data_c17360_2l7l ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c17360_2l7l _Entry.Title ; Solution structure of Ca2+/calmodulin complexed with a peptide representing the calmodulin-binding domain of calmodulin kinase I ; _Entry.Version_type original _Entry.Submission_date 2010-12-13 _Entry.Accession_date 2010-12-13 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.0.52 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Jessica Gifford . L. . c17360_2l7l 2 Hiroaki Ishida . . . c17360_2l7l 3 Hans Vogel . J. . c17360_2l7l 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 . 'not applicable' 'not applicable' . c17360_2l7l stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Calmodulin complex' . c17360_2l7l Ca2+/Calmodulin . c17360_2l7l 'Calmodulin kinase 1' . c17360_2l7l 'Calmodulin kinase 1 peptide' . c17360_2l7l 'solution structure' . c17360_2l7l stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c17360_2l7l stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 185 c17360_2l7l '13C chemical shifts' 9 c17360_2l7l stop_ loop_ _Release.Release_number _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 2011-05-13 2010-12-13 update BMRB 'update entry citation' c17360_2l7l 1 2011-03-07 2010-12-13 original author 'original release' c17360_2l7l stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1MXE 'X-ray structure of Ca2+/CaM bound to CaMKIp' c17360_2l7l BMRB 5286 'Backbone assignments of CaM:CaMKIp complex' c17360_2l7l stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID c17360_2l7l _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21360154 _Citation.Full_citation . _Citation.Title 'Fast methionine-based solution structure determination of calcium-calmodulin complexes.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full 'Journal of biomolecular NMR' _Citation.Journal_volume 50 _Citation.Journal_issue 1 _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 71 _Citation.Page_last 81 _Citation.Year 2011 _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 Jessica Gifford . L. . c17360_2l7l 1 2 Hiroaki Ishida . . . c17360_2l7l 1 3 Hans Vogel . J. . c17360_2l7l 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c17360_2l7l _Assembly.ID 1 _Assembly.Name 'calcium-calmodulin complexes' _Assembly.BMRB_code . _Assembly.Number_of_components 6 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A . yes native no no . . . c17360_2l7l 1 2 entity_2 2 $entity_2 B . yes native no no . . . c17360_2l7l 1 3 'CALCIUM ION_1' 3 $CA C . no native no no . . . c17360_2l7l 1 4 'CALCIUM ION_2' 3 $CA D . no native no no . . . c17360_2l7l 1 5 'CALCIUM ION_3' 3 $CA E . no native no no . . . c17360_2l7l 1 6 'CALCIUM ION_4' 3 $CA F . no native no no . . . c17360_2l7l 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID c17360_2l7l _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; ADQLTEEQIAEFKEAFSLFD KDGDGTITTKELGTVMRSLG QNPTEAELQDMINEVDADGN GTIDFPEFLTMMARKMKDTD SEEEIREAFRVFDKDGNGYI SAAELRHVMTNLGEKLTDEE VDEMIREADIDGDGQVNYEE FVQMMTAK ; _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 148 _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 16721.465 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2013-05-12 loop_ _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID no BMRB 15183 . calmodulin . . . . . 100.00 149 98.65 100.00 9.24e-100 . . . . c17360_2l7l 1 no BMRB 15184 . calmodulin . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 15185 . calmodulin . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 15186 . calmodulin . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 15187 . calmodulin . . . . . 100.00 149 98.65 100.00 9.24e-100 . . . . c17360_2l7l 1 no BMRB 15188 . calmodulin . . . . . 100.00 148 99.32 100.00 2.77e-100 . . . . c17360_2l7l 1 no BMRB 15191 . Calmodulin . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 15470 . calmodulin . . . . . 100.00 148 99.32 100.00 5.71e-100 . . . . c17360_2l7l 1 no BMRB 15624 . Calmodulin . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 15650 . calmodulin . . . . . 100.00 148 99.32 100.00 9.43e-100 . . . . c17360_2l7l 1 no BMRB 15852 . calmodulin . . . . . 100.00 148 99.32 100.00 9.43e-100 . . . . c17360_2l7l 1 no BMRB 1634 . calmodulin . . . . . 100.00 148 97.30 99.32 7.21e-98 . . . . c17360_2l7l 1 no BMRB 16418 . apoCaM . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 16465 . entity_1 . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 1648 . calmodulin . . . . . 100.00 148 97.30 99.32 7.21e-98 . . . . c17360_2l7l 1 no BMRB 16764 . CALMODULIN . . . . . 100.00 150 100.00 100.00 1.49e-100 . . . . c17360_2l7l 1 no BMRB 17264 . calmodulin . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 17771 . Calmodulin . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 17807 . Calmodulin . . . . . 99.32 147 100.00 100.00 7.25e-100 . . . . c17360_2l7l 1 no BMRB 18027 . CaM . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 18028 . CaM . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 18556 . Calmodulin . . . . . 100.00 148 98.65 99.32 7.52e-99 . . . . c17360_2l7l 1 no BMRB 19036 . calmodulin . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 4056 . calmodulin . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 5227 . CaM . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 547 . calmodulin . . . . . 100.00 148 97.30 99.32 7.21e-98 . . . . c17360_2l7l 1 no BMRB 6541 . calmodulin . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 6778 . calmodulin . . . . . 100.00 148 97.30 99.32 7.21e-98 . . . . c17360_2l7l 1 no BMRB 6798 . calmodulin . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 6802 . calmodulin . . . . . 100.00 148 98.65 99.32 9.99e-99 . . . . c17360_2l7l 1 no BMRB 6825 . calmodulin . . . . . 100.00 148 98.65 99.32 9.99e-99 . . . . c17360_2l7l 1 no BMRB 6830 . calmodulin . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 6831 . calmodulin . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 7018 . calmodulin . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no BMRB 7028 . calmodulin . . . . . 100.00 148 98.65 99.32 9.99e-99 . . . . c17360_2l7l 1 no BMRB 7029 . calmodulin . . . . . 100.00 148 98.65 99.32 9.99e-99 . . . . c17360_2l7l 1 no BMRB 7030 . calmodulin . . . . . 100.00 148 98.65 99.32 9.99e-99 . . . . c17360_2l7l 1 no BMRB 7031 . calmodulin . . . . . 100.00 148 98.65 99.32 9.99e-99 . . . . c17360_2l7l 1 no BMRB 7416 . calmodulin . . . . . 100.00 148 99.32 100.00 9.43e-100 . . . . c17360_2l7l 1 no BMRB 7417 . calmodulin . . . . . 100.00 148 99.32 100.00 9.43e-100 . . . . c17360_2l7l 1 no BMRB 7418 . calmodulin . . . . . 100.00 148 99.32 100.00 9.43e-100 . . . . c17360_2l7l 1 no BMRB 7423 . calmodulin . . . . . 100.00 148 99.32 100.00 9.43e-100 . . . . c17360_2l7l 1 no BMRB 7424 . calmodulin . . . . . 100.00 148 99.32 100.00 9.43e-100 . . . . c17360_2l7l 1 no BMRB 7425 . calmodulin . . . . . 100.00 148 99.32 100.00 9.43e-100 . . . . c17360_2l7l 1 no PDB 1A29 . 'Calmodulin Complexed With Trifluoperazine (1:2 Complex)' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1CFC . 'Calcium-Free Calmodulin' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1CFD . 'Calcium-Free Calmodulin' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1CFF . 'Nmr Solution Structure Of A Complex Of Calmodulin With A Binding Peptide Of The Ca2+-Pump' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1CKK . 'CalmodulinRAT CA2+CALMODULIN DEPENDENT PROTEIN KINASE Fragment' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1CLL . 'Calmodulin Structure Refined At 1.7 Angstroms Resolution' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1CM1 . 'Motions Of Calmodulin-Single-Conformer Refinement' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1CM4 . 'Motions Of Calmodulin-four-conformer Refinement' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1CTR . 'Drug Binding By Calmodulin: Crystal Structure Of A Calmodulin-Trifluoperazine Complex' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1DMO . 'Calmodulin, Nmr, 30 Structures' . . . . . 100.00 148 99.32 100.00 5.71e-100 . . . . c17360_2l7l 1 no PDB 1G4Y . '1.60 A Crystal Structure Of The Gating Domain From Small Conductance Potassium Channel Complexed With Calcium-Calmodulin' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1IQ5 . 'CalmodulinNEMATODE CA2+CALMODULIN DEPENDENT KINASE KINASE Fragment' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 1IWQ . 'Crystal Structure Of Marcks Calmodulin Binding Domain Peptide Complexed With Ca2+CALMODULIN' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1K90 . "Crystal Structure Of The Adenylyl Cyclase Domain Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And 3' Deoxy-Atp" . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1K93 . 'Crystal Structure Of The Adenylyl Cyclase Domain Of Anthrax Edema Factor (Ef) In Complex With Calmodulin' . . . . . 97.30 144 100.00 100.00 1.26e-97 . . . . c17360_2l7l 1 no PDB 1L7Z . 'Crystal Structure Of Ca2+/calmodulin Complexed With Myristoylated Cap-23/nap-22 Peptide' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1LIN . 'Calmodulin Complexed With Trifluoperazine (1:4 Complex)' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1LVC . "Crystal Structure Of The Adenylyl Cyclase Domain Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And 2' Deoxy, 3' Anthr" . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 1MUX . 'Solution Nmr Structure Of CalmodulinW-7 Complex: The Basis Of Diversity In Molecular Recognition, 30 Structures' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1MXE . 'Structure Of The Complex Of Calmodulin With The Target Sequence Of Camki' . . . . . 100.00 148 97.97 99.32 1.92e-98 . . . . c17360_2l7l 1 no PDB 1NWD . 'Solution Structure Of Ca2+CALMODULIN BOUND TO THE C- Terminal Domain Of Petunia Glutamate Decarboxylase' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1OOJ . 'Structural Genomics Of Caenorhabditis Elegans : Calmodulin' . . . . . 100.00 149 97.97 98.65 3.63e-98 . . . . c17360_2l7l 1 no PDB 1PRW . 'Crystal Structure Of Bovine Brain Ca++ Calmodulin In A Compact Form' . . . . . 100.00 149 99.32 99.32 1.21e-99 . . . . c17360_2l7l 1 no PDB 1QIV . "Calmodulin Complexed With N-(3,3,-Diphenylpropyl)-N'-[1-R-( 3,4-Bis-Butoxyphenyl)-Ethyl]-Propylenediamine (Dpd), 1:2 Complex" . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1QIW . "Calmodulin Complexed With N-(3,3,-Diphenylpropyl)-N'-[1-R-( 3,4-Bis-Butoxyphenyl)-Ethyl]-Propylenediamine (Dpd)" . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1QX5 . 'Crystal Structure Of Apocalmodulin' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1S26 . "Structure Of Anthrax Edema Factor-calmodulin-alpha,beta- Methyleneadenosine 5'-triphosphate Complex Reveals An Alternative Mode" . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1SK6 . "Crystal Structure Of The Adenylyl Cyclase Domain Of Anthrax Edema Factor (Ef) In Complex With Calmodulin, 3',5' Cyclic Amp (Cam" . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1SY9 . 'Structure Of Calmodulin Complexed With A Fragment Of The Olfactory Cng Channel' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1UP5 . 'Chicken Calmodulin' . . . . . 100.00 148 99.32 99.32 1.17e-99 . . . . c17360_2l7l 1 no PDB 1WRZ . 'Calmodulin Complexed With A Peptide From A Human Death-Associated Protein Kinase' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 1X02 . 'Solution Structure Of Stereo Array Isotope Labeled (Sail) Calmodulin' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1XA5 . 'Structure Of Calmodulin In Complex With Kar-2, A Bis-Indol Alkaloid' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 1XFU . 'Crystal Structure Of Anthrax Edema Factor (ef) Truncation Mutant, Ef-delta 64 In Complex With Calmodulin' . . . . . 100.00 149 99.32 100.00 3.46e-100 . . . . c17360_2l7l 1 no PDB 1XFV . "Crystal Structure Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And 3' Deoxy-Atp" . . . . . 100.00 149 99.32 100.00 3.46e-100 . . . . c17360_2l7l 1 no PDB 1XFW . "Crystal Structure Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And 3'5' Cyclic Amp (Camp)" . . . . . 100.00 149 99.32 100.00 3.46e-100 . . . . c17360_2l7l 1 no PDB 1XFY . 'Crystal Structure Of Anthrax Edema Factor (Ef) In Complex With Calmodulin' . . . . . 100.00 149 99.32 100.00 3.46e-100 . . . . c17360_2l7l 1 no PDB 1XFZ . 'Crystal Structure Of Anthrax Edema Factor (ef) In Complex With Calmodulin In The Presence Of 1 Millimolar Exogenously Added Cal' . . . . . 100.00 149 99.32 100.00 3.46e-100 . . . . c17360_2l7l 1 no PDB 1Y0V . 'Crystal Structure Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And Pyrophosphate' . . . . . 97.30 146 100.00 100.00 1.08e-97 . . . . c17360_2l7l 1 no PDB 1YR5 . '1.7-A Structure Of Calmodulin Bound To A Peptide From Dap Kinase' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2BBM . 'Solution Structure Of A Calmodulin-Target Peptide Complex By Multidimensional Nmr' . . . . . 100.00 148 97.97 99.32 1.92e-98 . . . . c17360_2l7l 1 no PDB 2BBN . 'Solution Structure Of A Calmodulin-Target Peptide Complex By Multidimensional Nmr' . . . . . 100.00 148 97.97 99.32 1.92e-98 . . . . c17360_2l7l 1 no PDB 2BCX . 'Crystal Structure Of Calmodulin In Complex With A Ryanodine Receptor Peptide' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2BKH . 'Myosin Vi Nucleotide-Free (Mdinsert2) Crystal Structure' . . . . . 100.00 149 97.97 99.32 1.46e-98 . . . . c17360_2l7l 1 no PDB 2BKI . 'Myosin Vi Nucleotide-Free (Mdinsert2-Iq) Crystal Structure' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 2DFS . '3-D Structure Of Myosin-V Inhibited State' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2F2O . 'Structure Of Calmodulin Bound To A Calcineurin Peptide: A New Way Of Making An Old Binding Mode' . . . . . 100.00 179 100.00 100.00 1.81e-100 . . . . c17360_2l7l 1 no PDB 2F2P . 'Structure Of Calmodulin Bound To A Calcineurin Peptide: A New Way Of Making An Old Binding Mode' . . . . . 100.00 179 100.00 100.00 1.81e-100 . . . . c17360_2l7l 1 no PDB 2F3Y . 'CalmodulinIQ DOMAIN COMPLEX' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2F3Z . 'CalmodulinIQ-Aa Domain Complex' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2FOT . 'Crystal Structure Of The Complex Between Calmodulin And Alphaii-Spectrin' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2HQW . 'Crystal Structure Of Ca2+CALMODULIN BOUND TO NMDA RECEPTOR NR1C1 Peptide' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2JZI . 'Structure Of Calmodulin Complexed With The Calmodulin Binding Domain Of Calcineurin' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2K0E . 'A Coupled Equilibrium Shift Mechanism In Calmodulin- Mediated Signal Transduction' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2K0F . 'Calmodulin Complexed With Calmodulin-Binding Peptide From Smooth Muscle Myosin Light Chain Kinase' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2K0J . 'Solution Structure Of Cam Complexed To Drp1p' . . . . . 100.00 148 99.32 100.00 9.43e-100 . . . . c17360_2l7l 1 no PDB 2K61 . 'Solution Structure Of Cam Complexed To Dapk Peptide' . . . . . 100.00 148 99.32 100.00 9.43e-100 . . . . c17360_2l7l 1 no PDB 2KDU . 'Structural Basis Of The Munc13-1CA2+-Calmodulin Interaction: A Novel 1-26 Calmodulin Binding Motif With A Bipartite Binding Mod' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2KNE . 'Calmodulin Wraps Around Its Binding Domain In The Plasma Membrane Ca2+ Pump Anchored By A Novel 18-1 Motif' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2L53 . 'Solution Nmr Structure Of Apo-Calmodulin In Complex With The Iq Motif Of Human Cardiac Sodium Channel Nav1.5' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2L7L . 'Solution Structure Of Ca2+CALMODULIN COMPLEXED WITH A PEPTIDE Representing The Calmodulin-Binding Domain Of Calmodulin Kinase I' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2LGF . 'Solution Structure Of Ca2+CALMODULIN COMPLEXED WITH A PEPTIDE Representing The Calmodulin-Binding Domain Of L-Selectin' . . . . . 98.65 146 100.00 100.00 3.03e-99 . . . . c17360_2l7l 1 no PDB 2LL6 . 'Solution Nmr Structure Of Cam Bound To Inos Cam Binding Domain Peptide' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2LL7 . 'Solution Nmr Structure Of Cam Bound To The Enos Cam Binding Domain Peptide' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2LV6 . 'The Complex Between Ca-calmodulin And Skeletal Muscle Myosin Light Chain Kinase From Combination Of Nmr And Aqueous And Contras' . . . . . 100.00 148 98.65 99.32 7.52e-99 . . . . c17360_2l7l 1 no PDB 2O5G . 'Calmodulin-Smooth Muscle Light Chain Kinase Peptide Complex' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2O60 . 'Calmodulin Bound To Peptide From Neuronal Nitric Oxide Synthase' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2R28 . 'The Complex Structure Of Calmodulin Bound To A Calcineurin Peptide' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 2V01 . 'Recombinant Vertebrate Calmodulin Complexed With Pb' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 2V02 . 'Recombinant Vertebrate Calmodulin Complexed With Ba' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 2VAS . 'Myosin Vi (Md-Insert2-Cam, Delta-Insert1) Post-Rigor State' . . . . . 100.00 149 97.97 99.32 1.46e-98 . . . . c17360_2l7l 1 no PDB 2VAY . 'Calmodulin Complexed With Cav1.1 Iq Peptide' . . . . . 98.65 146 100.00 100.00 3.03e-99 . . . . c17360_2l7l 1 no PDB 2VB6 . 'Myosin Vi (Md-Insert2-Cam, Delta Insert1) Post-Rigor State ( Crystal Form 2)' . . . . . 100.00 149 97.30 99.32 3.55e-98 . . . . c17360_2l7l 1 no PDB 2W73 . 'High-Resolution Structure Of The Complex Between Calmodulin And A Peptide From Calcineurin A' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 2WEL . 'Crystal Structure Of Su6656-Bound CalciumCALMODULIN- Dependent Protein Kinase Ii Delta In Complex With Calmodulin' . . . . . 100.00 150 100.00 100.00 1.35e-100 . . . . c17360_2l7l 1 no PDB 2X0G . 'X-ray Structure Of A Dap-kinase Calmodulin Complex' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 2X51 . 'M6 Delta Insert1' . . . . . 100.00 149 97.97 99.32 1.46e-98 . . . . c17360_2l7l 1 no PDB 2Y4V . 'Crystal Structure Of Human Calmodulin In Complex With A Dap Kinase-1 Mutant (W305y) Peptide' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 2YGG . 'Complex Of Cambr And Cam' . . . . . 100.00 150 100.00 100.00 1.59e-100 . . . . c17360_2l7l 1 no PDB 3BXK . 'Crystal Structure Of The PQ-Type Calcium Channel (Cav2.1) Iq Domain And Ca2+calmodulin Complex' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 3BXL . 'Crystal Structure Of The R-Type Calcium Channel (Cav2.3) Iq Domain And Ca2+calmodulin Complex' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 3BYA . 'Structure Of A Calmodulin Complex' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 3CLN . 'Structure Of Calmodulin Refined At 2.2 Angstroms Resolution' . . . . . 100.00 148 99.32 100.00 5.71e-100 . . . . c17360_2l7l 1 no PDB 3DVE . 'Crystal Structure Of Ca2+CAM-Cav2.2 Iq Domain Complex' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 3DVJ . 'Crystal Structure Of Ca2+CAM-Cav2.2 Iq Domain (Without Cloning Artifact, Hm To Tv) Complex' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 3DVK . 'Crystal Structure Of Ca2+CAM-Cav2.3 Iq Domain Complex' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 3DVM . 'Crystal Structure Of Ca2+CAM-Cav2.1 Iq Domain Complex' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 3EK4 . 'Calcium-Saturated Gcamp2 Monomer' . . . . . 99.32 449 100.00 100.00 3.46e-96 . . . . c17360_2l7l 1 no PDB 3EK7 . 'Calcium-Saturated Gcamp2 Dimer' . . . . . 99.32 449 100.00 100.00 3.46e-96 . . . . c17360_2l7l 1 no PDB 3EK8 . 'Calcium-Saturated Gcamp2 T116vG87R MUTANT MONOMER' . . . . . 99.32 449 100.00 100.00 3.61e-96 . . . . c17360_2l7l 1 no PDB 3EKH . 'Calcium-Saturated Gcamp2 T116vK378W MUTANT MONOMER' . . . . . 99.32 449 99.32 99.32 2.94e-95 . . . . c17360_2l7l 1 no PDB 3EVU . 'Crystal Structure Of Calcium Bound Dimeric Gcamp2, (#1)' . . . . . 99.32 449 100.00 100.00 3.46e-96 . . . . c17360_2l7l 1 no PDB 3EVV . 'Crystal Structure Of Calcium Bound Dimeric Gcamp2 (#2)' . . . . . 99.32 449 100.00 100.00 3.46e-96 . . . . c17360_2l7l 1 no PDB 3EWT . 'Crystal Structure Of Calmodulin Complexed With A Peptide' . . . . . 100.00 154 100.00 100.00 5.85e-101 . . . . c17360_2l7l 1 no PDB 3EWV . 'Crystal Structure Of Calmodulin Complexed With A Peptide' . . . . . 100.00 154 100.00 100.00 5.85e-101 . . . . c17360_2l7l 1 no PDB 3G43 . 'Crystal Structure Of The Calmodulin-Bound Cav1.2 C-Terminal Regulatory Domain Dimer' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 3GN4 . 'Myosin Lever Arm' . . . . . 100.00 149 97.97 99.32 1.46e-98 . . . . c17360_2l7l 1 no PDB 3GOF . 'Calmodulin Bound To Peptide From Macrophage Nitric Oxide Synthase' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 3HR4 . 'Human Inos Reductase And Calmodulin Complex' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 3IF7 . 'Structure Of Calmodulin Complexed With Its First Endogenous Inhibitor, Sphingosylphosphorylcholine' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 3L9I . 'Myosin Vi Nucleotide-Free (Mdinsert2) L310g Mutant Crystal Structure' . . . . . 100.00 149 97.97 99.32 1.46e-98 . . . . c17360_2l7l 1 no PDB 3O77 . 'The Structure Of Ca2+ Sensor (Case-16)' . . . . . 99.32 415 100.00 100.00 1.64e-96 . . . . c17360_2l7l 1 no PDB 3O78 . 'The Structure Of Ca2+ Sensor (Case-12)' . . . . . 99.32 415 100.00 100.00 1.57e-96 . . . . c17360_2l7l 1 no PDB 3OXQ . 'Crystal Structure Of Ca2+CAM-Cav1.2 Pre-IqIQ DOMAIN COMPLEX' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 3SG2 . 'Crystal Structure Of Gcamp2-T116v,D381y' . . . . . 99.32 449 99.32 99.32 4.68e-95 . . . . c17360_2l7l 1 no PDB 3SG3 . 'Crystal Structure Of Gcamp3-D380y' . . . . . 99.32 449 98.64 99.32 3.93e-94 . . . . c17360_2l7l 1 no PDB 3SG4 . 'Crystal Structure Of Gcamp3-D380y, Lp(Linker 2)' . . . . . 100.00 448 97.97 98.65 3.32e-94 . . . . c17360_2l7l 1 no PDB 3SG5 . 'Crystal Structure Of Dimeric Gcamp3-D380y, Qp(Linker 1), Lp(Linker 2)' . . . . . 100.00 448 97.97 98.65 2.73e-94 . . . . c17360_2l7l 1 no PDB 3SG6 . 'Crystal Structure Of Dimeric Gcamp2-Lia(Linker 1)' . . . . . 99.32 450 100.00 100.00 3.26e-96 . . . . c17360_2l7l 1 no PDB 3SG7 . 'Crystal Structure Of Gcamp3-Kf(Linker 1)' . . . . . 99.32 448 99.32 100.00 2.04e-95 . . . . c17360_2l7l 1 no PDB 3SJQ . 'Crystal Structure Of A Small Conductance Potassium Channel Splice Variant Complexed With Calcium-Calmodulin' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 3SUI . 'Crystal Structure Of Ca2+-Calmodulin In Complex With A Trpv1 C- Terminal Peptide' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 3U0K . 'Crystal Structure Of The Genetically Encoded Calcium Indicator Rcamp' . . . . . 99.32 440 98.64 99.32 8.15e-95 . . . . c17360_2l7l 1 no PDB 4ANJ . 'Myosin Vi (Mdinsert2-Gfp Fusion) Pre-Powerstroke State (Mg.Adp.Alf4)' . . . . . 100.00 149 97.97 99.32 1.46e-98 . . . . c17360_2l7l 1 no PDB 4CLN . 'Structure Of A Recombinant Calmodulin From Drosophila Melanogaster Refined At 2.2-Angstroms Resolution' . . . . . 100.00 148 97.97 99.32 1.92e-98 . . . . c17360_2l7l 1 no PDB 4DBP . 'Myosin Vi Nucleotide-free (mdinsert2) D179y Crystal Structure' . . . . . 100.00 149 97.97 99.32 1.46e-98 . . . . c17360_2l7l 1 no PDB 4DBQ . 'Myosin Vi D179y (md-insert2-cam, Delta-insert1) Post-rigor State' . . . . . 100.00 149 97.97 99.32 1.46e-98 . . . . c17360_2l7l 1 no PDB 4DCK . 'Crystal Structure Of The C-Terminus Of Voltage-Gated Sodium Channel In Complex With Fgf13 And Cam' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 4DJC . '1.35 A Crystal Structure Of The Nav1.5 Diii-Iv-CaCAM COMPLEX' . . . . . 100.00 152 100.00 100.00 1.02e-100 . . . . c17360_2l7l 1 no PDB 4E50 . 'Calmodulin And Ng Peptide Complex' . . . . . 98.65 185 100.00 100.00 9.25e-99 . . . . c17360_2l7l 1 no PDB 4EHQ . 'Crystal Structure Of Calmodulin Binding Domain Of Orai1 In Complex With Ca2+CALMODULIN DISPLAYS A UNIQUE BINDING MODE' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PDB 4G27 . 'Calcium-Calmodulin Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Splice Variant And P' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 4G28 . 'Calcium-Calmodulin Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Splice Variant And E' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 4HEX . 'A Novel Conformation Of Calmodulin' . . . . . 100.00 156 100.00 100.00 6.25e-101 . . . . c17360_2l7l 1 no PDB 4J9Y . 'Calcium-calmodulin Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Splice Variant' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PDB 4J9Z . 'Calcium-calmodulin Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Splice Variant And N' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no DBJ BAA08302 . 'calmodulin [Homo sapiens]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no DBJ BAA11896 . 'calmodulin [Anas platyrhynchos]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no DBJ BAA19786 . 'calmodulin [Branchiostoma lanceolatum]' . . . . . 100.00 149 97.97 99.32 1.46e-98 . . . . c17360_2l7l 1 no DBJ BAA19787 . 'calmodulin [Branchiostoma floridae]' . . . . . 100.00 149 97.97 99.32 1.46e-98 . . . . c17360_2l7l 1 no DBJ BAA19788 . 'calmodulin [Halocynthia roretzi]' . . . . . 100.00 149 97.97 99.32 1.46e-98 . . . . c17360_2l7l 1 no EMBL CAA10601 . 'calmodulin [Caenorhabditis elegans]' . . . . . 100.00 149 97.97 98.65 3.63e-98 . . . . c17360_2l7l 1 no EMBL CAA32050 . 'calmodulin [Rattus norvegicus]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no EMBL CAA32062 . 'calmodulin II [Rattus norvegicus]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no EMBL CAA32119 . 'calmodulin [Rattus norvegicus]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no EMBL CAA32120 . 'calmodulin [Rattus norvegicus]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no GB AAA35635 . 'calmodulin [Homo sapiens]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no GB AAA35641 . 'calmodulin [Homo sapiens]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no GB AAA37365 . 'calmodulin synthesis [Mus musculus]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no GB AAA40862 . 'calmodulin [Rattus norvegicus]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no GB AAA40863 . 'calmodulin [Rattus norvegicus]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PIR JC1305 . 'calmodulin - Japanese medaka' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no PIR MCON . 'calmodulin - salmon' . . . . . 100.00 148 100.00 100.00 1.39e-100 . . . . c17360_2l7l 1 no PRF 0409298A . 'troponin C-like protein' . . . . . 100.00 148 97.30 100.00 7.20e-99 . . . . c17360_2l7l 1 no PRF 0608335A . calmodulin . . . . . 100.00 148 97.97 99.32 9.90e-98 . . . . c17360_2l7l 1 no REF NP_001008160 . 'calmodulin 2 (phosphorylase kinase, delta) [Xenopus (Silurana) tropicalis]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no REF NP_001009759 . 'calmodulin [Ovis aries]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no REF NP_001027633 . 'calmodulin [Ciona intestinalis]' . . . . . 100.00 149 97.30 98.65 9.48e-98 . . . . c17360_2l7l 1 no REF NP_001039714 . 'calmodulin [Bos taurus]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no REF NP_001040234 . 'calmodulin [Bombyx mori]' . . . . . 100.00 149 97.97 99.32 1.46e-98 . . . . c17360_2l7l 1 no SP O02367 . 'RecName: Full=Calmodulin; Short=CaM; AltName: Full=Ci-CaM' . . . . . 100.00 149 97.30 98.65 9.48e-98 . . . . c17360_2l7l 1 no SP O16305 . 'RecName: Full=Calmodulin; Short=CaM' . . . . . 100.00 149 97.97 98.65 3.63e-98 . . . . c17360_2l7l 1 no SP O96081 . 'RecName: Full=Calmodulin-B; Short=CaM B' . . . . . 100.00 149 97.30 98.65 1.07e-97 . . . . c17360_2l7l 1 no SP P02594 . 'RecName: Full=Calmodulin; Short=CaM' . . . . . 100.00 149 99.32 100.00 4.69e-100 . . . . c17360_2l7l 1 no SP P05932 . 'RecName: Full=Calmodulin-beta; Short=Cam B' . . . . . 93.24 138 97.10 99.28 1.49e-90 . . . . c17360_2l7l 1 no TPG DAA13808 . 'TPA: calmodulin 2-like [Bos taurus]' . . . . . 100.00 216 98.65 98.65 7.08e-99 . . . . c17360_2l7l 1 no TPG DAA18029 . 'TPA: calmodulin [Bos taurus]' . . . . . 100.00 149 98.65 99.32 2.14e-99 . . . . c17360_2l7l 1 no TPG DAA19590 . 'TPA: calmodulin 3 [Bos taurus]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no TPG DAA24777 . 'TPA: calmodulin 2-like [Bos taurus]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 1 no TPG DAA24988 . 'TPA: calmodulin 2-like isoform 1 [Bos taurus]' . . . . . 100.00 149 100.00 100.00 1.46e-100 . . . . c17360_2l7l 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 . ALA . c17360_2l7l 1 2 . ASP . c17360_2l7l 1 3 . GLN . c17360_2l7l 1 4 . LEU . c17360_2l7l 1 5 . THR . c17360_2l7l 1 6 . GLU . c17360_2l7l 1 7 . GLU . c17360_2l7l 1 8 . GLN . c17360_2l7l 1 9 . ILE . c17360_2l7l 1 10 . ALA . c17360_2l7l 1 11 . GLU . c17360_2l7l 1 12 . PHE . c17360_2l7l 1 13 . LYS . c17360_2l7l 1 14 . GLU . c17360_2l7l 1 15 . ALA . c17360_2l7l 1 16 . PHE . c17360_2l7l 1 17 . SER . c17360_2l7l 1 18 . LEU . c17360_2l7l 1 19 . PHE . c17360_2l7l 1 20 . ASP . c17360_2l7l 1 21 . LYS . c17360_2l7l 1 22 . ASP . c17360_2l7l 1 23 . GLY . c17360_2l7l 1 24 . ASP . c17360_2l7l 1 25 . GLY . c17360_2l7l 1 26 . THR . c17360_2l7l 1 27 . ILE . c17360_2l7l 1 28 . THR . c17360_2l7l 1 29 . THR . c17360_2l7l 1 30 . LYS . c17360_2l7l 1 31 . GLU . c17360_2l7l 1 32 . LEU . c17360_2l7l 1 33 . GLY . c17360_2l7l 1 34 . THR . c17360_2l7l 1 35 . VAL . c17360_2l7l 1 36 . MET . c17360_2l7l 1 37 . ARG . c17360_2l7l 1 38 . SER . c17360_2l7l 1 39 . LEU . c17360_2l7l 1 40 . GLY . c17360_2l7l 1 41 . GLN . c17360_2l7l 1 42 . ASN . c17360_2l7l 1 43 . PRO . c17360_2l7l 1 44 . THR . c17360_2l7l 1 45 . GLU . c17360_2l7l 1 46 . ALA . c17360_2l7l 1 47 . GLU . c17360_2l7l 1 48 . LEU . c17360_2l7l 1 49 . GLN . c17360_2l7l 1 50 . ASP . c17360_2l7l 1 51 . MET . c17360_2l7l 1 52 . ILE . c17360_2l7l 1 53 . ASN . c17360_2l7l 1 54 . GLU . c17360_2l7l 1 55 . VAL . c17360_2l7l 1 56 . ASP . c17360_2l7l 1 57 . ALA . c17360_2l7l 1 58 . ASP . c17360_2l7l 1 59 . GLY . c17360_2l7l 1 60 . ASN . c17360_2l7l 1 61 . GLY . c17360_2l7l 1 62 . THR . c17360_2l7l 1 63 . ILE . c17360_2l7l 1 64 . ASP . c17360_2l7l 1 65 . PHE . c17360_2l7l 1 66 . PRO . c17360_2l7l 1 67 . GLU . c17360_2l7l 1 68 . PHE . c17360_2l7l 1 69 . LEU . c17360_2l7l 1 70 . THR . c17360_2l7l 1 71 . MET . c17360_2l7l 1 72 . MET . c17360_2l7l 1 73 . ALA . c17360_2l7l 1 74 . ARG . c17360_2l7l 1 75 . LYS . c17360_2l7l 1 76 . MET . c17360_2l7l 1 77 . LYS . c17360_2l7l 1 78 . ASP . c17360_2l7l 1 79 . THR . c17360_2l7l 1 80 . ASP . c17360_2l7l 1 81 . SER . c17360_2l7l 1 82 . GLU . c17360_2l7l 1 83 . GLU . c17360_2l7l 1 84 . GLU . c17360_2l7l 1 85 . ILE . c17360_2l7l 1 86 . ARG . c17360_2l7l 1 87 . GLU . c17360_2l7l 1 88 . ALA . c17360_2l7l 1 89 . PHE . c17360_2l7l 1 90 . ARG . c17360_2l7l 1 91 . VAL . c17360_2l7l 1 92 . PHE . c17360_2l7l 1 93 . ASP . c17360_2l7l 1 94 . LYS . c17360_2l7l 1 95 . ASP . c17360_2l7l 1 96 . GLY . c17360_2l7l 1 97 . ASN . c17360_2l7l 1 98 . GLY . c17360_2l7l 1 99 . TYR . c17360_2l7l 1 100 . ILE . c17360_2l7l 1 101 . SER . c17360_2l7l 1 102 . ALA . c17360_2l7l 1 103 . ALA . c17360_2l7l 1 104 . GLU . c17360_2l7l 1 105 . LEU . c17360_2l7l 1 106 . ARG . c17360_2l7l 1 107 . HIS . c17360_2l7l 1 108 . VAL . c17360_2l7l 1 109 . MET . c17360_2l7l 1 110 . THR . c17360_2l7l 1 111 . ASN . c17360_2l7l 1 112 . LEU . c17360_2l7l 1 113 . GLY . c17360_2l7l 1 114 . GLU . c17360_2l7l 1 115 . LYS . c17360_2l7l 1 116 . LEU . c17360_2l7l 1 117 . THR . c17360_2l7l 1 118 . ASP . c17360_2l7l 1 119 . GLU . c17360_2l7l 1 120 . GLU . c17360_2l7l 1 121 . VAL . c17360_2l7l 1 122 . ASP . c17360_2l7l 1 123 . GLU . c17360_2l7l 1 124 . MET . c17360_2l7l 1 125 . ILE . c17360_2l7l 1 126 . ARG . c17360_2l7l 1 127 . GLU . c17360_2l7l 1 128 . ALA . c17360_2l7l 1 129 . ASP . c17360_2l7l 1 130 . ILE . c17360_2l7l 1 131 . ASP . c17360_2l7l 1 132 . GLY . c17360_2l7l 1 133 . ASP . c17360_2l7l 1 134 . GLY . c17360_2l7l 1 135 . GLN . c17360_2l7l 1 136 . VAL . c17360_2l7l 1 137 . ASN . c17360_2l7l 1 138 . TYR . c17360_2l7l 1 139 . GLU . c17360_2l7l 1 140 . GLU . c17360_2l7l 1 141 . PHE . c17360_2l7l 1 142 . VAL . c17360_2l7l 1 143 . GLN . c17360_2l7l 1 144 . MET . c17360_2l7l 1 145 . MET . c17360_2l7l 1 146 . THR . c17360_2l7l 1 147 . ALA . c17360_2l7l 1 148 . LYS . c17360_2l7l 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 . ALA 1 1 c17360_2l7l 1 . ASP 2 2 c17360_2l7l 1 . GLN 3 3 c17360_2l7l 1 . LEU 4 4 c17360_2l7l 1 . THR 5 5 c17360_2l7l 1 . GLU 6 6 c17360_2l7l 1 . GLU 7 7 c17360_2l7l 1 . GLN 8 8 c17360_2l7l 1 . ILE 9 9 c17360_2l7l 1 . ALA 10 10 c17360_2l7l 1 . GLU 11 11 c17360_2l7l 1 . PHE 12 12 c17360_2l7l 1 . LYS 13 13 c17360_2l7l 1 . GLU 14 14 c17360_2l7l 1 . ALA 15 15 c17360_2l7l 1 . PHE 16 16 c17360_2l7l 1 . SER 17 17 c17360_2l7l 1 . LEU 18 18 c17360_2l7l 1 . PHE 19 19 c17360_2l7l 1 . ASP 20 20 c17360_2l7l 1 . LYS 21 21 c17360_2l7l 1 . ASP 22 22 c17360_2l7l 1 . GLY 23 23 c17360_2l7l 1 . ASP 24 24 c17360_2l7l 1 . GLY 25 25 c17360_2l7l 1 . THR 26 26 c17360_2l7l 1 . ILE 27 27 c17360_2l7l 1 . THR 28 28 c17360_2l7l 1 . THR 29 29 c17360_2l7l 1 . LYS 30 30 c17360_2l7l 1 . GLU 31 31 c17360_2l7l 1 . LEU 32 32 c17360_2l7l 1 . GLY 33 33 c17360_2l7l 1 . THR 34 34 c17360_2l7l 1 . VAL 35 35 c17360_2l7l 1 . MET 36 36 c17360_2l7l 1 . ARG 37 37 c17360_2l7l 1 . SER 38 38 c17360_2l7l 1 . LEU 39 39 c17360_2l7l 1 . GLY 40 40 c17360_2l7l 1 . GLN 41 41 c17360_2l7l 1 . ASN 42 42 c17360_2l7l 1 . PRO 43 43 c17360_2l7l 1 . THR 44 44 c17360_2l7l 1 . GLU 45 45 c17360_2l7l 1 . ALA 46 46 c17360_2l7l 1 . GLU 47 47 c17360_2l7l 1 . LEU 48 48 c17360_2l7l 1 . GLN 49 49 c17360_2l7l 1 . ASP 50 50 c17360_2l7l 1 . MET 51 51 c17360_2l7l 1 . ILE 52 52 c17360_2l7l 1 . ASN 53 53 c17360_2l7l 1 . GLU 54 54 c17360_2l7l 1 . VAL 55 55 c17360_2l7l 1 . ASP 56 56 c17360_2l7l 1 . ALA 57 57 c17360_2l7l 1 . ASP 58 58 c17360_2l7l 1 . GLY 59 59 c17360_2l7l 1 . ASN 60 60 c17360_2l7l 1 . GLY 61 61 c17360_2l7l 1 . THR 62 62 c17360_2l7l 1 . ILE 63 63 c17360_2l7l 1 . ASP 64 64 c17360_2l7l 1 . PHE 65 65 c17360_2l7l 1 . PRO 66 66 c17360_2l7l 1 . GLU 67 67 c17360_2l7l 1 . PHE 68 68 c17360_2l7l 1 . LEU 69 69 c17360_2l7l 1 . THR 70 70 c17360_2l7l 1 . MET 71 71 c17360_2l7l 1 . MET 72 72 c17360_2l7l 1 . ALA 73 73 c17360_2l7l 1 . ARG 74 74 c17360_2l7l 1 . LYS 75 75 c17360_2l7l 1 . MET 76 76 c17360_2l7l 1 . LYS 77 77 c17360_2l7l 1 . ASP 78 78 c17360_2l7l 1 . THR 79 79 c17360_2l7l 1 . ASP 80 80 c17360_2l7l 1 . SER 81 81 c17360_2l7l 1 . GLU 82 82 c17360_2l7l 1 . GLU 83 83 c17360_2l7l 1 . GLU 84 84 c17360_2l7l 1 . ILE 85 85 c17360_2l7l 1 . ARG 86 86 c17360_2l7l 1 . GLU 87 87 c17360_2l7l 1 . ALA 88 88 c17360_2l7l 1 . PHE 89 89 c17360_2l7l 1 . ARG 90 90 c17360_2l7l 1 . VAL 91 91 c17360_2l7l 1 . PHE 92 92 c17360_2l7l 1 . ASP 93 93 c17360_2l7l 1 . LYS 94 94 c17360_2l7l 1 . ASP 95 95 c17360_2l7l 1 . GLY 96 96 c17360_2l7l 1 . ASN 97 97 c17360_2l7l 1 . GLY 98 98 c17360_2l7l 1 . TYR 99 99 c17360_2l7l 1 . ILE 100 100 c17360_2l7l 1 . SER 101 101 c17360_2l7l 1 . ALA 102 102 c17360_2l7l 1 . ALA 103 103 c17360_2l7l 1 . GLU 104 104 c17360_2l7l 1 . LEU 105 105 c17360_2l7l 1 . ARG 106 106 c17360_2l7l 1 . HIS 107 107 c17360_2l7l 1 . VAL 108 108 c17360_2l7l 1 . MET 109 109 c17360_2l7l 1 . THR 110 110 c17360_2l7l 1 . ASN 111 111 c17360_2l7l 1 . LEU 112 112 c17360_2l7l 1 . GLY 113 113 c17360_2l7l 1 . GLU 114 114 c17360_2l7l 1 . LYS 115 115 c17360_2l7l 1 . LEU 116 116 c17360_2l7l 1 . THR 117 117 c17360_2l7l 1 . ASP 118 118 c17360_2l7l 1 . GLU 119 119 c17360_2l7l 1 . GLU 120 120 c17360_2l7l 1 . VAL 121 121 c17360_2l7l 1 . ASP 122 122 c17360_2l7l 1 . GLU 123 123 c17360_2l7l 1 . MET 124 124 c17360_2l7l 1 . ILE 125 125 c17360_2l7l 1 . ARG 126 126 c17360_2l7l 1 . GLU 127 127 c17360_2l7l 1 . ALA 128 128 c17360_2l7l 1 . ASP 129 129 c17360_2l7l 1 . ILE 130 130 c17360_2l7l 1 . ASP 131 131 c17360_2l7l 1 . GLY 132 132 c17360_2l7l 1 . ASP 133 133 c17360_2l7l 1 . GLY 134 134 c17360_2l7l 1 . GLN 135 135 c17360_2l7l 1 . VAL 136 136 c17360_2l7l 1 . ASN 137 137 c17360_2l7l 1 . TYR 138 138 c17360_2l7l 1 . GLU 139 139 c17360_2l7l 1 . GLU 140 140 c17360_2l7l 1 . PHE 141 141 c17360_2l7l 1 . VAL 142 142 c17360_2l7l 1 . GLN 143 143 c17360_2l7l 1 . MET 144 144 c17360_2l7l 1 . MET 145 145 c17360_2l7l 1 . THR 146 146 c17360_2l7l 1 . ALA 147 147 c17360_2l7l 1 . LYS 148 148 c17360_2l7l 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID c17360_2l7l _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; AKSKWKQAFNATAVVRHMRK LQ ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details ; N-terminal acetylation C-terminal amidation ; _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 22 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment CaMKIp _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 2606.146 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2013-02-17 loop_ _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID no BMRB 5286 . CaMKIp . . . . . 90.91 22 100.00 100.00 1.70e-04 . . . . c17360_2l7l 2 no BMRB 5287 . CaMKI . . . . . 100.00 340 100.00 100.00 7.97e-06 . . . . c17360_2l7l 2 no BMRB 6798 . 'CaMKI peptide' . . . . . 95.45 22 100.00 100.00 4.81e-05 . . . . c17360_2l7l 2 no BMRB 7018 . 'Cys-CaMKI peptide' . . . . . 95.45 37 100.00 100.00 3.08e-05 . . . . c17360_2l7l 2 no PDB 1A06 . 'Calmodulin-Dependent Protein Kinase From Rat' . . . . . 100.00 332 100.00 100.00 3.89e-06 . . . . c17360_2l7l 2 no PDB 1MXE . 'Structure Of The Complex Of Calmodulin With The Target Sequence Of Camki' . . . . . 90.91 25 100.00 100.00 2.73e-04 . . . . c17360_2l7l 2 no PDB 2L7L . 'Solution Structure Of Ca2+CALMODULIN COMPLEXED WITH A PEPTIDE Representing The Calmodulin-Binding Domain Of Calmodulin Kinase I' . . . . . 100.00 22 100.00 100.00 8.91e-06 . . . . c17360_2l7l 2 no PDB 4FG8 . 'Crystal Structure Of Human Calcium/calmodulin-dependent Protein Kinase I 1-315 In Complex With Atp' . . . . . 77.27 315 100.00 100.00 1.40e-02 . . . . c17360_2l7l 2 no PDB 4FG9 . 'Crystal Structure Of Human Calcium/calmodulin-dependent Protein Kinase I 1-320 In Complex With Atp' . . . . . 100.00 320 100.00 100.00 5.35e-06 . . . . c17360_2l7l 2 no PDB 4FGB . 'Crystal Structure Of Human Calcium/calmodulin-dependent Protein Kinase I Apo Form' . . . . . 100.00 320 100.00 100.00 5.35e-06 . . . . c17360_2l7l 2 no DBJ BAE22345 . 'unnamed protein product [Mus musculus]' . . . . . 100.00 374 100.00 100.00 2.52e-06 . . . . c17360_2l7l 2 no DBJ BAE41623 . 'unnamed protein product [Mus musculus]' . . . . . 100.00 216 100.00 100.00 8.65e-07 . . . . c17360_2l7l 2 no DBJ BAG37428 . 'unnamed protein product [Homo sapiens]' . . . . . 100.00 370 100.00 100.00 2.49e-06 . . . . c17360_2l7l 2 no DBJ BAG70091 . 'calcium/calmodulin-dependent protein kinase I [Homo sapiens]' . . . . . 100.00 370 100.00 100.00 2.49e-06 . . . . c17360_2l7l 2 no DBJ BAG70221 . 'calcium/calmodulin-dependent protein kinase I [Homo sapiens]' . . . . . 100.00 370 100.00 100.00 2.49e-06 . . . . c17360_2l7l 2 no GB AAA66944 . 'CaM-like protein kinase [Rattus norvegicus]' . . . . . 100.00 374 100.00 100.00 2.52e-06 . . . . c17360_2l7l 2 no GB AAA99458 . 'cam kinase I [Homo sapiens]' . . . . . 100.00 370 100.00 100.00 2.49e-06 . . . . c17360_2l7l 2 no GB AAH14825 . 'Calcium/calmodulin-dependent protein kinase I [Mus musculus]' . . . . . 100.00 374 100.00 100.00 2.52e-06 . . . . c17360_2l7l 2 no GB AAH71177 . 'Calcium/calmodulin-dependent protein kinase I [Rattus norvegicus]' . . . . . 100.00 374 100.00 100.00 2.52e-06 . . . . c17360_2l7l 2 no GB AAI06755 . 'Calcium/calmodulin-dependent protein kinase I [Homo sapiens]' . . . . . 100.00 370 100.00 100.00 2.49e-06 . . . . c17360_2l7l 2 no PRF 2024225A . 'Ca/calmodulin protein kinase I' . . . . . 100.00 374 100.00 100.00 2.52e-06 . . . . c17360_2l7l 2 no REF NP_001070336 . 'calcium/calmodulin-dependent protein kinase type 1 [Bos taurus]' . . . . . 100.00 370 100.00 100.00 3.31e-06 . . . . c17360_2l7l 2 no REF NP_001177124 . 'calcium/calmodulin-dependent protein kinase type 1 [Sus scrofa]' . . . . . 100.00 370 100.00 100.00 2.49e-06 . . . . c17360_2l7l 2 no REF NP_001244800 . 'calcium/calmodulin-dependent protein kinase type 1 [Macaca mulatta]' . . . . . 100.00 370 100.00 100.00 2.49e-06 . . . . c17360_2l7l 2 no REF NP_003647 . 'calcium/calmodulin-dependent protein kinase type 1 [Homo sapiens]' . . . . . 100.00 370 100.00 100.00 2.49e-06 . . . . c17360_2l7l 2 no REF NP_598687 . 'calcium/calmodulin-dependent protein kinase type 1 [Mus musculus]' . . . . . 100.00 374 100.00 100.00 2.52e-06 . . . . c17360_2l7l 2 no SP Q14012 . 'RecName: Full=Calcium/calmodulin-dependent protein kinase type 1; AltName: Full=CaM kinase I; Short=CaM-KI; AltName: Full=CaM k' . . . . . 100.00 370 100.00 100.00 2.49e-06 . . . . c17360_2l7l 2 no SP Q63450 . 'RecName: Full=Calcium/calmodulin-dependent protein kinase type 1; AltName: Full=CaM kinase I; Short=CaM-KI; AltName: Full=CaM k' . . . . . 100.00 374 100.00 100.00 2.52e-06 . . . . c17360_2l7l 2 no SP Q91YS8 . 'RecName: Full=Calcium/calmodulin-dependent protein kinase type 1; AltName: Full=CaM kinase I; Short=CaM-KI; AltName: Full=CaM k' . . . . . 100.00 374 100.00 100.00 2.52e-06 . . . . c17360_2l7l 2 no TPG DAA17160 . 'TPA: calcium/calmodulin-dependent protein kinase type 1 [Bos taurus]' . . . . . 100.00 370 100.00 100.00 3.31e-06 . . . . c17360_2l7l 2 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 1 299 ALA . c17360_2l7l 2 2 300 LYS . c17360_2l7l 2 3 301 SER . c17360_2l7l 2 4 302 LYS . c17360_2l7l 2 5 303 TRP . c17360_2l7l 2 6 304 LYS . c17360_2l7l 2 7 305 GLN . c17360_2l7l 2 8 306 ALA . c17360_2l7l 2 9 307 PHE . c17360_2l7l 2 10 308 ASN . c17360_2l7l 2 11 309 ALA . c17360_2l7l 2 12 310 THR . c17360_2l7l 2 13 311 ALA . c17360_2l7l 2 14 312 VAL . c17360_2l7l 2 15 313 VAL . c17360_2l7l 2 16 314 ARG . c17360_2l7l 2 17 315 HIS . c17360_2l7l 2 18 316 MET . c17360_2l7l 2 19 317 ARG . c17360_2l7l 2 20 318 LYS . c17360_2l7l 2 21 319 LEU . c17360_2l7l 2 22 320 GLN . c17360_2l7l 2 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 . ALA 1 1 c17360_2l7l 2 . LYS 2 2 c17360_2l7l 2 . SER 3 3 c17360_2l7l 2 . LYS 4 4 c17360_2l7l 2 . TRP 5 5 c17360_2l7l 2 . LYS 6 6 c17360_2l7l 2 . GLN 7 7 c17360_2l7l 2 . ALA 8 8 c17360_2l7l 2 . PHE 9 9 c17360_2l7l 2 . ASN 10 10 c17360_2l7l 2 . ALA 11 11 c17360_2l7l 2 . THR 12 12 c17360_2l7l 2 . ALA 13 13 c17360_2l7l 2 . VAL 14 14 c17360_2l7l 2 . VAL 15 15 c17360_2l7l 2 . ARG 16 16 c17360_2l7l 2 . HIS 17 17 c17360_2l7l 2 . MET 18 18 c17360_2l7l 2 . ARG 19 19 c17360_2l7l 2 . LYS 20 20 c17360_2l7l 2 . LEU 21 21 c17360_2l7l 2 . GLN 22 22 c17360_2l7l 2 stop_ save_ save_CA _Entity.Sf_category entity _Entity.Sf_framecode CA _Entity.Entry_ID c17360_2l7l _Entity.ID 3 _Entity.BMRB_code . _Entity.Name CA _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _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 . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID CA _Entity.Nonpolymer_comp_label $chem_comp_CA _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 3 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . CA . c17360_2l7l 3 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 c17360_2l7l _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . . . . . . . . . . . c17360_2l7l 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 c17360_2l7l _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET30b(+) . . . . . . c17360_2l7l 1 2 2 $entity_2 . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . c17360_2l7l 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_CA _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_CA _Chem_comp.Entry_ID c17360_2l7l _Chem_comp.ID CA _Chem_comp.Provenance . _Chem_comp.Name 'CALCIUM ION' _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code CA _Chem_comp.Ambiguous_flag . _Chem_comp.Initial_date . _Chem_comp.Modified_date . _Chem_comp.Release_status . _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code CA _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InCHi_code . _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 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Ca _Chem_comp.Formula_weight 40.078 _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 . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Tue Jun 9 13:21:54 2009 ; _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 [Ca+2] SMILES ACDLabs 10.04 c17360_2l7l CA InChI=1/Ca/q+2 InChI InChI 1.02b c17360_2l7l CA BHPQYMZQTOCNFJ-UHFFFAOYAP InChIKey InChI 1.02b c17360_2l7l CA [Ca++] SMILES_CANONICAL CACTVS 3.341 c17360_2l7l CA [Ca++] SMILES CACTVS 3.341 c17360_2l7l CA [Ca+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c17360_2l7l CA [Ca+2] SMILES 'OpenEye OEToolkits' 1.5.0 c17360_2l7l CA 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 calcium 'SYSTEMATIC NAME' ACDLabs 10.04 c17360_2l7l CA 'calcium(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c17360_2l7l CA 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 CA . CA . . CA . . N 2 . . . . . . . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 . . c17360_2l7l CA stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID c17360_2l7l _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'Sample for backbone and side chain assignment of CaM in the complex' _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 entity_1 '[U-13C; U-15N]' . . 1 $entity_1 . . 0.95 . . mM . . . . c17360_2l7l 1 2 entity_2 'natural abundance' . . 2 $entity_2 . . 1.05 . . mM . . . . c17360_2l7l 1 3 'CALCIUM ION' 'natural abundance' . . 3 $CA . . 4 . . mM . . . . c17360_2l7l 1 4 DSS 'natural abundance' . . . . . . 0.5 . . mM . . . . c17360_2l7l 1 5 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . c17360_2l7l 1 6 Bis-Tris 'natural abundance' . . . . . . 20 . . mM . . . . c17360_2l7l 1 7 'sodium azide' 'natural abundance' . . . . . . 0.03 . . % . . . . c17360_2l7l 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID c17360_2l7l _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'Sample for collecting intrapeptide NOEs to determine the structure of the bound CaMKI' _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 entity_1 '[U-2H; U-15N]' . . 1 $entity_1 . . 0.66 . . mM . . . . c17360_2l7l 2 2 entity_2 'natural abundance' . . 2 $entity_2 . . 0.40 . . mM . . . . c17360_2l7l 2 3 Bis-Tris 'natural abundance' . . . . . . 20 . . mM . . . . c17360_2l7l 2 4 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . c17360_2l7l 2 5 'CALCIUM ION' 'natural abundance' . . 3 $CA . . 4 . . mM . . . . c17360_2l7l 2 6 'sodium azide' 'natural abundance' . . . . . . 0.03 . . % . . . . c17360_2l7l 2 7 DSS 'natural abundance' . . . . . . 0.5 . . mM . . . . c17360_2l7l 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID c17360_2l7l _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'Methionine methyl-labeled CaM sample for the collection of intermolecular NOEs between CaM and the bound peptide' _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 entity_1 '[1H/13C-methyl Met; U-2H; U-15N]' . . 1 $entity_1 . . 0.64 . . mM . . . . c17360_2l7l 3 2 entity_2 'natural abundance' . . 2 $entity_2 . . 0.83 . . mM . . . . c17360_2l7l 3 3 Bis-Tris 'natural abundance' . . . . . . 20 . . mM . . . . c17360_2l7l 3 4 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . c17360_2l7l 3 5 'CALCIUM ION' 'natural abundance' . . 3 $CA . . 4 . . mM . . . . c17360_2l7l 3 6 'sodium azide' 'natural abundance' . . . . . . 0.03 . . % . . . . c17360_2l7l 3 7 DSS 'natural abundance' . . . . . . 0.5 . . mM . . . . c17360_2l7l 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID c17360_2l7l _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'Isotropic U-13;U-15 sample for collection of CaM RDCs' _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 entity_1 '[U-13C; U-15N]' . . 1 $entity_1 . . 0.95 . . mM . . . . c17360_2l7l 4 2 entity_2 'natural abundance' . . 2 $entity_2 . . 1.05 . . mM . . . . c17360_2l7l 4 3 Bis-Tris 'natural abundance' . . . . . . 20 . . mM . . . . c17360_2l7l 4 4 'potassium chloride' 'natural abundance' . . . . . . 300 . . mM . . . . c17360_2l7l 4 5 'CALCIUM ION' 'natural abundance' . . 3 $CA . . 4 . . mM . . . . c17360_2l7l 4 6 'sodium azide' 'natural abundance' . . . . . . 0.03 . . % . . . . c17360_2l7l 4 7 DSS 'natural abundance' . . . . . . 0.5 . . mM . . . . c17360_2l7l 4 stop_ save_ save_sample_5 _Sample.Sf_category sample _Sample.Sf_framecode sample_5 _Sample.Entry_ID c17360_2l7l _Sample.ID 5 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'Anisotropic U13;U15 sample for the collection of CaM RDCs' _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 entity_1 '[U-13C; U-15N]' . . 1 $entity_1 . . 0.95 . . mM . . . . c17360_2l7l 5 2 entity_2 'natural abundance' . . 2 $entity_2 . . 1.05 . . mM . . . . c17360_2l7l 5 3 Bis-Tris 'natural abundance' . . . . . . 20 . . mM . . . . c17360_2l7l 5 4 'potassium chloride' 'natural abundance' . . . . . . 300 . . mM . . . . c17360_2l7l 5 5 'CALCIUM ION' 'natural abundance' . . 3 $CA . . 4 . . mM . . . . c17360_2l7l 5 6 'sodium azide' 'natural abundance' . . . . . . 0.03 . . % . . . . c17360_2l7l 5 7 DSS 'natural abundance' . . . . . . 0.5 . . mM . . . . c17360_2l7l 5 8 'Pf1 phage' 'natural abundance' . . . . . . 16 . . w/v . . . . c17360_2l7l 5 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 c17360_2l7l _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID temperature 303 . K c17360_2l7l 1 pH 6.8 . pH c17360_2l7l 1 pressure 1 . atm c17360_2l7l 1 'ionic strength' 0.1 . M c17360_2l7l 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID c17360_2l7l _Sample_condition_list.ID 2 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID temperature 303 . K c17360_2l7l 2 pH 6.8 . pH c17360_2l7l 2 pressure 1 . atm c17360_2l7l 2 'ionic strength' 0.3 . M c17360_2l7l 2 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID c17360_2l7l _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' . . c17360_2l7l 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing c17360_2l7l 1 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID c17360_2l7l _Software.ID 2 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . c17360_2l7l 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' c17360_2l7l 2 'peak picking' c17360_2l7l 2 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID c17360_2l7l _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' . . c17360_2l7l 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' c17360_2l7l 3 'structure solution' c17360_2l7l 3 refinement c17360_2l7l 3 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID c17360_2l7l _Software.ID 4 _Software.Name X-PLOR_NIH _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . c17360_2l7l 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' c17360_2l7l 4 refinement c17360_2l7l 4 stop_ save_ save_ProcheckNMR _Software.Sf_category software _Software.Sf_framecode ProcheckNMR _Software.Entry_ID c17360_2l7l _Software.ID 5 _Software.Name ProcheckNMR _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Laskowski and MacArthur' . . c17360_2l7l 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' c17360_2l7l 5 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID c17360_2l7l _Software.ID 6 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . c17360_2l7l 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' c17360_2l7l 6 stop_ save_ save_Molmol _Software.Sf_category software _Software.Sf_framecode Molmol _Software.Entry_ID c17360_2l7l _Software.ID 7 _Software.Name Molmol _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Koradi, Billeter and Wuthrich' . . c17360_2l7l 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' c17360_2l7l 7 stop_ save_ save_xwinnmr _Software.Sf_category software _Software.Sf_framecode xwinnmr _Software.Entry_ID c17360_2l7l _Software.ID 8 _Software.Name xwinnmr _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . c17360_2l7l 8 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection c17360_2l7l 8 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 c17360_2l7l _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 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 c17360_2l7l _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 . 500 . . . c17360_2l7l 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 c17360_2l7l _Experiment_list.ID 1 _Experiment_list.Details 'The structure was determined using a combination of NOE and residual dipolar coupling restraints.' loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_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.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c17360_2l7l 1 2 '2D 1H-13C HSQC' no . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c17360_2l7l 1 3 '2D 1H-1H COSY' no . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c17360_2l7l 1 4 '3D CBCA(CO)NH' no . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c17360_2l7l 1 5 '3D C(CO)NH' no . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c17360_2l7l 1 6 '3D HNCO' no . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c17360_2l7l 1 7 '3D HNCACB' no . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c17360_2l7l 1 8 '3D HBHA(CO)NH' no . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c17360_2l7l 1 9 '3D H(CCO)NH' no . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c17360_2l7l 1 10 '3D 1H-13C NOESY' no . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c17360_2l7l 1 11 '3D HN(CA)CO' no . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c17360_2l7l 1 12 '2D HMBC' no . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c17360_2l7l 1 13 '3D LRCH' no . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c17360_2l7l 1 14 'F2-filtered 2D 1H-1H NOESY' no . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c17360_2l7l 1 15 '2D 1H-15N IPAP HSQC' no . . 4 $sample_4 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . c17360_2l7l 1 16 '2D 1H-15N IPAP HSQC' no . . 5 $sample_5 anisotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . c17360_2l7l 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 c17360_2l7l _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . c17360_2l7l 1 C 13 DSS 'methyl protons' . . . . ppm 0.00 n/a indirect 0.251449530 . . . . . . . . . c17360_2l7l 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 n/a indirect 0.101329118 . . . . . . . . . c17360_2l7l 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 c17360_2l7l _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . c17360_2l7l 1 2 '2D 1H-13C HSQC' . . . c17360_2l7l 1 3 '2D 1H-1H COSY' . . . c17360_2l7l 1 4 '3D CBCA(CO)NH' . . . c17360_2l7l 1 5 '3D C(CO)NH' . . . c17360_2l7l 1 6 '3D HNCO' . . . c17360_2l7l 1 7 '3D HNCACB' . . . c17360_2l7l 1 8 '3D HBHA(CO)NH' . . . c17360_2l7l 1 9 '3D H(CCO)NH' . . . c17360_2l7l 1 11 '3D HN(CA)CO' . . . c17360_2l7l 1 12 '2D HMBC' . . . c17360_2l7l 1 13 '3D LRCH' . . . c17360_2l7l 1 14 'F2-filtered 2D 1H-1H NOESY' . . . c17360_2l7l 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 36 36 MET HA H 1 3.778 . . 1 . . . . 36 MET HA . c17360_2l7l 1 2 . 1 1 36 36 MET HE1 H 1 2.059 . . 1 . . . . 36 MET HE1 . c17360_2l7l 1 3 . 1 1 36 36 MET HE2 H 1 2.059 . . 1 . . . . 36 MET HE1 . c17360_2l7l 1 4 . 1 1 36 36 MET HE3 H 1 2.059 . . 1 . . . . 36 MET HE1 . c17360_2l7l 1 5 . 1 1 36 36 MET CE C 13 18.468 . . 1 . . . . 36 MET CE . c17360_2l7l 1 6 . 1 1 51 51 MET HA H 1 3.878 . . 1 . . . . 51 MET HA . c17360_2l7l 1 7 . 1 1 51 51 MET HE1 H 1 1.969 . . 1 . . . . 51 MET HE1 . c17360_2l7l 1 8 . 1 1 51 51 MET HE2 H 1 1.969 . . 1 . . . . 51 MET HE1 . c17360_2l7l 1 9 . 1 1 51 51 MET HE3 H 1 1.969 . . 1 . . . . 51 MET HE1 . c17360_2l7l 1 10 . 1 1 51 51 MET CE C 13 17.873 . . 1 . . . . 