994 -5.419 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 2 . 281 . 1 1 9 LEU HG H -0.249 1.949 -3.033 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 2 . 282 . 1 1 9 LEU N N -2.739 0.472 -0.088 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 2 . 283 . 1 1 9 LEU O O -0.997 3.372 -1.017 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 2 . 284 . 1 1 10 MET C C -1.631 4.826 1.389 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 2 . 285 . 1 1 10 MET CA C -0.704 3.661 1.723 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 2 . 286 . 1 1 10 MET CB C 0.735 4.016 1.348 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 2 . 287 . 1 1 10 MET CE C 3.968 4.738 2.113 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 2 . 288 . 1 1 10 MET CG C 1.768 3.064 1.930 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 2 . 289 . 1 1 10 MET H H -1.335 1.621 1.569 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 2 . 290 . 1 1 10 MET HA H -0.748 3.479 2.797 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 2 . 291 . 1 1 10 MET HB2 H 0.826 4.011 0.262 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 2 . 292 . 1 1 10 MET HB3 H 0.948 5.021 1.713 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 2 . 293 . 1 1 10 MET HE1 H 4.971 5.006 1.781 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 2 . 294 . 1 1 10 MET HE2 H 3.985 4.517 3.180 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 2 . 295 . 1 1 10 MET HE3 H 3.289 5.570 1.925 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 2 . 296 . 1 1 10 MET HG2 H 1.830 3.231 3.005 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 2 . 297 . 1 1 10 MET HG3 H 1.444 2.038 1.749 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 2 . 298 . 1 1 10 MET N N -1.124 2.448 1.030 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 2 . 299 . 1 1 10 MET O O -1.420 5.951 1.845 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 2 . 300 . 1 1 10 MET SD S 3.407 3.295 1.214 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 3 . 301 . 1 1 1 GLY C C 10.004 2.754 1.604 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 3 . 302 . 1 1 1 GLY CA C 9.480 3.354 0.314 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 3 . 303 . 1 1 1 GLY H1 H 10.060 3.701 -1.596 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 3 . 304 . 1 1 1 GLY H2 H 11.287 3.778 -0.497 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 3 . 305 . 1 1 1 GLY H3 H 10.675 2.314 -0.948 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 3 . 306 . 1 1 1 GLY HA2 H 9.231 4.400 0.490 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 3 . 307 . 1 1 1 GLY HA3 H 8.578 2.820 0.015 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 3 . 308 . 1 1 1 GLY N N 10.449 3.281 -0.763 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 3 . 309 . 1 1 1 GLY O O 11.126 2.252 1.653 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 3 . 310 . 1 1 2 ASN C C 8.671 1.109 4.351 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 3 . 311 . 1 1 2 ASN CA C 9.577 2.269 3.951 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 3 . 312 . 1 1 2 ASN CB C 9.524 3.363 5.019 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 3 . 313 . 1 1 2 ASN CG C 10.514 4.480 4.750 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 3 . 314 . 1 1 2 ASN H H 8.280 3.235 2.549 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 3 . 315 . 1 1 2 ASN HA H 10.601 1.901 3.882 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 3 . 316 . 1 1 2 ASN HB2 H 8.519 3.784 5.039 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 3 . 317 . 1 1 2 ASN HB3 H 9.743 2.921 5.991 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 3 . 318 . 1 1 2 ASN HD21 H 12.065 3.273 5.259 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 3 . 319 . 1 1 2 ASN HD22 H 12.501 4.899 4.784 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 3 . 320 . 1 1 2 ASN N N 9.190 2.809 2.654 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 3 . 321 . 1 1 2 ASN ND2 N 11.795 4.195 4.947 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 3 . 322 . 1 1 2 ASN O O 9.096 0.183 5.041 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 3 . 323 . 1 1 2 ASN OD1 O 10.130 5.587 4.371 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 3 . 324 . 1 1 3 HIS C C 6.049 -0.641 2.962 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 3 . 325 . 1 1 3 HIS CA C 6.449 0.119 4.222 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 3 . 326 . 1 1 3 HIS CB C 5.212 0.724 4.885 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 3 . 327 . 1 1 3 HIS CD2 C 4.915 3.151 4.008 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 3 . 328 . 1 1 3 HIS CE1 C 3.184 2.795 2.717 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 3 . 329 . 1 1 3 HIS CG C 4.580 1.832 4.087 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 3 . 330 . 1 1 3 HIS H H 7.128 1.951 3.347 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 3 . 331 . 1 1 3 HIS HA H 6.908 -0.582 4.919 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 3 . 332 . 1 1 3 HIS HB2 H 4.473 -0.067 5.021 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 3 . 333 . 1 1 3 HIS HB3 H 5.493 1.112 5.864 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 3 . 334 . 1 1 3 HIS HD2 H 5.727 3.638 4.529 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 3 . 335 . 1 1 3 HIS HE1 H 2.371 2.955 2.024 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 3 . 336 . 1 1 3 HIS HE2 H 4.006 4.720 2.868 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 3 . 337 . 1 1 3 HIS N N 7.417 1.165 3.911 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 3 . 338 . 1 1 3 HIS ND1 N 3.484 1.626 3.265 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 3 . 339 . 1 1 3 HIS NE2 N 4.022 3.747 3.137 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 3 . 340 . 1 1 3 HIS O O 5.703 -0.040 1.945 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 3 . 341 . 1 1 4 TRP C C 4.271 -2.639 1.537 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 3 . 342 . 1 1 4 TRP CA C 5.741 -2.810 1.900 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 3 . 343 . 1 1 4 TRP CB C 6.034 -4.278 2.216 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 3 . 344 . 1 1 4 TRP CD1 C 8.177 -5.604 1.754 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 3 . 345 . 1 1 4 TRP CD2 C 7.193 -4.778 -0.080 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 3 . 346 . 1 1 4 TRP CE2 C 8.350 -5.481 -0.469 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 3 . 347 . 1 1 4 TRP CE3 C 6.410 -4.171 -1.065 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 3 . 348 . 1 1 4 TRP CG C 7.101 -4.870 1.346 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 3 . 349 . 1 1 4 TRP CH2 C 7.957 -4.987 -2.745 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 3 . 350 . 1 1 4 TRP CZ2 C 8.742 -5.591 -1.800 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 3 . 351 . 1 1 4 TRP CZ3 C 6.799 -4.282 -2.387 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 3 . 352 . 1 1 4 TRP H H 6.390 -2.402 3.900 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 3 . 353 . 1 1 4 TRP HA H 6.346 -2.512 1.044 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 3 . 354 . 1 1 4 TRP HB2 H 6.356 -4.350 3.255 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 3 . 355 . 1 1 4 TRP HB3 H 5.118 -4.854 2.091 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 3 . 356 . 1 1 4 TRP HD1 H 8.401 -5.857 2.779 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 3 . 357 . 1 1 4 TRP HE1 H 9.781 -6.523 0.703 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 3 . 358 . 1 1 4 TRP HE3 H 5.517 -3.625 -0.799 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 3 . 359 . 1 1 4 TRP HH2 H 8.235 -5.055 -3.786 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 3 . 360 . 1 1 4 TRP HZ2 H 9.633 -6.134 -2.078 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 3 . 361 . 1 1 4 TRP HZ3 H 6.201 -3.817 -3.158 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 3 . 362 . 1 1 4 TRP N N 6.098 -1.967 3.036 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 3 . 363 . 1 1 4 TRP NE1 N 8.933 -5.975 0.668 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 3 . 364 . 1 1 4 TRP O O 3.940 -2.210 0.431 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 3 . 365 . 1 1 5 ALA C C 1.222 -2.547 3.553 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 3 . 366 . 1 1 5 ALA CA C 1.955 -2.857 2.252 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 3 . 367 . 1 1 5 ALA CB C 1.410 -4.133 1.628 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 3 . 368 . 1 1 5 ALA H H 3.724 -3.322 3.361 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 3 . 369 . 1 1 5 ALA HA H 1.782 -2.035 1.557 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 3 . 370 . 1 1 5 ALA HB1 H 0.337 -4.030 1.468 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 3 . 371 . 1 1 5 ALA HB2 H 1.904 -4.309 0.673 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 3 . 372 . 1 1 5 ALA HB3 H 1.600 -4.973 2.296 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 3 . 373 . 1 1 5 ALA N N 3.390 -2.976 2.473 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 3 . 374 . 1 1 5 ALA O O 1.027 -3.428 4.392 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 3 . 375 . 1 1 6 VAL C C -1.357 -1.275 4.859 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 3 . 376 . 1 1 6 VAL CA C 0.107 -0.865 4.916 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 3 . 377 . 1 1 6 VAL CB C 0.199 0.660 5.109 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 3 . 378 . 1 1 6 VAL CG1 C -0.531 1.384 3.987 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 3 . 379 . 1 1 6 VAL CG2 C -0.365 1.058 6.465 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 3 . 380 . 1 1 6 VAL H H 1.012 -0.615 2.991 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 3 . 381 . 1 1 6 VAL HA H 0.566 -1.349 5.778 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 3 . 382 . 1 1 6 VAL HB H 1.250 0.947 5.077 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 3 . 383 . 1 1 6 VAL HG11 H -0.111 1.084 3.027 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 3 . 384 . 1 1 6 VAL HG12 H -1.590 1.126 4.017 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 3 . 385 . 1 1 6 VAL HG13 H -0.416 2.461 4.114 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 3 . 386 . 1 1 6 VAL HG21 H 0.172 0.528 7.252 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 3 . 387 . 1 1 6 VAL HG22 H -1.423 0.798 6.509 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 3 . 388 . 1 1 6 VAL HG23 H -0.249 2.132 6.606 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 3 . 389 . 1 1 6 VAL N N 0.820 -1.291 3.716 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 3 . 390 . 1 1 6 VAL O O -2.005 -1.454 5.890 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 3 . 391 . 1 1 7 GLY C C -4.119 -0.686 2.912 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 3 . 392 . 1 1 7 GLY CA C -3.269 -1.809 3.474 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 3 . 393 . 1 1 7 GLY H H -1.304 -1.259 2.830 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 3 . 394 . 1 1 7 GLY HA2 H -3.318 -2.663 2.798 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 3 . 395 . 1 1 7 GLY HA3 H -3.672 -2.100 4.444 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 3 . 396 . 1 1 7 GLY N N -1.880 -1.421 3.644 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 3 . 397 . 1 1 7 GLY O O -5.318 -0.611 3.184 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 3 . 398 . 1 1 8 HIS C C -3.906 1.409 0.032 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 3 . 399 . 1 1 8 HIS CA C -4.206 1.313 1.524 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 3 . 400 . 1 1 8 HIS CB C -3.818 2.618 2.222 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 3 . 401 . 1 1 8 HIS CD2 C -3.905 3.210 4.749 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 3 . 402 . 1 1 8 HIS CE1 C -6.016 2.742 5.093 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 3 . 403 . 1 1 8 HIS CG C -4.450 2.782 3.575 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 3 . 404 . 1 1 8 HIS H H -2.512 0.071 1.940 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 3 . 405 . 1 1 8 HIS HA H -5.277 1.156 1.653 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 3 . 406 . 1 1 8 HIS HB2 H -2.734 2.636 2.342 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 3 . 407 . 1 1 8 HIS HB3 H -4.115 3.455 1.591 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 3 . 408 . 1 1 8 HIS HD2 H -2.882 3.517 4.907 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 3 . 409 . 1 1 8 HIS HE1 H -6.971 2.611 5.581 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 3 . 410 . 1 1 8 HIS HE2 H -4.821 3.439 6.671 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 3 . 411 . 1 1 8 HIS N N -3.498 0.189 2.125 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 3 . 412 . 1 1 8 HIS ND1 N -5.784 2.490 3.813 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 3 . 413 . 1 1 8 HIS NE2 N -4.908 3.179 5.699 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 3 . 414 . 1 1 8 HIS O O -3.852 2.503 -0.531 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 3 . 415 . 1 1 9 LEU C C -4.398 -0.693 -2.762 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 3 . 416 . 1 1 9 LEU CA C -3.414 0.212 -2.030 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 3 . 417 . 1 1 9 LEU CB C -1.983 -0.280 -2.258 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 3 . 418 . 1 1 9 LEU CD1 C 0.446 -0.258 -1.640 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 3 . 419 . 1 1 9 LEU CD2 C -0.782 1.899 -1.951 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 3 . 420 . 1 1 9 LEU CG C -0.889 0.455 -1.483 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 3 . 421 . 1 1 9 LEU H H -3.767 -0.607 -0.083 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 3 . 422 . 1 1 9 LEU HA H -3.503 1.220 -2.435 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 3 . 423 . 1 1 9 LEU HB2 H -1.943 -1.332 -1.974 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 3 . 424 . 1 1 9 LEU HB3 H -1.759 -0.204 -3.322 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 3 . 425 . 1 1 9 LEU HD11 H 0.351 -1.289 -1.301 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 3 . 426 . 1 1 9 LEU HD12 H 0.742 -0.247 -2.689 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 3 . 427 . 1 1 9 LEU HD13 H 1.203 0.252 -1.044 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 3 . 428 . 1 1 9 LEU HD21 H -1.746 2.392 -1.832 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 3 . 429 . 1 1 9 LEU HD22 H -0.031 2.419 -1.356 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 3 . 430 . 1 1 9 LEU HD23 H -0.491 1.919 -3.002 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 3 . 431 . 1 1 9 LEU HG H -1.157 0.455 -0.427 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 3 . 432 . 1 1 9 LEU N N -3.710 0.258 -0.602 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 3 . 433 . 1 1 9 LEU O O -4.057 -1.810 -3.152 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 3 . 434 . 1 1 10 MET C C -6.872 -0.438 -5.047 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 3 . 435 . 1 1 10 MET CA C -6.654 -0.969 -3.635 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 3 . 436 . 1 1 10 MET CB C -7.965 -0.916 -2.848 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 3 . 437 . 1 1 10 MET CE C -9.953 -3.230 -1.140 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 3 . 438 . 1 1 10 MET CG C -7.846 -1.454 -1.431 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 3 . 439 . 1 1 10 MET H H -5.838 0.719 -2.599 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 3 . 440 . 1 1 10 MET HA H -6.330 -2.008 -3.700 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 3 . 441 . 1 1 10 MET HB2 H -8.295 0.122 -2.797 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 3 . 442 . 1 1 10 MET HB3 H -8.718 -1.497 -3.382 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 3 . 443 . 1 1 10 MET HE1 H -10.928 -3.465 -0.711 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 3 . 444 . 1 1 10 MET HE2 H -10.020 -3.253 -2.227 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 3 . 445 . 1 1 10 MET HE3 H -9.222 -3.966 -0.805 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 3 . 446 . 1 1 10 MET HG2 H -7.376 -2.437 -1.464 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 3 . 447 . 1 1 10 MET HG3 H -7.215 -0.779 -0.853 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 3 . 448 . 1 1 10 MET N N -5.620 -0.204 -2.945 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 3 . 449 . 1 1 10 MET O O -6.950 -1.207 -6.006 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 3 . 450 . 1 1 10 MET SD S -9.443 -1.598 -0.607 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 4 . 451 . 1 1 1 GLY C C 10.488 -0.885 8.464 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 4 . 452 . 1 1 1 GLY CA C 10.469 -1.064 9.969 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 4 . 453 . 1 1 1 GLY H1 H 9.336 -0.446 11.530 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 4 . 454 . 1 1 1 GLY H2 H 8.550 -1.452 10.487 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 4 . 455 . 1 1 1 GLY H3 H 8.827 0.118 10.066 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 4 . 456 . 1 1 1 GLY HA2 H 11.260 -0.457 10.408 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 4 . 457 . 1 1 1 GLY HA3 H 10.659 -2.113 10.199 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 4 . 458 . 1 1 1 GLY N N 9.199 -0.682 10.558 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 4 . 459 . 1 1 1 GLY O O 11.373 -0.225 7.923 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 4 . 460 . 1 1 2 ASN C C 8.059 -0.844 5.909 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 4 . 461 . 1 1 2 ASN CA C 9.421 -1.385 6.335 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 4 . 462 . 1 1 2 ASN CB C 9.660 -2.754 5.697 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 4 . 463 . 1 1 2 ASN CG C 9.084 -3.886 6.527 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 4 . 464 . 1 1 2 ASN H H 8.814 -2.008 8.291 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 4 . 465 . 1 1 2 ASN HA H 10.192 -0.699 5.983 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 4 . 466 . 1 1 2 ASN HB2 H 9.192 -2.769 4.713 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 4 . 467 . 1 1 2 ASN HB3 H 10.732 -2.910 5.582 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 4 . 468 . 1 1 2 ASN HD21 H 10.887 -4.819 6.567 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 4 . 469 . 1 1 2 ASN HD22 H 9.595 -5.639 7.415 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 4 . 470 . 1 1 2 ASN N N 9.511 -1.479 7.788 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 4 . 471 . 1 1 2 ASN ND2 N 9.922 -4.859 6.863 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 4 . 472 . 1 1 2 ASN O O 7.104 -0.851 6.687 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 4 . 473 . 1 1 2 ASN OD1 O 7.899 -3.886 6.860 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 4 . 474 . 1 1 3 HIS C C 6.316 -0.564 2.865 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 4 . 475 . 1 1 3 HIS CA C 6.731 0.169 4.137 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 4 . 476 . 1 1 3 HIS CB C 6.883 1.663 3.849 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 4 . 477 . 1 1 3 HIS CD2 C 8.273 2.178 1.716 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 4 . 478 . 1 1 3 HIS CE1 C 10.212 2.469 2.685 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 4 . 479 . 1 1 3 HIS CG C 8.117 2.001 3.058 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 4 . 480 . 1 1 3 HIS H H 8.796 -0.396 4.077 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 4 . 481 . 1 1 3 HIS HA H 5.948 0.037 4.884 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 4 . 482 . 1 1 3 HIS HB2 H 6.011 1.995 3.285 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 4 . 483 . 1 1 3 HIS HB3 H 6.914 2.201 4.796 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 4 . 484 . 1 1 3 HIS HD2 H 7.501 2.101 0.964 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 4 . 485 . 1 1 3 HIS HE1 H 11.263 2.668 2.836 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 4 . 486 . 1 1 3 HIS HE2 H 10.039 2.658 0.605 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 4 . 487 . 1 1 3 HIS N N 7.976 -0.375 4.667 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 4 . 488 . 1 1 3 HIS ND1 N 9.353 2.188 3.653 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 4 . 489 . 1 1 3 HIS NE2 N 9.605 2.473 1.498 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 4 . 490 . 1 1 3 HIS O O 6.304 0.016 1.779 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 4 . 491 . 1 1 4 TRP C C 4.129 -2.335 1.467 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 4 . 492 . 1 1 4 TRP CA C 5.566 -2.653 1.870 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 4 . 493 . 1 1 4 TRP CB C 5.696 -4.141 2.203 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 4 . 494 . 1 1 4 TRP CD1 C 7.813 -5.573 2.004 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 4 . 495 . 1 1 4 TRP CD2 C 7.036 -4.802 0.050 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 4 . 496 . 1 1 4 TRP CE2 C 8.193 -5.568 -0.197 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 4 . 497 . 1 1 4 TRP CE3 C 6.373 -4.215 -1.031 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 4 . 498 . 1 1 4 TRP CG C 6.811 -4.818 1.463 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 4 . 499 . 1 1 4 TRP CH2 C 8.029 -5.174 -2.521 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 4 . 500 . 1 1 4 TRP CZ2 C 8.697 -5.759 -1.480 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 4 . 501 . 1 1 4 TRP CZ3 C 6.876 -4.407 -2.304 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 4 . 502 . 1 1 4 TRP H H 6.010 -2.259 3.926 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 4 . 503 . 1 1 4 TRP HA H 6.220 -2.428 1.027 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 4 . 504 . 1 1 4 TRP HB2 H 5.880 -4.241 3.273 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 4 . 505 . 1 1 4 TRP HB3 H 4.758 -4.639 1.959 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 4 . 506 . 1 1 4 TRP HD1 H 7.932 -5.783 3.057 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 4 . 507 . 1 1 4 TRP HE1 H 9.465 -6.603 1.149 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 4 . 508 . 1 1 4 TRP HE3 H 5.484 -3.623 -0.875 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 4 . 509 . 1 1 4 TRP HH2 H 8.397 -5.305 -3.528 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 4 . 510 . 1 1 4 TRP HZ2 H 9.586 -6.350 -1.649 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 4 . 511 . 1 1 4 TRP HZ3 H 6.371 -3.958 -3.147 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 4 . 512 . 1 1 4 TRP N N 5.979 -1.841 3.008 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 4 . 513 . 1 1 4 TRP NE1 N 8.648 -6.026 1.011 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 4 . 514 . 1 1 4 TRP O O 3.884 -1.771 0.400 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 4 . 515 . 1 1 5 ALA C C 1.021 -2.128 3.348 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 4 . 516 . 1 1 5 ALA CA C 1.773 -2.452 2.061 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 4 . 517 . 1 1 5 ALA CB C 1.145 -3.654 1.369 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 4 . 518 . 1 1 5 ALA H H 3.450 -3.164 3.184 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 4 . 519 . 1 1 5 ALA HA H 1.696 -1.593 1.394 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 4 . 520 . 1 1 5 ALA HB1 H 0.091 -3.454 1.177 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 4 . 521 . 1 1 5 ALA HB2 H 1.238 -4.530 2.010 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 4 . 522 . 1 1 5 ALA HB3 H 1.658 -3.838 0.425 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 4 . 523 . 1 1 5 ALA N N 3.184 -2.701 2.326 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 4 . 524 . 1 1 5 ALA O O 0.551 -3.025 4.047 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 4 . 525 . 1 1 6 VAL C C -1.188 -0.985 4.929 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 4 . 526 . 1 1 6 VAL CA C 0.215 -0.395 4.859 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 4 . 527 . 1 1 6 VAL CB C 0.121 1.139 4.918 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 4 . 528 . 1 1 6 VAL CG1 C -0.560 1.682 3.671 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 4 . 529 . 1 1 6 VAL CG2 C -0.620 1.578 6.173 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 4 . 530 . 1 1 6 VAL H H 1.321 -0.150 3.041 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 4 . 531 . 1 1 6 VAL HA H 0.776 -0.739 5.727 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 4 . 532 . 1 1 6 VAL HB H 1.133 1.542 4.959 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 4 . 533 . 1 1 6 VAL HG11 H -0.013 1.355 2.786 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 4 . 534 . 1 1 6 VAL HG12 H -1.583 1.309 3.624 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 4 . 535 . 1 1 6 VAL HG13 H -0.572 2.771 3.709 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 4 . 536 . 1 1 6 VAL HG21 H -0.116 1.178 7.052 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 4 . 537 . 1 1 6 VAL HG22 H -0.632 2.667 6.225 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 4 . 538 . 1 1 6 VAL HG23 H -1.644 1.205 6.140 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 4 . 539 . 1 1 6 VAL N N 0.912 -0.839 3.656 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 4 . 540 . 1 1 6 VAL O O -1.712 -1.240 6.013 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 4 . 541 . 1 1 7 GLY C C -3.960 -1.183 2.584 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 4 . 542 . 1 1 7 GLY CA C -3.133 -1.758 3.717 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 4 . 543 . 1 1 7 GLY H H -1.318 -0.972 2.904 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 4 . 544 . 1 1 7 GLY HA2 H -3.057 -2.837 3.581 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 4 . 545 . 1 1 7 GLY HA3 H -3.635 -1.554 4.662 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 4 . 546 . 1 1 7 GLY N N -1.794 -1.200 3.764 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 4 . 547 . 1 1 7 GLY O O -4.653 -1.915 1.877 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 4 . 548 . 1 1 8 HIS C C -3.912 0.705 0.022 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 4 . 549 . 1 1 8 HIS CA C -4.641 0.809 1.359 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 4 . 550 . 1 1 8 HIS CB C -4.860 2.278 1.718 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 4 . 551 . 1 1 8 HIS CD2 C -6.005 3.555 -0.230 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 4 . 552 . 1 1 8 HIS CE1 C -8.042 3.567 0.574 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 4 . 553 . 1 1 8 HIS CG C -6.000 2.917 0.973 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 4 . 554 . 1 1 8 HIS H H -3.305 0.681 3.027 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 4 . 555 . 1 1 8 HIS HA H -5.613 0.326 1.262 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 4 . 556 . 1 1 8 HIS HB2 H -5.067 2.344 2.786 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 4 . 557 . 1 1 8 HIS HB3 H -3.946 2.831 1.503 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 4 . 558 . 1 1 8 HIS HD2 H -5.154 3.715 -0.876 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 4 . 559 . 1 1 8 HIS HE1 H -9.103 3.740 0.677 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 4 . 560 . 1 1 8 HIS HE2 H -7.639 4.462 -1.281 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 4 . 561 . 1 1 8 HIS N N -3.891 0.134 2.413 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 4 . 562 . 1 1 8 HIS ND1 N -7.293 2.934 1.466 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 4 . 563 . 1 1 8 HIS NE2 N -7.307 3.961 -0.469 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 4 . 564 . 1 1 8 HIS O O -3.583 1.716 -0.597 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 4 . 565 . 1 1 9 LEU C C -3.798 -1.666 -2.591 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 4 . 566 . 1 1 9 LEU CA C -2.973 -0.761 -1.680 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 4 . 567 . 1 1 9 LEU CB C -1.602 -1.387 -1.425 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 4 . 568 . 1 1 9 LEU CD1 C 0.801 -1.370 -2.138 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 4 . 569 . 1 1 9 LEU CD2 C -0.888 -2.643 -3.474 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 4 . 570 . 1 1 9 LEU CG C -0.642 -1.411 -2.615 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 4 . 571 . 1 1 9 LEU H H -3.960 -1.314 0.138 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 4 . 572 . 1 1 9 LEU HA H -2.829 0.196 -2.182 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 4 . 573 . 1 1 9 LEU HB2 H -1.124 -0.825 -0.622 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 4 . 574 . 1 1 9 LEU HB3 H -1.751 -2.412 -1.084 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 4 . 575 . 1 1 9 LEU HD11 H 0.957 -0.482 -1.526 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 4 . 576 . 1 1 9 LEU HD12 H 1.013 -2.261 -1.547 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 4 . 577 . 1 1 9 LEU HD13 H 1.467 -1.338 -3.000 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 4 . 578 . 1 1 9 LEU HD21 H -1.926 -2.654 -3.806 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 4 . 579 . 1 1 9 LEU HD22 H -0.229 -2.617 -4.343 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 4 . 580 . 1 1 9 LEU HD23 H -0.683 -3.540 -2.890 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 4 . 581 . 1 1 9 LEU HG H -0.828 -0.525 -3.223 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 4 . 582 . 1 1 9 LEU N N -3.664 -0.524 -0.417 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 4 . 583 . 1 1 9 LEU O O -4.285 -2.712 -2.163 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 4 . 584 . 1 1 10 MET C C -3.936 -2.176 -6.124 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 4 . 585 . 1 1 10 MET CA C -4.708 -2.033 -4.817 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 4 . 586 . 1 1 10 MET CB C -6.062 -1.372 -5.081 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 4 . 587 . 1 1 10 MET CE C -9.443 -3.420 -4.352 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 4 . 588 . 1 1 10 MET CG C -7.151 -2.353 -5.484 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 4 . 589 . 1 1 10 MET H H -3.521 -0.388 -4.135 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 4 . 590 . 1 1 10 MET HA H -4.882 -3.027 -4.406 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 4 . 591 . 1 1 10 MET HB2 H -6.378 -0.861 -4.172 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 4 . 592 . 1 1 10 MET HB3 H -5.943 -0.635 -5.875 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 4 . 593 . 1 1 10 MET HE1 H -9.908 -4.037 -3.583 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 4 . 594 . 1 1 10 MET HE2 H -9.822 -2.400 -4.277 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 4 . 595 . 1 1 10 MET HE3 H -9.682 -3.824 -5.336 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 4 . 596 . 1 1 10 MET HG2 H -8.014 -1.795 -5.844 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 4 . 597 . 1 1 10 MET HG3 H -6.773 -2.980 -6.292 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 4 . 598 . 1 1 10 MET N N -3.946 -1.257 -3.846 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 4 . 599 . 1 1 10 MET O O -3.588 -1.184 -6.764 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 4 . 600 . 1 1 10 MET SD S -7.667 -3.415 -4.123 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 5 . 601 . 1 1 1 GLY C C 11.223 0.417 5.299 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 5 . 602 . 1 1 1 GLY CA C 12.107 1.592 5.668 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 5 . 603 . 1 1 1 GLY H1 H 11.998 3.139 6.971 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 5 . 604 . 1 1 1 GLY H2 H 10.998 3.287 5.668 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 5 . 605 . 1 1 1 GLY H3 H 10.620 2.237 6.883 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 5 . 606 . 1 1 1 GLY HA2 H 12.551 2.001 4.760 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 5 . 607 . 1 1 1 GLY HA3 H 12.903 1.239 6.324 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 5 . 608 . 1 1 1 GLY N N 11.375 2.644 6.349 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 5 . 609 . 1 1 1 GLY O O 11.189 -0.002 4.143 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 5 . 610 . 1 1 2 ASN C C 8.193 -0.786 5.806 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 5 . 611 . 1 1 2 ASN CA C 9.623 -1.254 6.056 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 5 . 612 . 1 1 2 ASN CB C 9.659 -2.202 7.256 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 5 . 613 . 1 1 2 ASN CG C 11.052 -2.347 7.837 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 5 . 614 . 1 1 2 ASN H H 10.581 0.273 7.213 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 5 . 615 . 1 1 2 ASN HA H 9.971 -1.794 5.176 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 5 . 616 . 1 1 2 ASN HB2 H 8.996 -1.814 8.029 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 5 . 617 . 1 1 2 ASN HB3 H 9.301 -3.183 6.943 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 5 . 618 . 1 1 2 ASN HD21 H 10.331 -2.087 9.717 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 5 . 619 . 1 1 2 ASN HD22 H 12.058 -2.338 9.601 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 5 . 620 . 1 1 2 ASN N N 10.509 -0.118 6.284 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 5 . 621 . 1 1 2 ASN ND2 N 11.155 -2.250 9.157 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 5 . 622 . 1 1 2 ASN O O 7.352 -0.817 6.705 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 5 . 623 . 1 1 2 ASN OD1 O 12.024 -2.545 7.107 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 5 . 624 . 1 1 3 HIS C C 6.144 -0.501 2.888 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 5 . 625 . 1 1 3 HIS CA C 6.594 0.119 4.208 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 5 . 626 . 1 1 3 HIS CB C 6.583 1.642 4.101 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 5 . 627 . 1 1 3 HIS CD2 C 7.009 2.081 6.625 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 5 . 628 . 1 1 3 HIS CE1 C 8.341 3.805 6.410 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 5 . 629 . 1 1 3 HIS CG C 7.168 2.342 5.297 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 5 . 630 . 1 1 3 HIS H H 8.658 -0.351 3.884 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 5 . 631 . 1 1 3 HIS HA H 5.891 -0.178 4.987 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 5 . 632 . 1 1 3 HIS HB2 H 7.159 1.928 3.220 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 5 . 633 . 1 1 3 HIS HB3 H 5.554 1.976 3.969 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 5 . 634 . 1 1 3 HIS HD2 H 6.411 1.292 7.057 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 5 . 635 . 1 1 3 HIS HE1 H 8.992 4.633 6.647 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 5 . 636 . 1 1 3 HIS HE2 H 7.850 3.090 8.318 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 5 . 637 . 1 1 3 HIS N N 7.924 -0.353 4.578 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 5 . 638 . 1 1 3 HIS ND1 N 8.011 3.434 5.181 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 5 . 639 . 1 1 3 HIS NE2 N 7.759 3.017 7.315 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 5 . 640 . 1 1 3 HIS O O 6.035 0.187 1.874 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 5 . 641 . 1 1 4 TRP C C 3.993 -2.197 1.392 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 5 . 642 . 1 1 4 TRP CA C 5.449 -2.516 1.715 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 5 . 643 . 1 1 4 TRP CB C 5.625 -4.024 1.901 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 5 . 644 . 1 1 4 TRP CD1 C 7.790 -5.350 1.556 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 5 . 645 . 1 1 4 TRP CD2 C 6.950 -4.455 -0.317 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 5 . 646 . 1 1 4 TRP CE2 C 8.130 -5.153 -0.641 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 5 . 647 . 1 1 4 TRP CE3 C 6.246 -3.810 -1.338 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 5 . 648 . 1 1 4 TRP CG C 6.750 -4.595 1.094 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 5 . 649 . 1 1 4 TRP CH2 C 7.911 -4.580 -2.923 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 5 . 650 . 1 1 4 TRP CZ2 C 8.620 -5.220 -1.944 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 5 . 651 . 1 1 4 TRP CZ3 C 6.734 -3.879 -2.629 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 5 . 652 . 1 1 4 TRP H H 5.995 -2.313 3.776 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 5 . 653 . 1 1 4 TRP HA H 6.068 -2.196 0.877 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 5 . 654 . 1 1 4 TRP HB2 H 5.821 -4.221 2.955 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 5 . 655 . 1 1 4 TRP HB3 H 4.699 -4.523 1.616 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 5 . 656 . 1 1 4 TRP HD1 H 7.936 -5.639 2.587 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 5 . 657 . 1 1 4 TRP HE1 H 9.465 -6.243 0.598 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 5 . 658 . 1 1 4 TRP HE3 H 5.338 -3.268 -1.122 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 5 . 659 . 1 1 4 TRP HH2 H 8.265 -4.616 -3.942 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 5 . 660 . 1 1 4 TRP HZ2 H 9.528 -5.758 -2.172 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 5 . 661 . 1 1 4 TRP HZ3 H 6.199 -3.384 -3.426 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 5 . 662 . 1 1 4 TRP N N 5.886 -1.804 2.910 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 5 . 663 . 1 1 4 TRP NE1 N 8.625 -5.689 0.519 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 5 . 664 . 1 1 4 TRP O O 3.698 -1.538 0.396 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 5 . 665 . 1 1 5 ALA C C 0.969 -2.142 3.376 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 5 . 666 . 1 1 5 ALA CA C 1.663 -2.430 2.050 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 5 . 667 . 1 1 5 ALA CB C 1.016 -3.624 1.363 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 5 . 668 . 1 1 5 ALA H H 3.393 -3.204 3.042 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 5 . 669 . 1 1 5 ALA HA H 1.545 -1.559 1.405 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 5 . 670 . 1 1 5 ALA HB1 H 1.538 -4.536 1.652 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 5 . 671 . 1 1 5 ALA HB2 H -0.029 -3.694 1.663 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 5 . 672 . 1 1 5 ALA HB3 H 1.076 -3.498 0.282 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 5 . 673 . 1 1 5 ALA N N 3.086 -2.668 2.242 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 5 . 674 . 1 1 5 ALA O O 0.535 -3.058 4.074 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 5 . 675 . 1 1 6 VAL C C -1.180 -1.034 5.074 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 5 . 676 . 1 1 6 VAL CA C 0.223 -0.451 4.963 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 5 . 677 . 1 1 6 VAL CB C 0.143 1.081 5.072 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 5 . 678 . 1 1 6 VAL CG1 C -0.574 1.668 3.866 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 5 . 679 . 1 1 6 VAL CG2 C -0.553 1.486 6.364 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 5 . 680 . 1 1 6 VAL H H 1.241 -0.155 3.102 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 5 . 681 . 1 1 6 VAL HA H 0.818 -0.824 5.797 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 5 . 682 . 1 1 6 VAL HB H 1.158 1.476 5.092 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 5 . 683 . 1 1 6 VAL HG11 H -0.059 1.365 2.954 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 5 . 684 . 1 1 6 VAL HG12 H -0.575 2.756 3.938 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 5 . 685 . 1 1 6 VAL HG13 H -1.601 1.304 3.841 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 5 . 686 . 1 1 6 VAL HG21 H -0.602 2.573 6.426 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 5 . 687 . 1 1 6 VAL HG22 H -1.563 1.076 6.376 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 5 . 688 . 1 1 6 VAL HG23 H 0.007 1.099 7.215 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 5 . 689 . 1 1 6 VAL N N 0.865 -0.861 3.719 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 5 . 690 . 1 1 6 VAL O O -1.655 -1.332 6.169 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 5 . 691 . 1 1 7 GLY C C -4.021 -1.204 2.775 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 5 . 692 . 1 1 7 GLY CA C -3.186 -1.740 3.921 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 5 . 693 . 1 1 7 GLY H H -1.404 -0.930 3.060 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 5 . 694 . 1 1 7 GLY HA2 H -3.121 -2.824 3.829 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 5 . 695 . 1 1 7 GLY HA3 H -3.676 -1.493 4.863 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 5 . 696 . 1 1 7 GLY N N -1.842 -1.193 3.931 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 5 . 697 . 1 1 7 GLY O O -5.031 -1.801 2.400 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 5 . 698 . 1 1 8 HIS C C -3.362 0.912 -0.021 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 5 . 699 . 1 1 8 HIS CA C -4.320 0.545 1.109 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 5 . 700 . 1 1 8 HIS CB C -5.063 1.794 1.587 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 5 . 701 . 1 1 8 HIS CD2 C -5.615 3.701 -0.089 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 5 . 702 . 1 1 8 HIS CE1 C -7.378 2.790 -1.010 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 5 . 703 . 1 1 8 HIS CG C -5.832 2.488 0.495 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 5 . 704 . 1 1 8 HIS H H -2.766 0.371 2.572 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 5 . 705 . 1 1 8 HIS HA H -5.050 -0.169 0.728 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 5 . 706 . 1 1 8 HIS HB2 H -5.764 1.501 2.369 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 5 . 707 . 1 1 8 HIS HB3 H -4.341 2.494 2.007 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 5 . 708 . 1 1 8 HIS HD2 H -4.821 4.395 0.147 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 5 . 709 . 1 1 8 HIS HE1 H -8.239 2.635 -1.644 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 5 . 710 . 1 1 8 HIS HE2 H -6.719 4.676 -1.645 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 5 . 711 . 1 1 8 HIS N N -3.602 -0.072 2.219 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 5 . 712 . 1 1 8 HIS ND1 N -6.949 1.927 -0.100 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 5 . 713 . 1 1 8 HIS NE2 N -6.604 3.875 -1.040 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 5 . 714 . 1 1 8 HIS O O -2.978 2.072 -0.170 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 5 . 715 . 1 1 9 LEU C C -2.789 -0.033 -3.264 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 5 . 716 . 1 1 9 LEU CA C -2.068 0.134 -1.929 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 5 . 717 . 1 1 9 LEU CB C -0.892 -0.840 -1.848 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 5 . 718 . 1 1 9 LEU CD1 C -0.047 -3.082 -2.585 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 5 . 719 . 1 1 9 LEU CD2 C -1.660 -2.920 -0.680 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 5 . 720 . 1 1 9 LEU CG C -1.233 -2.321 -2.013 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 5 . 721 . 1 1 9 LEU H H -3.335 -1.014 -0.640 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 5 . 722 . 1 1 9 LEU HA H -1.682 1.151 -1.868 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 5 . 723 . 1 1 9 LEU HB2 H -0.183 -0.572 -2.632 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 5 . 724 . 1 1 9 LEU HB3 H -0.402 -0.706 -0.883 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 5 . 725 . 1 1 9 LEU HD11 H 0.245 -2.640 -3.537 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 5 . 726 . 1 1 9 LEU HD12 H -0.325 -4.125 -2.739 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 5 . 727 . 1 1 9 LEU HD13 H 0.790 -3.028 -1.888 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 5 . 728 . 1 1 9 LEU HD21 H -2.747 -3.002 -0.650 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 5 . 729 . 1 1 9 LEU HD22 H -1.218 -3.909 -0.568 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 5 . 730 . 1 1 9 LEU HD23 H -1.322 -2.277 0.132 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 5 . 731 . 1 1 9 LEU HG H -2.065 -2.406 -2.711 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 5 . 732 . 1 1 9 LEU N N -2.982 -0.084 -0.814 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 5 . 733 . 1 1 9 LEU O O -2.389 0.547 -4.273 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 5 . 734 . 1 1 10 MET C C -5.881 -0.191 -4.494 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 5 . 735 . 1 1 10 MET CA C -4.633 -1.067 -4.469 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 5 . 736 . 1 1 10 MET CB C -5.030 -2.542 -4.562 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 5 . 737 . 1 1 10 MET CE C -4.058 -4.762 -7.174 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 5 . 738 . 1 1 10 MET CG C -5.674 -2.916 -5.887 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 5 . 739 . 1 1 10 MET H H -4.132 -1.277 -2.397 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 5 . 740 . 1 1 10 MET HA H -4.017 -0.819 -5.333 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 5 . 741 . 1 1 10 MET HB2 H -4.134 -3.149 -4.431 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 5 . 742 . 1 1 10 MET HB3 H -5.728 -2.769 -3.756 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 5 . 743 . 1 1 10 MET HE1 H -3.861 -5.794 -7.461 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 5 . 744 . 1 1 10 MET HE2 H -4.153 -4.147 -8.069 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 5 . 745 . 1 1 10 MET HE3 H -3.233 -4.391 -6.565 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 5 . 746 . 1 1 10 MET HG2 H -6.723 -2.622 -5.861 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 5 . 747 . 1 1 10 MET HG3 H -5.174 -2.372 -6.689 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 5 . 748 . 1 1 10 MET N N -3.855 -0.828 -3.259 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 5 . 749 . 1 1 10 MET O O -6.553 -0.078 -5.520 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 5 . 750 . 1 1 10 MET SD S -5.578 -4.682 -6.232 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 6 . 751 . 1 1 1 GLY C C 9.440 -2.012 5.632 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 6 . 752 . 1 1 1 GLY CA C 9.598 -3.517 5.717 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 6 . 753 . 1 1 1 GLY H1 H 8.656 -5.149 6.465 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 6 . 754 . 1 1 1 GLY H2 H 8.468 -3.788 7.378 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 6 . 755 . 1 1 1 GLY H3 H 7.634 -3.955 5.965 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 6 . 756 . 1 1 1 GLY HA2 H 10.532 -3.743 6.231 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 6 . 757 . 1 1 1 GLY HA3 H 9.641 -3.926 4.707 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 6 . 758 . 1 1 1 GLY N N 8.506 -4.151 6.436 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 6 . 759 . 1 1 1 GLY O O 8.996 -1.372 6.584 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 6 . 760 . 1 1 2 ASN C C 8.429 0.349 3.523 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 6 . 761 . 1 1 2 ASN CA C 9.704 -0.004 4.282 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 6 . 762 . 1 1 2 ASN CB C 10.925 0.509 3.516 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 6 . 763 . 1 1 2 ASN CG C 12.164 0.586 4.387 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 6 . 764 . 1 1 2 ASN H H 10.163 -2.025 3.741 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 6 . 765 . 1 1 2 ASN HA H 9.676 0.484 5.256 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 6 . 766 . 1 1 2 ASN HB2 H 11.125 -0.166 2.683 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 6 . 767 . 1 1 2 ASN HB3 H 10.706 1.501 3.123 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 6 . 768 . 1 1 2 ASN HD21 H 12.810 -1.208 3.684 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 6 . 769 . 1 1 2 ASN HD22 H 13.852 -0.440 4.861 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 6 . 770 . 1 1 2 ASN N N 9.806 -1.445 4.487 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 6 . 771 . 1 1 2 ASN ND2 N 13.010 -0.436 4.304 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 6 . 772 . 1 1 2 ASN O O 8.449 0.537 2.306 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 6 . 773 . 1 1 2 ASN OD1 O 12.358 1.551 5.125 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 6 . 774 . 1 1 3 HIS C C 5.677 -0.227 2.546 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 6 . 775 . 1 1 3 HIS CA C 6.034 0.769 3.646 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 6 . 776 . 1 1 3 HIS CB C 6.068 2.188 3.077 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 6 . 777 . 1 1 3 HIS CD2 C 7.230 4.018 4.505 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 6 . 778 . 1 1 3 HIS CE1 C 5.507 4.576 5.737 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 6 . 779 . 1 1 3 HIS CG C 6.165 3.255 4.132 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 6 . 780 . 1 1 3 HIS H H 7.369 0.270 5.245 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 6 . 781 . 1 1 3 HIS HA H 5.266 0.723 4.418 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 6 . 782 . 1 1 3 HIS HB2 H 6.932 2.274 2.418 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 6 . 783 . 1 1 3 HIS HB3 H 5.163 2.353 2.492 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 6 . 784 . 1 1 3 HIS HD2 H 8.225 3.980 4.085 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 6 . 785 . 1 1 3 HIS HE1 H 4.891 5.068 6.475 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 6 . 786 . 1 1 3 HIS HE2 H 7.354 5.536 6.012 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 6 . 787 . 1 1 3 HIS N N 7.320 0.437 4.250 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 6 . 788 . 1 1 3 HIS ND1 N 5.087 3.621 4.921 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 6 . 789 . 1 1 3 HIS NE2 N 6.798 4.850 5.522 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 6 . 790 . 1 1 3 HIS O O 5.125 0.149 1.512 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 6 . 791 . 1 1 4 TRP C C 4.212 -2.660 1.553 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 6 . 792 . 1 1 4 TRP CA C 5.710 -2.543 1.804 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 6 . 793 . 1 1 4 TRP CB C 6.265 -3.885 2.291 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 6 . 794 . 1 1 4 TRP CD1 C 8.570 -4.920 1.861 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 6 . 795 . 1 1 4 TRP CD2 C 7.393 -4.489 0.004 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 6 . 796 . 1 1 4 TRP CE2 C 8.630 -5.052 -0.368 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 6 . 797 . 1 1 4 TRP CE3 C 6.485 -4.137 -0.997 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 6 . 798 . 1 1 4 TRP CG C 7.375 -4.414 1.434 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 6 . 799 . 1 1 4 TRP CH2 C 8.071 -4.914 -2.658 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 6 . 800 . 1 1 4 TRP CZ2 C 8.980 -5.268 -1.697 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 6 . 801 . 1 1 4 TRP CZ3 C 6.833 -4.353 -2.317 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 6 . 802 . 1 1 4 TRP H H 6.450 -1.739 3.645 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 6 . 803 . 1 1 4 TRP HA H 6.200 -2.287 0.864 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 6 . 804 . 1 1 4 TRP HB2 H 6.643 -3.755 3.305 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 6 . 805 . 1 1 4 TRP HB3 H 5.455 -4.614 2.308 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 6 . 806 . 1 1 4 TRP HD1 H 8.872 -5.005 2.894 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 6 . 807 . 1 1 4 TRP HE1 H 10.255 -5.709 0.832 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 6 . 808 . 1 1 4 TRP HE3 H 5.528 -3.705 -0.745 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 6 . 809 . 1 1 4 TRP HH2 H 8.313 -5.070 -3.699 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 6 . 810 . 1 1 4 TRP HZ2 H 9.934 -5.699 -1.962 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 6 . 811 . 1 1 4 TRP HZ3 H 6.139 -4.084 -3.099 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 6 . 812 . 1 1 4 TRP N N 5.997 -1.495 2.776 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 6 . 813 . 1 1 4 TRP NE1 N 9.330 -5.305 0.783 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 6 . 814 . 1 1 4 TRP O O 3.741 -2.447 0.437 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 6 . 815 . 1 1 5 ALA C C 1.337 -2.816 3.819 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 6 . 816 . 1 1 5 ALA CA C 2.019 -3.141 2.494 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 6 . 817 . 1 1 5 ALA CB C 1.660 -4.550 2.046 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 6 . 818 . 1 1 5 ALA H H 3.913 -3.163 3.491 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 6 . 819 . 1 1 5 ALA HA H 1.659 -2.440 1.741 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 6 . 820 . 1 1 5 ALA HB1 H 0.577 -4.643 1.971 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 6 . 821 . 1 1 5 ALA HB2 H 2.110 -4.747 1.073 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 6 . 822 . 1 1 5 ALA HB3 H 2.037 -5.270 2.772 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 6 . 823 . 1 1 5 ALA N N 3.466 -2.999 2.600 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 6 . 824 . 1 1 5 ALA O O 1.384 -3.603 4.762 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 6 . 825 . 1 1 6 VAL C C -1.487 -1.467 4.981 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 6 . 826 . 1 1 6 VAL CA C 0.011 -1.217 5.090 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 6 . 827 . 1 1 6 VAL CB C 0.254 0.276 5.373 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 6 . 828 . 1 1 6 VAL CG1 C -0.405 1.137 4.305 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 6 . 829 . 1 1 6 VAL CG2 C -0.258 0.646 6.757 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 6 . 830 . 1 1 6 VAL H H 0.705 -1.044 3.072 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 6 . 831 . 1 1 6 VAL HA H 0.395 -1.793 5.931 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 6 . 832 . 1 1 6 VAL HB H 1.328 0.459 5.346 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 6 . 833 . 1 1 6 VAL HG11 H 0.030 2.136 4.323 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 6 . 834 . 1 1 6 VAL HG12 H -0.243 0.688 3.325 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 6 . 835 . 1 1 6 VAL HG13 H -1.475 1.203 4.501 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 6 . 836 . 1 1 6 VAL HG21 H 0.227 0.018 7.504 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 6 . 837 . 1 1 6 VAL HG22 H -0.032 1.693 6.961 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 6 . 838 . 1 1 6 VAL HG23 H -1.337 0.493 6.798 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 6 . 839 . 1 1 6 VAL N N 0.705 -1.648 3.882 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 6 . 840 . 1 1 6 VAL O O -2.166 -1.687 5.986 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 6 . 841 . 1 1 7 GLY C C -4.015 -0.678 2.544 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 6 . 842 . 1 1 7 GLY CA C -3.419 -1.656 3.539 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 6 . 843 . 1 1 7 GLY H H -1.400 -1.245 2.968 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 6 . 844 . 1 1 7 GLY HA2 H -3.564 -2.670 3.169 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 6 . 845 . 1 1 7 GLY HA3 H -3.940 -1.548 4.490 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 6 . 846 . 1 1 7 GLY N N -2.002 -1.431 3.757 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 6 . 847 . 1 1 7 GLY O O -5.077 -0.932 1.976 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 6 . 848 . 1 1 8 HIS C C -3.151 1.281 0.032 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 6 . 849 . 1 1 8 HIS CA C -3.800 1.460 1.402 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 6 . 850 . 1 1 8 HIS CB C -3.498 2.856 1.944 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 6 . 851 . 1 1 8 HIS CD2 C -5.726 3.195 3.236 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 6 . 852 . 1 1 8 HIS CE1 C -4.882 4.042 5.071 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 6 . 853 . 1 1 8 HIS CG C -4.372 3.262 3.101 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 6 . 854 . 1 1 8 HIS H H -2.466 0.590 2.834 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 6 . 855 . 1 1 8 HIS HA H -4.879 1.357 1.290 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 6 . 856 . 1 1 8 HIS HB2 H -2.460 2.879 2.274 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 6 . 857 . 1 1 8 HIS HB3 H -3.626 3.579 1.139 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 6 . 858 . 1 1 8 HIS HD2 H -6.427 2.824 2.503 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 6 . 859 . 1 1 8 HIS HE1 H -4.798 4.465 6.061 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 6 . 860 . 1 1 8 HIS HE2 H -6.956 3.777 4.892 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 6 . 861 . 1 1 8 HIS N N -3.331 0.441 2.335 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 6 . 862 . 1 1 8 HIS ND1 N -3.855 3.798 4.268 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 6 . 863 . 1 1 8 HIS NE2 N -6.033 3.693 4.490 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 6 . 864 . 1 1 8 HIS O O -2.652 2.240 -0.559 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 6 . 865 . 1 1 9 LEU C C -3.587 -0.949 -2.673 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 6 . 866 . 1 1 9 LEU CA C -2.574 -0.252 -1.767 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 6 . 867 . 1 1 9 LEU CB C -1.336 -1.134 -1.595 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 6 . 868 . 1 1 9 LEU CD1 C 0.312 0.509 -2.526 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 6 . 869 . 1 1 9 LEU CD2 C -0.084 0.402 -0.059 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 6 . 870 . 1 1 9 LEU CG C -0.018 -0.399 -1.352 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 6 . 871 . 1 1 9 LEU H H -3.586 -0.693 0.067 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 6 . 872 . 1 1 9 LEU HA H -2.272 0.683 -2.238 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 6 . 873 . 1 1 9 LEU HB2 H -1.512 -1.794 -0.745 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 6 . 874 . 1 1 9 LEU HB3 H -1.226 -1.748 -2.489 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 6 . 875 . 1 1 9 LEU HD11 H 0.355 -0.081 -3.442 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 6 . 876 . 1 1 9 LEU HD12 H -0.461 1.273 -2.623 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 6 . 877 . 1 1 9 LEU HD13 H 1.276 0.988 -2.356 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 6 . 878 . 1 1 9 LEU HD21 H 0.900 0.420 0.409 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 6 . 879 . 1 1 9 LEU HD22 H -0.401 1.421 -0.279 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 6 . 880 . 1 1 9 LEU HD23 H -0.800 -0.063 0.619 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 6 . 881 . 1 1 9 LEU HG H 0.777 -1.139 -1.257 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 6 . 882 . 1 1 9 LEU N N -3.161 0.051 -0.467 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 6 . 883 . 1 1 9 LEU O O -4.593 -1.478 -2.202 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 6 . 884 . 1 1 10 MET C C -3.574 -2.861 -5.487 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 6 . 885 . 1 1 10 MET CA C -4.195 -1.579 -4.943 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 6 . 886 . 1 1 10 MET CB C -4.498 -0.616 -6.092 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 6 . 887 . 1 1 10 MET CE C -8.126 -0.304 -7.477 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 6 . 888 . 1 1 10 MET CG C -5.517 -1.155 -7.083 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 6 . 889 . 1 1 10 MET H H -2.468 -0.490 -4.295 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 6 . 890 . 1 1 10 MET HA H -5.132 -1.831 -4.446 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 6 . 891 . 1 1 10 MET HB2 H -4.874 0.319 -5.677 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 6 . 892 . 1 1 10 MET HB3 H -3.570 -0.415 -6.627 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 6 . 893 . 1 1 10 MET HE1 H -8.821 0.413 -7.914 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 6 . 894 . 1 1 10 MET HE2 H -8.341 -1.300 -7.864 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 6 . 895 . 1 1 10 MET HE3 H -8.237 -0.304 -6.393 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 6 . 896 . 1 1 10 MET HG2 H -4.998 -1.747 -7.837 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 6 . 897 . 1 1 10 MET HG3 H -6.217 -1.798 -6.549 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 6 . 898 . 1 1 10 MET N N -3.311 -0.944 -3.972 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 6 . 899 . 1 1 10 MET O O -4.284 -3.782 -5.895 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 6 . 900 . 1 1 10 MET SD S -6.447 0.153 -7.905 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 7 . 901 . 1 1 1 GLY C C 11.173 -1.540 2.885 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 7 . 902 . 1 1 1 GLY CA C 11.868 -0.660 1.865 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 7 . 903 . 1 1 1 GLY H1 H 11.551 1.016 0.770 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 7 . 904 . 1 1 1 GLY H2 H 10.193 0.117 1.031 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 7 . 905 . 1 1 1 GLY H3 H 10.822 1.032 2.250 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 7 . 906 . 1 1 1 GLY HA2 H 12.118 -1.261 0.991 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 7 . 907 . 1 1 1 GLY HA3 H 12.787 -0.274 2.305 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 7 . 908 . 1 1 1 GLY N N 11.046 0.462 1.447 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 7 . 909 . 1 1 1 GLY O O 10.920 -2.716 2.630 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 7 . 910 . 1 1 2 ASN C C 8.680 -1.660 4.937 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 7 . 911 . 1 1 2 ASN CA C 10.196 -1.709 5.109 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 7 . 912 . 1 1 2 ASN CB C 10.585 -1.143 6.475 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 7 . 913 . 1 1 2 ASN CG C 12.087 -1.087 6.673 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 7 . 914 . 1 1 2 ASN H H 11.097 0.004 4.194 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 7 . 915 . 1 1 2 ASN HA H 10.518 -2.749 5.061 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 7 . 916 . 1 1 2 ASN HB2 H 10.177 -0.136 6.571 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 7 . 917 . 1 1 2 ASN HB3 H 10.153 -1.775 7.251 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 7 . 918 . 1 1 2 ASN HD21 H 11.873 0.254 8.183 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 7 . 919 . 1 1 2 ASN HD22 H 13.520 -0.202 7.808 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 7 . 920 . 1 1 2 ASN N N 10.864 -0.967 4.046 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 7 . 921 . 1 1 2 ASN ND2 N 12.529 -0.281 7.631 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 7 . 922 . 1 1 2 ASN O O 8.003 -2.686 5.007 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 7 . 923 . 1 1 2 ASN OD1 O 12.842 -1.760 5.971 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 7 . 924 . 1 1 3 HIS C C 6.280 -0.764 3.153 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 7 . 925 . 1 1 3 HIS CA C 6.720 -0.276 4.530 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 7 . 926 . 1 1 3 HIS CB C 6.346 1.195 4.706 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 7 . 927 . 1 1 3 HIS CD2 C 6.497 0.958 7.287 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 7 . 928 . 1 1 3 HIS CE1 C 6.411 3.087 7.788 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 7 . 929 . 1 1 3 HIS CG C 6.397 1.671 6.130 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 7 . 930 . 1 1 3 HIS H H 8.766 0.344 4.666 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 7 . 931 . 1 1 3 HIS HA H 6.197 -0.859 5.288 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 7 . 932 . 1 1 3 HIS HB2 H 7.039 1.797 4.118 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 7 . 933 . 