51 MET CE . c17360_2l7l 1 11 . 1 1 71 71 MET HA H 1 3.975 . . 1 . . . . 71 MET HA . c17360_2l7l 1 12 . 1 1 71 71 MET HE1 H 1 1.504 . . 1 . . . . 71 MET HE1 . c17360_2l7l 1 13 . 1 1 71 71 MET HE2 H 1 1.504 . . 1 . . . . 71 MET HE1 . c17360_2l7l 1 14 . 1 1 71 71 MET HE3 H 1 1.504 . . 1 . . . . 71 MET HE1 . c17360_2l7l 1 15 . 1 1 71 71 MET CE C 13 17.341 . . 1 . . . . 71 MET CE . c17360_2l7l 1 16 . 1 1 72 72 MET HA H 1 3.787 . . 1 . . . . 72 MET HA . c17360_2l7l 1 17 . 1 1 72 72 MET HE1 H 1 1.310 . . 1 . . . . 72 MET HE1 . c17360_2l7l 1 18 . 1 1 72 72 MET HE2 H 1 1.310 . . 1 . . . . 72 MET HE1 . c17360_2l7l 1 19 . 1 1 72 72 MET HE3 H 1 1.310 . . 1 . . . . 72 MET HE1 . c17360_2l7l 1 20 . 1 1 72 72 MET CE C 13 16.852 . . 1 . . . . 72 MET CE . c17360_2l7l 1 21 . 1 1 76 76 MET HA H 1 4.235 . . 1 . . . . 76 MET HA . c17360_2l7l 1 22 . 1 1 76 76 MET HE1 H 1 2.165 . . 1 . . . . 76 MET HE1 . c17360_2l7l 1 23 . 1 1 76 76 MET HE2 H 1 2.165 . . 1 . . . . 76 MET HE1 . c17360_2l7l 1 24 . 1 1 76 76 MET HE3 H 1 2.165 . . 1 . . . . 76 MET HE1 . c17360_2l7l 1 25 . 1 1 76 76 MET CE C 13 16.787 . . 1 . . . . 76 MET CE . c17360_2l7l 1 26 . 1 1 109 109 MET HA H 1 4.266 . . 1 . . . . 109 MET HA . c17360_2l7l 1 27 . 1 1 109 109 MET HE1 H 1 1.815 . . 1 . . . . 109 MET HE1 . c17360_2l7l 1 28 . 1 1 109 109 MET HE2 H 1 1.815 . . 1 . . . . 109 MET HE1 . c17360_2l7l 1 29 . 1 1 109 109 MET HE3 H 1 1.815 . . 1 . . . . 109 MET HE1 . c17360_2l7l 1 30 . 1 1 109 109 MET CE C 13 16.259 . . 1 . . . . 109 MET CE . c17360_2l7l 1 31 . 1 1 124 124 MET HA H 1 3.998 . . 1 . . . . 124 MET HA . c17360_2l7l 1 32 . 1 1 124 124 MET HE1 H 1 0.834 . . 1 . . . . 124 MET HE1 . c17360_2l7l 1 33 . 1 1 124 124 MET HE2 H 1 0.834 . . 1 . . . . 124 MET HE1 . c17360_2l7l 1 34 . 1 1 124 124 MET HE3 H 1 0.834 . . 1 . . . . 124 MET HE1 . c17360_2l7l 1 35 . 1 1 124 124 MET CE C 13 15.640 . . 1 . . . . 124 MET CE . c17360_2l7l 1 36 . 1 1 144 144 MET HA H 1 4.144 . . 1 . . . . 144 MET HA . c17360_2l7l 1 37 . 1 1 144 144 MET HE1 H 1 1.231 . . 1 . . . . 144 MET HE1 . c17360_2l7l 1 38 . 1 1 144 144 MET HE2 H 1 1.231 . . 1 . . . . 144 MET HE1 . c17360_2l7l 1 39 . 1 1 144 144 MET HE3 H 1 1.231 . . 1 . . . . 144 MET HE1 . c17360_2l7l 1 40 . 1 1 144 144 MET CE C 13 15.978 . . 1 . . . . 144 MET CE . c17360_2l7l 1 41 . 1 1 145 145 MET HA H 1 3.973 . . 1 . . . . 145 MET HA . c17360_2l7l 1 42 . 1 1 145 145 MET HE1 H 1 1.294 . . 1 . . . . 145 MET HE1 . c17360_2l7l 1 43 . 1 1 145 145 MET HE2 H 1 1.294 . . 1 . . . . 145 MET HE1 . c17360_2l7l 1 44 . 1 1 145 145 MET HE3 H 1 1.294 . . 1 . . . . 145 MET HE1 . c17360_2l7l 1 45 . 1 1 145 145 MET CE C 13 18.312 . . 1 . . . . 145 MET CE . c17360_2l7l 1 46 . 2 2 1 1 ALA H H 1 8.599 . . 1 . . . . 299 ALA HN . c17360_2l7l 1 47 . 2 2 1 1 ALA HA H 1 4.073 . . 1 . . . . 299 ALA HA . c17360_2l7l 1 48 . 2 2 1 1 ALA HB1 H 1 1.452 . . 1 . . . . 299 ALA HB1 . c17360_2l7l 1 49 . 2 2 1 1 ALA HB2 H 1 1.452 . . 1 . . . . 299 ALA HB1 . c17360_2l7l 1 50 . 2 2 1 1 ALA HB3 H 1 1.452 . . 1 . . . . 299 ALA HB1 . c17360_2l7l 1 51 . 2 2 2 2 LYS H H 1 8.761 . . 1 . . . . 300 LYS HN . c17360_2l7l 1 52 . 2 2 2 2 LYS HA H 1 4.277 . . 1 . . . . 300 LYS HA . c17360_2l7l 1 53 . 2 2 2 2 LYS HB2 H 1 1.917 . . 2 . . . . 300 LYS HB1 . c17360_2l7l 1 54 . 2 2 2 2 LYS HG2 H 1 1.451 . . 2 . . . . 300 LYS HG2 . c17360_2l7l 1 55 . 2 2 2 2 LYS HG3 H 1 1.544 . . 2 . . . . 300 LYS HG3 . c17360_2l7l 1 56 . 2 2 2 2 LYS HD2 H 1 1.717 . . 2 . . . . 300 LYS HD1 . c17360_2l7l 1 57 . 2 2 2 2 LYS HE2 H 1 2.980 . . 2 . . . . 300 LYS HE1 . c17360_2l7l 1 58 . 2 2 3 3 SER H H 1 8.036 . . 1 . . . . 301 SER HN . c17360_2l7l 1 59 . 2 2 3 3 SER HA H 1 4.323 . . 1 . . . . 301 SER HA . c17360_2l7l 1 60 . 2 2 3 3 SER HB2 H 1 4.008 . . 2 . . . . 301 SER HB2 . c17360_2l7l 1 61 . 2 2 3 3 SER HB3 H 1 4.060 . . 2 . . . . 301 SER HB3 . c17360_2l7l 1 62 . 2 2 4 4 LYS H H 1 8.045 . . 1 . . . . 302 LYS HN . c17360_2l7l 1 63 . 2 2 4 4 LYS HA H 1 4.230 . . 1 . . . . 302 LYS HA . c17360_2l7l 1 64 . 2 2 4 4 LYS HB2 H 1 1.945 . . 2 . . . . 302 LYS HB1 . c17360_2l7l 1 65 . 2 2 4 4 LYS HG2 H 1 1.463 . . 2 . . . . 302 LYS HG2 . c17360_2l7l 1 66 . 2 2 4 4 LYS HG3 H 1 1.569 . . 2 . . . . 302 LYS HG3 . c17360_2l7l 1 67 . 2 2 4 4 LYS HD2 H 1 1.712 . . 2 . . . . 302 LYS HD1 . c17360_2l7l 1 68 . 2 2 4 4 LYS HE2 H 1 2.859 . . 2 . . . . 302 LYS HE1 . c17360_2l7l 1 69 . 2 2 5 5 TRP H H 1 8.145 . . 1 . . . . 303 TRP HN . c17360_2l7l 1 70 . 2 2 5 5 TRP HA H 1 4.260 . . 1 . . . . 303 TRP HA . c17360_2l7l 1 71 . 2 2 5 5 TRP HB2 H 1 3.000 . . 2 . . . . 303 TRP HB2 . c17360_2l7l 1 72 . 2 2 5 5 TRP HB3 H 1 3.446 . . 2 . . . . 303 TRP HB3 . c17360_2l7l 1 73 . 2 2 5 5 TRP HD1 H 1 7.139 . . 1 . . . . 303 TRP HD1 . c17360_2l7l 1 74 . 2 2 5 5 TRP HE1 H 1 10.371 . . 1 . . . . 303 TRP HE1 . c17360_2l7l 1 75 . 2 2 5 5 TRP HE3 H 1 7.391 . . 1 . . . . 303 TRP HE3 . c17360_2l7l 1 76 . 2 2 5 5 TRP HZ2 H 1 7.109 . . 1 . . . . 303 TRP HZ2 . c17360_2l7l 1 77 . 2 2 5 5 TRP HZ3 H 1 6.472 . . 1 . . . . 303 TRP HZ3 . c17360_2l7l 1 78 . 2 2 5 5 TRP HH2 H 1 6.848 . . 1 . . . . 303 TRP HH2 . c17360_2l7l 1 79 . 2 2 6 6 LYS H H 1 8.184 . . 1 . . . . 304 LYS HN . c17360_2l7l 1 80 . 2 2 6 6 LYS HA H 1 4.206 . . 1 . . . . 304 LYS HA . c17360_2l7l 1 81 . 2 2 6 6 LYS HB2 H 1 2.027 . . 2 . . . . 304 LYS HB1 . c17360_2l7l 1 82 . 2 2 6 6 LYS HG2 H 1 1.557 . . 2 . . . . 304 LYS HG1 . c17360_2l7l 1 83 . 2 2 6 6 LYS HD2 H 1 1.670 . . 2 . . . . 304 LYS HD1 . c17360_2l7l 1 84 . 2 2 6 6 LYS HE2 H 1 2.864 . . 2 . . . . 304 LYS HE1 . c17360_2l7l 1 85 . 2 2 7 7 GLN H H 1 8.284 . . 1 . . . . 305 GLN HN . c17360_2l7l 1 86 . 2 2 7 7 GLN HA H 1 4.486 . . 1 . . . . 305 GLN HA . c17360_2l7l 1 87 . 2 2 7 7 GLN HB2 H 1 2.258 . . 2 . . . . 305 GLN HB2 . c17360_2l7l 1 88 . 2 2 7 7 GLN HB3 H 1 2.295 . . 2 . . . . 305 GLN HB3 . c17360_2l7l 1 89 . 2 2 7 7 GLN HG2 H 1 2.235 . . 2 . . . . 305 GLN HG2 . c17360_2l7l 1 90 . 2 2 7 7 GLN HG3 H 1 2.456 . . 2 . . . . 305 GLN HG3 . c17360_2l7l 1 91 . 2 2 7 7 GLN HE21 H 1 7.212 . . 2 . . . . 305 GLN HE21 . c17360_2l7l 1 92 . 2 2 7 7 GLN HE22 H 1 6.974 . . 2 . . . . 305 GLN HE22 . c17360_2l7l 1 93 . 2 2 8 8 ALA H H 1 7.789 . . 1 . . . . 306 ALA HN . c17360_2l7l 1 94 . 2 2 8 8 ALA HA H 1 4.045 . . 1 . . . . 306 ALA HA . c17360_2l7l 1 95 . 2 2 8 8 ALA HB1 H 1 1.600 . . 1 . . . . 306 ALA HB1 . c17360_2l7l 1 96 . 2 2 8 8 ALA HB2 H 1 1.600 . . 1 . . . . 306 ALA HB1 . c17360_2l7l 1 97 . 2 2 8 8 ALA HB3 H 1 1.600 . . 1 . . . . 306 ALA HB1 . c17360_2l7l 1 98 . 2 2 9 9 PHE H H 1 8.961 . . 1 . . . . 307 PHE HN . c17360_2l7l 1 99 . 2 2 9 9 PHE HA H 1 4.346 . . 1 . . . . 307 PHE HA . c17360_2l7l 1 100 . 2 2 9 9 PHE HB2 H 1 3.437 . . 2 . . . . 307 PHE HB1 . c17360_2l7l 1 101 . 2 2 9 9 PHE HD1 H 1 7.156 . . 3 . . . . 307 PHE HD1 . c17360_2l7l 1 102 . 2 2 9 9 PHE HE1 H 1 7.290 . . 3 . . . . 307 PHE HE1 . c17360_2l7l 1 103 . 2 2 9 9 PHE HZ H 1 7.336 . . 1 . . . . 307 PHE HZ . c17360_2l7l 1 104 . 2 2 10 10 ASN H H 1 9.611 . . 1 . . . . 308 ASN HN . c17360_2l7l 1 105 . 2 2 10 10 ASN HA H 1 4.455 . . 1 . . . . 308 ASN HA . c17360_2l7l 1 106 . 2 2 10 10 ASN HB2 H 1 2.412 . . 2 . . . . 308 ASN HB2 . c17360_2l7l 1 107 . 2 2 10 10 ASN HB3 H 1 3.250 . . 2 . . . . 308 ASN HB3 . c17360_2l7l 1 108 . 2 2 10 10 ASN HD21 H 1 8.544 . . 2 . . . . 308 ASN HD21 . c17360_2l7l 1 109 . 2 2 10 10 ASN HD22 H 1 8.226 . . 2 . . . . 308 ASN HD22 . c17360_2l7l 1 110 . 2 2 11 11 ALA H H 1 8.422 . . 1 . . . . 309 ALA HN . c17360_2l7l 1 111 . 2 2 11 11 ALA HA H 1 4.348 . . 1 . . . . 309 ALA HA . c17360_2l7l 1 112 . 2 2 11 11 ALA HB1 H 1 1.478 . . 1 . . . . 309 ALA HB1 . c17360_2l7l 1 113 . 2 2 11 11 ALA HB2 H 1 1.478 . . 1 . . . . 309 ALA HB1 . c17360_2l7l 1 114 . 2 2 11 11 ALA HB3 H 1 1.478 . . 1 . . . . 309 ALA HB1 . c17360_2l7l 1 115 . 2 2 12 12 THR H H 1 7.782 . . 1 . . . . 310 THR HN . c17360_2l7l 1 116 . 2 2 12 12 THR HA H 1 3.922 . . 1 . . . . 310 THR HA . c17360_2l7l 1 117 . 2 2 12 12 THR HB H 1 4.333 . . 1 . . . . 310 THR HB . c17360_2l7l 1 118 . 2 2 12 12 THR HG1 H 1 4.923 . . 1 . . . . 310 THR HG1 . c17360_2l7l 1 119 . 2 2 12 12 THR HG21 H 1 1.396 . . 1 . . . . 310 THR HG21 . c17360_2l7l 1 120 . 2 2 12 12 THR HG22 H 1 1.396 . . 1 . . . . 310 THR HG21 . c17360_2l7l 1 121 . 2 2 12 12 THR HG23 H 1 1.396 . . 1 . . . . 310 THR HG21 . c17360_2l7l 1 122 . 2 2 13 13 ALA H H 1 8.353 . . 1 . . . . 311 ALA HN . c17360_2l7l 1 123 . 2 2 13 13 ALA HA H 1 4.119 . . 1 . . . . 311 ALA HA . c17360_2l7l 1 124 . 2 2 13 13 ALA HB1 H 1 1.183 . . 1 . . . . 311 ALA HB1 . c17360_2l7l 1 125 . 2 2 13 13 ALA HB2 H 1 1.183 . . 1 . . . . 311 ALA HB1 . c17360_2l7l 1 126 . 2 2 13 13 ALA HB3 H 1 1.183 . . 1 . . . . 311 ALA HB1 . c17360_2l7l 1 127 . 2 2 14 14 VAL H H 1 8.660 . . 1 . . . . 312 VAL HN . c17360_2l7l 1 128 . 2 2 14 14 VAL HA H 1 3.399 . . 1 . . . . 312 VAL HA . c17360_2l7l 1 129 . 2 2 14 14 VAL HB H 1 2.430 . . 1 . . . . 312 VAL HB . c17360_2l7l 1 130 . 2 2 14 14 VAL HG11 H 1 0.667 . . 2 . . . . 312 VAL HG11 . c17360_2l7l 1 131 . 2 2 14 14 VAL HG12 H 1 0.667 . . 2 . . . . 312 VAL HG11 . c17360_2l7l 1 132 . 2 2 14 14 VAL HG13 H 1 0.667 . . 2 . . . . 312 VAL HG11 . c17360_2l7l 1 133 . 2 2 14 14 VAL HG21 H 1 1.054 . . 2 . . . . 312 VAL HG21 . c17360_2l7l 1 134 . 2 2 14 14 VAL HG22 H 1 1.054 . . 2 . . . . 312 VAL HG21 . c17360_2l7l 1 135 . 2 2 14 14 VAL HG23 H 1 1.054 . . 2 . . . . 312 VAL HG21 . c17360_2l7l 1 136 . 2 2 15 15 VAL H H 1 7.834 . . 1 . . . . 313 VAL HN . c17360_2l7l 1 137 . 2 2 15 15 VAL HA H 1 3.555 . . 1 . . . . 313 VAL HA . c17360_2l7l 1 138 . 2 2 15 15 VAL HB H 1 2.282 . . 1 . . . . 313 VAL HB . c17360_2l7l 1 139 . 2 2 15 15 VAL HG11 H 1 1.064 . . 2 . . . . 313 VAL HG11 . c17360_2l7l 1 140 . 2 2 15 15 VAL HG12 H 1 1.064 . . 2 . . . . 313 VAL HG11 . c17360_2l7l 1 141 . 2 2 15 15 VAL HG13 H 1 1.064 . . 2 . . . . 313 VAL HG11 . c17360_2l7l 1 142 . 2 2 15 15 VAL HG21 H 1 1.207 . . 2 . . . . 313 VAL HG21 . c17360_2l7l 1 143 . 2 2 15 15 VAL HG22 H 1 1.207 . . 2 . . . . 313 VAL HG21 . c17360_2l7l 1 144 . 2 2 15 15 VAL HG23 H 1 1.207 . . 2 . . . . 313 VAL HG21 . c17360_2l7l 1 145 . 2 2 16 16 ARG H H 1 7.965 . . 1 . . . . 314 ARG HN . c17360_2l7l 1 146 . 2 2 16 16 ARG HA H 1 3.967 . . 1 . . . . 314 ARG HA . c17360_2l7l 1 147 . 2 2 16 16 ARG HB2 H 1 1.884 . . 2 . . . . 314 ARG HB2 . c17360_2l7l 1 148 . 2 2 16 16 ARG HB3 H 1 1.943 . . 2 . . . . 314 ARG HB3 . c17360_2l7l 1 149 . 2 2 16 16 ARG HG2 H 1 1.739 . . 2 . . . . 314 ARG HG1 . c17360_2l7l 1 150 . 2 2 16 16 ARG HD2 H 1 2.920 . . 2 . . . . 314 ARG HD1 . c17360_2l7l 1 151 . 2 2 17 17 HIS H H 1 8.074 . . 1 . . . . 315 HIS HN . c17360_2l7l 1 152 . 2 2 17 17 HIS HA H 1 4.296 . . 1 . . . . 315 HIS HA . c17360_2l7l 1 153 . 2 2 17 17 HIS HB2 H 1 3.121 . . 2 . . . . 315 HIS HB1 . c17360_2l7l 1 154 . 2 2 17 17 HIS HD2 H 1 6.689 . . 1 . . . . 315 HIS HD2 . c17360_2l7l 1 155 . 2 2 17 17 HIS HE1 H 1 7.725 . . 1 . . . . 315 HIS HE1 . c17360_2l7l 1 156 . 2 2 18 18 MET H H 1 8.572 . . 1 . . . . 316 MET HN . c17360_2l7l 1 157 . 2 2 18 18 MET HA H 1 3.812 . . 1 . . . . 316 MET HA . c17360_2l7l 1 158 . 2 2 18 18 MET HB2 H 1 1.984 . . 2 . . . . 316 MET HB2 . c17360_2l7l 1 159 . 2 2 18 18 MET HB3 H 1 2.058 . . 2 . . . . 316 MET HB3 . c17360_2l7l 1 160 . 2 2 18 18 MET HG2 H 1 2.444 . . 2 . . . . 316 MET HG2 . c17360_2l7l 1 161 . 2 2 18 18 MET HG3 H 1 2.828 . . 2 . . . . 316 MET HG3 . c17360_2l7l 1 162 . 2 2 18 18 MET HE1 H 1 1.774 . . 1 . . . . 316 MET HE1 . c17360_2l7l 1 163 . 2 2 18 18 MET HE2 H 1 1.774 . . 1 . . . . 316 MET HE1 . c17360_2l7l 1 164 . 2 2 18 18 MET HE3 H 1 1.774 . . 1 . . . . 316 MET HE1 . c17360_2l7l 1 165 . 2 2 19 19 ARG H H 1 7.788 . . 1 . . . . 317 ARG HN . c17360_2l7l 1 166 . 2 2 19 19 ARG HA H 1 4.149 . . 1 . . . . 317 ARG HA . c17360_2l7l 1 167 . 2 2 19 19 ARG HB2 H 1 1.922 . . 2 . . . . 317 ARG HB1 . c17360_2l7l 1 168 . 2 2 19 19 ARG HG2 H 1 1.674 . . 2 . . . . 317 ARG HG2 . c17360_2l7l 1 169 . 2 2 19 19 ARG HG3 H 1 1.801 . . 2 . . . . 317 ARG HG3 . c17360_2l7l 1 170 . 2 2 19 19 ARG HD2 H 1 3.163 . . 2 . . . . 317 ARG HD1 . c17360_2l7l 1 171 . 2 2 20 20 LYS H H 1 7.757 . . 1 . . . . 318 LYS HN . c17360_2l7l 1 172 . 2 2 20 20 LYS HA H 1 4.044 . . 1 . . . . 318 LYS HA . c17360_2l7l 1 173 . 2 2 20 20 LYS HB2 H 1 1.887 . . 2 . . . . 318 LYS HB1 . c17360_2l7l 1 174 . 2 2 20 20 LYS HG2 H 1 1.526 . . 2 . . . . 318 LYS HG2 . c17360_2l7l 1 175 . 2 2 20 20 LYS HG3 H 1 1.391 . . 2 . . . . 318 LYS HG3 . c17360_2l7l 1 176 . 2 2 20 20 LYS HD2 H 1 1.659 . . 2 . . . . 318 LYS HD1 . c17360_2l7l 1 177 . 2 2 20 20 LYS HE2 H 1 2.961 . . 2 . . . . 318 LYS HE1 . c17360_2l7l 1 178 . 2 2 21 21 LEU H H 1 7.755 . . 1 . . . . 319 LEU HN . c17360_2l7l 1 179 . 2 2 21 21 LEU HA H 1 4.004 . . 1 . . . . 319 LEU HA . c17360_2l7l 1 180 . 2 2 21 21 LEU HB2 H 1 1.734 . . 2 . . . . 319 LEU HB1 . c17360_2l7l 1 181 . 2 2 21 21 LEU HG H 1 1.386 . . 1 . . . . 319 LEU HG . c17360_2l7l 1 182 . 2 2 21 21 LEU HD11 H 1 0.672 . . 2 . . . . 319 LEU HD11 . c17360_2l7l 1 183 . 2 2 21 21 LEU HD12 H 1 0.672 . . 2 . . . . 319 LEU HD11 . c17360_2l7l 1 184 . 2 2 21 21 LEU HD13 H 1 0.672 . . 2 . . . . 319 LEU HD11 . c17360_2l7l 1 185 . 2 2 21 21 LEU HD21 H 1 0.692 . . 2 . . . . 319 LEU HD21 . c17360_2l7l 1 186 . 2 2 21 21 LEU HD22 H 1 0.692 . . 2 . . . . 319 LEU HD21 . c17360_2l7l 1 187 . 2 2 21 21 LEU HD23 H 1 0.692 . . 2 . . . . 319 LEU HD21 . c17360_2l7l 1 188 . 2 2 22 22 GLN H H 1 7.636 . . 1 . . . . 320 GLN HN . c17360_2l7l 1 189 . 2 2 22 22 GLN HA H 1 4.069 . . 1 . . . . 320 GLN HA . c17360_2l7l 1 190 . 2 2 22 22 GLN HB2 H 1 2.004 . . 2 . . . . 320 GLN HB2 . c17360_2l7l 1 191 . 2 2 22 22 GLN HB3 H 1 2.176 . . 2 . . . . 320 GLN HB3 . c17360_2l7l 1 192 . 2 2 22 22 GLN HG2 H 1 2.373 . . 2 . . . . 320 GLN HG1 . c17360_2l7l 1 193 . 2 2 22 22 GLN HE21 H 1 7.730 . . 2 . . . . 320 GLN HE21 . c17360_2l7l 1 194 . 2 2 22 22 GLN HE22 H 1 6.857 . . 2 . . . . 320 GLN HE22 . c17360_2l7l 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 c17360_2l7l _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 1 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 c17360_2l7l _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 . . . c17360_2l7l 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 . . . . c17360_2l7l 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 ALA C C -18.930 0.472 2.998 . . . 1.0 . . . . . . . . . . . . A . 1 ALA C . . . . . . . . . c17360_2l7l 1 . 1 . 2 . 1 1 1 ALA CA C -18.260 -0.877 2.768 . . . 1.0 . . . . . . . . . . . . A . 1 ALA CA . . . . . . . . . c17360_2l7l 1 . 1 . 3 . 1 1 1 ALA CB C -18.954 -1.955 3.604 . . . 1.0 . . . . . . . . . . . . A . 1 ALA CB . . . . . . . . . c17360_2l7l 1 . 1 . 4 . 1 1 1 ALA H1 H -16.402 -1.740 3.144 . . . 1.0 . . . . . . . . . . . . A . 1 ALA H1 . . . . . . . . . c17360_2l7l 1 . 1 . 5 . 1 1 1 ALA H2 H -16.756 -0.398 4.125 . . . 1.0 . . . . . . . . . . . . A . 1 ALA H2 . . . . . . . . . c17360_2l7l 1 . 1 . 6 . 1 1 1 ALA H3 H -16.320 -0.172 2.499 . . . 1.0 . . . . . . . . . . . . A . 1 ALA H3 . . . . . . . . . c17360_2l7l 1 . 1 . 7 . 1 1 1 ALA HA H -18.328 -1.136 1.722 . . . 1.0 . . . . . . . . . . . . A . 1 ALA HA . . . . . . . . . c17360_2l7l 1 . 1 . 8 . 1 1 1 ALA HB1 H -19.957 -2.107 3.235 . . . 1.0 . . . . . . . . . . . . A . 1 ALA HB1 . . . . . . . . . c17360_2l7l 1 . 1 . 9 . 1 1 1 ALA HB2 H -18.993 -1.640 4.637 . . . 1.0 . . . . . . . . . . . . A . 1 ALA HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 10 . 1 1 1 ALA HB3 H -18.400 -2.879 3.531 . . . 1.0 . . . . . . . . . . . . A . 1 ALA HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 11 . 1 1 1 ALA N N -16.826 -0.791 3.164 . . . 1.0 . . . . . . . . . . . . A . 1 ALA N . . . . . . . . . c17360_2l7l 1 . 1 . 12 . 1 1 1 ALA O O -18.365 1.518 2.679 . . . 1.0 . . . . . . . . . . . . A . 1 ALA O . . . . . . . . . c17360_2l7l 1 . 1 . 13 . 1 1 2 ASP C C -20.592 2.172 5.234 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 14 . 1 1 2 ASP CA C -20.880 1.674 3.824 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 15 . 1 1 2 ASP CB C -22.380 1.423 3.670 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 16 . 1 1 2 ASP CG C -22.810 0.260 4.559 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 17 . 1 1 2 ASP H H -20.539 -0.419 3.787 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 18 . 1 1 2 ASP HA H -20.582 2.435 3.118 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 19 . 1 1 2 ASP HB2 H -22.922 2.311 3.955 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 20 . 1 1 2 ASP HB3 H -22.599 1.184 2.641 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 21 . 1 1 2 ASP N N -20.138 0.444 3.554 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 22 . 1 1 2 ASP O O -21.148 3.180 5.672 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 23 . 1 1 2 ASP OD1 O -21.944 -0.351 5.162 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 24 . 1 1 2 ASP OD2 O -24.000 0.000 4.623 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 25 . 1 1 3 GLN C C -17.877 1.607 7.562 . . . 1.0 . . . . . . . . . . . . A . 3 GLN C . . . . . . . . . c17360_2l7l 1 . 1 . 26 . 1 1 3 GLN CA C -19.360 1.841 7.312 . . . 1.0 . . . . . . . . . . . . A . 3 GLN CA . . . . . . . . . c17360_2l7l 1 . 1 . 27 . 1 1 3 GLN CB C -20.178 1.025 8.312 . . . 1.0 . . . . . . . . . . . . A . 3 GLN CB . . . . . . . . . c17360_2l7l 1 . 1 . 28 . 1 1 3 GLN CD C -22.479 0.612 9.202 . . . 1.0 . . . . . . . . . . . . A . 3 GLN CD . . . . . . . . . c17360_2l7l 1 . 1 . 29 . 1 1 3 GLN CG C -21.645 1.452 8.243 . . . 1.0 . . . . . . . . . . . . A . 3 GLN CG . . . . . . . . . c17360_2l7l 1 . 1 . 30 . 1 1 3 GLN H H -19.306 0.669 5.542 . . . 1.0 . . . . . . . . . . . . A . 3 GLN H . . . . . . . . . c17360_2l7l 1 . 1 . 31 . 1 1 3 GLN HA H -19.575 2.891 7.464 . . . 1.0 . . . . . . . . . . . . A . 3 GLN HA . . . . . . . . . c17360_2l7l 1 . 1 . 32 . 1 1 3 GLN HB2 H -20.097 -0.025 8.069 . . . 1.0 . . . . . . . . . . . . A . 3 GLN HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 33 . 1 1 3 GLN HB3 H -19.802 1.193 9.310 . . . 1.0 . . . . . . . . . . . . A . 3 GLN HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 34 . 1 1 3 GLN HE21 H -23.010 2.159 10.325 . . . 1.0 . . . . . . . . . . . . A . 3 GLN HE21 . . . . . . . . . c17360_2l7l 1 . 1 . 35 . 1 1 3 GLN HE22 H -23.629 0.658 10.820 . . . 1.0 . . . . . . . . . . . . A . 3 GLN HE22 . . . . . . . . . c17360_2l7l 1 . 1 . 36 . 1 1 3 GLN HG2 H -21.727 2.494 8.515 . . . 1.0 . . . . . . . . . . . . A . 3 GLN HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 37 . 1 1 3 GLN HG3 H -22.012 1.314 7.237 . . . 1.0 . . . . . . . . . . . . A . 3 GLN HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 38 . 1 1 3 GLN N N -19.718 1.463 5.945 . . . 1.0 . . . . . . . . . . . . A . 3 GLN N . . . . . . . . . c17360_2l7l 1 . 1 . 39 . 1 1 3 GLN NE2 N -23.090 1.191 10.199 . . . 1.0 . . . . . . . . . . . . A . 3 GLN NE2 . . . . . . . . . c17360_2l7l 1 . 1 . 40 . 1 1 3 GLN O O -17.470 0.515 7.960 . . . 1.0 . . . . . . . . . . . . A . 3 GLN O . . . . . . . . . c17360_2l7l 1 . 1 . 41 . 1 1 3 GLN OE1 O -22.578 -0.604 9.039 . . . 1.0 . . . . . . . . . . . . A . 3 GLN OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 42 . 1 1 4 LEU C C -15.243 3.107 8.895 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c17360_2l7l 1 . 1 . 43 . 1 1 4 LEU CA C -15.624 2.542 7.532 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c17360_2l7l 1 . 1 . 44 . 1 1 4 LEU CB C -14.888 3.312 6.427 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c17360_2l7l 1 . 1 . 45 . 1 1 4 LEU CD1 C -16.273 2.201 4.660 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 46 . 1 1 4 LEU CD2 C -14.062 3.218 4.071 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 47 . 1 1 4 LEU CG C -14.845 2.467 5.150 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c17360_2l7l 1 . 1 . 48 . 1 1 4 LEU H H -17.454 3.486 7.015 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c17360_2l7l 1 . 1 . 49 . 1 1 4 LEU HA H -15.325 1.502 7.494 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c17360_2l7l 1 . 1 . 50 . 1 1 4 LEU HB2 H -15.407 4.238 6.228 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 51 . 1 1 4 LEU HB3 H -13.879 3.526 6.743 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 52 . 1 1 4 LEU HD11 H -16.249 1.901 3.623 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 53 . 1 1 4 LEU HD12 H -16.866 3.098 4.761 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 54 . 1 1 4 LEU HD13 H -16.712 1.411 5.250 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 55 . 1 1 4 LEU HD21 H -14.240 2.757 3.111 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 56 . 1 1 4 LEU HD22 H -13.007 3.178 4.299 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 57 . 1 1 4 LEU HD23 H -14.387 4.248 4.041 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c17360_2l7l 1 . 1 . 58 . 1 1 4 LEU HG H -14.358 1.525 5.360 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c17360_2l7l 1 . 1 . 59 . 1 1 4 LEU N N -17.069 2.640 7.330 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c17360_2l7l 1 . 1 . 60 . 1 1 4 LEU O O -15.731 4.162 9.301 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c17360_2l7l 1 . 1 . 61 . 1 1 5 THR C C -12.879 3.934 10.785 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c17360_2l7l 1 . 1 . 62 . 1 1 5 THR CA C -13.929 2.835 10.915 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c17360_2l7l 1 . 1 . 63 . 1 1 5 THR CB C -13.339 1.652 11.688 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c17360_2l7l 1 . 1 . 64 . 1 1 5 THR CG2 C -14.381 0.537 11.787 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 65 . 1 1 5 THR H H -14.013 1.564 9.222 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c17360_2l7l 1 . 1 . 66 . 1 1 5 THR HA H -14.778 3.220 11.460 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c17360_2l7l 1 . 1 . 67 . 1 1 5 THR HB H -13.062 1.971 12.680 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c17360_2l7l 1 . 1 . 68 . 1 1 5 THR HG1 H -11.857 0.409 11.488 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG1 . . . . . . . . . c17360_2l7l 1 . 1 . 69 . 1 1 5 THR HG21 H -14.668 0.222 10.795 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 70 . 1 1 5 THR HG22 H -15.250 0.903 12.314 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 71 . 1 1 5 THR HG23 H -13.961 -0.301 12.323 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 72 . 1 1 5 THR N N -14.368 2.395 9.598 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c17360_2l7l 1 . 1 . 73 . 1 1 5 THR O O -12.275 4.108 9.731 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c17360_2l7l 1 . 1 . 74 . 1 1 5 THR OG1 O -12.190 1.169 11.005 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c17360_2l7l 1 . 1 . 75 . 1 1 6 GLU C C -10.266 5.189 11.804 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 76 . 1 1 6 GLU CA C -11.684 5.747 11.873 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 77 . 1 1 6 GLU CB C -11.843 6.591 13.141 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 78 . 1 1 6 GLU CD C -13.225 8.336 11.987 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 79 . 1 1 6 GLU CG C -13.196 7.312 13.117 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 80 . 1 1 6 GLU H H -13.172 4.478 12.685 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 81 . 1 1 6 GLU HA H -11.852 6.374 11.014 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 82 . 1 1 6 GLU HB2 H -11.792 5.950 14.010 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 83 . 1 1 6 GLU HB3 H -11.051 7.323 13.187 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 84 . 1 1 6 GLU HG2 H -13.982 6.587 12.962 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 85 . 1 1 6 GLU HG3 H -13.352 7.814 14.060 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 86 . 1 1 6 GLU N N -12.665 4.667 11.867 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 87 . 1 1 6 GLU O O -9.307 5.920 11.536 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 88 . 1 1 6 GLU OE1 O -12.309 9.140 11.921 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 89 . 1 1 6 GLU OE2 O -14.160 8.301 11.205 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 90 . 1 1 7 GLU C C -8.347 3.088 10.556 . . . 1.0 . . . . . . . . . . . . A . 7 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 91 . 1 1 7 GLU CA C -8.832 3.250 11.995 . . . 1.0 . . . . . . . . . . . . A . 7 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 92 . 1 1 7 GLU CB C -8.909 1.875 12.668 . . . 1.0 . . . . . . . . . . . . A . 7 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 93 . 1 1 7 GLU CD C -6.726 2.083 13.871 . . . 1.0 . . . . . . . . . . . . A . 7 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 94 . 1 1 7 GLU CG C -7.501 1.291 12.824 . . . 1.0 . . . . . . . . . . . . A . 7 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 95 . 1 1 7 GLU H H -10.942 3.351 12.201 . . . 1.0 . . . . . . . . . . . . A . 7 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 96 . 1 1 7 GLU HA H -8.128 3.861 12.535 . . . 1.0 . . . . . . . . . . . . A . 7 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 97 . 1 1 7 GLU HB2 H -9.366 1.978 13.643 . . . 1.0 . . . . . . . . . . . . A . 7 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 98 . 1 1 7 GLU HB3 H -9.506 1.210 12.061 . . . 1.0 . . . . . . . . . . . . A . 7 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 99 . 1 1 7 GLU HG2 H -7.575 0.260 13.138 . . . 1.0 . . . . . . . . . . . . A . 7 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 100 . 1 1 7 GLU HG3 H -6.981 1.341 11.880 . . . 1.0 . . . . . . . . . . . . A . 7 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 101 . 1 1 7 GLU N N -10.140 3.889 12.036 . . . 1.0 . . . . . . . . . . . . A . 7 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 102 . 1 1 7 GLU O O -7.256 3.534 10.209 . . . 1.0 . . . . . . . . . . . . A . 7 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 103 . 1 1 7 GLU OE1 O -7.332 2.911 14.529 . . . 1.0 . . . . . . . . . . . . A . 7 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 104 . 1 1 7 GLU OE2 O -5.534 1.851 13.997 . . . 1.0 . . . . . . . . . . . . A . 7 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 105 . 1 1 8 GLN C C -8.751 3.561 7.573 . . . 1.0 . . . . . . . . . . . . A . 8 GLN C . . . . . . . . . c17360_2l7l 1 . 1 . 106 . 1 1 8 GLN CA C -8.798 2.237 8.328 . . . 1.0 . . . . . . . . . . . . A . 8 GLN CA . . . . . . . . . c17360_2l7l 1 . 1 . 107 . 1 1 8 GLN CB C -9.811 1.299 7.670 . . . 1.0 . . . . . . . . . . . . A . 8 GLN CB . . . . . . . . . c17360_2l7l 1 . 1 . 108 . 1 1 8 GLN CD C -10.774 -1.008 7.709 . . . 1.0 . . . . . . . . . . . . A . 8 GLN CD . . . . . . . . . c17360_2l7l 1 . 1 . 109 . 1 1 8 GLN CG C -9.765 -0.066 8.360 . . . 1.0 . . . . . . . . . . . . A . 8 GLN CG . . . . . . . . . c17360_2l7l 1 . 1 . 110 . 1 1 8 GLN H H -10.026 2.125 10.050 . . . 1.0 . . . . . . . . . . . . A . 8 GLN H . . . . . . . . . c17360_2l7l 1 . 1 . 111 . 1 1 8 GLN HA H -7.822 1.778 8.290 . . . 1.0 . . . . . . . . . . . . A . 8 GLN HA . . . . . . . . . c17360_2l7l 1 . 1 . 112 . 1 1 8 GLN HB2 H -10.802 1.717 7.760 . . . 1.0 . . . . . . . . . . . . A . 8 GLN HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 113 . 1 1 8 GLN HB3 H -9.563 1.179 6.629 . . . 1.0 . . . . . . . . . . . . A . 8 GLN HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 114 . 1 1 8 GLN HE21 H -10.451 -2.482 8.999 . . . 1.0 . . . . . . . . . . . . A . 8 GLN HE21 . . . . . . . . . c17360_2l7l 1 . 1 . 115 . 1 1 8 GLN HE22 H -11.604 -2.809 7.798 . . . 1.0 . . . . . . . . . . . . A . 8 GLN HE22 . . . . . . . . . c17360_2l7l 1 . 1 . 116 . 1 1 8 GLN HG2 H -8.772 -0.481 8.270 . . . 1.0 . . . . . . . . . . . . A . 8 GLN HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 117 . 1 1 8 GLN HG3 H -10.010 0.052 9.405 . . . 1.0 . . . . . . . . . . . . A . 8 GLN HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 118 . 1 1 8 GLN N N -9.163 2.455 9.724 . . . 1.0 . . . . . . . . . . . . A . 8 GLN N . . . . . . . . . c17360_2l7l 1 . 1 . 119 . 1 1 8 GLN NE2 N -10.958 -2.198 8.211 . . . 1.0 . . . . . . . . . . . . A . 8 GLN NE2 . . . . . . . . . c17360_2l7l 1 . 1 . 120 . 1 1 8 GLN O O -7.920 3.758 6.682 . . . 1.0 . . . . . . . . . . . . A . 8 GLN O . . . . . . . . . c17360_2l7l 1 . 1 . 121 . 1 1 8 GLN OE1 O -11.408 -0.651 6.716 . . . 1.0 . . . . . . . . . . . . A . 8 GLN OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 122 . 1 1 9 ILE C C -8.416 6.544 7.559 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . c17360_2l7l 1 . 1 . 123 . 1 1 9 ILE CA C -9.709 5.777 7.313 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . c17360_2l7l 1 . 1 . 124 . 1 1 9 ILE CB C -10.896 6.579 7.855 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . c17360_2l7l 1 . 1 . 125 . 1 1 9 ILE CD1 C -13.372 6.511 8.181 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 126 . 1 1 9 ILE CG1 C -12.200 5.933 7.386 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 127 . 1 1 9 ILE CG2 C -10.831 8.020 7.336 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 128 . 1 1 9 ILE H H -10.275 4.252 8.664 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . c17360_2l7l 1 . 1 . 129 . 1 1 9 ILE HA H -9.838 5.644 6.250 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . c17360_2l7l 1 . 1 . 130 . 1 1 9 ILE HB H -10.861 6.584 8.932 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . c17360_2l7l 1 . 1 . 131 . 1 1 9 ILE HD11 H -14.302 6.206 7.726 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 132 . 1 1 9 ILE HD12 H -13.308 7.590 8.182 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 133 . 1 1 9 ILE HD13 H -13.332 6.149 9.198 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 134 . 1 1 9 ILE HG12 H -12.343 6.136 6.334 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 135 . 1 1 9 ILE HG13 H -12.150 4.868 7.541 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 136 . 1 1 9 ILE HG21 H -10.597 8.012 6.281 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 137 . 1 1 9 ILE HG22 H -10.062 8.559 7.869 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 138 . 1 1 9 ILE HG23 H -11.784 8.504 7.490 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 139 . 1 1 9 ILE N N -9.645 4.468 7.945 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . c17360_2l7l 1 . 1 . 140 . 1 1 9 ILE O O -7.901 7.208 6.659 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . c17360_2l7l 1 . 1 . 141 . 1 1 10 ALA C C -5.466 6.541 8.357 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c17360_2l7l 1 . 1 . 142 . 1 1 10 ALA CA C -6.653 7.143 9.114 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c17360_2l7l 1 . 1 . 143 . 1 1 10 ALA CB C -6.407 7.046 10.619 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c17360_2l7l 1 . 1 . 144 . 1 1 10 ALA H H -8.315 5.891 9.469 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c17360_2l7l 1 . 1 . 145 . 1 1 10 ALA HA H -6.751 8.183 8.842 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c17360_2l7l 1 . 1 . 146 . 1 1 10 ALA HB1 H -5.460 7.502 10.861 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c17360_2l7l 1 . 1 . 147 . 1 1 10 ALA HB2 H -6.392 6.007 10.915 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 148 . 1 1 10 ALA HB3 H -7.199 7.558 11.146 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 149 . 1 1 10 ALA N N -7.890 6.451 8.779 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c17360_2l7l 1 . 1 . 150 . 1 1 10 ALA O O -4.583 7.261 7.888 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c17360_2l7l 1 . 1 . 151 . 1 1 11 GLU C C -4.244 5.044 6.117 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 152 . 1 1 11 GLU CA C -4.347 4.541 7.556 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 153 . 1 1 11 GLU CB C -4.602 3.032 7.559 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 154 . 1 1 11 GLU CD C -5.061 1.078 9.054 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 155 . 1 1 11 GLU CG C -4.520 2.506 8.992 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 156 . 1 1 11 GLU H H -6.166 4.683 8.652 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 157 . 1 1 11 GLU HA H -3.422 4.743 8.073 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 158 . 1 1 11 GLU HB2 H -5.583 2.831 7.155 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 159 . 1 1 11 GLU HB3 H -3.855 2.541 6.954 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 160 . 1 1 11 GLU HG2 H -3.489 2.513 9.314 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 161 . 1 1 11 GLU HG3 H -5.098 3.138 9.642 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 162 . 1 1 11 GLU N N -5.443 5.216 8.252 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 163 . 1 1 11 GLU O O -3.158 5.393 5.637 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 164 . 1 1 11 GLU OE1 O -5.212 0.478 8.003 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 165 . 1 1 11 GLU OE2 O -5.339 0.617 10.148 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 166 . 1 1 12 PHE C C -5.190 7.075 4.013 . . . 1.0 . . . . . . . . . . . . A . 12 PHE C . . . . . . . . . c17360_2l7l 1 . 1 . 167 . 1 1 12 PHE CA C -5.415 5.578 4.057 . . . 1.0 . . . . . . . . . . . . A . 12 PHE CA . . . . . . . . . c17360_2l7l 1 . 1 . 168 . 1 1 12 PHE CB C -6.756 5.216 3.412 . . . 1.0 . . . . . . . . . . . . A . 12 PHE CB . . . . . . . . . c17360_2l7l 1 . 1 . 169 . 1 1 12 PHE CD1 C -6.198 2.822 4.069 . . . 1.0 . . . . . . . . . . . . A . 12 PHE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 170 . 1 1 12 PHE CD2 C -8.524 3.503 3.968 . . . 1.0 . . . . . . . . . . . . A . 12 PHE CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 171 . 1 1 12 PHE CE1 C -6.588 1.546 4.452 . . . 1.0 . . . . . . . . . . . . A . 12 PHE CE1 . . . . . . . . . c17360_2l7l 1 . 1 . 172 . 1 1 12 PHE CE2 C -8.911 2.217 4.351 . . . 1.0 . . . . . . . . . . . . A . 12 PHE CE2 . . . . . . . . . c17360_2l7l 1 . 1 . 173 . 1 1 12 PHE CG C -7.166 3.814 3.824 . . . 1.0 . . . . . . . . . . . . A . 12 PHE CG . . . . . . . . . c17360_2l7l 1 . 1 . 174 . 1 1 12 PHE CZ C -7.943 1.239 4.594 . . . 1.0 . . . . . . . . . . . . A . 12 PHE CZ . . . . . . . . . c17360_2l7l 1 . 1 . 175 . 1 1 12 PHE H H -6.221 4.828 5.865 . . . 1.0 . . . . . . . . . . . . A . 12 PHE H . . . . . . . . . c17360_2l7l 1 . 1 . 176 . 1 1 12 PHE HA H -4.620 5.112 3.500 . . . 1.0 . . . . . . . . . . . . A . 12 PHE HA . . . . . . . . . c17360_2l7l 1 . 1 . 177 . 1 1 12 PHE HB2 H -7.507 5.918 3.737 . . . 1.0 . . . . . . . . . . . . A . 12 PHE HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 178 . 1 1 12 PHE HB3 H -6.663 5.262 2.337 . . . 1.0 . . . . . . . . . . . . A . 12 PHE HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 179 . 1 1 12 PHE HD1 H -5.150 3.034 3.962 . . . 1.0 . . . . . . . . . . . . A . 12 PHE HD1 . . . . . . . . . c17360_2l7l 1 . 1 . 180 . 1 1 12 PHE HD2 H -9.274 4.255 3.782 . . . 1.0 . . . . . . . . . . . . A . 12 PHE HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 181 . 1 1 12 PHE HE1 H -5.840 0.798 4.633 . . . 1.0 . . . . . . . . . . . . A . 12 PHE HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 182 . 1 1 12 PHE HE2 H -9.959 1.980 4.463 . . . 1.0 . . . . . . . . . . . . A . 12 PHE HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 183 . 1 1 12 PHE HZ H -8.244 0.247 4.889 . . . 1.0 . . . . . . . . . . . . A . 12 PHE HZ . . . . . . . . . c17360_2l7l 1 . 1 . 184 . 1 1 12 PHE N N -5.382 5.101 5.435 . . . 1.0 . . . . . . . . . . . . A . 12 PHE N . . . . . . . . . c17360_2l7l 1 . 1 . 185 . 1 1 12 PHE O O -4.718 7.603 3.014 . . . 1.0 . . . . . . . . . . . . A . 12 PHE O . . . . . . . . . c17360_2l7l 1 . 1 . 186 . 1 1 13 LYS C C -3.867 9.546 4.950 . . . 1.0 . . . . . . . . . . . . A . 13 LYS C . . . . . . . . . c17360_2l7l 1 . 1 . 187 . 1 1 13 LYS CA C -5.344 9.196 5.148 . . . 1.0 . . . . . . . . . . . . A . 13 LYS CA . . . . . . . . . c17360_2l7l 1 . 1 . 188 . 1 1 13 LYS CB C -5.825 9.726 6.503 . . . 1.0 . . . . . . . . . . . . A . 13 LYS CB . . . . . . . . . c17360_2l7l 1 . 1 . 189 . 1 1 13 LYS CD C -7.311 11.662 5.918 . . . 1.0 . . . . . . . . . . . . A . 13 LYS CD . . . . . . . . . c17360_2l7l 1 . 1 . 190 . 1 1 13 LYS CE C -7.430 13.180 5.917 . . . 1.0 . . . . . . . . . . . . A . 13 LYS CE . . . . . . . . . c17360_2l7l 1 . 1 . 191 . 1 1 13 LYS CG C -5.936 11.259 6.461 . . . 1.0 . . . . . . . . . . . . A . 13 LYS CG . . . . . . . . . c17360_2l7l 1 . 1 . 192 . 1 1 13 LYS H H -5.895 7.284 5.875 . . . 1.0 . . . . . . . . . . . . A . 13 LYS H . . . . . . . . . c17360_2l7l 1 . 1 . 193 . 1 1 13 LYS HA H -5.922 9.647 4.361 . . . 1.0 . . . . . . . . . . . . A . 13 LYS HA . . . . . . . . . c17360_2l7l 1 . 1 . 194 . 1 1 13 LYS HB2 H -6.788 9.292 6.737 . . . 1.0 . . . . . . . . . . . . A . 13 LYS HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 195 . 1 1 13 LYS HB3 H -5.114 9.442 7.267 . . . 1.0 . . . . . . . . . . . . A . 13 LYS HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 196 . 1 1 13 LYS HD2 H -7.430 11.292 4.912 . . . 1.0 . . . . . . . . . . . . A . 13 LYS HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 197 . 1 1 13 LYS HD3 H -8.082 11.245 6.549 . . . 1.0 . . . . . . . . . . . . A . 13 LYS HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 198 . 1 1 13 LYS HE2 H -7.332 13.550 6.926 . . . 1.0 . . . . . . . . . . . . A . 13 LYS HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 199 . 1 1 13 LYS HE3 H -6.650 13.600 5.300 . . . 1.0 . . . . . . . . . . . . A . 13 LYS HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 200 . 1 1 13 LYS HG2 H -5.816 11.655 7.460 . . . 1.0 . . . . . . . . . . . . A . 13 LYS HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 201 . 1 1 13 LYS HG3 H -5.165 11.663 5.820 . . . 1.0 . . . . . . . . . . . . A . 13 LYS HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 202 . 1 1 13 LYS HZ1 H -9.238 14.201 6.038 . . . 1.0 . . . . . . . . . . . . A . 13 LYS HZ1 . . . . . . . . . c17360_2l7l 1 . 1 . 203 . 1 1 13 LYS HZ2 H -9.336 12.711 5.229 . . . 1.0 . . . . . . . . . . . . A . 13 LYS HZ2 . . . . . . . . . c17360_2l7l 1 . 1 . 204 . 1 1 13 LYS HZ3 H -8.633 14.053 4.461 . . . 1.0 . . . . . . . . . . . . A . 13 LYS HZ3 . . . . . . . . . c17360_2l7l 1 . 1 . 205 . 1 1 13 LYS N N -5.522 7.754 5.099 . . . 1.0 . . . . . . . . . . . . A . 13 LYS N . . . . . . . . . c17360_2l7l 1 . 1 . 206 . 1 1 13 LYS NZ N -8.760 13.567 5.370 . . . 1.0 . . . . . . . . . . . . A . 13 LYS NZ . . . . . . . . . c17360_2l7l 1 . 1 . 207 . 1 1 13 LYS O O -3.516 10.392 4.118 . . . 1.0 . . . . . . . . . . . . A . 13 LYS O . . . . . . . . . c17360_2l7l 1 . 1 . 208 . 1 1 14 GLU C C -1.099 8.662 4.202 . . . 1.0 . . . . . . . . . . . . A . 14 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 209 . 1 1 14 GLU CA C -1.567 9.120 5.579 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 210 . 1 1 14 GLU CB C -0.814 8.364 6.677 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 211 . 1 1 14 GLU CD C -0.718 10.364 8.183 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 212 . 1 1 14 GLU CG C -1.206 8.925 8.047 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 213 . 1 1 14 GLU H H -3.326 8.203 6.335 . . . 1.0 . . . . . . . . . . . . A . 14 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 214 . 1 1 14 GLU HA H -1.378 10.178 5.680 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 215 . 1 1 14 GLU HB2 H -1.069 7.316 6.629 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 216 . 1 1 14 GLU HB3 H 0.249 8.483 6.533 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 217 . 1 1 14 GLU HG2 H -2.284 8.903 8.146 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 218 . 1 1 14 GLU HG3 H -0.764 8.322 8.823 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 219 . 1 1 14 GLU N N -3.000 8.878 5.703 . . . 1.0 . . . . . . . . . . . . A . 14 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 220 . 1 1 14 GLU O O -0.407 9.392 3.491 . . . 1.0 . . . . . . . . . . . . A . 14 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 221 . 1 1 14 GLU OE1 O 0.168 10.740 7.434 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 222 . 1 1 14 GLU OE2 O -1.239 11.068 9.033 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 223 . 1 1 15 ALA C C -1.609 7.810 1.411 . . . 1.0 . . . . . . . . . . . . A . 15 ALA C . . . . . . . . . c17360_2l7l 1 . 1 . 224 . 1 1 15 ALA CA C -1.091 6.906 2.529 . . . 1.0 . . . . . . . . . . . . A . 15 ALA CA . . . . . . . . . c17360_2l7l 1 . 1 . 225 . 1 1 15 ALA CB C -1.654 5.483 2.367 . . . 1.0 . . . . . . . . . . . . A . 15 ALA CB . . . . . . . . . c17360_2l7l 1 . 1 . 226 . 1 1 15 ALA H H -2.016 6.888 4.436 . . . 1.0 . . . . . . . . . . . . A . 15 ALA H . . . . . . . . . c17360_2l7l 1 . 1 . 227 . 1 1 15 ALA HA H -0.014 6.871 2.477 . . . 1.0 . . . . . . . . . . . . A . 15 ALA HA . . . . . . . . . c17360_2l7l 1 . 1 . 228 . 1 1 15 ALA HB1 H -1.726 5.016 3.339 . . . 1.0 . . . . . . . . . . . . A . 15 ALA HB1 . . . . . . . . . c17360_2l7l 1 . 1 . 229 . 1 1 15 ALA HB2 H -0.997 4.901 1.740 . . . 1.0 . . . . . . . . . . . . A . 15 ALA HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 230 . 1 1 15 ALA HB3 H -2.637 5.524 1.918 . . . 1.0 . . . . . . . . . . . . A . 15 ALA HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 231 . 1 1 15 ALA N N -1.479 7.442 3.827 . . . 1.0 . . . . . . . . . . . . A . 15 ALA N . . . . . . . . . c17360_2l7l 1 . 1 . 232 . 1 1 15 ALA O O -0.937 8.019 0.397 . . . 1.0 . . . . . . . . . . . . A . 15 ALA O . . . . . . . . . c17360_2l7l 1 . 1 . 233 . 1 1 16 PHE C C -2.469 10.386 0.321 . . . 1.0 . . . . . . . . . . . . A . 16 PHE C . . . . . . . . . c17360_2l7l 1 . 1 . 234 . 1 1 16 PHE CA C -3.408 9.226 0.612 . . . 1.0 . . . . . . . . . . . . A . 16 PHE CA . . . . . . . . . c17360_2l7l 1 . 1 . 235 . 1 1 16 PHE CB C -4.750 9.762 1.124 . . . 1.0 . . . . . . . . . . . . A . 16 PHE CB . . . . . . . . . c17360_2l7l 1 . 1 . 236 . 1 1 16 PHE CD1 C -6.045 10.208 -0.979 . . . 1.0 . . . . . . . . . . . . A . 16 PHE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 237 . 1 1 16 PHE CD2 C -5.166 12.089 0.271 . . . 1.0 . . . . . . . . . . . . A . 16 PHE CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 238 . 1 1 16 PHE CE1 C -6.589 11.085 -1.918 . . . 1.0 . . . . . . . . . . . . A . 16 PHE CE1 . . . . . . . . . c17360_2l7l 1 . 1 . 239 . 1 1 16 PHE CE2 C -5.712 12.969 -0.669 . . . 1.0 . . . . . . . . . . . . A . 16 PHE CE2 . . . . . . . . . c17360_2l7l 1 . 1 . 240 . 1 1 16 PHE CG C -5.334 10.709 0.115 . . . 1.0 . . . . . . . . . . . . A . 16 PHE CG . . . . . . . . . c17360_2l7l 1 . 1 . 241 . 1 1 16 PHE CZ C -6.423 12.465 -1.764 . . . 1.0 . . . . . . . . . . . . A . 16 PHE CZ . . . . . . . . . c17360_2l7l 1 . 1 . 242 . 1 1 16 PHE H H -3.300 8.151 2.427 . . . 1.0 . . . . . . . . . . . . A . 16 PHE H . . . . . . . . . c17360_2l7l 1 . 1 . 243 . 1 1 16 PHE HA H -3.576 8.670 -0.295 . . . 1.0 . . . . . . . . . . . . A . 16 PHE HA . . . . . . . . . c17360_2l7l 1 . 1 . 244 . 1 1 16 PHE HB2 H -5.431 8.940 1.273 . . . 1.0 . . . . . . . . . . . . A . 16 PHE HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 245 . 1 1 16 PHE HB3 H -4.600 10.279 2.058 . . . 1.0 . . . . . . . . . . . . A . 16 PHE HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 246 . 1 1 16 PHE HD1 H -6.172 9.143 -1.097 . . . 1.0 . . . . . . . . . . . . A . 16 PHE HD1 . . . . . . . . . c17360_2l7l 1 . 1 . 247 . 1 1 16 PHE HD2 H -4.618 12.475 1.118 . . . 1.0 . . . . . . . . . . . . A . 16 PHE HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 248 . 1 1 16 PHE HE1 H -7.142 10.696 -2.758 . . . 1.0 . . . . . . . . . . . . A . 16 PHE HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 249 . 1 1 16 PHE HE2 H -5.583 14.033 -0.551 . . . 1.0 . . . . . . . . . . . . A . 16 PHE HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 250 . 1 1 16 PHE HZ H -6.842 13.141 -2.492 . . . 1.0 . . . . . . . . . . . . A . 16 PHE HZ . . . . . . . . . c17360_2l7l 1 . 1 . 251 . 1 1 16 PHE N N -2.809 8.349 1.607 . . . 1.0 . . . . . . . . . . . . A . 16 PHE N . . . . . . . . . c17360_2l7l 1 . 1 . 252 . 1 1 16 PHE O O -2.219 10.718 -0.838 . . . 1.0 . . . . . . . . . . . . A . 16 PHE O . . . . . . . . . c17360_2l7l 1 . 1 . 253 . 1 1 17 SER C C 0.227 11.648 0.447 . . . 1.0 . . . . . . . . . . . . A . 17 SER C . . . . . . . . . c17360_2l7l 1 . 1 . 254 . 1 1 17 SER CA C -1.010 12.108 1.213 . . . 1.0 . . . . . . . . . . . . A . 17 SER CA . . . . . . . . . c17360_2l7l 1 . 1 . 255 . 1 1 17 SER CB C -0.593 12.659 2.575 . . . 1.0 . . . . . . . . . . . . A . 17 SER CB . . . . . . . . . c17360_2l7l 1 . 1 . 256 . 1 1 17 SER H H -2.170 10.680 2.284 . . . 1.0 . . . . . . . . . . . . A . 17 SER H . . . . . . . . . c17360_2l7l 1 . 1 . 257 . 1 1 17 SER HA H -1.496 12.889 0.651 . . . 1.0 . . . . . . . . . . . . A . 17 SER HA . . . . . . . . . c17360_2l7l 1 . 1 . 258 . 1 1 17 SER HB2 H 0.026 13.530 2.441 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 259 . 1 1 17 SER HB3 H -1.478 12.929 3.134 . . . 1.0 . . . . . . . . . . . . A . 17 SER HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 260 . 1 1 17 SER HG H 0.106 10.855 2.764 . . . 1.0 . . . . . . . . . . . . A . 17 SER HG . . . . . . . . . c17360_2l7l 1 . 1 . 261 . 1 1 17 SER N N -1.937 10.991 1.381 . . . 1.0 . . . . . . . . . . . . A . 17 SER N . . . . . . . . . c17360_2l7l 1 . 1 . 262 . 1 1 17 SER O O 0.754 12.372 -0.398 . . . 1.0 . . . . . . . . . . . . A . 17 SER O . . . . . . . . . c17360_2l7l 1 . 1 . 263 . 1 1 17 SER OG O 0.141 11.666 3.276 . . . 1.0 . . . . . . . . . . . . A . 17 SER OG . . . . . . . . . c17360_2l7l 1 . 1 . 264 . 1 1 18 LEU C C 1.575 9.692 -1.406 . . . 1.0 . . . . . . . . . . . . A . 18 LEU C . . . . . . . . . c17360_2l7l 1 . 1 . 265 . 1 1 18 LEU CA C 1.857 9.895 0.079 . . . 1.0 . . . . . . . . . . . . A . 18 LEU CA . . . . . . . . . c17360_2l7l 1 . 1 . 266 . 1 1 18 LEU CB C 2.245 8.555 0.722 . . . 1.0 . . . . . . . . . . . . A . 18 LEU CB . . . . . . . . . c17360_2l7l 1 . 1 . 267 . 1 1 18 LEU CD1 C 4.191 6.953 0.794 . . . 1.0 . . . . . . . . . . . . A . 18 LEU CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 268 . 1 1 18 LEU CD2 C 2.746 7.035 -1.287 . . . 1.0 . . . . . . . . . . . . A . 18 LEU CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 269 . 1 1 18 LEU CG C 3.355 7.867 -0.112 . . . 1.0 . . . . . . . . . . . . A . 18 LEU CG . . . . . . . . . c17360_2l7l 1 . 1 . 270 . 1 1 18 LEU H H 0.238 9.899 1.435 . . . 1.0 . . . . . . . . . . . . A . 18 LEU H . . . . . . . . . c17360_2l7l 1 . 1 . 271 . 1 1 18 LEU HA H 2.678 10.583 0.190 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HA . . . . . . . . . c17360_2l7l 1 . 1 . 272 . 1 1 18 LEU HB2 H 2.605 8.745 1.728 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 273 . 1 1 18 LEU HB3 H 1.377 7.915 0.772 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 274 . 1 1 18 LEU HD11 H 3.533 6.342 1.394 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 275 . 1 1 18 LEU HD12 H 4.811 7.556 1.440 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 276 . 1 1 18 LEU HD13 H 4.812 6.318 0.183 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 277 . 1 1 18 LEU HD21 H 3.154 7.395 -2.222 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 278 . 1 1 18 LEU HD22 H 1.667 7.134 -1.317 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 279 . 1 1 18 LEU HD23 H 2.998 5.986 -1.177 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HD23 . . . . . . . . . c17360_2l7l 1 . 1 . 280 . 1 1 18 LEU HG H 4.003 8.627 -0.523 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HG . . . . . . . . . c17360_2l7l 1 . 1 . 281 . 1 1 18 LEU N N 0.685 10.438 0.747 . . . 1.0 . . . . . . . . . . . . A . 18 LEU N . . . . . . . . . c17360_2l7l 1 . 1 . 282 . 1 1 18 LEU O O 2.494 9.672 -2.226 . . . 1.0 . . . . . . . . . . . . A . 18 LEU O . . . . . . . . . c17360_2l7l 1 . 1 . 283 . 1 1 19 PHE C C -0.448 10.701 -3.784 . . . 1.0 . . . . . . . . . . . . A . 19 PHE C . . . . . . . . . c17360_2l7l 1 . 1 . 284 . 1 1 19 PHE CA C -0.102 9.366 -3.139 . . . 1.0 . . . . . . . . . . . . A . 19 PHE CA . . . . . . . . . c17360_2l7l 1 . 1 . 285 . 1 1 19 PHE CB C -1.305 8.423 -3.223 . . . 1.0 . . . . . . . . . . . . A . 19 PHE CB . . . . . . . . . c17360_2l7l 1 . 1 . 286 . 1 1 19 PHE CD1 C 0.123 6.350 -3.463 . . . 1.0 . . . . . . . . . . . . A . 19 PHE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 287 . 1 1 19 PHE CD2 C -1.530 6.419 -1.696 . . . 1.0 . . . . . . . . . . . . A . 19 PHE CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 288 . 1 1 19 PHE CE1 C 0.505 5.070 -3.058 . . . 1.0 . . . . . . . . . . . . A . 19 PHE CE1 . . . . . . . . . c17360_2l7l 1 . 1 . 289 . 1 1 19 PHE CE2 C -1.145 5.136 -1.293 . . . 1.0 . . . . . . . . . . . . A . 19 PHE CE2 . . . . . . . . . c17360_2l7l 1 . 1 . 290 . 1 1 19 PHE CG C -0.895 7.031 -2.784 . . . 1.0 . . . . . . . . . . . . A . 19 PHE CG . . . . . . . . . c17360_2l7l 1 . 1 . 291 . 1 1 19 PHE CZ C -0.127 4.462 -1.973 . . . 1.0 . . . . . . . . . . . . A . 19 PHE CZ . . . . . . . . . c17360_2l7l 1 . 1 . 292 . 1 1 19 PHE H H -0.391 9.605 -1.048 . . . 1.0 . . . . . . . . . . . . A . 19 PHE H . . . . . . . . . c17360_2l7l 1 . 1 . 293 . 1 1 19 PHE HA H 0.719 8.937 -3.686 . . . 1.0 . . . . . . . . . . . . A . 19 PHE HA . . . . . . . . . c17360_2l7l 1 . 1 . 294 . 1 1 19 PHE HB2 H -2.091 8.791 -2.578 . . . 1.0 . . . . . . . . . . . . A . 19 PHE HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 295 . 1 1 19 PHE HB3 H -1.665 8.388 -4.240 . . . 1.0 . . . . . . . . . . . . A . 19 PHE HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 296 . 1 1 19 PHE HD1 H 0.612 6.806 -4.301 . . . 1.0 . . . . . . . . . . . . A . 19 PHE HD1 . . . . . . . . . c17360_2l7l 1 . 1 . 297 . 1 1 19 PHE HD2 H -2.315 6.934 -1.169 . . . 1.0 . . . . . . . . . . . . A . 19 PHE HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 298 . 1 1 19 PHE HE1 H 1.291 4.552 -3.582 . . . 1.0 . . . . . . . . . . . . A . 19 PHE HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 299 . 1 1 19 PHE HE2 H -1.636 4.664 -0.460 . . . 1.0 . . . . . . . . . . . . A . 19 PHE HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 300 . 1 1 19 PHE HZ H 0.171 3.474 -1.660 . . . 1.0 . . . . . . . . . . . . A . 19 PHE HZ . . . . . . . . . c17360_2l7l 1 . 1 . 301 . 1 1 19 PHE N N 0.297 9.555 -1.746 . . . 1.0 . . . . . . . . . . . . A . 19 PHE N . . . . . . . . . c17360_2l7l 1 . 1 . 302 . 1 1 19 PHE O O -0.184 10.914 -4.967 . . . 1.0 . . . . . . . . . . . . A . 19 PHE O . . . . . . . . . c17360_2l7l 1 . 1 . 303 . 1 1 20 ASP C C -0.287 13.907 -3.268 . . . 1.0 . . . . . . . . . . . . A . 20 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 304 . 1 1 20 ASP CA C -1.422 12.913 -3.509 . . . 1.0 . . . . . . . . . . . . A . 20 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 305 . 1 1 20 ASP CB C -2.704 13.387 -2.809 . . . 1.0 . . . . . . . . . . . . A . 20 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 306 . 1 1 20 ASP CG C -3.450 14.377 -3.698 . . . 1.0 . . . . . . . . . . . . A . 20 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 307 . 1 1 20 ASP H H -1.226 11.370 -2.068 . . . 1.0 . . . . . . . . . . . . A . 20 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 308 . 1 1 20 ASP HA H -1.603 12.841 -4.572 . . . 1.0 . . . . . . . . . . . . A . 20 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 309 . 1 1 20 ASP HB2 H -3.339 12.536 -2.609 . . . 1.0 . . . . . . . . . . . . A . 20 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 310 . 1 1 20 ASP HB3 H -2.451 13.869 -1.873 . . . 1.0 . . . . . . . . . . . . A . 20 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 311 . 1 1 20 ASP N N -1.042 11.597 -3.002 . . . 1.0 . . . . . . . . . . . . A . 20 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 312 . 1 1 20 ASP O O -0.233 14.567 -2.231 . . . 1.0 . . . . . . . . . . . . A . 20 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 313 . 1 1 20 ASP OD1 O -3.163 15.555 -3.613 . . . 1.0 . . . . . . . . . . . . A . 20 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 314 . 1 1 20 ASP OD2 O -4.296 13.933 -4.457 . . . 1.0 . . . . . . . . . . . . A . 20 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 315 . 1 1 21 LYS C C 1.293 16.366 -4.070 . . . 1.0 . . . . . . . . . . . . A . 21 LYS C . . . . . . . . . c17360_2l7l 1 . 1 . 316 . 1 1 21 LYS CA C 1.755 14.911 -4.106 . . . 1.0 . . . . . . . . . . . . A . 21 LYS CA . . . . . . . . . c17360_2l7l 1 . 1 . 317 . 1 1 21 LYS CB C 2.706 14.715 -5.285 . . . 1.0 . . . . . . . . . . . . A . 21 LYS CB . . . . . . . . . c17360_2l7l 1 . 1 . 318 . 1 1 21 LYS CD C 4.252 13.110 -6.416 . . . 1.0 . . . . . . . . . . . . A . 21 LYS CD . . . . . . . . . c17360_2l7l 1 . 1 . 319 . 1 1 21 LYS CE C 4.879 11.717 -6.340 . . . 1.0 . . . . . . . . . . . . A . 21 LYS CE . . . . . . . . . c17360_2l7l 1 . 1 . 320 . 1 1 21 LYS CG C 3.334 13.323 -5.210 . . . 1.0 . . . . . . . . . . . . A . 21 LYS CG . . . . . . . . . c17360_2l7l 1 . 1 . 321 . 1 1 21 LYS H H 0.527 13.447 -5.033 . . . 1.0 . . . . . . . . . . . . A . 21 LYS H . . . . . . . . . c17360_2l7l 1 . 1 . 322 . 1 1 21 LYS HA H 2.287 14.688 -3.192 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HA . . . . . . . . . c17360_2l7l 1 . 1 . 323 . 1 1 21 LYS HB2 H 2.159 14.816 -6.211 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 324 . 1 1 21 LYS HB3 H 3.486 15.461 -5.244 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 325 . 1 1 21 LYS HD2 H 3.675 13.197 -7.326 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 326 . 1 1 21 LYS HD3 H 5.033 13.855 -6.411 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 327 . 1 1 21 LYS HE2 H 5.465 11.637 -5.438 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 328 . 1 1 21 LYS HE3 H 4.098 10.971 -6.329 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 329 . 1 1 21 LYS HG2 H 3.910 13.236 -4.299 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 330 . 1 1 21 LYS HG3 H 2.556 12.576 -5.215 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 331 . 1 1 21 LYS HZ1 H 6.733 11.343 -7.210 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HZ1 . . . . . . . . . c17360_2l7l 1 . 1 . 332 . 1 1 21 LYS HZ2 H 5.721 12.341 -8.139 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HZ2 . . . . . . . . . c17360_2l7l 1 . 1 . 333 . 1 1 21 LYS HZ3 H 5.427 10.670 -8.055 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HZ3 . . . . . . . . . c17360_2l7l 1 . 1 . 334 . 1 1 21 LYS N N 0.622 14.000 -4.228 . . . 1.0 . . . . . . . . . . . . A . 21 LYS N . . . . . . . . . c17360_2l7l 1 . 1 . 335 . 1 1 21 LYS NZ N 5.756 11.502 -7.525 . . . 1.0 . . . . . . . . . . . . A . 21 LYS NZ . . . . . . . . . c17360_2l7l 1 . 1 . 336 . 1 1 21 LYS O O 1.817 17.174 -3.305 . . . 1.0 . . . . . . . . . . . . A . 21 LYS O . . . . . . . . . c17360_2l7l 1 . 1 . 337 . 1 1 22 ASP C C -1.170 18.322 -3.820 . . . 1.0 . . . . . . . . . . . . A . 22 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 338 . 1 1 22 ASP CA C -0.198 18.059 -4.967 . . . 1.0 . . . . . . . . . . . . A . 22 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 339 . 1 1 22 ASP CB C -0.901 18.292 -6.307 . . . 1.0 . . . . . . . . . . . . A . 22 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 340 . 1 1 22 ASP CG C -2.064 17.322 -6.461 . . . 1.0 . . . . . . . . . . . . A . 22 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 341 . 1 1 22 ASP H H -0.058 16.002 -5.494 . . . 1.0 . . . . . . . . . . . . A . 22 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 342 . 1 1 22 ASP HA H 0.630 18.748 -4.887 . . . 1.0 . . . . . . . . . . . . A . 22 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 343 . 1 1 22 ASP HB2 H -1.270 19.305 -6.349 . . . 1.0 . . . . . . . . . . . . A . 22 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 344 . 1 1 22 ASP HB3 H -0.198 18.134 -7.111 . . . 1.0 . . . . . . . . . . . . A . 22 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 345 . 1 1 22 ASP N N 0.315 16.692 -4.907 . . . 1.0 . . . . . . . . . . . . A . 22 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 346 . 1 1 22 ASP O O -1.632 19.448 -3.633 . . . 1.0 . . . . . . . . . . . . A . 