1 1 3 HIS HB3 H 5.338 1.347 4.322 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 7 . 934 . 1 1 3 HIS HD2 H 6.559 -0.117 7.375 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 7 . 935 . 1 1 3 HIS HE1 H 6.393 4.007 8.353 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 7 . 936 . 1 1 3 HIS HE2 H 6.569 1.653 9.312 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 7 . 937 . 1 1 3 HIS N N 8.156 -0.460 4.712 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 7 . 938 . 1 1 3 HIS ND1 N 6.345 3.014 6.467 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 7 . 939 . 1 1 3 HIS NE2 N 6.505 1.869 8.327 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 7 . 940 . 1 1 3 HIS O O 6.161 0.023 2.213 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 7 . 941 . 1 1 4 TRP C C 4.184 -2.264 1.444 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 7 . 942 . 1 1 4 TRP CA C 5.619 -2.660 1.777 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 7 . 943 . 1 1 4 TRP CB C 5.738 -4.184 1.840 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 7 . 944 . 1 1 4 TRP CD1 C 7.896 -5.526 1.508 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 7 . 945 . 1 1 4 TRP CD2 C 7.163 -4.491 -0.338 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 7 . 946 . 1 1 4 TRP CE2 C 8.346 -5.188 -0.652 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 7 . 947 . 1 1 4 TRP CE3 C 6.521 -3.765 -1.345 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 7 . 948 . 1 1 4 TRP CG C 6.893 -4.721 1.050 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 7 . 949 . 1 1 4 TRP CH2 C 8.248 -4.458 -2.897 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 7 . 950 . 1 1 4 TRP CZ2 C 8.899 -5.178 -1.931 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 7 . 951 . 1 1 4 TRP CZ3 C 7.071 -3.756 -2.613 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 7 . 952 . 1 1 4 TRP H H 6.163 -2.660 3.847 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 7 . 953 . 1 1 4 TRP HA H 6.271 -2.294 0.984 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 7 . 954 . 1 1 4 TRP HB2 H 5.854 -4.485 2.881 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 7 . 955 . 1 1 4 TRP HB3 H 4.819 -4.619 1.448 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 7 . 956 . 1 1 4 TRP HD1 H 7.985 -5.886 2.522 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 7 . 957 . 1 1 4 TRP HE1 H 9.601 -6.384 0.572 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 7 . 958 . 1 1 4 TRP HE3 H 5.612 -3.221 -1.136 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 7 . 959 . 1 1 4 TRP HH2 H 8.651 -4.432 -3.898 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 7 . 960 . 1 1 4 TRP HZ2 H 9.807 -5.718 -2.153 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 7 . 961 . 1 1 4 TRP HZ3 H 6.583 -3.198 -3.398 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 7 . 962 . 1 1 4 TRP N N 6.044 -2.066 3.039 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 7 . 963 . 1 1 4 TRP NE1 N 8.775 -5.810 0.490 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 7 . 964 . 1 1 4 TRP O O 3.942 -1.502 0.510 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 7 . 965 . 1 1 5 ALA C C 1.162 -2.029 3.301 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 7 . 966 . 1 1 5 ALA CA C 1.826 -2.483 2.006 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 7 . 967 . 1 1 5 ALA CB C 1.106 -3.698 1.438 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 7 . 968 . 1 1 5 ALA H H 3.500 -3.405 2.970 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 7 . 969 . 1 1 5 ALA HA H 1.755 -1.672 1.281 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 7 . 970 . 1 1 5 ALA HB1 H 0.054 -3.458 1.285 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 7 . 971 . 1 1 5 ALA HB2 H 1.558 -3.975 0.485 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 7 . 972 . 1 1 5 ALA HB3 H 1.192 -4.530 2.136 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 7 . 973 . 1 1 5 ALA N N 3.236 -2.785 2.217 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 7 . 974 . 1 1 5 ALA O O 0.672 -2.847 4.079 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 7 . 975 . 1 1 6 VAL C C -0.893 -0.637 4.896 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 7 . 976 . 1 1 6 VAL CA C 0.543 -0.155 4.728 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 7 . 977 . 1 1 6 VAL CB C 0.559 1.383 4.693 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 7 . 978 . 1 1 6 VAL CG1 C -0.130 1.898 3.439 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 7 . 979 . 1 1 6 VAL CG2 C -0.102 1.949 5.942 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 7 . 980 . 1 1 6 VAL H H 1.568 -0.099 2.848 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 7 . 981 . 1 1 6 VAL HA H 1.120 -0.486 5.591 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 7 . 982 . 1 1 6 VAL HB H 1.597 1.714 4.674 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 7 . 983 . 1 1 6 VAL HG11 H 0.280 2.872 3.172 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 7 . 984 . 1 1 6 VAL HG12 H 0.036 1.197 2.620 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 7 . 985 . 1 1 6 VAL HG13 H -1.200 1.992 3.624 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 7 . 986 . 1 1 6 VAL HG21 H 0.407 1.568 6.828 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 7 . 987 . 1 1 6 VAL HG22 H -1.149 1.648 5.967 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 7 . 988 . 1 1 6 VAL HG23 H -0.037 3.037 5.926 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 7 . 989 . 1 1 6 VAL N N 1.149 -0.719 3.526 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 7 . 990 . 1 1 6 VAL O O -1.359 -0.851 6.014 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 7 . 991 . 1 1 7 GLY C C -3.648 -1.185 2.468 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 7 . 992 . 1 1 7 GLY CA C -2.967 -1.258 3.822 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 7 . 993 . 1 1 7 GLY H H -1.159 -0.609 2.886 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 7 . 994 . 1 1 7 GLY HA2 H -2.982 -2.293 4.165 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 7 . 995 . 1 1 7 GLY HA3 H -3.522 -0.642 4.531 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 7 . 996 . 1 1 7 GLY N N -1.592 -0.803 3.778 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 7 . 997 . 1 1 7 GLY O O -3.377 -1.998 1.585 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 7 . 998 . 1 1 8 HIS C C -4.746 1.194 0.298 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 7 . 999 . 1 1 8 HIS CA C -5.256 -0.032 1.050 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 7 . 1000 . 1 1 8 HIS CB C -6.757 0.106 1.313 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 7 . 1001 . 1 1 8 HIS CD2 C -7.419 2.575 1.770 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 7 . 1002 . 1 1 8 HIS CE1 C -7.513 2.460 3.954 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 7 . 1003 . 1 1 8 HIS CG C -7.113 1.303 2.151 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 7 . 1004 . 1 1 8 HIS H H -4.713 0.428 3.070 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 7 . 1005 . 1 1 8 HIS HA H -5.092 -0.912 0.430 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 7 . 1006 . 1 1 8 HIS HB2 H -7.268 0.191 0.354 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 7 . 1007 . 1 1 8 HIS HB3 H -7.108 -0.794 1.819 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 7 . 1008 . 1 1 8 HIS HD2 H -7.458 2.951 0.758 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 7 . 1009 . 1 1 8 HIS HE1 H -7.643 2.734 4.991 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 7 . 1010 . 1 1 8 HIS HE2 H -7.924 4.272 2.978 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 7 . 1011 . 1 1 8 HIS N N -4.535 -0.208 2.306 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 7 . 1012 . 1 1 8 HIS ND1 N -7.177 1.250 3.533 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 7 . 1013 . 1 1 8 HIS NE2 N -7.669 3.296 2.925 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 7 . 1014 . 1 1 8 HIS O O -5.485 1.819 -0.464 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 7 . 1015 . 1 1 9 LEU C C -2.350 2.308 -1.524 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 7 . 1016 . 1 1 9 LEU CA C -2.872 2.683 -0.140 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 7 . 1017 . 1 1 9 LEU CB C -1.732 3.239 0.713 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 7 . 1018 . 1 1 9 LEU CD1 C -2.357 5.666 0.793 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 7 . 1019 . 1 1 9 LEU CD2 C 0.031 4.982 1.088 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 7 . 1020 . 1 1 9 LEU CG C -1.284 4.665 0.391 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 7 . 1021 . 1 1 9 LEU H H -2.927 0.978 1.154 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 7 . 1022 . 1 1 9 LEU HA H -3.629 3.459 -0.254 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 7 . 1023 . 1 1 9 LEU HB2 H -2.054 3.218 1.754 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 7 . 1024 . 1 1 9 LEU HB3 H -0.871 2.577 0.608 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 7 . 1025 . 1 1 9 LEU HD11 H -3.290 5.423 0.285 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 7 . 1026 . 1 1 9 LEU HD12 H -2.041 6.670 0.512 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 7 . 1027 . 1 1 9 LEU HD13 H -2.509 5.622 1.872 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 7 . 1028 . 1 1 9 LEU HD21 H 0.787 4.256 0.788 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 7 . 1029 . 1 1 9 LEU HD22 H -0.110 4.935 2.168 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 7 . 1030 . 1 1 9 LEU HD23 H 0.358 5.984 0.808 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 7 . 1031 . 1 1 9 LEU HG H -1.129 4.741 -0.686 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 7 . 1032 . 1 1 9 LEU N N -3.481 1.532 0.517 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 7 . 1033 . 1 1 9 LEU O O -1.463 1.465 -1.656 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 7 . 1034 . 1 1 10 MET C C -1.046 3.104 -4.151 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 7 . 1035 . 1 1 10 MET CA C -2.492 2.676 -3.926 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 7 . 1036 . 1 1 10 MET CB C -3.411 3.406 -4.906 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 7 . 1037 . 1 1 10 MET CE C -2.630 3.105 -8.970 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 7 . 1038 . 1 1 10 MET CG C -3.374 2.834 -6.315 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 7 . 1039 . 1 1 10 MET H H -3.630 3.622 -2.378 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 7 . 1040 . 1 1 10 MET HA H -2.569 1.605 -4.111 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 7 . 1041 . 1 1 10 MET HB2 H -4.434 3.340 -4.534 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 7 . 1042 . 1 1 10 MET HB3 H -3.119 4.456 -4.945 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 7 . 1043 . 1 1 10 MET HE1 H -1.931 3.491 -9.712 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 7 . 1044 . 1 1 10 MET HE2 H -3.621 3.520 -9.155 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 7 . 1045 . 1 1 10 MET HE3 H -2.672 2.018 -9.042 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 7 . 1046 . 1 1 10 MET HG2 H -3.205 1.759 -6.256 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 7 . 1047 . 1 1 10 MET HG3 H -4.338 3.015 -6.791 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 7 . 1048 . 1 1 10 MET N N -2.905 2.941 -2.552 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 7 . 1049 . 1 1 10 MET O O -0.741 4.297 -4.196 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 7 . 1050 . 1 1 10 MET SD S -2.082 3.575 -7.331 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 8 . 1051 . 1 1 1 GLY C C 10.040 1.731 2.777 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 8 . 1052 . 1 1 1 GLY CA C 9.931 3.234 2.618 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 8 . 1053 . 1 1 1 GLY H1 H 9.823 4.649 1.172 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 8 . 1054 . 1 1 1 GLY H2 H 10.752 3.347 0.769 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 8 . 1055 . 1 1 1 GLY H3 H 9.107 3.220 0.767 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 8 . 1056 . 1 1 1 GLY HA2 H 10.784 3.704 3.107 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 8 . 1057 . 1 1 1 GLY HA3 H 9.015 3.571 3.102 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 8 . 1058 . 1 1 1 GLY N N 9.901 3.644 1.226 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 8 . 1059 . 1 1 1 GLY O O 10.105 0.998 1.790 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 8 . 1060 . 1 1 2 ASN C C 8.787 -0.823 4.257 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 8 . 1061 . 1 1 2 ASN CA C 10.160 -0.159 4.308 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 8 . 1062 . 1 1 2 ASN CB C 10.795 -0.380 5.682 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 8 . 1063 . 1 1 2 ASN CG C 9.974 0.226 6.804 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 8 . 1064 . 1 1 2 ASN H H 9.999 1.921 4.792 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 8 . 1065 . 1 1 2 ASN HA H 10.797 -0.619 3.552 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 8 . 1066 . 1 1 2 ASN HB2 H 10.896 -1.451 5.857 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 8 . 1067 . 1 1 2 ASN HB3 H 11.785 0.075 5.687 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 8 . 1068 . 1 1 2 ASN HD21 H 10.956 1.994 6.611 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 8 . 1069 . 1 1 2 ASN HD22 H 9.725 1.948 7.853 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 8 . 1070 . 1 1 2 ASN N N 10.058 1.268 4.023 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 8 . 1071 . 1 1 2 ASN ND2 N 10.240 1.491 7.114 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 8 . 1072 . 1 1 2 ASN O O 8.659 -1.976 3.843 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 8 . 1073 . 1 1 2 ASN OD1 O 9.111 -0.434 7.384 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 8 . 1074 . 1 1 3 HIS C C 5.884 -0.782 3.255 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 8 . 1075 . 1 1 3 HIS CA C 6.400 -0.605 4.680 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 8 . 1076 . 1 1 3 HIS CB C 5.476 0.331 5.456 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 8 . 1077 . 1 1 3 HIS CD2 C 6.096 -0.710 7.753 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 8 . 1078 . 1 1 3 HIS CE1 C 5.785 1.075 8.983 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 8 . 1079 . 1 1 3 HIS CG C 5.699 0.312 6.944 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 8 . 1080 . 1 1 3 HIS H H 7.935 0.852 5.006 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 8 . 1081 . 1 1 3 HIS HA H 6.400 -1.578 5.172 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 8 . 1082 . 1 1 3 HIS HB2 H 5.625 1.349 5.094 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 8 . 1083 . 1 1 3 HIS HB3 H 4.445 0.037 5.259 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 8 . 1084 . 1 1 3 HIS HD2 H 6.329 -1.719 7.447 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 8 . 1085 . 1 1 3 HIS HE1 H 5.728 1.736 9.836 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 8 . 1086 . 1 1 3 HIS HE2 H 6.406 -0.721 9.873 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 8 . 1087 . 1 1 3 HIS N N 7.764 -0.088 4.678 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 8 . 1088 . 1 1 3 HIS ND1 N 5.507 1.430 7.738 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 8 . 1089 . 1 1 3 HIS NE2 N 6.146 -0.210 9.042 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 8 . 1090 . 1 1 3 HIS O O 5.544 0.191 2.582 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 8 . 1091 . 1 1 4 TRP C C 3.907 -1.900 1.277 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 8 . 1092 . 1 1 4 TRP CA C 5.358 -2.333 1.455 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 8 . 1093 . 1 1 4 TRP CB C 5.496 -3.829 1.169 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 8 . 1094 . 1 1 4 TRP CD1 C 7.723 -4.966 0.602 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 8 . 1095 . 1 1 4 TRP CD2 C 6.894 -3.693 -1.043 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 8 . 1096 . 1 1 4 TRP CE2 C 8.109 -4.257 -1.478 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 8 . 1097 . 1 1 4 TRP CE3 C 6.191 -2.854 -1.912 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 8 . 1098 . 1 1 4 TRP CG C 6.665 -4.160 0.290 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 8 . 1099 . 1 1 4 TRP CH2 C 7.925 -3.181 -3.574 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 8 . 1100 . 1 1 4 TRP CZ2 C 8.635 -4.006 -2.743 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 8 . 1101 . 1 1 4 TRP CZ3 C 6.715 -2.607 -3.167 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 8 . 1102 . 1 1 4 TRP H H 6.128 -2.785 3.401 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 8 . 1103 . 1 1 4 TRP HA H 5.972 -1.786 0.739 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 8 . 1104 . 1 1 4 TRP HB2 H 5.606 -4.359 2.115 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 8 . 1105 . 1 1 4 TRP HB3 H 4.585 -4.172 0.677 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 8 . 1106 . 1 1 4 TRP HD1 H 7.854 -5.479 1.544 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 8 . 1107 . 1 1 4 TRP HE1 H 9.454 -5.559 -0.477 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 8 . 1108 . 1 1 4 TRP HE3 H 5.256 -2.408 -1.609 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 8 . 1109 . 1 1 4 TRP HH2 H 8.306 -2.969 -4.562 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 8 . 1110 . 1 1 4 TRP HZ2 H 9.569 -4.446 -3.058 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 8 . 1111 . 1 1 4 TRP HZ3 H 6.181 -1.959 -3.846 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 8 . 1112 . 1 1 4 TRP N N 5.832 -2.029 2.801 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 8 . 1113 . 1 1 4 TRP NE1 N 8.595 -5.030 -0.456 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 8 . 1114 . 1 1 4 TRP O O 3.619 -0.948 0.553 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 8 . 1115 . 1 1 5 ALA C C 0.996 -2.010 3.240 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 8 . 1116 . 1 1 5 ALA CA C 1.577 -2.292 1.859 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 8 . 1117 . 1 1 5 ALA CB C 0.824 -3.432 1.189 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 8 . 1118 . 1 1 5 ALA H H 3.299 -3.378 2.517 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 8 . 1119 . 1 1 5 ALA HA H 1.458 -1.397 1.249 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 8 . 1120 . 1 1 5 ALA HB1 H -0.236 -3.185 1.134 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 8 . 1121 . 1 1 5 ALA HB2 H 0.955 -4.345 1.770 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 8 . 1122 . 1 1 5 ALA HB3 H 1.215 -3.582 0.182 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 8 . 1123 . 1 1 5 ALA N N 2.998 -2.605 1.941 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 8 . 1124 . 1 1 5 ALA O O 0.539 -2.922 3.930 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 8 . 1125 . 1 1 6 VAL C C -0.929 -0.863 5.140 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 8 . 1126 . 1 1 6 VAL CA C 0.487 -0.339 4.938 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 8 . 1127 . 1 1 6 VAL CB C 0.487 1.191 5.092 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 8 . 1128 . 1 1 6 VAL CG1 C -0.291 1.842 3.958 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 8 . 1129 . 1 1 6 VAL CG2 C -0.091 1.590 6.441 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 8 . 1130 . 1 1 6 VAL H H 1.402 -0.039 3.024 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 8 . 1131 . 1 1 6 VAL HA H 1.124 -0.762 5.714 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 8 . 1132 . 1 1 6 VAL HB H 1.518 1.540 5.044 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 8 . 1133 . 1 1 6 VAL HG11 H 0.092 2.848 3.785 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 8 . 1134 . 1 1 6 VAL HG12 H -0.175 1.249 3.051 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 8 . 1135 . 1 1 6 VAL HG13 H -1.346 1.896 4.224 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 8 . 1136 . 1 1 6 VAL HG21 H -0.084 2.676 6.534 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 8 . 1137 . 1 1 6 VAL HG22 H -1.116 1.226 6.520 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 8 . 1138 . 1 1 6 VAL HG23 H 0.512 1.154 7.238 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 8 . 1139 . 1 1 6 VAL N N 1.014 -0.742 3.638 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 8 . 1140 . 1 1 6 VAL O O -1.315 -1.225 6.251 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 8 . 1141 . 1 1 7 GLY C C -3.864 -1.085 2.883 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 8 . 1142 . 1 1 7 GLY CA C -3.070 -1.378 4.141 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 8 . 1143 . 1 1 7 GLY H H -1.333 -0.589 3.172 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 8 . 1144 . 1 1 7 GLY HA2 H -3.058 -2.455 4.309 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 8 . 1145 . 1 1 7 GLY HA3 H -3.561 -0.894 4.985 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 8 . 1146 . 1 1 7 GLY N N -1.702 -0.899 4.060 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 8 . 1147 . 1 1 7 GLY O O -4.734 -1.862 2.494 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 8 . 1148 . 1 1 8 HIS C C -3.552 -0.123 -0.206 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 8 . 1149 . 1 1 8 HIS CA C -4.256 0.438 1.024 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 8 . 1150 . 1 1 8 HIS CB C -4.339 1.961 0.931 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 8 . 1151 . 1 1 8 HIS CD2 C -6.618 2.000 -0.314 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 8 . 1152 . 1 1 8 HIS CE1 C -6.209 3.700 -1.634 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 8 . 1153 . 1 1 8 HIS CG C -5.359 2.456 -0.058 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 8 . 1154 . 1 1 8 HIS H H -2.838 0.641 2.617 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 8 . 1155 . 1 1 8 HIS HA H -5.269 0.037 1.056 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 8 . 1156 . 1 1 8 HIS HB2 H -4.584 2.359 1.915 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 8 . 1157 . 1 1 8 HIS HB3 H -3.361 2.340 0.633 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 8 . 1158 . 1 1 8 HIS HD2 H -7.112 1.172 0.172 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 8 . 1159 . 1 1 8 HIS HE1 H -6.327 4.464 -2.388 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 8 . 1160 . 1 1 8 HIS HE2 H -8.061 2.716 -1.727 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 8 . 1161 . 1 1 8 HIS N N -3.563 0.043 2.246 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 8 . 1162 . 1 1 8 HIS ND1 N -5.119 3.528 -0.900 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 8 . 1163 . 1 1 8 HIS NE2 N -7.142 2.799 -1.315 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 8 . 1164 . 1 1 8 HIS O O -3.221 0.614 -1.136 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 8 . 1165 . 1 1 9 LEU C C -3.384 -1.813 -2.633 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 8 . 1166 . 1 1 9 LEU CA C -2.656 -2.094 -1.323 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 8 . 1167 . 1 1 9 LEU CB C -2.584 -3.601 -1.077 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 8 . 1168 . 1 1 9 LEU CD1 C -4.586 -4.772 -2.026 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 8 . 1169 . 1 1 9 LEU CD2 C -3.681 -5.457 0.203 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 8 . 1170 . 1 1 9 LEU CG C -3.907 -4.294 -0.753 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 8 . 1171 . 1 1 9 LEU H H -3.616 -1.983 0.588 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 8 . 1172 . 1 1 9 LEU HA H -1.641 -1.706 -1.400 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 8 . 1173 . 1 1 9 LEU HB2 H -2.159 -4.072 -1.964 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 8 . 1174 . 1 1 9 LEU HB3 H -1.905 -3.770 -0.241 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 8 . 1175 . 1 1 9 LEU HD11 H -4.740 -3.926 -2.696 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 8 . 1176 . 1 1 9 LEU HD12 H -5.549 -5.218 -1.778 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 8 . 1177 . 1 1 9 LEU HD13 H -3.957 -5.515 -2.516 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 8 . 1178 . 1 1 9 LEU HD21 H -3.194 -5.094 1.108 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 8 . 1179 . 1 1 9 LEU HD22 H -4.639 -5.906 0.461 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 8 . 1180 . 1 1 9 LEU HD23 H -3.047 -6.203 -0.277 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 8 . 1181 . 1 1 9 LEU HG H -4.562 -3.571 -0.265 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 8 . 1182 . 1 1 9 LEU N N -3.322 -1.432 -0.206 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 8 . 1183 . 1 1 9 LEU O O -4.596 -1.604 -2.649 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 8 . 1184 . 1 1 10 MET C C -4.254 -2.621 -5.394 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 8 . 1185 . 1 1 10 MET CA C -3.210 -1.565 -5.047 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 8 . 1186 . 1 1 10 MET CB C -2.112 -1.547 -6.113 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 8 . 1187 . 1 1 10 MET CE C 1.530 0.487 -6.288 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 8 . 1188 . 1 1 10 MET CG C -0.991 -0.565 -5.814 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 8 . 1189 . 1 1 10 MET H H -1.644 -1.991 -3.651 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 8 . 1190 . 1 1 10 MET HA H -3.695 -0.589 -5.034 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 8 . 1191 . 1 1 10 MET HB2 H -1.688 -2.548 -6.196 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 8 . 1192 . 1 1 10 MET HB3 H -2.562 -1.276 -7.068 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 8 . 1193 . 1 1 10 MET HE1 H 2.487 0.427 -6.805 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 8 . 1194 . 1 1 10 MET HE2 H 1.695 0.445 -5.211 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 8 . 1195 . 1 1 10 MET HE3 H 1.036 1.424 -6.544 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 8 . 1196 . 1 1 10 MET HG2 H -1.342 0.443 -6.038 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 8 . 1197 . 1 1 10 MET HG3 H -0.741 -0.625 -4.755 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 8 . 1198 . 1 1 10 MET N N -2.635 -1.814 -3.731 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 8 . 1199 . 1 1 10 MET O O -4.641 -2.768 -6.556 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 8 . 1200 . 1 1 10 MET SD S 0.494 -0.888 -6.785 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 9 . 1201 . 1 1 1 GLY C C 9.110 3.713 6.103 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 9 . 1202 . 1 1 1 GLY CA C 9.236 4.103 7.563 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 9 . 1203 . 1 1 1 GLY H1 H 9.324 5.752 8.738 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 9 . 1204 . 1 1 1 GLY H2 H 10.018 5.946 7.254 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 9 . 1205 . 1 1 1 GLY H3 H 8.376 5.930 7.400 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 9 . 1206 . 1 1 1 GLY HA2 H 10.163 3.691 7.961 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 9 . 1207 . 1 1 1 GLY HA3 H 8.395 3.679 8.112 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 9 . 1208 . 1 1 1 GLY N N 9.239 5.542 7.753 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 9 . 1209 . 1 1 1 GLY O O 8.636 4.497 5.282 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 9 . 1210 . 1 1 2 ASN C C 8.720 0.676 4.344 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 9 . 1211 . 1 1 2 ASN CA C 9.471 2.002 4.409 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 9 . 1212 . 1 1 2 ASN CB C 10.880 1.832 3.839 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 9 . 1213 . 1 1 2 ASN CG C 11.801 1.088 4.786 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 9 . 1214 . 1 1 2 ASN H H 9.916 1.898 6.500 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 9 . 1215 . 1 1 2 ASN HA H 8.937 2.734 3.802 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 9 . 1216 . 1 1 2 ASN HB2 H 10.814 1.275 2.904 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 9 . 1217 . 1 1 2 ASN HB3 H 11.301 2.817 3.635 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 9 . 1218 . 1 1 2 ASN HD21 H 11.775 -0.548 3.582 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 9 . 1219 . 1 1 2 ASN HD22 H 12.744 -0.694 5.031 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 9 . 1220 . 1 1 2 ASN N N 9.537 2.495 5.779 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 9 . 1221 . 1 1 2 ASN ND2 N 12.133 -0.150 4.438 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 9 . 1222 . 1 1 2 ASN O O 9.298 -0.362 4.024 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 9 . 1223 . 1 1 2 ASN OD1 O 12.209 1.620 5.819 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 9 . 1224 . 1 1 3 HIS C C 6.164 -0.812 3.197 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 9 . 1225 . 1 1 3 HIS CA C 6.595 -0.479 4.623 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 9 . 1226 . 1 1 3 HIS CB C 5.365 -0.290 5.509 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 9 . 1227 . 1 1 3 HIS CD2 C 6.644 -1.159 7.596 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 9 . 1228 . 1 1 3 HIS CE1 C 5.324 -0.316 9.127 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 9 . 1229 . 1 1 3 HIS CG C 5.633 -0.487 6.976 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 9 . 1230 . 1 1 3 HIS H H 7.009 1.603 4.902 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 9 . 1231 . 1 1 3 HIS HA H 7.178 -1.313 5.013 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 9 . 1232 . 1 1 3 HIS HB2 H 4.975 0.716 5.356 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 9 . 1233 . 1 1 3 HIS HB3 H 4.606 -1.009 5.200 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 9 . 1234 . 1 1 3 HIS HD2 H 7.455 -1.684 7.114 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 9 . 1235 . 1 1 3 HIS HE1 H 4.903 -0.053 10.086 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 9 . 1236 . 1 1 3 HIS HE2 H 7.012 -1.428 9.690 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 9 . 1237 . 1 1 3 HIS N N 7.426 0.719 4.648 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 9 . 1238 . 1 1 3 HIS ND1 N 4.809 0.038 7.958 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 9 . 1239 . 1 1 3 HIS NE2 N 6.434 -1.040 8.959 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 9 . 1240 . 1 1 3 HIS O O 5.971 0.082 2.373 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 9 . 1241 . 1 1 4 TRP C C 4.153 -2.193 1.316 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 9 . 1242 . 1 1 4 TRP CA C 5.610 -2.550 1.589 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 9 . 1243 . 1 1 4 TRP CB C 5.812 -4.062 1.456 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 9 . 1244 . 1 1 4 TRP CD1 C 8.038 -5.224 0.952 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 9 . 1245 . 1 1 4 TRP CD2 C 7.224 -4.018 -0.751 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 9 . 1246 . 1 1 4 TRP CE2 C 8.440 -4.601 -1.154 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 9 . 1247 . 1 1 4 TRP CE3 C 6.529 -3.214 -1.658 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 9 . 1248 . 1 1 4 TRP CG C 6.985 -4.430 0.599 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 9 . 1249 . 1 1 4 TRP CH2 C 8.273 -3.612 -3.293 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 9 . 1250 . 1 1 4 TRP CZ2 C 8.975 -4.404 -2.425 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 9 . 1251 . 1 1 4 TRP CZ3 C 7.060 -3.020 -2.917 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 9 . 1252 . 1 1 4 TRP H H 6.189 -2.786 3.637 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 9 . 1253 . 1 1 4 TRP HA H 6.234 -2.051 0.848 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 9 . 1254 . 1 1 4 TRP HB2 H 5.965 -4.479 2.451 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 9 . 1255 . 1 1 4 TRP HB3 H 4.911 -4.500 1.026 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 9 . 1256 . 1 1 4 TRP HD1 H 8.162 -5.699 1.914 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 9 . 1257 . 1 1 4 TRP HE1 H 9.777 -5.862 -0.092 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 9 . 