22 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 347 . 1 1 22 ASP OD1 O -2.506 16.803 -5.455 . . . 1.0 . . . . . . . . . . . . A . 22 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 348 . 1 1 22 ASP OD2 O -2.495 17.116 -7.584 . . . 1.0 . . . . . . . . . . . . A . 22 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 349 . 1 1 23 GLY C C -3.653 18.162 -2.344 . . . 1.0 . . . . . . . . . . . . A . 23 GLY C . . . . . . . . . c17360_2l7l 1 . 1 . 350 . 1 1 23 GLY CA C -2.389 17.418 -1.926 . . . 1.0 . . . . . . . . . . . . A . 23 GLY CA . . . . . . . . . c17360_2l7l 1 . 1 . 351 . 1 1 23 GLY H H -1.077 16.404 -3.252 . . . 1.0 . . . . . . . . . . . . A . 23 GLY H . . . . . . . . . c17360_2l7l 1 . 1 . 352 . 1 1 23 GLY HA2 H -2.655 16.438 -1.554 . . . 1.0 . . . . . . . . . . . . A . 23 GLY HA2 . . . . . . . . . c17360_2l7l 1 . 1 . 353 . 1 1 23 GLY HA3 H -1.899 17.972 -1.139 . . . 1.0 . . . . . . . . . . . . A . 23 GLY HA3 . . . . . . . . . c17360_2l7l 1 . 1 . 354 . 1 1 23 GLY N N -1.475 17.278 -3.055 . . . 1.0 . . . . . . . . . . . . A . 23 GLY N . . . . . . . . . c17360_2l7l 1 . 1 . 355 . 1 1 23 GLY O O -4.219 18.926 -1.563 . . . 1.0 . . . . . . . . . . . . A . 23 GLY O . . . . . . . . . c17360_2l7l 1 . 1 . 356 . 1 1 24 ASP C C -6.540 17.971 -3.512 . . . 1.0 . . . . . . . . . . . . A . 24 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 357 . 1 1 24 ASP CA C -5.281 18.608 -4.089 . . . 1.0 . . . . . . . . . . . . A . 24 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 358 . 1 1 24 ASP CB C -5.318 18.521 -5.616 . . . 1.0 . . . . . . . . . . . . A . 24 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 359 . 1 1 24 ASP CG C -5.218 17.065 -6.058 . . . 1.0 . . . . . . . . . . . . A . 24 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 360 . 1 1 24 ASP H H -3.594 17.324 -4.162 . . . 1.0 . . . . . . . . . . . . A . 24 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 361 . 1 1 24 ASP HA H -5.251 19.648 -3.802 . . . 1.0 . . . . . . . . . . . . A . 24 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 362 . 1 1 24 ASP HB2 H -6.245 18.942 -5.977 . . . 1.0 . . . . . . . . . . . . A . 24 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 363 . 1 1 24 ASP HB3 H -4.488 19.077 -6.027 . . . 1.0 . . . . . . . . . . . . A . 24 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 364 . 1 1 24 ASP N N -4.087 17.941 -3.581 . . . 1.0 . . . . . . . . . . . . A . 24 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 365 . 1 1 24 ASP O O -7.651 18.445 -3.748 . . . 1.0 . . . . . . . . . . . . A . 24 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 366 . 1 1 24 ASP OD1 O -5.317 16.200 -5.203 . . . 1.0 . . . . . . . . . . . . A . 24 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 367 . 1 1 24 ASP OD2 O -5.046 16.837 -7.243 . . . 1.0 . . . . . . . . . . . . A . 24 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 368 . 1 1 25 GLY C C -8.160 15.278 -3.140 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . c17360_2l7l 1 . 1 . 369 . 1 1 25 GLY CA C -7.486 16.207 -2.141 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . c17360_2l7l 1 . 1 . 370 . 1 1 25 GLY H H -5.448 16.568 -2.596 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . c17360_2l7l 1 . 1 . 371 . 1 1 25 GLY HA2 H -7.134 15.628 -1.300 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . c17360_2l7l 1 . 1 . 372 . 1 1 25 GLY HA3 H -8.205 16.935 -1.794 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . c17360_2l7l 1 . 1 . 373 . 1 1 25 GLY N N -6.358 16.898 -2.750 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . c17360_2l7l 1 . 1 . 374 . 1 1 25 GLY O O -9.232 14.737 -2.873 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . c17360_2l7l 1 . 1 . 375 . 1 1 26 THR C C -6.941 13.465 -6.028 . . . 1.0 . . . . . . . . . . . . A . 26 THR C . . . . . . . . . c17360_2l7l 1 . 1 . 376 . 1 1 26 THR CA C -8.064 14.212 -5.326 . . . 1.0 . . . . . . . . . . . . A . 26 THR CA . . . . . . . . . c17360_2l7l 1 . 1 . 377 . 1 1 26 THR CB C -8.850 15.037 -6.347 . . . 1.0 . . . . . . . . . . . . A . 26 THR CB . . . . . . . . . c17360_2l7l 1 . 1 . 378 . 1 1 26 THR CG2 C -9.975 15.789 -5.635 . . . 1.0 . . . . . . . . . . . . A . 26 THR CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 379 . 1 1 26 THR H H -6.667 15.542 -4.446 . . . 1.0 . . . . . . . . . . . . A . 26 THR H . . . . . . . . . c17360_2l7l 1 . 1 . 380 . 1 1 26 THR HA H -8.730 13.491 -4.873 . . . 1.0 . . . . . . . . . . . . A . 26 THR HA . . . . . . . . . c17360_2l7l 1 . 1 . 381 . 1 1 26 THR HB H -9.276 14.381 -7.091 . . . 1.0 . . . . . . . . . . . . A . 26 THR HB . . . . . . . . . c17360_2l7l 1 . 1 . 382 . 1 1 26 THR HG1 H -7.248 15.475 -7.360 . . . 1.0 . . . . . . . . . . . . A . 26 THR HG1 . . . . . . . . . c17360_2l7l 1 . 1 . 383 . 1 1 26 THR HG21 H -10.641 16.221 -6.368 . . . 1.0 . . . . . . . . . . . . A . 26 THR HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 384 . 1 1 26 THR HG22 H -9.552 16.575 -5.025 . . . 1.0 . . . . . . . . . . . . A . 26 THR HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 385 . 1 1 26 THR HG23 H -10.525 15.105 -5.007 . . . 1.0 . . . . . . . . . . . . A . 26 THR HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 386 . 1 1 26 THR N N -7.522 15.089 -4.292 . . . 1.0 . . . . . . . . . . . . A . 26 THR N . . . . . . . . . c17360_2l7l 1 . 1 . 387 . 1 1 26 THR O O -5.854 14.003 -6.221 . . . 1.0 . . . . . . . . . . . . A . 26 THR O . . . . . . . . . c17360_2l7l 1 . 1 . 388 . 1 1 26 THR OG1 O -7.979 15.966 -6.976 . . . 1.0 . . . . . . . . . . . . A . 26 THR OG1 . . . . . . . . . c17360_2l7l 1 . 1 . 389 . 1 1 27 ILE C C -6.657 11.147 -8.558 . . . 1.0 . . . . . . . . . . . . A . 27 ILE C . . . . . . . . . c17360_2l7l 1 . 1 . 390 . 1 1 27 ILE CA C -6.230 11.394 -7.115 . . . 1.0 . . . . . . . . . . . . A . 27 ILE CA . . . . . . . . . c17360_2l7l 1 . 1 . 391 . 1 1 27 ILE CB C -6.057 10.057 -6.386 . . . 1.0 . . . . . . . . . . . . A . 27 ILE CB . . . . . . . . . c17360_2l7l 1 . 1 . 392 . 1 1 27 ILE CD1 C -5.516 9.050 -4.167 . . . 1.0 . . . . . . . . . . . . A . 27 ILE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 393 . 1 1 27 ILE CG1 C -5.358 10.293 -5.046 . . . 1.0 . . . . . . . . . . . . A . 27 ILE CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 394 . 1 1 27 ILE CG2 C -5.217 9.105 -7.239 . . . 1.0 . . . . . . . . . . . . A . 27 ILE CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 395 . 1 1 27 ILE H H -8.106 11.854 -6.239 . . . 1.0 . . . . . . . . . . . . A . 27 ILE H . . . . . . . . . c17360_2l7l 1 . 1 . 396 . 1 1 27 ILE HA H -5.276 11.904 -7.121 . . . 1.0 . . . . . . . . . . . . A . 27 ILE HA . . . . . . . . . c17360_2l7l 1 . 1 . 397 . 1 1 27 ILE HB H -7.029 9.620 -6.212 . . . 1.0 . . . . . . . . . . . . A . 27 ILE HB . . . . . . . . . c17360_2l7l 1 . 1 . 398 . 1 1 27 ILE HD11 H -5.075 9.233 -3.199 . . . 1.0 . . . . . . . . . . . . A . 27 ILE HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 399 . 1 1 27 ILE HD12 H -5.022 8.213 -4.637 . . . 1.0 . . . . . . . . . . . . A . 27 ILE HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 400 . 1 1 27 ILE HD13 H -6.565 8.827 -4.048 . . . 1.0 . . . . . . . . . . . . A . 27 ILE HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 401 . 1 1 27 ILE HG12 H -4.307 10.480 -5.219 . . . 1.0 . . . . . . . . . . . . A . 27 ILE HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 402 . 1 1 27 ILE HG13 H -5.798 11.145 -4.553 . . . 1.0 . . . . . . . . . . . . A . 27 ILE HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 403 . 1 1 27 ILE HG21 H -5.817 8.734 -8.056 . . . 1.0 . . . . . . . . . . . . A . 27 ILE HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 404 . 1 1 27 ILE HG22 H -4.880 8.278 -6.634 . . . 1.0 . . . . . . . . . . . . A . 27 ILE HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 405 . 1 1 27 ILE HG23 H -4.362 9.636 -7.632 . . . 1.0 . . . . . . . . . . . . A . 27 ILE HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 406 . 1 1 27 ILE N N -7.216 12.223 -6.419 . . . 1.0 . . . . . . . . . . . . A . 27 ILE N . . . . . . . . . c17360_2l7l 1 . 1 . 407 . 1 1 27 ILE O O -7.801 10.767 -8.828 . . . 1.0 . . . . . . . . . . . . A . 27 ILE O . . . . . . . . . c17360_2l7l 1 . 1 . 408 . 1 1 28 THR C C -5.446 9.826 -11.365 . . . 1.0 . . . . . . . . . . . . A . 28 THR C . . . . . . . . . c17360_2l7l 1 . 1 . 409 . 1 1 28 THR CA C -5.995 11.170 -10.904 . . . 1.0 . . . . . . . . . . . . A . 28 THR CA . . . . . . . . . c17360_2l7l 1 . 1 . 410 . 1 1 28 THR CB C -5.356 12.290 -11.722 . . . 1.0 . . . . . . . . . . . . A . 28 THR CB . . . . . . . . . c17360_2l7l 1 . 1 . 411 . 1 1 28 THR CG2 C -5.552 13.624 -11.001 . . . 1.0 . . . . . . . . . . . . A . 28 THR CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 412 . 1 1 28 THR H H -4.837 11.673 -9.202 . . . 1.0 . . . . . . . . . . . . A . 28 THR H . . . . . . . . . c17360_2l7l 1 . 1 . 413 . 1 1 28 THR HA H -7.064 11.186 -11.071 . . . 1.0 . . . . . . . . . . . . A . 28 THR HA . . . . . . . . . c17360_2l7l 1 . 1 . 414 . 1 1 28 THR HB H -5.824 12.339 -12.693 . . . 1.0 . . . . . . . . . . . . A . 28 THR HB . . . . . . . . . c17360_2l7l 1 . 1 . 415 . 1 1 28 THR HG1 H -3.745 11.269 -11.335 . . . 1.0 . . . . . . . . . . . . A . 28 THR HG1 . . . . . . . . . c17360_2l7l 1 . 1 . 416 . 1 1 28 THR HG21 H -4.963 13.636 -10.096 . . . 1.0 . . . . . . . . . . . . A . 28 THR HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 417 . 1 1 28 THR HG22 H -6.596 13.749 -10.753 . . . 1.0 . . . . . . . . . . . . A . 28 THR HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 418 . 1 1 28 THR HG23 H -5.237 14.430 -11.646 . . . 1.0 . . . . . . . . . . . . A . 28 THR HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 419 . 1 1 28 THR N N -5.727 11.369 -9.482 . . . 1.0 . . . . . . . . . . . . A . 28 THR N . . . . . . . . . c17360_2l7l 1 . 1 . 420 . 1 1 28 THR O O -4.707 9.161 -10.637 . . . 1.0 . . . . . . . . . . . . A . 28 THR O . . . . . . . . . c17360_2l7l 1 . 1 . 421 . 1 1 28 THR OG1 O -3.968 12.031 -11.876 . . . 1.0 . . . . . . . . . . . . A . 28 THR OG1 . . . . . . . . . c17360_2l7l 1 . 1 . 422 . 1 1 29 THR C C -3.842 8.136 -13.227 . . . 1.0 . . . . . . . . . . . . A . 29 THR C . . . . . . . . . c17360_2l7l 1 . 1 . 423 . 1 1 29 THR CA C -5.363 8.159 -13.120 . . . 1.0 . . . . . . . . . . . . A . 29 THR CA . . . . . . . . . c17360_2l7l 1 . 1 . 424 . 1 1 29 THR CB C -5.979 7.935 -14.511 . . . 1.0 . . . . . . . . . . . . A . 29 THR CB . . . . . . . . . c17360_2l7l 1 . 1 . 425 . 1 1 29 THR CG2 C -5.272 6.771 -15.222 . . . 1.0 . . . . . . . . . . . . A . 29 THR CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 426 . 1 1 29 THR H H -6.415 9.996 -13.106 . . . 1.0 . . . . . . . . . . . . A . 29 THR H . . . . . . . . . c17360_2l7l 1 . 1 . 427 . 1 1 29 THR HA H -5.679 7.366 -12.464 . . . 1.0 . . . . . . . . . . . . A . 29 THR HA . . . . . . . . . c17360_2l7l 1 . 1 . 428 . 1 1 29 THR HB H -5.862 8.831 -15.100 . . . 1.0 . . . . . . . . . . . . A . 29 THR HB . . . . . . . . . c17360_2l7l 1 . 1 . 429 . 1 1 29 THR HG1 H -7.633 7.879 -13.489 . . . 1.0 . . . . . . . . . . . . A . 29 THR HG1 . . . . . . . . . c17360_2l7l 1 . 1 . 430 . 1 1 29 THR HG21 H -5.054 5.989 -14.510 . . . 1.0 . . . . . . . . . . . . A . 29 THR HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 431 . 1 1 29 THR HG22 H -4.350 7.126 -15.659 . . . 1.0 . . . . . . . . . . . . A . 29 THR HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 432 . 1 1 29 THR HG23 H -5.910 6.384 -15.999 . . . 1.0 . . . . . . . . . . . . A . 29 THR HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 433 . 1 1 29 THR N N -5.819 9.429 -12.574 . . . 1.0 . . . . . . . . . . . . A . 29 THR N . . . . . . . . . c17360_2l7l 1 . 1 . 434 . 1 1 29 THR O O -3.199 7.148 -12.874 . . . 1.0 . . . . . . . . . . . . A . 29 THR O . . . . . . . . . c17360_2l7l 1 . 1 . 435 . 1 1 29 THR OG1 O -7.362 7.637 -14.378 . . . 1.0 . . . . . . . . . . . . A . 29 THR OG1 . . . . . . . . . c17360_2l7l 1 . 1 . 436 . 1 1 30 LYS C C -1.141 9.199 -12.527 . . . 1.0 . . . . . . . . . . . . A . 30 LYS C . . . . . . . . . c17360_2l7l 1 . 1 . 437 . 1 1 30 LYS CA C -1.835 9.312 -13.878 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CA . . . . . . . . . c17360_2l7l 1 . 1 . 438 . 1 1 30 LYS CB C -1.461 10.644 -14.527 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CB . . . . . . . . . c17360_2l7l 1 . 1 . 439 . 1 1 30 LYS CD C 0.402 11.960 -15.563 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CD . . . . . . . . . c17360_2l7l 1 . 1 . 440 . 1 1 30 LYS CE C 0.321 13.169 -14.624 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CE . . . . . . . . . c17360_2l7l 1 . 1 . 441 . 1 1 30 LYS CG C 0.044 10.675 -14.804 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CG . . . . . . . . . c17360_2l7l 1 . 1 . 442 . 1 1 30 LYS H H -3.838 9.981 -13.993 . . . 1.0 . . . . . . . . . . . . A . 30 LYS H . . . . . . . . . c17360_2l7l 1 . 1 . 443 . 1 1 30 LYS HA H -1.500 8.509 -14.515 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HA . . . . . . . . . c17360_2l7l 1 . 1 . 444 . 1 1 30 LYS HB2 H -2.002 10.756 -15.455 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 445 . 1 1 30 LYS HB3 H -1.719 11.449 -13.859 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 446 . 1 1 30 LYS HD2 H 1.404 11.876 -15.959 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 447 . 1 1 30 LYS HD3 H -0.294 12.097 -16.378 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 448 . 1 1 30 LYS HE2 H -0.711 13.440 -14.469 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 449 . 1 1 30 LYS HE3 H 0.777 12.927 -13.676 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 450 . 1 1 30 LYS HG2 H 0.584 10.642 -13.868 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 451 . 1 1 30 LYS HG3 H 0.316 9.820 -15.405 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 452 . 1 1 30 LYS HZ1 H 0.401 15.140 -15.283 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ1 . . . . . . . . . c17360_2l7l 1 . 1 . 453 . 1 1 30 LYS HZ2 H 1.351 14.065 -16.193 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ2 . . . . . . . . . c17360_2l7l 1 . 1 . 454 . 1 1 30 LYS HZ3 H 1.865 14.562 -14.652 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ3 . . . . . . . . . c17360_2l7l 1 . 1 . 455 . 1 1 30 LYS N N -3.276 9.225 -13.722 . . . 1.0 . . . . . . . . . . . . A . 30 LYS N . . . . . . . . . c17360_2l7l 1 . 1 . 456 . 1 1 30 LYS NZ N 1.039 14.321 -15.234 . . . 1.0 . . . . . . . . . . . . A . 30 LYS NZ . . . . . . . . . c17360_2l7l 1 . 1 . 457 . 1 1 30 LYS O O -0.079 8.593 -12.419 . . . 1.0 . . . . . . . . . . . . A . 30 LYS O . . . . . . . . . c17360_2l7l 1 . 1 . 458 . 1 1 31 GLU C C -1.222 8.336 -9.586 . . . 1.0 . . . . . . . . . . . . A . 31 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 459 . 1 1 31 GLU CA C -1.160 9.741 -10.165 . . . 1.0 . . . . . . . . . . . . A . 31 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 460 . 1 1 31 GLU CB C -1.916 10.698 -9.245 . . . 1.0 . . . . . . . . . . . . A . 31 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 461 . 1 1 31 GLU CD C -2.498 13.092 -8.852 . . . 1.0 . . . . . . . . . . . . A . 31 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 462 . 1 1 31 GLU CG C -1.648 12.139 -9.679 . . . 1.0 . . . . . . . . . . . . A . 31 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 463 . 1 1 31 GLU H H -2.592 10.257 -11.636 . . . 1.0 . . . . . . . . . . . . A . 31 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 464 . 1 1 31 GLU HA H -0.130 10.054 -10.219 . . . 1.0 . . . . . . . . . . . . A . 31 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 465 . 1 1 31 GLU HB2 H -2.975 10.494 -9.309 . . . 1.0 . . . . . . . . . . . . A . 31 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 466 . 1 1 31 GLU HB3 H -1.583 10.561 -8.228 . . . 1.0 . . . . . . . . . . . . A . 31 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 467 . 1 1 31 GLU HG2 H -0.604 12.369 -9.531 . . . 1.0 . . . . . . . . . . . . A . 31 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 468 . 1 1 31 GLU HG3 H -1.897 12.253 -10.723 . . . 1.0 . . . . . . . . . . . . A . 31 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 469 . 1 1 31 GLU N N -1.744 9.786 -11.499 . . . 1.0 . . . . . . . . . . . . A . 31 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 470 . 1 1 31 GLU O O -0.195 7.761 -9.234 . . . 1.0 . . . . . . . . . . . . A . 31 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 471 . 1 1 31 GLU OE1 O -3.254 12.606 -8.030 . . . 1.0 . . . . . . . . . . . . A . 31 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 472 . 1 1 31 GLU OE2 O -2.381 14.289 -9.052 . . . 1.0 . . . . . . . . . . . . A . 31 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 473 . 1 1 32 LEU C C -1.779 5.448 -9.727 . . . 1.0 . . . . . . . . . . . . A . 32 LEU C . . . . . . . . . c17360_2l7l 1 . 1 . 474 . 1 1 32 LEU CA C -2.604 6.454 -8.938 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CA . . . . . . . . . c17360_2l7l 1 . 1 . 475 . 1 1 32 LEU CB C -4.083 6.053 -8.985 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CB . . . . . . . . . c17360_2l7l 1 . 1 . 476 . 1 1 32 LEU CD1 C -3.798 4.610 -6.936 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 477 . 1 1 32 LEU CD2 C -5.748 4.251 -8.479 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 478 . 1 1 32 LEU CG C -4.269 4.641 -8.401 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CG . . . . . . . . . c17360_2l7l 1 . 1 . 479 . 1 1 32 LEU H H -3.215 8.302 -9.771 . . . 1.0 . . . . . . . . . . . . A . 32 LEU H . . . . . . . . . c17360_2l7l 1 . 1 . 480 . 1 1 32 LEU HA H -2.273 6.458 -7.911 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HA . . . . . . . . . c17360_2l7l 1 . 1 . 481 . 1 1 32 LEU HB2 H -4.660 6.757 -8.402 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 482 . 1 1 32 LEU HB3 H -4.427 6.066 -10.007 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 483 . 1 1 32 LEU HD11 H -4.010 5.560 -6.462 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 484 . 1 1 32 LEU HD12 H -2.735 4.426 -6.905 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 485 . 1 1 32 LEU HD13 H -4.310 3.821 -6.400 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 486 . 1 1 32 LEU HD21 H -6.294 4.739 -7.688 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 487 . 1 1 32 LEU HD22 H -5.840 3.180 -8.369 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 488 . 1 1 32 LEU HD23 H -6.149 4.549 -9.435 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD23 . . . . . . . . . c17360_2l7l 1 . 1 . 489 . 1 1 32 LEU HG H -3.688 3.934 -8.975 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HG . . . . . . . . . c17360_2l7l 1 . 1 . 490 . 1 1 32 LEU N N -2.428 7.790 -9.491 . . . 1.0 . . . . . . . . . . . . A . 32 LEU N . . . . . . . . . c17360_2l7l 1 . 1 . 491 . 1 1 32 LEU O O -1.235 4.500 -9.164 . . . 1.0 . . . . . . . . . . . . A . 32 LEU O . . . . . . . . . c17360_2l7l 1 . 1 . 492 . 1 1 33 GLY C C 0.559 4.951 -11.676 . . . 1.0 . . . . . . . . . . . . A . 33 GLY C . . . . . . . . . c17360_2l7l 1 . 1 . 493 . 1 1 33 GLY CA C -0.940 4.749 -11.880 . . . 1.0 . . . . . . . . . . . . A . 33 GLY CA . . . . . . . . . c17360_2l7l 1 . 1 . 494 . 1 1 33 GLY H H -2.164 6.415 -11.428 . . . 1.0 . . . . . . . . . . . . A . 33 GLY H . . . . . . . . . c17360_2l7l 1 . 1 . 495 . 1 1 33 GLY HA2 H -1.198 3.726 -11.639 . . . 1.0 . . . . . . . . . . . . A . 33 GLY HA2 . . . . . . . . . c17360_2l7l 1 . 1 . 496 . 1 1 33 GLY HA3 H -1.185 4.943 -12.912 . . . 1.0 . . . . . . . . . . . . A . 33 GLY HA3 . . . . . . . . . c17360_2l7l 1 . 1 . 497 . 1 1 33 GLY N N -1.704 5.648 -11.031 . . . 1.0 . . . . . . . . . . . . A . 33 GLY N . . . . . . . . . c17360_2l7l 1 . 1 . 498 . 1 1 33 GLY O O 1.311 3.992 -11.537 . . . 1.0 . . . . . . . . . . . . A . 33 GLY O . . . . . . . . . c17360_2l7l 1 . 1 . 499 . 1 1 34 THR C C 2.941 5.910 -10.192 . . . 1.0 . . . . . . . . . . . . A . 34 THR C . . . . . . . . . c17360_2l7l 1 . 1 . 500 . 1 1 34 THR CA C 2.407 6.508 -11.484 . . . 1.0 . . . . . . . . . . . . A . 34 THR CA . . . . . . . . . c17360_2l7l 1 . 1 . 501 . 1 1 34 THR CB C 2.614 8.026 -11.462 . . . 1.0 . . . . . . . . . . . . A . 34 THR CB . . . . . . . . . c17360_2l7l 1 . 1 . 502 . 1 1 34 THR CG2 C 4.081 8.347 -11.181 . . . 1.0 . . . . . . . . . . . . A . 34 THR CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 503 . 1 1 34 THR H H 0.349 6.939 -11.774 . . . 1.0 . . . . . . . . . . . . A . 34 THR H . . . . . . . . . c17360_2l7l 1 . 1 . 504 . 1 1 34 THR HA H 2.959 6.097 -12.316 . . . 1.0 . . . . . . . . . . . . A . 34 THR HA . . . . . . . . . c17360_2l7l 1 . 1 . 505 . 1 1 34 THR HB H 2.004 8.454 -10.681 . . . 1.0 . . . . . . . . . . . . A . 34 THR HB . . . . . . . . . c17360_2l7l 1 . 1 . 506 . 1 1 34 THR HG1 H 1.440 8.129 -13.008 . . . 1.0 . . . . . . . . . . . . A . 34 THR HG1 . . . . . . . . . c17360_2l7l 1 . 1 . 507 . 1 1 34 THR HG21 H 4.269 9.387 -11.402 . . . 1.0 . . . . . . . . . . . . A . 34 THR HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 508 . 1 1 34 THR HG22 H 4.710 7.728 -11.803 . . . 1.0 . . . . . . . . . . . . A . 34 THR HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 509 . 1 1 34 THR HG23 H 4.299 8.155 -10.141 . . . 1.0 . . . . . . . . . . . . A . 34 THR HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 510 . 1 1 34 THR N N 0.990 6.207 -11.658 . . . 1.0 . . . . . . . . . . . . A . 34 THR N . . . . . . . . . c17360_2l7l 1 . 1 . 511 . 1 1 34 THR O O 3.970 5.236 -10.192 . . . 1.0 . . . . . . . . . . . . A . 34 THR O . . . . . . . . . c17360_2l7l 1 . 1 . 512 . 1 1 34 THR OG1 O 2.234 8.581 -12.713 . . . 1.0 . . . . . . . . . . . . A . 34 THR OG1 . . . . . . . . . c17360_2l7l 1 . 1 . 513 . 1 1 35 VAL C C 2.606 4.113 -7.789 . . . 1.0 . . . . . . . . . . . . A . 35 VAL C . . . . . . . . . c17360_2l7l 1 . 1 . 514 . 1 1 35 VAL CA C 2.670 5.635 -7.803 . . . 1.0 . . . . . . . . . . . . A . 35 VAL CA . . . . . . . . . c17360_2l7l 1 . 1 . 515 . 1 1 35 VAL CB C 1.775 6.197 -6.695 . . . 1.0 . . . . . . . . . . . . A . 35 VAL CB . . . . . . . . . c17360_2l7l 1 . 1 . 516 . 1 1 35 VAL CG1 C 1.840 7.731 -6.712 . . . 1.0 . . . . . . . . . . . . A . 35 VAL CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 517 . 1 1 35 VAL CG2 C 0.331 5.747 -6.933 . . . 1.0 . . . . . . . . . . . . A . 35 VAL CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 518 . 1 1 35 VAL H H 1.430 6.704 -9.148 . . . 1.0 . . . . . . . . . . . . A . 35 VAL H . . . . . . . . . c17360_2l7l 1 . 1 . 519 . 1 1 35 VAL HA H 3.687 5.946 -7.617 . . . 1.0 . . . . . . . . . . . . A . 35 VAL HA . . . . . . . . . c17360_2l7l 1 . 1 . 520 . 1 1 35 VAL HB H 2.120 5.830 -5.740 . . . 1.0 . . . . . . . . . . . . A . 35 VAL HB . . . . . . . . . c17360_2l7l 1 . 1 . 521 . 1 1 35 VAL HG11 H 1.812 8.086 -7.732 . . . 1.0 . . . . . . . . . . . . A . 35 VAL HG11 . . . . . . . . . c17360_2l7l 1 . 1 . 522 . 1 1 35 VAL HG12 H 2.756 8.057 -6.244 . . . 1.0 . . . . . . . . . . . . A . 35 VAL HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 523 . 1 1 35 VAL HG13 H 0.997 8.137 -6.169 . . . 1.0 . . . . . . . . . . . . A . 35 VAL HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 524 . 1 1 35 VAL HG21 H -0.345 6.368 -6.360 . . . 1.0 . . . . . . . . . . . . A . 35 VAL HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 525 . 1 1 35 VAL HG22 H 0.216 4.717 -6.630 . . . 1.0 . . . . . . . . . . . . A . 35 VAL HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 526 . 1 1 35 VAL HG23 H 0.102 5.844 -7.977 . . . 1.0 . . . . . . . . . . . . A . 35 VAL HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 527 . 1 1 35 VAL N N 2.243 6.159 -9.090 . . . 1.0 . . . . . . . . . . . . A . 35 VAL N . . . . . . . . . c17360_2l7l 1 . 1 . 528 . 1 1 35 VAL O O 3.541 3.451 -7.341 . . . 1.0 . . . . . . . . . . . . A . 35 VAL O . . . . . . . . . c17360_2l7l 1 . 1 . 529 . 1 1 36 MET C C 2.450 1.486 -9.161 . . . 1.0 . . . . . . . . . . . . A . 36 MET C . . . . . . . . . c17360_2l7l 1 . 1 . 530 . 1 1 36 MET CA C 1.351 2.111 -8.314 . . . 1.0 . . . . . . . . . . . . A . 36 MET CA . . . . . . . . . c17360_2l7l 1 . 1 . 531 . 1 1 36 MET CB C -0.028 1.743 -8.885 . . . 1.0 . . . . . . . . . . . . A . 36 MET CB . . . . . . . . . c17360_2l7l 1 . 1 . 532 . 1 1 36 MET CE C -3.456 0.734 -6.919 . . . 1.0 . . . . . . . . . . . . A . 36 MET CE . . . . . . . . . c17360_2l7l 1 . 1 . 533 . 1 1 36 MET CG C -1.083 1.815 -7.776 . . . 1.0 . . . . . . . . . . . . A . 36 MET CG . . . . . . . . . c17360_2l7l 1 . 1 . 534 . 1 1 36 MET H H 0.786 4.128 -8.632 . . . 1.0 . . . . . . . . . . . . A . 36 MET H . . . . . . . . . c17360_2l7l 1 . 1 . 535 . 1 1 36 MET HA H 1.432 1.731 -7.306 . . . 1.0 . . . . . . . . . . . . A . 36 MET HA . . . . . . . . . c17360_2l7l 1 . 1 . 536 . 1 1 36 MET HB2 H -0.284 2.441 -9.668 . . . 1.0 . . . . . . . . . . . . A . 36 MET HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 537 . 1 1 36 MET HB3 H -0.005 0.743 -9.291 . . . 1.0 . . . . . . . . . . . . A . 36 MET HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 538 . 1 1 36 MET HE1 H -2.925 1.118 -6.057 . . . 1.0 . . . . . . . . . . . . A . 36 MET HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 539 . 1 1 36 MET HE2 H -3.398 -0.343 -6.921 . . . 1.0 . . . . . . . . . . . . A . 36 MET HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 540 . 1 1 36 MET HE3 H -4.498 1.031 -6.867 . . . 1.0 . . . . . . . . . . . . A . 36 MET HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 541 . 1 1 36 MET HG2 H -0.816 1.124 -6.994 . . . 1.0 . . . . . . . . . . . . A . 36 MET HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 542 . 1 1 36 MET HG3 H -1.110 2.817 -7.373 . . . 1.0 . . . . . . . . . . . . A . 36 MET HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 543 . 1 1 36 MET N N 1.502 3.558 -8.284 . . . 1.0 . . . . . . . . . . . . A . 36 MET N . . . . . . . . . c17360_2l7l 1 . 1 . 544 . 1 1 36 MET O O 3.137 0.576 -8.720 . . . 1.0 . . . . . . . . . . . . A . 36 MET O . . . . . . . . . c17360_2l7l 1 . 1 . 545 . 1 1 36 MET SD S -2.711 1.382 -8.444 . . . 1.0 . . . . . . . . . . . . A . 36 MET SD . . . . . . . . . c17360_2l7l 1 . 1 . 546 . 1 1 37 ARG C C 4.994 1.510 -10.615 . . . 1.0 . . . . . . . . . . . . A . 37 ARG C . . . . . . . . . c17360_2l7l 1 . 1 . 547 . 1 1 37 ARG CA C 3.620 1.433 -11.272 . . . 1.0 . . . . . . . . . . . . A . 37 ARG CA . . . . . . . . . c17360_2l7l 1 . 1 . 548 . 1 1 37 ARG CB C 3.638 2.251 -12.564 . . . 1.0 . . . . . . . . . . . . A . 37 ARG CB . . . . . . . . . c17360_2l7l 1 . 1 . 549 . 1 1 37 ARG CD C 2.272 2.967 -14.535 . . . 1.0 . . . . . . . . . . . . A . 37 ARG CD . . . . . . . . . c17360_2l7l 1 . 1 . 550 . 1 1 37 ARG CG C 2.366 1.981 -13.377 . . . 1.0 . . . . . . . . . . . . A . 37 ARG CG . . . . . . . . . c17360_2l7l 1 . 1 . 551 . 1 1 37 ARG CZ C 1.891 5.339 -14.860 . . . 1.0 . . . . . . . . . . . . A . 37 ARG CZ . . . . . . . . . c17360_2l7l 1 . 1 . 552 . 1 1 37 ARG H H 2.010 2.677 -10.708 . . . 1.0 . . . . . . . . . . . . A . 37 ARG H . . . . . . . . . c17360_2l7l 1 . 1 . 553 . 1 1 37 ARG HA H 3.389 0.406 -11.504 . . . 1.0 . . . . . . . . . . . . A . 37 ARG HA . . . . . . . . . c17360_2l7l 1 . 1 . 554 . 1 1 37 ARG HB2 H 3.696 3.300 -12.322 . . . 1.0 . . . . . . . . . . . . A . 37 ARG HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 555 . 1 1 37 ARG HB3 H 4.500 1.970 -13.152 . . . 1.0 . . . . . . . . . . . . A . 37 ARG HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 556 . 1 1 37 ARG HD2 H 3.197 2.952 -15.091 . . . 1.0 . . . . . . . . . . . . A . 37 ARG HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 557 . 1 1 37 ARG HD3 H 1.460 2.674 -15.184 . . . 1.0 . . . . . . . . . . . . A . 37 ARG HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 558 . 1 1 37 ARG HE H 1.978 4.459 -13.066 . . . 1.0 . . . . . . . . . . . . A . 37 ARG HE . . . . . . . . . c17360_2l7l 1 . 1 . 559 . 1 1 37 ARG HG2 H 2.406 0.990 -13.776 . . . 1.0 . . . . . . . . . . . . A . 37 ARG HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 560 . 1 1 37 ARG HG3 H 1.498 2.081 -12.748 . . . 1.0 . . . . . . . . . . . . A . 37 ARG HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 561 . 1 1 37 ARG HH11 H 2.128 4.236 -16.512 . . . 1.0 . . . . . . . . . . . . A . 37 ARG HH11 . . . . . . . . . c17360_2l7l 1 . 1 . 562 . 1 1 37 ARG HH12 H 1.858 5.926 -16.772 . . . 1.0 . . . . . . . . . . . . A . 37 ARG HH12 . . . . . . . . . c17360_2l7l 1 . 1 . 563 . 1 1 37 ARG HH21 H 1.617 6.676 -13.395 . . . 1.0 . . . . . . . . . . . . A . 37 ARG HH21 . . . . . . . . . c17360_2l7l 1 . 1 . 564 . 1 1 37 ARG HH22 H 1.570 7.308 -15.007 . . . 1.0 . . . . . . . . . . . . A . 37 ARG HH22 . . . . . . . . . c17360_2l7l 1 . 1 . 565 . 1 1 37 ARG N N 2.606 1.970 -10.381 . . . 1.0 . . . . . . . . . . . . A . 37 ARG N . . . . . . . . . c17360_2l7l 1 . 1 . 566 . 1 1 37 ARG NE N 2.033 4.310 -14.031 . . . 1.0 . . . . . . . . . . . . A . 37 ARG NE . . . . . . . . . c17360_2l7l 1 . 1 . 567 . 1 1 37 ARG NH1 N 1.965 5.152 -16.148 . . . 1.0 . . . . . . . . . . . . A . 37 ARG NH1 . . . . . . . . . c17360_2l7l 1 . 1 . 568 . 1 1 37 ARG NH2 N 1.676 6.533 -14.383 . . . 1.0 . . . . . . . . . . . . A . 37 ARG NH2 . . . . . . . . . c17360_2l7l 1 . 1 . 569 . 1 1 37 ARG O O 5.845 0.648 -10.831 . . . 1.0 . . . . . . . . . . . . A . 37 ARG O . . . . . . . . . c17360_2l7l 1 . 1 . 570 . 1 1 38 SER C C 6.779 1.558 -8.213 . . . 1.0 . . . . . . . . . . . . A . 38 SER C . . . . . . . . . c17360_2l7l 1 . 1 . 571 . 1 1 38 SER CA C 6.479 2.738 -9.133 . . . 1.0 . . . . . . . . . . . . A . 38 SER CA . . . . . . . . . c17360_2l7l 1 . 1 . 572 . 1 1 38 SER CB C 6.445 4.037 -8.313 . . . 1.0 . . . . . . . . . . . . A . 38 SER CB . . . . . . . . . c17360_2l7l 1 . 1 . 573 . 1 1 38 SER H H 4.484 3.206 -9.678 . . . 1.0 . . . . . . . . . . . . A . 38 SER H . . . . . . . . . c17360_2l7l 1 . 1 . 574 . 1 1 38 SER HA H 7.261 2.808 -9.877 . . . 1.0 . . . . . . . . . . . . A . 38 SER HA . . . . . . . . . c17360_2l7l 1 . 1 . 575 . 1 1 38 SER HB2 H 7.362 4.586 -8.450 . . . 1.0 . . . . . . . . . . . . A . 38 SER HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 576 . 1 1 38 SER HB3 H 5.618 4.646 -8.649 . . . 1.0 . . . . . . . . . . . . A . 38 SER HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 577 . 1 1 38 SER HG H 5.445 3.275 -6.822 . . . 1.0 . . . . . . . . . . . . A . 38 SER HG . . . . . . . . . c17360_2l7l 1 . 1 . 578 . 1 1 38 SER N N 5.202 2.552 -9.816 . . . 1.0 . . . . . . . . . . . . A . 38 SER N . . . . . . . . . c17360_2l7l 1 . 1 . 579 . 1 1 38 SER O O 7.928 1.318 -7.849 . . . 1.0 . . . . . . . . . . . . A . 38 SER O . . . . . . . . . c17360_2l7l 1 . 1 . 580 . 1 1 38 SER OG O 6.285 3.728 -6.932 . . . 1.0 . . . . . . . . . . . . A . 38 SER OG . . . . . . . . . c17360_2l7l 1 . 1 . 581 . 1 1 39 LEU C C 6.672 -1.442 -7.648 . . . 1.0 . . . . . . . . . . . . A . 39 LEU C . . . . . . . . . c17360_2l7l 1 . 1 . 582 . 1 1 39 LEU CA C 5.912 -0.322 -6.950 . . . 1.0 . . . . . . . . . . . . A . 39 LEU CA . . . . . . . . . c17360_2l7l 1 . 1 . 583 . 1 1 39 LEU CB C 4.547 -0.840 -6.498 . . . 1.0 . . . . . . . . . . . . A . 39 LEU CB . . . . . . . . . c17360_2l7l 1 . 1 . 584 . 1 1 39 LEU CD1 C 2.395 -0.124 -5.421 . . . 1.0 . . . . . . . . . . . . A . 39 LEU CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 585 . 1 1 39 LEU CD2 C 4.568 0.233 -4.204 . . . 1.0 . . . . . . . . . . . . A . 39 LEU CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 586 . 1 1 39 LEU CG C 3.880 0.208 -5.591 . . . 1.0 . . . . . . . . . . . . A . 39 LEU CG . . . . . . . . . c17360_2l7l 1 . 1 . 587 . 1 1 39 LEU H H 4.845 1.060 -8.159 . . . 1.0 . . . . . . . . . . . . A . 39 LEU H . . . . . . . . . c17360_2l7l 1 . 1 . 588 . 1 1 39 LEU HA H 6.471 -0.013 -6.081 . . . 1.0 . . . . . . . . . . . . A . 39 LEU HA . . . . . . . . . c17360_2l7l 1 . 1 . 589 . 1 1 39 LEU HB2 H 3.933 -1.027 -7.364 . . . 1.0 . . . . . . . . . . . . A . 39 LEU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 590 . 1 1 39 LEU HB3 H 4.675 -1.763 -5.952 . . . 1.0 . . . . . . . . . . . . A . 39 LEU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 591 . 1 1 39 LEU HD11 H 1.963 -0.348 -6.384 . . . 1.0 . . . . . . . . . . . . A . 39 LEU HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 592 . 1 1 39 LEU HD12 H 1.886 0.723 -4.988 . . . 1.0 . . . . . . . . . . . . A . 39 LEU HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 593 . 1 1 39 LEU HD13 H 2.288 -0.979 -4.769 . . . 1.0 . . . . . . . . . . . . A . 39 LEU HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 594 . 1 1 39 LEU HD21 H 5.408 0.911 -4.233 . . . 1.0 . . . . . . . . . . . . A . 39 LEU HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 595 . 1 1 39 LEU HD22 H 4.917 -0.757 -3.943 . . . 1.0 . . . . . . . . . . . . A . 39 LEU HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 596 . 1 1 39 LEU HD23 H 3.868 0.568 -3.451 . . . 1.0 . . . . . . . . . . . . A . 39 LEU HD23 . . . . . . . . . c17360_2l7l 1 . 1 . 597 . 1 1 39 LEU HG H 3.971 1.181 -6.050 . . . 1.0 . . . . . . . . . . . . A . 39 LEU HG . . . . . . . . . c17360_2l7l 1 . 1 . 598 . 1 1 39 LEU N N 5.741 0.825 -7.837 . . . 1.0 . . . . . . . . . . . . A . 39 LEU N . . . . . . . . . c17360_2l7l 1 . 1 . 599 . 1 1 39 LEU O O 6.549 -2.610 -7.278 . . . 1.0 . . . . . . . . . . . . A . 39 LEU O . . . . . . . . . c17360_2l7l 1 . 1 . 600 . 1 1 40 GLY C C 7.367 -2.860 -10.325 . . . 1.0 . . . . . . . . . . . . A . 40 GLY C . . . . . . . . . c17360_2l7l 1 . 1 . 601 . 1 1 40 GLY CA C 8.249 -2.069 -9.378 . . . 1.0 . . . . . . . . . . . . A . 40 GLY CA . . . . . . . . . c17360_2l7l 1 . 1 . 602 . 1 1 40 GLY H H 7.542 -0.142 -8.903 . . . 1.0 . . . . . . . . . . . . A . 40 GLY H . . . . . . . . . c17360_2l7l 1 . 1 . 603 . 1 1 40 GLY HA2 H 9.019 -1.561 -9.942 . . . 1.0 . . . . . . . . . . . . A . 40 GLY HA2 . . . . . . . . . c17360_2l7l 1 . 1 . 604 . 1 1 40 GLY HA3 H 8.709 -2.746 -8.675 . . . 1.0 . . . . . . . . . . . . A . 40 GLY HA3 . . . . . . . . . c17360_2l7l 1 . 1 . 605 . 1 1 40 GLY N N 7.466 -1.082 -8.654 . . . 1.0 . . . . . . . . . . . . A . 40 GLY N . . . . . . . . . c17360_2l7l 1 . 1 . 606 . 1 1 40 GLY O O 7.778 -3.892 -10.853 . . . 1.0 . . . . . . . . . . . . A . 40 GLY O . . . . . . . . . c17360_2l7l 1 . 1 . 607 . 1 1 41 GLN C C 4.984 -2.243 -12.679 . . . 1.0 . . . . . . . . . . . . A . 41 GLN C . . . . . . . . . c17360_2l7l 1 . 1 . 608 . 1 1 41 GLN CA C 5.196 -3.062 -11.413 . . . 1.0 . . . . . . . . . . . . A . 41 GLN CA . . . . . . . . . c17360_2l7l 1 . 1 . 609 . 1 1 41 GLN CB C 3.865 -3.259 -10.684 . . . 1.0 . . . . . . . . . . . . A . 41 GLN CB . . . . . . . . . c17360_2l7l 1 . 1 . 610 . 1 1 41 GLN CD C 2.849 -3.854 -8.482 . . . 1.0 . . . . . . . . . . . . A . 41 GLN CD . . . . . . . . . c17360_2l7l 1 . 1 . 611 . 1 1 41 GLN CG C 4.120 -3.896 -9.316 . . . 1.0 . . . . . . . . . . . . A . 41 GLN CG . . . . . . . . . c17360_2l7l 1 . 1 . 612 . 1 1 41 GLN H H 5.868 -1.549 -10.090 . . . 1.0 . . . . . . . . . . . . A . 41 GLN H . . . . . . . . . c17360_2l7l 1 . 1 . 613 . 1 1 41 GLN HA H 5.589 -4.032 -11.691 . . . 1.0 . . . . . . . . . . . . A . 41 GLN HA . . . . . . . . . c17360_2l7l 1 . 1 . 614 . 1 1 41 GLN HB2 H 3.365 -2.310 -10.559 . . . 1.0 . . . . . . . . . . . . A . 41 GLN HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 615 . 1 1 41 GLN HB3 H 3.241 -3.923 -11.259 . . . 1.0 . . . . . . . . . . . . A . 41 GLN HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 616 . 1 1 41 GLN HE21 H 2.545 -5.813 -8.572 . . . 1.0 . . . . . . . . . . . . A . 41 GLN HE21 . . . . . . . . . c17360_2l7l 1 . 1 . 617 . 1 1 41 GLN HE22 H 1.389 -4.938 -7.689 . . . 1.0 . . . . . . . . . . . . A . 41 GLN HE22 . . . . . . . . . c17360_2l7l 1 . 1 . 618 . 1 1 41 GLN HG2 H 4.425 -4.922 -9.450 . . . 1.0 . . . . . . . . . . . . A . 41 GLN HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 619 . 1 1 41 GLN HG3 H 4.900 -3.355 -8.798 . . . 1.0 . . . . . . . . . . . . A . 41 GLN HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 620 . 1 1 41 GLN N N 6.143 -2.379 -10.534 . . . 1.0 . . . . . . . . . . . . A . 41 GLN N . . . . . . . . . c17360_2l7l 1 . 1 . 621 . 1 1 41 GLN NE2 N 2.208 -4.960 -8.226 . . . 1.0 . . . . . . . . . . . . A . 41 GLN NE2 . . . . . . . . . c17360_2l7l 1 . 1 . 622 . 1 1 41 GLN O O 5.126 -1.020 -12.667 . . . 1.0 . . . . . . . . . . . . A . 41 GLN O . . . . . . . . . c17360_2l7l 1 . 1 . 623 . 1 1 41 GLN OE1 O 2.427 -2.780 -8.054 . . . 1.0 . . . . . . . . . . . . A . 41 GLN OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 624 . 1 1 42 ASN C C 3.074 -2.620 -15.646 . . . 1.0 . . . . . . . . . . . . A . 42 ASN C . . . . . . . . . c17360_2l7l 1 . 1 . 625 . 1 1 42 ASN CA C 4.431 -2.251 -15.056 . . . 1.0 . . . . . . . . . . . . A . 42 ASN CA . . . . . . . . . c17360_2l7l 1 . 1 . 626 . 1 1 42 ASN CB C 5.535 -2.643 -16.038 . . . 1.0 . . . . . . . . . . . . A . 42 ASN CB . . . . . . . . . c17360_2l7l 1 . 1 . 627 . 1 1 42 ASN CG C 6.897 -2.545 -15.356 . . . 1.0 . . . . . . . . . . . . A . 42 ASN CG . . . . . . . . . c17360_2l7l 1 . 1 . 628 . 1 1 42 ASN H H 4.560 -3.896 -13.721 . . . 1.0 . . . . . . . . . . . . A . 42 ASN H . . . . . . . . . c17360_2l7l 1 . 1 . 629 . 1 1 42 ASN HA H 4.468 -1.179 -14.918 . . . 1.0 . . . . . . . . . . . . A . 42 ASN HA . . . . . . . . . c17360_2l7l 1 . 1 . 630 . 1 1 42 ASN HB2 H 5.373 -3.655 -16.378 . . . 1.0 . . . . . . . . . . . . A . 42 ASN HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 631 . 1 1 42 ASN HB3 H 5.514 -1.973 -16.885 . . . 1.0 . . . . . . . . . . . . A . 42 ASN HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 632 . 1 1 42 ASN HD21 H 6.279 -1.261 -13.971 . . . 1.0 . . . . . . . . . . . . A . 42 ASN HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 633 . 1 1 42 ASN HD22 H 7.913 -1.708 -13.870 . . . 1.0 . . . . . . . . . . . . A . 42 ASN HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 634 . 1 1 42 ASN N N 4.649 -2.923 -13.773 . . . 1.0 . . . . . . . . . . . . A . 42 ASN N . . . . . . . . . c17360_2l7l 1 . 1 . 635 . 1 1 42 ASN ND2 N 7.042 -1.774 -14.313 . . . 1.0 . . . . . . . . . . . . A . 42 ASN ND2 . . . . . . . . . c17360_2l7l 1 . 1 . 636 . 1 1 42 ASN O O 2.983 -3.073 -16.787 . . . 1.0 . . . . . . . . . . . . A . 42 ASN O . . . . . . . . . c17360_2l7l 1 . 1 . 637 . 1 1 42 ASN OD1 O 7.854 -3.189 -15.786 . . . 1.0 . . . . . . . . . . . . A . 42 ASN OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 638 . 1 1 43 PRO C C 0.261 -1.843 -16.561 . . . 1.0 . . . . . . . . . . . . A . 43 PRO C . . . . . . . . . c17360_2l7l 1 . 1 . 639 . 1 1 43 PRO CA C 0.630 -2.692 -15.346 . . . 1.0 . . . . . . . . . . . . A . 43 PRO CA . . . . . . . . . c17360_2l7l 1 . 1 . 640 . 1 1 43 PRO CB C -0.237 -2.325 -14.119 . . . 1.0 . . . . . . . . . . . . A . 43 PRO CB . . . . . . . . . c17360_2l7l 1 . 1 . 641 . 1 1 43 PRO CD C 2.044 -1.904 -13.514 . . . 1.0 . . . . . . . . . . . . A . 43 PRO CD . . . . . . . . . c17360_2l7l 1 . 1 . 642 . 1 1 43 PRO CG C 0.619 -1.415 -13.298 . . . 1.0 . . . . . . . . . . . . A . 43 PRO CG . . . . . . . . . c17360_2l7l 1 . 1 . 643 . 1 1 43 PRO HA H 0.516 -3.740 -15.575 . . . 1.0 . . . . . . . . . . . . A . 43 PRO HA . . . . . . . . . c17360_2l7l 1 . 1 . 644 . 1 1 43 PRO HB2 H -1.144 -1.816 -14.427 . . . 1.0 . . . . . . . . . . . . A . 43 PRO HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 645 . 1 1 43 PRO HB3 H -0.481 -3.212 -13.551 . . . 1.0 . . . . . . . . . . . . A . 43 PRO HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 646 . 1 1 43 PRO HD2 H 2.749 -1.104 -13.405 . . . 1.0 . . . . . . . . . . . . A . 43 PRO HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 647 . 1 1 43 PRO HD3 H 2.271 -2.701 -12.835 . . . 1.0 . . . . . . . . . . . . A . 43 PRO HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 648 . 1 1 43 PRO HG2 H 0.515 -0.393 -13.634 . . . 1.0 . . . . . . . . . . . . A . 43 PRO HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 649 . 1 1 43 PRO HG3 H 0.363 -1.493 -12.251 . . . 1.0 . . . . . . . . . . . . A . 43 PRO HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 650 . 1 1 43 PRO N N 2.024 -2.413 -14.892 . . . 1.0 . . . . . . . . . . . . A . 43 PRO N . . . . . . . . . c17360_2l7l 1 . 1 . 651 . 1 1 43 PRO O O 0.717 -0.707 -16.696 . . . 1.0 . . . . . . . . . . . . A . 43 PRO O . . . . . . . . . c17360_2l7l 1 . 1 . 652 . 1 1 44 THR C C -2.077 -0.673 -18.313 . . . 1.0 . . . . . . . . . . . . A . 44 THR C . . . . . . . . . c17360_2l7l 1 . 1 . 653 . 1 1 44 THR CA C -0.977 -1.680 -18.639 . . . 1.0 . . . . . . . . . . . . A . 44 THR CA . . . . . . . . . c17360_2l7l 1 . 1 . 654 . 1 1 44 THR CB C -1.496 -2.677 -19.680 . . . 1.0 . . . . . . . . . . . . A . 44 THR CB . . . . . . . . . c17360_2l7l 1 . 1 . 655 . 1 1 44 THR CG2 C -0.603 -3.918 -19.692 . . . 1.0 . . . . . . . . . . . . A . 44 THR CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 656 . 1 1 44 THR H H -0.889 -3.310 -17.285 . . . 1.0 . . . . . . . . . . . . A . 44 THR H . . . . . . . . . c17360_2l7l 1 . 1 . 657 . 1 1 44 THR HA H -0.128 -1.157 -19.051 . . . 1.0 . . . . . . . . . . . . A . 44 THR HA . . . . . . . . . c17360_2l7l 1 . 1 . 658 . 1 1 44 THR HB H -1.481 -2.218 -20.657 . . . 1.0 . . . . . . . . . . . . A . 44 THR HB . . . . . . . . . c17360_2l7l 1 . 1 . 659 . 1 1 44 THR HG1 H -3.016 -2.738 -18.465 . . . 1.0 . . . . . . . . . . . . A . 44 THR HG1 . . . . . . . . . c17360_2l7l 1 . 1 . 660 . 1 1 44 THR HG21 H -0.869 -4.544 -20.532 . . . 1.0 . . . . . . . . . . . . A . 44 THR HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 661 . 1 1 44 THR HG22 H -0.742 -4.471 -18.774 . . . 1.0 . . . . . . . . . . . . A . 44 THR HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 662 . 1 1 44 THR HG23 H 0.430 -3.619 -19.780 . . . 1.0 . . . . . . . . . . . . A . 44 THR HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 663 . 1 1 44 THR N N -0.562 -2.400 -17.440 . . . 1.0 . . . . . . . . . . . . A . 44 THR N . . . . . . . . . c17360_2l7l 1 . 1 . 664 . 1 1 44 THR O O -2.754 -0.781 -17.293 . . . 1.0 . . . . . . . . . . . . A . 44 THR O . . . . . . . . . c17360_2l7l 1 . 1 . 665 . 1 1 44 THR OG1 O -2.827 -3.054 -19.353 . . . 1.0 . . . . . . . . . . . . A . 44 THR OG1 . . . . . . . . . c17360_2l7l 1 . 1 . 666 . 1 1 45 GLU C C -4.621 0.699 -18.743 . . . 1.0 . . . . . . . . . . . . A . 45 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 667 . 1 1 45 GLU CA C -3.256 1.340 -18.968 . . . 1.0 . . . . . . . . . . . . A . 45 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 668 . 1 1 45 GLU CB C -3.318 2.269 -20.182 . . . 1.0 . . . . . . . . . . . . A . 45 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 669 . 1 1 45 GLU CD C -4.323 4.376 -21.084 . . . 1.0 . . . . . . . . . . . . A . 45 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 670 . 1 1 45 GLU CG C -4.311 3.401 -19.912 . . . 1.0 . . . . . . . . . . . . A . 45 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 671 . 1 1 45 GLU H H -1.663 0.366 -19.971 . . . 1.0 . . . . . . . . . . . . A . 45 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 672 . 1 1 45 GLU HA H -2.991 1.920 -18.097 . . . 1.0 . . . . . . . . . . . . A . 45 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 673 . 1 1 45 GLU HB2 H -2.338 2.686 -20.367 . . . 1.0 . . . . . . . . . . . . A . 45 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 674 . 1 1 45 GLU HB3 H -3.641 1.710 -21.047 . . . 1.0 . . . . . . . . . . . . A . 45 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 675 . 1 1 45 GLU HG2 H -5.300 2.987 -19.783 . . . 1.0 . . . . . . . . . . . . A . 45 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 676 . 1 1 45 GLU HG3 H -4.023 3.926 -19.014 . . . 1.0 . . . . . . . . . . . . A . 45 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 677 . 1 1 45 GLU N N -2.242 0.315 -19.182 . . . 1.0 . . . . . . . . . . . . A . 45 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 678 . 1 1 45 GLU O O -5.419 1.180 -17.938 . . . 1.0 . . . . . . . . . . . . A . 45 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 679 . 1 1 45 GLU OE1 O -3.768 4.037 -22.116 . . . 1.0 . . . . . . . . . . . . A . 45 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 680 . 1 1 45 GLU OE2 O -4.886 5.447 -20.931 . . . 1.0 . . . . . . . . . . . . A . 45 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 681 . 1 1 46 ALA C C -6.330 -1.601 -17.892 . . . 1.0 . . . . . . . . . . . . A . 46 ALA C . . . . . . . . . c17360_2l7l 1 . 1 . 682 . 1 1 46 ALA CA C -6.151 -1.094 -19.322 . . . 1.0 . . . . . . . . . . . . A . 46 ALA CA . . . . . . . . . c17360_2l7l 1 . 1 . 683 . 1 1 46 ALA CB C -6.201 -2.271 -20.298 . . . 1.0 . . . . . . . . . . . . A . 46 ALA CB . . . . . . . . . c17360_2l7l 1 . 1 . 684 . 1 1 46 ALA H H -4.205 -0.730 -20.078 . . . 1.0 . . . . . . . . . . . . A . 46 ALA H . . . . . . . . . c17360_2l7l 1 . 1 . 685 . 1 1 46 ALA HA H -6.956 -0.412 -19.556 . . . 1.0 . . . . . . . . . . . . A . 46 ALA HA . . . . . . . . . c17360_2l7l 1 . 1 . 686 . 1 1 46 ALA HB1 H -5.385 -2.947 -20.090 . . . 1.0 . . . . . . . . . . . . A . 46 ALA HB1 . . . . . . . . . c17360_2l7l 1 . 1 . 687 . 1 1 46 ALA HB2 H -6.113 -1.904 -21.310 . . . 1.0 . . . . . . . . . . . . A . 46 ALA HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 688 . 1 1 46 ALA HB3 H -7.140 -2.793 -20.186 . . . 1.0 . . . . . . . . . . . . A . 46 ALA HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 689 . 1 1 46 ALA N N -4.881 -0.391 -19.454 . . . 1.0 . . . . . . . . . . . . A . 46 ALA N . . . . . . . . . c17360_2l7l 1 . 1 . 690 . 1 1 46 ALA O O -7.445 -1.637 -17.370 . . . 1.0 . . . . . . . . . . . . A . 46 ALA O . . . . . . . . . c17360_2l7l 1 . 1 . 691 . 1 1 47 GLU C C -5.618 -1.354 -14.937 . . . 1.0 . . . . . . . . . . . . A . 47 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 692 . 1 1 47 GLU CA C -5.266 -2.486 -15.899 . . . 1.0 . . . . . . . . . . . . A . 47 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 693 . 1 1 47 GLU CB C -3.920 -3.104 -15.513 . . . 1.0 . . . . . . . . . . . . A . 47 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 694 . 1 1 47 GLU CD C -2.319 -4.956 -16.023 . . . 1.0 . . . . . . . . . . . . A . 47 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 695 . 1 1 47 GLU CG C -3.676 -4.354 -16.361 . . . 1.0 . . . . . . . . . . . . A . 47 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 696 . 1 1 47 GLU H H -4.366 -1.927 -17.741 . . . 1.0 . . . . . . . . . . . . A . 47 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 697 . 1 1 47 GLU HA H -6.029 -3.247 -15.834 . . . 1.0 . . . . . . . . . . . . A . 47 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 698 . 1 1 47 GLU HB2 H -3.129 -2.390 -15.684 . . . 1.0 . . . . . . . . . . . . A . 47 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 699 . 1 1 47 GLU HB3 H -3.936 -3.380 -14.470 . . . 1.0 . . . . . . . . . . . . A . 47 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 700 . 1 1 47 GLU HG2 H -4.451 -5.080 -16.162 . . . 1.0 . . . . . . . . . . . . A . 47 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 701 . 1 1 47 GLU HG3 H -3.697 -4.086 -17.407 . . . 1.0 . . . . . . . . . . . . A . 47 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 702 . 1 1 47 GLU N N -5.222 -1.988 -17.268 . . . 1.0 . . . . . . . . . . . . A . 47 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 703 . 1 1 47 GLU O O -6.376 -1.547 -13.985 . . . 1.0 . . . . . . . . . . . . A . 47 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 704 . 1 1 47 GLU OE1 O -1.682 -4.453 -15.114 . . . 1.0 . . . . . . . . . . . . A . 47 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 705 . 1 1 47 GLU OE2 O -1.935 -5.910 -16.679 . . . 1.0 . . . . . . . . . . . . A . 47 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 706 . 1 1 48 LEU C C -6.751 1.485 -14.562 . . . 1.0 . . . . . . . . . . . . A . 48 LEU C . . . . . . . . . c17360_2l7l 1 . 1 . 707 . 1 1 48 LEU CA C -5.327 0.985 -14.343 . . . 1.0 . . . . . . . . . . . . A . 48 LEU CA . . . . . . . . . c17360_2l7l 1 . 1 . 708 . 1 1 48 LEU CB C -4.331 2.100 -14.667 . . . 1.0 . . . . . . . . . . . . A . 48 LEU CB . . . . . . . . . c17360_2l7l 1 . 1 . 709 . 1 1 48 LEU CD1 C -1.898 2.670 -14.821 . . . 1.0 . . . . . . . . . . . . A . 48 LEU CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 710 . 1 1 48 LEU CD2 C -2.763 1.479 -12.781 . . . 1.0 . . . . . . . . . . . . A . 48 LEU CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 711 . 1 1 48 LEU CG C -2.910 1.639 -14.309 . . . 1.0 . . . . . . . . . . . . A . 48 LEU CG . . . . . . . . . c17360_2l7l 1 . 1 . 712 . 1 1 48 LEU H H -4.470 -0.075 -15.967 . . . 1.0 . . . . . . . . . . . . A . 48 LEU H . . . . . . . . . c17360_2l7l 1 . 1 . 713 . 1 1 48 LEU HA H -5.217 0.698 -13.312 . . . 1.0 . . . . . . . . . . . . A . 48 LEU HA . . . . . . . . . c17360_2l7l 1 . 1 . 714 . 1 1 48 LEU HB2 H -4.381 2.329 -15.722 . . . 1.0 . . . . . . . . . . . . A . 48 LEU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 715 . 1 1 48 LEU HB3 H -4.579 2.982 -14.095 . . . 1.0 . . . . . . . . . . . . A . 48 LEU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 716 . 1 1 48 LEU HD11 H -1.811 2.587 -15.895 . . . 1.0 . . . . . . . . . . . . A . 48 LEU HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 717 . 1 1 48 LEU HD12 H -0.936 2.485 -14.367 . . . 1.0 . . . . . . . . . . . . A . 48 LEU HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 718 . 1 1 48 LEU HD13 H -2.234 3.663 -14.562 . . . 1.0 . . . . . . . . . . . . A . 48 LEU HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 719 . 1 1 48 LEU HD21 H -1.725 1.605 -12.498 . . . 1.0 . . . . . . . . . . . . A . 48 LEU HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 720 . 1 1 48 LEU HD22 H -3.088 0.491 -12.489 . . . 1.0 . . . . . . . . . . . . A . 48 LEU HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 721 . 1 1 48 LEU HD23 H -3.364 2.219 -12.272 . . . 1.0 . . . . . . . . . . . . A . 48 LEU HD23 . . . . . . . . . c17360_2l7l 1 . 1 . 722 . 1 1 48 LEU HG H -2.718 0.690 -14.788 . . . 1.0 . . . . . . . . . . . . A . 48 LEU HG . . . . . . . . . c17360_2l7l 1 . 1 . 723 . 1 1 48 LEU N N -5.063 -0.172 -15.194 . . . 1.0 . . . . . . . . . . . . A . 48 LEU N . . . . . . . . . c17360_2l7l 1 . 1 . 724 . 1 1 48 LEU O O -7.498 1.704 -13.613 . . . 1.0 . . . . . . . . . . . . A . 48 LEU O . . . . . . . . . c17360_2l7l 1 . 1 . 725 . 1 1 49 GLN C C -9.505 1.291 -15.457 . . . 1.0 . . . . . . . . . . . . A . 49 GLN C . . . . . . . . . c17360_2l7l 1 . 1 . 726 . 1 1 49 GLN CA C -8.456 2.158 -16.141 . . . 1.0 . . . . . . . . . . . . A . 49 GLN CA . . . . . . . . . c17360_2l7l 1 . 1 . 727 . 1 1 49 GLN CB C -8.666 2.120 -17.657 . . . 1.0 . . . . . . . . . . . . A . 49 GLN CB . . . . . . . . . c17360_2l7l 1 . 1 . 728 . 1 1 49 GLN CD C -8.341 4.579 -17.975 . . . 1.0 . . . . . . . . . . . . A . 49 GLN CD . . . . . . . . . c17360_2l7l 1 . 1 . 729 . 1 1 49 GLN CG C -7.808 3.195 -18.326 . . . 1.0 . . . . . . . . . . . . A . 49 GLN CG . . . . . . . . . c17360_2l7l 1 . 1 . 730 . 1 1 49 GLN H H -6.479 1.514 -16.545 . . . 1.0 . . . . . . . . . . . . A . 49 GLN H . . . . . . . . . c17360_2l7l 1 . 1 . 731 . 1 1 49 GLN HA H -8.556 3.175 -15.794 . . . 1.0 . . . . . . . . . . . . A . 49 GLN HA . . . . . . . . . c17360_2l7l 1 . 1 . 732 . 1 1 49 GLN HB2 H -8.380 1.148 -18.032 . . . 1.0 . . . . . . . . . . . . A . 49 GLN HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 733 . 1 1 49 GLN HB3 H -9.706 2.301 -17.881 . . . 1.0 . . . . . . . . . . . . A . 49 GLN HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 734 . 1 1 49 GLN HE21 H -6.572 5.281 -17.414 . . . 1.0 . . . . . . . . . . . . A . 49 GLN HE21 . . . . . . . . . c17360_2l7l 1 . 1 . 735 . 1 1 49 GLN HE22 H -7.860 6.381 -17.297 . . . 1.0 . . . . . . . . . . . . A . 49 GLN HE22 . . . . . . . . . c17360_2l7l 1 . 1 . 736 . 1 1 49 GLN HG2 H -6.788 3.105 -17.980 . . . 1.0 . . . . . . . . . . . . A . 49 GLN HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 737 . 1 1 49 GLN HG3 H -7.836 3.062 -19.398 . . . 1.0 . . . . . . . . . . . . A . 49 GLN HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 738 . 1 1 49 GLN N N -7.119 1.675 -15.822 . . . 1.0 . . . . . . . . . . . . A . 49 GLN N . . . . . . . . . c17360_2l7l 1 . 1 . 739 . 1 1 49 GLN NE2 N -7.523 5.489 -17.525 . . . 1.0 . . . . . . . . . . . . A . 49 GLN NE2 . . . . . . . . . c17360_2l7l 1 . 1 . 740 . 1 1 49 GLN O O -10.435 1.801 -14.833 . . . 1.0 . . . . . . . . . . . . A . 49 GLN O . . . . . . . . . c17360_2l7l 1 . 1 . 741 . 1 1 49 GLN OE1 O -9.537 4.839 -18.115 . . . 1.0 . . . . . . . . . . . . A . 49 GLN OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 742 . 1 1 50 ASP C C -10.231 -0.802 -13.425 . . . 1.0 . . . . . . . . . . . . A . 50 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 743 . 1 1 50 ASP CA C -10.276 -0.952 -14.941 . . . 1.0 . . . . . . . . . . . . A . 50 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 744 . 1 1 50 ASP CB C -9.928 -2.386 -15.333 . . . 1.0 . . . . . . . . . . . . A . 50 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 745 . 1 1 50 ASP CG C -10.298 -2.633 -16.792 . . . 1.0 . . . . . . . . . . . . A . 50 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 746 . 1 1 50 ASP H H -8.576 -0.374 -16.066 . . . 1.0 . . . . . . . . . . . . A . 50 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 747 . 1 1 50 ASP HA H -11.276 -0.727 -15.283 . . . 1.0 . . . . . . . . . . . . A . 50 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 748 . 1 1 50 ASP HB2 H -8.869 -2.544 -15.203 . . . 1.0 . . . . . . . . . . . . A . 50 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 749 . 1 1 50 ASP HB3 H -10.476 -3.070 -14.707 . . . 1.0 . . . . . . . . . . . . A . 50 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 750 . 1 1 50 ASP N N -9.342 -0.023 -15.565 . . . 1.0 . . . . . . . . . . . . A . 50 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 751 . 1 1 50 ASP O O -11.263 -0.839 -12.757 . . . 1.0 . . . . . . . . . . . . A . 50 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 752 . 1 1 50 ASP OD1 O -11.028 -1.826 -17.344 . . . 1.0 . . . . . . . . . . . . A . 50 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 753 . 1 1 50 ASP OD2 O -9.848 -3.628 -17.334 . . . 1.0 . . . . . . . . . . . . A . 50 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 754 . 1 1 51 MET C C -9.662 0.745 -10.963 . . . 1.0 . . . . . . . . . . . . A . 51 MET C . . . . . . . . . c17360_2l7l 1 . 1 . 755 . 1 1 51 MET CA C -8.873 -0.464 -11.448 . . . 1.0 . . . . . . . . . . . . A . 51 MET CA . . . . . . . . . c17360_2l7l 1 . 1 . 756 . 1 1 51 MET CB C -7.383 -0.277 -11.100 . . . 1.0 . . . . . . . . . . . . A . 51 MET CB . . . . . . . . . c17360_2l7l 1 . 1 . 757 . 1 1 51 MET CE C -5.227 -1.302 -8.522 . . . 1.0 . . . . . . . . . . . . A . 51 MET CE . . . . . . . . . c17360_2l7l 1 . 1 . 758 . 1 1 51 MET CG C -7.221 0.161 -9.638 . . . 1.0 . . . . . . . . . . . . A . 51 MET CG . . . . . . . . . c17360_2l7l 1 . 1 . 759 . 1 1 51 MET H H -8.237 -0.600 -13.467 . . . 1.0 . . . . . . . . . . . . A . 51 MET H . . . . . . . . . c17360_2l7l 1 . 1 . 760 . 1 1 51 MET HA H -9.239 -1.350 -10.953 . . . 1.0 . . . . . . . . . . . . A . 51 MET HA . . . . . . . . . c17360_2l7l 1 . 1 . 761 . 1 1 51 MET HB2 H -6.862 -1.211 -11.248 . . . 1.0 . . . . . . . . . . . . A . 51 MET HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 762 . 1 1 51 MET HB3 H -6.954 0.474 -11.743 . . . 1.0 . . . . . . . . . . . . A . 51 MET HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 763 . 1 1 51 MET HE1 H -4.209 -1.619 -8.682 . . . 1.0 . . . . . . . . . . . . A . 51 MET HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 764 . 1 1 51 MET HE2 H -5.897 -2.015 -8.976 . . . 1.0 . . . . . . . . . . . . A . 51 MET HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 765 . 1 1 51 MET HE3 H -5.433 -1.239 -7.463 . . . 1.0 . . . . . . . . . . . . A . 51 MET HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 766 . 1 1 51 MET HG2 H -7.696 1.121 -9.487 . . . 1.0 . . . . . . . . . . . . A . 51 MET HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 767 . 1 1 51 MET HG3 H -7.670 -0.570 -8.986 . . . 1.0 . . . . . . . . . . . . A . 51 MET HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 768 . 1 1 51 MET N N -9.028 -0.626 -12.888 . . . 1.0 . . . . . . . . . . . . A . 51 MET N . . . . . . . . . c17360_2l7l 1 . 1 . 769 . 1 1 51 MET O O -10.371 0.673 -9.958 . . . 1.0 . . . . . . . . . . . . A . 51 MET O . . . . . . . . . c17360_2l7l 1 . 1 . 770 . 1 1 51 MET SD S -5.462 0.324 -9.266 . . . 1.0 . . . . . . . . . . . . A . 51 MET SD . . . . . . . . . c17360_2l7l 1 . 1 . 771 . 1 1 52 ILE C C -11.716 2.952 -11.552 . . . 1.0 . . . . . . . . . . . . A . 52 ILE C . . . . . . . . . c17360_2l7l 1 . 1 . 772 . 1 1 52 ILE CA C -10.222 3.076 -11.294 . . . 1.0 . . . . . . . . . . . . A . 52 ILE CA . . . . . . . . . c17360_2l7l 1 . 1 . 773 . 1 1 52 ILE CB C -9.672 4.259 -12.082 . . . 1.0 . . . . . . . . . . . . A . 52 ILE CB . . . . . . . . . c17360_2l7l 1 . 1 . 774 . 1 1 52 ILE CD1 C -7.559 5.381 -12.804 . . . 1.0 . . . . . . . . . . . . A . 52 ILE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 775 . 1 1 52 ILE CG1 C -8.167 4.365 -11.841 . . . 1.0 . . . . . . . . . . . . A . 52 ILE CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 776 . 1 1 52 ILE CG2 C -10.346 5.549 -11.605 . . . 1.0 . . . . . . . . . . . . A . 52 ILE CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 777 . 1 1 52 ILE H H -8.951 1.851 -12.469 . . . 1.0 . . . . . . . . . . . . A . 52 ILE H . . . . . . . . . c17360_2l7l 1 . 1 . 778 . 1 1 52 ILE HA H -10.058 3.259 -10.245 . . . 1.0 . . . . . . . . . . . . A . 52 ILE HA . . . . . . . . . c17360_2l7l 1 . 1 . 779 . 1 1 52 ILE HB H -9.868 4.113 -13.133 . . . 1.0 . . . . . . . . . . . . A . 52 ILE HB . . . . . . . . . c17360_2l7l 1 . 1 . 780 . 1 1 52 ILE HD11 H -7.968 5.238 -13.794 . . . 1.0 . . . . . . . . . . . . A . 52 ILE HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 781 . 1 1 52 ILE HD12 H -6.490 5.244 -12.833 . . . 1.0 . . . . . . . . . . . . A . 52 ILE HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 782 . 1 1 52 ILE HD13 H -7.787 6.378 -12.459 . . . 1.0 . . . . . . . . . . . . A . 52 ILE HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 783 . 1 1 52 ILE HG12 H -7.993 4.687 -10.828 . . . 1.0 . . . . . . . . . . . . A . 52 ILE HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 784 . 1 1 52 ILE HG13 H -7.707 3.402 -11.998 . . . 1.0 . . . . . . . . . . . . A . 52 ILE HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 785 . 1 1 52 ILE HG21 H -11.397 5.520 -11.848 . . . 1.0 . . . . . . . . . . . . A . 52 ILE HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 786 . 1 1 52 ILE HG22 H -9.887 6.397 -12.094 . . . 1.0 . . . . . . . . . . . . A . 52 ILE HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 787 . 1 1 52 ILE HG23 H -10.225 5.643 -10.536 . . . 1.0 . . . . . . . . . . . . A . 52 ILE HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 788 . 1 1 52 ILE N N -9.524 1.857 -11.675 . . . 1.0 . . . . . . . . . . . . A . 52 ILE N . . . . . . . . . c17360_2l7l 1 . 1 . 789 . 1 1 52 ILE O O -12.529 3.219 -10.673 . . . 1.0 . . . . . . . . . . . . A . 52 ILE O . . . . . . . . . c17360_2l7l 1 . 1 . 790 . 1 1 53 ASN C C -14.210 1.549 -12.117 . . . 1.0 . . . . . . . . . . . . A . 53 ASN C . . . . . . . . . c17360_2l7l 1 . 1 . 791 . 1 1 53 ASN CA C -13.461 2.383 -13.145 . . . 1.0 . . . . . . . . . . . . A . 53 ASN CA . . . . . . . . . c17360_2l7l 1 . 1 . 792 . 1 1 53 ASN CB C -13.563 1.716 -14.519 . . . 1.0 . . . . . . . . . . . . A . 53 ASN CB . . . . . . . . . c17360_2l7l 1 . 1 . 793 . 1 1 53 ASN CG C -12.978 2.631 -15.592 . . . 1.0 . . . . . . . . . . . . A . 53 ASN CG . . . . . . . . . c17360_2l7l 1 . 1 . 794 . 1 1 53 ASN H H -11.362 2.330 -13.420 . . . 1.0 . . . . . . . . . . . . A . 53 ASN H . . . . . . . . . c17360_2l7l 1 . 1 . 795 . 1 1 53 ASN HA H -13.919 3.360 -13.200 . . . 1.0 . . . . . . . . . . . . A . 53 ASN HA . . . . . . . . . c17360_2l7l 1 . 1 . 796 . 1 1 53 ASN HB2 H -13.018 0.784 -14.506 . . . 1.0 . . . . . . . . . . . . A . 53 ASN HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 797 . 1 1 53 ASN HB3 H -14.601 1.521 -14.746 . . . 1.0 . . . . . . . . . . . . A . 53 ASN HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 798 . 1 1 53 ASN HD21 H -12.919 4.228 -14.413 . . . 1.0 . . . . . . . . . . . . A . 53 ASN HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 799 . 1 1 53 ASN HD22 H -12.353 4.472 -15.995 . . . 1.0 . . . . . . . . . . . . A . 53 ASN HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 800 . 1 1 53 ASN N N -12.062 2.536 -12.765 . . . 1.0 . . . . . . . . . . . . A . 53 ASN N . . . . . . . . . c17360_2l7l 1 . 1 . 801 . 1 1 53 ASN ND2 N -12.730 3.881 -15.310 . . . 1.0 . . . . . . . . . . . . A . 53 ASN ND2 . . . . . . . . . c17360_2l7l 1 . 1 . 802 . 1 1 53 ASN O O -15.399 1.761 -11.882 . . . 1.0 . . . . . . . . . . . . A . 53 ASN O . . . . . . . . . c17360_2l7l 1 . 1 . 803 . 1 1 53 ASN OD1 O -12.736 2.193 -16.716 . . . 1.0 . . . . . . . . . . . . A . 53 ASN OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 804 . 1 1 54 GLU C C -14.557 0.543 -9.288 . . . 1.0 . . . . . . . . . . . . A . 54 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 805 . 1 1 54 GLU CA C -14.128 -0.263 -10.510 . . . 1.0 . . . . . . . . . . . . A . 54 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 806 . 1 1 54 GLU CB C -13.140 -1.348 -10.082 . . . 1.0 . . . . . . . . . . . . A . 54 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 807 . 1 1 54 GLU CD C -12.881 -3.455 -8.757 . . . 1.0 . . . . . . . . . . . . A . 54 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 808 . 1 1 54 GLU CG C -13.827 -2.313 -9.114 . . . 1.0 . . . . . . . . . . . . A . 54 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 809 . 1 1 54 GLU H H -12.566 0.470 -11.733 . . . 1.0 . . . . . . . . . . . . A . 54 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 810 . 1 1 54 GLU HA H -14.997 -0.735 -10.940 . . . 1.0 . . . . . . . . . . . . A . 54 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 811 . 1 1 54 GLU HB2 H -12.801 -1.890 -10.953 . . . 1.0 . . . . . . . . . . . . A . 54 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 812 . 1 1 54 GLU HB3 H -12.294 -0.890 -9.591 . . . 1.0 . . . . . . . . . . . . A . 54 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 813 . 1 1 54 GLU HG2 H -14.101 -1.783 -8.213 . . . 1.0 . . . . . . . . . . . . A . 54 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 814 . 1 1 54 GLU HG3 H -14.714 -2.716 -9.578 . . . 1.0 . . . . . . . . . . . . A . 54 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 815 . 1 1 54 GLU N N -13.511 0.598 -11.510 . . . 1.0 . . . . . . . . . . . . A . 54 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 816 . 1 1 54 GLU O O -15.658 0.362 -8.770 . . . 1.0 . . . . . . . . . . . . A . 54 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 817 . 1 1 54 GLU OE1 O -11.706 -3.344 -9.066 . . . 1.0 . . . . . . . . . . . . A . 54 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 818 . 1 1 54 GLU OE2 O -13.346 -4.424 -8.183 . . . 1.0 . . . . . . . . . . . . A . 54 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 819 . 1 1 55 VAL C C -14.684 3.546 -8.084 . . . 1.0 . . . . . . . . . . . . A . 55 VAL C . . . . . . . . . c17360_2l7l 1 . 1 . 820 . 1 1 55 VAL CA C -13.980 2.258 -7.662 . . . 1.0 . . . . . . . . . . . . A . 55 VAL CA . . . . . . . . . c17360_2l7l 1 . 1 . 821 . 1 1 55 VAL CB C -12.685 2.596 -6.916 . . . 1.0 . . . . . . . . . . . . A . 55 VAL CB . . . . . . . . . c17360_2l7l 1 . 1 . 822 . 1 1 55 VAL CG1 C -11.672 3.180 -7.896 . . . 1.0 . . . . . . . . . . . . A . 55 VAL CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 823 . 1 1 55 VAL CG2 C -12.977 3.619 -5.815 . . . 1.0 . . . . . . . . . . . . A . 55 VAL CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 824 . 1 1 55 VAL H H -12.816 1.532 -9.279 . . . 1.0 . . . . . . . . . . . . A . 55 VAL H . . . . . . . . . c17360_2l7l 1 . 1 . 825 . 1 1 55 VAL HA H -14.630 1.708 -6.993 . . . 1.0 . . . . . . . . . . . . A . 55 VAL HA . . . . . . . . . c17360_2l7l 1 . 1 . 826 . 1 1 55 VAL HB H -12.280 1.697 -6.476 . . . 1.0 . . . . . . . . . . . . A . 55 VAL HB . . . . . . . . . c17360_2l7l 1 . 1 . 827 . 1 1 55 VAL HG11 H -10.841 3.601 -7.349 . . . 1.0 . . . . . . . . . . . . A . 55 VAL HG11 . . . . . . . . . c17360_2l7l 1 . 1 . 828 . 1 1 55 VAL HG12 H -12.143 3.952 -8.486 . . . 1.0 . . . . . . . . . . . . A . 55 VAL HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 829 . 1 1 55 VAL HG13 H -11.317 2.395 -8.544 . . . 1.0 . . . . . . . . . . . . A . 55 VAL HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 830 . 1 1 55 VAL HG21 H -12.140 3.665 -5.133 . . . 1.0 . . . . . . . . . . . . A . 55 VAL HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 831 . 1 1 55 VAL HG22 H -13.865 3.322 -5.278 . . . 1.0 . . . . . . . . . . . . A . 55 VAL HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 832 . 1 1 55 VAL HG23 H -13.133 4.588 -6.261 . . . 1.0 . . . . . . . . . . . . A . 55 VAL HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 833 . 1 1 55 VAL N N -13.680 1.431 -8.828 . . . 1.0 . . . . . . . . . . . . A . 55 VAL N . . . . . . . . . c17360_2l7l 1 . 1 . 834 . 1 1 55 VAL O O -15.332 4.203 -7.267 . . . 1.0 . . . . . . . . . . . . A . 55 VAL O . . . . . . . . . c17360_2l7l 1 . 1 . 835 . 1 1 56 ASP C C -16.702 4.907 -9.904 . . . 1.0 . . . . . . . . . . . . A . 56 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 836 . 1 1 56 ASP CA C -15.186 5.109 -9.857 . . . 1.0 . . . . . . . . . . . . A . 56 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 837 . 1 1 56 ASP CB C -14.640 5.431 -11.265 . . . 1.0 . . . . . . . . . . . . A . 56 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 838 . 1 1 56 ASP CG C -14.642 6.937 -11.503 . . . 1.0 . . . . . . . . . . . . A . 56 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 839 . 1 1 56 ASP H H -14.032 3.343 -9.967 . . . 1.0 . . . . . . . . . . . . A . 56 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 840 . 1 1 56 ASP HA H -14.958 5.924 -9.190 . . . 1.0 . . . . . . . . . . . . A . 56 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 841 . 1 1 56 ASP HB2 H -13.629 5.070 -11.348 . . . 1.0 . . . . . . . . . . . . A . 56 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 842 . 1 1 56 ASP HB3 H -15.249 4.948 -12.015 . . . 1.0 . . . . . . . . . . . . A . 56 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 843 . 1 1 56 ASP N N -14.557 3.899 -9.356 . . . 1.0 . . . . . . . . . . . . A . 56 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 844 . 1 1 56 ASP O O -17.264 4.540 -10.935 . . . 1.0 . . . . . . . . . . . . A . 56 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 845 . 1 1 56 ASP OD1 O -15.692 7.473 -11.790 . . . 1.0 . . . . . . . . . . . . A . 56 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 846 . 1 1 56 ASP OD2 O -13.589 7.537 -11.368 . . . 1.0 . . . . . . . . . . . . A . 56 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 847 . 1 1 57 ALA C C -19.509 5.869 -9.699 . . . 1.0 . . . . . . . . . . . . A . 57 ALA C . . . . . . . . . c17360_2l7l 1 . 1 . 848 . 1 1 57 ALA CA C -18.794 4.982 -8.693 . . . 1.0 . . . . . . . . . . . . A . 57 ALA CA . . . . . . . . . c17360_2l7l 1 . 1 . 849 . 1 1 57 ALA CB C -19.280 5.324 -7.287 . . . 1.0 . . . . . . . . . . . . A . 57 ALA CB . . . . . . . . . c17360_2l7l 1 . 1 . 850 . 1 1 57 ALA H H -16.854 5.438 -7.983 . . . 1.0 . . . . . . . . . . . . A . 57 ALA H . . . . . . . . . c17360_2l7l 1 . 1 . 851 . 1 1 57 ALA HA H -19.040 3.949 -8.898 . . . 1.0 . . . . . . . . . . . . A . 57 ALA HA . . . . . . . . . c17360_2l7l 1 . 1 . 852 . 1 1 57 ALA HB1 H -20.352 5.203 -7.241 . . . 1.0 . . . . . . . . . . . . A . 57 ALA HB1 . . . . . . . . . c17360_2l7l 1 . 1 . 853 . 1 1 57 ALA HB2 H -19.023 6.348 -7.059 . . . 1.0 . . . . . . . . . . . . A . 57 ALA HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 854 . 1 1 57 ALA HB3 H -18.813 4.666 -6.571 . . . 1.0 . . . . . . . . . . . . A . 57 ALA HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 855 . 1 1 57 ALA N N -17.354 5.146 -8.776 . . . 1.0 . . . . . . . . . . . . A . 57 ALA N . . . . . . . . . c17360_2l7l 1 . 1 . 856 . 1 1 57 ALA O O -20.622 5.559 -10.118 . . . 1.0 . . . . . . . . . . . . A . 57 ALA O . . . . . . . . . c17360_2l7l 1 . 1 . 857 . 1 1 58 ASP C C -18.876 7.764 -12.416 . . . 1.0 . . . . . . . . . . . . A . 58 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 858 . 1 1 58 ASP CA C -19.491 7.912 -11.025 . . . 1.0 . . . . . . . . . . . . A . 58 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 859 . 1 1 58 ASP CB C -19.280 9.339 -10.522 . . . 1.0 . . . . . . . . . . . . A . 58 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 860 . 1 1 58 ASP CG C -17.794 9.602 -10.301 . . . 1.0 . . . . . . . . . . . . A . 58 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 861 . 1 1 58 ASP H H -17.996 7.200 -9.717 . . . 1.0 . . . . . . . . . . . . A . 58 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 862 . 1 1 58 ASP HA H -20.554 7.723 -11.090 . . . 1.0 . . . . . . . . . . . . A . 58 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 863 . 1 1 58 ASP HB2 H -19.665 10.038 -11.247 . . . 1.0 . . . . . . . . . . . . A . 58 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 864 . 1 1 58 ASP HB3 H -19.805 9.466 -9.587 . . . 1.0 . . . . . . . . . . . . A . 58 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 865 . 1 1 58 ASP N N -18.883 6.983 -10.071 . . . 1.0 . . . . . . . . . . . . A . 58 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 866 . 1 1 58 ASP O O -19.339 8.378 -13.377 . . . 1.0 . . . . . . . . . . . . A . 58 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 867 . 1 1 58 ASP OD1 O -17.030 9.344 -11.213 . . . 1.0 . . . . . . . . . . . . A . 58 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 868 . 1 1 58 ASP OD2 O -17.441 10.057 -9.225 . . . 1.0 . . . . . . . . . . . . A . 58 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 869 . 1 1 59 GLY C C -16.700 8.076 -14.392 . . . 1.0 . . . . . . . . . . . . A . 59 GLY C . . . . . . . . . c17360_2l7l 1 . 1 . 870 . 1 1 59 GLY CA C -17.165 6.748 -13.805 . . . 1.0 . . . . . . . . . . . . A . 59 GLY CA . . . . . . . . . c17360_2l7l 1 . 1 . 871 . 1 1 59 GLY H H -17.500 6.488 -11.723 . . . 1.0 . . . . . . . . . . . . A . 59 GLY H . . . . . . . . . c17360_2l7l 1 . 1 . 872 . 1 1 59 GLY HA2 H -16.307 6.108 -13.663 . . . 1.0 . . . . . . . . . . . . A . 59 GLY HA2 . . . . . . . . . c17360_2l7l 1 . 1 . 873 . 1 1 59 GLY HA3 H -17.848 6.277 -14.493 . . . 1.0 . . . . . . . . . . . . A . 59 GLY HA3 . . . . . . . . . c17360_2l7l 1 . 1 . 874 . 1 1 59 GLY N N -17.831 6.954 -12.521 . . . 1.0 . . . . . . . . . . . . A . 59 GLY N . . . . . . . . . c17360_2l7l 1 . 1 . 875 . 1 1 59 GLY O O -16.690 8.255 -15.610 . . . 1.0 . . . . . . . . . . . . A . 59 GLY O . . . . . . . . . c17360_2l7l 1 . 1 . 876 . 1 1 60 ASN C C -14.438 10.240 -14.507 . . . 1.0 . . . . . . . . . . . . A . 60 ASN C . . . . . . . . . c17360_2l7l 1 . 1 . 877 . 1 1 60 ASN CA C -15.863 10.318 -13.974 . . . 1.0 . . . . . . . . . . . . A . 60 ASN CA . . . . . . . . . c17360_2l7l 1 . 1 . 878 . 1 1 60 ASN CB C -15.917 11.319 -12.817 . . . 1.0 . . . . . . . . . . . . A . 60 ASN CB . . . . . . . . . c17360_2l7l 1 . 1 . 879 . 1 1 60 ASN CG C -14.965 10.884 -11.709 . . . 1.0 . . . . . . . . . . . . A . 60 ASN CG . . . . . . . . . c17360_2l7l 1 . 1 . 880 . 1 1 60 ASN H H -16.346 8.814 -12.565 . . . 1.0 . . . . . . . . . . . . A . 60 ASN H . . . . . . . . . c17360_2l7l 1 . 1 . 881 . 1 1 60 ASN HA H -16.513 10.664 -14.763 . . . 1.0 . . . . . . . . . . . . A . 60 ASN HA . . . . . . . . . c17360_2l7l 1 . 1 . 882 . 1 1 60 ASN HB2 H -15.630 12.297 -13.174 . . . 1.0 . . . . . . . . . . . . A . 60 ASN HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 883 . 1 1 60 ASN HB3 H -16.923 11.361 -12.427 . . . 1.0 . . . . . . . . . . . . A . 60 ASN HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 884 . 1 1 60 ASN HD21 H -15.184 12.558 -10.661 . . . 1.0 . . . . . . . . . . . . A . 60 ASN HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 885 . 1 1 60 ASN HD22 H -14.128 11.412 -9.985 . . . 1.0 . . . . . . . . . . . . A . 60 ASN HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 886 . 1 1 60 ASN N N -16.319 9.009 -13.523 . . . 1.0 . . . . . . . . . . . . A . 60 ASN N . . . . . . . . . c17360_2l7l 1 . 1 . 887 . 1 1 60 ASN ND2 N -14.741 11.684 -10.701 . . . 1.0 . . . . . . . . . . . . A . 60 ASN ND2 . . . . . . . . . c17360_2l7l 1 . 1 . 888 . 1 1 60 ASN O O -13.919 11.209 -15.060 . . . 1.0 . . . . . . . . . . . . A . 60 ASN O . . . . . . . . . c17360_2l7l 1 . 1 . 889 . 1 1 60 ASN OD1 O -14.411 9.788 -11.763 . . . 1.0 . . . . . . . . . . . . A . 60 ASN OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 890 . 1 1 61 GLY C C -11.431 9.351 -13.789 . . . 1.0 . . . . . . . . . . . . A . 61 GLY C . . . . . . . . . c17360_2l7l 1 . 1 . 891 . 1 1 61 GLY CA C -12.445 8.887 -14.826 . . . 1.0 . . . . . . . . . . . . A . 61 GLY CA . . . . . . . . . c17360_2l7l 1 . 1 . 892 . 1 1 61 GLY H H -14.271 8.337 -13.904 . . . 1.0 . . . . . . . . . . . . A . 61 GLY H . . . . . . . . . c17360_2l7l 1 . 1 . 893 . 1 1 61 GLY HA2 H -12.287 7.837 -15.026 . . . 1.0 . . . . . . . . . . . . A . 61 GLY HA2 . . . . . . . . . c17360_2l7l 1 . 1 . 894 . 1 1 61 GLY HA3 H -12.301 9.448 -15.736 . . . 1.0 . . . . . . . . . . . . A . 61 GLY HA3 . . . . . . . . . c17360_2l7l 1 . 1 . 895 . 1 1 61 GLY N N -13.810 9.078 -14.348 . . . 1.0 . . . . . . . . . . . . A . 61 GLY N . . . . . . . . . c17360_2l7l 1 . 1 . 896 . 1 1 61 GLY O O -10.226 9.341 -14.039 . . . 1.0 . . . . . . . . . . . . A . 61 GLY O . . . . . . . . . c17360_2l7l 1 . 1 . 897 . 1 1 62 THR C C -11.600 9.815 -10.196 . . . 1.0 . . . . . . . . . . . . A . 62 THR C . . . . . . . . . c17360_2l7l 1 . 1 . 898 . 1 1 62 THR CA C -11.043 10.224 -11.549 . . . 1.0 . . . . . . . . . . . . A . 62 THR CA . . . . . . . . . c17360_2l7l 1 . 1 . 899 . 1 1 62 THR CB C -10.905 11.742 -11.612 . . . 1.0 . . . . . . . . . . . . A . 62 THR CB . . . . . . . . . c17360_2l7l 1 . 1 . 900 . 1 1 62 THR CG2 C -10.367 12.143 -12.985 . . . 1.0 . . . . . . . . . . . . A . 62 THR CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 901 . 1 1 62 THR H H -12.890 9.740 -12.473 . . . 1.0 . . . . . . . . . . . . A . 62 THR H . . . . . . . . . c17360_2l7l 1 . 1 . 902 . 1 1 62 THR HA H -10.064 9.778 -11.667 . . . 1.0 . . . . . . . . . . . . A . 62 THR HA . . . . . . . . . c17360_2l7l 1 . 1 . 903 . 1 1 62 THR HB H -10.220 12.075 -10.850 . . . 1.0 . . . . . . . . . . . . A . 62 THR HB . . . . . . . . . c17360_2l7l 1 . 1 . 904 . 1 1 62 THR HG1 H -12.590 11.910 -10.652 . . . 1.0 . . . . . . . . . . . . A . 62 THR HG1 . . . . . . . . . c17360_2l7l 1 . 1 . 905 . 1 1 62 THR HG21 H -9.531 11.507 -13.242 . . . 1.0 . . . . . . . . . . . . A . 62 THR HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 906 . 1 1 62 THR HG22 H -10.043 13.171 -12.958 . . . 1.0 . . . . . . . . . . . . A . 62 THR HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 907 . 1 1 62 THR HG23 H -11.145 12.028 -13.725 . . . 1.0 . . . . . . . . . . . . A . 62 THR HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 908 . 1 1 62 THR N N -11.922 9.761 -12.622 . . . 1.0 . . . . . . . . . . . . A . 62 THR N . . . . . . . . . c17360_2l7l 1 . 1 . 909 . 1 1 62 THR O O -12.809 9.670 -10.037 . . . 1.0 . . . . . . . . . . . . A . 62 THR O . . . . . . . . . c17360_2l7l 1 . 1 . 910 . 1 1 62 THR OG1 O -12.177 12.342 -11.404 . . . 1.0 . . . . . . . . . . . . A . 62 THR OG1 . . . . . . . . . c17360_2l7l 1 . 1 . 911 . 1 1 63 ILE C C -10.751 10.293 -6.849 . . . 1.0 . . . . . . . . . . . . A . 63 ILE C . . . . . . . . . c17360_2l7l 1 . 1 . 912 . 1 1 63 ILE CA C -11.133 9.231 -7.870 . . . 1.0 . . . . . . . . . . . . A . 63 ILE CA . . . . . . . . . c17360_2l7l 1 . 1 . 913 . 1 1 63 ILE CB C -10.477 7.893 -7.502 . . . 1.0 . . . . . . . . . . . . A . 63 ILE CB . . . . . . . . . c17360_2l7l 1 . 1 . 914 . 1 1 63 ILE CD1 C -8.241 6.794 -7.261 . . . 1.0 . . . . . . . . . . . . A . 63 ILE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 915 . 1 1 63 ILE CG1 C -9.018 7.901 -7.975 . . . 1.0 . . . . . . . . . . . . A . 63 ILE CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 916 . 1 1 63 ILE CG2 C -11.231 6.736 -8.172 . . . 1.0 . . . . . . . . . . . . A . 63 ILE CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 917 . 1 1 63 ILE H H -9.756 9.762 -9.398 . . . 1.0 . . . . . . . . . . . . A . 63 ILE H . . . . . . . . . c17360_2l7l 1 . 1 . 918 . 1 1 63 ILE HA H -12.206 9.110 -7.844 . . . 1.0 . . . . . . . . . . . . A . 63 ILE HA . . . . . . . . . c17360_2l7l 1 . 1 . 919 . 1 1 63 ILE HB H -10.508 7.760 -6.429 . . . 1.0 . . . . . . . . . . . . A . 63 ILE HB . . . . . . . . . c17360_2l7l 1 . 1 . 920 . 1 1 63 ILE HD11 H -7.195 6.872 -7.514 . . . 1.0 . . . . . . . . . . . . A . 63 ILE HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 921 . 1 1 63 ILE HD12 H -8.617 5.832 -7.570 . . . 1.0 . . . . . . . . . . . . A . 63 ILE HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 922 . 1 1 63 ILE HD13 H -8.360 6.902 -6.192 . . . 1.0 . . . . . . . . . . . . A . 63 ILE HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 923 . 1 1 63 ILE HG12 H -8.986 7.730 -9.042 . . . 1.0 . . . . . . . . . . . . A . 63 ILE HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 924 . 1 1 63 ILE HG13 H -8.571 8.853 -7.749 . . . 1.0 . . . . . . . . . . . . A . 63 ILE HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 925 . 1 1 63 ILE HG21 H -10.591 5.864 -8.216 . . . 1.0 . . . . . . . . . . . . A . 63 ILE HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 926 . 1 1 63 ILE HG22 H -11.520 7.022 -9.172 . . . 1.0 . . . . . . . . . . . . A . 63 ILE HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 927 . 1 1 63 ILE HG23 H -12.113 6.501 -7.596 . . . 1.0 . . . . . . . . . . . . A . 63 ILE HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 928 . 1 1 63 ILE N N -10.713 9.631 -9.216 . . . 1.0 . . . . . . . . . . . . A . 63 ILE N . . . . . . . . . c17360_2l7l 1 . 1 . 929 . 1 1 63 ILE O O -9.598 10.718 -6.775 . . . 1.0 . . . . . . . . . . . . A . 63 ILE O . . . . . . . . . c17360_2l7l 1 . 1 . 930 . 1 1 64 ASP C C -11.023 11.077 -3.743 . . . 1.0 . . . . . . . . . . . . A . 64 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 931 . 1 1 64 ASP CA C -11.493 11.734 -5.043 . . . 1.0 . . . . . . . . . . . . A . 64 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 932 . 1 1 64 ASP CB C -12.770 12.542 -4.804 . . . 1.0 . . . . . . . . . . . . A . 64 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 933 . 1 1 64 ASP CG C -13.229 13.189 -6.100 . . . 1.0 . . . . . . . . . . . . A . 64 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 934 . 1 1 64 ASP H H -12.632 10.346 -6.168 . . . 1.0 . . . . . . . . . . . . A . 64 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 935 . 1 1 64 ASP HA H -10.719 12.405 -5.391 . . . 1.0 . . . . . . . . . . . . A . 64 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 936 . 1 1 64 ASP HB2 H -13.551 11.892 -4.437 . . . 1.0 . . . . . . . . . . . . A . 64 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 937 . 1 1 64 ASP HB3 H -12.571 13.317 -4.080 . . . 1.0 . . . . . . . . . . . . A . 64 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 938 . 1 1 64 ASP N N -11.732 10.719 -6.061 . . . 1.0 . . . . . . . . . . . . A . 64 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 939 . 1 1 64 ASP O O -11.036 9.851 -3.616 . . . 1.0 . . . . . . . . . . . . A . 64 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 940 . 1 1 64 ASP OD1 O -12.388 13.421 -6.953 . . . 1.0 . . . . . . . . . . . . A . 64 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 941 . 1 1 64 ASP OD2 O -14.414 13.445 -6.222 . . . 1.0 . . . . . . . . . . . . A . 64 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 942 . 1 1 65 PHE C C -11.091 10.296 -0.977 . . . 1.0 . . . . . . . . . . . . A . 65 PHE C . . . . . . . . . c17360_2l7l 1 . 1 . 943 . 1 1 65 PHE CA C -10.129 11.377 -1.499 . . . 1.0 . . . . . . . . . . . . A . 65 PHE CA . . . . . . . . . c17360_2l7l 1 . 1 . 944 . 1 1 65 PHE CB C -9.949 12.528 -0.480 . . . 1.0 . . . . . . . . . . . . A . 65 PHE CB . . . . . . . . . c17360_2l7l 1 . 1 . 945 . 1 1 65 PHE CD1 C -8.838 11.136 1.275 . . . 1.0 . . . . . . . . . . . . A . 65 PHE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 946 . 1 1 65 PHE CD2 C -10.918 12.241 1.845 . . . 1.0 . . . . . . . . . . . . A . 65 PHE CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 947 . 1 1 65 PHE CE1 C -8.770 10.596 2.560 . . . 1.0 . . . . . . . . . . . . A . 65 PHE CE1 . . . . . . . . . c17360_2l7l 1 . 1 . 948 . 1 1 65 PHE CE2 C -10.852 11.699 3.135 . . . 1.0 . . . . . . . . . . . . A . 65 PHE CE2 . . . . . . . . . c17360_2l7l 1 . 1 . 949 . 1 1 65 PHE CG C -9.904 11.958 0.917 . . . 1.0 . . . . . . . . . . . . A . 65 PHE CG . . . . . . . . . c17360_2l7l 1 . 1 . 950 . 1 1 65 PHE CZ C -9.775 10.878 3.493 . . . 1.0 . . . . . . . . . . . . A . 65 PHE CZ . . . . . . . . . c17360_2l7l 1 . 1 . 951 . 1 1 65 PHE H H -10.619 12.865 -2.937 . . . 1.0 . . . . . . . . . . . . A . 65 PHE H . . . . . . . . . c17360_2l7l 1 . 1 . 952 . 1 1 65 PHE HA H -9.163 10.916 -1.658 . . . 1.0 . . . . . . . . . . . . A . 65 PHE HA . . . . . . . . . c17360_2l7l 1 . 1 . 953 . 1 1 65 PHE HB2 H -9.016 13.042 -0.681 . . . 1.0 . . . . . . . . . . . . A . 65 PHE HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 954 . 1 1 65 PHE HB3 H -10.754 13.234 -0.560 . . . 1.0 . . . . . . . . . . . . A . 65 PHE HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 955 . 1 1 65 PHE HD1 H -8.064 10.918 0.557 . . . 1.0 . . . . . . . . . . . . A . 65 PHE HD1 . . . . . . . . . c17360_2l7l 1 . 1 . 956 . 1 1 65 PHE HD2 H -11.750 12.872 1.567 . . . 1.0 . . . . . . . . . . . . A . 65 PHE HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 957 . 1 1 65 PHE HE1 H -7.942 9.959 2.833 . . . 1.0 . . . . . . . . . . . . A . 65 PHE HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 958 . 1 1 65 PHE HE2 H -11.629 11.916 3.855 . . . 1.0 . . . . . . . . . . . . A . 65 PHE HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 959 . 1 1 65 PHE HZ H -9.721 10.461 4.487 . . . 1.0 . . . . . . . . . . . . A . 65 PHE HZ . . . . . . . . . c17360_2l7l 1 . 1 . 960 . 1 1 65 PHE N N -10.604 11.899 -2.782 . . . 1.0 . . . . . . . . . . . . A . 65 PHE N . . . . . . . . . c17360_2l7l 1 . 1 . 961 . 1 1 65 PHE O O -10.673 9.173 -0.675 . . . 1.0 . . . . . . . . . . . . A . 65 PHE O . . . . . . . . . c17360_2l7l 1 . 1 . 962 . 1 1 66 PRO C C -13.293 8.288 -1.191 . . . 1.0 . . . . . . . . . . . . A . 66 PRO C . . . . . . . . . c17360_2l7l 1 . 1 . 963 . 1 1 66 PRO CA C -13.369 9.612 -0.405 . . . 1.0 . . . . . . . . . . . . A . 66 PRO CA . . . . . . . . . c17360_2l7l 1 . 1 . 964 . 1 1 66 PRO CB C -14.710 10.333 -0.670 . . . 1.0 . . . . . . . . . . . . A . 66 PRO CB . . . . . . . . . c17360_2l7l 1 . 1 . 965 . 1 1 66 PRO CD C -12.966 11.893 -1.206 . . . 1.0 . . . . . . . . . . . . A . 66 PRO CD . . . . . . . . . c17360_2l7l 1 . 1 . 966 . 1 1 66 PRO CG C -14.389 11.789 -0.697 . . . 1.0 . . . . . . . . . . . . A . 66 PRO CG . . . . . . . . . c17360_2l7l 1 . 1 . 967 . 1 1 66 PRO HA H -13.250 9.434 0.651 . . . 1.0 . . . . . . . . . . . . A . 66 PRO HA . . . . . . . . . c17360_2l7l 1 . 1 . 968 . 1 1 66 PRO HB2 H -15.118 10.029 -1.626 . . . 1.0 . . . . . . . . . . . . A . 66 PRO HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 969 . 1 1 66 PRO HB3 H -15.414 10.126 0.119 . . . 1.0 . . . . . . . . . . . . A . 66 PRO HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 970 . 1 1 66 PRO HD2 H -12.952 12.058 -2.266 . . . 1.0 . . . . . . . . . . . . A . 66 PRO HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 971 . 1 1 66 PRO HD3 H -12.479 12.680 -0.692 . . . 1.0 . . . . . . . . . . . . A . 66 PRO HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 972 . 1 1 66 PRO HG2 H -15.062 12.319 -1.362 . . . 1.0 . . . . . . . . . . . . A . 66 PRO HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 973 . 1 1 66 PRO HG3 H -14.449 12.207 0.300 . . . 1.0 . . . . . . . . . . . . A . 66 PRO HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 974 . 1 1 66 PRO N N -12.357 10.596 -0.880 . . . 1.0 . . . . . . . . . . . . A . 66 PRO N . . . . . . . . . c17360_2l7l 1 . 1 . 975 . 1 1 66 PRO O O -13.302 7.186 -0.617 . . . 1.0 . . . . . . . . . . . . A . 66 PRO O . . . . . . . . . c17360_2l7l 1 . 1 . 976 . 1 1 67 GLU C C -11.890 6.422 -3.048 . . . 1.0 . . . . . . . . . . . . A . 67 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 977 . 1 1 67 GLU CA C -13.149 7.226 -3.364 . . . 1.0 . . . . . . . . . . . . A . 67 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 978 . 1 1 67 GLU CB C -13.158 7.636 -4.837 . . . 1.0 . . . . . . . . . . . . A . 67 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 979 . 1 1 67 GLU CD C -14.577 8.616 -6.647 . . . 1.0 . . . . . . . . . . . . A . 67 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 980 . 1 1 67 GLU CG C -14.445 8.405 -5.147 . . . 1.0 . . . . . . . . . . . . A . 67 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 981 . 1 1 67 GLU H H -13.205 9.296 -2.919 . . . 1.0 . . . . . . . . . . . . A . 67 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 982 . 1 1 67 GLU HA H -14.018 6.612 -3.167 . . . 1.0 . . . . . . . . . . . . A . 67 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 983 . 1 1 67 GLU HB2 H -12.306 8.268 -5.039 . . . 1.0 . . . . . . . . . . . . A . 67 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 984 . 1 1 67 GLU HB3 H -13.110 6.757 -5.457 . . . 1.0 . . . . . . . . . . . . A . 67 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 985 . 1 1 67 GLU HG2 H -15.296 7.844 -4.787 . . . 1.0 . . . . . . . . . . . . A . 67 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 986 . 1 1 67 GLU HG3 H -14.416 9.365 -4.653 . . . 1.0 . . . . . . . . . . . . A . 67 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 987 . 1 1 67 GLU N N -13.215 8.405 -2.512 . . . 1.0 . . . . . . . . . . . . A . 67 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 988 . 1 1 67 GLU O O -11.893 5.192 -3.103 . . . 1.0 . . . . . . . . . . . . A . 67 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 989 . 1 1 67 GLU OE1 O -14.054 7.799 -7.385 . . . 1.0 . . . . . . . . . . . . A . 67 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 990 . 1 1 67 GLU OE2 O -15.190 9.597 -7.033 . . . 1.0 . . . . . . . . . . . . A . 67 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 991 . 1 1 68 PHE C C -9.801 5.506 -1.200 . . . 1.0 . . . . . . . . . . . . A . 68 PHE C . . . . . . . . . c17360_2l7l 1 . 1 . 992 . 1 1 68 PHE CA C -9.567 6.457 -2.371 . . . 1.0 . . . . . . . . . . . . A . 68 PHE CA . . . . . . . . . c17360_2l7l 1 . 1 . 993 . 1 1 68 PHE CB C -8.502 7.494 -2.008 . . . 1.0 . . . . . . . . . . . . A . 68 PHE CB . . . . . . . . . c17360_2l7l 1 . 1 . 994 . 1 1 68 PHE CD1 C -6.471 6.365 -2.967 . . . 1.0 . . . . . . . . . . . . A . 68 PHE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 995 . 1 1 68 PHE CD2 C -6.633 6.628 -0.562 . . . 1.0 . . . . . . . . . . . . A . 68 PHE CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 996 . 1 1 68 PHE CE1 C -5.232 5.734 -2.813 . . . 1.0 . . . . . . . . . . . . A . 68 PHE CE1 . . . . . . . . . c17360_2l7l 1 . 1 . 997 . 1 1 68 PHE CE2 C -5.395 5.997 -0.408 . . . 1.0 . . . . . . . . . . . . A . 68 PHE CE2 . . . . . . . . . c17360_2l7l 1 . 1 . 998 . 1 1 68 PHE CG C -7.170 6.812 -1.840 . . . 1.0 . . . . . . . . . . . . A . 68 PHE CG . . . . . . . . . c17360_2l7l 1 . 1 . 999 . 1 1 68 PHE CZ C -4.695 5.550 -1.533 . . . 1.0 . . . . . . . . . . . . A . 68 PHE CZ . . . . . . . . . c17360_2l7l 1 . 1 . 1000 . 1 1 68 PHE H H -10.873 8.100 -2.663 . . . 1.0 . . . . . . . . . . . . A . 68 PHE H . . . . . . . . . c17360_2l7l 1 . 1 . 1001 . 1 1 68 PHE HA H -9.234 5.886 -3.226 . . . 1.0 . . . . . . . . . . . . A . 68 PHE HA . . . . . . . . . c17360_2l7l 1 . 1 . 1002 . 1 1 68 PHE HB2 H -8.436 8.228 -2.795 . . . 1.0 . . . . . . . . . . . . A . 68 PHE HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1003 . 1 1 68 PHE HB3 H -8.773 7.980 -1.085 . . . 1.0 . . . . . . . . . . . . A . 68 PHE HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1004 . 1 1 68 PHE HD1 H -6.885 6.507 -3.954 . . . 1.0 . . . . . . . . . . . . A . 68 PHE HD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1005 . 1 1 68 PHE HD2 H -7.173 6.976 0.307 . . . 1.0 . . . . . . . . . . . . A . 68 PHE HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1006 . 1 1 68 PHE HE1 H -4.690 5.388 -3.681 . . . 1.0 . . . . . . . . . . . . A . 68 PHE HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1007 . 1 1 68 PHE HE2 H -4.981 5.856 0.579 . . . 1.0 . . . . . . . . . . . . A . 68 PHE HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1008 . 1 1 68 PHE HZ H -3.742 5.061 -1.414 . . . 1.0 . . . . . . . . . . . . A . 68 PHE HZ . . . . . . . . . c17360_2l7l 1 . 1 . 1009 . 1 1 68 PHE N N -10.817 7.124 -2.702 . . . 1.0 . . . . . . . . . . . . A . 68 PHE N . . . . . . . . . c17360_2l7l 1 . 1 . 1010 . 1 1 68 PHE O O -9.357 4.356 -1.218 . . . 1.0 . . . . . . . . . . . . A . 68 PHE O . . . . . . . . . c17360_2l7l 1 . 1 . 1011 . 1 1 69 LEU C C -11.525 3.928 0.575 . . . 1.0 . . . . . . . . . . . . A . 69 LEU C . . . . . . . . . c17360_2l7l 1 . 1 . 1012 . 1 1 69 LEU CA C -10.784 5.188 0.999 . . . 1.0 . . . . . . . . . . . . A . 69 LEU CA . . . . . . . . . c17360_2l7l 1 . 1 . 1013 . 1 1 69 LEU CB C -11.654 5.977 1.981 . . . 1.0 . . . . . . . . . . . . A . 69 LEU CB . . . . . . . . . c17360_2l7l 1 . 1 . 1014 . 1 1 69 LEU CD1 C -11.977 8.193 3.100 . . . 1.0 . . . . . . . . . . . . A . 69 LEU CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1015 . 1 1 69 LEU CD2 C -9.682 7.224 2.898 . . . 1.0 . . . . . . . . . . . . A . 69 LEU CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1016 . 1 1 69 LEU CG C -11.044 7.364 2.215 . . . 1.0 . . . . . . . . . . . . A . 69 LEU CG . . . . . . . . . c17360_2l7l 1 . 1 . 1017 . 1 1 69 LEU H H -10.800 6.934 -0.208 . . . 1.0 . . . . . . . . . . . . A . 69 LEU H . . . . . . . . . c17360_2l7l 1 . 1 . 1018 . 1 1 69 LEU HA H -9.863 4.906 1.477 . . . 1.0 . . . . . . . . . . . . A . 69 LEU HA . . . . . . . . . c17360_2l7l 1 . 1 . 1019 . 1 1 69 LEU HB2 H -12.648 6.083 1.573 . . . 1.0 . . . . . . . . . . . . A . 69 LEU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1020 . 1 1 69 LEU HB3 H -11.706 5.446 2.921 . . . 1.0 . . . . . . . . . . . . A . 69 LEU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1021 . 1 1 69 LEU HD11 H -12.999 8.053 2.779 . . . 1.0 . . . . . . . . . . . . A . 69 LEU HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 1022 . 1 1 69 LEU HD12 H -11.716 9.236 3.013 . . . 1.0 . . . . . . . . . . . . A . 69 LEU HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 1023 . 1 1 69 LEU HD13 H -11.876 7.881 4.129 . . . 1.0 . . . . . . . . . . . . A . 69 LEU HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 1024 . 1 1 69 LEU HD21 H -9.756 6.505 3.699 . . . 1.0 . . . . . . . . . . . . A . 69 LEU HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 1025 . 1 1 69 LEU HD22 H -9.380 8.179 3.300 . . . 1.0 . . . . . . . . . . . . A . 69 LEU HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 1026 . 1 1 69 LEU HD23 H -8.949 6.891 2.178 . . . 1.0 . . . . . . . . . . . . A . 69 LEU HD23 . . . . . . . . . c17360_2l7l 1 . 1 . 1027 . 1 1 69 LEU HG H -10.921 7.866 1.267 . . . 1.0 . . . . . . . . . . . . A . 69 LEU HG . . . . . . . . . c17360_2l7l 1 . 1 . 1028 . 1 1 69 LEU N N -10.499 5.999 -0.181 . . . 1.0 . . . . . . . . . . . . A . 69 LEU N . . . . . . . . . c17360_2l7l 1 . 1 . 1029 . 1 1 69 LEU O O -11.356 2.862 1.172 . . . 1.0 . . . . . . . . . . . . A . 69 LEU O . . . . . . . . . c17360_2l7l 1 . 1 . 1030 . 1 1 70 THR C C -12.141 1.829 -1.504 . . . 1.0 . . . . . . . . . . . . A . 70 THR C . . . . . . . . . c17360_2l7l 1 . 1 . 1031 . 1 1 70 THR CA C -13.094 2.903 -0.968 . . . 1.0 . . . . . . . . . . . . A . 70 THR CA . . . . . . . . . c17360_2l7l 1 . 1 . 1032 . 1 1 70 THR CB C -14.042 3.335 -2.085 . . . 1.0 . . . . . . . . . . . . A . 70 THR CB . . . . . . . . . c17360_2l7l 1 . 1 . 1033 . 1 1 70 THR CG2 C -15.057 2.223 -2.360 . . . 1.0 . . . . . . . . . . . . A . 70 THR CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1034 . 1 1 70 THR H H -12.430 4.934 -0.907 . . . 1.0 . . . . . . . . . . . . A . 70 THR H . . . . . . . . . c17360_2l7l 1 . 1 . 1035 . 1 1 70 THR HA H -13.673 2.485 -0.160 . . . 1.0 . . . . . . . . . . . . A . 70 THR HA . . . . . . . . . c17360_2l7l 1 . 1 . 1036 . 1 1 70 THR HB H -13.478 3.527 -2.982 . . . 1.0 . . . . . . . . . . . . A . 70 THR HB . . . . . . . . . c17360_2l7l 1 . 1 . 1037 . 1 1 70 THR HG1 H -14.149 5.258 -1.854 . . . 1.0 . . . . . . . . . . . . A . 70 THR HG1 . . . . . . . . . c17360_2l7l 1 . 1 . 1038 . 1 1 70 THR HG21 H -14.540 1.342 -2.708 . . . 1.0 . . . . . . . . . . . . A . 70 THR HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 1039 . 1 1 70 THR HG22 H -15.752 2.555 -3.116 . . . 1.0 . . . . . . . . . . . . A . 70 THR HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 1040 . 1 1 70 THR HG23 H -15.594 1.993 -1.452 . . . 1.0 . . . . . . . . . . . . A . 70 THR HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 1041 . 1 1 70 THR N N -12.343 4.055 -0.467 . . . 1.0 . . . . . . . . . . . . A . 70 THR N . . . . . . . . . c17360_2l7l 1 . 1 . 1042 . 1 1 70 THR O O -12.264 0.656 -1.167 . . . 1.0 . . . . . . . . . . . . A . 70 THR O . . . . . . . . . c17360_2l7l 1 . 1 . 1043 . 1 1 70 THR OG1 O -14.726 4.511 -1.687 . . . 1.0 . . . . . . . . . . . . A . 70 THR OG1 . . . . . . . . . c17360_2l7l 1 . 1 . 1044 . 1 1 71 MET C C -9.492 0.528 -1.809 . . . 1.0 . . . . . . . . . . . . A . 71 MET C . . . . . . . . . c17360_2l7l 1 . 1 . 1045 . 1 1 71 MET CA C -10.230 1.288 -2.918 . . . 1.0 . . . . . . . . . . . . A . 71 MET CA . . . . . . . . . c17360_2l7l 1 . 1 . 1046 . 1 1 71 MET CB C -9.214 2.055 -3.767 . . . 1.0 . . . . . . . . . . . . A . 71 MET CB . . . . . . . . . c17360_2l7l 1 . 1 . 1047 . 1 1 71 MET CE C -5.836 1.525 -3.846 . . . 1.0 . . . . . . . . . . . . A . 71 MET CE . . . . . . . . . c17360_2l7l 1 . 1 . 1048 . 1 1 71 MET CG C -8.404 1.068 -4.607 . . . 1.0 . . . . . . . . . . . . A . 71 MET CG . . . . . . . . . c17360_2l7l 1 . 1 . 1049 . 1 1 71 MET H H -11.130 3.190 -2.579 . . . 1.0 . . . . . . . . . . . . A . 71 MET H . . . . . . . . . c17360_2l7l 1 . 1 . 1050 . 1 1 71 MET HA H -10.738 0.581 -3.555 . . . 1.0 . . . . . . . . . . . . A . 71 MET HA . . . . . . . . . c17360_2l7l 1 . 1 . 1051 . 1 1 71 MET HB2 H -9.738 2.739 -4.423 . . . 1.0 . . . . . . . . . . . . A . 71 MET HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1052 . 1 1 71 MET HB3 H -8.548 2.612 -3.126 . . . 1.0 . . . . . . . . . . . . A . 71 MET HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1053 . 1 1 71 MET HE1 H -6.422 1.402 -2.944 . . . 1.0 . . . . . . . . . . . . A . 71 MET HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1054 . 1 1 71 MET HE2 H -5.136 2.332 -3.707 . . . 1.0 . . . . . . . . . . . . A . 71 MET HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1055 . 1 1 71 MET HE3 H -5.294 0.617 -4.055 . . . 1.0 . . . . . . . . . . . . A . 71 MET HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 1056 . 1 1 71 MET HG2 H -8.114 0.225 -3.999 . . . 1.0 . . . . . . . . . . . . A . 71 MET HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1057 . 1 1 71 MET HG3 H -9.007 0.723 -5.435 . . . 1.0 . . . . . . . . . . . . A . 71 MET HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1058 . 1 1 71 MET N N -11.189 2.238 -2.341 . . . 1.0 . . . . . . . . . . . . A . 71 MET N . . . . . . . . . c17360_2l7l 1 . 1 . 1059 . 1 1 71 MET O O -9.439 -0.717 -1.796 . . . 1.0 . . . . . . . . . . . . A . 71 MET O . . . . . . . . . c17360_2l7l 1 . 1 . 1060 . 1 1 71 MET SD S -6.929 1.899 -5.243 . . . 1.0 . . . . . . . . . . . . A . 71 MET SD . . . . . . . . . c17360_2l7l 1 . 1 . 1061 . 1 1 72 MET C C -9.130 -0.125 1.122 . . . 1.0 . . . . . . . . . . . . A . 72 MET C . . . . . . . . . c17360_2l7l 1 . 1 . 1062 . 1 1 72 MET CA C -8.194 0.674 0.225 . . . 1.0 . . . . . . . . . . . . A . 72 MET CA . . . . . . . . . c17360_2l7l 1 . 1 . 1063 . 1 1 72 MET CB C -7.499 1.762 1.047 . . . 1.0 . . . . . . . . . . . . A . 72 MET CB . . . . . . . . . c17360_2l7l 1 . 1 . 1064 . 1 1 72 MET CE C -4.802 0.063 -0.269 . . . 1.0 . . . . . . . . . . . . A . 72 MET CE . . . . . . . . . c17360_2l7l 1 . 1 . 1065 . 1 1 72 MET CG C -6.285 2.326 0.277 . . . 1.0 . . . . . . . . . . . . A . 72 MET CG . . . . . . . . . c17360_2l7l 1 . 1 . 1066 . 1 1 72 MET H H -9.003 2.256 -0.924 . . . 1.0 . . . . . . . . . . . . A . 72 MET H . . . . . . . . . c17360_2l7l 1 . 1 . 1067 . 1 1 72 MET HA H -7.446 0.013 -0.179 . . . 1.0 . . . . . . . . . . . . A . 72 MET HA . . . . . . . . . c17360_2l7l 1 . 1 . 1068 . 1 1 72 MET HB2 H -8.202 2.558 1.254 . . . 1.0 . . . . . . . . . . . . A . 72 MET HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1069 . 1 1 72 MET HB3 H -7.161 1.335 1.975 . . . 1.0 . . . . . . . . . . . . A . 72 MET HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1070 . 1 1 72 MET HE1 H -5.331 0.302 -1.175 . . . 1.0 . . . . . . . . . . . . A . 72 MET HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1071 . 1 1 72 MET HE2 H -5.294 -0.756 0.229 . . . 1.0 . . . . . . . . . . . . A . 72 MET HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1072 . 1 1 72 MET HE3 H -3.788 -0.228 -0.509 . . . 1.0 . . . . . . . . . . . . A . 72 MET HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 1073 . 1 1 72 MET HG2 H -6.418 2.177 -0.781 . . . 1.0 . . . . . . . . . . . . A . 72 MET HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1074 . 1 1 72 MET HG3 H -6.201 3.389 0.470 . . . 1.0 . . . . . . . . . . . . A . 72 MET HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1075 . 1 1 72 MET N N -8.927 1.280 -0.874 . . . 1.0 . . . . . . . . . . . . A . 72 MET N . . . . . . . . . c17360_2l7l 1 . 1 . 1076 . 1 1 72 MET O O -8.748 -1.161 1.662 . . . 1.0 . . . . . . . . . . . . A . 72 MET O . . . . . . . . . c17360_2l7l 1 . 1 . 1077 . 1 1 72 MET SD S -4.761 1.508 0.829 . . . 1.0 . . . . . . . . . . . . A . 72 MET SD . . . . . . . . . c17360_2l7l 1 . 1 . 1078 . 1 1 73 ALA C C -11.735 -1.651 1.501 . . . 1.0 . . . . . . . . . . . . A . 73 ALA C . . . . . . . . . c17360_2l7l 1 . 1 . 1079 . 1 1 73 ALA CA C -11.333 -0.314 2.113 . . . 1.0 . . . . . . . . . . . . A . 73 ALA CA . . . . . . . . . c17360_2l7l 1 . 1 . 1080 . 1 1 73 ALA CB C -12.571 0.563 2.277 . . . 1.0 . . . . . . . . . . . . A . 73 ALA CB . . . . . . . . . c17360_2l7l 1 . 1 . 1081 . 1 1 73 ALA H H -10.604 1.193 0.818 . . . 1.0 . . . . . . . . . . . . A . 73 ALA H . . . . . . . . . c17360_2l7l 1 . 1 . 1082 . 1 1 73 ALA HA H -10.900 -0.486 3.085 . . . 1.0 . . . . . . . . . . . . A . 73 ALA HA . . . . . . . . . c17360_2l7l 1 . 1 . 1083 . 1 1 73 ALA HB1 H -12.948 0.836 1.305 . . . 1.0 . . . . . . . . . . . . A . 73 ALA HB1 . . . . . . . . . c17360_2l7l 1 . 1 . 1084 . 1 1 73 ALA HB2 H -12.309 1.457 2.825 . . . 1.0 . . . . . . . . . . . . A . 73 ALA HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1085 . 1 1 73 ALA HB3 H -13.330 0.017 2.818 . . . 1.0 . . . . . . . . . . . . A . 73 ALA HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1086 . 1 1 73 ALA N N -10.355 0.362 1.275 . . . 1.0 . . . . . . . . . . . . A . 73 ALA N . . . . . . . . . c17360_2l7l 1 . 1 . 1087 . 1 1 73 ALA O O -11.980 -2.624 2.216 . . . 1.0 . . . . . . . . . . . . A . 73 ALA O . . . . . . . . . c17360_2l7l 1 . 1 . 1088 . 1 1 74 ARG C C -11.169 -4.025 -0.216 . . . 1.0 . . . . . . . . . . . . A . 74 ARG C . . . . . . . . . c17360_2l7l 1 . 1 . 1089 . 1 1 74 ARG CA C -12.167 -2.924 -0.521 . . . 1.0 . . . . . . . . . . . . A . 74 ARG CA . . . . . . . . . c17360_2l7l 1 . 1 . 1090 . 1 1 74 ARG CB C -12.210 -2.672 -2.034 . . . 1.0 . . . . . . . . . . . . A . 74 ARG CB . . . . . . . . . c17360_2l7l 1 . 1 . 1091 . 1 1 74 ARG CD C -13.433 -1.483 -3.857 . . . 1.0 . . . . . . . . . . . . A . 74 ARG CD . . . . . . . . . c17360_2l7l 1 . 1 . 1092 . 1 1 74 ARG CG C -13.500 -1.936 -2.399 . . . 1.0 . . . . . . . . . . . . A . 74 ARG CG . . . . . . . . . c17360_2l7l 1 . 1 . 1093 . 1 1 74 ARG CZ C -14.405 -3.293 -5.159 . . . 1.0 . . . . . . . . . . . . A . 74 ARG CZ . . . . . . . . . c17360_2l7l 1 . 1 . 1094 . 1 1 74 ARG H H -11.585 -0.893 -0.348 . . . 1.0 . . . . . . . . . . . . A . 74 ARG H . . . . . . . . . c17360_2l7l 1 . 1 . 1095 . 1 1 74 ARG HA H -13.146 -3.236 -0.189 . . . 1.0 . . . . . . . . . . . . A . 74 ARG HA . . . . . . . . . c17360_2l7l 1 . 1 . 1096 . 1 1 74 ARG HB2 H -11.361 -2.069 -2.318 . . . 1.0 . . . . . . . . . . . . A . 74 ARG HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1097 . 1 1 74 ARG HB3 H -12.175 -3.614 -2.563 . . . 1.0 . . . . . . . . . . . . A . 74 ARG HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1098 . 1 1 74 ARG HD2 H -14.326 -0.928 -4.100 . . . 1.0 . . . . . . . . . . . . A . 74 ARG HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1099 . 1 1 74 ARG HD3 H -12.571 -0.846 -3.992 . . . 1.0 . . . . . . . . . . . . A . 74 ARG HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 1100 . 1 1 74 ARG HE H -12.439 -2.942 -5.031 . . . 1.0 . . . . . . . . . . . . A . 74 ARG HE . . . . . . . . . c17360_2l7l 1 . 1 . 1101 . 1 1 74 ARG HG2 H -14.338 -2.606 -2.271 . . . 1.0 . . . . . . . . . . . . A . 74 ARG HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1102 . 1 1 74 ARG HG3 H -13.626 -1.081 -1.760 . . . 1.0 . . . . . . . . . . . . A . 74 ARG HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1103 . 1 1 74 ARG HH11 H -15.685 -2.115 -4.170 . . . 1.0 . . . . . . . . . . . . A . 74 ARG HH11 . . . . . . . . . c17360_2l7l 1 . 1 . 1104 . 1 1 74 ARG HH12 H -16.402 -3.392 -5.093 . . . 1.0 . . . . . . . . . . . . A . 74 ARG HH12 . . . . . . . . . c17360_2l7l 1 . 1 . 1105 . 1 1 74 ARG HH21 H -13.369 -4.620 -6.243 . . . 1.0 . . . . . . . . . . . . A . 74 ARG HH21 . . . . . . . . . c17360_2l7l 1 . 1 . 1106 . 1 1 74 ARG HH22 H -15.091 -4.812 -6.267 . . . 1.0 . . . . . . . . . . . . A . 74 ARG HH22 . . . . . . . . . c17360_2l7l 1 . 1 . 1107 . 1 1 74 ARG N N -11.796 -1.696 0.172 . . . 1.0 . . . . . . . . . . . . A . 74 ARG N . . . . . . . . . c17360_2l7l 1 . 1 . 1108 . 1 1 74 ARG NE N -13.325 -2.641 -4.740 . . . 1.0 . . . . . . . . . . . . A . 74 ARG NE . . . . . . . . . c17360_2l7l 1 . 1 . 1109 . 1 1 74 ARG NH1 N -15.590 -2.903 -4.778 . . . 1.0 . . . . . . . . . . . . A . 74 ARG NH1 . . . . . . . . . c17360_2l7l 1 . 1 . 1110 . 1 1 74 ARG NH2 N -14.278 -4.322 -5.952 . . . 1.0 . . . . . . . . . . . . A . 74 ARG NH2 . . . . . . . . . c17360_2l7l 1 . 1 . 1111 . 1 1 74 ARG O O -11.552 -5.153 0.091 . . . 1.0 . . . . . . . . . . . . A . 74 ARG O . . . . . . . . . c17360_2l7l 1 . 1 . 1112 . 1 1 75 LYS C C -8.699 -4.910 1.485 . . . 1.0 . . . . . . . . . . . . A . 75 LYS C . . . . . . . . . c17360_2l7l 1 . 1 . 1113 . 1 1 75 LYS CA C -8.856 -4.689 -0.014 . . . 1.0 . . . . . . . . . . . . A . 75 LYS CA . . . . . . . . . c17360_2l7l 1 . 1 . 1114 . 1 1 75 LYS CB C -7.518 -4.238 -0.604 . . . 1.0 . . . . . . . . . . . . A . 75 LYS CB . . . . . . . . . c17360_2l7l 1 . 1 . 1115 . 1 1 75 LYS CD C -6.767 -6.637 -0.626 . . . 1.0 . . . . . . . . . . . . A . 75 LYS CD . . . . . . . . . c17360_2l7l 1 . 1 . 1116 . 1 1 75 LYS CE C -5.518 -7.503 -0.687 . . . 1.0 . . . . . . . . . . . . A . 75 LYS CE . . . . . . . . . c17360_2l7l 1 . 1 . 1117 . 1 1 75 LYS CG C -6.395 -5.212 -0.196 . . . 1.0 . . . . . . . . . . . . A . 75 LYS CG . . . . . . . . . c17360_2l7l 1 . 1 . 1118 . 1 1 75 LYS H H -9.634 -2.774 -0.551 . . . 1.0 . . . . . . . . . . . . A . 75 LYS H . . . . . . . . . c17360_2l7l 1 . 1 . 1119 . 1 1 75 LYS HA H -9.140 -5.620 -0.477 . . . 1.0 . . . . . . . . . . . . A . 75 LYS HA . . . . . . . . . c17360_2l7l 1 . 1 . 1120 . 1 1 75 LYS HB2 H -7.597 -4.217 -1.680 . . . 1.0 . . . . . . . . . . . . A . 75 LYS HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1121 . 1 1 75 LYS HB3 H -7.282 -3.249 -0.243 . . . 1.0 . . . . . . . . . . . . A . 75 LYS HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1122 . 1 1 75 LYS HD2 H -7.450 -7.062 0.095 . . . 1.0 . . . . . . . . . . . . A . 75 LYS HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1123 . 1 1 75 LYS HD3 H -7.235 -6.612 -1.591 . . . 1.0 . . . . . . . . . . . . A . 75 LYS HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 1124 . 1 1 75 LYS HE2 H -4.821 -7.070 -1.380 . . . 1.0 . . . . . . . . . . . . A . 75 LYS HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1125 . 1 1 75 LYS HE3 H -5.072 -7.555 0.291 . . . 1.0 . . . . . . . . . . . . A . 75 LYS HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 1126 . 1 1 75 LYS HG2 H -5.475 -4.917 -0.676 . . . 1.0 . . . . . . . . . . . . A . 75 LYS HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1127 . 1 1 75 LYS HG3 H -6.255 -5.185 0.875 . . . 1.0 . . . . . . . . . . . . A . 75 LYS HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1128 . 1 1 75 LYS HZ1 H -6.793 -8.839 -1.646 . . . 1.0 . . . . . . . . . . . . A . 75 LYS HZ1 . . . . . . . . . c17360_2l7l 1 . 1 . 1129 . 1 1 75 LYS HZ2 H -5.966 -9.497 -0.315 . . . 1.0 . . . . . . . . . . . . A . 75 LYS HZ2 . . . . . . . . . c17360_2l7l 1 . 1 . 1130 . 1 1 75 LYS HZ3 H -5.148 -9.231 -1.780 . . . 1.0 . . . . . . . . . . . . A . 75 LYS HZ3 . . . . . . . . . c17360_2l7l 1 . 1 . 1131 . 1 1 75 LYS N N -9.889 -3.696 -0.298 . . . 1.0 . . . . . . . . . . . . A . 75 LYS N . . . . . . . . . c17360_2l7l 1 . 1 . 1132 . 1 1 75 LYS NZ N -5.885 -8.871 -1.142 . . . 1.0 . . . . . . . . . . . . A . 75 LYS NZ . . . . . . . . . c17360_2l7l 1 . 1 . 1133 . 1 1 75 LYS O O -8.397 -6.015 1.939 . . . 1.0 . . . . . . . . . . . . A . 75 LYS O . . . . . . . . . c17360_2l7l 1 . 1 . 1134 . 1 1 76 MET C C -9.729 -4.917 4.272 . . . 1.0 . . . . . . . . . . . . A . 76 MET C . . . . . . . . . c17360_2l7l 1 . 1 . 1135 . 1 1 76 MET CA C -8.729 -3.933 3.686 . . . 1.0 . . . . . . . . . . . . A . 76 MET CA . . . . . . . . . c17360_2l7l 1 . 1 . 1136 . 1 1 76 MET CB C -8.915 -2.558 4.321 . . . 1.0 . . . . . . . . . . . . A . 76 MET CB . . . . . . . . . c17360_2l7l 1 . 1 . 1137 . 1 1 76 MET CE C -6.060 -1.620 5.581 . . . 1.0 . . . . . . . . . . . . A . 76 MET CE . . . . . . . . . c17360_2l7l 1 . 1 . 1138 . 1 1 76 MET CG C -8.592 -2.620 5.819 . . . 1.0 . . . . . . . . . . . . A . 76 MET CG . . . . . . . . . c17360_2l7l 1 . 1 . 1139 . 1 1 76 MET H H -9.119 -2.996 1.830 . . . 1.0 . . . . . . . . . . . . A . 76 MET H . . . . . . . . . c17360_2l7l 1 . 1 . 1140 . 1 1 76 MET HA H -7.732 -4.281 3.892 . . . 1.0 . . . . . . . . . . . . A . 76 MET HA . . . . . . . . . c17360_2l7l 1 . 1 . 1141 . 1 1 76 MET HB2 H -8.268 -1.845 3.839 . . . 1.0 . . . . . . . . . . . . A . 76 MET HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1142 . 1 1 76 MET HB3 H -9.940 -2.251 4.198 . . . 1.0 . . . . . . . . . . . . A . 76 MET HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1143 . 1 1 76 MET HE1 H -6.541 -0.789 6.078 . . . 1.0 . . . . . . . . . . . . A . 76 MET HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1144 . 1 1 76 MET HE2 H -6.134 -1.494 4.511 . . . 1.0 . . . . . . . . . . . . A . 76 MET HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1145 . 1 1 76 MET HE3 H -5.017 -1.659 5.863 . . . 1.0 . . . . . . . . . . . . A . 76 MET HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 1146 . 1 1 76 MET HG2 H -8.724 -1.639 6.247 . . . 1.0 . . . . . . . . . . . . A . 76 MET HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1147 . 1 1 76 MET HG3 H -9.263 -3.314 6.302 . . . 1.0 . . . . . . . . . . . . A . 76 MET HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1148 . 1 1 76 MET N N -8.884 -3.851 2.246 . . . 1.0 . . . . . . . . . . . . A . 76 MET N . . . . . . . . . c17360_2l7l 1 . 1 . 1149 . 1 1 76 MET O O -9.469 -5.563 5.285 . . . 1.0 . . . . . . . . . . . . A . 76 MET O . . . . . . . . . c17360_2l7l 1 . 1 . 1150 . 1 1 76 MET SD S -6.876 -3.155 6.079 . . . 1.0 . . . . . . . . . . . . A . 76 MET SD . . . . . . . . . c17360_2l7l 1 . 1 . 1151 . 1 1 77 LYS C C -11.437 -7.360 4.082 . . . 1.0 . . . . . . . . . . . . A . 77 LYS C . . . . . . . . . c17360_2l7l 1 . 1 . 1152 . 1 1 77 LYS CA C -11.915 -5.913 4.134 . . . 1.0 . . . . . . . . . . . . A . 77 LYS CA . . . . . . . . . c17360_2l7l 1 . 1 . 1153 . 1 1 77 LYS CB C -13.171 -5.771 3.274 . . . 1.0 . . . . . . . . . . . . A . 77 LYS CB . . . . . . . . . c17360_2l7l 1 . 1 . 1154 . 1 1 77 LYS CD C -14.726 -6.189 5.208 . . . 1.0 . . . . . . . . . . . . A . 77 LYS CD . . . . . . . . . c17360_2l7l 1 . 1 . 1155 . 1 1 77 LYS CE C -16.129 -6.696 5.516 . . . 1.0 . . . . . . . . . . . . A . 77 LYS CE . . . . . . . . . c17360_2l7l 1 . 1 . 1156 . 1 1 77 LYS CG C -14.296 -6.669 3.813 . . . 1.0 . . . . . . . . . . . . A . 77 LYS CG . . . . . . . . . c17360_2l7l 1 . 1 . 1157 . 1 1 77 LYS H H -11.055 -4.461 2.850 . . . 1.0 . . . . . . . . . . . . A . 77 LYS H . . . . . . . . . c17360_2l7l 1 . 1 . 1158 . 1 1 77 LYS HA H -12.149 -5.650 5.149 . . . 1.0 . . . . . . . . . . . . A . 77 LYS HA . . . . . . . . . c17360_2l7l 1 . 1 . 1159 . 1 1 77 LYS HB2 H -13.499 -4.741 3.288 . . . 1.0 . . . . . . . . . . . . A . 77 LYS HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1160 . 1 1 77 LYS HB3 H -12.942 -6.060 2.259 . . . 1.0 . . . . . . . . . . . . A . 77 LYS HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1161 . 1 1 77 LYS HD2 H -14.046 -6.580 5.950 . . . 1.0 . . . . . . . . . . . . A . 77 LYS HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1162 . 1 1 77 LYS HD3 H -14.721 -5.110 5.244 . . . 1.0 . . . . . . . . . . . . A . 77 LYS HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 1163 . 1 1 77 LYS HE2 H -16.147 -7.773 5.434 . . . 1.0 . . . . . . . . . . . . A . 77 LYS HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1164 . 1 1 77 LYS HE3 H -16.406 -6.404 6.517 . . . 1.0 . . . . . . . . . . . . A . 77 LYS HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 1165 . 1 1 77 LYS HG2 H -15.139 -6.626 3.137 . . . 1.0 . . . . . . . . . . . . A . 77 LYS HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1166 . 1 1 77 LYS HG3 H -13.949 -7.690 3.880 . . . 1.0 . . . . . . . . . . . . A . 77 LYS HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1167 . 1 1 77 LYS HZ1 H -16.626 -5.317 4.039 . . . 1.0 . . . . . . . . . . . . A . 77 LYS HZ1 . . . . . . . . . c17360_2l7l 1 . 1 . 1168 . 1 1 77 LYS HZ2 H -17.923 -5.750 5.047 . . . 1.0 . . . . . . . . . . . . A . 77 LYS HZ2 . . . . . . . . . c17360_2l7l 1 . 1 . 1169 . 1 1 77 LYS HZ3 H -17.374 -6.827 3.854 . . . 1.0 . . . . . . . . . . . . A . 77 LYS HZ3 . . . . . . . . . c17360_2l7l 1 . 1 . 1170 . 1 1 77 LYS N N -10.887 -5.013 3.645 . . . 1.0 . . . . . . . . . . . . A . 77 LYS N . . . . . . . . . c17360_2l7l 1 . 1 . 1171 . 1 1 77 LYS NZ N -17.085 -6.104 4.540 . . . 1.0 . . . . . . . . . . . . A . 77 LYS NZ . . . . . . . . . c17360_2l7l 1 . 1 . 1172 . 1 1 77 LYS O O -11.570 -8.103 5.054 . . . 1.0 . . . . . . . . . . . . A . 77 LYS O . . . . . . . . . c17360_2l7l 1 . 1 . 1173 . 1 1 78 ASP C C -8.905 -9.196 2.988 . . . 1.0 . . . . . . . . . . . . A . 78 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 1174 . 1 1 78 ASP CA C -10.405 -9.128 2.758 . . . 1.0 . . . . . . . . . . . . A . 78 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 1175 . 1 1 78 ASP CB C -10.734 -9.623 1.349 . . . 1.0 . . . . . . . . . . . . A . 78 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 1176 . 1 1 78 ASP CG C -10.168 -8.661 0.311 . . . 1.0 . . . . . . . . . . . . A . 78 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 1177 . 1 1 78 ASP H H -10.816 -7.126 2.194 . . . 1.0 . . . . . . . . . . . . A . 