1258 . 1 1 4 TRP HE3 H 5.593 -2.754 -1.380 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 9 . 1259 . 1 1 4 TRP HH2 H 8.661 -3.440 -4.286 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 9 . 1260 . 1 1 4 TRP HZ2 H 9.910 -4.859 -2.715 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 9 . 1261 . 1 1 4 TRP HZ3 H 6.531 -2.400 -3.626 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 9 . 1262 . 1 1 4 TRP N N 6.016 -2.101 2.916 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 9 . 1263 . 1 1 4 TRP NE1 N 8.918 -5.331 -0.098 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 9 . 1264 . 1 1 4 TRP O O 3.859 -1.341 0.480 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 9 . 1265 . 1 1 5 ALA C C 1.147 -2.339 3.207 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 9 . 1266 . 1 1 5 ALA CA C 1.817 -2.602 1.863 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 9 . 1267 . 1 1 5 ALA CB C 1.153 -3.778 1.160 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 9 . 1268 . 1 1 5 ALA H H 3.549 -3.544 2.697 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 9 . 1269 . 1 1 5 ALA HA H 1.694 -1.717 1.239 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 9 . 1270 . 1 1 5 ALA HB1 H 0.088 -3.578 1.044 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 9 . 1271 . 1 1 5 ALA HB2 H 1.290 -4.681 1.755 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 9 . 1272 . 1 1 5 ALA HB3 H 1.606 -3.918 0.178 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 9 . 1273 . 1 1 5 ALA N N 3.244 -2.852 2.027 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 9 . 1274 . 1 1 5 ALA O O 0.724 -3.270 3.894 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 9 . 1275 . 1 1 6 VAL C C -0.977 -1.241 4.954 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 9 . 1276 . 1 1 6 VAL CA C 0.434 -0.681 4.842 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 9 . 1277 . 1 1 6 VAL CB C 0.382 0.849 4.995 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 9 . 1278 . 1 1 6 VAL CG1 C -0.295 1.232 6.303 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 9 . 1279 . 1 1 6 VAL CG2 C 1.781 1.442 4.916 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 9 . 1280 . 1 1 6 VAL H H 1.423 -0.349 2.971 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 9 . 1281 . 1 1 6 VAL HA H 1.031 -1.088 5.657 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 9 . 1282 . 1 1 6 VAL HB H -0.208 1.255 4.173 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 9 . 1283 . 1 1 6 VAL HG11 H -1.294 0.798 6.337 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 9 . 1284 . 1 1 6 VAL HG12 H 0.294 0.856 7.140 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 9 . 1285 . 1 1 6 VAL HG13 H -0.368 2.318 6.371 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 9 . 1286 . 1 1 6 VAL HG21 H 2.245 1.156 3.973 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 9 . 1287 . 1 1 6 VAL HG22 H 2.381 1.067 5.745 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 9 . 1288 . 1 1 6 VAL HG23 H 1.719 2.529 4.976 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 9 . 1289 . 1 1 6 VAL N N 1.054 -1.067 3.578 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 9 . 1290 . 1 1 6 VAL O O -1.245 -2.118 5.774 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 9 . 1291 . 1 1 7 GLY C C -4.148 -0.403 3.204 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 9 . 1292 . 1 1 7 GLY CA C -3.256 -1.191 4.145 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 9 . 1293 . 1 1 7 GLY H H -1.606 -0.011 3.469 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 9 . 1294 . 1 1 7 GLY HA2 H -3.278 -2.240 3.849 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 9 . 1295 . 1 1 7 GLY HA3 H -3.644 -1.101 5.159 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 9 . 1296 . 1 1 7 GLY N N -1.880 -0.730 4.123 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 9 . 1297 . 1 1 7 GLY O O -5.316 -0.160 3.504 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 9 . 1298 . 1 1 8 HIS C C -4.173 0.172 -0.318 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 9 . 1299 . 1 1 8 HIS CA C -4.346 0.764 1.078 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 9 . 1300 . 1 1 8 HIS CB C -3.895 2.225 1.082 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 9 . 1301 . 1 1 8 HIS CD2 C -5.177 3.624 -0.693 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 9 . 1302 . 1 1 8 HIS CE1 C -6.638 4.547 0.649 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 9 . 1303 . 1 1 8 HIS CG C -4.942 3.180 0.573 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 9 . 1304 . 1 1 8 HIS H H -2.629 -0.236 1.876 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 9 . 1305 . 1 1 8 HIS HA H -5.403 0.727 1.342 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 9 . 1306 . 1 1 8 HIS HB2 H -3.629 2.507 2.100 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 9 . 1307 . 1 1 8 HIS HB3 H -3.011 2.315 0.451 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 9 . 1308 . 1 1 8 HIS HD2 H -4.625 3.352 -1.581 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 9 . 1309 . 1 1 8 HIS HE1 H -7.460 5.145 1.014 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 9 . 1310 . 1 1 8 HIS HE2 H -6.672 4.983 -1.401 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 9 . 1311 . 1 1 8 HIS N N -3.594 -0.003 2.064 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 9 . 1312 . 1 1 8 HIS ND1 N -5.874 3.773 1.408 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 9 . 1313 . 1 1 8 HIS NE2 N -6.254 4.488 -0.627 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 9 . 1314 . 1 1 8 HIS O O -4.222 0.889 -1.318 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 9 . 1315 . 1 1 9 LEU C C -5.124 -2.033 -2.356 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 9 . 1316 . 1 1 9 LEU CA C -3.788 -1.828 -1.650 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 9 . 1317 . 1 1 9 LEU CB C -3.101 -3.178 -1.429 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 9 . 1318 . 1 1 9 LEU CD1 C -1.757 -3.585 -3.505 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 9 . 1319 . 1 1 9 LEU CD2 C -2.759 -5.516 -2.268 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 9 . 1320 . 1 1 9 LEU CG C -2.937 -4.058 -2.668 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 9 . 1321 . 1 1 9 LEU H H -3.939 -1.671 0.481 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 9 . 1322 . 1 1 9 LEU HA H -3.150 -1.215 -2.287 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 9 . 1323 . 1 1 9 LEU HB2 H -2.108 -2.984 -1.023 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 9 . 1324 . 1 1 9 LEU HB3 H -3.672 -3.734 -0.686 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 9 . 1325 . 1 1 9 LEU HD11 H -1.903 -2.541 -3.781 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 9 . 1326 . 1 1 9 LEU HD12 H -0.839 -3.683 -2.926 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 9 . 1327 . 1 1 9 LEU HD13 H -1.685 -4.193 -4.407 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 9 . 1328 . 1 1 9 LEU HD21 H -3.612 -5.836 -1.670 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 9 . 1329 . 1 1 9 LEU HD22 H -2.691 -6.132 -3.165 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 9 . 1330 . 1 1 9 LEU HD23 H -1.845 -5.623 -1.684 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 9 . 1331 . 1 1 9 LEU HG H -3.841 -3.976 -3.271 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 9 . 1332 . 1 1 9 LEU N N -3.969 -1.138 -0.377 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 9 . 1333 . 1 1 9 LEU O O -6.126 -2.364 -1.722 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 9 . 1334 . 1 1 10 MET C C -6.910 -3.410 -4.298 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 9 . 1335 . 1 1 10 MET CA C -6.344 -2.002 -4.461 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 9 . 1336 . 1 1 10 MET CB C -6.060 -1.721 -5.937 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 9 . 1337 . 1 1 10 MET CE C -2.877 -2.821 -8.092 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 9 . 1338 . 1 1 10 MET CG C -5.218 -2.795 -6.608 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 9 . 1339 . 1 1 10 MET H H -4.274 -1.564 -4.131 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 9 . 1340 . 1 1 10 MET HA H -7.088 -1.287 -4.109 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 9 . 1341 . 1 1 10 MET HB2 H -7.008 -1.636 -6.467 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 9 . 1342 . 1 1 10 MET HB3 H -5.530 -0.771 -6.012 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 9 . 1343 . 1 1 10 MET HE1 H -2.348 -2.570 -9.011 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 9 . 1344 . 1 1 10 MET HE2 H -2.852 -3.901 -7.942 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 9 . 1345 . 1 1 10 MET HE3 H -2.395 -2.327 -7.249 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 9 . 1346 . 1 1 10 MET HG2 H -4.376 -3.035 -5.959 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 9 . 1347 . 1 1 10 MET HG3 H -5.827 -3.689 -6.743 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 9 . 1348 . 1 1 10 MET N N -5.130 -1.836 -3.669 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 9 . 1349 . 1 1 10 MET O O -6.264 -4.288 -3.724 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 9 . 1350 . 1 1 10 MET SD S -4.580 -2.274 -8.213 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 10 . 1351 . 1 1 1 GLY C C 10.466 2.268 1.581 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 10 . 1352 . 1 1 1 GLY CA C 10.346 2.481 0.084 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 10 . 1353 . 1 1 1 GLY H1 H 11.510 2.653 -1.565 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 10 . 1354 . 1 1 1 GLY H2 H 12.262 3.089 -0.163 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 10 . 1355 . 1 1 1 GLY H3 H 12.014 1.495 -0.505 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 10 . 1356 . 1 1 1 GLY HA2 H 9.899 3.459 -0.095 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 10 . 1357 . 1 1 1 GLY HA3 H 9.694 1.712 -0.332 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 10 . 1358 . 1 1 1 GLY N N 11.631 2.425 -0.588 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 10 . 1359 . 1 1 1 GLY O O 11.519 1.871 2.076 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 10 . 1360 . 1 1 2 ASN C C 8.601 1.120 4.153 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 10 . 1361 . 1 1 2 ASN CA C 9.371 2.374 3.752 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 10 . 1362 . 1 1 2 ASN CB C 8.749 3.604 4.419 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 10 . 1363 . 1 1 2 ASN CG C 9.582 4.854 4.217 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 10 . 1364 . 1 1 2 ASN H H 8.547 2.860 1.837 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 10 . 1365 . 1 1 2 ASN HA H 10.400 2.275 4.098 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 10 . 1366 . 1 1 2 ASN HB2 H 7.759 3.770 3.992 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 10 . 1367 . 1 1 2 ASN HB3 H 8.647 3.414 5.487 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 10 . 1368 . 1 1 2 ASN HD21 H 9.214 5.448 6.124 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 10 . 1369 . 1 1 2 ASN HD22 H 10.222 6.523 5.182 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 10 . 1370 . 1 1 2 ASN N N 9.383 2.536 2.303 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 10 . 1371 . 1 1 2 ASN ND2 N 9.681 5.674 5.257 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 10 . 1372 . 1 1 2 ASN O O 9.190 0.130 4.590 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 10 . 1373 . 1 1 2 ASN OD1 O 10.129 5.082 3.138 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 10 . 1374 . 1 1 3 HIS C C 6.159 -0.833 3.123 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 10 . 1375 . 1 1 3 HIS CA C 6.430 0.035 4.347 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 10 . 1376 . 1 1 3 HIS CB C 5.109 0.525 4.944 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 10 . 1377 . 1 1 3 HIS CD2 C 5.267 1.274 7.425 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 10 . 1378 . 1 1 3 HIS CE1 C 5.615 3.407 7.072 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 10 . 1379 . 1 1 3 HIS CG C 5.285 1.494 6.081 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 10 . 1380 . 1 1 3 HIS H H 6.857 2.011 3.641 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 10 . 1381 . 1 1 3 HIS HA H 6.944 -0.570 5.094 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 10 . 1382 . 1 1 3 HIS HB2 H 4.528 1.007 4.158 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 10 . 1383 . 1 1 3 HIS HB3 H 4.555 -0.340 5.310 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 10 . 1384 . 1 1 3 HIS HD2 H 5.117 0.325 7.919 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 10 . 1385 . 1 1 3 HIS HE1 H 5.792 4.458 7.242 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 10 . 1386 . 1 1 3 HIS HE2 H 5.519 2.667 9.033 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 10 . 1387 . 1 1 3 HIS N N 7.281 1.169 4.003 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 10 . 1388 . 1 1 3 HIS ND1 N 5.505 2.846 5.878 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 10 . 1389 . 1 1 3 HIS NE2 N 5.477 2.496 8.038 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 10 . 1390 . 1 1 3 HIS O O 5.907 -0.323 2.032 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 10 . 1391 . 1 1 4 TRP C C 4.542 -2.976 1.712 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 10 . 1392 . 1 1 4 TRP CA C 5.974 -3.087 2.223 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 10 . 1393 . 1 1 4 TRP CB C 6.255 -4.518 2.685 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 10 . 1394 . 1 1 4 TRP CD1 C 8.518 -5.717 2.765 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 10 . 1395 . 1 1 4 TRP CD2 C 7.867 -5.116 0.707 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 10 . 1396 . 1 1 4 TRP CE2 C 9.115 -5.760 0.612 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 10 . 1397 . 1 1 4 TRP CE3 C 7.258 -4.648 -0.461 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 10 . 1398 . 1 1 4 TRP CG C 7.502 -5.098 2.092 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 10 . 1399 . 1 1 4 TRP CH2 C 9.146 -5.480 -1.733 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 10 . 1400 . 1 1 4 TRP CZ2 C 9.765 -5.948 -0.604 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 10 . 1401 . 1 1 4 TRP CZ3 C 7.905 -4.836 -1.668 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 10 . 1402 . 1 1 4 TRP H H 6.422 -2.503 4.234 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 10 . 1403 . 1 1 4 TRP HA H 6.653 -2.848 1.405 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 10 . 1404 . 1 1 4 TRP HB2 H 6.356 -4.517 3.770 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 10 . 1405 . 1 1 4 TRP HB3 H 5.409 -5.148 2.411 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 10 . 1406 . 1 1 4 TRP HD1 H 8.551 -5.870 3.833 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 10 . 1407 . 1 1 4 TRP HE1 H 10.345 -6.597 2.125 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 10 . 1408 . 1 1 4 TRP HE3 H 6.301 -4.150 -0.421 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 10 . 1409 . 1 1 4 TRP HH2 H 9.625 -5.611 -2.692 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 10 . 1410 . 1 1 4 TRP HZ2 H 10.723 -6.444 -0.656 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 10 . 1411 . 1 1 4 TRP HZ3 H 7.444 -4.478 -2.577 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 10 . 1412 . 1 1 4 TRP N N 6.212 -2.146 3.313 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 10 . 1413 . 1 1 4 TRP NE1 N 9.491 -6.117 1.880 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 10 . 1414 . 1 1 4 TRP O O 4.312 -2.707 0.534 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 10 . 1415 . 1 1 5 ALA C C 1.358 -2.443 3.355 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 10 . 1416 . 1 1 5 ALA CA C 2.172 -3.104 2.248 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 10 . 1417 . 1 1 5 ALA CB C 1.624 -4.490 1.947 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 10 . 1418 . 1 1 5 ALA H H 3.834 -3.400 3.561 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 10 . 1419 . 1 1 5 ALA HA H 2.081 -2.496 1.348 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 10 . 1420 . 1 1 5 ALA HB1 H 0.570 -4.415 1.679 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 10 . 1421 . 1 1 5 ALA HB2 H 2.179 -4.927 1.116 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 10 . 1422 . 1 1 5 ALA HB3 H 1.732 -5.123 2.828 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 10 . 1423 . 1 1 5 ALA N N 3.581 -3.182 2.608 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 10 . 1424 . 1 1 5 ALA O O 0.898 -3.107 4.283 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 10 . 1425 . 1 1 6 VAL C C -0.955 -0.982 4.453 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 10 . 1426 . 1 1 6 VAL CA C 0.428 -0.375 4.246 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 10 . 1427 . 1 1 6 VAL CB C 0.275 1.099 3.835 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 10 . 1428 . 1 1 6 VAL CG1 C -0.520 1.866 4.882 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 10 . 1429 . 1 1 6 VAL CG2 C 1.639 1.738 3.619 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 10 . 1430 . 1 1 6 VAL H H 1.589 -0.639 2.467 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 10 . 1431 . 1 1 6 VAL HA H 0.966 -0.415 5.192 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 10 . 1432 . 1 1 6 VAL HB H -0.273 1.137 2.894 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 10 . 1433 . 1 1 6 VAL HG11 H -1.492 1.392 5.021 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 10 . 1434 . 1 1 6 VAL HG12 H 0.024 1.862 5.827 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 10 . 1435 . 1 1 6 VAL HG13 H -0.662 2.895 4.550 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 10 . 1436 . 1 1 6 VAL HG21 H 2.190 1.173 2.867 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 10 . 1437 . 1 1 6 VAL HG22 H 2.195 1.732 4.557 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 10 . 1438 . 1 1 6 VAL HG23 H 1.509 2.765 3.280 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 10 . 1439 . 1 1 6 VAL N N 1.185 -1.128 3.253 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 10 . 1440 . 1 1 6 VAL O O -1.297 -1.413 5.555 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 10 . 1441 . 1 1 7 GLY C C -4.014 -1.015 2.407 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 10 . 1442 . 1 1 7 GLY CA C -3.088 -1.563 3.475 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 10 . 1443 . 1 1 7 GLY H H -1.419 -0.639 2.510 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 10 . 1444 . 1 1 7 GLY HA2 H -3.026 -2.646 3.362 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 10 . 1445 . 1 1 7 GLY HA3 H -3.505 -1.334 4.456 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 10 . 1446 . 1 1 7 GLY N N -1.750 -1.009 3.390 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 10 . 1447 . 1 1 7 GLY O O -4.373 -1.721 1.464 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 10 . 1448 . 1 1 8 HIS C C -4.535 1.912 0.750 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 10 . 1449 . 1 1 8 HIS CA C -5.292 0.890 1.593 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 10 . 1450 . 1 1 8 HIS CB C -6.454 1.573 2.319 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 10 . 1451 . 1 1 8 HIS CD2 C -8.251 2.950 1.047 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 10 . 1452 . 1 1 8 HIS CE1 C -9.365 1.270 0.191 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 10 . 1453 . 1 1 8 HIS CG C -7.659 1.789 1.446 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 10 . 1454 . 1 1 8 HIS H H -4.071 0.775 3.349 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 10 . 1455 . 1 1 8 HIS HA H -5.698 0.125 0.931 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 10 . 1456 . 1 1 8 HIS HB2 H -6.747 0.950 3.164 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 10 . 1457 . 1 1 8 HIS HB3 H -6.115 2.538 2.694 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 10 . 1458 . 1 1 8 HIS HD2 H -7.937 3.951 1.303 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 10 . 1459 . 1 1 8 HIS HE1 H -10.100 0.701 -0.359 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 10 . 1460 . 1 1 8 HIS HE2 H -9.970 3.242 -0.200 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 10 . 1461 . 1 1 8 HIS N N -4.402 0.248 2.553 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 10 . 1462 . 1 1 8 HIS ND1 N -8.376 0.740 0.895 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 10 . 1463 . 1 1 8 HIS NE2 N -9.329 2.604 0.251 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 10 . 1464 . 1 1 8 HIS O O -4.798 3.112 0.825 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 10 . 1465 . 1 1 9 LEU C C -3.693 3.126 -1.827 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 10 . 1466 . 1 1 9 LEU CA C -2.798 2.298 -0.912 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 10 . 1467 . 1 1 9 LEU CB C -1.821 1.469 -1.748 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 10 . 1468 . 1 1 9 LEU CD1 C 0.021 -0.231 -1.786 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 10 . 1469 . 1 1 9 LEU CD2 C 0.418 2.016 -0.760 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 10 . 1470 . 1 1 9 LEU CG C -0.605 0.915 -1.005 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 10 . 1471 . 1 1 9 LEU H H -3.425 0.431 -0.069 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 10 . 1472 . 1 1 9 LEU HA H -2.225 2.977 -0.281 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 10 . 1473 . 1 1 9 LEU HB2 H -2.367 0.632 -2.183 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 10 . 1474 . 1 1 9 LEU HB3 H -1.458 2.100 -2.558 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 10 . 1475 . 1 1 9 LEU HD11 H -0.724 -1.009 -1.951 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 10 . 1476 . 1 1 9 LEU HD12 H 0.380 0.138 -2.746 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 10 . 1477 . 1 1 9 LEU HD13 H 0.857 -0.643 -1.219 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 10 . 1478 . 1 1 9 LEU HD21 H -0.048 2.827 -0.200 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 10 . 1479 . 1 1 9 LEU HD22 H 1.254 1.615 -0.189 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 10 . 1480 . 1 1 9 LEU HD23 H 0.779 2.395 -1.716 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 10 . 1481 . 1 1 9 LEU HG H -0.936 0.532 -0.039 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 10 . 1482 . 1 1 9 LEU N N -3.594 1.427 -0.053 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 10 . 1483 . 1 1 9 LEU O O -4.510 2.583 -2.569 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 10 . 1484 . 1 1 10 MET C C -3.929 5.225 -4.066 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 10 . 1485 . 1 1 10 MET CA C -4.322 5.347 -2.598 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 10 . 1486 . 1 1 10 MET CB C -4.143 6.792 -2.129 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 10 . 1487 . 1 1 10 MET CE C -7.480 9.007 -1.498 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 10 . 1488 . 1 1 10 MET CG C -5.271 7.716 -2.560 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 10 . 1489 . 1 1 10 MET H H -2.843 4.829 -1.138 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 10 . 1490 . 1 1 10 MET HA H -5.374 5.078 -2.497 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 10 . 1491 . 1 1 10 MET HB2 H -4.090 6.797 -1.040 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 10 . 1492 . 1 1 10 MET HB3 H -3.203 7.176 -2.527 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 10 . 1493 . 1 1 10 MET HE1 H -8.443 8.951 -0.990 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 10 . 1494 . 1 1 10 MET HE2 H -7.610 9.481 -2.470 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 10 . 1495 . 1 1 10 MET HE3 H -6.787 9.595 -0.896 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 10 . 1496 . 1 1 10 MET HG2 H -4.985 8.743 -2.337 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 10 . 1497 . 1 1 10 MET HG3 H -5.418 7.615 -3.636 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 10 . 1498 . 1 1 10 MET N N -3.531 4.444 -1.770 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 10 . 1499 . 1 1 10 MET O O -4.596 5.772 -4.946 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 10 . 1500 . 1 1 10 MET SD S -6.825 7.355 -1.722 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 11 . 1501 . 1 1 1 GLY C C 10.700 -0.230 3.351 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 11 . 1502 . 1 1 1 GLY CA C 11.083 0.060 1.913 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 11 . 1503 . 1 1 1 GLY H1 H 12.636 -0.171 0.632 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 11 . 1504 . 1 1 1 GLY H2 H 12.494 -1.383 1.741 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 11 . 1505 . 1 1 1 GLY H3 H 13.089 0.086 2.196 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 11 . 1506 . 1 1 1 GLY HA2 H 11.023 1.136 1.746 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 11 . 1507 . 1 1 1 GLY HA3 H 10.378 -0.441 1.251 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 11 . 1508 . 1 1 1 GLY N N 12.428 -0.386 1.597 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 11 . 1509 . 1 1 1 GLY O O 10.571 -1.388 3.744 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 11 . 1510 . 1 1 2 ASN C C 8.826 -0.062 5.682 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 11 . 1511 . 1 1 2 ASN CA C 10.152 0.679 5.542 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 11 . 1512 . 1 1 2 ASN CB C 10.054 2.052 6.211 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 11 . 1513 . 1 1 2 ASN CG C 8.973 2.920 5.596 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 11 . 1514 . 1 1 2 ASN H H 10.639 1.753 3.755 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 11 . 1515 . 1 1 2 ASN HA H 10.927 0.102 6.045 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 11 . 1516 . 1 1 2 ASN HB2 H 9.837 1.916 7.271 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 11 . 1517 . 1 1 2 ASN HB3 H 11.012 2.561 6.108 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 11 . 1518 . 1 1 2 ASN HD21 H 7.998 3.023 7.373 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 11 . 1519 . 1 1 2 ASN HD22 H 7.247 3.887 6.050 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 11 . 1520 . 1 1 2 ASN N N 10.519 0.826 4.138 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 11 . 1521 . 1 1 2 ASN ND2 N 7.995 3.308 6.404 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 11 . 1522 . 1 1 2 ASN O O 8.586 -0.744 6.678 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 11 . 1523 . 1 1 2 ASN OD1 O 9.019 3.238 4.407 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 11 . 1524 . 1 1 3 HIS C C 6.215 -0.913 3.265 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 11 . 1525 . 1 1 3 HIS CA C 6.666 -0.581 4.685 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 11 . 1526 . 1 1 3 HIS CB C 5.626 0.307 5.369 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 11 . 1527 . 1 1 3 HIS CD2 C 5.512 -0.825 7.703 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 11 . 1528 . 1 1 3 HIS CE1 C 5.859 0.962 8.920 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 11 . 1529 . 1 1 3 HIS CG C 5.666 0.243 6.871 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 11 . 1530 . 1 1 3 HIS H H 8.222 0.652 3.887 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 11 . 1531 . 1 1 3 HIS HA H 6.752 -1.511 5.248 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 11 . 1532 . 1 1 3 HIS HB2 H 5.801 1.338 5.064 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 11 . 1533 . 1 1 3 HIS HB3 H 4.634 0.006 5.032 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 11 . 1534 . 1 1 3 HIS HD2 H 5.327 -1.847 7.408 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 11 . 1535 . 1 1 3 HIS HE1 H 6.000 1.612 9.771 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 11 . 1536 . 1 1 3 HIS HE2 H 5.572 -0.901 9.845 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 11 . 1537 . 1 1 3 HIS N N 7.967 0.077 4.676 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 11 . 1538 . 1 1 3 HIS ND1 N 5.884 1.362 7.656 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 11 . 1539 . 1 1 3 HIS NE2 N 5.637 -0.353 8.998 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 11 . 1540 . 1 1 3 HIS O O 6.054 -0.024 2.431 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 11 . 1541 . 1 1 4 TRP C C 4.146 -2.210 1.400 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 11 . 1542 . 1 1 4 TRP CA C 5.580 -2.648 1.683 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 11 . 1543 . 1 1 4 TRP CB C 5.690 -4.170 1.578 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 11 . 1544 . 1 1 4 TRP CD1 C 7.867 -5.463 1.181 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 11 . 1545 . 1 1 4 TRP CD2 C 7.171 -4.269 -0.581 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 11 . 1546 . 1 1 4 TRP CE2 C 8.368 -4.926 -0.928 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 11 . 1547 . 1 1 4 TRP CE3 C 6.547 -3.459 -1.534 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 11 . 1548 . 1 1 4 TRP CG C 6.870 -4.626 0.772 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 11 . 1549 . 1 1 4 TRP CH2 C 8.317 -3.996 -3.099 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 11 . 1550 . 1 1 4 TRP CZ2 C 8.950 -4.797 -2.186 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 11 . 1551 . 1 1 4 TRP CZ3 C 7.126 -3.331 -2.782 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 11 . 1552 . 1 1 4 TRP H H 6.160 -2.882 3.730 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 11 . 1553 . 1 1 4 TRP HA H 6.233 -2.201 0.933 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 11 . 1554 . 1 1 4 TRP HB2 H 5.780 -4.580 2.584 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 11 . 1555 . 1 1 4 TRP HB3 H 4.780 -4.558 1.120 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 11 . 1556 . 1 1 4 TRP HD1 H 7.935 -5.913 2.161 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 11 . 1557 . 1 1 4 TRP HE1 H 9.602 -6.224 0.213 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 11 . 1558 . 1 1 4 TRP HE3 H 5.628 -2.942 -1.298 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 11 . 1559 . 1 1 4 TRP HH2 H 8.745 -3.876 -4.084 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 11 . 1560 . 1 1 4 TRP HZ2 H 9.868 -5.310 -2.433 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 11 . 1561 . 1 1 4 TRP HZ3 H 6.652 -2.706 -3.525 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 11 . 1562 . 1 1 4 TRP N N 6.012 -2.199 3.001 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 11 . 1563 . 1 1 4 TRP NE1 N 8.773 -5.649 0.164 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 11 . 1564 . 1 1 4 TRP O O 3.908 -1.348 0.556 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 11 . 1565 . 1 1 5 ALA C C 1.161 -2.045 3.260 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 11 . 1566 . 1 1 5 ALA CA C 1.789 -2.478 1.940 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 11 . 1567 . 1 1 5 ALA CB C 1.036 -3.666 1.359 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 11 . 1568 . 1 1 5 ALA H H 3.460 -3.512 2.789 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 11 . 1569 . 1 1 5 ALA HA H 1.716 -1.649 1.237 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 11 . 1570 . 1 1 5 ALA HB1 H -0.015 -3.406 1.235 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 11 . 1571 . 1 1 5 ALA HB2 H 1.122 -4.517 2.035 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 11 . 1572 . 1 1 5 ALA HB3 H 1.462 -3.928 0.390 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 11 . 1573 . 1 1 5 ALA N N 3.198 -2.810 2.112 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 11 . 1574 . 1 1 5 ALA O O 0.666 -2.875 4.025 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 11 . 1575 . 1 1 6 VAL C C -0.823 -0.661 4.940 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 11 . 1576 . 1 1 6 VAL CA C 0.615 -0.199 4.751 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 11 . 1577 . 1 1 6 VAL CB C 0.656 1.338 4.754 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 11 . 1578 . 1 1 6 VAL CG1 C 0.031 1.888 6.029 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 11 . 1579 . 