78 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 1178 . 1 1 78 ASP HA H -10.896 -9.779 3.473 . . . 1.0 . . . . . . . . . . . . A . 78 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 1179 . 1 1 78 ASP HB2 H -10.301 -10.601 1.204 . . . 1.0 . . . . . . . . . . . . A . 78 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1180 . 1 1 78 ASP HB3 H -11.806 -9.684 1.232 . . . 1.0 . . . . . . . . . . . . A . 78 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1181 . 1 1 78 ASP N N -10.890 -7.761 2.938 . . . 1.0 . . . . . . . . . . . . A . 78 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 1182 . 1 1 78 ASP O O -8.221 -10.061 2.440 . . . 1.0 . . . . . . . . . . . . A . 78 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 1183 . 1 1 78 ASP OD1 O -9.661 -7.625 0.709 . . . 1.0 . . . . . . . . . . . . A . 78 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1184 . 1 1 78 ASP OD2 O -10.248 -8.976 -0.864 . . . 1.0 . . . . . . . . . . . . A . 78 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1185 . 1 1 79 THR C C -6.427 -9.643 4.315 . . . 1.0 . . . . . . . . . . . . A . 79 THR C . . . . . . . . . c17360_2l7l 1 . 1 . 1186 . 1 1 79 THR CA C -6.964 -8.236 4.085 . . . 1.0 . . . . . . . . . . . . A . 79 THR CA . . . . . . . . . c17360_2l7l 1 . 1 . 1187 . 1 1 79 THR CB C -6.701 -7.398 5.342 . . . 1.0 . . . . . . . . . . . . A . 79 THR CB . . . . . . . . . c17360_2l7l 1 . 1 . 1188 . 1 1 79 THR CG2 C -5.197 -7.265 5.585 . . . 1.0 . . . . . . . . . . . . A . 79 THR CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1189 . 1 1 79 THR H H -8.984 -7.601 4.197 . . . 1.0 . . . . . . . . . . . . A . 79 THR H . . . . . . . . . c17360_2l7l 1 . 1 . 1190 . 1 1 79 THR HA H -6.445 -7.788 3.251 . . . 1.0 . . . . . . . . . . . . A . 79 THR HA . . . . . . . . . c17360_2l7l 1 . 1 . 1191 . 1 1 79 THR HB H -7.155 -7.878 6.195 . . . 1.0 . . . . . . . . . . . . A . 79 THR HB . . . . . . . . . c17360_2l7l 1 . 1 . 1192 . 1 1 79 THR HG1 H -6.631 -5.581 4.676 . . . 1.0 . . . . . . . . . . . . A . 79 THR HG1 . . . . . . . . . c17360_2l7l 1 . 1 . 1193 . 1 1 79 THR HG21 H -4.744 -6.750 4.752 . . . 1.0 . . . . . . . . . . . . A . 79 THR HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 1194 . 1 1 79 THR HG22 H -4.755 -8.245 5.691 . . . 1.0 . . . . . . . . . . . . A . 79 THR HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 1195 . 1 1 79 THR HG23 H -5.031 -6.697 6.489 . . . 1.0 . . . . . . . . . . . . A . 79 THR HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 1196 . 1 1 79 THR N N -8.393 -8.273 3.798 . . . 1.0 . . . . . . . . . . . . A . 79 THR N . . . . . . . . . c17360_2l7l 1 . 1 . 1197 . 1 1 79 THR O O -6.632 -10.233 5.374 . . . 1.0 . . . . . . . . . . . . A . 79 THR O . . . . . . . . . c17360_2l7l 1 . 1 . 1198 . 1 1 79 THR OG1 O -7.254 -6.109 5.178 . . . 1.0 . . . . . . . . . . . . A . 79 THR OG1 . . . . . . . . . c17360_2l7l 1 . 1 . 1199 . 1 1 80 ASP C C -3.655 -11.410 3.743 . . . 1.0 . . . . . . . . . . . . A . 80 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 1200 . 1 1 80 ASP CA C -5.142 -11.508 3.414 . . . 1.0 . . . . . . . . . . . . A . 80 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 1201 . 1 1 80 ASP CB C -5.325 -12.251 2.090 . . . 1.0 . . . . . . . . . . . . A . 80 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 1202 . 1 1 80 ASP CG C -6.793 -12.616 1.904 . . . 1.0 . . . . . . . . . . . . A . 80 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 1203 . 1 1 80 ASP H H -5.588 -9.649 2.497 . . . 1.0 . . . . . . . . . . . . A . 80 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 1204 . 1 1 80 ASP HA H -5.637 -12.064 4.197 . . . 1.0 . . . . . . . . . . . . A . 80 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 1205 . 1 1 80 ASP HB2 H -5.005 -11.616 1.276 . . . 1.0 . . . . . . . . . . . . A . 80 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1206 . 1 1 80 ASP HB3 H -4.730 -13.151 2.099 . . . 1.0 . . . . . . . . . . . . A . 80 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1207 . 1 1 80 ASP N N -5.727 -10.174 3.314 . . . 1.0 . . . . . . . . . . . . A . 80 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 1208 . 1 1 80 ASP O O -2.802 -11.622 2.881 . . . 1.0 . . . . . . . . . . . . A . 80 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 1209 . 1 1 80 ASP OD1 O -7.531 -12.533 2.872 . . . 1.0 . . . . . . . . . . . . A . 80 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1210 . 1 1 80 ASP OD2 O -7.158 -12.975 0.797 . . . 1.0 . . . . . . . . . . . . A . 80 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1211 . 1 1 81 SER C C -1.112 -12.092 4.849 . . . 1.0 . . . . . . . . . . . . A . 81 SER C . . . . . . . . . c17360_2l7l 1 . 1 . 1212 . 1 1 81 SER CA C -1.957 -10.961 5.424 . . . 1.0 . . . . . . . . . . . . A . 81 SER CA . . . . . . . . . c17360_2l7l 1 . 1 . 1213 . 1 1 81 SER CB C -1.881 -10.995 6.951 . . . 1.0 . . . . . . . . . . . . A . 81 SER CB . . . . . . . . . c17360_2l7l 1 . 1 . 1214 . 1 1 81 SER H H -4.068 -10.923 5.640 . . . 1.0 . . . . . . . . . . . . A . 81 SER H . . . . . . . . . c17360_2l7l 1 . 1 . 1215 . 1 1 81 SER HA H -1.566 -10.016 5.079 . . . 1.0 . . . . . . . . . . . . A . 81 SER HA . . . . . . . . . c17360_2l7l 1 . 1 . 1216 . 1 1 81 SER HB2 H -0.872 -10.794 7.267 . . . 1.0 . . . . . . . . . . . . A . 81 SER HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1217 . 1 1 81 SER HB3 H -2.542 -10.241 7.361 . . . 1.0 . . . . . . . . . . . . A . 81 SER HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1218 . 1 1 81 SER HG H -1.560 -12.898 7.204 . . . 1.0 . . . . . . . . . . . . A . 81 SER HG . . . . . . . . . c17360_2l7l 1 . 1 . 1219 . 1 1 81 SER N N -3.348 -11.089 4.996 . . . 1.0 . . . . . . . . . . . . A . 81 SER N . . . . . . . . . c17360_2l7l 1 . 1 . 1220 . 1 1 81 SER O O 0.098 -11.950 4.671 . . . 1.0 . . . . . . . . . . . . A . 81 SER O . . . . . . . . . c17360_2l7l 1 . 1 . 1221 . 1 1 81 SER OG O -2.268 -12.283 7.411 . . . 1.0 . . . . . . . . . . . . A . 81 SER OG . . . . . . . . . c17360_2l7l 1 . 1 . 1222 . 1 1 82 GLU C C -0.495 -14.046 2.619 . . . 1.0 . . . . . . . . . . . . A . 82 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 1223 . 1 1 82 GLU CA C -1.050 -14.363 4.005 . . . 1.0 . . . . . . . . . . . . A . 82 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 1224 . 1 1 82 GLU CB C -2.004 -15.559 3.908 . . . 1.0 . . . . . . . . . . . . A . 82 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 1225 . 1 1 82 GLU CD C -2.160 -18.006 3.398 . . . 1.0 . . . . . . . . . . . . A . 82 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 1226 . 1 1 82 GLU CG C -1.234 -16.794 3.434 . . . 1.0 . . . . . . . . . . . . A . 82 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 1227 . 1 1 82 GLU H H -2.724 -13.272 4.712 . . . 1.0 . . . . . . . . . . . . A . 82 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 1228 . 1 1 82 GLU HA H -0.235 -14.621 4.663 . . . 1.0 . . . . . . . . . . . . A . 82 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 1229 . 1 1 82 GLU HB2 H -2.438 -15.754 4.879 . . . 1.0 . . . . . . . . . . . . A . 82 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1230 . 1 1 82 GLU HB3 H -2.789 -15.335 3.201 . . . 1.0 . . . . . . . . . . . . A . 82 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1231 . 1 1 82 GLU HG2 H -0.842 -16.615 2.444 . . . 1.0 . . . . . . . . . . . . A . 82 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1232 . 1 1 82 GLU HG3 H -0.419 -16.990 4.113 . . . 1.0 . . . . . . . . . . . . A . 82 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1233 . 1 1 82 GLU N N -1.758 -13.214 4.554 . . . 1.0 . . . . . . . . . . . . A . 82 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 1234 . 1 1 82 GLU O O 0.721 -13.916 2.439 . . . 1.0 . . . . . . . . . . . . A . 82 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 1235 . 1 1 82 GLU OE1 O -3.360 -17.814 3.505 . . . 1.0 . . . . . . . . . . . . A . 82 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1236 . 1 1 82 GLU OE2 O -1.655 -19.108 3.261 . . . 1.0 . . . . . . . . . . . . A . 82 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1237 . 1 1 83 GLU C C -0.416 -12.205 0.186 . . . 1.0 . . . . . . . . . . . . A . 83 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 1238 . 1 1 83 GLU CA C -0.964 -13.623 0.280 . . . 1.0 . . . . . . . . . . . . A . 83 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 1239 . 1 1 83 GLU CB C -2.146 -13.785 -0.674 . . . 1.0 . . . . . . . . . . . . A . 83 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 1240 . 1 1 83 GLU CD C -3.784 -15.418 -1.624 . . . 1.0 . . . . . . . . . . . . A . 83 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 1241 . 1 1 83 GLU CG C -2.552 -15.257 -0.739 . . . 1.0 . . . . . . . . . . . . A . 83 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 1242 . 1 1 83 GLU H H -2.338 -14.030 1.833 . . . 1.0 . . . . . . . . . . . . A . 83 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 1243 . 1 1 83 GLU HA H -0.187 -14.317 -0.006 . . . 1.0 . . . . . . . . . . . . A . 83 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 1244 . 1 1 83 GLU HB2 H -2.979 -13.195 -0.320 . . . 1.0 . . . . . . . . . . . . A . 83 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1245 . 1 1 83 GLU HB3 H -1.862 -13.452 -1.657 . . . 1.0 . . . . . . . . . . . . A . 83 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1246 . 1 1 83 GLU HG2 H -1.738 -15.834 -1.149 . . . 1.0 . . . . . . . . . . . . A . 83 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1247 . 1 1 83 GLU HG3 H -2.779 -15.611 0.256 . . . 1.0 . . . . . . . . . . . . A . 83 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1248 . 1 1 83 GLU N N -1.384 -13.922 1.642 . . . 1.0 . . . . . . . . . . . . A . 83 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 1249 . 1 1 83 GLU O O 0.593 -11.960 -0.477 . . . 1.0 . . . . . . . . . . . . A . 83 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 1250 . 1 1 83 GLU OE1 O -4.246 -14.418 -2.151 . . . 1.0 . . . . . . . . . . . . A . 83 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1251 . 1 1 83 GLU OE2 O -4.246 -16.538 -1.765 . . . 1.0 . . . . . . . . . . . . A . 83 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1252 . 1 1 84 GLU C C 0.819 -9.760 1.103 . . . 1.0 . . . . . . . . . . . . A . 84 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 1253 . 1 1 84 GLU CA C -0.668 -9.878 0.809 . . . 1.0 . . . . . . . . . . . . A . 84 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 1254 . 1 1 84 GLU CB C -1.443 -9.075 1.852 . . . 1.0 . . . . . . . . . . . . A . 84 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 1255 . 1 1 84 GLU CD C -3.647 -8.059 2.432 . . . 1.0 . . . . . . . . . . . . A . 84 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 1256 . 1 1 84 GLU CG C -2.906 -8.944 1.431 . . . 1.0 . . . . . . . . . . . . A . 84 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 1257 . 1 1 84 GLU H H -1.899 -11.516 1.340 . . . 1.0 . . . . . . . . . . . . A . 84 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 1258 . 1 1 84 GLU HA H -0.871 -9.468 -0.169 . . . 1.0 . . . . . . . . . . . . A . 84 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 1259 . 1 1 84 GLU HB2 H -1.390 -9.585 2.801 . . . 1.0 . . . . . . . . . . . . A . 84 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1260 . 1 1 84 GLU HB3 H -1.008 -8.095 1.948 . . . 1.0 . . . . . . . . . . . . A . 84 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1261 . 1 1 84 GLU HG2 H -2.954 -8.503 0.448 . . . 1.0 . . . . . . . . . . . . A . 84 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1262 . 1 1 84 GLU HG3 H -3.363 -9.919 1.408 . . . 1.0 . . . . . . . . . . . . A . 84 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1263 . 1 1 84 GLU N N -1.093 -11.269 0.841 . . . 1.0 . . . . . . . . . . . . A . 84 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 1264 . 1 1 84 GLU O O 1.568 -9.180 0.319 . . . 1.0 . . . . . . . . . . . . A . 84 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 1265 . 1 1 84 GLU OE1 O -4.025 -8.567 3.471 . . . 1.0 . . . . . . . . . . . . A . 84 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1266 . 1 1 84 GLU OE2 O -3.824 -6.887 2.144 . . . 1.0 . . . . . . . . . . . . A . 84 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1267 . 1 1 85 ILE C C 3.503 -11.009 1.608 . . . 1.0 . . . . . . . . . . . . A . 85 ILE C . . . . . . . . . c17360_2l7l 1 . 1 . 1268 . 1 1 85 ILE CA C 2.646 -10.251 2.613 . . . 1.0 . . . . . . . . . . . . A . 85 ILE CA . . . . . . . . . c17360_2l7l 1 . 1 . 1269 . 1 1 85 ILE CB C 2.840 -10.857 4.002 . . . 1.0 . . . . . . . . . . . . A . 85 ILE CB . . . . . . . . . c17360_2l7l 1 . 1 . 1270 . 1 1 85 ILE CD1 C 2.137 -10.683 6.392 . . . 1.0 . . . . . . . . . . . . A . 85 ILE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1271 . 1 1 85 ILE CG1 C 2.119 -9.986 5.031 . . . 1.0 . . . . . . . . . . . . A . 85 ILE CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 1272 . 1 1 85 ILE CG2 C 4.339 -10.907 4.340 . . . 1.0 . . . . . . . . . . . . A . 85 ILE CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1273 . 1 1 85 ILE H H 0.602 -10.761 2.828 . . . 1.0 . . . . . . . . . . . . A . 85 ILE H . . . . . . . . . c17360_2l7l 1 . 1 . 1274 . 1 1 85 ILE HA H 2.961 -9.216 2.633 . . . 1.0 . . . . . . . . . . . . A . 85 ILE HA . . . . . . . . . c17360_2l7l 1 . 1 . 1275 . 1 1 85 ILE HB H 2.432 -11.856 4.019 . . . 1.0 . . . . . . . . . . . . A . 85 ILE HB . . . . . . . . . c17360_2l7l 1 . 1 . 1276 . 1 1 85 ILE HD11 H 3.146 -10.686 6.774 . . . 1.0 . . . . . . . . . . . . A . 85 ILE HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 1277 . 1 1 85 ILE HD12 H 1.793 -11.701 6.281 . . . 1.0 . . . . . . . . . . . . A . 85 ILE HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 1278 . 1 1 85 ILE HD13 H 1.492 -10.155 7.078 . . . 1.0 . . . . . . . . . . . . A . 85 ILE HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 1279 . 1 1 85 ILE HG12 H 2.614 -9.033 5.104 . . . 1.0 . . . . . . . . . . . . A . 85 ILE HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 1280 . 1 1 85 ILE HG13 H 1.095 -9.835 4.721 . . . 1.0 . . . . . . . . . . . . A . 85 ILE HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 1281 . 1 1 85 ILE HG21 H 4.785 -9.945 4.135 . . . 1.0 . . . . . . . . . . . . A . 85 ILE HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 1282 . 1 1 85 ILE HG22 H 4.822 -11.663 3.738 . . . 1.0 . . . . . . . . . . . . A . 85 ILE HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 1283 . 1 1 85 ILE HG23 H 4.467 -11.146 5.383 . . . 1.0 . . . . . . . . . . . . A . 85 ILE HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 1284 . 1 1 85 ILE N N 1.243 -10.310 2.235 . . . 1.0 . . . . . . . . . . . . A . 85 ILE N . . . . . . . . . c17360_2l7l 1 . 1 . 1285 . 1 1 85 ILE O O 4.570 -10.548 1.227 . . . 1.0 . . . . . . . . . . . . A . 85 ILE O . . . . . . . . . c17360_2l7l 1 . 1 . 1286 . 1 1 86 ARG C C 4.169 -12.186 -0.996 . . . 1.0 . . . . . . . . . . . . A . 86 ARG C . . . . . . . . . c17360_2l7l 1 . 1 . 1287 . 1 1 86 ARG CA C 3.816 -12.987 0.255 . . . 1.0 . . . . . . . . . . . . A . 86 ARG CA . . . . . . . . . c17360_2l7l 1 . 1 . 1288 . 1 1 86 ARG CB C 2.992 -14.214 -0.150 . . . 1.0 . . . . . . . . . . . . A . 86 ARG CB . . . . . . . . . c17360_2l7l 1 . 1 . 1289 . 1 1 86 ARG CD C 2.987 -16.340 -1.470 . . . 1.0 . . . . . . . . . . . . A . 86 ARG CD . . . . . . . . . c17360_2l7l 1 . 1 . 1290 . 1 1 86 ARG CG C 3.821 -15.124 -1.062 . . . 1.0 . . . . . . . . . . . . A . 86 ARG CG . . . . . . . . . c17360_2l7l 1 . 1 . 1291 . 1 1 86 ARG CZ C 4.172 -17.047 -3.469 . . . 1.0 . . . . . . . . . . . . A . 86 ARG CZ . . . . . . . . . c17360_2l7l 1 . 1 . 1292 . 1 1 86 ARG H H 2.186 -12.521 1.540 . . . 1.0 . . . . . . . . . . . . A . 86 ARG H . . . . . . . . . c17360_2l7l 1 . 1 . 1293 . 1 1 86 ARG HA H 4.723 -13.319 0.734 . . . 1.0 . . . . . . . . . . . . A . 86 ARG HA . . . . . . . . . c17360_2l7l 1 . 1 . 1294 . 1 1 86 ARG HB2 H 2.699 -14.759 0.734 . . . 1.0 . . . . . . . . . . . . A . 86 ARG HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1295 . 1 1 86 ARG HB3 H 2.108 -13.890 -0.681 . . . 1.0 . . . . . . . . . . . . A . 86 ARG HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1296 . 1 1 86 ARG HD2 H 2.599 -16.822 -0.586 . . . 1.0 . . . . . . . . . . . . A . 86 ARG HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1297 . 1 1 86 ARG HD3 H 2.165 -16.017 -2.091 . . . 1.0 . . . . . . . . . . . . A . 86 ARG HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 1298 . 1 1 86 ARG HE H 4.109 -18.112 -1.774 . . . 1.0 . . . . . . . . . . . . A . 86 ARG HE . . . . . . . . . c17360_2l7l 1 . 1 . 1299 . 1 1 86 ARG HG2 H 4.115 -14.582 -1.947 . . . 1.0 . . . . . . . . . . . . A . 86 ARG HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1300 . 1 1 86 ARG HG3 H 4.701 -15.457 -0.533 . . . 1.0 . . . . . . . . . . . . A . 86 ARG HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1301 . 1 1 86 ARG HH11 H 3.220 -15.289 -3.568 . . . 1.0 . . . . . . . . . . . . A . 86 ARG HH11 . . . . . . . . . c17360_2l7l 1 . 1 . 1302 . 1 1 86 ARG HH12 H 4.056 -15.770 -5.006 . . . 1.0 . . . . . . . . . . . . A . 86 ARG HH12 . . . . . . . . . c17360_2l7l 1 . 1 . 1303 . 1 1 86 ARG HH21 H 5.209 -18.750 -3.658 . . . 1.0 . . . . . . . . . . . . A . 86 ARG HH21 . . . . . . . . . c17360_2l7l 1 . 1 . 1304 . 1 1 86 ARG HH22 H 5.182 -17.729 -5.057 . . . 1.0 . . . . . . . . . . . . A . 86 ARG HH22 . . . . . . . . . c17360_2l7l 1 . 1 . 1305 . 1 1 86 ARG N N 3.043 -12.183 1.195 . . . 1.0 . . . . . . . . . . . . A . 86 ARG N . . . . . . . . . c17360_2l7l 1 . 1 . 1306 . 1 1 86 ARG NE N 3.813 -17.287 -2.211 . . . 1.0 . . . . . . . . . . . . A . 86 ARG NE . . . . . . . . . c17360_2l7l 1 . 1 . 1307 . 1 1 86 ARG NH1 N 3.786 -15.950 -4.060 . . . 1.0 . . . . . . . . . . . . A . 86 ARG NH1 . . . . . . . . . c17360_2l7l 1 . 1 . 1308 . 1 1 86 ARG NH2 N 4.911 -17.909 -4.111 . . . 1.0 . . . . . . . . . . . . A . 86 ARG NH2 . . . . . . . . . c17360_2l7l 1 . 1 . 1309 . 1 1 86 ARG O O 5.339 -12.094 -1.381 . . . 1.0 . . . . . . . . . . . . A . 86 ARG O . . . . . . . . . c17360_2l7l 1 . 1 . 1310 . 1 1 87 GLU C C 4.172 -9.550 -2.515 . . . 1.0 . . . . . . . . . . . . A . 87 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 1311 . 1 1 87 GLU CA C 3.396 -10.821 -2.831 . . . 1.0 . . . . . . . . . . . . A . 87 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 1312 . 1 1 87 GLU CB C 2.061 -10.451 -3.474 . . . 1.0 . . . . . . . . . . . . A . 87 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 1313 . 1 1 87 GLU CD C 2.802 -10.864 -5.828 . . . 1.0 . . . . . . . . . . . . A . 87 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 1314 . 1 1 87 GLU CG C 2.299 -9.812 -4.848 . . . 1.0 . . . . . . . . . . . . A . 87 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 1315 . 1 1 87 GLU H H 2.252 -11.702 -1.280 . . . 1.0 . . . . . . . . . . . . A . 87 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 1316 . 1 1 87 GLU HA H 3.964 -11.416 -3.532 . . . 1.0 . . . . . . . . . . . . A . 87 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 1317 . 1 1 87 GLU HB2 H 1.462 -11.343 -3.592 . . . 1.0 . . . . . . . . . . . . A . 87 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1318 . 1 1 87 GLU HB3 H 1.547 -9.753 -2.836 . . . 1.0 . . . . . . . . . . . . A . 87 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1319 . 1 1 87 GLU HG2 H 1.373 -9.399 -5.218 . . . 1.0 . . . . . . . . . . . . A . 87 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1320 . 1 1 87 GLU HG3 H 3.032 -9.023 -4.762 . . . 1.0 . . . . . . . . . . . . A . 87 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1321 . 1 1 87 GLU N N 3.163 -11.604 -1.627 . . . 1.0 . . . . . . . . . . . . A . 87 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 1322 . 1 1 87 GLU O O 5.083 -9.171 -3.252 . . . 1.0 . . . . . . . . . . . . A . 87 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 1323 . 1 1 87 GLU OE1 O 2.789 -12.031 -5.473 . . . 1.0 . . . . . . . . . . . . A . 87 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1324 . 1 1 87 GLU OE2 O 3.197 -10.487 -6.919 . . . 1.0 . . . . . . . . . . . . A . 87 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1325 . 1 1 88 ALA C C 5.954 -7.932 -0.705 . . . 1.0 . . . . . . . . . . . . A . 88 ALA C . . . . . . . . . c17360_2l7l 1 . 1 . 1326 . 1 1 88 ALA CA C 4.488 -7.662 -1.026 . . . 1.0 . . . . . . . . . . . . A . 88 ALA CA . . . . . . . . . c17360_2l7l 1 . 1 . 1327 . 1 1 88 ALA CB C 3.787 -7.059 0.194 . . . 1.0 . . . . . . . . . . . . A . 88 ALA CB . . . . . . . . . c17360_2l7l 1 . 1 . 1328 . 1 1 88 ALA H H 3.090 -9.232 -0.848 . . . 1.0 . . . . . . . . . . . . A . 88 ALA H . . . . . . . . . c17360_2l7l 1 . 1 . 1329 . 1 1 88 ALA HA H 4.433 -6.959 -1.842 . . . 1.0 . . . . . . . . . . . . A . 88 ALA HA . . . . . . . . . c17360_2l7l 1 . 1 . 1330 . 1 1 88 ALA HB1 H 2.718 -7.164 0.082 . . . 1.0 . . . . . . . . . . . . A . 88 ALA HB1 . . . . . . . . . c17360_2l7l 1 . 1 . 1331 . 1 1 88 ALA HB2 H 4.035 -6.013 0.271 . . . 1.0 . . . . . . . . . . . . A . 88 ALA HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1332 . 1 1 88 ALA HB3 H 4.106 -7.573 1.089 . . . 1.0 . . . . . . . . . . . . A . 88 ALA HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1333 . 1 1 88 ALA N N 3.813 -8.893 -1.416 . . . 1.0 . . . . . . . . . . . . A . 88 ALA N . . . . . . . . . c17360_2l7l 1 . 1 . 1334 . 1 1 88 ALA O O 6.842 -7.199 -1.139 . . . 1.0 . . . . . . . . . . . . A . 88 ALA O . . . . . . . . . c17360_2l7l 1 . 1 . 1335 . 1 1 89 PHE C C 8.408 -9.554 -0.792 . . . 1.0 . . . . . . . . . . . . A . 89 PHE C . . . . . . . . . c17360_2l7l 1 . 1 . 1336 . 1 1 89 PHE CA C 7.552 -9.350 0.451 . . . 1.0 . . . . . . . . . . . . A . 89 PHE CA . . . . . . . . . c17360_2l7l 1 . 1 . 1337 . 1 1 89 PHE CB C 7.546 -10.631 1.296 . . . 1.0 . . . . . . . . . . . . A . 89 PHE CB . . . . . . . . . c17360_2l7l 1 . 1 . 1338 . 1 1 89 PHE CD1 C 9.981 -11.254 1.451 . . . 1.0 . . . . . . . . . . . . A . 89 PHE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1339 . 1 1 89 PHE CD2 C 8.890 -10.316 3.399 . . . 1.0 . . . . . . . . . . . . A . 89 PHE CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1340 . 1 1 89 PHE CE1 C 11.177 -11.348 2.169 . . . 1.0 . . . . . . . . . . . . A . 89 PHE CE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1341 . 1 1 89 PHE CE2 C 10.084 -10.408 4.117 . . . 1.0 . . . . . . . . . . . . A . 89 PHE CE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1342 . 1 1 89 PHE CG C 8.838 -10.739 2.066 . . . 1.0 . . . . . . . . . . . . A . 89 PHE CG . . . . . . . . . c17360_2l7l 1 . 1 . 1343 . 1 1 89 PHE CZ C 11.228 -10.925 3.503 . . . 1.0 . . . . . . . . . . . . A . 89 PHE CZ . . . . . . . . . c17360_2l7l 1 . 1 . 1344 . 1 1 89 PHE H H 5.450 -9.525 0.392 . . . 1.0 . . . . . . . . . . . . A . 89 PHE H . . . . . . . . . c17360_2l7l 1 . 1 . 1345 . 1 1 89 PHE HA H 7.972 -8.547 1.035 . . . 1.0 . . . . . . . . . . . . A . 89 PHE HA . . . . . . . . . c17360_2l7l 1 . 1 . 1346 . 1 1 89 PHE HB2 H 6.724 -10.598 1.992 . . . 1.0 . . . . . . . . . . . . A . 89 PHE HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1347 . 1 1 89 PHE HB3 H 7.441 -11.491 0.651 . . . 1.0 . . . . . . . . . . . . A . 89 PHE HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1348 . 1 1 89 PHE HD1 H 9.941 -11.582 0.421 . . . 1.0 . . . . . . . . . . . . A . 89 PHE HD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1349 . 1 1 89 PHE HD2 H 8.004 -9.919 3.872 . . . 1.0 . . . . . . . . . . . . A . 89 PHE HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1350 . 1 1 89 PHE HE1 H 12.059 -11.748 1.694 . . . 1.0 . . . . . . . . . . . . A . 89 PHE HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1351 . 1 1 89 PHE HE2 H 10.122 -10.080 5.145 . . . 1.0 . . . . . . . . . . . . A . 89 PHE HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1352 . 1 1 89 PHE HZ H 12.151 -10.994 4.057 . . . 1.0 . . . . . . . . . . . . A . 89 PHE HZ . . . . . . . . . c17360_2l7l 1 . 1 . 1353 . 1 1 89 PHE N N 6.196 -8.987 0.065 . . . 1.0 . . . . . . . . . . . . A . 89 PHE N . . . . . . . . . c17360_2l7l 1 . 1 . 1354 . 1 1 89 PHE O O 9.578 -9.175 -0.817 . . . 1.0 . . . . . . . . . . . . A . 89 PHE O . . . . . . . . . c17360_2l7l 1 . 1 . 1355 . 1 1 90 ARG C C 8.874 -9.059 -3.760 . . . 1.0 . . . . . . . . . . . . A . 90 ARG C . . . . . . . . . c17360_2l7l 1 . 1 . 1356 . 1 1 90 ARG CA C 8.533 -10.379 -3.071 . . . 1.0 . . . . . . . . . . . . A . 90 ARG CA . . . . . . . . . c17360_2l7l 1 . 1 . 1357 . 1 1 90 ARG CB C 7.685 -11.242 -4.003 . . . 1.0 . . . . . . . . . . . . A . 90 ARG CB . . . . . . . . . c17360_2l7l 1 . 1 . 1358 . 1 1 90 ARG CD C 6.639 -13.490 -4.287 . . . 1.0 . . . . . . . . . . . . A . 90 ARG CD . . . . . . . . . c17360_2l7l 1 . 1 . 1359 . 1 1 90 ARG CG C 7.632 -12.671 -3.463 . . . 1.0 . . . . . . . . . . . . A . 90 ARG CG . . . . . . . . . c17360_2l7l 1 . 1 . 1360 . 1 1 90 ARG CZ C 6.287 -14.069 -6.617 . . . 1.0 . . . . . . . . . . . . A . 90 ARG CZ . . . . . . . . . c17360_2l7l 1 . 1 . 1361 . 1 1 90 ARG H H 6.867 -10.414 -1.764 . . . 1.0 . . . . . . . . . . . . A . 90 ARG H . . . . . . . . . c17360_2l7l 1 . 1 . 1362 . 1 1 90 ARG HA H 9.450 -10.903 -2.851 . . . 1.0 . . . . . . . . . . . . A . 90 ARG HA . . . . . . . . . c17360_2l7l 1 . 1 . 1363 . 1 1 90 ARG HB2 H 6.684 -10.838 -4.057 . . . 1.0 . . . . . . . . . . . . A . 90 ARG HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1364 . 1 1 90 ARG HB3 H 8.125 -11.247 -4.989 . . . 1.0 . . . . . . . . . . . . A . 90 ARG HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1365 . 1 1 90 ARG HD2 H 6.567 -14.484 -3.873 . . . 1.0 . . . . . . . . . . . . A . 90 ARG HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1366 . 1 1 90 ARG HD3 H 5.667 -13.017 -4.247 . . . 1.0 . . . . . . . . . . . . A . 90 ARG HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 1367 . 1 1 90 ARG HE H 7.981 -13.270 -5.911 . . . 1.0 . . . . . . . . . . . . A . 90 ARG HE . . . . . . . . . c17360_2l7l 1 . 1 . 1368 . 1 1 90 ARG HG2 H 8.614 -13.117 -3.536 . . . 1.0 . . . . . . . . . . . . A . 90 ARG HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1369 . 1 1 90 ARG HG3 H 7.321 -12.658 -2.432 . . . 1.0 . . . . . . . . . . . . A . 90 ARG HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1370 . 1 1 90 ARG HH11 H 4.765 -14.427 -5.366 . . . 1.0 . . . . . . . . . . . . A . 90 ARG HH11 . . . . . . . . . c17360_2l7l 1 . 1 . 1371 . 1 1 90 ARG HH12 H 4.488 -14.849 -7.022 . . . 1.0 . . . . . . . . . . . . A . 90 ARG HH12 . . . . . . . . . c17360_2l7l 1 . 1 . 1372 . 1 1 90 ARG HH21 H 7.624 -13.819 -8.086 . . . 1.0 . . . . . . . . . . . . A . 90 ARG HH21 . . . . . . . . . c17360_2l7l 1 . 1 . 1373 . 1 1 90 ARG HH22 H 6.106 -14.505 -8.562 . . . 1.0 . . . . . . . . . . . . A . 90 ARG HH22 . . . . . . . . . c17360_2l7l 1 . 1 . 1374 . 1 1 90 ARG N N 7.814 -10.148 -1.823 . . . 1.0 . . . . . . . . . . . . A . 90 ARG N . . . . . . . . . c17360_2l7l 1 . 1 . 1375 . 1 1 90 ARG NE N 7.082 -13.578 -5.673 . . . 1.0 . . . . . . . . . . . . A . 90 ARG NE . . . . . . . . . c17360_2l7l 1 . 1 . 1376 . 1 1 90 ARG NH1 N 5.087 -14.480 -6.311 . . . 1.0 . . . . . . . . . . . . A . 90 ARG NH1 . . . . . . . . . c17360_2l7l 1 . 1 . 1377 . 1 1 90 ARG NH2 N 6.705 -14.136 -7.851 . . . 1.0 . . . . . . . . . . . . A . 90 ARG NH2 . . . . . . . . . c17360_2l7l 1 . 1 . 1378 . 1 1 90 ARG O O 9.956 -8.906 -4.326 . . . 1.0 . . . . . . . . . . . . A . 90 ARG O . . . . . . . . . c17360_2l7l 1 . 1 . 1379 . 1 1 91 VAL C C 9.342 -6.093 -3.702 . . . 1.0 . . . . . . . . . . . . A . 91 VAL C . . . . . . . . . c17360_2l7l 1 . 1 . 1380 . 1 1 91 VAL CA C 8.161 -6.813 -4.351 . . . 1.0 . . . . . . . . . . . . A . 91 VAL CA . . . . . . . . . c17360_2l7l 1 . 1 . 1381 . 1 1 91 VAL CB C 6.897 -5.955 -4.221 . . . 1.0 . . . . . . . . . . . . A . 91 VAL CB . . . . . . . . . c17360_2l7l 1 . 1 . 1382 . 1 1 91 VAL CG1 C 7.183 -4.535 -4.717 . . . 1.0 . . . . . . . . . . . . A . 91 VAL CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 1383 . 1 1 91 VAL CG2 C 5.773 -6.570 -5.061 . . . 1.0 . . . . . . . . . . . . A . 91 VAL CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1384 . 1 1 91 VAL H H 7.093 -8.288 -3.256 . . . 1.0 . . . . . . . . . . . . A . 91 VAL H . . . . . . . . . c17360_2l7l 1 . 1 . 1385 . 1 1 91 VAL HA H 8.373 -6.964 -5.397 . . . 1.0 . . . . . . . . . . . . A . 91 VAL HA . . . . . . . . . c17360_2l7l 1 . 1 . 1386 . 1 1 91 VAL HB H 6.594 -5.918 -3.184 . . . 1.0 . . . . . . . . . . . . A . 91 VAL HB . . . . . . . . . c17360_2l7l 1 . 1 . 1387 . 1 1 91 VAL HG11 H 7.777 -4.010 -3.983 . . . 1.0 . . . . . . . . . . . . A . 91 VAL HG11 . . . . . . . . . c17360_2l7l 1 . 1 . 1388 . 1 1 91 VAL HG12 H 6.252 -4.010 -4.868 . . . 1.0 . . . . . . . . . . . . A . 91 VAL HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 1389 . 1 1 91 VAL HG13 H 7.725 -4.583 -5.650 . . . 1.0 . . . . . . . . . . . . A . 91 VAL HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 1390 . 1 1 91 VAL HG21 H 5.746 -7.637 -4.900 . . . 1.0 . . . . . . . . . . . . A . 91 VAL HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 1391 . 1 1 91 VAL HG22 H 5.953 -6.369 -6.106 . . . 1.0 . . . . . . . . . . . . A . 91 VAL HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 1392 . 1 1 91 VAL HG23 H 4.828 -6.137 -4.768 . . . 1.0 . . . . . . . . . . . . A . 91 VAL HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 1393 . 1 1 91 VAL N N 7.942 -8.111 -3.717 . . . 1.0 . . . . . . . . . . . . A . 91 VAL N . . . . . . . . . c17360_2l7l 1 . 1 . 1394 . 1 1 91 VAL O O 10.214 -5.560 -4.389 . . . 1.0 . . . . . . . . . . . . A . 91 VAL O . . . . . . . . . c17360_2l7l 1 . 1 . 1395 . 1 1 92 PHE C C 11.729 -6.240 -1.782 . . . 1.0 . . . . . . . . . . . . A . 92 PHE C . . . . . . . . . c17360_2l7l 1 . 1 . 1396 . 1 1 92 PHE CA C 10.442 -5.444 -1.640 . . . 1.0 . . . . . . . . . . . . A . 92 PHE CA . . . . . . . . . c17360_2l7l 1 . 1 . 1397 . 1 1 92 PHE CB C 10.069 -5.306 -0.161 . . . 1.0 . . . . . . . . . . . . A . 92 PHE CB . . . . . . . . . c17360_2l7l 1 . 1 . 1398 . 1 1 92 PHE CD1 C 8.098 -3.872 -0.862 . . . 1.0 . . . . . . . . . . . . A . 92 PHE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1399 . 1 1 92 PHE CD2 C 7.789 -5.519 0.890 . . . 1.0 . . . . . . . . . . . . A . 92 PHE CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1400 . 1 1 92 PHE CE1 C 6.759 -3.499 -0.747 . . . 1.0 . . . . . . . . . . . . A . 92 PHE CE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1401 . 1 1 92 PHE CE2 C 6.447 -5.145 1.001 . . . 1.0 . . . . . . . . . . . . A . 92 PHE CE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1402 . 1 1 92 PHE CG C 8.619 -4.887 -0.041 . . . 1.0 . . . . . . . . . . . . A . 92 PHE CG . . . . . . . . . c17360_2l7l 1 . 1 . 1403 . 1 1 92 PHE CZ C 5.931 -4.133 0.182 . . . 1.0 . . . . . . . . . . . . A . 92 PHE CZ . . . . . . . . . c17360_2l7l 1 . 1 . 1404 . 1 1 92 PHE H H 8.643 -6.544 -1.894 . . . 1.0 . . . . . . . . . . . . A . 92 PHE H . . . . . . . . . c17360_2l7l 1 . 1 . 1405 . 1 1 92 PHE HA H 10.615 -4.463 -2.052 . . . 1.0 . . . . . . . . . . . . A . 92 PHE HA . . . . . . . . . c17360_2l7l 1 . 1 . 1406 . 1 1 92 PHE HB2 H 10.214 -6.256 0.336 . . . 1.0 . . . . . . . . . . . . A . 92 PHE HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1407 . 1 1 92 PHE HB3 H 10.697 -4.561 0.299 . . . 1.0 . . . . . . . . . . . . A . 92 PHE HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1408 . 1 1 92 PHE HD1 H 8.726 -3.375 -1.577 . . . 1.0 . . . . . . . . . . . . A . 92 PHE HD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1409 . 1 1 92 PHE HD2 H 8.186 -6.297 1.523 . . . 1.0 . . . . . . . . . . . . A . 92 PHE HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1410 . 1 1 92 PHE HE1 H 6.362 -2.721 -1.380 . . . 1.0 . . . . . . . . . . . . A . 92 PHE HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1411 . 1 1 92 PHE HE2 H 5.811 -5.634 1.717 . . . 1.0 . . . . . . . . . . . . A . 92 PHE HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1412 . 1 1 92 PHE HZ H 4.896 -3.844 0.267 . . . 1.0 . . . . . . . . . . . . A . 92 PHE HZ . . . . . . . . . c17360_2l7l 1 . 1 . 1413 . 1 1 92 PHE N N 9.364 -6.090 -2.378 . . . 1.0 . . . . . . . . . . . . A . 92 PHE N . . . . . . . . . c17360_2l7l 1 . 1 . 1414 . 1 1 92 PHE O O 12.817 -5.672 -1.828 . . . 1.0 . . . . . . . . . . . . A . 92 PHE O . . . . . . . . . c17360_2l7l 1 . 1 . 1415 . 1 1 93 ASP C C 13.056 -8.704 -3.461 . . . 1.0 . . . . . . . . . . . . A . 93 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 1416 . 1 1 93 ASP CA C 12.767 -8.431 -1.985 . . . 1.0 . . . . . . . . . . . . A . 93 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 1417 . 1 1 93 ASP CB C 12.522 -9.747 -1.233 . . . 1.0 . . . . . . . . . . . . A . 93 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 1418 . 1 1 93 ASP CG C 13.849 -10.336 -0.769 . . . 1.0 . . . . . . . . . . . . A . 93 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 1419 . 1 1 93 ASP H H 10.705 -7.958 -1.817 . . . 1.0 . . . . . . . . . . . . A . 93 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 1420 . 1 1 93 ASP HA H 13.624 -7.934 -1.552 . . . 1.0 . . . . . . . . . . . . A . 93 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 1421 . 1 1 93 ASP HB2 H 11.898 -9.555 -0.371 . . . 1.0 . . . . . . . . . . . . A . 93 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1422 . 1 1 93 ASP HB3 H 12.022 -10.455 -1.882 . . . 1.0 . . . . . . . . . . . . A . 93 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1423 . 1 1 93 ASP N N 11.600 -7.563 -1.846 . . . 1.0 . . . . . . . . . . . . A . 93 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 1424 . 1 1 93 ASP O O 12.661 -9.735 -4.003 . . . 1.0 . . . . . . . . . . . . A . 93 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 1425 . 1 1 93 ASP OD1 O 14.462 -11.054 -1.534 . . . 1.0 . . . . . . . . . . . . A . 93 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1426 . 1 1 93 ASP OD2 O 14.235 -10.044 0.346 . . . 1.0 . . . . . . . . . . . . A . 93 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1427 . 1 1 94 LYS C C 14.952 -9.151 -5.747 . . . 1.0 . . . . . . . . . . . . A . 94 LYS C . . . . . . . . . c17360_2l7l 1 . 1 . 1428 . 1 1 94 LYS CA C 14.064 -7.933 -5.520 . . . 1.0 . . . . . . . . . . . . A . 94 LYS CA . . . . . . . . . c17360_2l7l 1 . 1 . 1429 . 1 1 94 LYS CB C 14.785 -6.684 -6.023 . . . 1.0 . . . . . . . . . . . . A . 94 LYS CB . . . . . . . . . c17360_2l7l 1 . 1 . 1430 . 1 1 94 LYS CD C 12.659 -5.508 -6.693 . . . 1.0 . . . . . . . . . . . . A . 94 LYS CD . . . . . . . . . c17360_2l7l 1 . 1 . 1431 . 1 1 94 LYS CE C 12.038 -4.116 -6.811 . . . 1.0 . . . . . . . . . . . . A . 94 LYS CE . . . . . . . . . c17360_2l7l 1 . 1 . 1432 . 1 1 94 LYS CG C 13.905 -5.450 -5.797 . . . 1.0 . . . . . . . . . . . . A . 94 LYS CG . . . . . . . . . c17360_2l7l 1 . 1 . 1433 . 1 1 94 LYS H H 14.030 -6.968 -3.631 . . . 1.0 . . . . . . . . . . . . A . 94 LYS H . . . . . . . . . c17360_2l7l 1 . 1 . 1434 . 1 1 94 LYS HA H 13.154 -8.063 -6.080 . . . 1.0 . . . . . . . . . . . . A . 94 LYS HA . . . . . . . . . c17360_2l7l 1 . 1 . 1435 . 1 1 94 LYS HB2 H 15.716 -6.567 -5.488 . . . 1.0 . . . . . . . . . . . . A . 94 LYS HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1436 . 1 1 94 LYS HB3 H 14.989 -6.790 -7.079 . . . 1.0 . . . . . . . . . . . . A . 94 LYS HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1437 . 1 1 94 LYS HD2 H 12.931 -5.864 -7.675 . . . 1.0 . . . . . . . . . . . . A . 94 LYS HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1438 . 1 1 94 LYS HD3 H 11.932 -6.175 -6.258 . . . 1.0 . . . . . . . . . . . . A . 94 LYS HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 1439 . 1 1 94 LYS HE2 H 12.791 -3.407 -7.124 . . . 1.0 . . . . . . . . . . . . A . 94 LYS HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1440 . 1 1 94 LYS HE3 H 11.242 -4.141 -7.541 . . . 1.0 . . . . . . . . . . . . A . 94 LYS HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 1441 . 1 1 94 LYS HG2 H 13.599 -5.420 -4.761 . . . 1.0 . . . . . . . . . . . . A . 94 LYS HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1442 . 1 1 94 LYS HG3 H 14.475 -4.561 -6.026 . . . 1.0 . . . . . . . . . . . . A . 94 LYS HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1443 . 1 1 94 LYS HZ1 H 10.461 -3.553 -5.575 . . . 1.0 . . . . . . . . . . . . A . 94 LYS HZ1 . . . . . . . . . c17360_2l7l 1 . 1 . 1444 . 1 1 94 LYS HZ2 H 11.946 -2.833 -5.176 . . . 1.0 . . . . . . . . . . . . A . 94 LYS HZ2 . . . . . . . . . c17360_2l7l 1 . 1 . 1445 . 1 1 94 LYS HZ3 H 11.660 -4.464 -4.794 . . . 1.0 . . . . . . . . . . . . A . 94 LYS HZ3 . . . . . . . . . c17360_2l7l 1 . 1 . 1446 . 1 1 94 LYS N N 13.740 -7.775 -4.107 . . . 1.0 . . . . . . . . . . . . A . 94 LYS N . . . . . . . . . c17360_2l7l 1 . 1 . 1447 . 1 1 94 LYS NZ N 11.485 -3.711 -5.489 . . . 1.0 . . . . . . . . . . . . A . 94 LYS NZ . . . . . . . . . c17360_2l7l 1 . 1 . 1448 . 1 1 94 LYS O O 14.739 -9.920 -6.684 . . . 1.0 . . . . . . . . . . . . A . 94 LYS O . . . . . . . . . c17360_2l7l 1 . 1 . 1449 . 1 1 95 ASP C C 16.182 -11.748 -4.600 . . . 1.0 . . . . . . . . . . . . A . 95 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 1450 . 1 1 95 ASP CA C 16.864 -10.446 -5.014 . . . 1.0 . . . . . . . . . . . . A . 95 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 1451 . 1 1 95 ASP CB C 18.100 -10.209 -4.140 . . . 1.0 . . . . . . . . . . . . A . 95 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 1452 . 1 1 95 ASP CG C 17.691 -10.118 -2.676 . . . 1.0 . . . . . . . . . . . . A . 95 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 1453 . 1 1 95 ASP H H 16.066 -8.670 -4.163 . . . 1.0 . . . . . . . . . . . . A . 95 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 1454 . 1 1 95 ASP HA H 17.178 -10.528 -6.043 . . . 1.0 . . . . . . . . . . . . A . 95 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 1455 . 1 1 95 ASP HB2 H 18.793 -11.025 -4.271 . . . 1.0 . . . . . . . . . . . . A . 95 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1456 . 1 1 95 ASP HB3 H 18.574 -9.285 -4.436 . . . 1.0 . . . . . . . . . . . . A . 95 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1457 . 1 1 95 ASP N N 15.947 -9.319 -4.887 . . . 1.0 . . . . . . . . . . . . A . 95 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 1458 . 1 1 95 ASP O O 16.677 -12.838 -4.888 . . . 1.0 . . . . . . . . . . . . A . 95 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 1459 . 1 1 95 ASP OD1 O 16.587 -10.525 -2.368 . . . 1.0 . . . . . . . . . . . . A . 95 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1460 . 1 1 95 ASP OD2 O 18.485 -9.636 -1.884 . . . 1.0 . . . . . . . . . . . . A . 95 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1461 . 1 1 96 GLY C C 15.151 -13.629 -2.497 . . . 1.0 . . . . . . . . . . . . A . 96 GLY C . . . . . . . . . c17360_2l7l 1 . 1 . 1462 . 1 1 96 GLY CA C 14.310 -12.804 -3.468 . . . 1.0 . . . . . . . . . . . . A . 96 GLY CA . . . . . . . . . c17360_2l7l 1 . 1 . 1463 . 1 1 96 GLY H H 14.703 -10.734 -3.707 . . . 1.0 . . . . . . . . . . . . A . 96 GLY H . . . . . . . . . c17360_2l7l 1 . 1 . 1464 . 1 1 96 GLY HA2 H 13.398 -12.491 -2.978 . . . 1.0 . . . . . . . . . . . . A . 96 GLY HA2 . . . . . . . . . c17360_2l7l 1 . 1 . 1465 . 1 1 96 GLY HA3 H 14.062 -13.413 -4.322 . . . 1.0 . . . . . . . . . . . . A . 96 GLY HA3 . . . . . . . . . c17360_2l7l 1 . 1 . 1466 . 1 1 96 GLY N N 15.046 -11.627 -3.919 . . . 1.0 . . . . . . . . . . . . A . 96 GLY N . . . . . . . . . c17360_2l7l 1 . 1 . 1467 . 1 1 96 GLY O O 15.024 -14.852 -2.439 . . . 1.0 . . . . . . . . . . . . A . 96 GLY O . . . . . . . . . c17360_2l7l 1 . 1 . 1468 . 1 1 97 ASN C C 16.079 -14.077 0.441 . . . 1.0 . . . . . . . . . . . . A . 97 ASN C . . . . . . . . . c17360_2l7l 1 . 1 . 1469 . 1 1 97 ASN CA C 16.875 -13.646 -0.783 . . . 1.0 . . . . . . . . . . . . A . 97 ASN CA . . . . . . . . . c17360_2l7l 1 . 1 . 1470 . 1 1 97 ASN CB C 18.018 -12.724 -0.351 . . . 1.0 . . . . . . . . . . . . A . 97 ASN CB . . . . . . . . . c17360_2l7l 1 . 1 . 1471 . 1 1 97 ASN CG C 17.455 -11.432 0.233 . . . 1.0 . . . . . . . . . . . . A . 97 ASN CG . . . . . . . . . c17360_2l7l 1 . 1 . 1472 . 1 1 97 ASN H H 16.082 -11.984 -1.829 . . . 1.0 . . . . . . . . . . . . A . 97 ASN H . . . . . . . . . c17360_2l7l 1 . 1 . 1473 . 1 1 97 ASN HA H 17.296 -14.521 -1.255 . . . 1.0 . . . . . . . . . . . . A . 97 ASN HA . . . . . . . . . c17360_2l7l 1 . 1 . 1474 . 1 1 97 ASN HB2 H 18.617 -13.223 0.397 . . . 1.0 . . . . . . . . . . . . A . 97 ASN HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1475 . 1 1 97 ASN HB3 H 18.634 -12.490 -1.206 . . . 1.0 . . . . . . . . . . . . A . 97 ASN HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1476 . 1 1 97 ASN HD21 H 19.240 -10.631 0.571 . . . 1.0 . . . . . . . . . . . . A . 97 ASN HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 1477 . 1 1 97 ASN HD22 H 17.914 -9.666 1.016 . . . 1.0 . . . . . . . . . . . . A . 97 ASN HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 1478 . 1 1 97 ASN N N 16.016 -12.956 -1.741 . . . 1.0 . . . . . . . . . . . . A . 97 ASN N . . . . . . . . . c17360_2l7l 1 . 1 . 1479 . 1 1 97 ASN ND2 N 18.271 -10.499 0.640 . . . 1.0 . . . . . . . . . . . . A . 97 ASN ND2 . . . . . . . . . c17360_2l7l 1 . 1 . 1480 . 1 1 97 ASN O O 16.563 -14.850 1.268 . . . 1.0 . . . . . . . . . . . . A . 97 ASN O . . . . . . . . . c17360_2l7l 1 . 1 . 1481 . 1 1 97 ASN OD1 O 16.240 -11.268 0.320 . . . 1.0 . . . . . . . . . . . . A . 97 ASN OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1482 . 1 1 98 GLY C C 14.111 -12.899 2.793 . . . 1.0 . . . . . . . . . . . . A . 98 GLY C . . . . . . . . . c17360_2l7l 1 . 1 . 1483 . 1 1 98 GLY CA C 13.987 -13.924 1.675 . . . 1.0 . . . . . . . . . . . . A . 98 GLY CA . . . . . . . . . c17360_2l7l 1 . 1 . 1484 . 1 1 98 GLY H H 14.524 -12.967 -0.143 . . . 1.0 . . . . . . . . . . . . A . 98 GLY H . . . . . . . . . c17360_2l7l 1 . 1 . 1485 . 1 1 98 GLY HA2 H 12.963 -13.952 1.336 . . . 1.0 . . . . . . . . . . . . A . 98 GLY HA2 . . . . . . . . . c17360_2l7l 1 . 1 . 1486 . 1 1 98 GLY HA3 H 14.262 -14.897 2.058 . . . 1.0 . . . . . . . . . . . . A . 98 GLY HA3 . . . . . . . . . c17360_2l7l 1 . 1 . 1487 . 1 1 98 GLY N N 14.852 -13.579 0.549 . . . 1.0 . . . . . . . . . . . . A . 98 GLY N . . . . . . . . . c17360_2l7l 1 . 1 . 1488 . 1 1 98 GLY O O 13.377 -12.957 3.778 . . . 1.0 . . . . . . . . . . . . A . 98 GLY O . . . . . . . . . c17360_2l7l 1 . 1 . 1489 . 1 1 99 TYR C C 15.202 -9.542 2.994 . . . 1.0 . . . . . . . . . . . . A . 99 TYR C . . . . . . . . . c17360_2l7l 1 . 1 . 1490 . 1 1 99 TYR CA C 15.254 -10.914 3.648 . . . 1.0 . . . . . . . . . . . . A . 99 TYR CA . . . . . . . . . c17360_2l7l 1 . 1 . 1491 . 1 1 99 TYR CB C 16.604 -11.114 4.330 . . . 1.0 . . . . . . . . . . . . A . 99 TYR CB . . . . . . . . . c17360_2l7l 1 . 1 . 1492 . 1 1 99 TYR CD1 C 16.945 -13.609 4.410 . . . 1.0 . . . . . . . . . . . . A . 99 TYR CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1493 . 1 1 99 TYR CD2 C 16.237 -12.463 6.425 . . . 1.0 . . . . . . . . . . . . A . 99 TYR CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1494 . 1 1 99 TYR CE1 C 16.938 -14.827 5.100 . . . 1.0 . . . . . . . . . . . . A . 99 TYR CE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1495 . 1 1 99 TYR CE2 C 16.229 -13.680 7.116 . . . 1.0 . . . . . . . . . . . . A . 99 TYR CE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1496 . 1 1 99 TYR CG C 16.595 -12.428 5.072 . . . 1.0 . . . . . . . . . . . . A . 99 TYR CG . . . . . . . . . c17360_2l7l 1 . 1 . 1497 . 1 1 99 TYR CZ C 16.580 -14.863 6.453 . . . 1.0 . . . . . . . . . . . . A . 99 TYR CZ . . . . . . . . . c17360_2l7l 1 . 1 . 1498 . 1 1 99 TYR H H 15.602 -11.960 1.837 . . . 1.0 . . . . . . . . . . . . A . 99 TYR H . . . . . . . . . c17360_2l7l 1 . 1 . 1499 . 1 1 99 TYR HA H 14.474 -10.970 4.397 . . . 1.0 . . . . . . . . . . . . A . 99 TYR HA . . . . . . . . . c17360_2l7l 1 . 1 . 1500 . 1 1 99 TYR HB2 H 17.389 -11.122 3.586 . . . 1.0 . . . . . . . . . . . . A . 99 TYR HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1501 . 1 1 99 TYR HB3 H 16.774 -10.313 5.026 . . . 1.0 . . . . . . . . . . . . A . 99 TYR HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1502 . 1 1 99 TYR HD1 H 17.221 -13.582 3.366 . . . 1.0 . . . . . . . . . . . . A . 99 TYR HD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1503 . 1 1 99 TYR HD2 H 15.966 -11.551 6.935 . . . 1.0 . . . . . . . . . . . . A . 99 TYR HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1504 . 1 1 99 TYR HE1 H 17.209 -15.738 4.590 . . . 1.0 . . . . . . . . . . . . A . 99 TYR HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1505 . 1 1 99 TYR HE2 H 15.953 -13.708 8.160 . . . 1.0 . . . . . . . . . . . . A . 99 TYR HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1506 . 1 1 99 TYR HH H 15.962 -15.983 7.868 . . . 1.0 . . . . . . . . . . . . A . 99 TYR HH . . . . . . . . . c17360_2l7l 1 . 1 . 1507 . 1 1 99 TYR N N 15.044 -11.958 2.642 . . . 1.0 . . . . . . . . . . . . A . 99 TYR N . . . . . . . . . c17360_2l7l 1 . 1 . 1508 . 1 1 99 TYR O O 15.749 -9.342 1.919 . . . 1.0 . . . . . . . . . . . . A . 99 TYR O . . . . . . . . . c17360_2l7l 1 . 1 . 1509 . 1 1 99 TYR OH O 16.574 -16.063 7.134 . . . 1.0 . . . . . . . . . . . . A . 99 TYR OH . . . . . . . . . c17360_2l7l 1 . 1 . 1510 . 1 1 100 ILE C C 15.468 -6.312 3.775 . . . 1.0 . . . . . . . . . . . . A . 100 ILE C . . . . . . . . . c17360_2l7l 1 . 1 . 1511 . 1 1 100 ILE CA C 14.442 -7.232 3.130 . . . 1.0 . . . . . . . . . . . . A . 100 ILE CA . . . . . . . . . c17360_2l7l 1 . 1 . 1512 . 1 1 100 ILE CB C 13.040 -6.690 3.404 . . . 1.0 . . . . . . . . . . . . A . 100 ILE CB . . . . . . . . . c17360_2l7l 1 . 1 . 1513 . 1 1 100 ILE CD1 C 10.605 -7.221 3.209 . . . 1.0 . . . . . . . . . . . . A . 100 ILE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1514 . 1 1 100 ILE CG1 C 12.006 -7.570 2.701 . . . 1.0 . . . . . . . . . . . . A . 100 ILE CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 1515 . 1 1 100 ILE CG2 C 12.932 -5.258 2.883 . . . 1.0 . . . . . . . . . . . . A . 100 ILE CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1516 . 1 1 100 ILE H H 14.160 -8.805 4.531 . . . 1.0 . . . . . . . . . . . . A . 100 ILE H . . . . . . . . . c17360_2l7l 1 . 1 . 1517 . 1 1 100 ILE HA H 14.604 -7.244 2.060 . . . 1.0 . . . . . . . . . . . . A . 100 ILE HA . . . . . . . . . c17360_2l7l 1 . 1 . 1518 . 1 1 100 ILE HB H 12.859 -6.698 4.466 . . . 1.0 . . . . . . . . . . . . A . 100 ILE HB . . . . . . . . . c17360_2l7l 1 . 1 . 1519 . 1 1 100 ILE HD11 H 10.423 -6.166 3.066 . . . 1.0 . . . . . . . . . . . . A . 100 ILE HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 1520 . 1 1 100 ILE HD12 H 10.533 -7.461 4.260 . . . 1.0 . . . . . . . . . . . . A . 100 ILE HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 1521 . 1 1 100 ILE HD13 H 9.871 -7.790 2.658 . . . 1.0 . . . . . . . . . . . . A . 100 ILE HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 1522 . 1 1 100 ILE HG12 H 12.056 -7.400 1.635 . . . 1.0 . . . . . . . . . . . . A . 100 ILE HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 1523 . 1 1 100 ILE HG13 H 12.216 -8.606 2.910 . . . 1.0 . . . . . . . . . . . . A . 100 ILE HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 1524 . 1 1 100 ILE HG21 H 11.899 -4.945 2.906 . . . 1.0 . . . . . . . . . . . . A . 100 ILE HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 1525 . 1 1 100 ILE HG22 H 13.300 -5.216 1.868 . . . 1.0 . . . . . . . . . . . . A . 100 ILE HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 1526 . 1 1 100 ILE HG23 H 13.521 -4.605 3.507 . . . 1.0 . . . . . . . . . . . . A . 100 ILE HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 1527 . 1 1 100 ILE N N 14.555 -8.592 3.660 . . . 1.0 . . . . . . . . . . . . A . 100 ILE N . . . . . . . . . c17360_2l7l 1 . 1 . 1528 . 1 1 100 ILE O O 15.462 -6.118 4.993 . . . 1.0 . . . . . . . . . . . . A . 100 ILE O . . . . . . . . . c17360_2l7l 1 . 1 . 1529 . 1 1 101 SER C C 16.907 -3.393 3.325 . . . 1.0 . . . . . . . . . . . . A . 101 SER C . . . . . . . . . c17360_2l7l 1 . 1 . 1530 . 1 1 101 SER CA C 17.386 -4.839 3.416 . . . 1.0 . . . . . . . . . . . . A . 101 SER CA . . . . . . . . . c17360_2l7l 1 . 1 . 1531 . 1 1 101 SER CB C 18.660 -5.012 2.588 . . . 1.0 . . . . . . . . . . . . A . 101 SER CB . . . . . . . . . c17360_2l7l 1 . 1 . 1532 . 1 1 101 SER H H 16.295 -5.952 1.984 . . . 1.0 . . . . . . . . . . . . A . 101 SER H . . . . . . . . . c17360_2l7l 1 . 1 . 1533 . 1 1 101 SER HA H 17.609 -5.065 4.451 . . . 1.0 . . . . . . . . . . . . A . 101 SER HA . . . . . . . . . c17360_2l7l 1 . 1 . 1534 . 1 1 101 SER HB2 H 19.513 -4.692 3.164 . . . 1.0 . . . . . . . . . . . . A . 101 SER HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1535 . 1 1 101 SER HB3 H 18.777 -6.054 2.324 . . . 1.0 . . . . . . . . . . . . A . 101 SER HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1536 . 1 1 101 SER HG H 17.666 -3.898 1.342 . . . 1.0 . . . . . . . . . . . . A . 101 SER HG . . . . . . . . . c17360_2l7l 1 . 1 . 1537 . 1 1 101 SER N N 16.348 -5.752 2.943 . . . 1.0 . . . . . . . . . . . . A . 101 SER N . . . . . . . . . c17360_2l7l 1 . 1 . 1538 . 1 1 101 SER O O 15.875 -3.108 2.716 . . . 1.0 . . . . . . . . . . . . A . 101 SER O . . . . . . . . . c17360_2l7l 1 . 1 . 1539 . 1 1 101 SER OG O 18.568 -4.218 1.414 . . . 1.0 . . . . . . . . . . . . A . 101 SER OG . . . . . . . . . c17360_2l7l 1 . 1 . 1540 . 1 1 102 ALA C C 17.405 -0.512 2.487 . . . 1.0 . . . . . . . . . . . . A . 102 ALA C . . . . . . . . . c17360_2l7l 1 . 1 . 1541 . 1 1 102 ALA CA C 17.320 -1.069 3.902 . . . 1.0 . . . . . . . . . . . . A . 102 ALA CA . . . . . . . . . c17360_2l7l 1 . 1 . 1542 . 1 1 102 ALA CB C 18.266 -0.285 4.812 . . . 1.0 . . . . . . . . . . . . A . 102 ALA CB . . . . . . . . . c17360_2l7l 1 . 1 . 1543 . 1 1 102 ALA H H 18.482 -2.773 4.389 . . . 1.0 . . . . . . . . . . . . A . 102 ALA H . . . . . . . . . c17360_2l7l 1 . 1 . 1544 . 1 1 102 ALA HA H 16.311 -0.944 4.259 . . . 1.0 . . . . . . . . . . . . A . 102 ALA HA . . . . . . . . . c17360_2l7l 1 . 1 . 1545 . 1 1 102 ALA HB1 H 18.111 -0.581 5.839 . . . 1.0 . . . . . . . . . . . . A . 102 ALA HB1 . . . . . . . . . c17360_2l7l 1 . 1 . 1546 . 1 1 102 ALA HB2 H 18.073 0.772 4.707 . . . 1.0 . . . . . . . . . . . . A . 102 ALA HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1547 . 1 1 102 ALA HB3 H 19.287 -0.493 4.529 . . . 1.0 . . . . . . . . . . . . A . 102 ALA HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1548 . 1 1 102 ALA N N 17.667 -2.486 3.927 . . . 1.0 . . . . . . . . . . . . A . 102 ALA N . . . . . . . . . c17360_2l7l 1 . 1 . 1549 . 1 1 102 ALA O O 16.575 0.299 2.079 . . . 1.0 . . . . . . . . . . . . A . 102 ALA O . . . . . . . . . c17360_2l7l 1 . 1 . 1550 . 1 1 103 ALA C C 17.362 -0.757 -0.462 . . . 1.0 . . . . . . . . . . . . A . 103 ALA C . . . . . . . . . c17360_2l7l 1 . 1 . 1551 . 1 1 103 ALA CA C 18.601 -0.478 0.379 . . . 1.0 . . . . . . . . . . . . A . 103 ALA CA . . . . . . . . . c17360_2l7l 1 . 1 . 1552 . 1 1 103 ALA CB C 19.808 -1.175 -0.252 . . . 1.0 . . . . . . . . . . . . A . 103 ALA CB . . . . . . . . . c17360_2l7l 1 . 1 . 1553 . 1 1 103 ALA H H 19.049 -1.595 2.122 . . . 1.0 . . . . . . . . . . . . A . 103 ALA H . . . . . . . . . c17360_2l7l 1 . 1 . 1554 . 1 1 103 ALA HA H 18.783 0.586 0.395 . . . 1.0 . . . . . . . . . . . . A . 103 ALA HA . . . . . . . . . c17360_2l7l 1 . 1 . 1555 . 1 1 103 ALA HB1 H 19.941 -0.819 -1.262 . . . 1.0 . . . . . . . . . . . . A . 103 ALA HB1 . . . . . . . . . c17360_2l7l 1 . 1 . 1556 . 1 1 103 ALA HB2 H 19.639 -2.242 -0.265 . . . 1.0 . . . . . . . . . . . . A . 103 ALA HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1557 . 1 1 103 ALA HB3 H 20.693 -0.957 0.327 . . . 1.0 . . . . . . . . . . . . A . 103 ALA HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1558 . 1 1 103 ALA N N 18.416 -0.949 1.744 . . . 1.0 . . . . . . . . . . . . A . 103 ALA N . . . . . . . . . c17360_2l7l 1 . 1 . 1559 . 1 1 103 ALA O O 16.866 0.126 -1.166 . . . 1.0 . . . . . . . . . . . . A . 103 ALA O . . . . . . . . . c17360_2l7l 1 . 1 . 1560 . 1 1 104 GLU C C 14.458 -1.617 -0.665 . . . 1.0 . . . . . . . . . . . . A . 104 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 1561 . 1 1 104 GLU CA C 15.688 -2.360 -1.163 . . . 1.0 . . . . . . . . . . . . A . 104 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 1562 . 1 1 104 GLU CB C 15.451 -3.863 -1.045 . . . 1.0 . . . . . . . . . . . . A . 104 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 1563 . 1 1 104 GLU CD C 16.388 -6.117 -1.571 . . . 1.0 . . . . . . . . . . . . A . 104 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 1564 . 1 1 104 GLU CG C 16.583 -4.616 -1.745 . . . 1.0 . . . . . . . . . . . . A . 104 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 1565 . 1 1 104 GLU H H 17.300 -2.652 0.181 . . . 1.0 . . . . . . . . . . . . A . 104 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 1566 . 1 1 104 GLU HA H 15.853 -2.112 -2.200 . . . 1.0 . . . . . . . . . . . . A . 104 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 1567 . 1 1 104 GLU HB2 H 15.422 -4.141 -0.001 . . . 1.0 . . . . . . . . . . . . A . 104 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1568 . 1 1 104 GLU HB3 H 14.512 -4.113 -1.510 . . . 1.0 . . . . . . . . . . . . A . 104 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1569 . 1 1 104 GLU HG2 H 16.579 -4.373 -2.796 . . . 1.0 . . . . . . . . . . . . A . 104 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1570 . 1 1 104 GLU HG3 H 17.528 -4.327 -1.312 . . . 1.0 . . . . . . . . . . . . A . 104 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1571 . 1 1 104 GLU N N 16.866 -1.988 -0.392 . . . 1.0 . . . . . . . . . . . . A . 104 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 1572 . 1 1 104 GLU O O 13.805 -0.907 -1.422 . . . 1.0 . . . . . . . . . . . . A . 104 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 1573 . 1 1 104 GLU OE1 O 15.389 -6.496 -0.986 . . . 1.0 . . . . . . . . . . . . A . 104 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1574 . 1 1 104 GLU OE2 O 17.239 -6.864 -2.026 . . . 1.0 . . . . . . . . . . . . A . 104 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1575 . 1 1 105 LEU C C 12.968 0.339 0.859 . . . 1.0 . . . . . . . . . . . . A . 105 LEU C . . . . . . . . . c17360_2l7l 1 . 1 . 1576 . 1 1 105 LEU CA C 12.963 -1.152 1.174 . . . 1.0 . . . . . . . . . . . . A . 105 LEU CA . . . . . . . . . c17360_2l7l 1 . 1 . 1577 . 1 1 105 LEU CB C 12.952 -1.355 2.686 . . . 1.0 . . . . . . . . . . . . A . 105 LEU CB . . . . . . . . . c17360_2l7l 1 . 1 . 1578 . 1 1 105 LEU CD1 C 11.099 -1.720 4.363 . . . 1.0 . . . . . . . . . . . . A . 105 LEU CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1579 . 1 1 105 LEU CD2 C 11.937 0.598 3.940 . . . 1.0 . . . . . . . . . . . . A . 105 LEU CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1580 . 1 1 105 LEU CG C 11.649 -0.768 3.297 . . . 1.0 . . . . . . . . . . . . A . 105 LEU CG . . . . . . . . . c17360_2l7l 1 . 1 . 1581 . 1 1 105 LEU H H 14.670 -2.401 1.166 . . . 1.0 . . . . . . . . . . . . A . 105 LEU H . . . . . . . . . c17360_2l7l 1 . 1 . 1582 . 1 1 105 LEU HA H 12.075 -1.606 0.762 . . . 1.0 . . . . . . . . . . . . A . 105 LEU HA . . . . . . . . . c17360_2l7l 1 . 1 . 1583 . 1 1 105 LEU HB2 H 13.017 -2.416 2.891 . . . 1.0 . . . . . . . . . . . . A . 105 LEU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1584 . 1 1 105 LEU HB3 H 13.814 -0.859 3.111 . . . 1.0 . . . . . . . . . . . . A . 105 LEU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1585 . 1 1 105 LEU HD11 H 10.652 -2.575 3.879 . . . 1.0 . . . . . . . . . . . . A . 105 LEU HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 1586 . 1 1 105 LEU HD12 H 10.356 -1.210 4.951 . . . 1.0 . . . . . . . . . . . . A . 105 LEU HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 1587 . 