1 1 6 VAL CG2 C 2.084 1.836 4.596 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 11 . 1580 . 1 1 6 VAL H H 1.606 -0.113 2.854 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 11 . 1581 . 1 1 6 VAL HA H 1.206 -0.560 5.592 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 11 . 1582 . 1 1 6 VAL HB H 0.074 1.697 3.905 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 11 . 1583 . 1 1 6 VAL HG11 H -0.991 1.519 6.121 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 11 . 1584 . 1 1 6 VAL HG12 H 0.021 2.977 5.988 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 11 . 1585 . 1 1 6 VAL HG13 H 0.614 1.561 6.890 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 11 . 1586 . 1 1 6 VAL HG21 H 2.512 1.431 3.679 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 11 . 1587 . 1 1 6 VAL HG22 H 2.086 2.925 4.548 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 11 . 1588 . 1 1 6 VAL HG23 H 2.679 1.509 5.449 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 11 . 1589 . 1 1 6 VAL N N 1.184 -0.743 3.522 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 11 . 1590 . 1 1 6 VAL O O -1.248 -0.963 6.056 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 11 . 1591 . 1 1 7 GLY C C -3.629 -1.149 2.551 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 11 . 1592 . 1 1 7 GLY CA C -2.958 -1.140 3.910 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 11 . 1593 . 1 1 7 GLY H H -1.172 -0.455 2.953 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 11 . 1594 . 1 1 7 GLY HA2 H -2.995 -2.147 4.324 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 11 . 1595 . 1 1 7 GLY HA3 H -3.504 -0.466 4.569 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 11 . 1596 . 1 1 7 GLY N N -1.572 -0.714 3.843 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 11 . 1597 . 1 1 7 GLY O O -3.380 -2.035 1.734 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 11 . 1598 . 1 1 8 HIS C C -4.594 1.043 0.167 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 11 . 1599 . 1 1 8 HIS CA C -5.193 -0.058 1.037 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 11 . 1600 . 1 1 8 HIS CB C -6.677 0.219 1.280 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 11 . 1601 . 1 1 8 HIS CD2 C -7.862 -0.361 3.518 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 11 . 1602 . 1 1 8 HIS CE1 C -7.940 -2.533 3.262 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 11 . 1603 . 1 1 8 HIS CG C -7.289 -0.678 2.323 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 11 . 1604 . 1 1 8 HIS H H -4.644 0.539 3.019 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 11 . 1605 . 1 1 8 HIS HA H -5.099 -1.007 0.509 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 11 . 1606 . 1 1 8 HIS HB2 H -6.795 1.255 1.596 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 11 . 1607 . 1 1 8 HIS HB3 H -7.214 0.074 0.343 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 11 . 1608 . 1 1 8 HIS HD2 H -7.977 0.629 3.933 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 11 . 1609 . 1 1 8 HIS HE1 H -8.131 -3.581 3.443 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 11 . 1610 . 1 1 8 HIS HE2 H -8.730 -1.652 4.991 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 11 . 1611 . 1 1 8 HIS N N -4.483 -0.160 2.308 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 11 . 1612 . 1 1 8 HIS ND1 N -7.347 -2.054 2.178 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 11 . 1613 . 1 1 8 HIS NE2 N -8.269 -1.549 4.098 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 11 . 1614 . 1 1 8 HIS O O -5.121 2.155 0.105 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 11 . 1615 . 1 1 9 LEU C C -3.763 2.198 -2.453 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 11 . 1616 . 1 1 9 LEU CA C -2.820 1.690 -1.368 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 11 . 1617 . 1 1 9 LEU CB C -1.583 1.055 -2.008 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 11 . 1618 . 1 1 9 LEU CD1 C -0.525 -0.240 -3.874 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 11 . 1619 . 1 1 9 LEU CD2 C -2.648 -1.058 -2.834 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 11 . 1620 . 1 1 9 LEU CG C -1.838 0.169 -3.228 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 11 . 1621 . 1 1 9 LEU H H -3.106 -0.201 -0.409 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 11 . 1622 . 1 1 9 LEU HA H -2.500 2.538 -0.763 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 11 . 1623 . 1 1 9 LEU HB2 H -0.916 1.861 -2.315 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 11 . 1624 . 1 1 9 LEU HB3 H -1.074 0.459 -1.251 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 11 . 1625 . 1 1 9 LEU HD11 H 0.039 0.652 -4.148 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 11 . 1626 . 1 1 9 LEU HD12 H -0.728 -0.830 -4.767 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 11 . 1627 . 1 1 9 LEU HD13 H 0.057 -0.835 -3.170 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 11 . 1628 . 1 1 9 LEU HD21 H -2.486 -1.851 -3.565 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 11 . 1629 . 1 1 9 LEU HD22 H -2.331 -1.401 -1.850 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 11 . 1630 . 1 1 9 LEU HD23 H -3.707 -0.801 -2.806 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 11 . 1631 . 1 1 9 LEU HG H -2.415 0.742 -3.955 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 11 . 1632 . 1 1 9 LEU N N -3.490 0.728 -0.502 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 11 . 1633 . 1 1 9 LEU O O -4.817 1.609 -2.699 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 11 . 1634 . 1 1 10 MET C C -4.002 3.115 -5.472 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 11 . 1635 . 1 1 10 MET CA C -4.190 3.876 -4.164 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 11 . 1636 . 1 1 10 MET CB C -3.827 5.349 -4.361 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 11 . 1637 . 1 1 10 MET CE C -4.684 8.563 -6.517 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 11 . 1638 . 1 1 10 MET CG C -4.803 6.101 -5.250 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 11 . 1639 . 1 1 10 MET H H -2.503 3.729 -2.853 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 11 . 1640 . 1 1 10 MET HA H -5.239 3.813 -3.873 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 11 . 1641 . 1 1 10 MET HB2 H -3.807 5.833 -3.384 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 11 . 1642 . 1 1 10 MET HB3 H -2.832 5.409 -4.802 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 11 . 1643 . 1 1 10 MET HE1 H -4.703 9.651 -6.453 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 11 . 1644 . 1 1 10 MET HE2 H -3.735 8.241 -6.947 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 11 . 1645 . 1 1 10 MET HE3 H -5.504 8.222 -7.150 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 11 . 1646 . 1 1 10 MET HG2 H -4.498 5.974 -6.289 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 11 . 1647 . 1 1 10 MET HG3 H -5.799 5.677 -5.120 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 11 . 1648 . 1 1 10 MET N N -3.378 3.292 -3.102 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 11 . 1649 . 1 1 10 MET O O -3.130 3.448 -6.276 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 11 . 1650 . 1 1 10 MET SD S -4.864 7.864 -4.878 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 12 . 1651 . 1 1 1 GLY C C 10.657 3.865 4.291 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 12 . 1652 . 1 1 1 GLY CA C 11.088 4.539 5.578 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 12 . 1653 . 1 1 1 GLY H1 H 12.611 5.641 6.333 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 12 . 1654 . 1 1 1 GLY H2 H 12.309 5.918 4.735 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 12 . 1655 . 1 1 1 GLY H3 H 13.078 4.536 5.202 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 12 . 1656 . 1 1 1 GLY HA2 H 11.164 3.783 6.360 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 12 . 1657 . 1 1 1 GLY HA3 H 10.332 5.270 5.865 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 12 . 1658 . 1 1 1 GLY N N 12.369 5.209 5.453 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 12 . 1659 . 1 1 1 GLY O O 10.378 4.533 3.297 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 12 . 1660 . 1 1 2 ASN C C 9.050 0.835 3.459 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 12 . 1661 . 1 1 2 ASN CA C 10.208 1.773 3.132 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 12 . 1662 . 1 1 2 ASN CB C 11.394 0.969 2.595 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 12 . 1663 . 1 1 2 ASN CG C 11.232 0.606 1.132 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 12 . 1664 . 1 1 2 ASN H H 10.845 2.047 5.158 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 12 . 1665 . 1 1 2 ASN HA H 9.882 2.469 2.359 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 12 . 1666 . 1 1 2 ASN HB2 H 12.300 1.564 2.710 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 12 . 1667 . 1 1 2 ASN HB3 H 11.495 0.054 3.179 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 12 . 1668 . 1 1 2 ASN HD21 H 13.066 1.365 0.705 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 12 . 1669 . 1 1 2 ASN HD22 H 12.193 0.694 -0.654 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 12 . 1670 . 1 1 2 ASN N N 10.605 2.538 4.309 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 12 . 1671 . 1 1 2 ASN ND2 N 12.244 0.913 0.331 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 12 . 1672 . 1 1 2 ASN O O 9.249 -0.360 3.686 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 12 . 1673 . 1 1 2 ASN OD1 O 10.209 0.054 0.729 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 12 . 1674 . 1 1 3 HIS C C 6.444 -0.498 2.734 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 12 . 1675 . 1 1 3 HIS CA C 6.649 0.594 3.780 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 12 . 1676 . 1 1 3 HIS CB C 5.417 1.498 3.839 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 12 . 1677 . 1 1 3 HIS CD2 C 5.963 3.822 4.864 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 12 . 1678 . 1 1 3 HIS CE1 C 5.254 3.428 6.896 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 12 . 1679 . 1 1 3 HIS CG C 5.490 2.544 4.918 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 12 . 1680 . 1 1 3 HIS H H 7.740 2.369 3.288 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 12 . 1681 . 1 1 3 HIS HA H 6.780 0.122 4.754 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 12 . 1682 . 1 1 3 HIS HB2 H 5.312 2.001 2.878 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 12 . 1683 . 1 1 3 HIS HB3 H 4.535 0.880 4.009 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 12 . 1684 . 1 1 3 HIS HD2 H 6.381 4.315 3.999 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 12 . 1685 . 1 1 3 HIS HE1 H 5.009 3.558 7.940 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 12 . 1686 . 1 1 3 HIS HE2 H 6.061 5.300 6.411 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 12 . 1687 . 1 1 3 HIS N N 7.839 1.383 3.482 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 12 . 1688 . 1 1 3 HIS ND1 N 5.047 2.313 6.209 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 12 . 1689 . 1 1 3 HIS NE2 N 5.805 4.366 6.126 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 12 . 1690 . 1 1 3 HIS O O 6.647 -0.273 1.540 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 12 . 1691 . 1 1 4 TRP C C 4.350 -2.861 1.855 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 12 . 1692 . 1 1 4 TRP CA C 5.811 -2.805 2.292 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 12 . 1693 . 1 1 4 TRP CB C 6.203 -4.116 2.974 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 12 . 1694 . 1 1 4 TRP CD1 C 8.408 -5.375 2.628 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 12 . 1695 . 1 1 4 TRP CD2 C 7.065 -5.359 0.835 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 12 . 1696 . 1 1 4 TRP CE2 C 8.234 -6.077 0.515 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 12 . 1697 . 1 1 4 TRP CE3 C 6.074 -5.217 -0.138 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 12 . 1698 . 1 1 4 TRP CG C 7.197 -4.919 2.191 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 12 . 1699 . 1 1 4 TRP CH2 C 7.448 -6.496 -1.673 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 12 . 1700 . 1 1 4 TRP CZ2 C 8.436 -6.650 -0.738 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 12 . 1701 . 1 1 4 TRP CZ3 C 6.275 -5.787 -1.383 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 12 . 1702 . 1 1 4 TRP H H 5.893 -1.799 4.180 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 12 . 1703 . 1 1 4 TRP HA H 6.433 -2.676 1.406 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 12 . 1704 . 1 1 4 TRP HB2 H 6.636 -3.884 3.947 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 12 . 1705 . 1 1 4 TRP HB3 H 5.305 -4.717 3.123 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 12 . 1706 . 1 1 4 TRP HD1 H 8.812 -5.211 3.616 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 12 . 1707 . 1 1 4 TRP HE1 H 9.945 -6.511 1.694 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 12 . 1708 . 1 1 4 TRP HE3 H 5.166 -4.673 0.077 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 12 . 1709 . 1 1 4 TRP HH2 H 7.575 -6.929 -2.654 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 12 . 1710 . 1 1 4 TRP HZ2 H 9.340 -7.196 -0.964 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 12 . 1711 . 1 1 4 TRP HZ3 H 5.516 -5.682 -2.143 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 12 . 1712 . 1 1 4 TRP N N 6.042 -1.678 3.189 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 12 . 1713 . 1 1 4 TRP NE1 N 9.038 -6.073 1.625 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 12 . 1714 . 1 1 4 TRP O O 4.038 -2.685 0.677 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 12 . 1715 . 1 1 5 ALA C C 1.206 -2.807 3.746 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 12 . 1716 . 1 1 5 ALA CA C 2.033 -3.188 2.523 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 12 . 1717 . 1 1 5 ALA CB C 1.666 -4.584 2.048 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 12 . 1718 . 1 1 5 ALA H H 3.781 -3.248 3.757 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 12 . 1719 . 1 1 5 ALA HA H 1.806 -2.483 1.723 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 12 . 1720 . 1 1 5 ALA HB1 H 0.597 -4.628 1.837 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 12 . 1721 . 1 1 5 ALA HB2 H 2.224 -4.818 1.141 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 12 . 1722 . 1 1 5 ALA HB3 H 1.913 -5.309 2.824 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 12 . 1723 . 1 1 5 ALA N N 3.461 -3.110 2.810 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 12 . 1724 . 1 1 5 ALA O O 1.112 -3.572 4.706 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 12 . 1725 . 1 1 6 VAL C C -1.682 -1.479 4.593 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 12 . 1726 . 1 1 6 VAL CA C -0.214 -1.140 4.811 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 12 . 1727 . 1 1 6 VAL CB C -0.069 0.382 4.995 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 12 . 1728 . 1 1 6 VAL CG1 C -0.419 1.110 3.706 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 12 . 1729 . 1 1 6 VAL CG2 C -0.944 0.865 6.141 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 12 . 1730 . 1 1 6 VAL H H 0.725 -1.038 2.890 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 12 . 1731 . 1 1 6 VAL HA H 0.120 -1.629 5.726 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 12 . 1732 . 1 1 6 VAL HB H 0.970 0.601 5.242 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 12 . 1733 . 1 1 6 VAL HG11 H 0.438 1.698 3.376 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 12 . 1734 . 1 1 6 VAL HG12 H -0.678 0.382 2.937 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 12 . 1735 . 1 1 6 VAL HG13 H -1.267 1.772 3.880 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 12 . 1736 . 1 1 6 VAL HG21 H -0.677 0.332 7.053 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 12 . 1737 . 1 1 6 VAL HG22 H -0.792 1.935 6.289 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 12 . 1738 . 1 1 6 VAL HG23 H -1.991 0.677 5.903 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 12 . 1739 . 1 1 6 VAL N N 0.608 -1.621 3.707 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 12 . 1740 . 1 1 6 VAL O O -2.444 -1.629 5.547 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 12 . 1741 . 1 1 7 GLY C C -4.171 -0.775 2.323 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 12 . 1742 . 1 1 7 GLY CA C -3.453 -1.922 3.006 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 12 . 1743 . 1 1 7 GLY H H -1.406 -1.467 2.584 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 12 . 1744 . 1 1 7 GLY HA2 H -3.464 -2.786 2.342 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 12 . 1745 . 1 1 7 GLY HA3 H -3.983 -2.174 3.925 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 12 . 1746 . 1 1 7 GLY N N -2.075 -1.600 3.329 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 12 . 1747 . 1 1 7 GLY O O -5.184 -0.979 1.653 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 12 . 1748 . 1 1 8 HIS C C -3.673 1.867 0.496 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 12 . 1749 . 1 1 8 HIS CA C -4.247 1.618 1.887 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 12 . 1750 . 1 1 8 HIS CB C -4.014 2.844 2.773 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 12 . 1751 . 1 1 8 HIS CD2 C -4.958 5.218 2.304 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 12 . 1752 . 1 1 8 HIS CE1 C -7.077 4.764 2.603 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 12 . 1753 . 1 1 8 HIS CG C -5.076 3.900 2.623 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 12 . 1754 . 1 1 8 HIS H H -2.814 0.536 3.055 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 12 . 1755 . 1 1 8 HIS HA H -5.321 1.455 1.795 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 12 . 1756 . 1 1 8 HIS HB2 H -3.994 2.520 3.813 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 12 . 1757 . 1 1 8 HIS HB3 H -3.047 3.281 2.522 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 12 . 1758 . 1 1 8 HIS HD2 H -4.040 5.749 2.097 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 12 . 1759 . 1 1 8 HIS HE1 H -8.149 4.874 2.675 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 12 . 1760 . 1 1 8 HIS HE2 H -6.482 6.709 2.095 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 12 . 1761 . 1 1 8 HIS N N -3.647 0.434 2.493 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 12 . 1762 . 1 1 8 HIS ND1 N -6.422 3.630 2.808 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 12 . 1763 . 1 1 8 HIS NE2 N -6.234 5.750 2.296 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 12 . 1764 . 1 1 8 HIS O O -3.125 2.936 0.221 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 12 . 1765 . 1 1 9 LEU C C -4.419 0.835 -2.756 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 12 . 1766 . 1 1 9 LEU CA C -3.291 0.985 -1.740 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 12 . 1767 . 1 1 9 LEU CB C -2.219 -0.077 -1.995 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 12 . 1768 . 1 1 9 LEU CD1 C -0.246 1.162 -2.921 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 12 . 1769 . 1 1 9 LEU CD2 C -0.724 -1.173 -3.683 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 12 . 1770 . 1 1 9 LEU CG C -1.335 0.144 -3.222 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 12 . 1771 . 1 1 9 LEU H H -4.257 0.022 -0.089 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 12 . 1772 . 1 1 9 LEU HA H -2.841 1.970 -1.865 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 12 . 1773 . 1 1 9 LEU HB2 H -1.571 -0.112 -1.119 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 12 . 1774 . 1 1 9 LEU HB3 H -2.712 -1.044 -2.097 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 12 . 1775 . 1 1 9 LEU HD11 H -0.701 2.096 -2.593 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 12 . 1776 . 1 1 9 LEU HD12 H 0.343 1.341 -3.821 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 12 . 1777 . 1 1 9 LEU HD13 H 0.403 0.778 -2.133 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 12 . 1778 . 1 1 9 LEU HD21 H -1.519 -1.888 -3.894 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 12 . 1779 . 1 1 9 LEU HD22 H -0.138 -1.004 -4.586 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 12 . 1780 . 1 1 9 LEU HD23 H -0.078 -1.568 -2.899 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 12 . 1781 . 1 1 9 LEU HG H -1.957 0.535 -4.028 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 12 . 1782 . 1 1 9 LEU N N -3.799 0.875 -0.377 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 12 . 1783 . 1 1 9 LEU O O -5.178 -0.133 -2.717 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 12 . 1784 . 1 1 10 MET C C -4.960 2.025 -6.071 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 12 . 1785 . 1 1 10 MET CA C -5.558 1.776 -4.690 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 12 . 1786 . 1 1 10 MET CB C -6.632 2.823 -4.391 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 12 . 1787 . 1 1 10 MET CE C -10.598 3.011 -5.668 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 12 . 1788 . 1 1 10 MET CG C -7.877 2.682 -5.251 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 12 . 1789 . 1 1 10 MET H H -3.870 2.571 -3.640 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 12 . 1790 . 1 1 10 MET HA H -6.025 0.791 -4.688 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 12 . 1791 . 1 1 10 MET HB2 H -6.919 2.741 -3.342 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 12 . 1792 . 1 1 10 MET HB3 H -6.206 3.812 -4.561 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 12 . 1793 . 1 1 10 MET HE1 H -11.540 3.477 -5.379 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 12 . 1794 . 1 1 10 MET HE2 H -10.358 3.284 -6.695 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 12 . 1795 . 1 1 10 MET HE3 H -10.691 1.927 -5.593 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 12 . 1796 . 1 1 10 MET HG2 H -7.660 3.071 -6.246 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 12 . 1797 . 1 1 10 MET HG3 H -8.133 1.625 -5.333 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 12 . 1798 . 1 1 10 MET N N -4.524 1.801 -3.663 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 12 . 1799 . 1 1 10 MET O O -5.098 1.203 -6.978 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 12 . 1800 . 1 1 10 MET SD S -9.292 3.575 -4.579 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 13 . 1801 . 1 1 1 GLY C C 10.879 0.371 7.555 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 13 . 1802 . 1 1 1 GLY CA C 11.715 -0.118 8.722 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 13 . 1803 . 1 1 1 GLY H1 H 13.413 0.340 9.727 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 13 . 1804 . 1 1 1 GLY H2 H 13.471 0.690 8.117 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 13 . 1805 . 1 1 1 GLY H3 H 12.606 1.653 9.139 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 13 . 1806 . 1 1 1 GLY HA2 H 12.031 -1.143 8.527 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 13 . 1807 . 1 1 1 GLY HA3 H 11.102 -0.102 9.623 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 13 . 1808 . 1 1 1 GLY N N 12.890 0.704 8.943 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 13 . 1809 . 1 1 1 GLY O O 10.236 1.417 7.639 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 13 . 1810 . 1 1 2 ASN C C 8.924 -0.948 5.094 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 13 . 1811 . 1 1 2 ASN CA C 10.125 -0.024 5.274 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 13 . 1812 . 1 1 2 ASN CB C 11.018 -0.082 4.033 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 13 . 1813 . 1 1 2 ASN CG C 12.124 0.954 4.068 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 13 . 1814 . 1 1 2 ASN H H 11.433 -1.237 6.458 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 13 . 1815 . 1 1 2 ASN HA H 9.762 0.997 5.393 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 13 . 1816 . 1 1 2 ASN HB2 H 11.468 -1.073 3.972 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 13 . 1817 . 1 1 2 ASN HB3 H 10.405 0.084 3.147 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 13 . 1818 . 1 1 2 ASN HD21 H 12.913 0.220 2.347 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 13 . 1819 . 1 1 2 ASN HD22 H 13.762 1.581 3.044 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 13 . 1820 . 1 1 2 ASN N N 10.886 -0.388 6.464 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 13 . 1821 . 1 1 2 ASN ND2 N 13.003 0.915 3.074 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 13 . 1822 . 1 1 2 ASN O O 9.068 -2.170 5.060 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 13 . 1823 . 1 1 2 ASN OD1 O 12.188 1.780 4.978 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 13 . 1824 . 1 1 3 HIS C C 6.033 -1.053 3.354 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 13 . 1825 . 1 1 3 HIS CA C 6.514 -1.124 4.800 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 13 . 1826 . 1 1 3 HIS CB C 5.421 -0.610 5.740 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 13 . 1827 . 1 1 3 HIS CD2 C 4.980 -1.838 7.984 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 13 . 1828 . 1 1 3 HIS CE1 C 6.598 -0.931 9.147 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 13 . 1829 . 1 1 3 HIS CG C 5.654 -0.968 7.183 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 13 . 1830 . 1 1 3 HIS H H 7.690 0.654 5.014 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 13 . 1831 . 1 1 3 HIS HA H 6.720 -2.166 5.046 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 13 . 1832 . 1 1 3 HIS HB2 H 5.377 0.476 5.656 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 13 . 1833 . 1 1 3 HIS HB3 H 4.463 -1.025 5.425 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 13 . 1834 . 1 1 3 HIS HD2 H 4.129 -2.442 7.703 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 13 . 1835 . 1 1 3 HIS HE1 H 7.263 -0.686 9.962 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 13 . 1836 . 1 1 3 HIS HE2 H 5.325 -2.339 10.040 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 13 . 1837 . 1 1 3 HIS N N 7.741 -0.354 4.978 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 13 . 1838 . 1 1 3 HIS ND1 N 6.673 -0.404 7.932 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 13 . 1839 . 1 1 3 HIS NE2 N 5.591 -1.804 9.226 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 13 . 1840 . 1 1 3 HIS O O 5.833 0.033 2.810 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 13 . 1841 . 1 1 4 TRP C C 3.975 -1.739 1.223 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 13 . 1842 . 1 1 4 TRP CA C 5.394 -2.284 1.356 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 13 . 1843 . 1 1 4 TRP CB C 5.448 -3.726 0.849 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 13 . 1844 . 1 1 4 TRP CD1 C 7.588 -4.930 0.113 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 13 . 1845 . 1 1 4 TRP CD2 C 6.913 -3.313 -1.284 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 13 . 1846 . 1 1 4 TRP CE2 C 8.090 -3.890 -1.799 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 13 . 1847 . 1 1 4 TRP CE3 C 6.304 -2.275 -1.994 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 13 . 1848 . 1 1 4 TRP CG C 6.609 -3.992 -0.061 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 13 . 1849 . 1 1 4 TRP CH2 C 8.052 -2.444 -3.666 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 13 . 1850 . 1 1 4 TRP CZ2 C 8.669 -3.462 -2.991 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 13 . 1851 . 1 1 4 TRP CZ3 C 6.881 -1.851 -3.177 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 13 . 1852 . 1 1 4 TRP H H 6.033 -3.072 3.241 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 13 . 1853 . 1 1 4 TRP HA H 6.057 -1.675 0.741 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 13 . 1854 . 1 1 4 TRP HB2 H 5.523 -4.392 1.709 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 13 . 1855 . 1 1 4 TRP HB3 H 4.524 -3.946 0.314 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 13 . 1856 . 1 1 4 TRP HD1 H 7.650 -5.614 0.946 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 13 . 1857 . 1 1 4 TRP HE1 H 9.298 -5.460 -1.036 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 13 . 1858 . 1 1 4 TRP HE3 H 5.400 -1.812 -1.626 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 13 . 1859 . 1 1 4 TRP HH2 H 8.476 -2.091 -4.594 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 13 . 1860 . 1 1 4 TRP HZ2 H 9.572 -3.917 -3.370 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 13 . 1861 . 1 1 4 TRP HZ3 H 6.421 -1.048 -3.733 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 13 . 1862 . 1 1 4 TRP N N 5.851 -2.215 2.739 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 13 . 1863 . 1 1 4 TRP NE1 N 8.483 -4.873 -0.929 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 13 . 1864 . 1 1 4 TRP O O 3.755 -0.702 0.598 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 13 . 1865 . 1 1 5 ALA C C 1.060 -1.815 3.166 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 13 . 1866 . 1 1 5 ALA CA C 1.621 -2.029 1.764 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 13 . 1867 . 1 1 5 ALA CB C 0.790 -3.061 1.015 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 13 . 1868 . 1 1 5 ALA H H 3.263 -3.288 2.313 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 13 . 1869 . 1 1 5 ALA HA H 1.564 -1.085 1.224 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 13 . 1870 . 1 1 5 ALA HB1 H 0.861 -4.023 1.522 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 13 . 1871 . 1 1 5 ALA HB2 H -0.251 -2.739 0.989 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 13 . 1872 . 1 1 5 ALA HB3 H 1.166 -3.159 -0.004 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 13 . 1873 . 1 1 5 ALA N N 3.017 -2.444 1.815 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 13 . 1874 . 1 1 5 ALA O O 0.533 -2.742 3.783 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 13 . 1875 . 1 1 6 VAL C C -0.768 -0.683 5.164 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 13 . 1876 . 1 1 6 VAL CA C 0.683 -0.252 4.995 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 13 . 1877 . 1 1 6 VAL CB C 0.797 1.258 5.269 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 13 . 1878 . 1 1 6 VAL CG1 C 0.247 1.593 6.648 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 13 . 1879 . 1 1 6 VAL CG2 C 2.240 1.717 5.137 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 13 . 1880 . 1 1 6 VAL H H 1.624 0.128 3.108 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 13 . 1881 . 1 1 6 VAL HA H 1.287 -0.782 5.731 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 13 . 1882 . 1 1 6 VAL HB H 0.201 1.787 4.525 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 13 . 1883 . 1 1 6 VAL HG11 H -0.787 1.255 6.719 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 13 . 1884 . 1 1 6 VAL HG12 H 0.846 1.092 7.409 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 13 . 1885 . 1 1 6 VAL HG13 H 0.289 2.671 6.804 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 13 . 1886 . 1 1 6 VAL HG21 H 2.613 1.468 4.144 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 13 . 1887 . 1 1 6 VAL HG22 H 2.293 2.796 5.285 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 13 . 1888 . 1 1 6 VAL HG23 H 2.851 1.218 5.890 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 13 . 1889 . 1 1 6 VAL N N 1.179 -0.589 3.664 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 13 . 1890 . 1 1 6 VAL O O -1.144 -1.249 6.190 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 13 . 1891 . 1 1 7 GLY C C -3.537 -1.177 2.852 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 13 . 1892 . 1 1 7 GLY CA C -2.987 -0.776 4.206 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 13 . 1893 . 1 1 7 GLY H H -1.223 0.057 3.330 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 13 . 1894 . 1 1 7 GLY HA2 H -3.108 -1.609 4.898 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 13 . 1895 . 1 1 7 GLY HA3 H -3.556 0.077 4.576 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 13 . 1896 . 1 1 7 GLY N N -1.584 -0.410 4.150 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 13 . 1897 . 1 1 7 GLY O O -3.361 -2.314 2.415 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 13 . 1898 . 1 1 8 HIS C C -3.920 0.097 -0.231 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 13 . 1899 . 1 1 8 HIS CA C -4.785 -0.503 0.873 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 13 . 1900 . 1 1 8 HIS CB C -6.202 0.070 0.794 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 13 . 1901 . 1 1 8 HIS CD2 C -7.739 0.425 2.858 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 13 . 1902 . 1 1 8 HIS CE1 C -8.129 -1.681 3.307 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 13 . 1903 . 1 1 8 HIS CG C -7.077 -0.342 1.947 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 13 . 1904 . 1 1 8 HIS H H -4.317 0.675 2.599 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 13 . 1905 . 1 1 8 HIS HA H -4.838 -1.582 0.725 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 13 . 1906 . 1 1 8 HIS HB2 H -6.135 1.158 0.783 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 13 . 1907 . 1 1 8 HIS HB3 H -6.665 -0.263 -0.135 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 13 . 1908 . 1 1 8 HIS HD2 H -7.747 1.504 2.904 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 13 . 1909 . 1 1 8 HIS HE1 H -8.506 -2.575 3.780 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 13 . 1910 . 1 1 8 HIS HE2 H -8.983 -0.179 4.494 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 13 . 1911 . 1 1 8 HIS N N -4.206 -0.240 2.186 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 13 . 1912 . 1 1 8 HIS ND1 N -7.334 -1.669 2.247 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 13 . 1913 . 1 1 8 HIS NE2 N -8.401 -0.440 3.711 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 13 . 1914 . 1 1 8 HIS O O -4.426 0.511 -1.276 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 13 . 1915 . 1 1 9 LEU C C -1.054 -0.417 -1.811 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 13 . 1916 . 1 1 9 LEU CA C -1.677 0.692 -0.969 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 13 . 1917 . 1 1 9 LEU CB C -0.581 1.487 -0.259 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 13 . 1918 . 1 1 9 LEU CD1 C 0.050 3.049 1.598 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 13 . 1919 . 1 1 9 LEU CD2 C -1.507 3.816 -0.204 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 13 . 1920 . 1 1 9 LEU CG C -1.054 2.632 0.638 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 13 . 1921 . 1 1 9 LEU H H -2.259 -0.214 0.882 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 13 . 1922 . 1 1 9 LEU HA H -2.221 1.366 -1.631 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 13 . 1923 . 1 1 9 LEU HB2 H -0.013 0.792 0.359 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 13 . 1924 . 1 1 9 LEU HB3 H 0.088 1.899 -1.015 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 13 . 1925 . 1 1 9 LEU HD11 H 0.361 2.189 2.191 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 13 . 1926 . 1 1 9 LEU HD12 H 0.902 3.426 1.031 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 13 . 1927 . 1 1 9 LEU HD13 H -0.321 3.832 2.260 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 13 . 1928 . 1 1 9 LEU HD21 H -2.296 3.498 -0.885 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 13 . 1929 . 1 1 9 LEU HD22 H -0.663 4.197 -0.779 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 13 . 1930 . 1 1 9 LEU HD23 H -1.885 4.602 0.450 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 13 . 1931 . 1 1 9 LEU HG H -1.904 2.281 1.223 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 13 . 1932 . 1 1 9 LEU N N -2.613 0.142 0.006 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 13 . 1933 . 1 1 9 LEU O O -0.295 -1.242 -1.305 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 13 . 1934 . 1 1 10 MET C C 0.669 -1.322 -4.121 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 13 . 1935 . 1 1 10 MET CA C -0.849 -1.433 -4.013 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 13 . 1936 . 1 1 10 MET CB C -1.482 -1.282 -5.397 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 13 . 1937 . 1 1 10 MET CE C -2.308 -4.864 -7.327 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 13 . 1938 . 1 1 10 MET CG C -1.302 -2.502 -6.285 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 13 . 1939 . 1 1 10 MET H H -2.008 0.279 -3.455 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 13 . 1940 . 1 1 10 MET HA H -1.098 -2.420 -3.624 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 13 . 1941 . 1 1 10 MET HB2 H -2.550 -1.104 -5.269 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 13 . 1942 . 1 1 10 MET HB3 H -1.040 -0.419 -5.893 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 13 . 1943 . 1 1 10 MET HE1 H -2.954 -5.736 -7.219 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 13 . 1944 . 1 1 10 MET HE2 H -2.618 -4.290 -8.200 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 13 . 1945 . 1 1 10 MET HE3 H -1.276 -5.190 -7.454 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 13 . 1946 . 1 1 10 MET HG2 H -1.478 -2.209 -7.320 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 13 . 1947 . 1 1 10 MET HG3 H -0.278 -2.862 -6.188 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 13 . 1948 . 1 1 10 MET N N -1.379 -0.427 -3.099 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 13 . 1949 . 1 1 10 MET O O 1.190 -0.410 -4.765 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 13 . 1950 . 1 1 10 MET SD S -2.435 -3.841 -5.864 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 14 . 1951 . 1 1 1 GLY C C 9.072 3.102 0.082 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 14 . 1952 . 1 1 1 GLY CA C 8.297 3.526 -1.149 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 14 . 1953 . 1 1 1 GLY H1 H 8.608 4.032 -3.087 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 14 . 1954 . 1 1 1 GLY H2 H 9.932 4.222 -2.123 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 14 . 1955 . 1 1 1 GLY H3 H 9.464 2.712 -2.592 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 14 . 1956 . 1 1 1 GLY HA2 H 7.841 4.497 -0.958 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 14 . 1957 . 1 1 1 GLY HA3 H 7.510 2.797 -1.340 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 14 . 1958 . 1 1 1 GLY N N 9.139 3.631 -2.328 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 14 . 1959 . 1 1 1 GLY O O 10.186 2.591 -0.023 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 14 . 1960 . 1 1 2 ASN C C 8.643 1.595 3.000 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 14 . 1961 . 1 1 2 ASN CA C 9.128 2.957 2.511 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 14 . 1962 . 1 1 2 ASN CB C 8.850 4.021 3.575 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 14 . 1963 . 1 1 2 ASN CG C 9.467 5.362 3.226 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 14 . 1964 . 1 1 2 ASN H H 7.568 3.743 1.273 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 14 . 1965 . 1 1 2 ASN HA H 10.204 2.904 2.347 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 14 . 1966 . 1 1 2 ASN HB2 H 7.772 4.147 3.672 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 14 . 1967 . 1 1 2 ASN HB3 H 9.255 3.683 4.529 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 14 . 1968 . 1 1 2 ASN HD21 H 11.300 4.507 3.036 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 14 . 1969 . 1 1 2 ASN HD22 H 11.239 6.231 2.745 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 14 . 1970 . 1 1 2 ASN N N 8.484 3.318 1.253 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 14 . 1971 . 1 1 2 ASN ND2 N 10.773 5.367 2.983 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 14 . 1972 . 1 1 2 ASN O O 9.372 0.605 2.935 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 14 . 1973 . 1 1 2 ASN OD1 O 8.777 6.381 3.175 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 14 . 1974 . 1 1 3 HIS C C 6.480 -0.626 2.836 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 14 . 1975 . 1 1 3 HIS CA C 6.824 0.313 3.987 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 14 . 1976 . 1 1 3 HIS CB C 5.569 0.608 4.810 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 14 . 1977 . 1 1 3 HIS CD2 C 3.509 0.653 3.231 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 14 . 1978 . 1 1 3 HIS CE1 C 3.209 2.822 3.192 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 14 . 1979 . 1 1 3 HIS CG C 4.460 1.237 4.013 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 14 . 1980 . 1 1 3 HIS H H 6.860 2.402 3.516 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 14 . 1981 . 1 1 3 HIS HA H 7.553 -0.179 4.631 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 14 . 1982 . 1 1 3 HIS HB2 H 5.204 -0.329 5.229 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 14 . 1983 . 1 1 3 HIS HB3 H 5.836 1.278 5.628 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 14 . 1984 . 1 1 3 HIS HD2 H 3.390 -0.405 3.046 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 14 . 1985 . 1 1 3 HIS HE1 H 2.804 3.797 2.966 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 14 . 1986 . 1 1 3 HIS HE2 H 1.932 1.565 2.101 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 14 . 1987 . 1 1 3 HIS N N 7.408 1.554 3.489 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 14 . 1988 . 1 1 3 HIS ND1 N 4.255 2.605 3.977 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 14 . 1989 . 1 1 3 HIS NE2 N 2.724 1.672 2.718 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 14 . 1990 . 1 1 3 HIS O O 6.577 -0.253 1.668 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 14 . 1991 . 1 1 4 TRP C C 4.274 -2.668 1.724 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 14 . 1992 . 1 1 4 TRP CA C 5.724 -2.840 2.169 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 14 . 1993 . 1 1 4 TRP CB C 5.936 -4.252 2.717 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 14 . 1994 . 1 1 4 TRP CD1 C 8.146 -5.546 2.609 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 14 . 1995 . 1 1 4 TRP CD2 C 7.142 -5.272 0.627 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 14 . 1996 . 1 1 4 TRP CE2 C 8.336 -5.993 0.429 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 14 . 1997 . 1 1 4 TRP CE3 C 6.340 -4.982 -0.481 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 14 . 1998 . 1 1 4 TRP CG C 7.039 -4.997 2.028 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 14 . 1999 . 1 1 4 TRP CH2 C 7.942 -6.125 -1.895 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 14 . 2000 . 1 1 4 TRP CZ2 C 8.746 -6.424 -0.829 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 14 . 2001 . 1 1 4 TRP CZ3 C 6.749 -5.410 -1.729 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 14 . 2002 . 1 1 4 TRP H H 6.021 -2.093 4.152 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 14 . 2003 . 1 1 4 TRP HA H 6.371 -2.703 1.303 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 14 . 2004 . 1 1 4 TRP HB2 H 6.169 -4.185 3.780 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 14 . 2005 . 1 1 4 TRP HB3 H 5.010 -4.814 2.594 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 14 . 2006 . 1 1 4 TRP HD1 H 8.371 -5.513 3.665 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 14 . 2007 . 1 1 4 TRP HE1 H 9.804 -6.623 1.828 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 14 . 2008 . 1 1 4 TRP HE3 H 5.418 -4.432 -0.363 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 14 . 2009 . 1 1 4 TRP HH2 H 8.232 -6.447 -2.884 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 14 . 2010 . 1 1 4 TRP HZ2 H 9.666 -6.975 -0.959 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 14 . 2011 . 1 1 4 TRP HZ3 H 6.137 -5.190 -2.592 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 14 . 2012 . 1 1 4 TRP N N 6.080 -1.847 3.175 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 14 . 2013 . 1 1 4 TRP NE1 N 8.931 -6.146 1.655 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 14 . 2014 . 1 1 4 TRP O O 4.007 -2.225 0.608 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 14 . 2015 . 1 1 5 ALA C C 1.103 -2.734 3.578 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 14 . 2016 . 1 1 5 ALA CA C 1.922 -2.902 2.304 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 14 . 2017 . 1 1 5 ALA CB C 1.446 -4.120 1.524 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 14 . 2018 . 1 1 5 ALA H H 3.629 -3.379 3.505 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 14 . 2019 . 1 1 5 ALA HA H 1.776 -2.018 1.683 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 14 . 2020 . 1 1 5 ALA HB1 H 0.383 -4.019 1.305 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 14 . 2021 . 1 1 5 ALA HB2 H 2.003 -4.193 0.590 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 14 . 2022 . 1 1 5 ALA HB3 H 1.611 -5.019 2.117 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 14 . 2023 . 1 1 5 ALA N N 3.345 -3.020 2.604 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 14 . 2024 . 1 1 5 ALA O O 0.864 -3.697 4.306 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 14 . 2025 . 1 1 6 VAL C C -1.584 -1.561 4.811 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 14 . 2026 . 1 1 6 VAL CA C -0.120 -1.208 5.029 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 14 . 2027 . 1 1 6 VAL CB C -0.012 0.277 5.419 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 14 . 2028 . 1 1 6 VAL CG1 C -0.421 1.167 4.254 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 14 . 2029 . 1 1 6 VAL CG2 C -0.865 0.568 6.645 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 14 . 2030 . 1 1 6 VAL H H 0.905 -0.754 3.205 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 14 . 2031 . 1 1 6 VAL HA H 0.260 -1.808 5.855 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 14 . 2032 . 1 1 6 VAL HB H 1.027 0.491 5.666 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 14 . 2033 . 1 1 6 VAL HG11 H 0.202 0.942 3.388 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 14 . 2034 . 1 1 6 VAL HG12 H -1.466 0.984 4.007 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 14 . 2035 . 1 1 6 VAL HG13 H -0.291 2.213 4.533 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 14 . 2036 . 1 1 6 VAL HG21 H -0.556 -0.079 7.466 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 14 . 2037 . 1 1 6 VAL HG22 H -0.737 1.610 6.937 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 14 . 2038 . 1 1 6 VAL HG23 H -1.914 0.383 6.411 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 14 . 2039 . 1 1 6 VAL N N 0.674 -1.503 3.842 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 14 . 2040 . 1 1 6 VAL O O -2.314 -1.846 5.760 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 14 . 2041 . 1 1 7 GLY C C -4.164 -0.664 2.725 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 14 . 2042 . 1 1 7 GLY CA C -3.391 -1.865 3.232 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 14 . 2043 . 1 1 7 GLY H H -1.370 -1.304 2.811 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 14 . 2044 . 1 1 7 GLY HA2 H -3.405 -2.643 2.468 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 14 . 2045 . 1 1 7 GLY HA3 H -3.880 -2.242 4.130 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 14 . 2046 . 1 1 7 GLY N N -2.012 -1.544 3.552 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 14 . 2047 . 1 1 7 GLY O O -5.390 -0.614 2.833 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 14 . 2048 . 1 1 8 HIS C C -3.761 1.695 0.168 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 14 . 2049 . 1 1 8 HIS CA C -4.073 1.520 1.651 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 14 . 2050 . 1 1 8 HIS CB C -3.597 2.747 2.431 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 14 . 2051 . 1 1 8 HIS CD2 C -4.171 5.138 1.602 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 14 . 2052 . 1 1 8 HIS CE1 C -6.234 5.222 2.330 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 14 . 2053 . 1 1 8 HIS CG C -4.459 3.960 2.222 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 14 . 2054 . 1 1 8 HIS H H -2.443 0.211 2.117 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 14 . 2055 . 1 1 8 HIS HA H -5.152 1.430 1.770 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 14 . 2056 . 1 1 8 HIS HB2 H -3.597 2.502 3.493 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 14 . 2057 . 1 1 8 HIS HB3 H -2.578 2.983 2.125 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 14 . 2058 . 1 1 8 HIS HD2 H -3.234 5.407 1.138 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 14 . 2059 . 1 1 8 HIS HE1 H -7.231 5.576 2.546 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 14 . 2060 . 1 1 8 HIS HE2 H -5.413 6.861 1.312 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 14 . 2061 . 1 1 8 HIS N N -3.447 0.310 2.174 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 14 . 2062 . 1 1 8 HIS ND1 N -5.767 4.031 2.676 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 14 . 2063 . 1 1 8 HIS NE2 N -5.307 5.926 1.680 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 14 . 2064 . 1 1 8 HIS O O -3.638 2.818 -0.323 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 14 . 2065 . 1 1 9 LEU C C -4.616 0.581 -2.795 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 14 . 2066 . 1 1 9 LEU CA C -3.333 0.609 -1.969 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 14 . 2067 . 1 1 9 LEU CB C -2.442 -0.575 -2.347 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 14 . 2068 . 1 1 9 LEU CD1 C -0.469 0.659 -3.277 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 14 . 2069 . 1 1 9 LEU CD2 C -0.571 0.127 -0.835 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 14 . 2070 . 1 1 9 LEU CG C -0.935 -0.346 -2.234 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 14 . 2071 . 1 1 9 LEU H H -3.745 -0.313 -0.080 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 14 . 2072 . 1 1 9 LEU HA H -2.797 1.531 -2.191 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 14 . 2073 . 1 1 9 LEU HB2 H -2.709 -1.421 -1.714 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 14 . 2074 . 1 1 9 LEU HB3 H -2.662 -0.840 -3.382 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 14 . 2075 . 1 1 9 LEU HD11 H -0.738 0.304 -4.271 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 14 . 2076 . 1 1 9 LEU HD12 H -0.947 1.621 -3.094 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 14 . 2077 . 1 1 9 LEU HD13 H 0.613 0.774 -3.213 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 14 . 2078 . 1 1 9 LEU HD21 H 0.507 0.056 -0.696 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 14 . 2079 . 1 1 9 LEU HD22 H -1.074 -0.500 -0.098 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 14 . 2080 . 1 1 9 LEU HD23 H -0.888 1.162 -0.707 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 14 . 2081 . 1 1 9 LEU HG H -0.429 -1.293 -2.420 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 14 . 2082 . 1 1 9 LEU N N -3.633 0.578 -0.541 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 14 . 2083 . 1 1 9 LEU O O -5.662 0.141 -2.320 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 14 . 2084 . 1 1 10 MET C C -5.234 1.060 -6.386 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 14 . 2085 . 1 1 10 MET CA C -5.677 1.078 -4.927 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 14 . 2086 . 1 1 10 MET CB C -6.532 2.318 -4.655 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 14 . 2087 . 1 1 10 MET CE C -7.168 6.028 -5.381 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 14 . 2088 . 1 1 10 MET CG C -5.841 3.623 -5.015 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 14 . 2089 . 1 1 10 MET H H -3.637 1.402 -4.364 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 14 . 2090 . 1 1 10 MET HA H -6.283 0.192 -4.737 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 14 . 2091 . 1 1 10 MET HB2 H -7.448 2.240 -5.241 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 14 . 2092 . 1 1 10 MET HB3 H -6.793 2.339 -3.597 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 14 . 2093 . 1 1 10 MET HE1 H -7.598 6.935 -4.955 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 14 . 2094 . 1 1 10 MET HE2 H -7.948 5.464 -5.894 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 14 . 2095 . 1 1 10 MET HE3 H -6.386 6.296 -6.092 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 14 . 2096 . 1 1 10 MET HG2 H -4.772 3.520 -4.827 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 14 . 2097 . 1 1 10 MET HG3 H -5.995 3.818 -6.076 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 14 . 2098 . 1 1 10 MET N N -4.525 1.053 -4.033 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 14 . 2099 . 1 1 10 MET O O -4.042 1.135 -6.685 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 14 . 2100 . 1 1 10 MET SD S -6.469 5.025 -4.072 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 15 . 2101 . 1 1 1 GLY C C 10.976 -1.855 6.511 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 15 . 2102 . 1 1 1 GLY CA C 12.005 -1.135 7.360 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 15 . 2103 . 1 1 1 GLY H1 H 12.982 -1.321 9.124 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 15 . 2104 . 1 1 1 GLY H2 H 12.655 -2.757 8.383 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 15 . 2105 . 1 1 1 GLY H3 H 11.448 -1.925 9.139 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 15 . 2106 . 1 1 1 GLY HA2 H 11.633 -0.139 7.598 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 15 . 2107 . 1 1 1 GLY HA3 H 12.927 -1.041 6.787 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 15 . 2108 . 1 1 1 GLY N N 12.295 -1.838 8.596 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 15 . 2109 . 1 1 1 GLY O O 11.240 -2.194 5.357 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 15 . 2110 . 1 1 2 ASN C C 7.548 -1.843 6.132 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 15 . 2111 . 1 1 2 ASN CA C 8.728 -2.778 6.371 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 15 . 2112 . 1 1 2 ASN CB C 8.268 -4.006 7.161 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 15 . 2113 . 1 1 2 ASN CG C 9.395 -4.993 7.403 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 15 . 2114 . 1 1 2 ASN H H 9.646 -1.789 8.033 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 15 . 2115 . 1 1 2 ASN HA H 9.109 -3.109 5.406 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 15 . 2116 . 1 1 2 ASN HB2 H 7.869 -3.680 8.122 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 15 . 2117 . 1 1 2 ASN HB3 H 7.478 -4.506 6.601 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 15 . 2118 . 1 1 2 ASN HD21 H 9.199 -5.728 5.520 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 15 . 2119 . 1 1 2 ASN HD22 H 10.447 -6.473 6.494 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 15 . 2120 . 1 1 2 ASN N N 9.800 -2.092 7.082 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 15 . 2121 . 1 1 2 ASN ND2 N 9.705 -5.795 6.392 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 15 . 2122 . 1 1 2 ASN O O 6.700 -1.657 7.006 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 15 . 2123 . 1 1 2 ASN OD1 O 9.978 -5.031 8.485 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 15 . 2124 . 1 1 3 HIS C C 5.884 -0.646 3.189 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 15 . 2125 . 1 1 3 HIS CA C 6.420 -0.340 4.585 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 15 . 2126 . 1 1 3 HIS CB C 6.908 1.109 4.649 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 15 . 2127 . 1 1 3 HIS CD2 C 6.378 2.230 6.931 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 15 . 2128 . 1 1 3 HIS CE1 C 8.336 1.940 7.869 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 15 . 2129 . 1 1 3 HIS CG C 7.191 1.586 6.047 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 15 . 2130 . 1 1 3 HIS H H 8.221 -1.449 4.264 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 15 . 2131 . 1 1 3 HIS HA H 5.608 -0.464 5.302 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 15 . 2132 . 1 1 3 HIS HB2 H 7.825 1.190 4.065 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 15 . 2133 . 1 1 3 HIS HB3 H 6.151 1.755 4.204 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 15 . 2134 . 1 1 3 HIS HD2 H 5.350 2.517 6.766 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 15 . 2135 . 1 1 3 HIS HE1 H 9.141 1.958 8.589 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 15 . 2136 . 1 1 3 HIS HE2 H 6.798 2.905 8.922 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 15 . 2137 . 1 1 3 HIS N N 7.496 -1.255 4.940 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 15 . 2138 . 1 1 3 HIS ND1 N 8.423 1.412 6.657 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 15 . 2139 . 1 1 3 HIS NE2 N 7.119 2.448 8.080 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 15 . 2140 . 1 1 3 HIS O O 5.427 0.249 2.478 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 15 . 2141 . 1 1 4 TRP C C 4.010 -1.944 1.289 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 15 . 2142 . 1 1 4 TRP CA C 5.469 -2.338 1.491 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 15 . 2143 . 1 1 4 TRP CB C 5.628 -3.851 1.332 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 15 . 2144 . 1 1 4 TRP CD1 C 7.850 -4.989 0.752 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 15 . 2145 . 1 1 4 TRP CD2 C 6.904 -3.892 -0.956 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 15 . 2146 . 1 1 4 TRP CE2 C 8.110 -4.466 -1.404 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 15 . 2147 . 1 1 4 TRP CE3 C 6.134 -3.153 -1.859 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 15 . 2148 . 1 1 4 TRP CG C 6.757 -4.237 0.426 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 15 . 2149 . 1 1 4 TRP CH2 C 7.787 -3.595 -3.575 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 15 . 2150 . 1 1 4 TRP CZ2 C 8.560 -4.324 -2.713 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 15 . 2151 . 1 1 4 TRP CZ3 C 6.584 -3.012 -3.158 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 15 . 2152 . 1 1 4 TRP H H 6.335 -2.603 3.431 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 15 . 2153 . 1 1 4 TRP HA H 6.070 -1.845 0.728 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 15 . 2154 . 1 1 4 TRP HB2 H 5.798 -4.292 2.314 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 15 . 2155 . 1 1 4 TRP HB3 H 4.702 -4.254 0.922 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 15 . 2156 . 1 1 4 TRP HD1 H 8.042 -5.410 1.728 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 15 . 2157 . 1 1 4 TRP HE1 H 9.540 -5.642 -0.362 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 15 . 2158 . 1 1 4 TRP HE3 H 5.205 -2.700 -1.547 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 15 . 2159 . 1 1 4 TRP HH2 H 8.111 -3.467 -4.598 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 15 . 2160 . 1 1 4 TRP HZ2 H 9.488 -4.772 -3.037 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 15 . 2161 . 1 1 4 TRP HZ3 H 5.997 -2.443 -3.863 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 15 . 2162 . 1 1 4 TRP N N 5.947 -1.914 2.802 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 15 . 2163 . 1 1 4 TRP NE1 N 8.668 -5.131 -0.342 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 15 . 2164 . 1 1 4 TRP O O 3.701 -1.067 0.485 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 15 . 2165 . 1 1 5 ALA C C 1.121 -1.897 3.280 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 15 . 2166 . 1 1 5 ALA CA C 1.690 -2.314 1.928 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 15 . 2167 . 1 1 5 ALA CB C 0.946 -3.527 1.391 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 15 . 2168 . 1 1 5 ALA H H 3.436 -3.310 2.668 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 15 . 2169 . 1 1 5 ALA HA H 1.552 -1.489 1.229 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 15 . 2170 . 1 1 5 ALA HB1 H -0.118 -3.301 1.324 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 15 . 2171 . 1 1 5 ALA HB2 H 1.327 -3.778 0.402 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 15 . 2172 . 1 1 5 ALA HB3 H 1.096 -4.372 2.063 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 15 . 2173 . 1 1 5 ALA N N 3.118 -2.598 2.026 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 15 . 2174 . 1 1 5 ALA O O 0.680 -2.736 4.065 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 15 . 2175 . 1 1 6 VAL C C -0.789 -0.579 5.078 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 15 . 2176 . 1 1 6 VAL CA C 0.617 -0.064 4.803 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 15 . 2177 . 1 1 6 VAL CB C 0.599 1.475 4.798 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 15 . 2178 . 1 1 6 VAL CG1 C -0.198 1.996 3.612 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 15 . 2179 . 1 1 6 VAL CG2 C 0.033 2.004 6.107 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 15 . 2180 . 1 1 6 VAL H H 1.510 0.046 2.860 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 15 . 2181 . 1 1 6 VAL HA H 1.269 -0.398 5.611 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 15 . 2182 . 1 1 6 VAL HB H 1.626 1.829 4.702 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 15 . 2183 . 1 1 6 VAL HG11 H 0.172 2.981 3.329 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 15 . 2184 . 1 1 6 VAL HG12 H -0.086 1.311 2.771 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 15 . 2185 . 1 1 6 VAL HG13 H -1.251 2.068 3.885 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 15 . 2186 . 1 1 6 VAL HG21 H 0.027 3.094 6.087 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 15 . 2187 . 1 1 6 VAL HG22 H -0.985 1.638 6.237 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 15 . 2188 . 1 1 6 VAL HG23 H 0.651 1.660 6.936 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 15 . 2189 . 1 1 6 VAL N N 1.134 -0.593 3.546 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 15 . 2190 . 1 1 6 VAL O O -1.154 -0.836 6.225 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 15 . 2191 . 1 1 7 GLY C C -3.645 -1.369 2.836 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 15 . 2192 . 1 1 7 GLY CA C -2.938 -1.210 4.166 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 15 . 2193 . 1 1 7 GLY H H -1.227 -0.497 3.100 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 15 . 2194 . 1 1 7 GLY HA2 H -2.912 -2.178 4.666 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 15 . 2195 . 1 1 7 GLY HA3 H -3.499 -0.508 4.783 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 15 . 2196 . 1 1 7 GLY N N -1.578 -0.726 4.019 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 15 . 2197 . 1 1 7 GLY O O -3.886 -2.489 2.382 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 15 . 2198 . 1 1 8 HIS C C -4.024 0.713 -0.054 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 15 . 2199 . 1 1 8 HIS CA C -4.667 -0.268 0.919 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 15 . 2200 . 1 1 8 HIS CB C -6.147 0.071 1.102 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 15 . 2201 . 1 1 8 HIS CD2 C -6.336 1.554 3.226 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 15 . 2202 . 1 1 8 HIS CE1 C -6.854 3.434 2.234 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 15 . 2203 . 1 1 8 HIS CG C -6.386 1.334 1.882 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 15 . 2204 . 1 1 8 HIS H H -3.758 0.641 2.633 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 15 . 2205 . 1 1 8 HIS HA H -4.591 -1.272 0.501 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 15 . 2206 . 1 1 8 HIS HB2 H -6.599 0.185 0.116 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 15 . 2207 . 1 1 8 HIS HB3 H -6.635 -0.757 1.617 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 15 . 2208 . 1 1 8 HIS HD2 H -6.106 0.822 3.987 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 15 . 2209 . 1 1 8 HIS HE1 H -7.111 4.471 2.070 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 15 . 2210 . 1 1 8 HIS HE2 H -6.679 3.361 4.324 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 15 . 2211 . 1 1 8 HIS N N -3.982 -0.247 2.208 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 15 . 2212 . 1 1 8 HIS ND1 N -6.714 2.534 1.273 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 15 . 2213 . 1 1 8 HIS NE2 N -6.635 2.888 3.433 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 15 . 2214 . 1 1 8 HIS O O -4.626 1.723 -0.424 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 15 . 2215 . 1 1 9 LEU C C -2.823 1.400 -2.717 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 15 . 2216 . 1 1 9 LEU CA C -2.071 1.269 -1.396 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 15 . 2217 . 1 1 9 LEU CB C -0.669 0.710 -1.648 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 15 . 2218 . 1 1 9 LEU CD1 C -0.642 -0.657 -3.749 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 15 . 2219 . 1 1 9 LEU CD2 C 0.645 -1.422 -1.745 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 15 . 