1 1 105 LEU HD13 H 11.904 -2.048 5.003 . . . 1.0 . . . . . . . . . . . . A . 105 LEU HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 1588 . 1 1 105 LEU HD21 H 12.438 0.452 4.886 . . . 1.0 . . . . . . . . . . . . A . 105 LEU HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 1589 . 1 1 105 LEU HD22 H 11.011 1.126 4.101 . . . 1.0 . . . . . . . . . . . . A . 105 LEU HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 1590 . 1 1 105 LEU HD23 H 12.571 1.176 3.284 . . . 1.0 . . . . . . . . . . . . A . 105 LEU HD23 . . . . . . . . . c17360_2l7l 1 . 1 . 1591 . 1 1 105 LEU HG H 10.899 -0.646 2.524 . . . 1.0 . . . . . . . . . . . . A . 105 LEU HG . . . . . . . . . c17360_2l7l 1 . 1 . 1592 . 1 1 105 LEU N N 14.135 -1.798 0.608 . . . 1.0 . . . . . . . . . . . . A . 105 LEU N . . . . . . . . . c17360_2l7l 1 . 1 . 1593 . 1 1 105 LEU O O 11.944 0.913 0.486 . . . 1.0 . . . . . . . . . . . . A . 105 LEU O . . . . . . . . . c17360_2l7l 1 . 1 . 1594 . 1 1 106 ARG C C 14.005 2.665 -0.743 . . . 1.0 . . . . . . . . . . . . A . 106 ARG C . . . . . . . . . c17360_2l7l 1 . 1 . 1595 . 1 1 106 ARG CA C 14.261 2.381 0.735 . . . 1.0 . . . . . . . . . . . . A . 106 ARG CA . . . . . . . . . c17360_2l7l 1 . 1 . 1596 . 1 1 106 ARG CB C 15.666 2.859 1.104 . . . 1.0 . . . . . . . . . . . . A . 106 ARG CB . . . . . . . . . c17360_2l7l 1 . 1 . 1597 . 1 1 106 ARG CD C 17.163 4.852 1.297 . . . 1.0 . . . . . . . . . . . . A . 106 ARG CD . . . . . . . . . c17360_2l7l 1 . 1 . 1598 . 1 1 106 ARG CG C 15.764 4.376 0.908 . . . 1.0 . . . . . . . . . . . . A . 106 ARG CG . . . . . . . . . c17360_2l7l 1 . 1 . 1599 . 1 1 106 ARG CZ C 19.456 4.490 0.581 . . . 1.0 . . . . . . . . . . . . A . 106 ARG CZ . . . . . . . . . c17360_2l7l 1 . 1 . 1600 . 1 1 106 ARG H H 14.904 0.452 1.322 . . . 1.0 . . . . . . . . . . . . A . 106 ARG H . . . . . . . . . c17360_2l7l 1 . 1 . 1601 . 1 1 106 ARG HA H 13.541 2.926 1.328 . . . 1.0 . . . . . . . . . . . . A . 106 ARG HA . . . . . . . . . c17360_2l7l 1 . 1 . 1602 . 1 1 106 ARG HB2 H 15.869 2.615 2.137 . . . 1.0 . . . . . . . . . . . . A . 106 ARG HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1603 . 1 1 106 ARG HB3 H 16.388 2.371 0.469 . . . 1.0 . . . . . . . . . . . . A . 106 ARG HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1604 . 1 1 106 ARG HD2 H 17.201 5.929 1.241 . . . 1.0 . . . . . . . . . . . . A . 106 ARG HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1605 . 1 1 106 ARG HD3 H 17.379 4.539 2.307 . . . 1.0 . . . . . . . . . . . . A . 106 ARG HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 1606 . 1 1 106 ARG HE H 17.860 3.751 -0.376 . . . 1.0 . . . . . . . . . . . . A . 106 ARG HE . . . . . . . . . c17360_2l7l 1 . 1 . 1607 . 1 1 106 ARG HG2 H 15.577 4.622 -0.127 . . . 1.0 . . . . . . . . . . . . A . 106 ARG HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1608 . 1 1 106 ARG HG3 H 15.033 4.868 1.533 . . . 1.0 . . . . . . . . . . . . A . 106 ARG HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1609 . 1 1 106 ARG HH11 H 19.194 5.599 2.226 . . . 1.0 . . . . . . . . . . . . A . 106 ARG HH11 . . . . . . . . . c17360_2l7l 1 . 1 . 1610 . 1 1 106 ARG HH12 H 20.838 5.356 1.740 . . . 1.0 . . . . . . . . . . . . A . 106 ARG HH12 . . . . . . . . . c17360_2l7l 1 . 1 . 1611 . 1 1 106 ARG HH21 H 20.015 3.427 -1.020 . . . 1.0 . . . . . . . . . . . . A . 106 ARG HH21 . . . . . . . . . c17360_2l7l 1 . 1 . 1612 . 1 1 106 ARG HH22 H 21.303 4.126 -0.098 . . . 1.0 . . . . . . . . . . . . A . 106 ARG HH22 . . . . . . . . . c17360_2l7l 1 . 1 . 1613 . 1 1 106 ARG N N 14.126 0.959 1.011 . . . 1.0 . . . . . . . . . . . . A . 106 ARG N . . . . . . . . . c17360_2l7l 1 . 1 . 1614 . 1 1 106 ARG NE N 18.157 4.289 0.389 . . . 1.0 . . . . . . . . . . . . A . 106 ARG NE . . . . . . . . . c17360_2l7l 1 . 1 . 1615 . 1 1 106 ARG NH1 N 19.861 5.204 1.594 . . . 1.0 . . . . . . . . . . . . A . 106 ARG NH1 . . . . . . . . . c17360_2l7l 1 . 1 . 1616 . 1 1 106 ARG NH2 N 20.326 3.974 -0.243 . . . 1.0 . . . . . . . . . . . . A . 106 ARG NH2 . . . . . . . . . c17360_2l7l 1 . 1 . 1617 . 1 1 106 ARG O O 13.440 3.700 -1.093 . . . 1.0 . . . . . . . . . . . . A . 106 ARG O . . . . . . . . . c17360_2l7l 1 . 1 . 1618 . 1 1 107 HIS C C 12.773 1.940 -3.419 . . . 1.0 . . . . . . . . . . . . A . 107 HIS C . . . . . . . . . c17360_2l7l 1 . 1 . 1619 . 1 1 107 HIS CA C 14.253 1.923 -3.044 . . . 1.0 . . . . . . . . . . . . A . 107 HIS CA . . . . . . . . . c17360_2l7l 1 . 1 . 1620 . 1 1 107 HIS CB C 14.952 0.785 -3.792 . . . 1.0 . . . . . . . . . . . . A . 107 HIS CB . . . . . . . . . c17360_2l7l 1 . 1 . 1621 . 1 1 107 HIS CD2 C 15.554 1.631 -6.201 . . . 1.0 . . . . . . . . . . . . A . 107 HIS CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1622 . 1 1 107 HIS CE1 C 13.850 0.809 -7.258 . . . 1.0 . . . . . . . . . . . . A . 107 HIS CE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1623 . 1 1 107 HIS CG C 14.786 0.979 -5.271 . . . 1.0 . . . . . . . . . . . . A . 107 HIS CG . . . . . . . . . c17360_2l7l 1 . 1 . 1624 . 1 1 107 HIS H H 14.873 0.931 -1.277 . . . 1.0 . . . . . . . . . . . . A . 107 HIS H . . . . . . . . . c17360_2l7l 1 . 1 . 1625 . 1 1 107 HIS HA H 14.703 2.859 -3.341 . . . 1.0 . . . . . . . . . . . . A . 107 HIS HA . . . . . . . . . c17360_2l7l 1 . 1 . 1626 . 1 1 107 HIS HB2 H 16.003 0.781 -3.544 . . . 1.0 . . . . . . . . . . . . A . 107 HIS HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1627 . 1 1 107 HIS HB3 H 14.512 -0.158 -3.505 . . . 1.0 . . . . . . . . . . . . A . 107 HIS HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1628 . 1 1 107 HIS HD2 H 16.479 2.147 -5.992 . . . 1.0 . . . . . . . . . . . . A . 107 HIS HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1629 . 1 1 107 HIS HE1 H 13.153 0.543 -8.039 . . . 1.0 . . . . . . . . . . . . A . 107 HIS HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1630 . 1 1 107 HIS HE2 H 15.289 1.890 -8.302 . . . 1.0 . . . . . . . . . . . . A . 107 HIS HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1631 . 1 1 107 HIS N N 14.436 1.746 -1.606 . . . 1.0 . . . . . . . . . . . . A . 107 HIS N . . . . . . . . . c17360_2l7l 1 . 1 . 1632 . 1 1 107 HIS ND1 N 13.704 0.463 -5.966 . . . 1.0 . . . . . . . . . . . . A . 107 HIS ND1 . . . . . . . . . c17360_2l7l 1 . 1 . 1633 . 1 1 107 HIS NE2 N 14.962 1.522 -7.455 . . . 1.0 . . . . . . . . . . . . A . 107 HIS NE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1634 . 1 1 107 HIS O O 12.305 2.853 -4.100 . . . 1.0 . . . . . . . . . . . . A . 107 HIS O . . . . . . . . . c17360_2l7l 1 . 1 . 1635 . 1 1 108 VAL C C 9.868 2.012 -2.652 . . . 1.0 . . . . . . . . . . . . A . 108 VAL C . . . . . . . . . c17360_2l7l 1 . 1 . 1636 . 1 1 108 VAL CA C 10.617 0.837 -3.267 . . . 1.0 . . . . . . . . . . . . A . 108 VAL CA . . . . . . . . . c17360_2l7l 1 . 1 . 1637 . 1 1 108 VAL CB C 10.048 -0.482 -2.737 . . . 1.0 . . . . . . . . . . . . A . 108 VAL CB . . . . . . . . . c17360_2l7l 1 . 1 . 1638 . 1 1 108 VAL CG1 C 10.605 -1.649 -3.556 . . . 1.0 . . . . . . . . . . . . A . 108 VAL CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 1639 . 1 1 108 VAL CG2 C 10.458 -0.658 -1.277 . . . 1.0 . . . . . . . . . . . . A . 108 VAL CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1640 . 1 1 108 VAL H H 12.472 0.231 -2.432 . . . 1.0 . . . . . . . . . . . . A . 108 VAL H . . . . . . . . . c17360_2l7l 1 . 1 . 1641 . 1 1 108 VAL HA H 10.484 0.867 -4.339 . . . 1.0 . . . . . . . . . . . . A . 108 VAL HA . . . . . . . . . c17360_2l7l 1 . 1 . 1642 . 1 1 108 VAL HB H 8.970 -0.467 -2.812 . . . 1.0 . . . . . . . . . . . . A . 108 VAL HB . . . . . . . . . c17360_2l7l 1 . 1 . 1643 . 1 1 108 VAL HG11 H 10.480 -1.444 -4.609 . . . 1.0 . . . . . . . . . . . . A . 108 VAL HG11 . . . . . . . . . c17360_2l7l 1 . 1 . 1644 . 1 1 108 VAL HG12 H 10.075 -2.554 -3.302 . . . 1.0 . . . . . . . . . . . . A . 108 VAL HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 1645 . 1 1 108 VAL HG13 H 11.656 -1.774 -3.337 . . . 1.0 . . . . . . . . . . . . A . 108 VAL HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 1646 . 1 1 108 VAL HG21 H 11.529 -0.620 -1.209 . . . 1.0 . . . . . . . . . . . . A . 108 VAL HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 1647 . 1 1 108 VAL HG22 H 10.108 -1.612 -0.913 . . . 1.0 . . . . . . . . . . . . A . 108 VAL HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 1648 . 1 1 108 VAL HG23 H 10.030 0.135 -0.682 . . . 1.0 . . . . . . . . . . . . A . 108 VAL HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 1649 . 1 1 108 VAL N N 12.043 0.928 -2.970 . . . 1.0 . . . . . . . . . . . . A . 108 VAL N . . . . . . . . . c17360_2l7l 1 . 1 . 1650 . 1 1 108 VAL O O 8.951 2.560 -3.261 . . . 1.0 . . . . . . . . . . . . A . 108 VAL O . . . . . . . . . c17360_2l7l 1 . 1 . 1651 . 1 1 109 MET C C 9.833 4.803 -1.543 . . . 1.0 . . . . . . . . . . . . A . 109 MET C . . . . . . . . . c17360_2l7l 1 . 1 . 1652 . 1 1 109 MET CA C 9.617 3.509 -0.766 . . . 1.0 . . . . . . . . . . . . A . 109 MET CA . . . . . . . . . c17360_2l7l 1 . 1 . 1653 . 1 1 109 MET CB C 10.191 3.652 0.647 . . . 1.0 . . . . . . . . . . . . A . 109 MET CB . . . . . . . . . c17360_2l7l 1 . 1 . 1654 . 1 1 109 MET CE C 7.817 2.649 3.634 . . . 1.0 . . . . . . . . . . . . A . 109 MET CE . . . . . . . . . c17360_2l7l 1 . 1 . 1655 . 1 1 109 MET CG C 9.600 2.578 1.560 . . . 1.0 . . . . . . . . . . . . A . 109 MET CG . . . . . . . . . c17360_2l7l 1 . 1 . 1656 . 1 1 109 MET H H 10.999 1.925 -1.003 . . . 1.0 . . . . . . . . . . . . A . 109 MET H . . . . . . . . . c17360_2l7l 1 . 1 . 1657 . 1 1 109 MET HA H 8.559 3.315 -0.701 . . . 1.0 . . . . . . . . . . . . A . 109 MET HA . . . . . . . . . c17360_2l7l 1 . 1 . 1658 . 1 1 109 MET HB2 H 11.264 3.539 0.612 . . . 1.0 . . . . . . . . . . . . A . 109 MET HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1659 . 1 1 109 MET HB3 H 9.944 4.626 1.037 . . . 1.0 . . . . . . . . . . . . A . 109 MET HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1660 . 1 1 109 MET HE1 H 6.803 2.438 3.954 . . . 1.0 . . . . . . . . . . . . A . 109 MET HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1661 . 1 1 109 MET HE2 H 8.177 3.529 4.142 . . . 1.0 . . . . . . . . . . . . A . 109 MET HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1662 . 1 1 109 MET HE3 H 8.456 1.813 3.875 . . . 1.0 . . . . . . . . . . . . A . 109 MET HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 1663 . 1 1 109 MET HG2 H 9.706 1.611 1.090 . . . 1.0 . . . . . . . . . . . . A . 109 MET HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1664 . 1 1 109 MET HG3 H 10.132 2.583 2.498 . . . 1.0 . . . . . . . . . . . . A . 109 MET HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1665 . 1 1 109 MET N N 10.262 2.395 -1.445 . . . 1.0 . . . . . . . . . . . . A . 109 MET N . . . . . . . . . c17360_2l7l 1 . 1 . 1666 . 1 1 109 MET O O 8.923 5.623 -1.665 . . . 1.0 . . . . . . . . . . . . A . 109 MET O . . . . . . . . . c17360_2l7l 1 . 1 . 1667 . 1 1 109 MET SD S 7.841 2.925 1.844 . . . 1.0 . . . . . . . . . . . . A . 109 MET SD . . . . . . . . . c17360_2l7l 1 . 1 . 1668 . 1 1 110 THR C C 10.576 6.189 -4.145 . . . 1.0 . . . . . . . . . . . . A . 110 THR C . . . . . . . . . c17360_2l7l 1 . 1 . 1669 . 1 1 110 THR CA C 11.365 6.165 -2.840 . . . 1.0 . . . . . . . . . . . . A . 110 THR CA . . . . . . . . . c17360_2l7l 1 . 1 . 1670 . 1 1 110 THR CB C 12.863 6.207 -3.141 . . . 1.0 . . . . . . . . . . . . A . 110 THR CB . . . . . . . . . c17360_2l7l 1 . 1 . 1671 . 1 1 110 THR CG2 C 13.175 7.429 -4.006 . . . 1.0 . . . . . . . . . . . . A . 110 THR CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1672 . 1 1 110 THR H H 11.721 4.281 -1.945 . . . 1.0 . . . . . . . . . . . . A . 110 THR H . . . . . . . . . c17360_2l7l 1 . 1 . 1673 . 1 1 110 THR HA H 11.103 7.037 -2.261 . . . 1.0 . . . . . . . . . . . . A . 110 THR HA . . . . . . . . . c17360_2l7l 1 . 1 . 1674 . 1 1 110 THR HB H 13.151 5.313 -3.671 . . . 1.0 . . . . . . . . . . . . A . 110 THR HB . . . . . . . . . c17360_2l7l 1 . 1 . 1675 . 1 1 110 THR HG1 H 13.077 5.838 -1.244 . . . 1.0 . . . . . . . . . . . . A . 110 THR HG1 . . . . . . . . . c17360_2l7l 1 . 1 . 1676 . 1 1 110 THR HG21 H 12.831 7.254 -5.015 . . . 1.0 . . . . . . . . . . . . A . 110 THR HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 1677 . 1 1 110 THR HG22 H 14.241 7.602 -4.015 . . . 1.0 . . . . . . . . . . . . A . 110 THR HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 1678 . 1 1 110 THR HG23 H 12.674 8.296 -3.601 . . . 1.0 . . . . . . . . . . . . A . 110 THR HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 1679 . 1 1 110 THR N N 11.039 4.974 -2.069 . . . 1.0 . . . . . . . . . . . . A . 110 THR N . . . . . . . . . c17360_2l7l 1 . 1 . 1680 . 1 1 110 THR O O 10.248 7.254 -4.666 . . . 1.0 . . . . . . . . . . . . A . 110 THR O . . . . . . . . . c17360_2l7l 1 . 1 . 1681 . 1 1 110 THR OG1 O 13.585 6.290 -1.921 . . . 1.0 . . . . . . . . . . . . A . 110 THR OG1 . . . . . . . . . c17360_2l7l 1 . 1 . 1682 . 1 1 111 ASN C C 8.144 5.509 -5.761 . . . 1.0 . . . . . . . . . . . . A . 111 ASN C . . . . . . . . . c17360_2l7l 1 . 1 . 1683 . 1 1 111 ASN CA C 9.532 4.894 -5.916 . . . 1.0 . . . . . . . . . . . . A . 111 ASN CA . . . . . . . . . c17360_2l7l 1 . 1 . 1684 . 1 1 111 ASN CB C 9.403 3.424 -6.320 . . . 1.0 . . . . . . . . . . . . A . 111 ASN CB . . . . . . . . . c17360_2l7l 1 . 1 . 1685 . 1 1 111 ASN CG C 10.784 2.788 -6.418 . . . 1.0 . . . . . . . . . . . . A . 111 ASN CG . . . . . . . . . c17360_2l7l 1 . 1 . 1686 . 1 1 111 ASN H H 10.567 4.185 -4.209 . . . 1.0 . . . . . . . . . . . . A . 111 ASN H . . . . . . . . . c17360_2l7l 1 . 1 . 1687 . 1 1 111 ASN HA H 10.064 5.423 -6.691 . . . 1.0 . . . . . . . . . . . . A . 111 ASN HA . . . . . . . . . c17360_2l7l 1 . 1 . 1688 . 1 1 111 ASN HB2 H 8.816 2.897 -5.583 . . . 1.0 . . . . . . . . . . . . A . 111 ASN HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1689 . 1 1 111 ASN HB3 H 8.917 3.360 -7.279 . . . 1.0 . . . . . . . . . . . . A . 111 ASN HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1690 . 1 1 111 ASN HD21 H 11.751 4.514 -6.261 . . . 1.0 . . . . . . . . . . . . A . 111 ASN HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 1691 . 1 1 111 ASN HD22 H 12.737 3.142 -6.426 . . . 1.0 . . . . . . . . . . . . A . 111 ASN HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 1692 . 1 1 111 ASN N N 10.279 5.003 -4.669 . . . 1.0 . . . . . . . . . . . . A . 111 ASN N . . . . . . . . . c17360_2l7l 1 . 1 . 1693 . 1 1 111 ASN ND2 N 11.845 3.544 -6.363 . . . 1.0 . . . . . . . . . . . . A . 111 ASN ND2 . . . . . . . . . c17360_2l7l 1 . 1 . 1694 . 1 1 111 ASN O O 7.619 6.125 -6.688 . . . 1.0 . . . . . . . . . . . . A . 111 ASN O . . . . . . . . . c17360_2l7l 1 . 1 . 1695 . 1 1 111 ASN OD1 O 10.899 1.569 -6.547 . . . 1.0 . . . . . . . . . . . . A . 111 ASN OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1696 . 1 1 112 LEU C C 6.282 7.396 -4.185 . . . 1.0 . . . . . . . . . . . . A . 112 LEU C . . . . . . . . . c17360_2l7l 1 . 1 . 1697 . 1 1 112 LEU CA C 6.228 5.882 -4.315 . . . 1.0 . . . . . . . . . . . . A . 112 LEU CA . . . . . . . . . c17360_2l7l 1 . 1 . 1698 . 1 1 112 LEU CB C 5.666 5.277 -3.028 . . . 1.0 . . . . . . . . . . . . A . 112 LEU CB . . . . . . . . . c17360_2l7l 1 . 1 . 1699 . 1 1 112 LEU CD1 C 4.975 3.143 -1.912 . . . 1.0 . . . . . . . . . . . . A . 112 LEU CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1700 . 1 1 112 LEU CD2 C 4.175 3.643 -4.253 . . . 1.0 . . . . . . . . . . . . A . 112 LEU CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1701 . 1 1 112 LEU CG C 5.345 3.792 -3.252 . . . 1.0 . . . . . . . . . . . . A . 112 LEU CG . . . . . . . . . c17360_2l7l 1 . 1 . 1702 . 1 1 112 LEU H H 8.022 4.841 -3.880 . . . 1.0 . . . . . . . . . . . . A . 112 LEU H . . . . . . . . . c17360_2l7l 1 . 1 . 1703 . 1 1 112 LEU HA H 5.577 5.631 -5.136 . . . 1.0 . . . . . . . . . . . . A . 112 LEU HA . . . . . . . . . c17360_2l7l 1 . 1 . 1704 . 1 1 112 LEU HB2 H 6.398 5.372 -2.240 . . . 1.0 . . . . . . . . . . . . A . 112 LEU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1705 . 1 1 112 LEU HB3 H 4.766 5.802 -2.745 . . . 1.0 . . . . . . . . . . . . A . 112 LEU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1706 . 1 1 112 LEU HD11 H 4.956 2.070 -2.027 . . . 1.0 . . . . . . . . . . . . A . 112 LEU HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 1707 . 1 1 112 LEU HD12 H 3.999 3.488 -1.604 . . . 1.0 . . . . . . . . . . . . A . 112 LEU HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 1708 . 1 1 112 LEU HD13 H 5.706 3.413 -1.165 . . . 1.0 . . . . . . . . . . . . A . 112 LEU HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 1709 . 1 1 112 LEU HD21 H 4.574 3.541 -5.251 . . . 1.0 . . . . . . . . . . . . A . 112 LEU HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 1710 . 1 1 112 LEU HD22 H 3.537 4.515 -4.214 . . . 1.0 . . . . . . . . . . . . A . 112 LEU HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 1711 . 1 1 112 LEU HD23 H 3.591 2.766 -4.015 . . . 1.0 . . . . . . . . . . . . A . 112 LEU HD23 . . . . . . . . . c17360_2l7l 1 . 1 . 1712 . 1 1 112 LEU HG H 6.219 3.301 -3.650 . . . 1.0 . . . . . . . . . . . . A . 112 LEU HG . . . . . . . . . c17360_2l7l 1 . 1 . 1713 . 1 1 112 LEU N N 7.556 5.339 -4.583 . . . 1.0 . . . . . . . . . . . . A . 112 LEU N . . . . . . . . . c17360_2l7l 1 . 1 . 1714 . 1 1 112 LEU O O 5.262 8.047 -3.959 . . . 1.0 . . . . . . . . . . . . A . 112 LEU O . . . . . . . . . c17360_2l7l 1 . 1 . 1715 . 1 1 113 GLY C C 7.853 9.817 -2.779 . . . 1.0 . . . . . . . . . . . . A . 113 GLY C . . . . . . . . . c17360_2l7l 1 . 1 . 1716 . 1 1 113 GLY CA C 7.660 9.395 -4.229 . . . 1.0 . . . . . . . . . . . . A . 113 GLY CA . . . . . . . . . c17360_2l7l 1 . 1 . 1717 . 1 1 113 GLY H H 8.254 7.382 -4.510 . . . 1.0 . . . . . . . . . . . . A . 113 GLY H . . . . . . . . . c17360_2l7l 1 . 1 . 1718 . 1 1 113 GLY HA2 H 8.528 9.685 -4.803 . . . 1.0 . . . . . . . . . . . . A . 113 GLY HA2 . . . . . . . . . c17360_2l7l 1 . 1 . 1719 . 1 1 113 GLY HA3 H 6.789 9.894 -4.627 . . . 1.0 . . . . . . . . . . . . A . 113 GLY HA3 . . . . . . . . . c17360_2l7l 1 . 1 . 1720 . 1 1 113 GLY N N 7.478 7.952 -4.329 . . . 1.0 . . . . . . . . . . . . A . 113 GLY N . . . . . . . . . c17360_2l7l 1 . 1 . 1721 . 1 1 113 GLY O O 7.863 11.007 -2.466 . . . 1.0 . . . . . . . . . . . . A . 113 GLY O . . . . . . . . . c17360_2l7l 1 . 1 . 1722 . 1 1 114 GLU C C 9.685 9.353 -0.194 . . . 1.0 . . . . . . . . . . . . A . 114 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 1723 . 1 1 114 GLU CA C 8.209 9.116 -0.477 . . . 1.0 . . . . . . . . . . . . A . 114 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 1724 . 1 1 114 GLU CB C 7.702 7.947 0.367 . . . 1.0 . . . . . . . . . . . . A . 114 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 1725 . 1 1 114 GLU CD C 6.596 9.383 2.094 . . . 1.0 . . . . . . . . . . . . A . 114 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 1726 . 1 1 114 GLU CG C 7.690 8.348 1.843 . . . 1.0 . . . . . . . . . . . . A . 114 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 1727 . 1 1 114 GLU H H 7.997 7.904 -2.204 . . . 1.0 . . . . . . . . . . . . A . 114 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 1728 . 1 1 114 GLU HA H 7.656 10.006 -0.213 . . . 1.0 . . . . . . . . . . . . A . 114 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 1729 . 1 1 114 GLU HB2 H 6.702 7.687 0.054 . . . 1.0 . . . . . . . . . . . . A . 114 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1730 . 1 1 114 GLU HB3 H 8.354 7.097 0.231 . . . 1.0 . . . . . . . . . . . . A . 114 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1731 . 1 1 114 GLU HG2 H 7.504 7.474 2.449 . . . 1.0 . . . . . . . . . . . . A . 114 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1732 . 1 1 114 GLU HG3 H 8.646 8.771 2.108 . . . 1.0 . . . . . . . . . . . . A . 114 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1733 . 1 1 114 GLU N N 8.011 8.834 -1.896 . . . 1.0 . . . . . . . . . . . . A . 114 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 1734 . 1 1 114 GLU O O 10.534 8.542 -0.561 . . . 1.0 . . . . . . . . . . . . A . 114 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 1735 . 1 1 114 GLU OE1 O 5.827 9.642 1.183 . . . 1.0 . . . . . . . . . . . . A . 114 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1736 . 1 1 114 GLU OE2 O 6.544 9.902 3.197 . . . 1.0 . . . . . . . . . . . . A . 114 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1737 . 1 1 115 LYS C C 11.731 10.345 2.183 . . . 1.0 . . . . . . . . . . . . A . 115 LYS C . . . . . . . . . c17360_2l7l 1 . 1 . 1738 . 1 1 115 LYS CA C 11.369 10.810 0.779 . . . 1.0 . . . . . . . . . . . . A . 115 LYS CA . . . . . . . . . c17360_2l7l 1 . 1 . 1739 . 1 1 115 LYS CB C 11.564 12.328 0.678 . . . 1.0 . . . . . . . . . . . . A . 115 LYS CB . . . . . . . . . c17360_2l7l 1 . 1 . 1740 . 1 1 115 LYS CD C 11.250 12.219 -1.806 . . . 1.0 . . . . . . . . . . . . A . 115 LYS CD . . . . . . . . . c17360_2l7l 1 . 1 . 1741 . 1 1 115 LYS CE C 10.543 12.860 -2.997 . . . 1.0 . . . . . . . . . . . . A . 115 LYS CE . . . . . . . . . c17360_2l7l 1 . 1 . 1742 . 1 1 115 LYS CG C 10.769 12.878 -0.512 . . . 1.0 . . . . . . . . . . . . A . 115 LYS CG . . . . . . . . . c17360_2l7l 1 . 1 . 1743 . 1 1 115 LYS H H 9.267 11.077 0.729 . . . 1.0 . . . . . . . . . . . . A . 115 LYS H . . . . . . . . . c17360_2l7l 1 . 1 . 1744 . 1 1 115 LYS HA H 12.036 10.329 0.077 . . . 1.0 . . . . . . . . . . . . A . 115 LYS HA . . . . . . . . . c17360_2l7l 1 . 1 . 1745 . 1 1 115 LYS HB2 H 11.221 12.801 1.587 . . . 1.0 . . . . . . . . . . . . A . 115 LYS HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1746 . 1 1 115 LYS HB3 H 12.612 12.547 0.534 . . . 1.0 . . . . . . . . . . . . A . 115 LYS HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1747 . 1 1 115 LYS HD2 H 12.317 12.350 -1.904 . . . 1.0 . . . . . . . . . . . . A . 115 LYS HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1748 . 1 1 115 LYS HD3 H 11.015 11.166 -1.783 . . . 1.0 . . . . . . . . . . . . A . 115 LYS HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 1749 . 1 1 115 LYS HE2 H 10.750 12.288 -3.888 . . . 1.0 . . . . . . . . . . . . A . 115 LYS HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1750 . 1 1 115 LYS HE3 H 9.478 12.877 -2.817 . . . 1.0 . . . . . . . . . . . . A . 115 LYS HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 1751 . 1 1 115 LYS HG2 H 9.716 12.673 -0.371 . . . 1.0 . . . . . . . . . . . . A . 115 LYS HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1752 . 1 1 115 LYS HG3 H 10.918 13.945 -0.579 . . . 1.0 . . . . . . . . . . . . A . 115 LYS HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1753 . 1 1 115 LYS HZ1 H 11.109 14.470 -4.187 . . . 1.0 . . . . . . . . . . . . A . 115 LYS HZ1 . . . . . . . . . c17360_2l7l 1 . 1 . 1754 . 1 1 115 LYS HZ2 H 11.979 14.342 -2.732 . . . 1.0 . . . . . . . . . . . . A . 115 LYS HZ2 . . . . . . . . . c17360_2l7l 1 . 1 . 1755 . 1 1 115 LYS HZ3 H 10.379 14.916 -2.722 . . . 1.0 . . . . . . . . . . . . A . 115 LYS HZ3 . . . . . . . . . c17360_2l7l 1 . 1 . 1756 . 1 1 115 LYS N N 9.987 10.470 0.457 . . . 1.0 . . . . . . . . . . . . A . 115 LYS N . . . . . . . . . c17360_2l7l 1 . 1 . 1757 . 1 1 115 LYS NZ N 11.040 14.252 -3.173 . . . 1.0 . . . . . . . . . . . . A . 115 LYS NZ . . . . . . . . . c17360_2l7l 1 . 1 . 1758 . 1 1 115 LYS O O 11.485 11.049 3.163 . . . 1.0 . . . . . . . . . . . . A . 115 LYS O . . . . . . . . . c17360_2l7l 1 . 1 . 1759 . 1 1 116 LEU C C 14.218 8.619 3.702 . . . 1.0 . . . . . . . . . . . . A . 116 LEU C . . . . . . . . . c17360_2l7l 1 . 1 . 1760 . 1 1 116 LEU CA C 12.704 8.598 3.572 . . . 1.0 . . . . . . . . . . . . A . 116 LEU CA . . . . . . . . . c17360_2l7l 1 . 1 . 1761 . 1 1 116 LEU CB C 12.203 7.158 3.699 . . . 1.0 . . . . . . . . . . . . A . 116 LEU CB . . . . . . . . . c17360_2l7l 1 . 1 . 1762 . 1 1 116 LEU CD1 C 10.198 5.665 3.557 . . . 1.0 . . . . . . . . . . . . A . 116 LEU CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1763 . 1 1 116 LEU CD2 C 9.937 8.032 4.350 . . . 1.0 . . . . . . . . . . . . A . 116 LEU CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1764 . 1 1 116 LEU CG C 10.701 7.104 3.393 . . . 1.0 . . . . . . . . . . . . A . 116 LEU CG . . . . . . . . . c17360_2l7l 1 . 1 . 1765 . 1 1 116 LEU H H 12.462 8.629 1.462 . . . 1.0 . . . . . . . . . . . . A . 116 LEU H . . . . . . . . . c17360_2l7l 1 . 1 . 1766 . 1 1 116 LEU HA H 12.279 9.190 4.370 . . . 1.0 . . . . . . . . . . . . A . 116 LEU HA . . . . . . . . . c17360_2l7l 1 . 1 . 1767 . 1 1 116 LEU HB2 H 12.736 6.528 3.002 . . . 1.0 . . . . . . . . . . . . A . 116 LEU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1768 . 1 1 116 LEU HB3 H 12.374 6.805 4.705 . . . 1.0 . . . . . . . . . . . . A . 116 LEU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1769 . 1 1 116 LEU HD11 H 9.244 5.560 3.061 . . . 1.0 . . . . . . . . . . . . A . 116 LEU HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 1770 . 1 1 116 LEU HD12 H 10.082 5.442 4.607 . . . 1.0 . . . . . . . . . . . . A . 116 LEU HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 1771 . 1 1 116 LEU HD13 H 10.909 4.979 3.120 . . . 1.0 . . . . . . . . . . . . A . 116 LEU HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 1772 . 1 1 116 LEU HD21 H 8.899 7.733 4.395 . . . 1.0 . . . . . . . . . . . . A . 116 LEU HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 1773 . 1 1 116 LEU HD22 H 9.999 9.049 3.992 . . . 1.0 . . . . . . . . . . . . A . 116 LEU HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 1774 . 1 1 116 LEU HD23 H 10.370 7.972 5.338 . . . 1.0 . . . . . . . . . . . . A . 116 LEU HD23 . . . . . . . . . c17360_2l7l 1 . 1 . 1775 . 1 1 116 LEU HG H 10.537 7.423 2.373 . . . 1.0 . . . . . . . . . . . . A . 116 LEU HG . . . . . . . . . c17360_2l7l 1 . 1 . 1776 . 1 1 116 LEU N N 12.317 9.155 2.277 . . . 1.0 . . . . . . . . . . . . A . 116 LEU N . . . . . . . . . c17360_2l7l 1 . 1 . 1777 . 1 1 116 LEU O O 14.941 8.379 2.736 . . . 1.0 . . . . . . . . . . . . A . 116 LEU O . . . . . . . . . c17360_2l7l 1 . 1 . 1778 . 1 1 117 THR C C 16.632 7.642 5.690 . . . 1.0 . . . . . . . . . . . . A . 117 THR C . . . . . . . . . c17360_2l7l 1 . 1 . 1779 . 1 1 117 THR CA C 16.122 8.983 5.178 . . . 1.0 . . . . . . . . . . . . A . 117 THR CA . . . . . . . . . c17360_2l7l 1 . 1 . 1780 . 1 1 117 THR CB C 16.415 10.072 6.211 . . . 1.0 . . . . . . . . . . . . A . 117 THR CB . . . . . . . . . c17360_2l7l 1 . 1 . 1781 . 1 1 117 THR CG2 C 15.556 11.303 5.915 . . . 1.0 . . . . . . . . . . . . A . 117 THR CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1782 . 1 1 117 THR H H 14.055 9.093 5.637 . . . 1.0 . . . . . . . . . . . . A . 117 THR H . . . . . . . . . c17360_2l7l 1 . 1 . 1783 . 1 1 117 THR HA H 16.645 9.228 4.263 . . . 1.0 . . . . . . . . . . . . A . 117 THR HA . . . . . . . . . c17360_2l7l 1 . 1 . 1784 . 1 1 117 THR HB H 17.457 10.346 6.159 . . . 1.0 . . . . . . . . . . . . A . 117 THR HB . . . . . . . . . c17360_2l7l 1 . 1 . 1785 . 1 1 117 THR HG1 H 15.587 8.787 7.412 . . . 1.0 . . . . . . . . . . . . A . 117 THR HG1 . . . . . . . . . c17360_2l7l 1 . 1 . 1786 . 1 1 117 THR HG21 H 14.515 11.061 6.072 . . . 1.0 . . . . . . . . . . . . A . 117 THR HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 1787 . 1 1 117 THR HG22 H 15.705 11.608 4.890 . . . 1.0 . . . . . . . . . . . . A . 117 THR HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 1788 . 1 1 117 THR HG23 H 15.843 12.108 6.575 . . . 1.0 . . . . . . . . . . . . A . 117 THR HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 1789 . 1 1 117 THR N N 14.688 8.919 4.910 . . . 1.0 . . . . . . . . . . . . A . 117 THR N . . . . . . . . . c17360_2l7l 1 . 1 . 1790 . 1 1 117 THR O O 15.848 6.747 6.001 . . . 1.0 . . . . . . . . . . . . A . 117 THR O . . . . . . . . . c17360_2l7l 1 . 1 . 1791 . 1 1 117 THR OG1 O 16.116 9.583 7.510 . . . 1.0 . . . . . . . . . . . . A . 117 THR OG1 . . . . . . . . . c17360_2l7l 1 . 1 . 1792 . 1 1 118 ASP C C 18.119 5.985 7.669 . . . 1.0 . . . . . . . . . . . . A . 118 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 1793 . 1 1 118 ASP CA C 18.556 6.269 6.235 . . . 1.0 . . . . . . . . . . . . A . 118 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 1794 . 1 1 118 ASP CB C 20.088 6.384 6.167 . . . 1.0 . . . . . . . . . . . . A . 118 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 1795 . 1 1 118 ASP CG C 20.587 6.112 4.747 . . . 1.0 . . . . . . . . . . . . A . 118 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 1796 . 1 1 118 ASP H H 18.527 8.251 5.496 . . . 1.0 . . . . . . . . . . . . A . 118 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 1797 . 1 1 118 ASP HA H 18.229 5.455 5.608 . . . 1.0 . . . . . . . . . . . . A . 118 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 1798 . 1 1 118 ASP HB2 H 20.384 7.379 6.462 . . . 1.0 . . . . . . . . . . . . A . 118 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1799 . 1 1 118 ASP HB3 H 20.535 5.666 6.841 . . . 1.0 . . . . . . . . . . . . A . 118 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1800 . 1 1 118 ASP N N 17.949 7.508 5.768 . . . 1.0 . . . . . . . . . . . . A . 118 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 1801 . 1 1 118 ASP O O 17.930 4.831 8.053 . . . 1.0 . . . . . . . . . . . . A . 118 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 1802 . 1 1 118 ASP OD1 O 19.844 5.530 3.976 . . . 1.0 . . . . . . . . . . . . A . 118 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1803 . 1 1 118 ASP OD2 O 21.708 6.495 4.454 . . . 1.0 . . . . . . . . . . . . A . 118 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1804 . 1 1 119 GLU C C 16.113 6.347 9.910 . . . 1.0 . . . . . . . . . . . . A . 119 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 1805 . 1 1 119 GLU CA C 17.540 6.885 9.843 . . . 1.0 . . . . . . . . . . . . A . 119 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 1806 . 1 1 119 GLU CB C 17.616 8.231 10.565 . . . 1.0 . . . . . . . . . . . . A . 119 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 1807 . 1 1 119 GLU CD C 17.411 9.363 12.787 . . . 1.0 . . . . . . . . . . . . A . 119 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 1808 . 1 1 119 GLU CG C 17.272 8.040 12.044 . . . 1.0 . . . . . . . . . . . . A . 119 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 1809 . 1 1 119 GLU H H 18.117 7.940 8.098 . . . 1.0 . . . . . . . . . . . . A . 119 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 1810 . 1 1 119 GLU HA H 18.202 6.187 10.331 . . . 1.0 . . . . . . . . . . . . A . 119 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 1811 . 1 1 119 GLU HB2 H 18.616 8.630 10.477 . . . 1.0 . . . . . . . . . . . . A . 119 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1812 . 1 1 119 GLU HB3 H 16.913 8.919 10.121 . . . 1.0 . . . . . . . . . . . . A . 119 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1813 . 1 1 119 GLU HG2 H 16.255 7.686 12.134 . . . 1.0 . . . . . . . . . . . . A . 119 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1814 . 1 1 119 GLU HG3 H 17.943 7.315 12.478 . . . 1.0 . . . . . . . . . . . . A . 119 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1815 . 1 1 119 GLU N N 17.958 7.042 8.457 . . . 1.0 . . . . . . . . . . . . A . 119 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 1816 . 1 1 119 GLU O O 15.811 5.466 10.713 . . . 1.0 . . . . . . . . . . . . A . 119 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 1817 . 1 1 119 GLU OE1 O 18.011 10.271 12.233 . . . 1.0 . . . . . . . . . . . . A . 119 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1818 . 1 1 119 GLU OE2 O 16.917 9.452 13.899 . . . 1.0 . . . . . . . . . . . . A . 119 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1819 . 1 1 120 GLU C C 13.754 4.994 8.565 . . . 1.0 . . . . . . . . . . . . A . 120 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 1820 . 1 1 120 GLU CA C 13.848 6.442 9.034 . . . 1.0 . . . . . . . . . . . . A . 120 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 1821 . 1 1 120 GLU CB C 13.037 7.342 8.101 . . . 1.0 . . . . . . . . . . . . A . 120 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 1822 . 1 1 120 GLU CD C 12.211 9.677 7.742 . . . 1.0 . . . . . . . . . . . . A . 120 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 1823 . 1 1 120 GLU CG C 12.933 8.744 8.706 . . . 1.0 . . . . . . . . . . . . A . 120 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 1824 . 1 1 120 GLU H H 15.537 7.578 8.439 . . . 1.0 . . . . . . . . . . . . A . 120 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 1825 . 1 1 120 GLU HA H 13.441 6.514 10.031 . . . 1.0 . . . . . . . . . . . . A . 120 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 1826 . 1 1 120 GLU HB2 H 13.527 7.398 7.140 . . . 1.0 . . . . . . . . . . . . A . 120 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1827 . 1 1 120 GLU HB3 H 12.046 6.932 7.976 . . . 1.0 . . . . . . . . . . . . A . 120 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1828 . 1 1 120 GLU HG2 H 12.383 8.693 9.635 . . . 1.0 . . . . . . . . . . . . A . 120 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1829 . 1 1 120 GLU HG3 H 13.925 9.126 8.898 . . . 1.0 . . . . . . . . . . . . A . 120 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1830 . 1 1 120 GLU N N 15.241 6.880 9.059 . . . 1.0 . . . . . . . . . . . . A . 120 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 1831 . 1 1 120 GLU O O 12.982 4.202 9.109 . . . 1.0 . . . . . . . . . . . . A . 120 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 1832 . 1 1 120 GLU OE1 O 11.844 9.219 6.674 . . . 1.0 . . . . . . . . . . . . A . 120 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1833 . 1 1 120 GLU OE2 O 12.034 10.834 8.085 . . . 1.0 . . . . . . . . . . . . A . 120 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1834 . 1 1 121 VAL C C 15.052 2.314 8.077 . . . 1.0 . . . . . . . . . . . . A . 121 VAL C . . . . . . . . . c17360_2l7l 1 . 1 . 1835 . 1 1 121 VAL CA C 14.552 3.298 7.023 . . . 1.0 . . . . . . . . . . . . A . 121 VAL CA . . . . . . . . . c17360_2l7l 1 . 1 . 1836 . 1 1 121 VAL CB C 15.445 3.224 5.781 . . . 1.0 . . . . . . . . . . . . A . 121 VAL CB . . . . . . . . . c17360_2l7l 1 . 1 . 1837 . 1 1 121 VAL CG1 C 15.547 1.771 5.311 . . . 1.0 . . . . . . . . . . . . A . 121 VAL CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 1838 . 1 1 121 VAL CG2 C 14.835 4.077 4.666 . . . 1.0 . . . . . . . . . . . . A . 121 VAL CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1839 . 1 1 121 VAL H H 15.141 5.331 7.169 . . . 1.0 . . . . . . . . . . . . A . 121 VAL H . . . . . . . . . c17360_2l7l 1 . 1 . 1840 . 1 1 121 VAL HA H 13.544 3.029 6.743 . . . 1.0 . . . . . . . . . . . . A . 121 VAL HA . . . . . . . . . c17360_2l7l 1 . 1 . 1841 . 1 1 121 VAL HB H 16.429 3.594 6.024 . . . 1.0 . . . . . . . . . . . . A . 121 VAL HB . . . . . . . . . c17360_2l7l 1 . 1 . 1842 . 1 1 121 VAL HG11 H 14.562 1.330 5.291 . . . 1.0 . . . . . . . . . . . . A . 121 VAL HG11 . . . . . . . . . c17360_2l7l 1 . 1 . 1843 . 1 1 121 VAL HG12 H 16.175 1.216 5.992 . . . 1.0 . . . . . . . . . . . . A . 121 VAL HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 1844 . 1 1 121 VAL HG13 H 15.975 1.742 4.320 . . . 1.0 . . . . . . . . . . . . A . 121 VAL HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 1845 . 1 1 121 VAL HG21 H 15.569 4.231 3.889 . . . 1.0 . . . . . . . . . . . . A . 121 VAL HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 1846 . 1 1 121 VAL HG22 H 14.532 5.032 5.068 . . . 1.0 . . . . . . . . . . . . A . 121 VAL HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 1847 . 1 1 121 VAL HG23 H 13.975 3.571 4.254 . . . 1.0 . . . . . . . . . . . . A . 121 VAL HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 1848 . 1 1 121 VAL N N 14.547 4.654 7.556 . . . 1.0 . . . . . . . . . . . . A . 121 VAL N . . . . . . . . . c17360_2l7l 1 . 1 . 1849 . 1 1 121 VAL O O 14.487 1.235 8.251 . . . 1.0 . . . . . . . . . . . . A . 121 VAL O . . . . . . . . . c17360_2l7l 1 . 1 . 1850 . 1 1 122 ASP C C 15.666 1.579 10.910 . . . 1.0 . . . . . . . . . . . . A . 122 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 1851 . 1 1 122 ASP CA C 16.688 1.837 9.808 . . . 1.0 . . . . . . . . . . . . A . 122 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 1852 . 1 1 122 ASP CB C 17.934 2.498 10.404 . . . 1.0 . . . . . . . . . . . . A . 122 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 1853 . 1 1 122 ASP CG C 19.080 2.455 9.398 . . . 1.0 . . . . . . . . . . . . A . 122 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 1854 . 1 1 122 ASP H H 16.527 3.566 8.593 . . . 1.0 . . . . . . . . . . . . A . 122 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 1855 . 1 1 122 ASP HA H 16.970 0.895 9.365 . . . 1.0 . . . . . . . . . . . . A . 122 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 1856 . 1 1 122 ASP HB2 H 17.710 3.525 10.650 . . . 1.0 . . . . . . . . . . . . A . 122 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1857 . 1 1 122 ASP HB3 H 18.225 1.970 11.301 . . . 1.0 . . . . . . . . . . . . A . 122 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1858 . 1 1 122 ASP N N 16.118 2.695 8.776 . . . 1.0 . . . . . . . . . . . . A . 122 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 1859 . 1 1 122 ASP O O 15.523 0.454 11.387 . . . 1.0 . . . . . . . . . . . . A . 122 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 1860 . 1 1 122 ASP OD1 O 18.972 1.714 8.436 . . . 1.0 . . . . . . . . . . . . A . 122 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1861 . 1 1 122 ASP OD2 O 20.049 3.166 9.607 . . . 1.0 . . . . . . . . . . . . A . 122 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1862 . 1 1 123 GLU C C 12.820 1.576 11.889 . . . 1.0 . . . . . . . . . . . . A . 123 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 1863 . 1 1 123 GLU CA C 13.942 2.499 12.349 . . . 1.0 . . . . . . . . . . . . A . 123 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 1864 . 1 1 123 GLU CB C 13.369 3.876 12.695 . . . 1.0 . . . . . . . . . . . . A . 123 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 1865 . 1 1 123 GLU CD C 14.677 4.111 14.816 . . . 1.0 . . . . . . . . . . . . A . 123 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 1866 . 1 1 123 GLU CG C 14.422 4.704 13.435 . . . 1.0 . . . . . . . . . . . . A . 123 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 1867 . 1 1 123 GLU H H 15.112 3.500 10.890 . . . 1.0 . . . . . . . . . . . . A . 123 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 1868 . 1 1 123 GLU HA H 14.399 2.077 13.231 . . . 1.0 . . . . . . . . . . . . A . 123 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 1869 . 1 1 123 GLU HB2 H 13.086 4.386 11.784 . . . 1.0 . . . . . . . . . . . . A . 123 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1870 . 1 1 123 GLU HB3 H 12.499 3.758 13.325 . . . 1.0 . . . . . . . . . . . . A . 123 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1871 . 1 1 123 GLU HG2 H 15.343 4.698 12.870 . . . 1.0 . . . . . . . . . . . . A . 123 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1872 . 1 1 123 GLU HG3 H 14.074 5.720 13.540 . . . 1.0 . . . . . . . . . . . . A . 123 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1873 . 1 1 123 GLU N N 14.953 2.628 11.306 . . . 1.0 . . . . . . . . . . . . A . 123 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 1874 . 1 1 123 GLU O O 12.318 0.760 12.662 . . . 1.0 . . . . . . . . . . . . A . 123 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 1875 . 1 1 123 GLU OE1 O 13.811 3.401 15.302 . . . 1.0 . . . . . . . . . . . . A . 123 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1876 . 1 1 123 GLU OE2 O 15.733 4.373 15.367 . . . 1.0 . . . . . . . . . . . . A . 123 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1877 . 1 1 124 MET C C 11.760 -0.595 10.156 . . . 1.0 . . . . . . . . . . . . A . 124 MET C . . . . . . . . . c17360_2l7l 1 . 1 . 1878 . 1 1 124 MET CA C 11.367 0.876 10.077 . . . 1.0 . . . . . . . . . . . . A . 124 MET CA . . . . . . . . . c17360_2l7l 1 . 1 . 1879 . 1 1 124 MET CB C 11.104 1.264 8.618 . . . 1.0 . . . . . . . . . . . . A . 124 MET CB . . . . . . . . . c17360_2l7l 1 . 1 . 1880 . 1 1 124 MET CE C 8.084 -0.051 6.136 . . . 1.0 . . . . . . . . . . . . A . 124 MET CE . . . . . . . . . c17360_2l7l 1 . 1 . 1881 . 1 1 124 MET CG C 9.890 0.495 8.092 . . . 1.0 . . . . . . . . . . . . A . 124 MET CG . . . . . . . . . c17360_2l7l 1 . 1 . 1882 . 1 1 124 MET H H 12.867 2.372 10.052 . . . 1.0 . . . . . . . . . . . . A . 124 MET H . . . . . . . . . c17360_2l7l 1 . 1 . 1883 . 1 1 124 MET HA H 10.466 1.032 10.649 . . . 1.0 . . . . . . . . . . . . A . 124 MET HA . . . . . . . . . c17360_2l7l 1 . 1 . 1884 . 1 1 124 MET HB2 H 10.913 2.325 8.557 . . . 1.0 . . . . . . . . . . . . A . 124 MET HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1885 . 1 1 124 MET HB3 H 11.969 1.020 8.020 . . . 1.0 . . . . . . . . . . . . A . 124 MET HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1886 . 1 1 124 MET HE1 H 8.344 -1.097 6.075 . . . 1.0 . . . . . . . . . . . . A . 124 MET HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1887 . 1 1 124 MET HE2 H 7.581 0.240 5.229 . . . 1.0 . . . . . . . . . . . . A . 124 MET HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1888 . 1 1 124 MET HE3 H 7.429 0.116 6.973 . . . 1.0 . . . . . . . . . . . . A . 124 MET HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 1889 . 1 1 124 MET HG2 H 10.075 -0.564 8.167 . . . 1.0 . . . . . . . . . . . . A . 124 MET HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1890 . 1 1 124 MET HG3 H 9.025 0.754 8.682 . . . 1.0 . . . . . . . . . . . . A . 124 MET HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1891 . 1 1 124 MET N N 12.431 1.708 10.625 . . . 1.0 . . . . . . . . . . . . A . 124 MET N . . . . . . . . . c17360_2l7l 1 . 1 . 1892 . 1 1 124 MET O O 10.978 -1.434 10.603 . . . 1.0 . . . . . . . . . . . . A . 124 MET O . . . . . . . . . c17360_2l7l 1 . 1 . 1893 . 1 1 124 MET SD S 9.588 0.935 6.360 . . . 1.0 . . . . . . . . . . . . A . 124 MET SD . . . . . . . . . c17360_2l7l 1 . 1 . 1894 . 1 1 125 ILE C C 13.705 -2.726 11.207 . . . 1.0 . . . . . . . . . . . . A . 125 ILE C . . . . . . . . . c17360_2l7l 1 . 1 . 1895 . 1 1 125 ILE CA C 13.468 -2.276 9.770 . . . 1.0 . . . . . . . . . . . . A . 125 ILE CA . . . . . . . . . c17360_2l7l 1 . 1 . 1896 . 1 1 125 ILE CB C 14.771 -2.397 8.975 . . . 1.0 . . . . . . . . . . . . A . 125 ILE CB . . . . . . . . . c17360_2l7l 1 . 1 . 1897 . 1 1 125 ILE CD1 C 15.775 -2.109 6.694 . . . 1.0 . . . . . . . . . . . . A . 125 ILE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1898 . 1 1 125 ILE CG1 C 14.470 -2.284 7.477 . . . 1.0 . . . . . . . . . . . . A . 125 ILE CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 1899 . 1 1 125 ILE CG2 C 15.452 -3.743 9.262 . . . 1.0 . . . . . . . . . . . . A . 125 ILE CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1900 . 1 1 125 ILE H H 13.566 -0.192 9.387 . . . 1.0 . . . . . . . . . . . . A . 125 ILE H . . . . . . . . . c17360_2l7l 1 . 1 . 1901 . 1 1 125 ILE HA H 12.727 -2.920 9.321 . . . 1.0 . . . . . . . . . . . . A . 125 ILE HA . . . . . . . . . c17360_2l7l 1 . 1 . 1902 . 1 1 125 ILE HB H 15.436 -1.596 9.265 . . . 1.0 . . . . . . . . . . . . A . 125 ILE HB . . . . . . . . . c17360_2l7l 1 . 1 . 1903 . 1 1 125 ILE HD11 H 16.601 -2.550 7.239 . . . 1.0 . . . . . . . . . . . . A . 125 ILE HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 1904 . 1 1 125 ILE HD12 H 15.961 -1.057 6.549 . . . 1.0 . . . . . . . . . . . . A . 125 ILE HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 1905 . 1 1 125 ILE HD13 H 15.680 -2.593 5.735 . . . 1.0 . . . . . . . . . . . . A . 125 ILE HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 1906 . 1 1 125 ILE HG12 H 13.970 -3.180 7.144 . . . 1.0 . . . . . . . . . . . . A . 125 ILE HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 1907 . 1 1 125 ILE HG13 H 13.832 -1.431 7.301 . . . 1.0 . . . . . . . . . . . . A . 125 ILE HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 1908 . 1 1 125 ILE HG21 H 16.166 -3.967 8.483 . . . 1.0 . . . . . . . . . . . . A . 125 ILE HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 1909 . 1 1 125 ILE HG22 H 14.708 -4.521 9.302 . . . 1.0 . . . . . . . . . . . . A . 125 ILE HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 1910 . 1 1 125 ILE HG23 H 15.964 -3.689 10.211 . . . 1.0 . . . . . . . . . . . . A . 125 ILE HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 1911 . 1 1 125 ILE N N 12.981 -0.901 9.726 . . . 1.0 . . . . . . . . . . . . A . 125 ILE N . . . . . . . . . c17360_2l7l 1 . 1 . 1912 . 1 1 125 ILE O O 13.300 -3.816 11.596 . . . 1.0 . . . . . . . . . . . . A . 125 ILE O . . . . . . . . . c17360_2l7l 1 . 1 . 1913 . 1 1 126 ARG C C 13.396 -2.435 14.155 . . . 1.0 . . . . . . . . . . . . A . 126 ARG C . . . . . . . . . c17360_2l7l 1 . 1 . 1914 . 1 1 126 ARG CA C 14.679 -2.221 13.367 . . . 1.0 . . . . . . . . . . . . A . 126 ARG CA . . . . . . . . . c17360_2l7l 1 . 1 . 1915 . 1 1 126 ARG CB C 15.498 -1.097 14.006 . . . 1.0 . . . . . . . . . . . . A . 126 ARG CB . . . . . . . . . c17360_2l7l 1 . 1 . 1916 . 1 1 126 ARG CD C 16.712 -0.369 16.066 . . . 1.0 . . . . . . . . . . . . A . 126 ARG CD . . . . . . . . . c17360_2l7l 1 . 1 . 1917 . 1 1 126 ARG CG C 15.898 -1.494 15.430 . . . 1.0 . . . . . . . . . . . . A . 126 ARG CG . . . . . . . . . c17360_2l7l 1 . 1 . 1918 . 1 1 126 ARG CZ C 16.484 -0.707 18.462 . . . 1.0 . . . . . . . . . . . . A . 126 ARG CZ . . . . . . . . . c17360_2l7l 1 . 1 . 1919 . 1 1 126 ARG H H 14.686 -1.030 11.614 . . . 1.0 . . . . . . . . . . . . A . 126 ARG H . . . . . . . . . c17360_2l7l 1 . 1 . 1920 . 1 1 126 ARG HA H 15.263 -3.131 13.387 . . . 1.0 . . . . . . . . . . . . A . 126 ARG HA . . . . . . . . . c17360_2l7l 1 . 1 . 1921 . 1 1 126 ARG HB2 H 16.387 -0.919 13.418 . . . 1.0 . . . . . . . . . . . . A . 126 ARG HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1922 . 1 1 126 ARG HB3 H 14.904 -0.196 14.041 . . . 1.0 . . . . . . . . . . . . A . 126 ARG HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1923 . 1 1 126 ARG HD2 H 17.539 -0.116 15.419 . . . 1.0 . . . . . . . . . . . . A . 126 ARG HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1924 . 1 1 126 ARG HD3 H 16.081 0.500 16.194 . . . 1.0 . . . . . . . . . . . . A . 126 ARG HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 1925 . 1 1 126 ARG HE H 18.138 -1.151 17.425 . . . 1.0 . . . . . . . . . . . . A . 126 ARG HE . . . . . . . . . c17360_2l7l 1 . 1 . 1926 . 1 1 126 ARG HG2 H 15.011 -1.671 16.020 . . . 1.0 . . . . . . . . . . . . A . 126 ARG HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1927 . 1 1 126 ARG HG3 H 16.495 -2.393 15.399 . . . 1.0 . . . . . . . . . . . . A . 126 ARG HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1928 . 1 1 126 ARG HH11 H 14.898 0.057 17.510 . . . 1.0 . . . . . . . . . . . . A . 126 ARG HH11 . . . . . . . . . c17360_2l7l 1 . 1 . 1929 . 1 1 126 ARG HH12 H 14.708 -0.172 19.216 . . . 1.0 . . . . . . . . . . . . A . 126 ARG HH12 . . . . . . . . . c17360_2l7l 1 . 1 . 1930 . 1 1 126 ARG HH21 H 17.899 -1.455 19.664 . . . 1.0 . . . . . . . . . . . . A . 126 ARG HH21 . . . . . . . . . c17360_2l7l 1 . 1 . 1931 . 1 1 126 ARG HH22 H 16.408 -1.029 20.435 . . . 1.0 . . . . . . . . . . . . A . 126 ARG HH22 . . . . . . . . . c17360_2l7l 1 . 1 . 1932 . 1 1 126 ARG N N 14.377 -1.884 11.983 . . . 1.0 . . . . . . . . . . . . A . 126 ARG N . . . . . . . . . c17360_2l7l 1 . 1 . 1933 . 1 1 126 ARG NE N 17.227 -0.794 17.363 . . . 1.0 . . . . . . . . . . . . A . 126 ARG NE . . . . . . . . . c17360_2l7l 1 . 1 . 1934 . 1 1 126 ARG NH1 N 15.269 -0.237 18.390 . . . 1.0 . . . . . . . . . . . . A . 126 ARG NH1 . . . . . . . . . c17360_2l7l 1 . 1 . 1935 . 1 1 126 ARG NH2 N 16.968 -1.093 19.609 . . . 1.0 . . . . . . . . . . . . A . 126 ARG NH2 . . . . . . . . . c17360_2l7l 1 . 1 . 1936 . 1 1 126 ARG O O 13.278 -3.394 14.920 . . . 1.0 . . . . . . . . . . . . A . 126 ARG O . . . . . . . . . c17360_2l7l 1 . 1 . 1937 . 1 1 127 GLU C C 10.382 -2.852 14.174 . . . 1.0 . . . . . . . . . . . . A . 127 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 1938 . 1 1 127 GLU CA C 11.164 -1.639 14.657 . . . 1.0 . . . . . . . . . . . . A . 127 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 1939 . 1 1 127 GLU CB C 10.340 -0.371 14.430 . . . 1.0 . . . . . . . . . . . . A . 127 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 1940 . 1 1 127 GLU CD C 8.283 0.859 15.140 . . . 1.0 . . . . . . . . . . . . A . 127 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 1941 . 1 1 127 GLU CG C 9.033 -0.465 15.221 . . . 1.0 . . . . . . . . . . . . A . 127 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 1942 . 1 1 127 GLU H H 12.590 -0.800 13.337 . . . 1.0 . . . . . . . . . . . . A . 127 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 1943 . 1 1 127 GLU HA H 11.351 -1.746 15.714 . . . 1.0 . . . . . . . . . . . . A . 127 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 1944 . 1 1 127 GLU HB2 H 10.903 0.490 14.763 . . . 1.0 . . . . . . . . . . . . A . 127 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1945 . 1 1 127 GLU HB3 H 10.115 -0.271 13.379 . . . 1.0 . . . . . . . . . . . . A . 127 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1946 . 1 1 127 GLU HG2 H 8.418 -1.251 14.806 . . . 1.0 . . . . . . . . . . . . A . 127 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1947 . 1 1 127 GLU HG3 H 9.252 -0.688 16.254 . . . 1.0 . . . . . . . . . . . . A . 127 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 1948 . 1 1 127 GLU N N 12.438 -1.540 13.962 . . . 1.0 . . . . . . . . . . . . A . 127 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 1949 . 1 1 127 GLU O O 9.566 -3.407 14.908 . . . 1.0 . . . . . . . . . . . . A . 127 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 1950 . 1 1 127 GLU OE1 O 8.706 1.709 14.375 . . . 1.0 . . . . . . . . . . . . A . 127 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 1951 . 1 1 127 GLU OE2 O 7.295 1.003 15.841 . . . 1.0 . . . . . . . . . . . . A . 127 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 1952 . 1 1 128 ALA C C 10.759 -5.692 12.570 . . . 1.0 . . . . . . . . . . . . A . 128 ALA C . . . . . . . . . c17360_2l7l 1 . 1 . 1953 . 1 1 128 ALA CA C 9.948 -4.418 12.359 . . . 1.0 . . . . . . . . . . . . A . 128 ALA CA . . . . . . . . . c17360_2l7l 1 . 1 . 1954 . 1 1 128 ALA CB C 9.740 -4.195 10.864 . . . 1.0 . . . . . . . . . . . . A . 128 ALA CB . . . . . . . . . c17360_2l7l 1 . 1 . 1955 . 1 1 128 ALA H H 11.303 -2.793 12.391 . . . 1.0 . . . . . . . . . . . . A . 128 ALA H . . . . . . . . . c17360_2l7l 1 . 1 . 1956 . 1 1 128 ALA HA H 8.984 -4.536 12.831 . . . 1.0 . . . . . . . . . . . . A . 128 ALA HA . . . . . . . . . c17360_2l7l 1 . 1 . 1957 . 1 1 128 ALA HB1 H 10.690 -4.253 10.355 . . . 1.0 . . . . . . . . . . . . A . 128 ALA HB1 . . . . . . . . . c17360_2l7l 1 . 1 . 1958 . 1 1 128 ALA HB2 H 9.306 -3.220 10.708 . . . 1.0 . . . . . . . . . . . . A . 128 ALA HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1959 . 1 1 128 ALA HB3 H 9.078 -4.955 10.476 . . . 1.0 . . . . . . . . . . . . A . 128 ALA HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1960 . 1 1 128 ALA N N 10.637 -3.264 12.934 . . . 1.0 . . . . . . . . . . . . A . 128 ALA N . . . . . . . . . c17360_2l7l 1 . 1 . 1961 . 1 1 128 ALA O O 10.214 -6.796 12.556 . . . 1.0 . . . . . . . . . . . . A . 128 ALA O . . . . . . . . . c17360_2l7l 1 . 1 . 1962 . 1 1 129 ASP C C 13.014 -7.041 14.445 . . . 1.0 . . . . . . . . . . . . A . 129 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 1963 . 1 1 129 ASP CA C 12.948 -6.678 12.967 . . . 1.0 . . . . . . . . . . . . A . 129 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 1964 . 1 1 129 ASP CB C 14.351 -6.354 12.455 . . . 1.0 . . . . . . . . . . . . A . 129 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 1965 . 1 1 129 ASP CG C 15.177 -7.626 12.378 . . . 1.0 . . . . . . . . . . . . A . 129 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 1966 . 1 1 129 ASP H H 12.446 -4.630 12.757 . . . 1.0 . . . . . . . . . . . . A . 129 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 1967 . 1 1 129 ASP HA H 12.565 -7.524 12.416 . . . 1.0 . . . . . . . . . . . . A . 129 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 1968 . 1 1 129 ASP HB2 H 14.284 -5.916 11.472 . . . 1.0 . . . . . . . . . . . . A . 129 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 1969 . 1 1 129 ASP HB3 H 14.830 -5.658 13.129 . . . 1.0 . . . . . . . . . . . . A . 129 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 1970 . 1 1 129 ASP N N 12.065 -5.533 12.760 . . . 1.0 . . . . . . . . . . . . A . 129 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 1971 . 1 1 129 ASP O O 13.609 -6.319 15.245 . . . 1.0 . . . . . . . . . . . . A . 129 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 1972 . 1 1 129 ASP OD1 O 14.595 -8.694 12.460 . . . 1.0 . . . . . . . . . . . . A . 129 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1973 . 1 1 129 ASP OD2 O 16.377 -7.512 12.234 . . . 1.0 . . . . . . . . . . . . A . 129 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 1974 . 1 1 130 ILE C C 13.786 -9.004 16.637 . . . 1.0 . . . . . . . . . . . . A . 130 ILE C . . . . . . . . . c17360_2l7l 1 . 1 . 1975 . 1 1 130 ILE CA C 12.384 -8.604 16.187 . . . 1.0 . . . . . . . . . . . . A . 130 ILE CA . . . . . . . . . c17360_2l7l 1 . 1 . 1976 . 1 1 130 ILE CB C 11.434 -9.799 16.341 . . . 1.0 . . . . . . . . . . . . A . 130 ILE CB . . . . . . . . . c17360_2l7l 1 . 1 . 1977 . 1 1 130 ILE CD1 C 10.991 -12.148 15.571 . . . 1.0 . . . . . . . . . . . . A . 130 ILE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 1978 . 1 1 130 ILE CG1 C 12.034 -11.029 15.639 . . . 1.0 . . . . . . . . . . . . A . 130 ILE CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 1979 . 1 1 130 ILE CG2 C 10.080 -9.458 15.711 . . . 1.0 . . . . . . . . . . . . A . 130 ILE CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 1980 . 1 1 130 ILE H H 11.935 -8.695 14.119 . . . 1.0 . . . . . . . . . . . . A . 130 ILE H . . . . . . . . . c17360_2l7l 1 . 1 . 1981 . 1 1 130 ILE HA H 12.030 -7.796 16.811 . . . 1.0 . . . . . . . . . . . . A . 130 ILE HA . . . . . . . . . c17360_2l7l 1 . 1 . 1982 . 1 1 130 ILE HB H 11.298 -10.012 17.391 . . . 1.0 . . . . . . . . . . . . A . 130 ILE HB . . . . . . . . . c17360_2l7l 1 . 1 . 1983 . 1 1 130 ILE HD11 H 11.480 -13.079 15.330 . . . 1.0 . . . . . . . . . . . . A . 130 ILE HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 1984 . 1 1 130 ILE HD12 H 10.261 -11.914 14.810 . . . 1.0 . . . . . . . . . . . . A . 130 ILE HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 1985 . 1 1 130 ILE HD13 H 10.498 -12.237 16.528 . . . 1.0 . . . . . . . . . . . . A . 130 ILE HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 1986 . 1 1 130 ILE HG12 H 12.344 -10.762 14.642 . . . 1.0 . . . . . . . . . . . . A . 130 ILE HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 1987 . 1 1 130 ILE HG13 H 12.888 -11.381 16.198 . . . 1.0 . . . . . . . . . . . . A . 130 ILE HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 1988 . 1 1 130 ILE HG21 H 9.782 -8.464 16.009 . . . 1.0 . . . . . . . . . . . . A . 130 ILE HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 1989 . 1 1 130 ILE HG22 H 9.340 -10.171 16.044 . . . 1.0 . . . . . . . . . . . . A . 130 ILE HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 1990 . 1 1 130 ILE HG23 H 10.162 -9.503 14.635 . . . 1.0 . . . . . . . . . . . . A . 130 ILE HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 1991 . 1 1 130 ILE N N 12.395 -8.161 14.801 . . . 1.0 . . . . . . . . . . . . A . 130 ILE N . . . . . . . . . c17360_2l7l 1 . 1 . 1992 . 1 1 130 ILE O O 14.197 -8.702 17.757 . . . 1.0 . . . . . . . . . . . . A . 