2220 . 1 1 9 LEU CG C -0.605 -0.702 -2.229 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 15 . 2221 . 1 1 9 LEU H H -2.356 -0.429 -0.126 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 15 . 2222 . 1 1 9 LEU HA H -1.974 2.260 -0.952 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 15 . 2223 . 1 1 9 LEU HB2 H -0.164 1.380 -2.343 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 15 . 2224 . 1 1 9 LEU HB3 H -0.122 0.718 -0.705 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 15 . 2225 . 1 1 9 LEU HD11 H -1.543 -0.139 -4.076 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 15 . 2226 . 1 1 9 LEU HD12 H -0.644 -1.673 -4.143 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 15 . 2227 . 1 1 9 LEU HD13 H 0.236 -0.127 -4.118 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 15 . 2228 . 1 1 9 LEU HD21 H 0.653 -1.444 -0.655 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 15 . 2229 . 1 1 9 LEU HD22 H 0.649 -2.442 -2.129 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 15 . 2230 . 1 1 9 LEU HD23 H 1.529 -0.895 -2.104 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 15 . 2231 . 1 1 9 LEU HG H -1.477 -1.257 -1.881 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 15 . 2232 . 1 1 9 LEU N N -2.797 0.413 -0.466 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 15 . 2233 . 1 1 9 LEU O O -2.731 2.421 -3.398 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 15 . 2234 . 1 1 10 MET C C -5.253 1.579 -4.381 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 15 . 2235 . 1 1 10 MET CA C -4.341 0.358 -4.310 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 15 . 2236 . 1 1 10 MET CB C -5.171 -0.921 -4.418 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 15 . 2237 . 1 1 10 MET CE C -8.485 -2.638 -3.652 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 15 . 2238 . 1 1 10 MET CG C -6.238 -1.046 -3.343 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 15 . 2239 . 1 1 10 MET H H -3.604 -0.451 -2.470 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 15 . 2240 . 1 1 10 MET HA H -3.647 0.394 -5.151 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 15 . 2241 . 1 1 10 MET HB2 H -5.661 -0.933 -5.392 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 15 . 2242 . 1 1 10 MET HB3 H -4.503 -1.780 -4.351 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 15 . 2243 . 1 1 10 MET HE1 H -8.960 -3.615 -3.563 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 15 . 2244 . 1 1 10 MET HE2 H -8.510 -2.316 -4.693 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 15 . 2245 . 1 1 10 MET HE3 H -9.021 -1.916 -3.036 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 15 . 2246 . 1 1 10 MET HG2 H -5.838 -0.666 -2.403 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 15 . 2247 . 1 1 10 MET HG3 H -7.097 -0.442 -3.632 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 15 . 2248 . 1 1 10 MET N N -3.569 0.359 -3.072 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 15 . 2249 . 1 1 10 MET O O -5.370 2.219 -5.427 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 15 . 2250 . 1 1 10 MET SD S -6.784 -2.748 -3.101 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 16 . 2251 . 1 1 1 GLY C C 9.276 3.431 5.375 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 16 . 2252 . 1 1 1 GLY CA C 8.978 4.226 6.632 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 16 . 2253 . 1 1 1 GLY H1 H 9.841 4.559 8.434 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 16 . 2254 . 1 1 1 GLY H2 H 9.393 2.991 8.183 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 16 . 2255 . 1 1 1 GLY H3 H 10.730 3.597 7.431 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 16 . 2256 . 1 1 1 GLY HA2 H 7.929 4.085 6.894 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 16 . 2257 . 1 1 1 GLY HA3 H 9.155 5.282 6.433 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 16 . 2258 . 1 1 1 GLY N N 9.798 3.812 7.755 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 16 . 2259 . 1 1 1 GLY O O 9.479 4.005 4.306 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 16 . 2260 . 1 1 2 ASN C C 8.589 0.079 4.317 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 16 . 2261 . 1 1 2 ASN CA C 9.581 1.236 4.370 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 16 . 2262 . 1 1 2 ASN CB C 11.009 0.694 4.455 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 16 . 2263 . 1 1 2 ASN CG C 12.051 1.792 4.355 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 16 . 2264 . 1 1 2 ASN H H 9.126 1.699 6.410 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 16 . 2265 . 1 1 2 ASN HA H 9.484 1.817 3.453 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 16 . 2266 . 1 1 2 ASN HB2 H 11.133 0.180 5.408 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 16 . 2267 . 1 1 2 ASN HB3 H 11.167 -0.019 3.645 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 16 . 2268 . 1 1 2 ASN HD21 H 12.016 2.052 6.369 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 16 . 2269 . 1 1 2 ASN HD22 H 13.114 3.095 5.494 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 16 . 2270 . 1 1 2 ASN N N 9.303 2.110 5.504 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 16 . 2271 . 1 1 2 ASN ND2 N 12.423 2.359 5.497 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 16 . 2272 . 1 1 2 ASN O O 8.941 -1.040 3.942 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 16 . 2273 . 1 1 2 ASN OD1 O 12.515 2.125 3.265 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 16 . 2274 . 1 1 3 HIS C C 5.755 -0.876 3.285 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 16 . 2275 . 1 1 3 HIS CA C 6.300 -0.663 4.694 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 16 . 2276 . 1 1 3 HIS CB C 5.167 -0.264 5.636 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 16 . 2277 . 1 1 3 HIS CD2 C 6.310 -1.453 7.643 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 16 . 2278 . 1 1 3 HIS CE1 C 5.263 -0.401 9.251 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 16 . 2279 . 1 1 3 HIS CG C 5.443 -0.561 7.084 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 16 . 2280 . 1 1 3 HIS H H 7.118 1.292 4.999 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 16 . 2281 . 1 1 3 HIS HA H 6.729 -1.601 5.046 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 16 . 2282 . 1 1 3 HIS HB2 H 4.981 0.804 5.528 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 16 . 2283 . 1 1 3 HIS HB3 H 4.269 -0.807 5.340 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 16 . 2284 . 1 1 3 HIS HD2 H 6.971 -2.123 7.113 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 16 . 2285 . 1 1 3 HIS HE1 H 4.946 -0.089 10.235 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 16 . 2286 . 1 1 3 HIS HE2 H 6.693 -1.865 9.710 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 16 . 2287 . 1 1 3 HIS N N 7.345 0.354 4.699 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 16 . 2288 . 1 1 3 HIS ND1 N 4.791 0.094 8.116 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 16 . 2289 . 1 1 3 HIS NE2 N 6.183 -1.338 9.015 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 16 . 2290 . 1 1 3 HIS O O 5.235 0.049 2.663 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 16 . 2291 . 1 1 4 TRP C C 3.946 -2.010 1.271 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 16 . 2292 . 1 1 4 TRP CA C 5.399 -2.436 1.452 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 16 . 2293 . 1 1 4 TRP CB C 5.537 -3.939 1.199 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 16 . 2294 . 1 1 4 TRP CD1 C 7.719 -5.078 0.484 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 16 . 2295 . 1 1 4 TRP CD2 C 6.759 -3.837 -1.116 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 16 . 2296 . 1 1 4 TRP CE2 C 7.941 -4.403 -1.632 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 16 . 2297 . 1 1 4 TRP CE3 C 5.989 -3.017 -1.942 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 16 . 2298 . 1 1 4 TRP CG C 6.636 -4.281 0.239 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 16 . 2299 . 1 1 4 TRP CH2 C 7.591 -3.366 -3.726 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 16 . 2300 . 1 1 4 TRP CZ2 C 8.367 -4.174 -2.939 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 16 . 2301 . 1 1 4 TRP CZ3 C 6.411 -2.789 -3.238 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 16 . 2302 . 1 1 4 TRP H H 6.313 -2.820 3.350 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 16 . 2303 . 1 1 4 TRP HA H 6.010 -1.905 0.722 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 16 . 2304 . 1 1 4 TRP HB2 H 5.742 -4.432 2.150 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 16 . 2305 . 1 1 4 TRP HB3 H 4.594 -4.317 0.804 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 16 . 2306 . 1 1 4 TRP HD1 H 7.925 -5.574 1.421 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 16 . 2307 . 1 1 4 TRP HE1 H 9.365 -5.683 -0.719 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 16 . 2308 . 1 1 4 TRP HE3 H 5.078 -2.567 -1.574 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 16 . 2309 . 1 1 4 TRP HH2 H 7.894 -3.170 -4.744 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 16 . 2310 . 1 1 4 TRP HZ2 H 9.276 -4.617 -3.317 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 16 . 2311 . 1 1 4 TRP HZ3 H 5.822 -2.156 -3.886 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 16 . 2312 . 1 1 4 TRP N N 5.878 -2.102 2.788 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 16 . 2313 . 1 1 4 TRP NE1 N 8.507 -5.156 -0.639 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 16 . 2314 . 1 1 4 TRP O O 3.655 -1.063 0.542 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 16 . 2315 . 1 1 5 ALA C C 1.044 -2.078 3.232 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 16 . 2316 . 1 1 5 ALA CA C 1.617 -2.404 1.857 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 16 . 2317 . 1 1 5 ALA CB C 0.861 -3.567 1.229 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 16 . 2318 . 1 1 5 ALA H H 3.343 -3.481 2.524 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 16 . 2319 . 1 1 5 ALA HA H 1.494 -1.530 1.218 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 16 . 2320 . 1 1 5 ALA HB1 H 0.638 -4.311 1.994 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 16 . 2321 . 1 1 5 ALA HB2 H -0.069 -3.203 0.794 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 16 . 2322 . 1 1 5 ALA HB3 H 1.474 -4.020 0.450 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 16 . 2323 . 1 1 5 ALA N N 3.039 -2.713 1.942 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 16 . 2324 . 1 1 5 ALA O O 0.580 -2.966 3.949 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 16 . 2325 . 1 1 6 VAL C C -0.860 -0.860 5.107 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 16 . 2326 . 1 1 6 VAL CA C 0.559 -0.356 4.884 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 16 . 2327 . 1 1 6 VAL CB C 0.573 1.178 4.995 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 16 . 2328 . 1 1 6 VAL CG1 C -0.203 1.804 3.844 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 16 . 2329 . 1 1 6 VAL CG2 C 0.004 1.621 6.334 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 16 . 2330 . 1 1 6 VAL H H 1.474 -0.120 2.961 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 16 . 2331 . 1 1 6 VAL HA H 1.195 -0.763 5.670 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 16 . 2332 . 1 1 6 VAL HB H 1.608 1.517 4.933 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 16 . 2333 . 1 1 6 VAL HG11 H 0.193 2.798 3.636 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 16 . 2334 . 1 1 6 VAL HG12 H -0.104 1.179 2.957 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 16 . 2335 . 1 1 6 VAL HG13 H -1.256 1.883 4.117 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 16 . 2336 . 1 1 6 VAL HG21 H 0.575 1.161 7.141 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 16 . 2337 . 1 1 6 VAL HG22 H -1.039 1.312 6.405 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 16 . 2338 . 1 1 6 VAL HG23 H 0.068 2.706 6.416 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 16 . 2339 . 1 1 6 VAL N N 1.078 -0.801 3.594 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 16 . 2340 . 1 1 6 VAL O O -1.234 -1.221 6.223 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 16 . 2341 . 1 1 7 GLY C C -3.853 -0.966 2.929 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 16 . 2342 . 1 1 7 GLY CA C -3.023 -1.346 4.139 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 16 . 2343 . 1 1 7 GLY H H -1.292 -0.577 3.146 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 16 . 2344 . 1 1 7 GLY HA2 H -3.020 -2.432 4.234 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 16 . 2345 . 1 1 7 GLY HA3 H -3.478 -0.913 5.030 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 16 . 2346 . 1 1 7 GLY N N -1.651 -0.884 4.039 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 16 . 2347 . 1 1 7 GLY O O -4.839 -1.633 2.610 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 16 . 2348 . 1 1 8 HIS C C -3.665 -0.129 -0.184 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 16 . 2349 . 1 1 8 HIS CA C -4.171 0.575 1.072 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 16 . 2350 . 1 1 8 HIS CB C -4.013 2.087 0.920 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 16 . 2351 . 1 1 8 HIS CD2 C -1.438 1.844 0.702 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 16 . 2352 . 1 1 8 HIS CE1 C -0.910 3.945 1.020 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 16 . 2353 . 1 1 8 HIS CG C -2.584 2.553 0.900 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 16 . 2354 . 1 1 8 HIS H H -2.639 0.612 2.567 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 16 . 2355 . 1 1 8 HIS HA H -5.230 0.348 1.194 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 16 . 2356 . 1 1 8 HIS HB2 H -4.495 2.397 -0.007 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 16 . 2357 . 1 1 8 HIS HB3 H -4.520 2.570 1.755 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 16 . 2358 . 1 1 8 HIS HD2 H -1.364 0.782 0.519 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 16 . 2359 . 1 1 8 HIS HE1 H -0.335 4.852 1.134 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 16 . 2360 . 1 1 8 HIS HE2 H 0.595 2.523 0.676 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 16 . 2361 . 1 1 8 HIS N N -3.456 0.107 2.254 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 16 . 2362 . 1 1 8 HIS ND1 N -2.232 3.878 1.098 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 16 . 2363 . 1 1 8 HIS NE2 N -0.386 2.740 0.780 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 16 . 2364 . 1 1 8 HIS O O -3.279 0.519 -1.158 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 16 . 2365 . 1 1 9 LEU C C -4.382 -2.901 -2.009 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 16 . 2366 . 1 1 9 LEU CA C -3.206 -2.249 -1.289 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 16 . 2367 . 1 1 9 LEU CB C -2.221 -3.322 -0.821 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 16 . 2368 . 1 1 9 LEU CD1 C -0.181 -3.245 -2.276 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 16 . 2369 . 1 1 9 LEU CD2 C -1.069 -5.447 -1.487 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 16 . 2370 . 1 1 9 LEU CG C -1.433 -4.033 -1.920 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 16 . 2371 . 1 1 9 LEU H H -3.996 -1.929 0.676 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 16 . 2372 . 1 1 9 LEU HA H -2.694 -1.588 -1.988 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 16 . 2373 . 1 1 9 LEU HB2 H -1.504 -2.847 -0.151 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 16 . 2374 . 1 1 9 LEU HB3 H -2.774 -4.072 -0.256 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 16 . 2375 . 1 1 9 LEU HD11 H -0.461 -2.237 -2.584 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 16 . 2376 . 1 1 9 LEU HD12 H 0.473 -3.190 -1.406 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 16 . 2377 . 1 1 9 LEU HD13 H 0.341 -3.742 -3.093 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 16 . 2378 . 1 1 9 LEU HD21 H -1.977 -5.995 -1.236 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 16 . 2379 . 1 1 9 LEU HD22 H -0.419 -5.403 -0.613 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 16 . 2380 . 1 1 9 LEU HD23 H -0.551 -5.954 -2.300 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 16 . 2381 . 1 1 9 LEU HG H -2.062 -4.097 -2.808 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 16 . 2382 . 1 1 9 LEU N N -3.667 -1.457 -0.153 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 16 . 2383 . 1 1 9 LEU O O -4.766 -4.027 -1.697 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 16 . 2384 . 1 1 10 MET C C -5.595 -3.514 -4.940 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 16 . 2385 . 1 1 10 MET CA C -6.077 -2.698 -3.744 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 16 . 2386 . 1 1 10 MET CB C -6.960 -1.544 -4.222 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 16 . 2387 . 1 1 10 MET CE C -8.046 1.572 -2.391 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 16 . 2388 . 1 1 10 MET CG C -7.969 -1.082 -3.185 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 16 . 2389 . 1 1 10 MET H H -4.585 -1.267 -3.186 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 16 . 2390 . 1 1 10 MET HA H -6.670 -3.345 -3.098 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 16 . 2391 . 1 1 10 MET HB2 H -6.322 -0.702 -4.491 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 16 . 2392 . 1 1 10 MET HB3 H -7.503 -1.871 -5.109 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 16 . 2393 . 1 1 10 MET HE1 H -7.701 2.360 -1.720 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 16 . 2394 . 1 1 10 MET HE2 H -9.126 1.461 -2.295 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 16 . 2395 . 1 1 10 MET HE3 H -7.797 1.836 -3.419 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 16 . 2396 . 1 1 10 MET HG2 H -8.779 -0.560 -3.694 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 16 . 2397 . 1 1 10 MET HG3 H -8.377 -1.954 -2.674 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 16 . 2398 . 1 1 10 MET N N -4.947 -2.186 -2.977 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 16 . 2399 . 1 1 10 MET O O -5.666 -3.061 -6.083 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 16 . 2400 . 1 1 10 MET SD S -7.247 0.029 -1.960 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 17 . 2401 . 1 1 1 GLY C C 10.788 2.747 6.033 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 17 . 2402 . 1 1 1 GLY CA C 12.184 2.530 6.579 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 17 . 2403 . 1 1 1 GLY H1 H 13.127 1.830 8.230 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 17 . 2404 . 1 1 1 GLY H2 H 11.710 1.059 7.888 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 17 . 2405 . 1 1 1 GLY H3 H 11.688 2.573 8.542 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 17 . 2406 . 1 1 1 GLY HA2 H 12.698 3.491 6.616 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 17 . 2407 . 1 1 1 GLY HA3 H 12.728 1.865 5.908 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 17 . 2408 . 1 1 1 GLY N N 12.177 1.954 7.911 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 17 . 2409 . 1 1 1 GLY O O 10.090 3.672 6.445 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 17 . 2410 . 1 1 2 ASN C C 8.400 0.624 4.384 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 17 . 2411 . 1 1 2 ASN CA C 9.057 1.997 4.494 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 17 . 2412 . 1 1 2 ASN CB C 9.157 2.640 3.111 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 17 . 2413 . 1 1 2 ASN CG C 9.908 1.769 2.120 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 17 . 2414 . 1 1 2 ASN H H 11.000 1.152 4.803 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 17 . 2415 . 1 1 2 ASN HA H 8.435 2.630 5.127 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 17 . 2416 . 1 1 2 ASN HB2 H 8.150 2.811 2.731 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 17 . 2417 . 1 1 2 ASN HB3 H 9.670 3.597 3.201 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 17 . 2418 . 1 1 2 ASN HD21 H 8.160 1.054 1.374 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 17 . 2419 . 1 1 2 ASN HD22 H 9.611 0.422 0.630 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 17 . 2420 . 1 1 2 ASN N N 10.379 1.892 5.100 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 17 . 2421 . 1 1 2 ASN ND2 N 9.167 1.022 1.310 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 17 . 2422 . 1 1 2 ASN O O 9.009 -0.331 3.900 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 17 . 2423 . 1 1 2 ASN OD1 O 11.138 1.769 2.087 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 17 . 2424 . 1 1 3 HIS C C 5.955 -1.028 3.366 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 17 . 2425 . 1 1 3 HIS CA C 6.413 -0.723 4.789 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 17 . 2426 . 1 1 3 HIS CB C 5.204 -0.663 5.724 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 17 . 2427 . 1 1 3 HIS CD2 C 3.482 -2.600 5.909 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 17 . 2428 . 1 1 3 HIS CE1 C 4.730 -4.002 7.036 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 17 . 2429 . 1 1 3 HIS CG C 4.695 -2.019 6.131 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 17 . 2430 . 1 1 3 HIS H H 6.709 1.353 5.223 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 17 . 2431 . 1 1 3 HIS HA H 7.069 -1.527 5.122 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 17 . 2432 . 1 1 3 HIS HB2 H 5.490 -0.117 6.623 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 17 . 2433 . 1 1 3 HIS HB3 H 4.400 -0.121 5.225 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 17 . 2434 . 1 1 3 HIS HD2 H 2.648 -2.162 5.381 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 17 . 2435 . 1 1 3 HIS HE1 H 5.060 -4.884 7.564 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 17 . 2436 . 1 1 3 HIS HE2 H 2.775 -4.534 6.497 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 17 . 2437 . 1 1 3 HIS N N 7.154 0.532 4.837 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 17 . 2438 . 1 1 3 HIS ND1 N 5.469 -2.919 6.845 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 17 . 2439 . 1 1 3 HIS NE2 N 3.522 -3.855 6.489 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 17 . 2440 . 1 1 3 HIS O O 5.485 -0.143 2.651 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 17 . 2441 . 1 1 4 TRP C C 4.228 -2.380 1.365 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 17 . 2442 . 1 1 4 TRP CA C 5.695 -2.708 1.623 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 17 . 2443 . 1 1 4 TRP CB C 5.934 -4.208 1.447 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 17 . 2444 . 1 1 4 TRP CD1 C 8.244 -5.230 1.012 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 17 . 2445 . 1 1 4 TRP CD2 C 7.373 -4.140 -0.741 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 17 . 2446 . 1 1 4 TRP CE2 C 8.634 -4.649 -1.110 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 17 . 2447 . 1 1 4 TRP CE3 C 6.637 -3.419 -1.684 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 17 . 2448 . 1 1 4 TRP CG C 7.142 -4.522 0.619 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 17 . 2449 . 1 1 4 TRP CH2 C 8.429 -3.747 -3.283 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 17 . 2450 . 1 1 4 TRP CZ2 C 9.173 -4.458 -2.380 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 17 . 2451 . 1 1 4 TRP CZ3 C 7.173 -3.230 -2.944 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 17 . 2452 . 1 1 4 TRP H H 6.484 -2.967 3.597 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 17 . 2453 . 1 1 4 TRP HA H 6.304 -2.172 0.895 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 17 . 2454 . 1 1 4 TRP HB2 H 6.052 -4.663 2.430 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 17 . 2455 . 1 1 4 TRP HB3 H 5.060 -4.642 0.961 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 17 . 2456 . 1 1 4 TRP HD1 H 8.385 -5.662 1.992 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 17 . 2457 . 1 1 4 TRP HE1 H 10.039 -5.778 0.012 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 17 . 2458 . 1 1 4 TRP HE3 H 5.666 -3.016 -1.433 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 17 . 2459 . 1 1 4 TRP HH2 H 8.819 -3.582 -4.277 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 17 . 2460 . 1 1 4 TRP HZ2 H 10.141 -4.856 -2.643 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 17 . 2461 . 1 1 4 TRP HZ3 H 6.612 -2.673 -3.681 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 17 . 2462 . 1 1 4 TRP N N 6.094 -2.286 2.962 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 17 . 2463 . 1 1 4 TRP NE1 N 9.145 -5.309 -0.023 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 17 . 2464 . 1 1 4 TRP O O 3.907 -1.572 0.494 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 17 . 2465 . 1 1 5 ALA C C 1.320 -2.163 3.242 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 17 . 2466 . 1 1 5 ALA CA C 1.909 -2.785 1.980 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 17 . 2467 . 1 1 5 ALA CB C 1.199 -4.090 1.652 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 17 . 2468 . 1 1 5 ALA H H 3.668 -3.663 2.825 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 17 . 2469 . 1 1 5 ALA HA H 1.754 -2.093 1.152 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 17 . 2470 . 1 1 5 ALA HB1 H 0.130 -3.905 1.545 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 17 . 2471 . 1 1 5 ALA HB2 H 1.593 -4.493 0.720 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 17 . 2472 . 1 1 5 ALA HB3 H 1.365 -4.806 2.457 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 17 . 2473 . 1 1 5 ALA N N 3.341 -3.011 2.127 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 17 . 2474 . 1 1 5 ALA O O 0.850 -2.869 4.134 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 17 . 2475 . 1 1 6 VAL C C -0.604 -0.566 4.782 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 17 . 2476 . 1 1 6 VAL CA C 0.817 -0.117 4.465 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 17 . 2477 . 1 1 6 VAL CB C 0.825 1.404 4.228 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 17 . 2478 . 1 1 6 VAL CG1 C 0.235 2.133 5.427 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 17 . 2479 . 1 1 6 VAL CG2 C 2.235 1.892 3.938 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 17 . 2480 . 1 1 6 VAL H H 1.751 -0.311 2.547 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 17 . 2481 . 1 1 6 VAL HA H 1.448 -0.335 5.327 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 17 . 2482 . 1 1 6 VAL HB H 0.204 1.618 3.359 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 17 . 2483 . 1 1 6 VAL HG11 H -0.774 1.767 5.615 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 17 . 2484 . 1 1 6 VAL HG12 H 0.201 3.202 5.221 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 17 . 2485 . 1 1 6 VAL HG13 H 0.857 1.951 6.304 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 17 . 2486 . 1 1 6 VAL HG21 H 2.636 1.356 3.077 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 17 . 2487 . 1 1 6 VAL HG22 H 2.869 1.709 4.806 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 17 . 2488 . 1 1 6 VAL HG23 H 2.213 2.960 3.723 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 17 . 2489 . 1 1 6 VAL N N 1.350 -0.835 3.311 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 17 . 2490 . 1 1 6 VAL O O -0.908 -0.943 5.912 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 17 . 2491 . 1 1 7 GLY C C -3.619 -1.013 2.662 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 17 . 2492 . 1 1 7 GLY CA C -2.853 -0.926 3.968 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 17 . 2493 . 1 1 7 GLY H H -1.167 -0.204 2.867 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 17 . 2494 . 1 1 7 GLY HA2 H -2.872 -1.900 4.456 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 17 . 2495 . 1 1 7 GLY HA3 H -3.344 -0.197 4.613 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 17 . 2496 . 1 1 7 GLY N N -1.472 -0.522 3.776 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 17 . 2497 . 1 1 7 GLY O O -3.436 -1.953 1.889 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 17 . 2498 . 1 1 8 HIS C C -4.684 0.971 0.183 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 17 . 2499 . 1 1 8 HIS CA C -5.279 -0.001 1.196 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 17 . 2500 . 1 1 8 HIS CB C -6.722 0.395 1.514 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 17 . 2501 . 1 1 8 HIS CD2 C -8.498 0.981 -0.286 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 17 . 2502 . 1 1 8 HIS CE1 C -8.754 -1.029 -1.119 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 17 . 2503 . 1 1 8 HIS CG C -7.677 0.125 0.386 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 17 . 2504 . 1 1 8 HIS H H -4.585 0.713 3.093 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 17 . 2505 . 1 1 8 HIS HA H -5.281 -1.000 0.759 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 17 . 2506 . 1 1 8 HIS HB2 H -7.051 -0.168 2.388 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 17 . 2507 . 1 1 8 HIS HB3 H -6.751 1.459 1.751 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 17 . 2508 . 1 1 8 HIS HD2 H -8.601 2.042 -0.111 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 17 . 2509 . 1 1 8 HIS HE1 H -9.103 -1.850 -1.728 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 17 . 2510 . 1 1 8 HIS HE2 H -9.855 0.579 -1.896 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 17 . 2511 . 1 1 8 HIS N N -4.481 -0.031 2.417 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 17 . 2512 . 1 1 8 HIS ND1 N -7.853 -1.139 -0.154 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 17 . 2513 . 1 1 8 HIS NE2 N -9.173 0.233 -1.237 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 17 . 2514 . 1 1 8 HIS O O -5.094 2.130 0.106 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 17 . 2515 . 1 1 9 LEU C C -3.211 0.703 -2.988 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 17 . 2516 . 1 1 9 LEU CA C -3.066 1.321 -1.602 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 17 . 2517 . 1 1 9 LEU CB C -1.586 1.502 -1.264 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 17 . 2518 . 1 1 9 LEU CD1 C 0.684 0.472 -1.533 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 17 . 2519 . 1 1 9 LEU CD2 C -0.847 -0.336 0.273 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 17 . 2520 . 1 1 9 LEU CG C -0.763 0.218 -1.142 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 17 . 2521 . 1 1 9 LEU H H -3.426 -0.467 -0.478 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 17 . 2522 . 1 1 9 LEU HA H -3.543 2.301 -1.607 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 17 . 2523 . 1 1 9 LEU HB2 H -1.137 2.111 -2.048 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 17 . 2524 . 1 1 9 LEU HB3 H -1.513 2.046 -0.323 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 17 . 2525 . 1 1 9 LEU HD11 H 0.723 0.868 -2.548 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 17 . 2526 . 1 1 9 LEU HD12 H 1.125 1.194 -0.845 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 17 . 2527 . 1 1 9 LEU HD13 H 1.243 -0.462 -1.486 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 17 . 2528 . 1 1 9 LEU HD21 H -1.890 -0.511 0.534 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 17 . 2529 . 1 1 9 LEU HD22 H -0.296 -1.275 0.328 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 17 . 2530 . 1 1 9 LEU HD23 H -0.413 0.381 0.970 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 17 . 2531 . 1 1 9 LEU HG H -1.179 -0.522 -1.825 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 17 . 2532 . 1 1 9 LEU N N -3.717 0.493 -0.591 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 17 . 2533 . 1 1 9 LEU O O -2.339 0.860 -3.842 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 17 . 2534 . 1 1 10 MET C C -5.770 0.013 -5.189 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 17 . 2535 . 1 1 10 MET CA C -4.579 -0.636 -4.491 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 17 . 2536 . 1 1 10 MET CB C -4.839 -2.132 -4.298 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 17 . 2537 . 1 1 10 MET CE C -2.853 -4.926 -6.134 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 17 . 2538 . 1 1 10 MET CG C -3.574 -2.974 -4.303 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 17 . 2539 . 1 1 10 MET H H -4.998 -0.090 -2.463 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 17 . 2540 . 1 1 10 MET HA H -3.699 -0.515 -5.122 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 17 . 2541 . 1 1 10 MET HB2 H -5.344 -2.274 -3.343 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 17 . 2542 . 1 1 10 MET HB3 H -5.495 -2.479 -5.096 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 17 . 2543 . 1 1 10 MET HE1 H -2.438 -5.189 -7.107 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 17 . 2544 . 1 1 10 MET HE2 H -2.245 -5.370 -5.347 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 17 . 2545 . 1 1 10 MET HE3 H -3.874 -5.302 -6.061 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 17 . 2546 . 1 1 10 MET HG2 H -2.839 -2.503 -3.651 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 17 . 2547 . 1 1 10 MET HG3 H -3.807 -3.965 -3.915 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 17 . 2548 . 1 1 10 MET N N -4.319 0.002 -3.206 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 17 . 2549 . 1 1 10 MET O O -6.141 -0.377 -6.297 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 17 . 2550 . 1 1 10 MET SD S -2.859 -3.144 -5.950 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 1 . 18 . 2551 . 1 1 1 GLY C C 8.624 2.933 6.287 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25519_2n0b 1 . 18 . 2552 . 1 1 1 GLY CA C 8.207 3.829 7.437 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25519_2n0b 1 . 18 . 2553 . 1 1 1 GLY H1 H 8.439 4.008 9.442 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25519_2n0b 1 . 18 . 2554 . 1 1 1 GLY H2 H 9.731 3.330 8.675 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25519_2n0b 1 . 18 . 2555 . 1 1 1 GLY H3 H 8.357 2.448 8.912 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25519_2n0b 1 . 18 . 2556 . 1 1 1 GLY HA2 H 7.119 3.861 7.485 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 18 . 2557 . 1 1 1 GLY HA3 H 8.583 4.835 7.250 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 18 . 2558 . 1 1 1 GLY N N 8.723 3.369 8.713 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25519_2n0b 1 . 18 . 2559 . 1 1 1 GLY O O 9.274 1.910 6.493 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25519_2n0b 1 . 18 . 2560 . 1 1 2 ASN C C 8.086 1.106 4.014 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25519_2n0b 1 . 18 . 2561 . 1 1 2 ASN CA C 8.584 2.543 3.884 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25519_2n0b 1 . 18 . 2562 . 1 1 2 ASN CB C 10.096 2.552 3.656 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25519_2n0b 1 . 18 . 2563 . 1 1 2 ASN CG C 10.584 3.858 3.061 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25519_2n0b 1 . 18 . 2564 . 1 1 2 ASN H H 7.714 4.172 4.969 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25519_2n0b 1 . 18 . 2565 . 1 1 2 ASN HA H 8.100 3.001 3.021 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25519_2n0b 1 . 18 . 2566 . 1 1 2 ASN HB2 H 10.595 2.395 4.612 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25519_2n0b 1 . 18 . 2567 . 1 1 2 ASN HB3 H 10.358 1.736 2.982 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25519_2n0b 1 . 18 . 2568 . 1 1 2 ASN HD21 H 12.030 2.883 2.019 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25519_2n0b 1 . 18 . 2569 . 1 1 2 ASN HD22 H 11.983 4.618 1.798 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25519_2n0b 1 . 18 . 2570 . 1 1 2 ASN N N 8.246 3.320 5.072 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25519_2n0b 1 . 18 . 2571 . 1 1 2 ASN ND2 N 11.615 3.780 2.226 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25519_2n0b 1 . 18 . 2572 . 1 1 2 ASN O O 8.799 0.159 3.684 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25519_2n0b 1 . 18 . 2573 . 1 1 2 ASN OD1 O 10.041 4.926 3.347 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25519_2n0b 1 . 18 . 2574 . 1 1 3 HIS C C 5.859 -0.962 3.326 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25519_2n0b 1 . 18 . 2575 . 1 1 3 HIS CA C 6.263 -0.368 4.671 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25519_2n0b 1 . 18 . 2576 . 1 1 3 HIS CB C 5.047 -0.286 5.593 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25519_2n0b 1 . 18 . 2577 . 1 1 3 HIS CD2 C 5.260 -2.666 6.611 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 18 . 2578 . 1 1 3 HIS CE1 C 3.144 -3.217 6.532 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 18 . 2579 . 1 1 3 HIS CG C 4.562 -1.625 6.078 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25519_2n0b 1 . 18 . 2580 . 1 1 3 HIS H H 6.323 1.771 4.753 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25519_2n0b 1 . 18 . 2581 . 1 1 3 HIS HA H 7.003 -1.023 5.130 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25519_2n0b 1 . 18 . 2582 . 1 1 3 HIS HB2 H 5.304 0.328 6.456 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 18 . 2583 . 1 1 3 HIS HB3 H 4.235 0.197 5.049 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 18 . 2584 . 1 1 3 HIS HD2 H 6.326 -2.702 6.782 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 18 . 2585 . 1 1 3 HIS HE1 H 2.226 -3.777 6.631 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 18 . 2586 . 1 1 3 HIS HE2 H 4.555 -4.569 7.298 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 18 . 2587 . 1 1 3 HIS N N 6.857 0.953 4.498 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25519_2n0b 1 . 18 . 2588 . 1 1 3 HIS ND1 N 3.227 -1.992 6.036 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 18 . 2589 . 1 1 3 HIS NE2 N 4.349 -3.667 6.894 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 18 . 2590 . 1 1 3 HIS O O 5.258 -0.283 2.492 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25519_2n0b 1 . 18 . 2591 . 1 1 4 TRP C C 4.379 -2.790 1.559 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25519_2n0b 1 . 18 . 2592 . 1 1 4 TRP CA C 5.866 -2.915 1.874 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25519_2n0b 1 . 18 . 2593 . 1 1 4 TRP CB C 6.259 -4.391 1.960 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25519_2n0b 1 . 18 . 2594 . 1 1 4 TRP CD1 C 8.648 -5.241 1.588 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25519_2n0b 1 . 18 . 2595 . 1 1 4 TRP CD2 C 7.598 -4.595 -0.283 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25519_2n0b 1 . 18 . 2596 . 1 1 4 TRP CE2 C 8.891 -5.037 -0.623 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25519_2n0b 1 . 18 . 2597 . 1 1 4 TRP CE3 C 6.752 -4.140 -1.298 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25519_2n0b 1 . 18 . 2598 . 1 1 4 TRP CG C 7.463 -4.734 1.136 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25519_2n0b 1 . 18 . 2599 . 1 1 4 TRP CH2 C 8.507 -4.586 -2.909 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25519_2n0b 1 . 18 . 2600 . 1 1 4 TRP CZ2 C 9.356 -5.037 -1.935 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25519_2n0b 1 . 18 . 2601 . 1 1 4 TRP CZ3 C 7.214 -4.140 -2.600 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25519_2n0b 1 . 18 . 2602 . 1 1 4 TRP H H 6.688 -2.732 3.844 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25519_2n0b 1 . 18 . 2603 . 1 1 4 TRP HA H 6.432 -2.453 1.065 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25519_2n0b 1 . 18 . 2604 . 1 1 4 TRP HB2 H 6.473 -4.631 3.002 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25519_2n0b 1 . 18 . 2605 . 1 1 4 TRP HB3 H 5.418 -4.998 1.625 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25519_2n0b 1 . 18 . 2606 . 1 1 4 TRP HD1 H 8.872 -5.464 2.620 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25519_2n0b 1 . 18 . 2607 . 1 1 4 TRP HE1 H 10.451 -5.788 0.605 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25519_2n0b 1 . 18 . 2608 . 1 1 4 TRP HE3 H 5.754 -3.795 -1.069 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25519_2n0b 1 . 18 . 2609 . 1 1 4 TRP HH2 H 8.839 -4.573 -3.936 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25519_2n0b 1 . 18 . 2610 . 1 1 4 TRP HZ2 H 10.352 -5.380 -2.175 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25519_2n0b 1 . 18 . 2611 . 1 1 4 TRP HZ3 H 6.569 -3.791 -3.393 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25519_2n0b 1 . 18 . 2612 . 1 1 4 TRP N N 6.194 -2.229 3.120 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25519_2n0b 1 . 18 . 2613 . 1 1 4 TRP NE1 N 9.511 -5.425 0.536 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25519_2n0b 1 . 18 . 2614 . 1 1 4 TRP O O 4.001 -2.265 0.512 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25519_2n0b 1 . 18 . 2615 . 1 1 5 ALA C C 1.449 -2.326 3.347 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25519_2n0b 1 . 18 . 2616 . 1 1 5 ALA CA C 2.097 -3.212 2.290 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25519_2n0b 1 . 18 . 2617 . 1 1 5 ALA CB C 1.501 -4.612 2.334 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25519_2n0b 1 . 18 . 2618 . 1 1 5 ALA H H 3.916 -3.692 3.310 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25519_2n0b 1 . 18 . 2619 . 1 1 5 ALA HA H 1.892 -2.782 1.309 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25519_2n0b 1 . 18 . 2620 . 1 1 5 ALA HB1 H 0.421 -4.552 2.197 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25519_2n0b 1 . 18 . 2621 . 1 1 5 ALA HB2 H 1.935 -5.216 1.537 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25519_2n0b 1 . 18 . 2622 . 1 1 5 ALA HB3 H 1.721 -5.070 3.298 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25519_2n0b 1 . 18 . 2623 . 1 1 5 ALA N N 3.542 -3.273 2.471 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25519_2n0b 1 . 18 . 2624 . 1 1 5 ALA O O 1.029 -2.804 4.400 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25519_2n0b 1 . 18 . 2625 . 1 1 6 VAL C C -0.611 -0.534 4.429 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25519_2n0b 1 . 18 . 2626 . 1 1 6 VAL CA C 0.772 -0.075 3.986 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25519_2n0b 1 . 18 . 2627 . 1 1 6 VAL CB C 0.661 1.324 3.354 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25519_2n0b 1 . 18 . 2628 . 1 1 6 VAL CG1 C 0.003 2.296 4.321 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25519_2n0b 1 . 18 . 2629 . 1 1 6 VAL CG2 C 2.030 1.828 2.927 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25519_2n0b 1 . 18 . 2630 . 1 1 6 VAL H H 1.737 -0.699 2.178 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25519_2n0b 1 . 18 . 2631 . 1 1 6 VAL HA H 1.410 -0.004 4.868 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25519_2n0b 1 . 18 . 2632 . 1 1 6 VAL HB H 0.033 1.248 2.466 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25519_2n0b 1 . 18 . 2633 . 1 1 6 VAL HG11 H -0.976 1.914 4.612 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25519_2n0b 1 . 18 . 2634 . 1 1 6 VAL HG12 H 0.628 2.406 5.207 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25519_2n0b 1 . 18 . 2635 . 1 1 6 VAL HG13 H -0.116 3.266 3.838 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25519_2n0b 1 . 18 . 2636 . 1 1 6 VAL HG21 H 2.481 1.116 2.235 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25519_2n0b 1 . 18 . 2637 . 1 1 6 VAL HG22 H 1.924 2.795 2.434 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25519_2n0b 1 . 18 . 2638 . 1 1 6 VAL HG23 H 2.668 1.936 3.804 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25519_2n0b 1 . 18 . 2639 . 1 1 6 VAL N N 1.372 -1.030 3.059 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25519_2n0b 1 . 18 . 2640 . 1 1 6 VAL O O -0.883 -0.659 5.622 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25519_2n0b 1 . 18 . 2641 . 1 1 7 GLY C C -3.781 -1.065 2.599 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25519_2n0b 1 . 18 . 2642 . 1 1 7 GLY CA C -2.832 -1.228 3.770 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25519_2n0b 1 . 18 . 2643 . 1 1 7 GLY H H -1.209 -0.663 2.496 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25519_2n0b 1 . 18 . 2644 . 1 1 7 GLY HA2 H -2.798 -2.281 4.048 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25519_2n0b 1 . 18 . 2645 . 1 1 7 GLY HA3 H -3.210 -0.651 4.614 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25519_2n0b 1 . 18 . 2646 . 1 1 7 GLY N N -1.485 -0.784 3.461 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25519_2n0b 1 . 18 . 2647 . 1 1 7 GLY O O -3.978 -1.995 1.816 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25519_2n0b 1 . 18 . 2648 . 1 1 8 HIS C C -4.977 1.730 0.723 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25519_2n0b 1 . 18 . 2649 . 1 1 8 HIS CA C -5.308 0.400 1.394 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25519_2n0b 1 . 18 . 2650 . 1 1 8 HIS CB C -6.742 0.426 1.922 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25519_2n0b 1 . 18 . 2651 . 1 1 8 HIS CD2 C -6.707 2.631 3.294 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25519_2n0b 1 . 18 . 2652 . 1 1 8 HIS CE1 C -7.425 1.813 5.193 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25519_2n0b 1 . 18 . 2653 . 1 1 8 HIS CG C -6.925 1.295 3.136 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25519_2n0b 1 . 18 . 2654 . 1 1 8 HIS H H -4.172 0.842 3.154 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25519_2n0b 1 . 18 . 2655 . 1 1 8 HIS HA H -5.226 -0.393 0.651 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25519_2n0b 1 . 18 . 2656 . 1 1 8 HIS HB2 H -7.399 0.786 1.131 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25519_2n0b 1 . 18 . 2657 . 1 1 8 HIS HB3 H -7.031 -0.592 2.181 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25519_2n0b 1 . 18 . 2658 . 1 1 8 HIS HD2 H -6.350 3.317 2.539 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25519_2n0b 1 . 18 . 2659 . 1 1 8 HIS HE1 H -7.741 1.738 6.223 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25519_2n0b 1 . 18 . 2660 . 1 1 8 HIS HE2 H -6.975 3.856 5.031 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25519_2n0b 1 . 18 . 2661 . 1 1 8 HIS N N -4.374 0.119 2.478 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25519_2n0b 1 . 18 . 2662 . 1 1 8 HIS ND1 N -7.378 0.796 4.346 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25519_2n0b 1 . 18 . 2663 . 1 1 8 HIS NE2 N -7.029 2.943 4.602 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25519_2n0b 1 . 18 . 2664 . 1 1 8 HIS O O -5.869 2.526 0.426 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25519_2n0b 1 . 18 . 2665 . 1 1 9 LEU C C -3.167 3.035 -1.663 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25519_2n0b 1 . 18 . 2666 . 1 1 9 LEU CA C -3.244 3.199 -0.148 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25519_2n0b 1 . 18 . 2667 . 1 1 9 LEU CB C -1.876 3.612 0.401 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25519_2n0b 1 . 18 . 2668 . 1 1 9 LEU CD1 C -0.612 5.482 1.492 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25519_2n0b 1 . 18 . 2669 . 1 1 9 LEU CD2 C -0.974 5.498 -0.982 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25519_2n0b 1 . 18 . 2670 . 1 1 9 LEU CG C -1.563 5.108 0.367 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25519_2n0b 1 . 18 . 2671 . 1 1 9 LEU H H -3.006 1.272 0.755 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25519_2n0b 1 . 18 . 2672 . 1 1 9 LEU HA H -3.961 3.987 0.080 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25519_2n0b 1 . 18 . 2673 . 1 1 9 LEU HB2 H -1.821 3.284 1.440 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25519_2n0b 1 . 18 . 2674 . 1 1 9 LEU HB3 H -1.106 3.088 -0.165 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25519_2n0b 1 . 18 . 2675 . 1 1 9 LEU HD11 H -1.049 5.195 2.449 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25519_2n0b 1 . 18 . 2676 . 1 1 9 LEU HD12 H 0.335 4.960 1.355 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25519_2n0b 1 . 18 . 2677 . 1 1 9 LEU HD13 H -0.439 6.558 1.479 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25519_2n0b 1 . 18 . 2678 . 1 1 9 LEU HD21 H -1.669 5.223 -1.775 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25519_2n0b 1 . 18 . 2679 . 1 1 9 LEU HD22 H -0.803 6.574 -1.005 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25519_2n0b 1 . 18 . 2680 . 1 1 9 LEU HD23 H -0.028 4.977 -1.129 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25519_2n0b 1 . 18 . 2681 . 1 1 9 LEU HG H -2.494 5.657 0.507 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25519_2n0b 1 . 18 . 2682 . 1 1 9 LEU N N -3.691 1.965 0.488 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25519_2n0b 1 . 18 . 2683 . 1 1 9 LEU O O -3.757 3.814 -2.412 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25519_2n0b 1 . 18 . 2684 . 1 1 10 MET C C -3.602 1.268 -4.136 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25519_2n0b 1 . 18 . 2685 . 1 1 10 MET CA C -2.287 1.749 -3.531 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25519_2n0b 1 . 18 . 2686 . 1 1 10 MET CB C -1.192 0.705 -3.764 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25519_2n0b 1 . 18 . 2687 . 1 1 10 MET CE C -0.974 0.829 -7.860 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25519_2n0b 1 . 18 . 2688 . 1 1 10 MET CG C -0.525 0.816 -5.125 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25519_2n0b 1 . 18 . 2689 . 1 1 10 MET H H -1.977 1.414 -1.439 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25519_2n0b 1 . 18 . 2690 . 1 1 10 MET HA H -1.994 2.674 -4.029 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25519_2n0b 1 . 18 . 2691 . 1 1 10 MET HB2 H -0.429 0.829 -2.996 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25519_2n0b 1 . 18 . 2692 . 1 1 10 MET HB3 H -1.629 -0.288 -3.668 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25519_2n0b 1 . 18 . 2693 . 1 1 10 MET HE1 H -1.437 0.374 -8.735 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25519_2n0b 1 . 18 . 2694 . 1 1 10 MET HE2 H 0.108 0.844 -7.987 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25519_2n0b 1 . 18 . 2695 . 1 1 10 MET HE3 H -1.340 1.850 -7.745 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25519_2n0b 1 . 18 . 2696 . 1 1 10 MET HG2 H -0.503 1.866 -5.419 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25519_2n0b 1 . 18 . 2697 . 1 1 10 MET HG3 H 0.498 0.448 -5.049 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25519_2n0b 1 . 18 . 2698 . 1 1 10 MET N N -2.438 2.017 -2.106 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25519_2n0b 1 . 18 . 2699 . 1 1 10 MET O O -3.864 1.473 -5.322 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25519_2n0b 1 . 18 . 2700 . 1 1 10 MET SD S -1.390 -0.121 -6.400 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25519_2n0b 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 c25519_2n0b _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 2n0b.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c25519_2n0b 1 1 2n0b.mr . . DYANA/DIANA 2 distance NOE simple 50 c25519_2n0b 1 1 2n0b.mr . . 'MR format' 3 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c25519_2n0b 1 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode DYANA/DIANA_distance_constraints_2 _Gen_dist_constraint_list.Entry_ID c25519_2n0b _Gen_dist_constraint_list.ID 1 _Gen_dist_constraint_list.Constraint_type NOE _Gen_dist_constraint_list.Details 'Generated by Wattos' _Gen_dist_constraint_list.Constraint_file_ID 1 _Gen_dist_constraint_list.Block_ID 2 loop_ _Gen_dist_constraint_software.Software_ID _Gen_dist_constraint_software.Software_label _Gen_dist_constraint_software.Method_ID _Gen_dist_constraint_software.Method_label _Gen_dist_constraint_software.Entry_ID _Gen_dist_constraint_software.Gen_dist_constraint_list_ID . . . . c25519_2n0b 1 stop_ loop_ _Gen_dist_constraint.ID _Gen_dist_constraint.Member_ID _Gen_dist_constraint.Member_logic_code _Gen_dist_constraint.Assembly_atom_ID_1 _Gen_dist_constraint.Entity_assembly_ID_1 _Gen_dist_constraint.Entity_ID_1 _Gen_dist_constraint.Comp_index_ID_1 _Gen_dist_constraint.Seq_ID_1 _Gen_dist_constraint.Comp_ID_1 _Gen_dist_constraint.Atom_ID_1 _Gen_dist_constraint.Atom_type_1 _Gen_dist_constraint.Atom_isotope_number_1 _Gen_dist_constraint.Resonance_ID_1 _Gen_dist_constraint.Assembly_atom_ID_2 _Gen_dist_constraint.Entity_assembly_ID_2 _Gen_dist_constraint.Entity_ID_2 _Gen_dist_constraint.Comp_index_ID_2 _Gen_dist_constraint.Seq_ID_2 _Gen_dist_constraint.Comp_ID_2 _Gen_dist_constraint.Atom_ID_2 _Gen_dist_constraint.Atom_type_2 _Gen_dist_constraint.Atom_isotope_number_2 _Gen_dist_constraint.Resonance_ID_2 _Gen_dist_constraint.Intensity_val _Gen_dist_constraint.Intensity_lower_val_err _Gen_dist_constraint.Intensity_upper_val_err _Gen_dist_constraint.Distance_val _Gen_dist_constraint.Distance_lower_bound_val _Gen_dist_constraint.Distance_upper_bound_val _Gen_dist_constraint.Contribution_fractional_val _Gen_dist_constraint.Spectral_peak_ID _Gen_dist_constraint.Spectral_peak_list_ID _Gen_dist_constraint.PDB_record_ID_1 _Gen_dist_constraint.PDB_model_num_1 _Gen_dist_constraint.PDB_strand_ID_1 _Gen_dist_constraint.PDB_ins_code_1 _Gen_dist_constraint.PDB_residue_no_1 _Gen_dist_constraint.PDB_residue_name_1 _Gen_dist_constraint.PDB_atom_name_1 _Gen_dist_constraint.PDB_record_ID_2 _Gen_dist_constraint.PDB_model_num_2 _Gen_dist_constraint.PDB_strand_ID_2 _Gen_dist_constraint.PDB_ins_code_2 _Gen_dist_constraint.PDB_residue_no_2 _Gen_dist_constraint.PDB_residue_name_2 _Gen_dist_constraint.PDB_atom_name_2 _Gen_dist_constraint.Auth_entity_assembly_ID_1 _Gen_dist_constraint.Auth_asym_ID_1 _Gen_dist_constraint.Auth_chain_ID_1 _Gen_dist_constraint.Auth_seq_ID_1 _Gen_dist_constraint.Auth_comp_ID_1 _Gen_dist_constraint.Auth_atom_ID_1 _Gen_dist_constraint.Auth_alt_ID_1 _Gen_dist_constraint.Auth_atom_name_1 _Gen_dist_constraint.Auth_entity_assembly_ID_2 _Gen_dist_constraint.Auth_asym_ID_2 _Gen_dist_constraint.Auth_chain_ID_2 _Gen_dist_constraint.Auth_seq_ID_2 _Gen_dist_constraint.Auth_comp_ID_2 _Gen_dist_constraint.Auth_atom_ID_2 _Gen_dist_constraint.Auth_alt_ID_2 _Gen_dist_constraint.Auth_atom_name_2 _Gen_dist_constraint.Entry_ID _Gen_dist_constraint.Gen_dist_constraint_list_ID 1 1 . . 1 1 5 5 ALA H H . . . 1 1 5 5 ALA MB H . . . . . . . 3.62 . . . . . A . 5 ALA H . . A . 5 ALA MB . . . 5 ALA H . . . . . 5 ALA QB . . c25519_2n0b 1 2 1 . . 1 1 6 6 VAL H H . . . 1 1 6 6 VAL HB H . . . . . . . 3.45 . . . . . A . 6 VAL H . . A . 6 VAL HB . . . 6 VAL H . . . . . 6 VAL HB . . c25519_2n0b 1 3 1 . . 1 1 6 6 VAL H H . . . 1 1 6 6 VAL MG1 H . . . . . . . 4.68 . . . . . A . 6 VAL H . . A . 6 VAL MG1 . . . 6 VAL H . . . . . 6 VAL QG1 . . c25519_2n0b 1 4 1 . . 1 1 6 6 VAL H H . . . 1 1 6 6 VAL MG2 H . . . . . . . 4.68 . . . . . A . 6 VAL H . . A . 6 VAL MG2 . . . 6 VAL H . . . . . 6 VAL QG2 . . c25519_2n0b 1 5 1 . . 1 1 4 4 TRP H H . . . 1 1 4 4 TRP HB2 H . . . . . . . 3.79 . . . . . A . 4 TRP H . . A . 4 TRP HB2 . . . 4 TRP H . . . . . 4 TRP HB2 . . c25519_2n0b 1 6 1 . . 1 1 4 4 TRP H H . . . 1 1 4 4 TRP HB3 H . . . . . . . 3.79 . . . . . A . 4 TRP H . . A . 4 TRP HB3 . . . 4 TRP H . . . . . 4 TRP HB3 . . c25519_2n0b 1 7 1 . . 1 1 8 8 HIS H H . . . 1 1 8 8 HIS HB2 H . . . . . . . 4.13 . . . . . A . 8 HIS H . . A . 8 HIS HB2 . . . 8 HIS H . . . . . 8 HIS HB2 . . c25519_2n0b 1 8 1 . . 1 1 8 8 HIS H H . . . 1 1 8 8 HIS HB3 H . . . . . . . 4.13 . . . . . A . 8 HIS H . . A . 8 HIS HB3 . . . 8 HIS H . . . . . 8 HIS HB3 . . c25519_2n0b 1 9 1 . . 1 1 8 8 HIS H H . . . 1 1 7 7 GLY H H . . . . . . . 4.19 . . . . . A . 8 HIS H . . A . 7 GLY H . . . 8 HIS H . . . . . 7 GLY H . . c25519_2n0b 1 10 1 . . 1 1 6 6 VAL H H . . . 1 1 7 7 GLY H H . . . . . . . 3.95 . . . . . A . 6 VAL H . . A . 7 GLY H . . . 6 VAL H . . . . . 7 GLY H . . c25519_2n0b 1 11 1 . . 1 1 7 7 GLY H H . . . 1 1 9 9 LEU H H . . . . . . . 4.20 . . . . . A . 7 GLY H . . A . 9 LEU H . . . 7 GLY H . . . . . 9 LEU H . . c25519_2n0b 1 12 1 . . 1 1 5 5 ALA H H . . . 1 1 6 6 VAL H H . . . . . . . 3.84 . . . . . A . 5 ALA H . . A . 6 VAL H . . . 5 ALA H . . . . . 6 VAL H . . c25519_2n0b 1 13 1 . . 1 1 5 5 ALA H H . . . 1 1 4 4 TRP H H . . . . . . . 3.45 . . . . . A . 5 ALA H . . A . 4 TRP H . . . 5 ALA H . . . . . 4 TRP H . . c25519_2n0b 1 14 1 . . 1 1 5 5 ALA H H . . . 1 1 4 4 TRP HE3 H . . . . . . . 4.74 . . . . . A . 5 ALA H . . A . 4 TRP HE3 . . . 5 ALA H . . . . . 4 TRP HE3 . . c25519_2n0b 1 15 1 . . 1 1 4 4 TRP H H . . . 1 1 4 4 TRP HE3 H . . . . . . . 5.13 . . . . . A . 4 TRP H . . A . 4 TRP HE3 . . . 4 TRP H . . . . . 4 TRP HE3 . . c25519_2n0b 1 16 1 . . 1 1 4 4 TRP H H . . . 1 1 4 4 TRP HD1 H . . . . . . . 4.55 . . . . . A . 4 TRP H . . A . 4 TRP HD1 . . . 4 TRP H . . . . . 4 TRP HD1 . . c25519_2n0b 1 17 1 . . 1 1 5 5 ALA H H . . . 1 1 4 4 TRP HD1 H . . . . . . . 5.40 . . . . . A . 5 ALA H . . A . 4 TRP HD1 . . . 5 ALA H . . . . . 4 TRP HD1 . . c25519_2n0b 1 18 1 . . 1 1 7 7 GLY H H . . . 1 1 5 5 ALA HA H . . . . . . . 5.32 . . . . . A . 7 GLY H . . A . 5 ALA HA . . . 7 GLY H . . . . . 5 ALA HA . . c25519_2n0b 1 19 1 . . 1 1 7 7 GLY H H . . . 1 1 8 8 HIS HA H . . . . . . . 5.50 . . . . . A . 7 GLY H . . A . 8 HIS HA . . . 7 GLY H . . . . . 8 HIS HA . . c25519_2n0b 1 20 1 . . 1 1 6 6 VAL HB H . . . 1 1 7 7 GLY H H . . . . . . . 4.22 . . . . . A . 6 VAL HB . . A . 7 GLY H . . . 6 VAL HB . . . . . 7 GLY H . . c25519_2n0b 1 21 1 . . 1 1 5 5 ALA MB H . . . 1 1 7 7 GLY H H . . . . . . . 5.11 . . . . . A . 5 ALA MB . . A . 7 GLY H . . . 5 ALA QB . . . . . 7 GLY H . . c25519_2n0b 1 22 1 . . 1 1 9 9 LEU H H . . . 1 1 8 8 HIS HA H . . . . . . . 3.12 . . . . . A . 9 LEU H . . A . 8 HIS HA . . . 9 LEU H . . . . . 8 HIS HA . . c25519_2n0b 1 23 1 . . 1 1 9 9 LEU H H . . . 1 1 8 8 HIS HB2 H . . . . . . . 4.79 . . . . . A . 9 LEU H . . A . 8 HIS HB2 . . . 9 LEU H . . . . . 8 HIS HB2 . . c25519_2n0b 1 24 1 . . 1 1 9 9 LEU H H . . . 1 1 8 8 HIS HB3 H . . . . . . . 4.79 . . . . . A . 9 LEU H . . A . 8 HIS HB3 . . . 9 LEU H . . . . . 8 HIS HB3 . . c25519_2n0b 1 25 1 . . 1 1 6 6 VAL H H . . . 1 1 5 5 ALA HA H . . . . . . . 2.87 . . . . . A . 6 VAL H . . A . 5 ALA HA . . . 6 VAL H . . . . . 5 ALA HA . . c25519_2n0b 1 26 1 . . 1 1 5 5 ALA H H . . . 1 1 4 4 TRP HB2 H . . . . . . . 4.18 . . . . . A . 5 ALA H . . A . 4 TRP HB2 . . . 5 ALA H . . . . . 4 TRP HB2 . . c25519_2n0b 1 27 1 . . 1 1 5 5 ALA H H . . . 1 1 4 4 TRP HB3 H . . . . . . . 4.18 . . . . . A . 5 ALA H . . A . 4 TRP HB3 . . . 5 ALA H . . . . . 4 TRP HB3 . . c25519_2n0b 1 28 1 . . 1 1 4 4 TRP H H . . . 1 1 3 3 HIS HA H . . . . . . . 3.08 . . . . . A . 4 TRP H . . A . 3 HIS HA . . . 4 TRP H . . . . . 3 HIS HA . . c25519_2n0b 1 29 1 . . 1 1 5 5 ALA MB H . . . 1 1 6 6 VAL H H . . . . . . . 4.14 . . . . . A . 5 ALA MB . . A . 6 VAL H . . . 5 ALA QB . . . . . 6 VAL H . . c25519_2n0b 1 30 1 . . 1 1 4 4 TRP HE3 H . . . 1 1 4 4 TRP HA H . . . . . . . 3.97 . . . . . A . 4 TRP HE3 . . A . 4 TRP HA . . . 4 TRP HE3 . . . . . 4 TRP HA . . c25519_2n0b 1 31 1 . . 1 1 4 4 TRP HE3 H . . . 1 1 5 5 ALA HA H . . . . . . . 4.86 . . . . . A . 4 TRP HE3 . . A . 5 ALA HA . . . 4 TRP HE3 . . . . . 5 ALA HA . . c25519_2n0b 1 32 1 . . 1 1 4 4 TRP HD1 H . . . 1 1 4 4 TRP HA H . . . . . . . 4.31 . . . . . A . 4 TRP HD1 . . A . 4 TRP HA . . . 4 TRP HD1 . . . . . 4 TRP HA . . c25519_2n0b 1 33 1 . . 1 1 4 4 TRP HD1 H . . . 1 1 4 4 TRP HB2 H . . . . . . . 3.74 . . . . . A . 4 TRP HD1 . . A . 4 TRP HB2 . . . 4 TRP HD1 . . . . . 4 TRP HB2 . . c25519_2n0b 1 34 1 . . 1 1 4 4 TRP HD1 H . . . 1 1 4 4 TRP HB3 H . . . . . . . 3.74 . . . . . A . 4 TRP HD1 . . A . 4 TRP HB3 . . . 4 TRP HD1 . . . . . 4 TRP HB3 . . c25519_2n0b 1 35 1 . . 1 1 5 5 ALA HA H . . . 1 1 6 6 VAL HA H . . . . . . . 5.09 . . . . . A . 5 ALA HA . . A . 6 VAL HA . . . 5 ALA HA . . . . . 6 VAL HA . . c25519_2n0b 1 36 1 . . 1 1 5 5 ALA HA H . . . 1 1 4 4 TRP HA H . . . . . . . 4.96 . . . . . A . 5 ALA HA . . A . 4 TRP HA . . . 5 ALA HA . . . . . 4 TRP HA . . c25519_2n0b 1 37 1 . . 1 1 5 5 ALA MB H . . . 1 1 6 6 VAL HA H . . . . . . . 5.29 . . . . . A . 5 ALA MB . . A . 6 VAL HA . . . 5 ALA QB . . . . . 6 VAL HA . . c25519_2n0b 1 38 1 . . 1 1 6 6 VAL HB H . . . 1 1 5 5 ALA HA H . . . . . . . 5.03 . . . . . A . 6 VAL HB . . A . 5 ALA HA . . . 6 VAL HB . . . . . 5 ALA HA . . c25519_2n0b 1 39 1 . . 1 1 5 5 ALA HA H . . . 1 1 6 6 VAL MG1 H . . . . . . . 5.50 . . . . . A . 5 ALA HA . . A . 6 VAL MG1 . . . 5 ALA HA . . . . . 6 VAL QG1 . . c25519_2n0b 1 40 1 . . 1 1 5 5 ALA HA H . . . 1 1 6 6 VAL MG2 H . . . . . . . 5.50 . . . . . A . 5 ALA HA . . A . 6 VAL MG2 . . . 5 ALA HA . . . . . 6 VAL QG2 . . c25519_2n0b 1 41 1 OR . 1 1 4 4 TRP H H . . . 1 1 4 4 TRP HB3 H . . . . . . . 3.24 . . . . . A . 4 TRP H . . A . 4 TRP HB3 . . . 4 TRP H . . . . . 4 TRP QB . . c25519_2n0b 1 41 2 OR . 1 1 4 4 TRP H H . . . 1 1 4 4 TRP HB2 H . . . . . . . 3.24 . . . . . A . 4 TRP H . . A . 4 TRP HB2 . . . 4 TRP H . . . . . 4 TRP QB . . c25519_2n0b 1 42 1 OR . 1 1 4 4 TRP HD1 H . . . 1 1 4 4 TRP HB3 H . . . . . . . 3.22 . . . . . A . 4 TRP HD1 . . A . 4 TRP HB3 . . . 4 TRP HD1 . . . . . 4 TRP QB . . c25519_2n0b 1 42 2 OR . 1 1 4 4 TRP HD1 H . . . 1 1 4 4 TRP HB2 H . . . . . . . 3.22 . . . . . A . 4 TRP HD1 . . A . 4 TRP HB2 . . . 4 TRP HD1 . . . . . 4 TRP QB . . c25519_2n0b 1 43 1 OR . 1 1 4 4 TRP HE3 H . . . 1 1 4 4 TRP HB3 H . . . . . . . 3.58 . . . . . A . 4 TRP HE3 . . A . 4 TRP HB3 . . . 4 TRP HE3 . . . . . 4 TRP QB . . c25519_2n0b 1 43 2 OR . 1 1 4 4 TRP HE3 H . . . 1 1 4 4 TRP HB2 H . . . . . . . 3.58 . . . . . A . 4 TRP HE3 . . A . 4 TRP HB2 . . . 4 TRP HE3 . . . . . 4 TRP QB . . c25519_2n0b 1 44 1 OR . 1 1 5 5 ALA H H . . . 1 1 4 4 TRP HB3 H . . . . . . . 3.64 . . . . . A . 5 ALA H . . A . 4 TRP HB3 . . . 5 ALA H . . . . . 4 TRP QB . . c25519_2n0b 1 44 2 OR . 1 1 5 5 ALA H H . . . 1 1 4 4 TRP HB2 H . . . . . . . 3.64 . . . . . A . 5 ALA H . . A . 4 TRP HB2 . . . 5 ALA H . . . . . 4 TRP QB . . c25519_2n0b 1 45 1 OR . 1 1 6 6 VAL H H . . . 1 1 6 6 VAL MG1 H . . . . . . . 4.00 . . . . . A . 6 VAL H . . A . 6 VAL MG1 . . . 6 VAL H . . . . . 6 VAL QQG . . c25519_2n0b 1 45 2 OR . 1 1 6 6 VAL H H . . . 1 1 6 6 VAL MG2 H . . . . . . . 4.00 . . . . . A . 6 VAL H . . A . 6 VAL MG2 . . . 6 VAL H . . . . . 6 VAL QQG . . c25519_2n0b 1 46 1 OR . 1 1 7 7 GLY H H . . . 1 1 6 6 VAL MG1 H . . . . . . . 4.46 . . . . . A . 7 GLY H . . A . 6 VAL MG1 . . . 7 GLY H . . . . . 6 VAL QQG . . c25519_2n0b 1 46 2 OR . 1 1 7 7 GLY H H . . . 1 1 6 6 VAL MG2 H . . . . . . . 4.46 . . . . . A . 7 GLY H . . A . 6 VAL MG2 . . . 7 GLY H . . . . . 6 VAL QQG . . c25519_2n0b 1 47 1 OR . 1 1 6 6 VAL MG1 H . . . 1 1 7 7 GLY HA2 H . . . . . . . 4.87 . . . . . A . 6 VAL MG1 . . A . 7 GLY HA2 . . . 6 VAL QQG . . . . . 7 GLY QA . . c25519_2n0b 1 47 2 OR . 1 1 7 7 GLY HA3 H . . . 1 1 6 6 VAL MG1 H . . . . . . . 4.87 . . . . . A . 7 GLY HA3 . . A . 6 VAL MG1 . . . 7 GLY QA . . . . . 6 VAL QQG . . c25519_2n0b 1 47 3 OR . 1 1 6 6 VAL MG2 H . . . 1 1 7 7 GLY HA3 H . . . . . . . 4.87 . . . . . A . 6 VAL MG2 . . A . 7 GLY HA3 . . . 6 VAL QQG . . . . . 7 GLY QA . . c25519_2n0b 1 47 4 OR . 1 1 6 6 VAL MG2 H . . . 1 1 7 7 GLY HA2 H . . . . . . . 4.87 . . . . . A . 6 VAL MG2 . . A . 7 GLY HA2 . . . 6 VAL QQG . . . . . 7 GLY QA . . c25519_2n0b 1 48 1 OR . 1 1 8 8 HIS H H . . . 1 1 8 8 HIS HB3 H . . . . . . . 3.60 . . . . . A . 8 HIS H . . A . 8 HIS HB3 . . . 8 HIS H . . . . . 8 HIS QB . . c25519_2n0b 1 48 2 OR . 1 1 8 8 HIS H H . . . 1 1 8 8 HIS HB2 H . . . . . . . 3.60 . . . . . A . 8 HIS H . . A . 8 HIS HB2 . . . 8 HIS H . . . . . 8 HIS QB . . c25519_2n0b 1 49 1 OR . 1 1 9 9 LEU H H . . . 1 1 8 8 HIS HB3 H . . . . . . . 4.20 . . . . . A . 9 LEU H . . A . 8 HIS HB3 . . . 9 LEU H . . . . . 8 HIS QB . . c25519_2n0b 1 49 2 OR . 1 1 9 9 LEU H H . . . 1 1 8 8 HIS HB2 H . . . . . . . 4.20 . . . . . A . 9 LEU H . . A . 8 HIS HB2 . . . 9 LEU H . . . . . 8 HIS QB . . c25519_2n0b 1 50 1 OR . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU HB2 H . . . . . . . 3.60 . . . . . A . 9 LEU H . . A . 9 LEU HB2 . . . 9 LEU H . . . . . 9 LEU QB . . c25519_2n0b 1 50 2 OR . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU HB3 H . . . . . . . 3.60 . . . . . A . 9 LEU H . . A . 9 LEU HB3 . . . 9 LEU H . . . . . 9 LEU QB . . c25519_2n0b 1 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 c25519_2n0b _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 HORMONE 05-MAR-15 2N0B *TITLE NMR STRUCTURE OF NEUROMEDIN C IN AQUEOUS SOLUTION *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: GASTRIN-RELEASING PEPTIDE; *COMPND 3 CHAIN: A; *COMPND 4 FRAGMENT: UNP RESIDUES 41-50; *COMPND 5 SYNONYM: GRP, NEUROMEDIN-C, GRP-10; *COMPND 6 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: HOMO SAPIENS; *SOURCE 4 ORGANISM_COMMON: HUMAN; *SOURCE 5 ORGANISM_TAXID: 9606 *KEYWDS NEUROPEPTIDE, FEEDING REGULATION, HORMONE *EXPDTA SOLUTION NMR *NUMMDL 18 *AUTHOR M.ADROVER, P.SANCHIS, B.VILANOVA, K.PAUWELS, G.MARTORELL, J.PEREZ *REVDAT 1 14-OCT-15 2N0B 0' save_