130 ILE O . . . . . . . . . c17360_2l7l 1 . 1 . 1993 . 1 1 131 ASP C C 16.845 -8.976 16.007 . . . 1.0 . . . . . . . . . . . . A . 131 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 1994 . 1 1 131 ASP CA C 15.860 -10.136 16.086 . . . 1.0 . . . . . . . . . . . . A . 131 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 1995 . 1 1 131 ASP CB C 16.288 -11.243 15.119 . . . 1.0 . . . . . . . . . . . . A . 131 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 1996 . 1 1 131 ASP CG C 16.176 -10.757 13.676 . . . 1.0 . . . . . . . . . . . . A . 131 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 1997 . 1 1 131 ASP H H 14.136 -9.914 14.884 . . . 1.0 . . . . . . . . . . . . A . 131 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 1998 . 1 1 131 ASP HA H 15.864 -10.531 17.090 . . . 1.0 . . . . . . . . . . . . A . 131 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 1999 . 1 1 131 ASP HB2 H 17.312 -11.520 15.324 . . . 1.0 . . . . . . . . . . . . A . 131 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2000 . 1 1 131 ASP HB3 H 15.651 -12.103 15.255 . . . 1.0 . . . . . . . . . . . . A . 131 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2001 . 1 1 131 ASP N N 14.510 -9.692 15.761 . . . 1.0 . . . . . . . . . . . . A . 131 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 2002 . 1 1 131 ASP O O 17.870 -8.974 16.689 . . . 1.0 . . . . . . . . . . . . A . 131 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 2003 . 1 1 131 ASP OD1 O 16.523 -9.618 13.429 . . . 1.0 . . . . . . . . . . . . A . 131 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 2004 . 1 1 131 ASP OD2 O 15.743 -11.534 12.839 . . . 1.0 . . . . . . . . . . . . A . 131 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2005 . 1 1 132 GLY C C 18.634 -7.173 14.191 . . . 1.0 . . . . . . . . . . . . A . 132 GLY C . . . . . . . . . c17360_2l7l 1 . 1 . 2006 . 1 1 132 GLY CA C 17.400 -6.829 15.022 . . . 1.0 . . . . . . . . . . . . A . 132 GLY CA . . . . . . . . . c17360_2l7l 1 . 1 . 2007 . 1 1 132 GLY H H 15.701 -8.036 14.654 . . . 1.0 . . . . . . . . . . . . A . 132 GLY H . . . . . . . . . c17360_2l7l 1 . 1 . 2008 . 1 1 132 GLY HA2 H 16.850 -6.040 14.530 . . . 1.0 . . . . . . . . . . . . A . 132 GLY HA2 . . . . . . . . . c17360_2l7l 1 . 1 . 2009 . 1 1 132 GLY HA3 H 17.713 -6.488 15.997 . . . 1.0 . . . . . . . . . . . . A . 132 GLY HA3 . . . . . . . . . c17360_2l7l 1 . 1 . 2010 . 1 1 132 GLY N N 16.529 -7.987 15.176 . . . 1.0 . . . . . . . . . . . . A . 132 GLY N . . . . . . . . . c17360_2l7l 1 . 1 . 2011 . 1 1 132 GLY O O 19.719 -6.644 14.428 . . . 1.0 . . . . . . . . . . . . A . 132 GLY O . . . . . . . . . c17360_2l7l 1 . 1 . 2012 . 1 1 133 ASP C C 19.792 -7.444 11.252 . . . 1.0 . . . . . . . . . . . . A . 133 ASP C . . . . . . . . . c17360_2l7l 1 . 1 . 2013 . 1 1 133 ASP CA C 19.563 -8.472 12.356 . . . 1.0 . . . . . . . . . . . . A . 133 ASP CA . . . . . . . . . c17360_2l7l 1 . 1 . 2014 . 1 1 133 ASP CB C 19.258 -9.839 11.732 . . . 1.0 . . . . . . . . . . . . A . 133 ASP CB . . . . . . . . . c17360_2l7l 1 . 1 . 2015 . 1 1 133 ASP CG C 18.124 -9.723 10.714 . . . 1.0 . . . . . . . . . . . . A . 133 ASP CG . . . . . . . . . c17360_2l7l 1 . 1 . 2016 . 1 1 133 ASP H H 17.573 -8.446 13.073 . . . 1.0 . . . . . . . . . . . . A . 133 ASP H . . . . . . . . . c17360_2l7l 1 . 1 . 2017 . 1 1 133 ASP HA H 20.461 -8.554 12.949 . . . 1.0 . . . . . . . . . . . . A . 133 ASP HA . . . . . . . . . c17360_2l7l 1 . 1 . 2018 . 1 1 133 ASP HB2 H 20.143 -10.209 11.237 . . . 1.0 . . . . . . . . . . . . A . 133 ASP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2019 . 1 1 133 ASP HB3 H 18.969 -10.529 12.509 . . . 1.0 . . . . . . . . . . . . A . 133 ASP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2020 . 1 1 133 ASP N N 18.462 -8.062 13.218 . . . 1.0 . . . . . . . . . . . . A . 133 ASP N . . . . . . . . . c17360_2l7l 1 . 1 . 2021 . 1 1 133 ASP O O 20.630 -7.640 10.373 . . . 1.0 . . . . . . . . . . . . A . 133 ASP O . . . . . . . . . c17360_2l7l 1 . 1 . 2022 . 1 1 133 ASP OD1 O 17.574 -8.645 10.586 . . . 1.0 . . . . . . . . . . . . A . 133 ASP OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 2023 . 1 1 133 ASP OD2 O 17.818 -10.721 10.081 . . . 1.0 . . . . . . . . . . . . A . 133 ASP OD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2024 . 1 1 134 GLY C C 18.375 -5.616 9.057 . . . 1.0 . . . . . . . . . . . . A . 134 GLY C . . . . . . . . . c17360_2l7l 1 . 1 . 2025 . 1 1 134 GLY CA C 19.176 -5.288 10.308 . . . 1.0 . . . . . . . . . . . . A . 134 GLY CA . . . . . . . . . c17360_2l7l 1 . 1 . 2026 . 1 1 134 GLY H H 18.394 -6.233 12.033 . . . 1.0 . . . . . . . . . . . . A . 134 GLY H . . . . . . . . . c17360_2l7l 1 . 1 . 2027 . 1 1 134 GLY HA2 H 18.818 -4.358 10.726 . . . 1.0 . . . . . . . . . . . . A . 134 GLY HA2 . . . . . . . . . c17360_2l7l 1 . 1 . 2028 . 1 1 134 GLY HA3 H 20.217 -5.179 10.041 . . . 1.0 . . . . . . . . . . . . A . 134 GLY HA3 . . . . . . . . . c17360_2l7l 1 . 1 . 2029 . 1 1 134 GLY N N 19.043 -6.345 11.307 . . . 1.0 . . . . . . . . . . . . A . 134 GLY N . . . . . . . . . c17360_2l7l 1 . 1 . 2030 . 1 1 134 GLY O O 18.528 -4.966 8.023 . . . 1.0 . . . . . . . . . . . . A . 134 GLY O . . . . . . . . . c17360_2l7l 1 . 1 . 2031 . 1 1 135 GLN C C 15.354 -7.549 8.492 . . . 1.0 . . . . . . . . . . . . A . 135 GLN C . . . . . . . . . c17360_2l7l 1 . 1 . 2032 . 1 1 135 GLN CA C 16.703 -7.040 8.014 . . . 1.0 . . . . . . . . . . . . A . 135 GLN CA . . . . . . . . . c17360_2l7l 1 . 1 . 2033 . 1 1 135 GLN CB C 17.409 -8.141 7.225 . . . 1.0 . . . . . . . . . . . . A . 135 GLN CB . . . . . . . . . c17360_2l7l 1 . 1 . 2034 . 1 1 135 GLN CD C 19.357 -8.636 5.731 . . . 1.0 . . . . . . . . . . . . A . 135 GLN CD . . . . . . . . . c17360_2l7l 1 . 1 . 2035 . 1 1 135 GLN CG C 18.706 -7.590 6.627 . . . 1.0 . . . . . . . . . . . . A . 135 GLN CG . . . . . . . . . c17360_2l7l 1 . 1 . 2036 . 1 1 135 GLN H H 17.444 -7.112 9.999 . . . 1.0 . . . . . . . . . . . . A . 135 GLN H . . . . . . . . . c17360_2l7l 1 . 1 . 2037 . 1 1 135 GLN HA H 16.542 -6.192 7.363 . . . 1.0 . . . . . . . . . . . . A . 135 GLN HA . . . . . . . . . c17360_2l7l 1 . 1 . 2038 . 1 1 135 GLN HB2 H 17.636 -8.968 7.883 . . . 1.0 . . . . . . . . . . . . A . 135 GLN HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2039 . 1 1 135 GLN HB3 H 16.764 -8.479 6.431 . . . 1.0 . . . . . . . . . . . . A . 135 GLN HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2040 . 1 1 135 GLN HE21 H 21.054 -8.671 6.761 . . . 1.0 . . . . . . . . . . . . A . 135 GLN HE21 . . . . . . . . . c17360_2l7l 1 . 1 . 2041 . 1 1 135 GLN HE22 H 20.995 -9.712 5.421 . . . 1.0 . . . . . . . . . . . . A . 135 GLN HE22 . . . . . . . . . c17360_2l7l 1 . 1 . 2042 . 1 1 135 GLN HG2 H 18.487 -6.706 6.047 . . . 1.0 . . . . . . . . . . . . A . 135 GLN HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2043 . 1 1 135 GLN HG3 H 19.388 -7.334 7.424 . . . 1.0 . . . . . . . . . . . . A . 135 GLN HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 2044 . 1 1 135 GLN N N 17.525 -6.631 9.151 . . . 1.0 . . . . . . . . . . . . A . 135 GLN N . . . . . . . . . c17360_2l7l 1 . 1 . 2045 . 1 1 135 GLN NE2 N 20.569 -9.039 5.992 . . . 1.0 . . . . . . . . . . . . A . 135 GLN NE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2046 . 1 1 135 GLN O O 15.189 -7.887 9.666 . . . 1.0 . . . . . . . . . . . . A . 135 GLN O . . . . . . . . . c17360_2l7l 1 . 1 . 2047 . 1 1 135 GLN OE1 O 18.746 -9.099 4.769 . . . 1.0 . . . . . . . . . . . . A . 135 GLN OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2048 . 1 1 136 VAL C C 12.696 -9.334 7.134 . . . 1.0 . . . . . . . . . . . . A . 136 VAL C . . . . . . . . . c17360_2l7l 1 . 1 . 2049 . 1 1 136 VAL CA C 13.038 -8.071 7.911 . . . 1.0 . . . . . . . . . . . . A . 136 VAL CA . . . . . . . . . c17360_2l7l 1 . 1 . 2050 . 1 1 136 VAL CB C 12.008 -6.983 7.591 . . . 1.0 . . . . . . . . . . . . A . 136 VAL CB . . . . . . . . . c17360_2l7l 1 . 1 . 2051 . 1 1 136 VAL CG1 C 10.699 -7.282 8.324 . . . 1.0 . . . . . . . . . . . . A . 136 VAL CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 2052 . 1 1 136 VAL CG2 C 12.544 -5.629 8.057 . . . 1.0 . . . . . . . . . . . . A . 136 VAL CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2053 . 1 1 136 VAL H H 14.581 -7.312 6.656 . . . 1.0 . . . . . . . . . . . . A . 136 VAL H . . . . . . . . . c17360_2l7l 1 . 1 . 2054 . 1 1 136 VAL HA H 12.987 -8.293 8.966 . . . 1.0 . . . . . . . . . . . . A . 136 VAL HA . . . . . . . . . c17360_2l7l 1 . 1 . 2055 . 1 1 136 VAL HB H 11.826 -6.956 6.528 . . . 1.0 . . . . . . . . . . . . A . 136 VAL HB . . . . . . . . . c17360_2l7l 1 . 1 . 2056 . 1 1 136 VAL HG11 H 9.961 -6.538 8.062 . . . 1.0 . . . . . . . . . . . . A . 136 VAL HG11 . . . . . . . . . c17360_2l7l 1 . 1 . 2057 . 1 1 136 VAL HG12 H 10.869 -7.261 9.390 . . . 1.0 . . . . . . . . . . . . A . 136 VAL HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 2058 . 1 1 136 VAL HG13 H 10.341 -8.260 8.035 . . . 1.0 . . . . . . . . . . . . A . 136 VAL HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 2059 . 1 1 136 VAL HG21 H 12.710 -5.659 9.123 . . . 1.0 . . . . . . . . . . . . A . 136 VAL HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 2060 . 1 1 136 VAL HG22 H 11.827 -4.857 7.826 . . . 1.0 . . . . . . . . . . . . A . 136 VAL HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 2061 . 1 1 136 VAL HG23 H 13.473 -5.417 7.551 . . . 1.0 . . . . . . . . . . . . A . 136 VAL HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 2062 . 1 1 136 VAL N N 14.386 -7.600 7.576 . . . 1.0 . . . . . . . . . . . . A . 136 VAL N . . . . . . . . . c17360_2l7l 1 . 1 . 2063 . 1 1 136 VAL O O 12.728 -9.346 5.904 . . . 1.0 . . . . . . . . . . . . A . 136 VAL O . . . . . . . . . c17360_2l7l 1 . 1 . 2064 . 1 1 137 ASN C C 10.498 -11.782 7.083 . . . 1.0 . . . . . . . . . . . . A . 137 ASN C . . . . . . . . . c17360_2l7l 1 . 1 . 2065 . 1 1 137 ASN CA C 12.010 -11.670 7.237 . . . 1.0 . . . . . . . . . . . . A . 137 ASN CA . . . . . . . . . c17360_2l7l 1 . 1 . 2066 . 1 1 137 ASN CB C 12.528 -12.834 8.082 . . . 1.0 . . . . . . . . . . . . A . 137 ASN CB . . . . . . . . . c17360_2l7l 1 . 1 . 2067 . 1 1 137 ASN CG C 12.263 -14.152 7.360 . . . 1.0 . . . . . . . . . . . . A . 137 ASN CG . . . . . . . . . c17360_2l7l 1 . 1 . 2068 . 1 1 137 ASN H H 12.360 -10.326 8.840 . . . 1.0 . . . . . . . . . . . . A . 137 ASN H . . . . . . . . . c17360_2l7l 1 . 1 . 2069 . 1 1 137 ASN HA H 12.465 -11.725 6.258 . . . 1.0 . . . . . . . . . . . . A . 137 ASN HA . . . . . . . . . c17360_2l7l 1 . 1 . 2070 . 1 1 137 ASN HB2 H 13.590 -12.717 8.239 . . . 1.0 . . . . . . . . . . . . A . 137 ASN HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2071 . 1 1 137 ASN HB3 H 12.022 -12.840 9.036 . . . 1.0 . . . . . . . . . . . . A . 137 ASN HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2072 . 1 1 137 ASN HD21 H 13.556 -13.781 5.898 . . . 1.0 . . . . . . . . . . . . A . 137 ASN HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 2073 . 1 1 137 ASN HD22 H 12.741 -15.267 5.789 . . . 1.0 . . . . . . . . . . . . A . 137 ASN HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 2074 . 1 1 137 ASN N N 12.363 -10.397 7.863 . . . 1.0 . . . . . . . . . . . . A . 137 ASN N . . . . . . . . . c17360_2l7l 1 . 1 . 2075 . 1 1 137 ASN ND2 N 12.907 -14.422 6.258 . . . 1.0 . . . . . . . . . . . . A . 137 ASN ND2 . . . . . . . . . c17360_2l7l 1 . 1 . 2076 . 1 1 137 ASN O O 9.755 -10.898 7.510 . . . 1.0 . . . . . . . . . . . . A . 137 ASN O . . . . . . . . . c17360_2l7l 1 . 1 . 2077 . 1 1 137 ASN OD1 O 11.445 -14.953 7.812 . . . 1.0 . . . . . . . . . . . . A . 137 ASN OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 2078 . 1 1 138 TYR C C 7.886 -13.133 7.605 . . . 1.0 . . . . . . . . . . . . A . 138 TYR C . . . . . . . . . c17360_2l7l 1 . 1 . 2079 . 1 1 138 TYR CA C 8.619 -13.081 6.265 . . . 1.0 . . . . . . . . . . . . A . 138 TYR CA . . . . . . . . . c17360_2l7l 1 . 1 . 2080 . 1 1 138 TYR CB C 8.395 -14.392 5.506 . . . 1.0 . . . . . . . . . . . . A . 138 TYR CB . . . . . . . . . c17360_2l7l 1 . 1 . 2081 . 1 1 138 TYR CD1 C 6.197 -14.097 4.308 . . . 1.0 . . . . . . . . . . . . A . 138 TYR CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 2082 . 1 1 138 TYR CD2 C 6.257 -15.448 6.320 . . . 1.0 . . . . . . . . . . . . A . 138 TYR CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2083 . 1 1 138 TYR CE1 C 4.823 -14.336 4.188 . . . 1.0 . . . . . . . . . . . . A . 138 TYR CE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2084 . 1 1 138 TYR CE2 C 4.884 -15.687 6.201 . . . 1.0 . . . . . . . . . . . . A . 138 TYR CE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2085 . 1 1 138 TYR CG C 6.914 -14.652 5.374 . . . 1.0 . . . . . . . . . . . . A . 138 TYR CG . . . . . . . . . c17360_2l7l 1 . 1 . 2086 . 1 1 138 TYR CZ C 4.166 -15.131 5.134 . . . 1.0 . . . . . . . . . . . . A . 138 TYR CZ . . . . . . . . . c17360_2l7l 1 . 1 . 2087 . 1 1 138 TYR H H 10.685 -13.541 6.148 . . . 1.0 . . . . . . . . . . . . A . 138 TYR H . . . . . . . . . c17360_2l7l 1 . 1 . 2088 . 1 1 138 TYR HA H 8.224 -12.266 5.678 . . . 1.0 . . . . . . . . . . . . A . 138 TYR HA . . . . . . . . . c17360_2l7l 1 . 1 . 2089 . 1 1 138 TYR HB2 H 8.837 -14.318 4.523 . . . 1.0 . . . . . . . . . . . . A . 138 TYR HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2090 . 1 1 138 TYR HB3 H 8.855 -15.205 6.048 . . . 1.0 . . . . . . . . . . . . A . 138 TYR HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2091 . 1 1 138 TYR HD1 H 6.704 -13.483 3.577 . . . 1.0 . . . . . . . . . . . . A . 138 TYR HD1 . . . . . . . . . c17360_2l7l 1 . 1 . 2092 . 1 1 138 TYR HD2 H 6.811 -15.876 7.143 . . . 1.0 . . . . . . . . . . . . A . 138 TYR HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2093 . 1 1 138 TYR HE1 H 4.270 -13.908 3.365 . . . 1.0 . . . . . . . . . . . . A . 138 TYR HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2094 . 1 1 138 TYR HE2 H 4.377 -16.300 6.931 . . . 1.0 . . . . . . . . . . . . A . 138 TYR HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2095 . 1 1 138 TYR HH H 2.391 -14.549 4.743 . . . 1.0 . . . . . . . . . . . . A . 138 TYR HH . . . . . . . . . c17360_2l7l 1 . 1 . 2096 . 1 1 138 TYR N N 10.048 -12.870 6.470 . . . 1.0 . . . . . . . . . . . . A . 138 TYR N . . . . . . . . . c17360_2l7l 1 . 1 . 2097 . 1 1 138 TYR O O 6.860 -12.473 7.792 . . . 1.0 . . . . . . . . . . . . A . 138 TYR O . . . . . . . . . c17360_2l7l 1 . 1 . 2098 . 1 1 138 TYR OH O 2.812 -15.367 5.016 . . . 1.0 . . . . . . . . . . . . A . 138 TYR OH . . . . . . . . . c17360_2l7l 1 . 1 . 2099 . 1 1 139 GLU C C 7.759 -12.686 10.544 . . . 1.0 . . . . . . . . . . . . A . 139 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 2100 . 1 1 139 GLU CA C 7.809 -14.047 9.854 . . . 1.0 . . . . . . . . . . . . A . 139 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 2101 . 1 1 139 GLU CB C 8.611 -15.033 10.706 . . . 1.0 . . . . . . . . . . . . A . 139 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 2102 . 1 1 139 GLU CD C 8.664 -16.267 12.880 . . . 1.0 . . . . . . . . . . . . A . 139 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 2103 . 1 1 139 GLU CG C 7.910 -15.236 12.049 . . . 1.0 . . . . . . . . . . . . A . 139 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 2104 . 1 1 139 GLU H H 9.239 -14.418 8.333 . . . 1.0 . . . . . . . . . . . . A . 139 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 2105 . 1 1 139 GLU HA H 6.803 -14.421 9.738 . . . 1.0 . . . . . . . . . . . . A . 139 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 2106 . 1 1 139 GLU HB2 H 8.683 -15.979 10.188 . . . 1.0 . . . . . . . . . . . . A . 139 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2107 . 1 1 139 GLU HB3 H 9.602 -14.639 10.875 . . . 1.0 . . . . . . . . . . . . A . 139 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2108 . 1 1 139 GLU HG2 H 7.880 -14.299 12.583 . . . 1.0 . . . . . . . . . . . . A . 139 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2109 . 1 1 139 GLU HG3 H 6.902 -15.584 11.877 . . . 1.0 . . . . . . . . . . . . A . 139 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 2110 . 1 1 139 GLU N N 8.421 -13.918 8.536 . . . 1.0 . . . . . . . . . . . . A . 139 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 2111 . 1 1 139 GLU O O 6.769 -12.329 11.183 . . . 1.0 . . . . . . . . . . . . A . 139 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 2112 . 1 1 139 GLU OE1 O 9.776 -16.600 12.508 . . . 1.0 . . . . . . . . . . . . A . 139 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2113 . 1 1 139 GLU OE2 O 8.117 -16.708 13.878 . . . 1.0 . . . . . . . . . . . . A . 139 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2114 . 1 1 140 GLU C C 7.918 -9.665 10.342 . . . 1.0 . . . . . . . . . . . . A . 140 GLU C . . . . . . . . . c17360_2l7l 1 . 1 . 2115 . 1 1 140 GLU CA C 8.898 -10.609 11.029 . . . 1.0 . . . . . . . . . . . . A . 140 GLU CA . . . . . . . . . c17360_2l7l 1 . 1 . 2116 . 1 1 140 GLU CB C 10.313 -10.042 10.932 . . . 1.0 . . . . . . . . . . . . A . 140 GLU CB . . . . . . . . . c17360_2l7l 1 . 1 . 2117 . 1 1 140 GLU CD C 12.667 -10.325 11.733 . . . 1.0 . . . . . . . . . . . . A . 140 GLU CD . . . . . . . . . c17360_2l7l 1 . 1 . 2118 . 1 1 140 GLU CG C 11.245 -10.869 11.817 . . . 1.0 . . . . . . . . . . . . A . 140 GLU CG . . . . . . . . . c17360_2l7l 1 . 1 . 2119 . 1 1 140 GLU H H 9.605 -12.265 9.910 . . . 1.0 . . . . . . . . . . . . A . 140 GLU H . . . . . . . . . c17360_2l7l 1 . 1 . 2120 . 1 1 140 GLU HA H 8.626 -10.694 12.071 . . . 1.0 . . . . . . . . . . . . A . 140 GLU HA . . . . . . . . . c17360_2l7l 1 . 1 . 2121 . 1 1 140 GLU HB2 H 10.650 -10.090 9.905 . . . 1.0 . . . . . . . . . . . . A . 140 GLU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2122 . 1 1 140 GLU HB3 H 10.317 -9.016 11.267 . . . 1.0 . . . . . . . . . . . . A . 140 GLU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2123 . 1 1 140 GLU HG2 H 10.900 -10.821 12.837 . . . 1.0 . . . . . . . . . . . . A . 140 GLU HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2124 . 1 1 140 GLU HG3 H 11.238 -11.895 11.482 . . . 1.0 . . . . . . . . . . . . A . 140 GLU HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 2125 . 1 1 140 GLU N N 8.838 -11.928 10.417 . . . 1.0 . . . . . . . . . . . . A . 140 GLU N . . . . . . . . . c17360_2l7l 1 . 1 . 2126 . 1 1 140 GLU O O 7.344 -8.780 10.977 . . . 1.0 . . . . . . . . . . . . A . 140 GLU O . . . . . . . . . c17360_2l7l 1 . 1 . 2127 . 1 1 140 GLU OE1 O 12.878 -9.382 10.995 . . . 1.0 . . . . . . . . . . . . A . 140 GLU OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2128 . 1 1 140 GLU OE2 O 13.525 -10.860 12.415 . . . 1.0 . . . . . . . . . . . . A . 140 GLU OE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2129 . 1 1 141 PHE C C 5.416 -9.089 8.853 . . . 1.0 . . . . . . . . . . . . A . 141 PHE C . . . . . . . . . c17360_2l7l 1 . 1 . 2130 . 1 1 141 PHE CA C 6.826 -9.004 8.282 . . . 1.0 . . . . . . . . . . . . A . 141 PHE CA . . . . . . . . . c17360_2l7l 1 . 1 . 2131 . 1 1 141 PHE CB C 6.805 -9.453 6.814 . . . 1.0 . . . . . . . . . . . . A . 141 PHE CB . . . . . . . . . c17360_2l7l 1 . 1 . 2132 . 1 1 141 PHE CD1 C 4.851 -8.055 6.029 . . . 1.0 . . . . . . . . . . . . A . 141 PHE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 2133 . 1 1 141 PHE CD2 C 7.038 -7.643 5.069 . . . 1.0 . . . . . . . . . . . . A . 141 PHE CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2134 . 1 1 141 PHE CE1 C 4.311 -7.040 5.238 . . . 1.0 . . . . . . . . . . . . A . 141 PHE CE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2135 . 1 1 141 PHE CE2 C 6.493 -6.628 4.277 . . . 1.0 . . . . . . . . . . . . A . 141 PHE CE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2136 . 1 1 141 PHE CG C 6.218 -8.358 5.948 . . . 1.0 . . . . . . . . . . . . A . 141 PHE CG . . . . . . . . . c17360_2l7l 1 . 1 . 2137 . 1 1 141 PHE CZ C 5.130 -6.325 4.363 . . . 1.0 . . . . . . . . . . . . A . 141 PHE CZ . . . . . . . . . c17360_2l7l 1 . 1 . 2138 . 1 1 141 PHE H H 8.220 -10.568 8.576 . . . 1.0 . . . . . . . . . . . . A . 141 PHE H . . . . . . . . . c17360_2l7l 1 . 1 . 2139 . 1 1 141 PHE HA H 7.172 -7.984 8.332 . . . 1.0 . . . . . . . . . . . . A . 141 PHE HA . . . . . . . . . c17360_2l7l 1 . 1 . 2140 . 1 1 141 PHE HB2 H 7.815 -9.667 6.491 . . . 1.0 . . . . . . . . . . . . A . 141 PHE HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2141 . 1 1 141 PHE HB3 H 6.204 -10.346 6.721 . . . 1.0 . . . . . . . . . . . . A . 141 PHE HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2142 . 1 1 141 PHE HD1 H 4.213 -8.605 6.697 . . . 1.0 . . . . . . . . . . . . A . 141 PHE HD1 . . . . . . . . . c17360_2l7l 1 . 1 . 2143 . 1 1 141 PHE HD2 H 8.091 -7.873 5.004 . . . 1.0 . . . . . . . . . . . . A . 141 PHE HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2144 . 1 1 141 PHE HE1 H 3.259 -6.804 5.305 . . . 1.0 . . . . . . . . . . . . A . 141 PHE HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2145 . 1 1 141 PHE HE2 H 7.126 -6.075 3.600 . . . 1.0 . . . . . . . . . . . . A . 141 PHE HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2146 . 1 1 141 PHE HZ H 4.709 -5.541 3.754 . . . 1.0 . . . . . . . . . . . . A . 141 PHE HZ . . . . . . . . . c17360_2l7l 1 . 1 . 2147 . 1 1 141 PHE N N 7.735 -9.855 9.037 . . . 1.0 . . . . . . . . . . . . A . 141 PHE N . . . . . . . . . c17360_2l7l 1 . 1 . 2148 . 1 1 141 PHE O O 4.792 -8.068 9.145 . . . 1.0 . . . . . . . . . . . . A . 141 PHE O . . . . . . . . . c17360_2l7l 1 . 1 . 2149 . 1 1 142 VAL C C 3.517 -10.027 11.003 . . . 1.0 . . . . . . . . . . . . A . 142 VAL C . . . . . . . . . c17360_2l7l 1 . 1 . 2150 . 1 1 142 VAL CA C 3.579 -10.512 9.559 . . . 1.0 . . . . . . . . . . . . A . 142 VAL CA . . . . . . . . . c17360_2l7l 1 . 1 . 2151 . 1 1 142 VAL CB C 3.192 -11.993 9.478 . . . 1.0 . . . . . . . . . . . . A . 142 VAL CB . . . . . . . . . c17360_2l7l 1 . 1 . 2152 . 1 1 142 VAL CG1 C 4.277 -12.840 10.133 . . . 1.0 . . . . . . . . . . . . A . 142 VAL CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 2153 . 1 1 142 VAL CG2 C 1.864 -12.216 10.206 . . . 1.0 . . . . . . . . . . . . A . 142 VAL CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2154 . 1 1 142 VAL H H 5.463 -11.091 8.768 . . . 1.0 . . . . . . . . . . . . A . 142 VAL H . . . . . . . . . c17360_2l7l 1 . 1 . 2155 . 1 1 142 VAL HA H 2.877 -9.937 8.971 . . . 1.0 . . . . . . . . . . . . A . 142 VAL HA . . . . . . . . . c17360_2l7l 1 . 1 . 2156 . 1 1 142 VAL HB H 3.089 -12.284 8.445 . . . 1.0 . . . . . . . . . . . . A . 142 VAL HB . . . . . . . . . c17360_2l7l 1 . 1 . 2157 . 1 1 142 VAL HG11 H 5.192 -12.732 9.572 . . . 1.0 . . . . . . . . . . . . A . 142 VAL HG11 . . . . . . . . . c17360_2l7l 1 . 1 . 2158 . 1 1 142 VAL HG12 H 3.975 -13.877 10.132 . . . 1.0 . . . . . . . . . . . . A . 142 VAL HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 2159 . 1 1 142 VAL HG13 H 4.433 -12.511 11.147 . . . 1.0 . . . . . . . . . . . . A . 142 VAL HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 2160 . 1 1 142 VAL HG21 H 2.026 -12.174 11.273 . . . 1.0 . . . . . . . . . . . . A . 142 VAL HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 2161 . 1 1 142 VAL HG22 H 1.464 -13.183 9.939 . . . 1.0 . . . . . . . . . . . . A . 142 VAL HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 2162 . 1 1 142 VAL HG23 H 1.163 -11.445 9.919 . . . 1.0 . . . . . . . . . . . . A . 142 VAL HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 2163 . 1 1 142 VAL N N 4.919 -10.311 9.015 . . . 1.0 . . . . . . . . . . . . A . 142 VAL N . . . . . . . . . c17360_2l7l 1 . 1 . 2164 . 1 1 142 VAL O O 2.503 -9.489 11.446 . . . 1.0 . . . . . . . . . . . . A . 142 VAL O . . . . . . . . . c17360_2l7l 1 . 1 . 2165 . 1 1 143 GLN C C 4.616 -8.284 13.215 . . . 1.0 . . . . . . . . . . . . A . 143 GLN C . . . . . . . . . c17360_2l7l 1 . 1 . 2166 . 1 1 143 GLN CA C 4.665 -9.804 13.121 . . . 1.0 . . . . . . . . . . . . A . 143 GLN CA . . . . . . . . . c17360_2l7l 1 . 1 . 2167 . 1 1 143 GLN CB C 5.948 -10.324 13.775 . . . 1.0 . . . . . . . . . . . . A . 143 GLN CB . . . . . . . . . c17360_2l7l 1 . 1 . 2168 . 1 1 143 GLN CD C 4.820 -10.767 15.966 . . . 1.0 . . . . . . . . . . . . A . 143 GLN CD . . . . . . . . . c17360_2l7l 1 . 1 . 2169 . 1 1 143 GLN CG C 5.941 -9.999 15.273 . . . 1.0 . . . . . . . . . . . . A . 143 GLN CG . . . . . . . . . c17360_2l7l 1 . 1 . 2170 . 1 1 143 GLN H H 5.389 -10.658 11.325 . . . 1.0 . . . . . . . . . . . . A . 143 GLN H . . . . . . . . . c17360_2l7l 1 . 1 . 2171 . 1 1 143 GLN HA H 3.814 -10.213 13.642 . . . 1.0 . . . . . . . . . . . . A . 143 GLN HA . . . . . . . . . c17360_2l7l 1 . 1 . 2172 . 1 1 143 GLN HB2 H 6.010 -11.393 13.639 . . . 1.0 . . . . . . . . . . . . A . 143 GLN HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2173 . 1 1 143 GLN HB3 H 6.803 -9.852 13.312 . . . 1.0 . . . . . . . . . . . . A . 143 GLN HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2174 . 1 1 143 GLN HE21 H 4.301 -9.248 17.133 . . . 1.0 . . . . . . . . . . . . A . 143 GLN HE21 . . . . . . . . . c17360_2l7l 1 . 1 . 2175 . 1 1 143 GLN HE22 H 3.389 -10.665 17.338 . . . 1.0 . . . . . . . . . . . . A . 143 GLN HE22 . . . . . . . . . c17360_2l7l 1 . 1 . 2176 . 1 1 143 GLN HG2 H 6.890 -10.284 15.705 . . . 1.0 . . . . . . . . . . . . A . 143 GLN HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2177 . 1 1 143 GLN HG3 H 5.789 -8.940 15.416 . . . 1.0 . . . . . . . . . . . . A . 143 GLN HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 2178 . 1 1 143 GLN N N 4.608 -10.222 11.731 . . . 1.0 . . . . . . . . . . . . A . 143 GLN N . . . . . . . . . c17360_2l7l 1 . 1 . 2179 . 1 1 143 GLN NE2 N 4.111 -10.178 16.889 . . . 1.0 . . . . . . . . . . . . A . 143 GLN NE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2180 . 1 1 143 GLN O O 4.030 -7.727 14.143 . . . 1.0 . . . . . . . . . . . . A . 143 GLN O . . . . . . . . . c17360_2l7l 1 . 1 . 2181 . 1 1 143 GLN OE1 O 4.580 -11.933 15.652 . . . 1.0 . . . . . . . . . . . . A . 143 GLN OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2182 . 1 1 144 MET C C 3.915 -5.613 11.797 . . . 1.0 . . . . . . . . . . . . A . 144 MET C . . . . . . . . . c17360_2l7l 1 . 1 . 2183 . 1 1 144 MET CA C 5.261 -6.164 12.244 . . . 1.0 . . . . . . . . . . . . A . 144 MET CA . . . . . . . . . c17360_2l7l 1 . 1 . 2184 . 1 1 144 MET CB C 6.361 -5.658 11.300 . . . 1.0 . . . . . . . . . . . . A . 144 MET CB . . . . . . . . . c17360_2l7l 1 . 1 . 2185 . 1 1 144 MET CE C 6.486 -1.652 12.234 . . . 1.0 . . . . . . . . . . . . A . 144 MET CE . . . . . . . . . c17360_2l7l 1 . 1 . 2186 . 1 1 144 MET CG C 6.283 -4.129 11.161 . . . 1.0 . . . . . . . . . . . . A . 144 MET CG . . . . . . . . . c17360_2l7l 1 . 1 . 2187 . 1 1 144 MET H H 5.696 -8.114 11.540 . . . 1.0 . . . . . . . . . . . . A . 144 MET H . . . . . . . . . c17360_2l7l 1 . 1 . 2188 . 1 1 144 MET HA H 5.470 -5.816 13.243 . . . 1.0 . . . . . . . . . . . . A . 144 MET HA . . . . . . . . . c17360_2l7l 1 . 1 . 2189 . 1 1 144 MET HB2 H 7.326 -5.929 11.703 . . . 1.0 . . . . . . . . . . . . A . 144 MET HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2190 . 1 1 144 MET HB3 H 6.237 -6.114 10.329 . . . 1.0 . . . . . . . . . . . . A . 144 MET HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2191 . 1 1 144 MET HE1 H 5.621 -1.458 11.617 . . . 1.0 . . . . . . . . . . . . A . 144 MET HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2192 . 1 1 144 MET HE2 H 7.381 -1.482 11.659 . . . 1.0 . . . . . . . . . . . . A . 144 MET HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2193 . 1 1 144 MET HE3 H 6.481 -0.993 13.091 . . . 1.0 . . . . . . . . . . . . A . 144 MET HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 2194 . 1 1 144 MET HG2 H 7.084 -3.787 10.526 . . . 1.0 . . . . . . . . . . . . A . 144 MET HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2195 . 1 1 144 MET HG3 H 5.339 -3.842 10.719 . . . 1.0 . . . . . . . . . . . . A . 144 MET HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 2196 . 1 1 144 MET N N 5.241 -7.619 12.253 . . . 1.0 . . . . . . . . . . . . A . 144 MET N . . . . . . . . . c17360_2l7l 1 . 1 . 2197 . 1 1 144 MET O O 3.567 -4.485 12.132 . . . 1.0 . . . . . . . . . . . . A . 144 MET O . . . . . . . . . c17360_2l7l 1 . 1 . 2198 . 1 1 144 MET SD S 6.445 -3.369 12.795 . . . 1.0 . . . . . . . . . . . . A . 144 MET SD . . . . . . . . . c17360_2l7l 1 . 1 . 2199 . 1 1 145 MET C C 0.896 -5.773 11.686 . . . 1.0 . . . . . . . . . . . . A . 145 MET C . . . . . . . . . c17360_2l7l 1 . 1 . 2200 . 1 1 145 MET CA C 1.875 -5.973 10.534 . . . 1.0 . . . . . . . . . . . . A . 145 MET CA . . . . . . . . . c17360_2l7l 1 . 1 . 2201 . 1 1 145 MET CB C 1.325 -7.015 9.545 . . . 1.0 . . . . . . . . . . . . A . 145 MET CB . . . . . . . . . c17360_2l7l 1 . 1 . 2202 . 1 1 145 MET CE C 2.442 -4.271 7.129 . . . 1.0 . . . . . . . . . . . . A . 145 MET CE . . . . . . . . . c17360_2l7l 1 . 1 . 2203 . 1 1 145 MET CG C 1.883 -6.752 8.144 . . . 1.0 . . . . . . . . . . . . A . 145 MET CG . . . . . . . . . c17360_2l7l 1 . 1 . 2204 . 1 1 145 MET H H 3.512 -7.294 10.794 . . . 1.0 . . . . . . . . . . . . A . 145 MET H . . . . . . . . . c17360_2l7l 1 . 1 . 2205 . 1 1 145 MET HA H 1.999 -5.029 10.023 . . . 1.0 . . . . . . . . . . . . A . 145 MET HA . . . . . . . . . c17360_2l7l 1 . 1 . 2206 . 1 1 145 MET HB2 H 1.622 -8.001 9.866 . . . 1.0 . . . . . . . . . . . . A . 145 MET HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2207 . 1 1 145 MET HB3 H 0.245 -6.960 9.513 . . . 1.0 . . . . . . . . . . . . A . 145 MET HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2208 . 1 1 145 MET HE1 H 2.112 -3.307 6.761 . . . 1.0 . . . . . . . . . . . . A . 145 MET HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2209 . 1 1 145 MET HE2 H 3.092 -4.728 6.403 . . . 1.0 . . . . . . . . . . . . A . 145 MET HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2210 . 1 1 145 MET HE3 H 2.978 -4.144 8.059 . . . 1.0 . . . . . . . . . . . . A . 145 MET HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 2211 . 1 1 145 MET HG2 H 2.939 -6.537 8.215 . . . 1.0 . . . . . . . . . . . . A . 145 MET HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2212 . 1 1 145 MET HG3 H 1.734 -7.627 7.528 . . . 1.0 . . . . . . . . . . . . A . 145 MET HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 2213 . 1 1 145 MET N N 3.174 -6.406 11.036 . . . 1.0 . . . . . . . . . . . . A . 145 MET N . . . . . . . . . c17360_2l7l 1 . 1 . 2214 . 1 1 145 MET O O -0.205 -5.257 11.492 . . . 1.0 . . . . . . . . . . . . A . 145 MET O . . . . . . . . . c17360_2l7l 1 . 1 . 2215 . 1 1 145 MET SD S 1.007 -5.339 7.410 . . . 1.0 . . . . . . . . . . . . A . 145 MET SD . . . . . . . . . c17360_2l7l 1 . 1 . 2216 . 1 1 146 THR C C -0.182 -4.644 14.081 . . . 1.0 . . . . . . . . . . . . A . 146 THR C . . . . . . . . . c17360_2l7l 1 . 1 . 2217 . 1 1 146 THR CA C 0.455 -6.030 14.055 . . . 1.0 . . . . . . . . . . . . A . 146 THR CA . . . . . . . . . c17360_2l7l 1 . 1 . 2218 . 1 1 146 THR CB C 1.285 -6.246 15.325 . . . 1.0 . . . . . . . . . . . . A . 146 THR CB . . . . . . . . . c17360_2l7l 1 . 1 . 2219 . 1 1 146 THR CG2 C 1.548 -7.744 15.521 . . . 1.0 . . . . . . . . . . . . A . 146 THR CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2220 . 1 1 146 THR H H 2.195 -6.573 12.979 . . . 1.0 . . . . . . . . . . . . A . 146 THR H . . . . . . . . . c17360_2l7l 1 . 1 . 2221 . 1 1 146 THR HA H -0.327 -6.772 14.015 . . . 1.0 . . . . . . . . . . . . A . 146 THR HA . . . . . . . . . c17360_2l7l 1 . 1 . 2222 . 1 1 146 THR HB H 0.745 -5.867 16.179 . . . 1.0 . . . . . . . . . . . . A . 146 THR HB . . . . . . . . . c17360_2l7l 1 . 1 . 2223 . 1 1 146 THR HG1 H 2.344 -4.616 15.264 . . . 1.0 . . . . . . . . . . . . A . 146 THR HG1 . . . . . . . . . c17360_2l7l 1 . 1 . 2224 . 1 1 146 THR HG21 H 1.781 -8.199 14.569 . . . 1.0 . . . . . . . . . . . . A . 146 THR HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 2225 . 1 1 146 THR HG22 H 0.670 -8.211 15.938 . . . 1.0 . . . . . . . . . . . . A . 146 THR HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 2226 . 1 1 146 THR HG23 H 2.381 -7.876 16.196 . . . 1.0 . . . . . . . . . . . . A . 146 THR HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 2227 . 1 1 146 THR N N 1.305 -6.175 12.880 . . . 1.0 . . . . . . . . . . . . A . 146 THR N . . . . . . . . . c17360_2l7l 1 . 1 . 2228 . 1 1 146 THR O O 0.513 -3.630 14.016 . . . 1.0 . . . . . . . . . . . . A . 146 THR O . . . . . . . . . c17360_2l7l 1 . 1 . 2229 . 1 1 146 THR OG1 O 2.521 -5.557 15.202 . . . 1.0 . . . . . . . . . . . . A . 146 THR OG1 . . . . . . . . . c17360_2l7l 1 . 1 . 2230 . 1 1 147 ALA C C -2.029 -2.642 15.536 . . . 1.0 . . . . . . . . . . . . A . 147 ALA C . . . . . . . . . c17360_2l7l 1 . 1 . 2231 . 1 1 147 ALA CA C -2.225 -3.344 14.198 . . . 1.0 . . . . . . . . . . . . A . 147 ALA CA . . . . . . . . . c17360_2l7l 1 . 1 . 2232 . 1 1 147 ALA CB C -3.716 -3.588 13.964 . . . 1.0 . . . . . . . . . . . . A . 147 ALA CB . . . . . . . . . c17360_2l7l 1 . 1 . 2233 . 1 1 147 ALA H H -2.012 -5.449 14.224 . . . 1.0 . . . . . . . . . . . . A . 147 ALA H . . . . . . . . . c17360_2l7l 1 . 1 . 2234 . 1 1 147 ALA HA H -1.850 -2.709 13.411 . . . 1.0 . . . . . . . . . . . . A . 147 ALA HA . . . . . . . . . c17360_2l7l 1 . 1 . 2235 . 1 1 147 ALA HB1 H -3.856 -4.083 13.015 . . . 1.0 . . . . . . . . . . . . A . 147 ALA HB1 . . . . . . . . . c17360_2l7l 1 . 1 . 2236 . 1 1 147 ALA HB2 H -4.240 -2.643 13.958 . . . 1.0 . . . . . . . . . . . . A . 147 ALA HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2237 . 1 1 147 ALA HB3 H -4.108 -4.210 14.756 . . . 1.0 . . . . . . . . . . . . A . 147 ALA HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2238 . 1 1 147 ALA N N -1.507 -4.610 14.171 . . . 1.0 . . . . . . . . . . . . A . 147 ALA N . . . . . . . . . c17360_2l7l 1 . 1 . 2239 . 1 1 147 ALA O O -2.637 -1.605 15.797 . . . 1.0 . . . . . . . . . . . . A . 147 ALA O . . . . . . . . . c17360_2l7l 1 . 1 . 2240 . 1 1 148 LYS C C 0.528 -2.923 18.125 . . . 1.0 . . . . . . . . . . . . A . 148 LYS C . . . . . . . . . c17360_2l7l 1 . 1 . 2241 . 1 1 148 LYS CA C -0.905 -2.628 17.696 . . . 1.0 . . . . . . . . . . . . A . 148 LYS CA . . . . . . . . . c17360_2l7l 1 . 1 . 2242 . 1 1 148 LYS CB C -1.873 -3.198 18.732 . . . 1.0 . . . . . . . . . . . . A . 148 LYS CB . . . . . . . . . c17360_2l7l 1 . 1 . 2243 . 1 1 148 LYS CD C -4.232 -3.114 19.568 . . . 1.0 . . . . . . . . . . . . A . 148 LYS CD . . . . . . . . . c17360_2l7l 1 . 1 . 2244 . 1 1 148 LYS CE C -4.412 -4.636 19.598 . . . 1.0 . . . . . . . . . . . . A . 148 LYS CE . . . . . . . . . c17360_2l7l 1 . 1 . 2245 . 1 1 148 LYS CG C -3.294 -2.719 18.424 . . . 1.0 . . . . . . . . . . . . A . 148 LYS CG . . . . . . . . . c17360_2l7l 1 . 1 . 2246 . 1 1 148 LYS H H -0.718 -4.039 16.123 . . . 1.0 . . . . . . . . . . . . A . 148 LYS H . . . . . . . . . c17360_2l7l 1 . 1 . 2247 . 1 1 148 LYS HA H -1.039 -1.557 17.646 . . . 1.0 . . . . . . . . . . . . A . 148 LYS HA . . . . . . . . . c17360_2l7l 1 . 1 . 2248 . 1 1 148 LYS HB2 H -1.837 -4.277 18.693 . . . 1.0 . . . . . . . . . . . . A . 148 LYS HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2249 . 1 1 148 LYS HB3 H -1.587 -2.863 19.718 . . . 1.0 . . . . . . . . . . . . A . 148 LYS HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2250 . 1 1 148 LYS HD2 H -3.806 -2.786 20.506 . . . 1.0 . . . . . . . . . . . . A . 148 LYS HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2251 . 1 1 148 LYS HD3 H -5.192 -2.642 19.426 . . . 1.0 . . . . . . . . . . . . A . 148 LYS HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 2252 . 1 1 148 LYS HE2 H -4.559 -5.005 18.594 . . . 1.0 . . . . . . . . . . . . A . 148 LYS HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2253 . 1 1 148 LYS HE3 H -3.535 -5.096 20.026 . . . 1.0 . . . . . . . . . . . . A . 148 LYS HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 2254 . 1 1 148 LYS HG2 H -3.293 -1.644 18.312 . . . 1.0 . . . . . . . . . . . . A . 148 LYS HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2255 . 1 1 148 LYS HG3 H -3.637 -3.174 17.506 . . . 1.0 . . . . . . . . . . . . A . 148 LYS HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 2256 . 1 1 148 LYS HZ1 H -6.322 -5.426 19.831 . . . 1.0 . . . . . . . . . . . . A . 148 LYS HZ1 . . . . . . . . . c17360_2l7l 1 . 1 . 2257 . 1 1 148 LYS HZ2 H -5.987 -4.109 20.851 . . . 1.0 . . . . . . . . . . . . A . 148 LYS HZ2 . . . . . . . . . c17360_2l7l 1 . 1 . 2258 . 1 1 148 LYS HZ3 H -5.317 -5.635 21.181 . . . 1.0 . . . . . . . . . . . . A . 148 LYS HZ3 . . . . . . . . . c17360_2l7l 1 . 1 . 2259 . 1 1 148 LYS N N -1.176 -3.212 16.383 . . . 1.0 . . . . . . . . . . . . A . 148 LYS N . . . . . . . . . c17360_2l7l 1 . 1 . 2260 . 1 1 148 LYS NZ N -5.599 -4.978 20.427 . . . 1.0 . . . . . . . . . . . . A . 148 LYS NZ . . . . . . . . . c17360_2l7l 1 . 1 . 2261 . 1 1 148 LYS O O 0.917 -2.455 19.182 . . . 1.0 . . . . . . . . . . . . A . 148 LYS O . . . . . . . . . c17360_2l7l 1 . 1 . 2262 . 1 1 148 LYS OXT O 1.216 -3.613 17.389 . . . 1.0 . . . . . . . . . . . . A . 148 LYS OXT . . . . . . . . . c17360_2l7l 1 . 1 . 2263 . 2 2 1 ALA C C 5.671 2.861 11.053 . . . 1.0 . . . . . . . . . . . . B . 299 ALA C . . . . . . . . . c17360_2l7l 1 . 1 . 2264 . 2 2 1 ALA CA C 6.631 3.918 11.588 . . . 1.0 . . . . . . . . . . . . B . 299 ALA CA . . . . . . . . . c17360_2l7l 1 . 1 . 2265 . 2 2 1 ALA CB C 7.525 3.309 12.669 . . . 1.0 . . . . . . . . . . . . B . 299 ALA CB . . . . . . . . . c17360_2l7l 1 . 1 . 2266 . 2 2 1 ALA H1 H 5.238 4.687 12.929 . . . 1.0 . . . . . . . . . . . . B . 299 ALA H1 . . . . . . . . . c17360_2l7l 1 . 1 . 2267 . 2 2 1 ALA H2 H 5.266 5.479 11.426 . . . 1.0 . . . . . . . . . . . . B . 299 ALA H2 . . . . . . . . . c17360_2l7l 1 . 1 . 2268 . 2 2 1 ALA H3 H 6.504 5.753 12.558 . . . 1.0 . . . . . . . . . . . . B . 299 ALA H3 . . . . . . . . . c17360_2l7l 1 . 1 . 2269 . 2 2 1 ALA HA H 7.244 4.285 10.779 . . . 1.0 . . . . . . . . . . . . B . 299 ALA HA . . . . . . . . . c17360_2l7l 1 . 1 . 2270 . 2 2 1 ALA HB1 H 6.912 2.937 13.477 . . . 1.0 . . . . . . . . . . . . B . 299 ALA HB1 . . . . . . . . . c17360_2l7l 1 . 1 . 2271 . 2 2 1 ALA HB2 H 8.197 4.066 13.049 . . . 1.0 . . . . . . . . . . . . B . 299 ALA HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2272 . 2 2 1 ALA HB3 H 8.098 2.498 12.248 . . . 1.0 . . . . . . . . . . . . B . 299 ALA HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2273 . 2 2 1 ALA N N 5.851 5.044 12.169 . . . 1.0 . . . . . . . . . . . . B . 299 ALA N . . . . . . . . . c17360_2l7l 1 . 1 . 2274 . 2 2 1 ALA O O 5.803 2.407 9.917 . . . 1.0 . . . . . . . . . . . . B . 299 ALA O . . . . . . . . . c17360_2l7l 1 . 1 . 2275 . 2 2 2 LYS C C 2.933 1.950 10.285 . . . 1.0 . . . . . . . . . . . . B . 300 LYS C . . . . . . . . . c17360_2l7l 1 . 1 . 2276 . 2 2 2 LYS CA C 3.748 1.450 11.483 . . . 1.0 . . . . . . . . . . . . B . 300 LYS CA . . . . . . . . . c17360_2l7l 1 . 1 . 2277 . 2 2 2 LYS CB C 2.815 1.130 12.668 . . . 1.0 . . . . . . . . . . . . B . 300 LYS CB . . . . . . . . . c17360_2l7l 1 . 1 . 2278 . 2 2 2 LYS CD C 1.713 -0.640 11.269 . . . 1.0 . . . . . . . . . . . . B . 300 LYS CD . . . . . . . . . c17360_2l7l 1 . 1 . 2279 . 2 2 2 LYS CE C 0.858 -1.902 11.388 . . . 1.0 . . . . . . . . . . . . B . 300 LYS CE . . . . . . . . . c17360_2l7l 1 . 1 . 2280 . 2 2 2 LYS CG C 2.378 -0.339 12.614 . . . 1.0 . . . . . . . . . . . . B . 300 LYS CG . . . . . . . . . c17360_2l7l 1 . 1 . 2281 . 2 2 2 LYS H H 4.660 2.854 12.780 . . . 1.0 . . . . . . . . . . . . B . 300 LYS H . . . . . . . . . c17360_2l7l 1 . 1 . 2282 . 2 2 2 LYS HA H 4.279 0.558 11.194 . . . 1.0 . . . . . . . . . . . . B . 300 LYS HA . . . . . . . . . c17360_2l7l 1 . 1 . 2283 . 2 2 2 LYS HB2 H 3.334 1.316 13.595 . . . 1.0 . . . . . . . . . . . . B . 300 LYS HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2284 . 2 2 2 LYS HB3 H 1.936 1.761 12.620 . . . 1.0 . . . . . . . . . . . . B . 300 LYS HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2285 . 2 2 2 LYS HD2 H 1.096 0.192 10.970 . . . 1.0 . . . . . . . . . . . . B . 300 LYS HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2286 . 2 2 2 LYS HD3 H 2.476 -0.807 10.528 . . . 1.0 . . . . . . . . . . . . B . 300 LYS HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 2287 . 2 2 2 LYS HE2 H 0.118 -1.768 12.164 . . . 1.0 . . . . . . . . . . . . B . 300 LYS HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2288 . 2 2 2 LYS HE3 H 0.365 -2.095 10.446 . . . 1.0 . . . . . . . . . . . . B . 300 LYS HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 2289 . 2 2 2 LYS HG2 H 3.252 -0.965 12.724 . . . 1.0 . . . . . . . . . . . . B . 300 LYS HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2290 . 2 2 2 LYS HG3 H 1.688 -0.540 13.417 . . . 1.0 . . . . . . . . . . . . B . 300 LYS HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 2291 . 2 2 2 LYS HZ1 H 2.143 -3.448 10.866 . . . 1.0 . . . . . . . . . . . . B . 300 LYS HZ1 . . . . . . . . . c17360_2l7l 1 . 1 . 2292 . 2 2 2 LYS HZ2 H 1.166 -3.782 12.215 . . . 1.0 . . . . . . . . . . . . B . 300 LYS HZ2 . . . . . . . . . c17360_2l7l 1 . 1 . 2293 . 2 2 2 LYS HZ3 H 2.494 -2.733 12.364 . . . 1.0 . . . . . . . . . . . . B . 300 LYS HZ3 . . . . . . . . . c17360_2l7l 1 . 1 . 2294 . 2 2 2 LYS N N 4.714 2.465 11.882 . . . 1.0 . . . . . . . . . . . . B . 300 LYS N . . . . . . . . . c17360_2l7l 1 . 1 . 2295 . 2 2 2 LYS NZ N 1.730 -3.052 11.734 . . . 1.0 . . . . . . . . . . . . B . 300 LYS NZ . . . . . . . . . c17360_2l7l 1 . 1 . 2296 . 2 2 2 LYS O O 2.563 1.181 9.399 . . . 1.0 . . . . . . . . . . . . B . 300 LYS O . . . . . . . . . c17360_2l7l 1 . 1 . 2297 . 2 2 3 SER C C 2.574 3.562 7.844 . . . 1.0 . . . . . . . . . . . . B . 301 SER C . . . . . . . . . c17360_2l7l 1 . 1 . 2298 . 2 2 3 SER CA C 1.888 3.827 9.178 . . . 1.0 . . . . . . . . . . . . B . 301 SER CA . . . . . . . . . c17360_2l7l 1 . 1 . 2299 . 2 2 3 SER CB C 1.740 5.333 9.391 . . . 1.0 . . . . . . . . . . . . B . 301 SER CB . . . . . . . . . c17360_2l7l 1 . 1 . 2300 . 2 2 3 SER H H 2.980 3.819 10.993 . . . 1.0 . . . . . . . . . . . . B . 301 SER H . . . . . . . . . c17360_2l7l 1 . 1 . 2301 . 2 2 3 SER HA H 0.908 3.377 9.164 . . . 1.0 . . . . . . . . . . . . B . 301 SER HA . . . . . . . . . c17360_2l7l 1 . 1 . 2302 . 2 2 3 SER HB2 H 1.017 5.518 10.168 . . . 1.0 . . . . . . . . . . . . B . 301 SER HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2303 . 2 2 3 SER HB3 H 2.695 5.749 9.683 . . . 1.0 . . . . . . . . . . . . B . 301 SER HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2304 . 2 2 3 SER HG H 1.858 6.693 8.006 . . . 1.0 . . . . . . . . . . . . B . 301 SER HG . . . . . . . . . c17360_2l7l 1 . 1 . 2305 . 2 2 3 SER N N 2.659 3.245 10.266 . . . 1.0 . . . . . . . . . . . . B . 301 SER N . . . . . . . . . c17360_2l7l 1 . 1 . 2306 . 2 2 3 SER O O 1.925 3.204 6.867 . . . 1.0 . . . . . . . . . . . . B . 301 SER O . . . . . . . . . c17360_2l7l 1 . 1 . 2307 . 2 2 3 SER OG O 1.294 5.937 8.184 . . . 1.0 . . . . . . . . . . . . B . 301 SER OG . . . . . . . . . c17360_2l7l 1 . 1 . 2308 . 2 2 4 LYS C C 4.502 2.066 6.116 . . . 1.0 . . . . . . . . . . . . B . 302 LYS C . . . . . . . . . c17360_2l7l 1 . 1 . 2309 . 2 2 4 LYS CA C 4.652 3.512 6.586 . . . 1.0 . . . . . . . . . . . . B . 302 LYS CA . . . . . . . . . c17360_2l7l 1 . 1 . 2310 . 2 2 4 LYS CB C 6.129 3.818 6.843 . . . 1.0 . . . . . . . . . . . . B . 302 LYS CB . . . . . . . . . c17360_2l7l 1 . 1 . 2311 . 2 2 4 LYS CD C 5.922 6.237 6.169 . . . 1.0 . . . . . . . . . . . . B . 302 LYS CD . . . . . . . . . c17360_2l7l 1 . 1 . 2312 . 2 2 4 LYS CE C 6.519 7.615 6.448 . . . 1.0 . . . . . . . . . . . . B . 302 LYS CE . . . . . . . . . c17360_2l7l 1 . 1 . 2313 . 2 2 4 LYS CG C 6.291 5.272 7.304 . . . 1.0 . . . . . . . . . . . . B . 302 LYS CG . . . . . . . . . c17360_2l7l 1 . 1 . 2314 . 2 2 4 LYS H H 4.358 4.017 8.626 . . . 1.0 . . . . . . . . . . . . B . 302 LYS H . . . . . . . . . c17360_2l7l 1 . 1 . 2315 . 2 2 4 LYS HA H 4.283 4.165 5.815 . . . 1.0 . . . . . . . . . . . . B . 302 LYS HA . . . . . . . . . c17360_2l7l 1 . 1 . 2316 . 2 2 4 LYS HB2 H 6.506 3.154 7.608 . . . 1.0 . . . . . . . . . . . . B . 302 LYS HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2317 . 2 2 4 LYS HB3 H 6.689 3.669 5.933 . . . 1.0 . . . . . . . . . . . . B . 302 LYS HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2318 . 2 2 4 LYS HD2 H 6.306 5.864 5.232 . . . 1.0 . . . . . . . . . . . . B . 302 LYS HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2319 . 2 2 4 LYS HD3 H 4.849 6.332 6.108 . . . 1.0 . . . . . . . . . . . . B . 302 LYS HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 2320 . 2 2 4 LYS HE2 H 7.588 7.527 6.575 . . . 1.0 . . . . . . . . . . . . B . 302 LYS HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2321 . 2 2 4 LYS HE3 H 6.308 8.272 5.617 . . . 1.0 . . . . . . . . . . . . B . 302 LYS HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 2322 . 2 2 4 LYS HG2 H 5.640 5.448 8.149 . . . 1.0 . . . . . . . . . . . . B . 302 LYS HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2323 . 2 2 4 LYS HG3 H 7.316 5.440 7.603 . . . 1.0 . . . . . . . . . . . . B . 302 LYS HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 2324 . 2 2 4 LYS HZ1 H 6.282 7.663 8.515 . . . 1.0 . . . . . . . . . . . . B . 302 LYS HZ1 . . . . . . . . . c17360_2l7l 1 . 1 . 2325 . 2 2 4 LYS HZ2 H 4.876 8.064 7.647 . . . 1.0 . . . . . . . . . . . . B . 302 LYS HZ2 . . . . . . . . . c17360_2l7l 1 . 1 . 2326 . 2 2 4 LYS HZ3 H 6.152 9.181 7.769 . . . 1.0 . . . . . . . . . . . . B . 302 LYS HZ3 . . . . . . . . . c17360_2l7l 1 . 1 . 2327 . 2 2 4 LYS N N 3.889 3.734 7.812 . . . 1.0 . . . . . . . . . . . . B . 302 LYS N . . . . . . . . . c17360_2l7l 1 . 1 . 2328 . 2 2 4 LYS NZ N 5.911 8.174 7.688 . . . 1.0 . . . . . . . . . . . . B . 302 LYS NZ . . . . . . . . . c17360_2l7l 1 . 1 . 2329 . 2 2 4 LYS O O 4.361 1.797 4.918 . . . 1.0 . . . . . . . . . . . . B . 302 LYS O . . . . . . . . . c17360_2l7l 1 . 1 . 2330 . 2 2 5 TRP C C 3.049 -0.508 6.031 . . . 1.0 . . . . . . . . . . . . B . 303 TRP C . . . . . . . . . c17360_2l7l 1 . 1 . 2331 . 2 2 5 TRP CA C 4.383 -0.272 6.725 . . . 1.0 . . . . . . . . . . . . B . 303 TRP CA . . . . . . . . . c17360_2l7l 1 . 1 . 2332 . 2 2 5 TRP CB C 4.476 -1.127 7.999 . . . 1.0 . . . . . . . . . . . . B . 303 TRP CB . . . . . . . . . c17360_2l7l 1 . 1 . 2333 . 2 2 5 TRP CD1 C 6.565 -0.732 9.304 . . . 1.0 . . . . . . . . . . . . B . 303 TRP CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 2334 . 2 2 5 TRP CD2 C 6.815 -2.316 7.758 . . . 1.0 . . . . . . . . . . . . B . 303 TRP CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2335 . 2 2 5 TRP CE2 C 8.063 -2.202 8.407 . . . 1.0 . . . . . . . . . . . . B . 303 TRP CE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2336 . 2 2 5 TRP CE3 C 6.680 -3.243 6.733 . . . 1.0 . . . . . . . . . . . . B . 303 TRP CE3 . . . . . . . . . c17360_2l7l 1 . 1 . 2337 . 2 2 5 TRP CG C 5.894 -1.375 8.349 . . . 1.0 . . . . . . . . . . . . B . 303 TRP CG . . . . . . . . . c17360_2l7l 1 . 1 . 2338 . 2 2 5 TRP CH2 C 9.003 -3.918 7.008 . . . 1.0 . . . . . . . . . . . . B . 303 TRP CH2 . . . . . . . . . c17360_2l7l 1 . 1 . 2339 . 2 2 5 TRP CZ2 C 9.150 -2.994 8.041 . . . 1.0 . . . . . . . . . . . . B . 303 TRP CZ2 . . . . . . . . . c17360_2l7l 1 . 1 . 2340 . 2 2 5 TRP CZ3 C 7.771 -4.044 6.354 . . . 1.0 . . . . . . . . . . . . B . 303 TRP CZ3 . . . . . . . . . c17360_2l7l 1 . 1 . 2341 . 2 2 5 TRP H H 4.635 1.405 7.997 . . . 1.0 . . . . . . . . . . . . B . 303 TRP H . . . . . . . . . c17360_2l7l 1 . 1 . 2342 . 2 2 5 TRP HA H 5.177 -0.552 6.046 . . . 1.0 . . . . . . . . . . . . B . 303 TRP HA . . . . . . . . . c17360_2l7l 1 . 1 . 2343 . 2 2 5 TRP HB2 H 4.013 -0.606 8.804 . . . 1.0 . . . . . . . . . . . . B . 303 TRP HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2344 . 2 2 5 TRP HB3 H 3.986 -2.065 7.855 . . . 1.0 . . . . . . . . . . . . B . 303 TRP HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2345 . 2 2 5 TRP HD1 H 6.151 0.030 9.926 . . . 1.0 . . . . . . . . . . . . B . 303 TRP HD1 . . . . . . . . . c17360_2l7l 1 . 1 . 2346 . 2 2 5 TRP HE1 H 8.558 -0.917 9.966 . . . 1.0 . . . . . . . . . . . . B . 303 TRP HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2347 . 2 2 5 TRP HE3 H 5.725 -3.336 6.238 . . . 1.0 . . . . . . . . . . . . B . 303 TRP HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 2348 . 2 2 5 TRP HH2 H 9.836 -4.535 6.709 . . . 1.0 . . . . . . . . . . . . B . 303 TRP HH2 . . . . . . . . . c17360_2l7l 1 . 1 . 2349 . 2 2 5 TRP HZ2 H 10.097 -2.888 8.546 . . . 1.0 . . . . . . . . . . . . B . 303 TRP HZ2 . . . . . . . . . c17360_2l7l 1 . 1 . 2350 . 2 2 5 TRP HZ3 H 7.664 -4.755 5.560 . . . 1.0 . . . . . . . . . . . . B . 303 TRP HZ3 . . . . . . . . . c17360_2l7l 1 . 1 . 2351 . 2 2 5 TRP N N 4.526 1.139 7.061 . . . 1.0 . . . . . . . . . . . . B . 303 TRP N . . . . . . . . . c17360_2l7l 1 . 1 . 2352 . 2 2 5 TRP NE1 N 7.860 -1.220 9.351 . . . 1.0 . . . . . . . . . . . . B . 303 TRP NE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2353 . 2 2 5 TRP O O 2.994 -1.179 5.005 . . . 1.0 . . . . . . . . . . . . B . 303 TRP O . . . . . . . . . c17360_2l7l 1 . 1 . 2354 . 2 2 6 LYS C C 0.621 0.464 4.585 . . . 1.0 . . . . . . . . . . . . B . 304 LYS C . . . . . . . . . c17360_2l7l 1 . 1 . 2355 . 2 2 6 LYS CA C 0.656 -0.099 6.001 . . . 1.0 . . . . . . . . . . . . B . 304 LYS CA . . . . . . . . . c17360_2l7l 1 . 1 . 2356 . 2 2 6 LYS CB C -0.394 0.615 6.855 . . . 1.0 . . . . . . . . . . . . B . 304 LYS CB . . . . . . . . . c17360_2l7l 1 . 1 . 2357 . 2 2 6 LYS CD C -1.719 0.511 8.963 . . . 1.0 . . . . . . . . . . . . B . 304 LYS CD . . . . . . . . . c17360_2l7l 1 . 1 . 2358 . 2 2 6 LYS CE C -2.011 -0.313 10.218 . . . 1.0 . . . . . . . . . . . . B . 304 LYS CE . . . . . . . . . c17360_2l7l 1 . 1 . 2359 . 2 2 6 LYS CG C -0.613 -0.163 8.152 . . . 1.0 . . . . . . . . . . . . B . 304 LYS CG . . . . . . . . . c17360_2l7l 1 . 1 . 2360 . 2 2 6 LYS H H 2.090 0.591 7.412 . . . 1.0 . . . . . . . . . . . . B . 304 LYS H . . . . . . . . . c17360_2l7l 1 . 1 . 2361 . 2 2 6 LYS HA H 0.411 -1.149 5.966 . . . 1.0 . . . . . . . . . . . . B . 304 LYS HA . . . . . . . . . c17360_2l7l 1 . 1 . 2362 . 2 2 6 LYS HB2 H -0.045 1.612 7.086 . . . 1.0 . . . . . . . . . . . . B . 304 LYS HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2363 . 2 2 6 LYS HB3 H -1.324 0.677 6.310 . . . 1.0 . . . . . . . . . . . . B . 304 LYS HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2364 . 2 2 6 LYS HD2 H -1.399 1.502 9.249 . . . 1.0 . . . . . . . . . . . . B . 304 LYS HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2365 . 2 2 6 LYS HD3 H -2.611 0.578 8.361 . . . 1.0 . . . . . . . . . . . . B . 304 LYS HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 2366 . 2 2 6 LYS HE2 H -2.289 -1.317 9.936 . . . 1.0 . . . . . . . . . . . . B . 304 LYS HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2367 . 2 2 6 LYS HE3 H -1.132 -0.345 10.835 . . . 1.0 . . . . . . . . . . . . B . 304 LYS HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 2368 . 2 2 6 LYS HG2 H -0.902 -1.178 7.920 . . . 1.0 . . . . . . . . . . . . B . 304 LYS HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2369 . 2 2 6 LYS HG3 H 0.300 -0.170 8.727 . . . 1.0 . . . . . . . . . . . . B . 304 LYS HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 2370 . 2 2 6 LYS HZ1 H -3.517 1.105 10.442 . . . 1.0 . . . . . . . . . . . . B . 304 LYS HZ1 . . . . . . . . . c17360_2l7l 1 . 1 . 2371 . 2 2 6 LYS HZ2 H -2.761 0.657 11.896 . . . 1.0 . . . . . . . . . . . . B . 304 LYS HZ2 . . . . . . . . . c17360_2l7l 1 . 1 . 2372 . 2 2 6 LYS HZ3 H -3.868 -0.394 11.152 . . . 1.0 . . . . . . . . . . . . B . 304 LYS HZ3 . . . . . . . . . c17360_2l7l 1 . 1 . 2373 . 2 2 6 LYS N N 1.982 0.058 6.590 . . . 1.0 . . . . . . . . . . . . B . 304 LYS N . . . . . . . . . c17360_2l7l 1 . 1 . 2374 . 2 2 6 LYS NZ N -3.122 0.312 10.984 . . . 1.0 . . . . . . . . . . . . B . 304 LYS NZ . . . . . . . . . c17360_2l7l 1 . 1 . 2375 . 2 2 6 LYS O O 0.008 -0.119 3.691 . . . 1.0 . . . . . . . . . . . . B . 304 LYS O . . . . . . . . . c17360_2l7l 1 . 1 . 2376 . 2 2 7 GLN C C 1.825 1.267 2.018 . . . 1.0 . . . . . . . . . . . . B . 305 GLN C . . . . . . . . . c17360_2l7l 1 . 1 . 2377 . 2 2 7 GLN CA C 1.311 2.230 3.077 . . . 1.0 . . . . . . . . . . . . B . 305 GLN CA . . . . . . . . . c17360_2l7l 1 . 1 . 2378 . 2 2 7 GLN CB C 2.211 3.463 3.110 . . . 1.0 . . . . . . . . . . . . B . 305 GLN CB . . . . . . . . . c17360_2l7l 1 . 1 . 2379 . 2 2 7 GLN CD C 2.454 5.785 4.014 . . . 1.0 . . . . . . . . . . . . B . 305 GLN CD . . . . . . . . . c17360_2l7l 1 . 1 . 2380 . 2 2 7 GLN CG C 1.535 4.572 3.914 . . . 1.0 . . . . . . . . . . . . B . 305 GLN CG . . . . . . . . . c17360_2l7l 1 . 1 . 2381 . 2 2 7 GLN H H 1.745 2.021 5.140 . . . 1.0 . . . . . . . . . . . . B . 305 GLN H . . . . . . . . . c17360_2l7l 1 . 1 . 2382 . 2 2 7 GLN HA H 0.313 2.539 2.812 . . . 1.0 . . . . . . . . . . . . B . 305 GLN HA . . . . . . . . . c17360_2l7l 1 . 1 . 2383 . 2 2 7 GLN HB2 H 3.150 3.204 3.572 . . . 1.0 . . . . . . . . . . . . B . 305 GLN HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2384 . 2 2 7 GLN HB3 H 2.388 3.808 2.102 . . . 1.0 . . . . . . . . . . . . B . 305 GLN HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2385 . 2 2 7 GLN HE21 H 0.967 7.099 3.984 . . . 1.0 . . . . . . . . . . . . B . 305 GLN HE21 . . . . . . . . . c17360_2l7l 1 . 1 . 2386 . 2 2 7 GLN HE22 H 2.523 7.768 4.097 . . . 1.0 . . . . . . . . . . . . B . 305 GLN HE22 . . . . . . . . . c17360_2l7l 1 . 1 . 2387 . 2 2 7 GLN HG2 H 0.620 4.856 3.424 . . . 1.0 . . . . . . . . . . . . B . 305 GLN HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2388 . 2 2 7 GLN HG3 H 1.311 4.211 4.902 . . . 1.0 . . . . . . . . . . . . B . 305 GLN HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 2389 . 2 2 7 GLN N N 1.277 1.599 4.389 . . . 1.0 . . . . . . . . . . . . B . 305 GLN N . . . . . . . . . c17360_2l7l 1 . 1 . 2390 . 2 2 7 GLN NE2 N 1.939 6.984 4.033 . . . 1.0 . . . . . . . . . . . . B . 305 GLN NE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2391 . 2 2 7 GLN O O 1.074 0.832 1.148 . . . 1.0 . . . . . . . . . . . . B . 305 GLN O . . . . . . . . . c17360_2l7l 1 . 1 . 2392 . 2 2 7 GLN OE1 O 3.675 5.637 4.079 . . . 1.0 . . . . . . . . . . . . B . 305 GLN OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2393 . 2 2 8 ALA C C 3.005 -1.316 1.124 . . . 1.0 . . . . . . . . . . . . B . 306 ALA C . . . . . . . . . c17360_2l7l 1 . 1 . 2394 . 2 2 8 ALA CA C 3.707 0.036 1.116 . . . 1.0 . . . . . . . . . . . . B . 306 ALA CA . . . . . . . . . c17360_2l7l 1 . 1 . 2395 . 2 2 8 ALA CB C 5.190 -0.163 1.433 . . . 1.0 . . . . . . . . . . . . B . 306 ALA CB . . . . . . . . . c17360_2l7l 1 . 1 . 2396 . 2 2 8 ALA H H 3.668 1.325 2.807 . . . 1.0 . . . . . . . . . . . . B . 306 ALA H . . . . . . . . . c17360_2l7l 1 . 1 . 2397 . 2 2 8 ALA HA H 3.620 0.471 0.132 . . . 1.0 . . . . . . . . . . . . B . 306 ALA HA . . . . . . . . . c17360_2l7l 1 . 1 . 2398 . 2 2 8 ALA HB1 H 5.628 -0.835 0.709 . . . 1.0 . . . . . . . . . . . . B . 306 ALA HB1 . . . . . . . . . c17360_2l7l 1 . 1 . 2399 . 2 2 8 ALA HB2 H 5.293 -0.585 2.422 . . . 1.0 . . . . . . . . . . . . B . 306 ALA HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2400 . 2 2 8 ALA HB3 H 5.698 0.789 1.394 . . . 1.0 . . . . . . . . . . . . B . 306 ALA HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2401 . 2 2 8 ALA N N 3.111 0.942 2.092 . . . 1.0 . . . . . . . . . . . . B . 306 ALA N . . . . . . . . . c17360_2l7l 1 . 1 . 2402 . 2 2 8 ALA O O 2.764 -1.907 0.070 . . . 1.0 . . . . . . . . . . . . B . 306 ALA O . . . . . . . . . c17360_2l7l 1 . 1 . 2403 . 2 2 9 PHE C C 0.669 -3.086 1.712 . . . 1.0 . . . . . . . . . . . . B . 307 PHE C . . . . . . . . . c17360_2l7l 1 . 1 . 2404 . 2 2 9 PHE CA C 2.016 -3.093 2.436 . . . 1.0 . . . . . . . . . . . . B . 307 PHE CA . . . . . . . . . c17360_2l7l 1 . 1 . 2405 . 2 2 9 PHE CB C 1.792 -3.422 3.915 . . . 1.0 . . . . . . . . . . . . B . 307 PHE CB . . . . . . . . . c17360_2l7l 1 . 1 . 2406 . 2 2 9 PHE CD1 C 1.390 -5.882 3.573 . . . 1.0 . . . . . . . . . . . . B . 307 PHE CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 2407 . 2 2 9 PHE CD2 C -0.347 -4.558 4.633 . . . 1.0 . . . . . . . . . . . . B . 307 PHE CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2408 . 2 2 9 PHE CE1 C 0.585 -7.017 3.683 . . . 1.0 . . . . . . . . . . . . B . 307 PHE CE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2409 . 2 2 9 PHE CE2 C -1.148 -5.694 4.743 . . . 1.0 . . . . . . . . . . . . B . 307 PHE CE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2410 . 2 2 9 PHE CG C 0.925 -4.653 4.046 . . . 1.0 . . . . . . . . . . . . B . 307 PHE CG . . . . . . . . . c17360_2l7l 1 . 1 . 2411 . 2 2 9 PHE CZ C -0.683 -6.922 4.267 . . . 1.0 . . . . . . . . . . . . B . 307 PHE CZ . . . . . . . . . c17360_2l7l 1 . 1 . 2412 . 2 2 9 PHE H H 2.904 -1.295 3.122 . . . 1.0 . . . . . . . . . . . . B . 307 PHE H . . . . . . . . . c17360_2l7l 1 . 1 . 2413 . 2 2 9 PHE HA H 2.652 -3.851 2.005 . . . 1.0 . . . . . . . . . . . . B . 307 PHE HA . . . . . . . . . c17360_2l7l 1 . 1 . 2414 . 2 2 9 PHE HB2 H 2.741 -3.604 4.391 . . . 1.0 . . . . . . . . . . . . B . 307 PHE HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2415 . 2 2 9 PHE HB3 H 1.301 -2.593 4.391 . . . 1.0 . . . . . . . . . . . . B . 307 PHE HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2416 . 2 2 9 PHE HD1 H 2.368 -5.955 3.121 . . . 1.0 . . . . . . . . . . . . B . 307 PHE HD1 . . . . . . . . . c17360_2l7l 1 . 1 . 2417 . 2 2 9 PHE HD2 H -0.705 -3.607 5.005 . . . 1.0 . . . . . . . . . . . . B . 307 PHE HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2418 . 2 2 9 PHE HE1 H 0.941 -7.969 3.317 . . . 1.0 . . . . . . . . . . . . B . 307 PHE HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2419 . 2 2 9 PHE HE2 H -2.126 -5.625 5.194 . . . 1.0 . . . . . . . . . . . . B . 307 PHE HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2420 . 2 2 9 PHE HZ H -1.303 -7.793 4.348 . . . 1.0 . . . . . . . . . . . . B . 307 PHE HZ . . . . . . . . . c17360_2l7l 1 . 1 . 2421 . 2 2 9 PHE N N 2.683 -1.804 2.314 . . . 1.0 . . . . . . . . . . . . B . 307 PHE N . . . . . . . . . c17360_2l7l 1 . 1 . 2422 . 2 2 9 PHE O O 0.391 -3.955 0.883 . . . 1.0 . . . . . . . . . . . . B . 307 PHE O . . . . . . . . . c17360_2l7l 1 . 1 . 2423 . 2 2 10 ASN C C -1.380 -1.710 -0.054 . . . 1.0 . . . . . . . . . . . . B . 308 ASN C . . . . . . . . . c17360_2l7l 1 . 1 . 2424 . 2 2 10 ASN CA C -1.485 -1.995 1.436 . . . 1.0 . . . . . . . . . . . . B . 308 ASN CA . . . . . . . . . c17360_2l7l 1 . 1 . 2425 . 2 2 10 ASN CB C -2.276 -0.880 2.110 . . . 1.0 . . . . . . . . . . . . B . 308 ASN CB . . . . . . . . . c17360_2l7l 1 . 1 . 2426 . 2 2 10 ASN CG C -2.591 -1.261 3.550 . . . 1.0 . . . . . . . . . . . . B . 308 ASN CG . . . . . . . . . c17360_2l7l 1 . 1 . 2427 . 2 2 10 ASN H H 0.111 -1.452 2.716 . . . 1.0 . . . . . . . . . . . . B . 308 ASN H . . . . . . . . . c17360_2l7l 1 . 1 . 2428 . 2 2 10 ASN HA H -2.018 -2.920 1.574 . . . 1.0 . . . . . . . . . . . . B . 308 ASN HA . . . . . . . . . c17360_2l7l 1 . 1 . 2429 . 2 2 10 ASN HB2 H -1.706 0.035 2.086 . . . 1.0 . . . . . . . . . . . . B . 308 ASN HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2430 . 2 2 10 ASN HB3 H -3.198 -0.738 1.579 . . . 1.0 . . . . . . . . . . . . B . 308 ASN HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2431 . 2 2 10 ASN HD21 H -3.168 0.569 4.051 . . . 1.0 . . . . . . . . . . . . B . 308 ASN HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 2432 . 2 2 10 ASN HD22 H -3.245 -0.583 5.296 . . . 1.0 . . . . . . . . . . . . B . 308 ASN HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 2433 . 2 2 10 ASN N N -0.165 -2.108 2.043 . . . 1.0 . . . . . . . . . . . . B . 308 ASN N . . . . . . . . . c17360_2l7l 1 . 1 . 2434 . 2 2 10 ASN ND2 N -3.039 -0.351 4.368 . . . 1.0 . . . . . . . . . . . . B . 308 ASN ND2 . . . . . . . . . c17360_2l7l 1 . 1 . 2435 . 2 2 10 ASN O O -2.144 -2.251 -0.849 . . . 1.0 . . . . . . . . . . . . B . 308 ASN O . . . . . . . . . c17360_2l7l 1 . 1 . 2436 . 2 2 10 ASN OD1 O -2.443 -2.421 3.936 . . . 1.0 . . . . . . . . . . . . B . 308 ASN OD1 . . . . . . . . . c17360_2l7l 1 . 1 . 2437 . 2 2 11 ALA C C -0.031 -1.732 -2.689 . . . 1.0 . . . . . . . . . . . . B . 309 ALA C . . . . . . . . . c17360_2l7l 1 . 1 . 2438 . 2 2 11 ALA CA C -0.245 -0.494 -1.822 . . . 1.0 . . . . . . . . . . . . B . 309 ALA CA . . . . . . . . . c17360_2l7l 1 . 1 . 2439 . 2 2 11 ALA CB C 0.961 0.436 -1.962 . . . 1.0 . . . . . . . . . . . . B . 309 ALA CB . . . . . . . . . c17360_2l7l 1 . 1 . 2440 . 2 2 11 ALA H H 0.140 -0.449 0.262 . . . 1.0 . . . . . . . . . . . . B . 309 ALA H . . . . . . . . . c17360_2l7l 1 . 1 . 2441 . 2 2 11 ALA HA H -1.122 0.028 -2.168 . . . 1.0 . . . . . . . . . . . . B . 309 ALA HA . . . . . . . . . c17360_2l7l 1 . 1 . 2442 . 2 2 11 ALA HB1 H 0.961 1.149 -1.153 . . . 1.0 . . . . . . . . . . . . B . 309 ALA HB1 . . . . . . . . . c17360_2l7l 1 . 1 . 2443 . 2 2 11 ALA HB2 H 0.901 0.961 -2.901 . . . 1.0 . . . . . . . . . . . . B . 309 ALA HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2444 . 2 2 11 ALA HB3 H 1.874 -0.145 -1.930 . . . 1.0 . . . . . . . . . . . . B . 309 ALA HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2445 . 2 2 11 ALA N N -0.435 -0.854 -0.422 . . . 1.0 . . . . . . . . . . . . B . 309 ALA N . . . . . . . . . c17360_2l7l 1 . 1 . 2446 . 2 2 11 ALA O O -0.649 -1.890 -3.737 . . . 1.0 . . . . . . . . . . . . B . 309 ALA O . . . . . . . . . c17360_2l7l 1 . 1 . 2447 . 2 2 12 THR C C -0.032 -4.790 -2.945 . . . 1.0 . . . . . . . . . . . . B . 310 THR C . . . . . . . . . c17360_2l7l 1 . 1 . 2448 . 2 2 12 THR CA C 1.134 -3.811 -3.019 . . . 1.0 . . . . . . . . . . . . B . 310 THR CA . . . . . . . . . c17360_2l7l 1 . 1 . 2449 . 2 2 12 THR CB C 2.393 -4.485 -2.476 . . . 1.0 . . . . . . . . . . . . B . 310 THR CB . . . . . . . . . c17360_2l7l 1 . 1 . 2450 . 2 2 12 THR CG2 C 3.604 -3.594 -2.747 . . . 1.0 . . . . . . . . . . . . B . 310 THR CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2451 . 2 2 12 THR H H 1.339 -2.434 -1.421 . . . 1.0 . . . . . . . . . . . . B . 310 THR H . . . . . . . . . c17360_2l7l 1 . 1 . 2452 . 2 2 12 THR HA H 1.301 -3.545 -4.052 . . . 1.0 . . . . . . . . . . . . B . 310 THR HA . . . . . . . . . c17360_2l7l 1 . 1 . 2453 . 2 2 12 THR HB H 2.533 -5.436 -2.967 . . . 1.0 . . . . . . . . . . . . B . 310 THR HB . . . . . . . . . c17360_2l7l 1 . 1 . 2454 . 2 2 12 THR HG1 H 2.536 -3.885 -0.631 . . . 1.0 . . . . . . . . . . . . B . 310 THR HG1 . . . . . . . . . c17360_2l7l 1 . 1 . 2455 . 2 2 12 THR HG21 H 3.694 -3.421 -3.809 . . . 1.0 . . . . . . . . . . . . B . 310 THR HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 2456 . 2 2 12 THR HG22 H 4.496 -4.083 -2.386 . . . 1.0 . . . . . . . . . . . . B . 310 THR HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 2457 . 2 2 12 THR HG23 H 3.479 -2.651 -2.237 . . . 1.0 . . . . . . . . . . . . B . 310 THR HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 2458 . 2 2 12 THR N N 0.858 -2.604 -2.258 . . . 1.0 . . . . . . . . . . . . B . 310 THR N . . . . . . . . . c17360_2l7l 1 . 1 . 2459 . 2 2 12 THR O O -0.355 -5.457 -3.932 . . . 1.0 . . . . . . . . . . . . B . 310 THR O . . . . . . . . . c17360_2l7l 1 . 1 . 2460 . 2 2 12 THR OG1 O 2.252 -4.687 -1.077 . . . 1.0 . . . . . . . . . . . . B . 310 THR OG1 . . . . . . . . . c17360_2l7l 1 . 1 . 2461 . 2 2 13 ALA C C -2.989 -5.387 -2.410 . . . 1.0 . . . . . . . . . . . . B . 311 ALA C . . . . . . . . . c17360_2l7l 1 . 1 . 2462 . 2 2 13 ALA CA C -1.775 -5.789 -1.575 . . . 1.0 . . . . . . . . . . . . B . 311 ALA CA . . . . . . . . . c17360_2l7l 1 . 1 . 2463 . 2 2 13 ALA CB C -2.165 -5.806 -0.097 . . . 1.0 . . . . . . . . . . . . B . 311 ALA CB . . . . . . . . . c17360_2l7l 1 . 1 . 2464 . 2 2 13 ALA H H -0.346 -4.320 -1.024 . . . 1.0 . . . . . . . . . . . . B . 311 ALA H . . . . . . . . . c17360_2l7l 1 . 1 . 2465 . 2 2 13 ALA HA H -1.466 -6.784 -1.854 . . . 1.0 . . . . . . . . . . . . B . 311 ALA HA . . . . . . . . . c17360_2l7l 1 . 1 . 2466 . 2 2 13 ALA HB1 H -2.170 -4.799 0.282 . . . 1.0 . . . . . . . . . . . . B . 311 ALA HB1 . . . . . . . . . c17360_2l7l 1 . 1 . 2467 . 2 2 13 ALA HB2 H -1.451 -6.395 0.456 . . . 1.0 . . . . . . . . . . . . B . 311 ALA HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2468 . 2 2 13 ALA HB3 H -3.150 -6.236 0.014 . . . 1.0 . . . . . . . . . . . . B . 311 ALA HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2469 . 2 2 13 ALA N N -0.653 -4.877 -1.772 . . . 1.0 . . . . . . . . . . . . B . 311 ALA N . . . . . . . . . c17360_2l7l 1 . 1 . 2470 . 2 2 13 ALA O O -3.591 -6.208 -3.100 . . . 1.0 . . . . . . . . . . . . B . 311 ALA O . . . . . . . . . c17360_2l7l 1 . 1 . 2471 . 2 2 14 VAL C C -4.268 -3.729 -4.574 . . . 1.0 . . . . . . . . . . . . B . 312 VAL C . . . . . . . . . c17360_2l7l 1 . 1 . 2472 . 2 2 14 VAL CA C -4.510 -3.642 -3.078 . . . 1.0 . . . . . . . . . . . . B . 312 VAL CA . . . . . . . . . c17360_2l7l 1 . 1 . 2473 . 2 2 14 VAL CB C -4.808 -2.196 -2.691 . . . 1.0 . . . . . . . . . . . . B . 312 VAL CB . . . . . . . . . c17360_2l7l 1 . 1 . 2474 . 2 2 14 VAL CG1 C -3.697 -1.288 -3.227 . . . 1.0 . . . . . . . . . . . . B . 312 VAL CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 2475 . 2 2 14 VAL CG2 C -6.157 -1.771 -3.280 . . . 1.0 . . . . . . . . . . . . B . 312 VAL CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2476 . 2 2 14 VAL H H -2.856 -3.505 -1.761 . . . 1.0 . . . . . . . . . . . . B . 312 VAL H . . . . . . . . . c17360_2l7l 1 . 1 . 2477 . 2 2 14 VAL HA H -5.362 -4.253 -2.835 . . . 1.0 . . . . . . . . . . . . B . 312 VAL HA . . . . . . . . . c17360_2l7l 1 . 1 . 2478 . 2 2 14 VAL HB H -4.842 -2.122 -1.617 . . . 1.0 . . . . . . . . . . . . B . 312 VAL HB . . . . . . . . . c17360_2l7l 1 . 1 . 2479 . 2 2 14 VAL HG11 H -3.745 -0.326 -2.746 . . . 1.0 . . . . . . . . . . . . B . 312 VAL HG11 . . . . . . . . . c17360_2l7l 1 . 1 . 2480 . 2 2 14 VAL HG12 H -3.813 -1.165 -4.293 . . . 1.0 . . . . . . . . . . . . B . 312 VAL HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 2481 . 2 2 14 VAL HG13 H -2.747 -1.741 -3.020 . . . 1.0 . . . . . . . . . . . . B . 312 VAL HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 2482 . 2 2 14 VAL HG21 H -6.509 -0.896 -2.765 . . . 1.0 . . . . . . . . . . . . B . 312 VAL HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 2483 . 2 2 14 VAL HG22 H -6.878 -2.566 -3.159 . . . 1.0 . . . . . . . . . . . . B . 312 VAL HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 2484 . 2 2 14 VAL HG23 H -6.038 -1.551 -4.329 . . . 1.0 . . . . . . . . . . . . B . 312 VAL HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 2485 . 2 2 14 VAL N N -3.358 -4.123 -2.334 . . . 1.0 . . . . . . . . . . . . B . 312 VAL N . . . . . . . . . c17360_2l7l 1 . 1 . 2486 . 2 2 14 VAL O O -5.185 -4.012 -5.340 . . . 1.0 . . . . . . . . . . . . B . 312 VAL O . . . . . . . . . c17360_2l7l 1 . 1 . 2487 . 2 2 15 VAL C C -2.966 -4.912 -6.974 . . . 1.0 . . . . . . . . . . . . B . 313 VAL C . . . . . . . . . c17360_2l7l 1 . 1 . 2488 . 2 2 15 VAL CA C -2.706 -3.526 -6.403 . . . 1.0 . . . . . . . . . . . . B . 313 VAL CA . . . . . . . . . c17360_2l7l 1 . 1 . 2489 . 2 2 15 VAL CB C -1.230 -3.158 -6.600 . . . 1.0 . . . . . . . . . . . . B . 313 VAL CB . . . . . . . . . c17360_2l7l 1 . 1 . 2490 . 2 2 15 VAL CG1 C -0.774 -3.547 -8.019 . . . 1.0 . . . . . . . . . . . . B . 313 VAL CG1 . . . . . . . . . c17360_2l7l 1 . 1 . 2491 . 2 2 15 VAL CG2 C -1.041 -1.645 -6.397 . . . 1.0 . . . . . . . . . . . . B . 313 VAL CG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2492 . 2 2 15 VAL H H -2.336 -3.249 -4.334 . . . 1.0 . . . . . . . . . . . . B . 313 VAL H . . . . . . . . . c17360_2l7l 1 . 1 . 2493 . 2 2 15 VAL HA H -3.315 -2.809 -6.925 . . . 1.0 . . . . . . . . . . . . B . 313 VAL HA . . . . . . . . . c17360_2l7l 1 . 1 . 2494 . 2 2 15 VAL HB H -0.636 -3.694 -5.875 . . . 1.0 . . . . . . . . . . . . B . 313 VAL HB . . . . . . . . . c17360_2l7l 1 . 1 . 2495 . 2 2 15 VAL HG11 H -0.593 -4.611 -8.060 . . . 1.0 . . . . . . . . . . . . B . 313 VAL HG11 . . . . . . . . . c17360_2l7l 1 . 1 . 2496 . 2 2 15 VAL HG12 H 0.130 -3.018 -8.266 . . . 1.0 . . . . . . . . . . . . B . 313 VAL HG12 . . . . . . . . . c17360_2l7l 1 . 1 . 2497 . 2 2 15 VAL HG13 H -1.547 -3.286 -8.728 . . . 1.0 . . . . . . . . . . . . B . 313 VAL HG13 . . . . . . . . . c17360_2l7l 1 . 1 . 2498 . 2 2 15 VAL HG21 H -1.216 -1.128 -7.328 . . . 1.0 . . . . . . . . . . . . B . 313 VAL HG21 . . . . . . . . . c17360_2l7l 1 . 1 . 2499 . 2 2 15 VAL HG22 H -0.033 -1.453 -6.066 . . . 1.0 . . . . . . . . . . . . B . 313 VAL HG22 . . . . . . . . . c17360_2l7l 1 . 1 . 2500 . 2 2 15 VAL HG23 H -1.734 -1.283 -5.651 . . . 1.0 . . . . . . . . . . . . B . 313 VAL HG23 . . . . . . . . . c17360_2l7l 1 . 1 . 2501 . 2 2 15 VAL N N -3.034 -3.478 -4.988 . . . 1.0 . . . . . . . . . . . . B . 313 VAL N . . . . . . . . . c17360_2l7l 1 . 1 . 2502 . 2 2 15 VAL O O -3.591 -5.048 -8.025 . . . 1.0 . . . . . . . . . . . . B . 313 VAL O . . . . . . . . . c17360_2l7l 1 . 1 . 2503 . 2 2 16 ARG C C -4.126 -7.712 -6.664 . . . 1.0 . . . . . . . . . . . . B . 314 ARG C . . . . . . . . . c17360_2l7l 1 . 1 . 2504 . 2 2 16 ARG CA C -2.668 -7.295 -6.750 . . . 1.0 . . . . . . . . . . . . B . 314 ARG CA . . . . . . . . . c17360_2l7l 1 . 1 . 2505 . 2 2 16 ARG CB C -1.812 -8.258 -5.929 . . . 1.0 . . . . . . . . . . . . B . 314 ARG CB . . . . . . . . . c17360_2l7l 1 . 1 . 2506 . 2 2 16 ARG CD C -1.499 -9.237 -3.656 . . . 1.0 . . . . . . . . . . . . B . 314 ARG CD . . . . . . . . . c17360_2l7l 1 . 1 . 2507 . 2 2 16 ARG CG C -2.172 -8.127 -4.448 . . . 1.0 . . . . . . . . . . . . B . 314 ARG CG . . . . . . . . . c17360_2l7l 1 . 1 . 2508 . 2 2 16 ARG CZ C -1.568 -11.658 -3.543 . . . 1.0 . . . . . . . . . . . . B . 314 ARG CZ . . . . . . . . . c17360_2l7l 1 . 1 . 2509 . 2 2 16 ARG H H -1.983 -5.763 -5.452 . . . 1.0 . . . . . . . . . . . . B . 314 ARG H . . . . . . . . . c17360_2l7l 1 . 1 . 2510 . 2 2 16 ARG HA H -2.354 -7.352 -7.775 . . . 1.0 . . . . . . . . . . . . B . 314 ARG HA . . . . . . . . . c17360_2l7l 1 . 1 . 2511 . 2 2 16 ARG HB2 H -1.986 -9.273 -6.261 . . . 1.0 . . . . . . . . . . . . B . 314 ARG HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2512 . 2 2 16 ARG HB3 H -0.770 -8.011 -6.066 . . . 1.0 . . . . . . . . . . . . B . 314 ARG HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2513 . 2 2 16 ARG HD2 H -0.438 -9.192 -3.813 . . . 1.0 . . . . . . . . . . . . B . 314 ARG HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2514 . 2 2 16 ARG HD3 H -1.713 -9.103 -2.606 . . . 1.0 . . . . . . . . . . . . B . 314 ARG HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 2515 . 2 2 16 ARG HE H -2.672 -10.573 -4.808 . . . 1.0 . . . . . . . . . . . . B . 314 ARG HE . . . . . . . . . c17360_2l7l 1 . 1 . 2516 . 2 2 16 ARG HG2 H -1.821 -7.178 -4.090 . . . 1.0 . . . . . . . . . . . . B . 314 ARG HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2517 . 2 2 16 ARG HG3 H -3.237 -8.191 -4.311 . . . 1.0 . . . . . . . . . . . . B . 314 ARG HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 2518 . 2 2 16 ARG HH11 H -0.329 -10.735 -2.271 . . . 1.0 . . . . . . . . . . . . B . 314 ARG HH11 . . . . . . . . . c17360_2l7l 1 . 1 . 2519 . 2 2 16 ARG HH12 H -0.353 -12.464 -2.172 . . . 1.0 . . . . . . . . . . . . B . 314 ARG HH12 . . . . . . . . . c17360_2l7l 1 . 1 . 2520 . 2 2 16 ARG HH21 H -2.709 -12.840 -4.690 . . . 1.0 . . . . . . . . . . . . B . 314 ARG HH21 . . . . . . . . . c17360_2l7l 1 . 1 . 2521 . 2 2 16 ARG HH22 H -1.701 -13.656 -3.542 . . . 1.0 . . . . . . . . . . . . B . 314 ARG HH22 . . . . . . . . . c17360_2l7l 1 . 1 . 2522 . 2 2 16 ARG N N -2.480 -5.931 -6.284 . . . 1.0 . . . . . . . . . . . . B . 314 ARG N . . . . . . . . . c17360_2l7l 1 . 1 . 2523 . 2 2 16 ARG NE N -2.004 -10.533 -4.092 . . . 1.0 . . . . . . . . . . . . B . 314 ARG NE . . . . . . . . . c17360_2l7l 1 . 1 . 2524 . 2 2 16 ARG NH1 N -0.681 -11.615 -2.588 . . . 1.0 . . . . . . . . . . . . B . 314 ARG NH1 . . . . . . . . . c17360_2l7l 1 . 1 . 2525 . 2 2 16 ARG NH2 N -2.029 -12.808 -3.958 . . . 1.0 . . . . . . . . . . . . B . 314 ARG NH2 . . . . . . . . . c17360_2l7l 1 . 1 . 2526 . 2 2 16 ARG O O -4.599 -8.508 -7.467 . . . 1.0 . . . . . . . . . . . . B . 314 ARG O . . . . . . . . . c17360_2l7l 1 . 1 . 2527 . 2 2 17 HIS C C -7.138 -6.824 -6.441 . . . 1.0 . . . . . . . . . . . . B . 315 HIS C . . . . . . . . . c17360_2l7l 1 . 1 . 2528 . 2 2 17 HIS CA C -6.220 -7.544 -5.467 . . . 1.0 . . . . . . . . . . . . B . 315 HIS CA . . . . . . . . . c17360_2l7l 1 . 1 . 2529 . 2 2 17 HIS CB C -6.631 -7.197 -4.033 . . . 1.0 . . . . . . . . . . . . B . 315 HIS CB . . . . . . . . . c17360_2l7l 1 . 1 . 2530 . 2 2 17 HIS CD2 C -9.111 -6.374 -3.740 . . . 1.0 . . . . . . . . . . . . B . 315 HIS CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2531 . 2 2 17 HIS CE1 C -10.091 -8.306 -3.737 . . . 1.0 . . . . . . . . . . . . B . 315 HIS CE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2532 . 2 2 17 HIS CG C -8.127 -7.320 -3.881 . . . 1.0 . . . . . . . . . . . . B . 315 HIS CG . . . . . . . . . c17360_2l7l 1 . 1 . 2533 . 2 2 17 HIS H H -4.386 -6.578 -5.039 . . . 1.0 . . . . . . . . . . . . B . 315 HIS H . . . . . . . . . c17360_2l7l 1 . 1 . 2534 . 2 2 17 HIS HA H -6.333 -8.600 -5.609 . . . 1.0 . . . . . . . . . . . . B . 315 HIS HA . . . . . . . . . c17360_2l7l 1 . 1 . 2535 . 2 2 17 HIS HB2 H -6.143 -7.872 -3.346 . . . 1.0 . . . . . . . . . . . . B . 315 HIS HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2536 . 2 2 17 HIS HB3 H -6.331 -6.181 -3.811 . . . 1.0 . . . . . . . . . . . . B . 315 HIS HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2537 . 2 2 17 HIS HD2 H -8.945 -5.303 -3.705 . . . 1.0 . . . . . . . . . . . . B . 315 HIS HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2538 . 2 2 17 HIS HE1 H -10.846 -9.078 -3.705 . . . 1.0 . . . . . . . . . . . . B . 315 HIS HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2539 . 2 2 17 HIS HE2 H -11.227 -6.571 -3.549 . . . 1.0 . . . . . . . . . . . . B . 315 HIS HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2540 . 2 2 17 HIS N N -4.825 -7.193 -5.667 . . . 1.0 . . . . . . . . . . . . B . 315 HIS N . . . . . . . . . c17360_2l7l 1 . 1 . 2541 . 2 2 17 HIS ND1 N -8.774 -8.544 -3.875 . . . 1.0 . . . . . . . . . . . . B . 315 HIS ND1 . . . . . . . . . c17360_2l7l 1 . 1 . 2542 . 2 2 17 HIS NE2 N -10.350 -6.998 -3.649 . . . 1.0 . . . . . . . . . . . . B . 315 HIS NE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2543 . 2 2 17 HIS O O -7.942 -7.453 -7.124 . . . 1.0 . . . . . . . . . . . . B . 315 HIS O . . . . . . . . . c17360_2l7l 1 . 1 . 2544 . 2 2 18 MET C C -7.643 -5.091 -8.816 . . . 1.0 . . . . . . . . . . . . B . 316 MET C . . . . . . . . . c17360_2l7l 1 . 1 . 2545 . 2 2 18 MET CA C -7.876 -4.726 -7.359 . . . 1.0 . . . . . . . . . . . . B . 316 MET CA . . . . . . . . . c17360_2l7l 1 . 1 . 2546 . 2 2 18 MET CB C -7.574 -3.243 -7.148 . . . 1.0 . . . . . . . . . . . . B . 316 MET CB . . . . . . . . . c17360_2l7l 1 . 1 . 2547 . 2 2 18 MET CE C -10.096 -1.375 -7.394 . . . 1.0 . . . . . . . . . . . . B . 316 MET CE . . . . . . . . . c17360_2l7l 1 . 1 . 2548 . 2 2 18 MET CG C -8.268 -2.727 -5.888 . . . 1.0 . . . . . . . . . . . . B . 316 MET CG . . . . . . . . . c17360_2l7l 1 . 1 . 2549 . 2 2 18 MET H H -6.379 -5.064 -5.903 . . . 1.0 . . . . . . . . . . . . B . 316 MET H . . . . . . . . . c17360_2l7l 1 . 1 . 2550 . 2 2 18 MET HA H -8.909 -4.914 -7.111 . . . 1.0 . . . . . . . . . . . . B . 316 MET HA . . . . . . . . . c17360_2l7l 1 . 1 . 2551 . 2 2 18 MET HB2 H -6.514 -3.128 -7.037 . . . 1.0 . . . . . . . . . . . . B . 316 MET HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2552 . 2 2 18 MET HB3 H -7.915 -2.674 -8.001 . . . 1.0 . . . . . . . . . . . . B . 316 MET HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2553 . 2 2 18 MET HE1 H -10.065 -1.809 -8.383 . . . 1.0 . . . . . . . . . . . . B . 316 MET HE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2554 . 2 2 18 MET HE2 H -9.244 -0.727 -7.265 . . . 1.0 . . . . . . . . . . . . B . 316 MET HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2555 . 2 2 18 MET HE3 H -11.003 -0.798 -7.276 . . . 1.0 . . . . . . . . . . . . B . 316 MET HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 2556 . 2 2 18 MET HG2 H -8.038 -3.380 -5.057 . . . 1.0 . . . . . . . . . . . . B . 316 MET HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2557 . 2 2 18 MET HG3 H -7.920 -1.729 -5.667 . . . 1.0 . . . . . . . . . . . . B . 316 MET HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 2558 . 2 2 18 MET N N -7.029 -5.513 -6.482 . . . 1.0 . . . . . . . . . . . . B . 316 MET N . . . . . . . . . c17360_2l7l 1 . 1 . 2559 . 2 2 18 MET O O -8.593 -5.201 -9.590 . . . 1.0 . . . . . . . . . . . . B . 316 MET O . . . . . . . . . c17360_2l7l 1 . 1 . 2560 . 2 2 18 MET SD S -10.059 -2.697 -6.153 . . . 1.0 . . . . . . . . . . . . B . 316 MET SD . . . . . . . . . c17360_2l7l 1 . 1 . 2561 . 2 2 19 ARG C C -6.560 -7.026 -10.895 . . . 1.0 . . . . . . . . . . . . B . 317 ARG C . . . . . . . . . c17360_2l7l 1 . 1 . 2562 . 2 2 19 ARG CA C -6.063 -5.617 -10.560 . . . 1.0 . . . . . . . . . . . . B . 317 ARG CA . . . . . . . . . c17360_2l7l 1 . 1 . 2563 . 2 2 19 ARG CB C -4.545 -5.532 -10.780 . . . 1.0 . . . . . . . . . . . . B . 317 ARG CB . . . . . . . . . c17360_2l7l 1 . 1 . 2564 . 2 2 19 ARG CD C -2.339 -6.617 -10.299 . . . 1.0 . . . . . . . . . . . . B . 317 ARG CD . . . . . . . . . c17360_2l7l 1 . 1 . 2565 . 2 2 19 ARG CG C -3.850 -6.799 -10.250 . . . 1.0 . . . . . . . . . . . . B . 317 ARG CG . . . . . . . . . c17360_2l7l 1 . 1 . 2566 . 2 2 19 ARG CZ C -1.706 -7.267 -12.554 . . . 1.0 . . . . . . . . . . . . B . 317 ARG CZ . . . . . . . . . c17360_2l7l 1 . 1 . 2567 . 2 2 19 ARG H H -5.664 -5.168 -8.532 . . . 1.0 . . . . . . . . . . . . B . 317 ARG H . . . . . . . . . c17360_2l7l 1 . 1 . 2568 . 2 2 19 ARG HA H -6.545 -4.903 -11.213 . . . 1.0 . . . . . . . . . . . . B . 317 ARG HA . . . . . . . . . c17360_2l7l 1 . 1 . 2569 . 2 2 19 ARG HB2 H -4.343 -5.429 -11.837 . . . 1.0 . . . . . . . . . . . . B . 317 ARG HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2570 . 2 2 19 ARG HB3 H -4.161 -4.670 -10.259 . . . 1.0 . . . . . . . . . . . . B . 317 ARG HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2571 . 2 2 19 ARG HD2 H -2.047 -5.816 -9.639 . . . 1.0 . . . . . . . . . . . . B . 317 ARG HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2572 . 2 2 19 ARG HD3 H -1.863 -7.535 -9.985 . . . 1.0 . . . . . . . . . . . . B . 317 ARG HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 2573 . 2 2 19 ARG HE H -1.807 -5.370 -11.925 . . . 1.0 . . . . . . . . . . . . B . 317 ARG HE . . . . . . . . . c17360_2l7l 1 . 1 . 2574 . 2 2 19 ARG HG2 H -4.156 -6.974 -9.230 . . . 1.0 . . . . . . . . . . . . B . 317 ARG HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2575 . 2 2 19 ARG HG3 H -4.121 -7.648 -10.857 . . . 1.0 . . . . . . . . . . . . B . 317 ARG HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 2576 . 2 2 19 ARG HH11 H -2.161 -8.756 -11.293 . . . 1.0 . . . . . . . . . . . . B . 317 ARG HH11 . . . . . . . . . c17360_2l7l 1 . 1 . 2577 . 2 2 19 ARG HH12 H -1.703 -9.241 -12.892 . . . 1.0 . . . . . . . . . . . . B . 317 ARG HH12 . . . . . . . . . c17360_2l7l 1 . 1 . 2578 . 2 2 19 ARG HH21 H -1.207 -5.999 -14.017 . . . 1.0 . . . . . . . . . . . . B . 317 ARG HH21 . . . . . . . . . c17360_2l7l 1 . 1 . 2579 . 2 2 19 ARG HH22 H -1.163 -7.679 -14.435 . . . 1.0 . . . . . . . . . . . . B . 317 ARG HH22 . . . . . . . . . c17360_2l7l 1 . 1 . 2580 . 2 2 19 ARG N N -6.385 -5.272 -9.189 . . . 1.0 . . . . . . . . . . . . B . 317 ARG N . . . . . . . . . c17360_2l7l 1 . 1 . 2581 . 2 2 19 ARG NE N -1.926 -6.306 -11.662 . . . 1.0 . . . . . . . . . . . . B . 317 ARG NE . . . . . . . . . c17360_2l7l 1 . 1 . 2582 . 2 2 19 ARG NH1 N -1.870 -8.520 -12.220 . . . 1.0 . . . . . . . . . . . . B . 317 ARG NH1 . . . . . . . . . c17360_2l7l 1 . 1 . 2583 . 2 2 19 ARG NH2 N -1.329 -6.959 -13.763 . . . 1.0 . . . . . . . . . . . . B . 317 ARG NH2 . . . . . . . . . c17360_2l7l 1 . 1 . 2584 . 2 2 19 ARG O O -6.974 -7.306 -12.016 . . . 1.0 . . . . . . . . . . . . B . 317 ARG O . . . . . . . . . c17360_2l7l 1 . 1 . 2585 . 2 2 20 LYS C C -8.385 -9.368 -10.426 . . . 1.0 . . . . . . . . . . . . B . 318 LYS C . . . . . . . . . c17360_2l7l 1 . 1 . 2586 . 2 2 20 LYS CA C -6.900 -9.293 -10.113 . . . 1.0 . . . . . . . . . . . . B . 318 LYS CA . . . . . . . . . c17360_2l7l 1 . 1 . 2587 . 2 2 20 LYS CB C -6.590 -10.131 -8.867 . . . 1.0 . . . . . . . . . . . . B . 318 LYS CB . . . . . . . . . c17360_2l7l 1 . 1 . 2588 . 2 2 20 LYS CD C -6.483 -12.220 -10.252 . . . 1.0 . . . . . . . . . . . . B . 318 LYS CD . . . . . . . . . c17360_2l7l 1 . 1 . 2589 . 2 2 20 LYS CE C -6.657 -13.733 -10.169 . . . 1.0 . . . . . . . . . . . . B . 318 LYS CE . . . . . . . . . c17360_2l7l 1 . 1 . 2590 . 2 2 20 LYS CG C -7.129 -11.559 -9.027 . . . 1.0 . . . . . . . . . . . . B . 318 LYS CG . . . . . . . . . c17360_2l7l 1 . 1 . 2591 . 2 2 20 LYS H H -6.125 -7.640 -9.040 . . . 1.0 . . . . . . . . . . . . B . 318 LYS H . . . . . . . . . c17360_2l7l 1 . 1 . 2592 . 2 2 20 LYS HA H -6.345 -9.690 -10.945 . . . 1.0 . . . . . . . . . . . . B . 318 LYS HA . . . . . . . . . c17360_2l7l 1 . 1 . 2593 . 2 2 20 LYS HB2 H -5.522 -10.179 -8.735 . . . 1.0 . . . . . . . . . . . . B . 318 LYS HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2594 . 2 2 20 LYS HB3 H -7.041 -9.674 -8.000 . . . 1.0 . . . . . . . . . . . . B . 318 LYS HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2595 . 2 2 20 LYS HD2 H -6.964 -11.861 -11.149 . . . 1.0 . . . . . . . . . . . . B . 318 LYS HD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2596 . 2 2 20 LYS HD3 H -5.431 -11.980 -10.283 . . . 1.0 . . . . . . . . . . . . B . 318 LYS HD3 . . . . . . . . . c17360_2l7l 1 . 1 . 2597 . 2 2 20 LYS HE2 H -6.139 -14.197 -10.995 . . . 1.0 . . . . . . . . . . . . B . 318 LYS HE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2598 . 2 2 20 LYS HE3 H -6.247 -14.092 -9.238 . . . 1.0 . . . . . . . . . . . . B . 318 LYS HE3 . . . . . . . . . c17360_2l7l 1 . 1 . 2599 . 2 2 20 LYS HG2 H -6.888 -12.129 -8.141 . . . 1.0 . . . . . . . . . . . . B . 318 LYS HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2600 . 2 2 20 LYS HG3 H -8.203 -11.540 -9.152 . . . 1.0 . . . . . . . . . . . . B . 318 LYS HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 2601 . 2 2 20 LYS HZ1 H -8.235 -14.945 -10.777 . . . 1.0 . . . . . . . . . . . . B . 318 LYS HZ1 . . . . . . . . . c17360_2l7l 1 . 1 . 2602 . 2 2 20 LYS HZ2 H -8.618 -13.291 -10.713 . . . 1.0 . . . . . . . . . . . . B . 318 LYS HZ2 . . . . . . . . . c17360_2l7l 1 . 1 . 2603 . 2 2 20 LYS HZ3 H -8.480 -14.191 -9.278 . . . 1.0 . . . . . . . . . . . . B . 318 LYS HZ3 . . . . . . . . . c17360_2l7l 1 . 1 . 2604 . 2 2 20 LYS N N -6.482 -7.914 -9.911 . . . 1.0 . . . . . . . . . . . . B . 318 LYS N . . . . . . . . . c17360_2l7l 1 . 1 . 2605 . 2 2 20 LYS NZ N -8.107 -14.065 -10.240 . . . 1.0 . . . . . . . . . . . . B . 318 LYS NZ . . . . . . . . . c17360_2l7l 1 . 1 . 2606 . 2 2 20 LYS O O -8.807 -10.126 -11.302 . . . 1.0 . . . . . . . . . . . . B . 318 LYS O . . . . . . . . . c17360_2l7l 1 . 1 . 2607 . 2 2 21 LEU C C -10.954 -8.251 -11.336 . . . 1.0 . . . . . . . . . . . . B . 319 LEU C . . . . . . . . . c17360_2l7l 1 . 1 . 2608 . 2 2 21 LEU CA C -10.609 -8.589 -9.893 . . . 1.0 . . . . . . . . . . . . B . 319 LEU CA . . . . . . . . . c17360_2l7l 1 . 1 . 2609 . 2 2 21 LEU CB C -11.258 -7.565 -8.957 . . . 1.0 . . . . . . . . . . . . B . 319 LEU CB . . . . . . . . . c17360_2l7l 1 . 1 . 2610 . 2 2 21 LEU CD1 C -11.562 -6.911 -6.557 . . . 1.0 . . . . . . . . . . . . B . 319 LEU CD1 . . . . . . . . . c17360_2l7l 1 . 1 . 2611 . 2 2 21 LEU CD2 C -12.030 -9.282 -7.264 . . . 1.0 . . . . . . . . . . . . B . 319 LEU CD2 . . . . . . . . . c17360_2l7l 1 . 1 . 2612 . 2 2 21 LEU CG C -11.138 -8.043 -7.502 . . . 1.0 . . . . . . . . . . . . B . 319 LEU CG . . . . . . . . . c17360_2l7l 1 . 1 . 2613 . 2 2 21 LEU H H -8.773 -8.018 -9.010 . . . 1.0 . . . . . . . . . . . . B . 319 LEU H . . . . . . . . . c17360_2l7l 1 . 1 . 2614 . 2 2 21 LEU HA H -10.995 -9.566 -9.665 . . . 1.0 . . . . . . . . . . . . B . 319 LEU HA . . . . . . . . . c17360_2l7l 1 . 1 . 2615 . 2 2 21 LEU HB2 H -10.752 -6.615 -9.066 . . . 1.0 . . . . . . . . . . . . B . 319 LEU HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2616 . 2 2 21 LEU HB3 H -12.300 -7.447 -9.216 . . . 1.0 . . . . . . . . . . . . B . 319 LEU HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2617 . 2 2 21 LEU HD11 H -12.462 -6.447 -6.930 . . . 1.0 . . . . . . . . . . . . B . 319 LEU HD11 . . . . . . . . . c17360_2l7l 1 . 1 . 2618 . 2 2 21 LEU HD12 H -10.775 -6.174 -6.500 . . . 1.0 . . . . . . . . . . . . B . 319 LEU HD12 . . . . . . . . . c17360_2l7l 1 . 1 . 2619 . 2 2 21 LEU HD13 H -11.748 -7.315 -5.573 . . . 1.0 . . . . . . . . . . . . B . 319 LEU HD13 . . . . . . . . . c17360_2l7l 1 . 1 . 2620 . 2 2 21 LEU HD21 H -11.475 -10.177 -7.508 . . . 1.0 . . . . . . . . . . . . B . 319 LEU HD21 . . . . . . . . . c17360_2l7l 1 . 1 . 2621 . 2 2 21 LEU HD22 H -12.913 -9.230 -7.885 . . . 1.0 . . . . . . . . . . . . B . 319 LEU HD22 . . . . . . . . . c17360_2l7l 1 . 1 . 2622 . 2 2 21 LEU HD23 H -12.327 -9.326 -6.224 . . . 1.0 . . . . . . . . . . . . B . 319 LEU HD23 . . . . . . . . . c17360_2l7l 1 . 1 . 2623 . 2 2 21 LEU HG H -10.110 -8.303 -7.301 . . . 1.0 . . . . . . . . . . . . B . 319 LEU HG . . . . . . . . . c17360_2l7l 1 . 1 . 2624 . 2 2 21 LEU N N -9.169 -8.592 -9.700 . . . 1.0 . . . . . . . . . . . . B . 319 LEU N . . . . . . . . . c17360_2l7l 1 . 1 . 2625 . 2 2 21 LEU O O -12.032 -8.594 -11.821 . . . 1.0 . . . . . . . . . . . . B . 319 LEU O . . . . . . . . . c17360_2l7l 1 . 1 . 2626 . 2 2 22 GLN C C -10.195 -8.423 -14.308 . . . 1.0 . . . . . . . . . . . . B . 320 GLN C . . . . . . . . . c17360_2l7l 1 . 1 . 2627 . 2 2 22 GLN CA C -10.261 -7.197 -13.401 . . . 1.0 . . . . . . . . . . . . B . 320 GLN CA . . . . . . . . . c17360_2l7l 1 . 1 . 2628 . 2 2 22 GLN CB C -9.201 -6.186 -13.835 . . . 1.0 . . . . . . . . . . . . B . 320 GLN CB . . . . . . . . . c17360_2l7l 1 . 1 . 2629 . 2 2 22 GLN CD C -8.083 -4.037 -13.227 . . . 1.0 . . . . . . . . . . . . B . 320 GLN CD . . . . . . . . . c17360_2l7l 1 . 1 . 2630 . 2 2 22 GLN CG C -9.200 -5.007 -12.864 . . . 1.0 . . . . . . . . . . . . B . 320 GLN CG . . . . . . . . . c17360_2l7l 1 . 1 . 2631 . 2 2 22 GLN H H -9.197 -7.330 -11.575 . . . 1.0 . . . . . . . . . . . . B . 320 GLN H . . . . . . . . . c17360_2l7l 1 . 1 . 2632 . 2 2 22 GLN HA H -11.236 -6.743 -13.490 . . . 1.0 . . . . . . . . . . . . B . 320 GLN HA . . . . . . . . . c17360_2l7l 1 . 1 . 2633 . 2 2 22 GLN HB2 H -8.231 -6.657 -13.839 . . . 1.0 . . . . . . . . . . . . B . 320 GLN HB2 . . . . . . . . . c17360_2l7l 1 . 1 . 2634 . 2 2 22 GLN HB3 H -9.431 -5.831 -14.828 . . . 1.0 . . . . . . . . . . . . B . 320 GLN HB3 . . . . . . . . . c17360_2l7l 1 . 1 . 2635 . 2 2 22 GLN HE21 H -8.472 -2.795 -11.729 . . . 1.0 . . . . . . . . . . . . B . 320 GLN HE21 . . . . . . . . . c17360_2l7l 1 . 1 . 2636 . 2 2 22 GLN HE22 H -7.179 -2.341 -12.729 . . . 1.0 . . . . . . . . . . . . B . 320 GLN HE22 . . . . . . . . . c17360_2l7l 1 . 1 . 2637 . 2 2 22 GLN HG2 H -10.151 -4.499 -12.913 . . . 1.0 . . . . . . . . . . . . B . 320 GLN HG2 . . . . . . . . . c17360_2l7l 1 . 1 . 2638 . 2 2 22 GLN HG3 H -9.042 -5.372 -11.863 . . . 1.0 . . . . . . . . . . . . B . 320 GLN HG3 . . . . . . . . . c17360_2l7l 1 . 1 . 2639 . 2 2 22 GLN N N -10.037 -7.577 -12.014 . . . 1.0 . . . . . . . . . . . . B . 320 GLN N . . . . . . . . . c17360_2l7l 1 . 1 . 2640 . 2 2 22 GLN NE2 N -7.897 -2.970 -12.502 . . . 1.0 . . . . . . . . . . . . B . 320 GLN NE2 . . . . . . . . . c17360_2l7l 1 . 1 . 2641 . 2 2 22 GLN O O -10.030 -9.514 -13.784 . . . 1.0 . . . . . . . . . . . . B . 320 GLN O . . . . . . . . . c17360_2l7l 1 . 1 . 2642 . 2 2 22 GLN OXT O -10.308 -8.254 -15.510 . . . 1.0 . . . . . . . . . . . . B . 320 GLN OXT . . . . . . . . . c17360_2l7l 1 . 1 . 2643 . 2 2 22 GLN OE1 O -7.362 -4.258 -14.197 . . . 1.0 . . . . . . . . . . . . B . 320 GLN OE1 . . . . . . . . . c17360_2l7l 1 . 1 . 2644 . 3 3 1 CA CA Ca -3.475 14.827 -6.760 . . . 1.0 . . . . . . . . . . . . A . 401 CA CA . . . . . . . . . c17360_2l7l 1 . 1 . 2645 . 4 3 1 CA CA Ca -15.164 8.803 -9.485 . . . 1.0 . . . . . . . . . . . . A . 402 CA CA . . . . . . . . . c17360_2l7l 1 . 1 . 2646 . 5 3 1 CA CA Ca 16.447 -8.792 -0.467 . . . 1.0 . . . . . . . . . . . . A . 403 CA CA . . . . . . . . . c17360_2l7l 1 . 1 . 2647 . 6 3 1 CA CA Ca 15.283 -10.327 10.566 . . . 1.0 . . . . . . . . . . . . A . 404 CA CA . . . . . . . . . c17360_2l7l 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 c17360_2l7l _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 2l7l.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c17360_2l7l 1 1 2l7l.mr . . XPLOR/CNS 2 'dihedral angle' 'Not applicable' 'Not applicable' 334 c17360_2l7l 1 1 2l7l.mr . . XPLOR/CNS 3 distance 'hydrogen bond' simple 144 c17360_2l7l 1 1 2l7l.mr . . XPLOR/CNS 4 distance NOE simple 244 c17360_2l7l 1 1 2l7l.mr . . XPLOR/CNS 5 distance 'general distance' simple 24 c17360_2l7l 1 1 2l7l.mr . . XPLOR/CNS 6 distance NOE simple 116 c17360_2l7l 1 1 2l7l.mr . . XPLOR/CNS 7 'dipolar coupling' 'Not applicable' 'Not applicable' 115 c17360_2l7l 1 1 2l7l.mr . . 'MR format' 8 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c17360_2l7l 1 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_4 _Gen_dist_constraint_list.Entry_ID c17360_2l7l _Gen_dist_constraint_list.ID 2 _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 4 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 . . . . c17360_2l7l 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 . . 2 2 6 6 LYS HA H . . . 2 2 10 10 ASN H H . . . . . 4.97 0.0 4.97 . . . . . B . 304 LYS HA . . B . 308 ASN H . . . 304 . HA . . . . . 308 . HN . . c17360_2l7l 1 2 1 . . 2 2 10 10 ASN H H . . . 2 2 9 9 PHE QD H . . . . . 4.37 0.0 4.37 . . . . . B . 308 ASN H . . B . 307 PHE QD . . . 308 . HN . . . . . 307 . HD# . . c17360_2l7l 1 3 1 . . 2 2 10 10 ASN H H . . . 2 2 11 11 ALA H H . . . . . 4.16 0.0 4.16 . . . . . B . 308 ASN H . . B . 309 ALA H . . . 308 . HN . . . . . 309 . HN . . c17360_2l7l 1 4 1 . . 2 2 10 10 ASN H H . . . 2 2 9 9 PHE H H . . . . . 4.19 0.0 4.19 . . . . . B . 308 ASN H . . B . 307 PHE H . . . 308 . HN . . . . . 307 . HN . . c17360_2l7l 1 5 1 . . 2 2 9 9 PHE QD H . . . 2 2 9 9 PHE H H . . . . . 4.66 0.0 4.66 . . . . . B . 307 PHE QD . . B . 307 PHE H . . . 307 . HD# . . . . . 307 . HN . . c17360_2l7l 1 6 1 . . 2 2 9 9 PHE H H . . . 2 2 8 8 ALA H H . . . . . 4.04 0.0 4.04 . . . . . B . 307 PHE H . . B . 306 ALA H . . . 307 . HN . . . . . 306 . HN . . c17360_2l7l 1 7 1 . . 2 2 6 6 LYS HA H . . . 2 2 9 9 PHE H H . . . . . 4.15 0.0 4.15 . . . . . B . 304 LYS HA . . B . 307 PHE H . . . 304 . HA . . . . . 307 . HN . . c17360_2l7l 1 8 1 . . 2 2 9 9 PHE H H . . . 2 2 8 8 ALA MB H . . . . . 3.71 0.0 3.71 . . . . . B . 307 PHE H . . B . 306 ALA MB . . . 307 . HN . . . . . 306 . HB# . . c17360_2l7l 1 9 1 . . 2 2 1 1 ALA MB H . . . 2 2 2 2 LYS H H . . . . . 3.58 0.0 3.58 . . . . . B . 299 ALA MB . . B . 300 LYS H . . . 299 . HB# . . . . . 300 . HN . . c17360_2l7l 1 10 1 . . 2 2 2 2 LYS H H . . . 2 2 3 3 SER H H . . . . . 3.96 0.0 3.96 . . . . . B . 300 LYS H . . B . 301 SER H . . . 300 . HN . . . . . 301 . HN . . c17360_2l7l 1 11 1 . . 2 2 2 2 LYS H H . . . 2 2 1 1 ALA H1 H . . . . . 4.40 0.0 4.40 . . . . . B . 300 LYS H . . B . 299 ALA H1 . . . 300 . HN . . . . . 299 . HT* . . c17360_2l7l 1 12 1 . . 2 2 13 13 ALA H H . . . 2 2 14 14 VAL H H . . . . . 4.10 0.0 4.10 . . . . . B . 311 ALA H . . B . 312 VAL H . . . 311 . HN . . . . . 312 . HN . . c17360_2l7l 1 13 1 . . 2 2 14 14 VAL H H . . . 2 2 15 15 VAL H H . . . . . 4.12 0.0 4.12 . . . . . B . 312 VAL H . . B . 313 VAL H . . . 312 . HN . . . . . 313 . HN . . c17360_2l7l 1 14 1 . . 2 2 14 14 VAL H H . . . 2 2 11 11 ALA HA H . . . . . 4.48 0.0 4.48 . . . . . B . 312 VAL H . . B . 309 ALA HA . . . 312 . HN . . . . . 309 . HA . . c17360_2l7l 1 15 1 . . 2 2 14 14 VAL H H . . . 2 2 14 14 VAL HB H . . . . . 3.37 0.0 3.37 . . . . . B . 312 VAL H . . B . 312 VAL HB . . . 312 . HN . . . . . 312 . HB . . c17360_2l7l 1 16 1 . . 2 2 14 14 VAL H H . . . 2 2 13 13 ALA MB H . . . . . 4.05 0.0 4.05 . . . . . B . 312 VAL H . . B . 311 ALA MB . . . 312 . HN . . . . . 311 . HB# . . c17360_2l7l 1 17 1 . . 2 2 1 1 ALA MB H . . . 2 2 1 1 ALA H1 H . . . . . 3.11 0.0 3.11 . . . . . B . 299 ALA MB . . B . 299 ALA H1 . . . 299 . HB# . . . . . 299 . HT* . . c17360_2l7l 1 18 1 . . 2 2 17 17 HIS H H . . . 2 2 18 18 MET H H . . . . . 4.38 0.0 4.38 . . . . . B . 315 HIS H . . B . 316 MET H . . . 315 . HN . . . . . 316 . HN . . c17360_2l7l 1 19 1 . . 2 2 18 18 MET H H . . . 2 2 19 19 ARG H H . . . . . 4.30 0.0 4.30 . . . . . B . 316 MET H . . B . 317 ARG H . . . 316 . HN . . . . . 317 . HN . . c17360_2l7l 1 20 1 . . 2 2 18 18 MET H H . . . 2 2 15 15 VAL HA H . . . . . 5.23 0.0 5.23 . . . . . B . 316 MET H . . B . 313 VAL HA . . . 316 . HN . . . . . 313 . HA . . c17360_2l7l 1 21 1 . . 2 2 18 18 MET H H . . . 2 2 14 14 VAL HA H . . . . . 5.50 0.0 5.50 . . . . . B . 316 MET H . . B . 312 VAL HA . . . 316 . HN . . . . . 312 . HA . . c17360_2l7l 1 22 1 . . 2 2 18 18 MET H H . . . 2 2 18 18 MET ME H . . . . . 5.50 0.0 5.50 . . . . . B . 316 MET H . . B . 316 MET ME . . . 316 . HN . . . . . 316 . HE# . . c17360_2l7l 1 23 1 . . 2 2 18 18 MET H H . . . 2 2 15 15 VAL MG1 H . . . . . 5.50 0.0 5.50 . . . . . B . 316 MET H . . B . 313 VAL MG1 . . . 316 . HN . . . . . 313 . HG1# . . c17360_2l7l 1 24 1 . . 2 2 11 11 ALA H H . . . 2 2 13 13 ALA MB H . . . . . 5.50 0.0 5.50 . . . . . B . 309 ALA H . . B . 311 ALA MB . . . 309 . HN . . . . . 311 . HB# . . c17360_2l7l 1 25 1 . . 2 2 11 11 ALA H H . . . 2 2 12 12 THR MG H . . . . . 5.03 0.0 5.03 . . . . . B . 309 ALA H . . B . 310 THR MG . . . 309 . HN . . . . . 310 . HG2# . . c17360_2l7l 1 26 1 . . 2 2 11 11 ALA H H . . . 2 2 11 11 ALA MB H . . . . . 3.14 0.0 3.14 . . . . . B . 309 ALA H . . B . 309 ALA MB . . . 309 . HN . . . . . 309 . HB# . . c17360_2l7l 1 27 1 . . 2 2 11 11 ALA H H . . . 2 2 8 8 ALA MB H . . . . . 5.50 0.0 5.50 . . . . . B . 309 ALA H . . B . 306 ALA MB . . . 309 . HN . . . . . 306 . HB# . . c17360_2l7l 1 28 1 . . 2 2 11 11 ALA H H . . . 2 2 8 8 ALA HA H . . . . . 4.52 0.0 4.52 . . . . . B . 309 ALA H . . B . 306 ALA HA . . . 309 . HN . . . . . 306 . HA . . c17360_2l7l 1 29 1 . . 2 2 11 11 ALA H H . . . 2 2 7 7 GLN HA H . . . . . 4.83 0.0 4.83 . . . . . B . 309 ALA H . . B . 305 GLN HA . . . 309 . HN . . . . . 305 . HA . . c17360_2l7l 1 30 1 . . 2 2 11 11 ALA H H . . . 2 2 12 12 THR H H . . . . . 3.87 0.0 3.87 . . . . . B . 309 ALA H . . B . 310 THR H . . . 309 . HN . . . . . 310 . HN . . c17360_2l7l 1 31 1 . . 2 2 13 13 ALA H H . . . 2 2 12 12 THR H H . . . . . 3.84 0.0 3.84 . . . . . B . 311 ALA H . . B . 310 THR H . . . 311 . HN . . . . . 310 . HN . . c17360_2l7l 1 32 1 . . 2 2 13 13 ALA H H . . . 2 2 12 12 THR HG1 H . . . . . 3.82 0.0 3.82 . . . . . B . 311 ALA H . . B . 310 THR HG1 . . . 311 . HN . . . . . 310 . HG1 . . c17360_2l7l 1 33 1 . . 2 2 13 13 ALA H H . . . 2 2 10 10 ASN HA H . . . . . 4.31 0.0 4.31 . . . . . B . 311 ALA H . . B . 308 ASN HA . . . 311 . HN . . . . . 308 . HA . . c17360_2l7l 1 34 1 . . 2 2 13 13 ALA H H . . . 2 2 11 11 ALA HA H . . . . . 4.52 0.0 4.52 . . . . . B . 311 ALA H . . B . 309 ALA HA . . . 311 . HN . . . . . 309 . HA . . c17360_2l7l 1 35 1 . . 2 2 13 13 ALA H H . . . 2 2 12 12 THR HB H . . . . . 4.70 0.0 4.70 . . . . . B . 311 ALA H . . B . 310 THR HB . . . 311 . HN . . . . . 310 . HB . . c17360_2l7l 1 36 1 . . 2 2 13 13 ALA H H . . . 2 2 11 11 ALA MB H . . . . . 4.83 0.0 4.83 . . . . . B . 311 ALA H . . B . 309 ALA MB . . . 311 . HN . . . . . 309 . HB# . . c17360_2l7l 1 37 1 . . 2 2 13 13 ALA H H . . . 2 2 12 12 THR MG H . . . . . 4.52 0.0 4.52 . . . . . B . 311 ALA H . . B . 310 THR MG . . . 311 . HN . . . . . 310 . HG2# . . c17360_2l7l 1 38 1 . . 2 2 13 13 ALA H H . . . 2 2 13 13 ALA MB H . . . . . 3.34 0.0 3.34 . . . . . B . 311 ALA H . . B . 311 ALA MB . . . 311 . HN . . . . . 311 . HB# . . c17360_2l7l 1 39 1 . . 2 2 8 8 ALA MB H . . . 2 2 7 7 GLN H H . . . . . 5.17 0.0 5.17 . . . . . B . 306 ALA MB . . B . 305 GLN H . . . 306 . HB# . . . . . 305 . HN . . c17360_2l7l 1 40 1 . . 2 2 7 7 GLN H H . . . 2 2 4 4 LYS HA H . . . . . 4.23 0.0 4.23 . . . . . B . 305 GLN H . . B . 302 LYS HA . . . 305 . HN . . . . . 302 . HA . . c17360_2l7l 1 41 1 . . 2 2 7 7 GLN H H . . . 2 2 3 3 SER HA H . . . . . 5.16 0.0 5.16 . . . . . B . 305 GLN H . . B . 301 SER HA . . . 305 . HN . . . . . 301 . HA . . c17360_2l7l 1 42 1 . . 2 2 8 8 ALA H H . . . 2 2 7 7 GLN H H . . . . . 3.87 0.0 3.87 . . . . . B . 306 ALA H . . B . 305 GLN H . . . 306 . HN . . . . . 305 . HN . . c17360_2l7l 1 43 1 . . 2 2 7 7 GLN H H . . . 2 2 6 6 LYS H H . . . . . 3.43 0.0 3.43 . . . . . B . 305 GLN H . . B . 304 LYS H . . . 305 . HN . . . . . 304 . HN . . c17360_2l7l 1 44 1 . . 2 2 4 4 LYS H H . . . 2 2 5 5 TRP H H . . . . . 3.44 0.0 3.44 . . . . . B . 302 LYS H . . B . 303 TRP H . . . 302 . HN . . . . . 303 . HN . . c17360_2l7l 1 45 1 . . 2 2 5 5 TRP H H . . . 2 2 5 5 TRP HD1 H . . . . . 4.15 0.0 4.15 . . . . . B . 303 TRP H . . B . 303 TRP HD1 . . . 303 . HN . . . . . 303 . HD1 . . c17360_2l7l 1 46 1 . . 2 2 3 3 SER HA H . . . 2 2 6 6 LYS H H . . . . . 4.35 0.0 4.35 . . . . . B . 301 SER HA . . B . 304 LYS H . . . 301 . HA . . . . . 304 . HN . . c17360_2l7l 1 47 1 . . 2 2 5 5 TRP H H . . . 2 2 1 1 ALA HA H . . . . . 5.50 0.0 5.50 . . . . . B . 303 TRP H . . B . 299 ALA HA . . . 303 . HN . . . . . 299 . HA . . c17360_2l7l 1 48 1 . . 2 2 6 6 LYS H H . . . 2 2 5 5 TRP HB3 H . . . . . 4.03 0.0 4.03 . . . . . B . 304 LYS H . . B . 303 TRP HB3 . . . 304 . HN . . . . . 303 . HB1 . . c17360_2l7l 1 49 1 . . 2 2 5 5 TRP H H . . . 2 2 5 5 TRP HB3 H . . . . . 3.75 0.0 3.75 . . . . . B . 303 TRP H . . B . 303 TRP HB3 . . . 303 . HN . . . . . 303 . HB1 . . c17360_2l7l 1 50 1 . . 2 2 6 6 LYS H H . . . 2 2 5 5 TRP HB2 H . . . . . 4.77 0.0 4.77 . . . . . B . 304 LYS H . . B . 303 TRP HB2 . . . 304 . HN . . . . . 303 . HB2 . . c17360_2l7l 1 51 1 . . 2 2 5 5 TRP H H . . . 2 2 5 5 TRP HB2 H . . . . . 4.10 0.0 4.10 . . . . . B . 303 TRP H . . B . 303 TRP HB2 . . . 303 . HN . . . . . 303 . HB2 . . c17360_2l7l 1 52 1 . . 2 2 6 6 LYS H H . . . 2 2 2 2 LYS HA H . . . . . 4.31 0.0 4.31 . . . . . B . 304 LYS H . . B . 300 LYS HA . . . 304 . HN . . . . . 300 . HA . . c17360_2l7l 1 53 1 . . 2 2 3 3 SER H H . . . 2 2 6 6 LYS H H . . . . . 5.13 0.0 5.13 . . . . . B . 301 SER H . . B . 304 LYS H . . . 301 . HN . . . . . 304 . HN . . c17360_2l7l 1 54 1 . . 2 2 6 6 LYS H H . . . 2 2 4 4 LYS H H . . . . . 5.44 0.0 5.44 . . . . . B . 304 LYS H . . B . 302 LYS H . . . 304 . HN . . . . . 302 . HN . . c17360_2l7l 1 55 1 . . 2 2 17 17 HIS H H . . . 2 2 14 14 VAL HA H . . . . . 4.69 0.0 4.69 . . . . . B . 315 HIS H . . B . 312 VAL HA . . . 315 . HN . . . . . 312 . HA . . c17360_2l7l 1 56 1 . . 2 2 17 17 HIS H H . . . 2 2 15 15 VAL MG1 H . . . . . 5.50 0.0 5.50 . . . . . B . 315 HIS H . . B . 313 VAL MG1 . . . 315 . HN . . . . . 313 . HG1# . . c17360_2l7l 1 57 1 . . 2 2 3 3 SER H H . . . 2 2 5 5 TRP HD1 H . . . . . 5.50 0.0 5.50 . . . . . B . 301 SER H . . B . 303 TRP HD1 . . . 301 . HN . . . . . 303 . HD1 . . c17360_2l7l 1 58 1 . . 2 2 4 4 LYS H H . . . 2 2 5 5 TRP HD1 H . . . . . 5.50 0.0 5.50 . . . . . B . 302 LYS H . . B . 303 TRP HD1 . . . 302 . HN . . . . . 303 . HD1 . . c17360_2l7l 1 59 1 . . 2 2 1 1 ALA MB H . . . 2 2 3 3 SER H H . . . . . 4.53 0.0 4.53 . . . . . B . 299 ALA MB . . B . 301 SER H . . . 299 . HB# . . . . . 301 . HN . . c17360_2l7l 1 60 1 . . 2 2 15 15 VAL MG1 H . . . 2 2 16 16 ARG H H . . . . . 4.50 0.0 4.50 . . . . . B . 313 VAL MG1 . . B . 314 ARG H . . . 313 . HG1# . . . . . 314 . HN . . c17360_2l7l 1 61 1 . . 2 2 16 16 ARG H H . . . 2 2 15 15 VAL MG2 H . . . . . 4.31 0.0 4.31 . . . . . B . 314 ARG H . . B . 313 VAL MG2 . . . 314 . HN . . . . . 313 . HG2# . . c17360_2l7l 1 62 1 . . 2 2 16 16 ARG H H . . . 2 2 15 15 VAL HB H . . . . . 4.06 0.0 4.06 . . . . . B . 314 ARG H . . B . 313 VAL HB . . . 314 . HN . . . . . 313 . HB . . c17360_2l7l 1 63 1 . . 2 2 16 16 ARG H H . . . 2 2 12 12 THR HA H . . . . . 4.89 0.0 4.89 . . . . . B . 314 ARG H . . B . 310 THR HA . . . 314 . HN . . . . . 310 . HA . . c17360_2l7l 1 64 1 . . 2 2 16 16 ARG H H . . . 2 2 13 13 ALA HA H . . . . . 4.78 0.0 4.78 . . . . . B . 314 ARG H . . B . 311 ALA HA . . . 314 . HN . . . . . 311 . HA . . c17360_2l7l 1 65 1 . . 2 2 12 12 THR HB H . . . 2 2 16 16 ARG H H . . . . . 5.50 0.0 5.50 . . . . . B . 310 THR HB . . B . 314 ARG H . . . 310 . HB . . . . . 314 . HN . . c17360_2l7l 1 66 1 . . 2 2 16 16 ARG H H . . . 2 2 17 17 HIS HA H . . . . . 5.50 0.0 5.50 . . . . . B . 314 ARG H . . B . 315 HIS HA . . . 314 . HN . . . . . 315 . HA . . c17360_2l7l 1 67 1 . . 2 2 15 15 VAL H H . . . 2 2 16 16 ARG H H . . . . . 3.85 0.0 3.85 . . . . . B . 313 VAL H . . B . 314 ARG H . . . 313 . HN . . . . . 314 . HN . . c17360_2l7l 1 68 1 . . 2 2 15 15 VAL H H . . . 2 2 15 15 VAL MG1 H . . . . . 4.62 0.0 4.62 . . . . . B . 313 VAL H . . B . 313 VAL MG1 . . . 313 . HN . . . . . 313 . HG1# . . c17360_2l7l 1 69 1 . . 2 2 13 13 ALA MB H . . . 2 2 12 12 THR H H . . . . . 4.70 0.0 4.70 . . . . . B . 311 ALA MB . . B . 310 THR H . . . 311 . HB# . . . . . 310 . HN . . c17360_2l7l 1 70 1 . . 2 2 12 12 THR H H . . . 2 2 15 15 VAL MG2 H . . . . . 4.94 0.0 4.94 . . . . . B . 310 THR H . . B . 313 VAL MG2 . . . 310 . HN . . . . . 313 . HG2# . . c17360_2l7l 1 71 1 . . 2 2 15 15 VAL H H . . . 2 2 15 15 VAL HB H . . . . . 3.32 0.0 3.32 . . . . . B . 313 VAL H . . B . 313 VAL HB . . . 313 . HN . . . . . 313 . HB . . c17360_2l7l 1 72 1 . . 2 2 15 15 VAL H H . . . 2 2 14 14 VAL HB H . . . . . 4.29 0.0 4.29 . . . . . B . 313 VAL H . . B . 312 VAL HB . . . 313 . HN . . . . . 312 . HB . . c17360_2l7l 1 73 1 . . 2 2 15 15 VAL H H . . . 2 2 12 12 THR HA H . . . . . 4.64 0.0 4.64 . . . . . B . 313 VAL H . . B . 310 THR HA . . . 313 . HN . . . . . 310 . HA . . c17360_2l7l 1 74 1 . . 2 2 15 15 VAL H H . . . 2 2 11 11 ALA HA H . . . . . 4.85 0.0 4.85 . . . . . B . 313 VAL H . . B . 309 ALA HA . . . 313 . HN . . . . . 309 . HA . . c17360_2l7l 1 75 1 . . 2 2 19 19 ARG H H . . . 2 2 15 15 VAL MG1 H . . . . . 4.76 0.0 4.76 . . . . . B . 317 ARG H . . B . 313 VAL MG1 . . . 317 . HN . . . . . 313 . HG1# . . c17360_2l7l 1 76 1 . . 2 2 15 15 VAL H H . . . 2 2 15 15 VAL MG2 H . . . . . 3.37 0.0 3.37 . . . . . B . 313 VAL H . . B . 313 VAL MG2 . . . 313 . HN . . . . . 313 . HG2# . . c17360_2l7l 1 77 1 . . 2 2 8 8 ALA H H . . . 2 2 8 8 ALA MB H . . . . . 3.07 0.0 3.07 . . . . . B . 306 ALA H . . B . 306 ALA MB . . . 306 . HN . . . . . 306 . HB# . . c17360_2l7l 1 78 1 . . 2 2 19 19 ARG H H . . . 2 2 15 15 VAL HA H . . . . . 5.48 0.0 5.48 . . . . . B . 317 ARG H . . B . 313 VAL HA . . . 317 . HN . . . . . 313 . HA . . c17360_2l7l 1 79 1 . . 2 2 8 8 ALA H H . . . 2 2 4 4 LYS HA H . . . . . 4.48 0.0 4.48 . . . . . B . 306 ALA H . . B . 302 LYS HA . . . 306 . HN . . . . . 302 . HA . . c17360_2l7l 1 80 1 . . 2 2 8 8 ALA H H . . . 2 2 5 5 TRP HA H . . . . . 4.94 0.0 4.94 . . . . . B . 306 ALA H . . B . 303 TRP HA . . . 306 . HN . . . . . 303 . HA . . c17360_2l7l 1 81 1 . . 2 2 12 12 THR H H . . . 2 2 12 12 THR HG1 H . . . . . 3.89 0.0 3.89 . . . . . B . 310 THR H . . B . 310 THR HG1 . . . 310 . HN . . . . . 310 . HG1 . . c17360_2l7l 1 82 1 . . 2 2 21 21 LEU H H . . . 2 2 22 22 GLN H H . . . . . 3.23 0.0 3.23 . . . . . B . 319 LEU H . . B . 320 GLN H . . . 319 . HN . . . . . 320 . HN . . c17360_2l7l 1 83 1 . . 2 2 18 18 MET HA H . . . 2 2 20 20 LYS H H . . . . . 5.50 0.0 5.50 . . . . . B . 316 MET HA . . B . 318 LYS H . . . 316 . HA . . . . . 318 . HN . . c17360_2l7l 1 84 1 . . 2 2 12 12 THR MG H . . . 2 2 12 12 THR H H . . . . . 3.10 0.0 3.10 . . . . . B . 310 THR MG . . B . 310 THR H . . . 310 . HG2# . . . . . 310 . HN . . c17360_2l7l 1 85 1 . . 2 2 21 21 LEU H H . . . 2 2 21 21 LEU HG H . . . . . 3.47 0.0 3.47 . . . . . B . 319 LEU H . . B . 319 LEU HG . . . 319 . HN . . . . . 319 . HG . . c17360_2l7l 1 86 1 . . 2 2 11 11 ALA MB H . . . 2 2 12 12 THR H H . . . . . 3.32 0.0 3.32 . . . . . B . 309 ALA MB . . B . 310 THR H . . . 309 . HB# . . . . . 310 . HN . . c17360_2l7l 1 87 1 . . 2 2 17 17 HIS HA H . . . 2 2 17 17 HIS HE1 H . . . . . 4.94 0.0 4.94 . . . . . B . 315 HIS HA . . B . 315 HIS HE1 . . . 315 . HA . . . . . 315 . HE1 . . c17360_2l7l 1 88 1 . . 2 2 22 22 GLN H H . . . 2 2 21 21 LEU HG H . . . . . 4.88 0.0 4.88 . . . . . B . 320 GLN H . . B . 319 LEU HG . . . 320 . HN . . . . . 319 . HG . . c17360_2l7l 1 89 1 . . 2 2 22 22 GLN H H . . . 2 2 22 22 GLN HB2 H . . . . . 3.81 0.0 3.81 . . . . . B . 320 GLN H . . B . 320 GLN HB2 . . . 320 . HN . . . . . 320 . HB2 . . c17360_2l7l 1 90 1 . . 2 2 22 22 GLN H H . . . 2 2 22 22 GLN HB3 H . . . . . 3.81 0.0 3.81 . . . . . B . 320 GLN H . . B . 320 GLN HB3 . . . 320 . HN . . . . . 320 . HB1 . . c17360_2l7l 1 91 1 . . 2 2 22 22 GLN H H . . . 2 2 19 19 ARG HA H . . . . . 4.73 0.0 4.73 . . . . . B . 320 GLN H . . B . 317 ARG HA . . . 320 . HN . . . . . 317 . HA . . c17360_2l7l 1 92 1 . . 2 2 22 22 GLN H H . . . 2 2 21 21 LEU MD1 H . . . . . 5.50 0.0 5.50 . . . . . B . 320 GLN H . . B . 319 LEU MD1 . . . 320 . HN . . . . . 319 . HD1# . . c17360_2l7l 1 93 1 . . 2 2 22 22 GLN H H . . . 2 2 21 21 LEU MD2 H . . . . . 5.50 0.0 5.50 . . . . . B . 320 GLN H . . B . 319 LEU MD2 . . . 320 . HN . . . . . 319 . HD2# . . c17360_2l7l 1 94 1 . . 2 2 8 8 ALA MB H . . . 2 2 5 5 TRP HE3 H . . . . . 4.59 0.0 4.59 . . . . . B . 306 ALA MB . . B . 303 TRP HE3 . . . 306 . HB# . . . . . 303 . HE3 . . c17360_2l7l 1 95 1 . . 2 2 5 5 TRP HE3 H . . . 2 2 5 5 TRP HB2 H . . . . . 3.56 0.0 3.56 . . . . . B . 303 TRP HE3 . . B . 303 TRP HB2 . . . 303 . HE3 . . . . . 303 . HB2 . . c17360_2l7l 1 96 1 . . 2 2 5 5 TRP HA H . . . 2 2 5 5 TRP HE3 H . . . . . 3.13 0.0 3.13 . . . . . B . 303 TRP HA . . B . 303 TRP HE3 . . . 303 . HA . . . . . 303 . HE3 . . c17360_2l7l 1 97 1 . . 2 2 9 9 PHE QD H . . . 2 2 9 9 PHE HZ H . . . . . 3.90 0.0 3.90 . . . . . B . 307 PHE QD . . B . 307 PHE HZ . . . 307 . HD# . . . . . 307 . HZ . . c17360_2l7l 1 98 1 . . 2 2 13 13 ALA MB H . . . 2 2 9 9 PHE QE H . . . . . 4.16 0.0 4.16 . . . . . B . 311 ALA MB . . B . 307 PHE QE . . . 311 . HB# . . . . . 307 . HE# . . c17360_2l7l 1 99 1 . . 2 2 13 13 ALA MB H . . . 2 2 9 9 PHE HZ H . . . . . 4.41 0.0 4.41 . . . . . B . 311 ALA MB . . B . 307 PHE HZ . . . 311 . HB# . . . . . 307 . HZ . . c17360_2l7l 1 100 1 . . 2 2 10 10 ASN HA H . . . 2 2 9 9 PHE HZ H . . . . . 5.50 0.0 5.50 . . . . . B . 308 ASN HA . . B . 307 PHE HZ . . . 308 . HA . . . . . 307 . HZ . . c17360_2l7l 1 101 1 . . 2 2 9 9 PHE QE H . . . 2 2 9 9 PHE HA H . . . . . 4.73 0.0 4.73 . . . . . B . 307 PHE QE . . B . 307 PHE HA . . . 307 . HE# . . . . . 307 . HA . . c17360_2l7l 1 102 1 . . 2 2 10 10 ASN HA H . . . 2 2 9 9 PHE QE H . . . . . 4.67 0.0 4.67 . . . . . B . 308 ASN HA . . B . 307 PHE QE . . . 308 . HA . . . . . 307 . HE# . . c17360_2l7l 1 103 1 . . 2 2 6 6 LYS HA H . . . 2 2 9 9 PHE QE H . . . . . 5.22 0.0 5.22 . . . . . B . 304 LYS HA . . B . 307 PHE QE . . . 304 . HA . . . . . 307 . HE# . . c17360_2l7l 1 104 1 . . 2 2 9 9 PHE HZ H . . . 2 2 9 9 PHE QE H . . . . . 2.40 0.0 2.40 . . . . . B . 307 PHE HZ . . B . 307 PHE QE . . . 307 . HZ . . . . . 307 . HE# . . c17360_2l7l 1 105 1 . . 2 2 5 5 TRP HD1 H . . . 2 2 5 5 TRP HB3 H . . . . . 3.07 0.0 3.07 . . . . . B . 303 TRP HD1 . . B . 303 TRP HB3 . . . 303 . HD1 . . . . . 303 . HB1 . . c17360_2l7l 1 106 1 . . 2 2 9 9 PHE QD H . . . 2 2 13 13 ALA MB H . . . . . 4.35 0.0 4.35 . . . . . B . 307 PHE QD . . B . 311 ALA MB . . . 307 . HD# . . . . . 311 . HB# . . c17360_2l7l 1 107 1 . . 2 2 9 9 PHE QD H . . . 2 2 12 12 THR MG H . . . . . 5.50 0.0 5.50 . . . . . B . 307 PHE QD . . B . 310 THR MG . . . 307 . HD# . . . . . 310 . HG2# . . c17360_2l7l 1 108 1 . . 2 2 1 1 ALA MB H . . . 2 2 5 5 TRP HD1 H . . . . . 3.97 0.0 3.97 . . . . . B . 299 ALA MB . . B . 303 TRP HD1 . . . 299 . HB# . . . . . 303 . HD1 . . c17360_2l7l 1 109 1 . . 2 2 9 9 PHE QD H . . . 2 2 8 8 ALA MB H . . . . . 5.43 0.0 5.43 . . . . . B . 307 PHE QD . . B . 306 ALA MB . . . 307 . HD# . . . . . 306 . HB# . . c17360_2l7l 1 110 1 . . 2 2 5 5 TRP HD1 H . . . 2 2 5 5 TRP HB2 H . . . . . 3.71 0.0 3.71 . . . . . B . 303 TRP HD1 . . B . 303 TRP HB2 . . . 303 . HD1 . . . . . 303 . HB2 . . c17360_2l7l 1 111 1 . . 2 2 5 5 TRP HD1 H . . . 2 2 1 1 ALA HA H . . . . . 5.15 0.0 5.15 . . . . . B . 303 TRP HD1 . . B . 299 ALA HA . . . 303 . HD1 . . . . . 299 . HA . . c17360_2l7l 1 112 1 . . 2 2 6 6 LYS HA H . . . 2 2 9 9 PHE QD H . . . . . 3.76 0.0 3.76 . . . . . B . 304 LYS HA . . B . 307 PHE QD . . . 304 . HA . . . . . 307 . HD# . . c17360_2l7l 1 113 1 . . 2 2 5 5 TRP HD1 H . . . 2 2 2 2 LYS HA H . . . . . 3.09 0.0 3.09 . . . . . B . 303 TRP HD1 . . B . 300 LYS HA . . . 303 . HD1 . . . . . 300 . HA . . c17360_2l7l 1 114 1 . . 2 2 9 9 PHE QD H . . . 2 2 9 9 PHE HA H . . . . . 3.34 0.0 3.34 . . . . . B . 307 PHE QD . . B . 307 PHE HA . . . 307 . HD# . . . . . 307 . HA . . c17360_2l7l 1 115 1 . . 2 2 9 9 PHE QD H . . . 2 2 10 10 ASN HA H . . . . . 4.18 0.0 4.18 . . . . . B . 307 PHE QD . . B . 308 ASN HA . . . 307 . HD# . . . . . 308 . HA . . c17360_2l7l 1 116 1 . . 2 2 17 17 HIS HA H . . . 2 2 17 17 HIS HD2 H . . . . . 5.02 0.0 5.02 . . . . . B . 315 HIS HA . . B . 315 HIS HD2 . . . 315 . HA . . . . . 315 . HD2 . . c17360_2l7l 1 117 1 . . 2 2 5 5 TRP HA H . . . 2 2 5 5 TRP HZ3 H . . . . . 5.39 0.0 5.39 . . . . . B . 303 TRP HA . . B . 303 TRP HZ3 . . . 303 . HA . . . . . 303 . HZ3 . . c17360_2l7l 1 118 1 . . 2 2 14 14 VAL HA H . . . 2 2 17 17 HIS HD2 H . . . . . 4.98 0.0 4.98 . . . . . B . 312 VAL HA . . B . 315 HIS HD2 . . . 312 . HA . . . . . 315 . HD2 . . c17360_2l7l 1 119 1 . . 2 2 18 18 MET ME H . . . 2 2 17 17 HIS HD2 H . . . . . 5.40 0.0 5.40 . . . . . B . 316 MET ME . . B . 315 HIS HD2 . . . 316 . HE# . . . . . 315 . HD2 . . c17360_2l7l 1 120 1 . . 2 2 14 14 VAL HA H . . . 2 2 14 14 VAL MG2 H . . . . . 3.97 0.0 3.97 . . . . . B . 312 VAL HA . . B . 312 VAL MG2 . . . 312 . HA . . . . . 312 . HG2# . . c17360_2l7l 1 121 1 . . 2 2 15 15 VAL HA H . . . 2 2 15 15 VAL MG1 H . . . . . 3.84 0.0 3.84 . . . . . B . 313 VAL HA . . B . 313 VAL MG1 . . . 313 . HA . . . . . 313 . HG1# . . c17360_2l7l 1 122 1 . . 2 2 15 15 VAL HA H . . . 2 2 15 15 VAL MG2 H . . . . . 3.99 0.0 3.99 . . . . . B . 313 VAL HA . . B . 313 VAL MG2 . . . 313 . HA . . . . . 313 . HG2# . . c17360_2l7l 1 123 1 . . 2 2 14 14 VAL HA H . . . 2 2 14 14 VAL MG1 H . . . . . 3.97 0.0 3.97 . . . . . B . 312 VAL HA . . B . 312 VAL MG1 . . . 312 . HA . . . . . 312 . HG1# . . c17360_2l7l 1 124 1 . . 2 2 14 14 VAL HB H . . . 2 2 13 13 ALA MB H . . . . . 5.38 0.0 5.38 . . . . . B . 312 VAL HB . . B . 311 ALA MB . . . 312 . HB . . . . . 311 . HB# . . c17360_2l7l 1 125 1 . . 2 2 14 14 VAL HB H . . . 2 2 15 15 VAL MG2 H . . . . . 5.06 0.0 5.06 . . . . . B . 312 VAL HB . . B . 313 VAL MG2 . . . 312 . HB . . . . . 313 . HG2# . . c17360_2l7l 1 126 1 . . 2 2 14 14 VAL HB H . . . 2 2 11 11 ALA MB H . . . . . 5.50 0.0 5.50 . . . . . B . 312 VAL HB . . B . 309 ALA MB . . . 312 . HB . . . . . 309 . HB# . . c17360_2l7l 1 127 1 . . 2 2 15 15 VAL MG1 H . . . 2 2 12 12 THR HA H . . . . . 4.31 0.0 4.31 . . . . . B . 313 VAL MG1 . . B . 310 THR HA . . . 313 . HG1# . . . . . 310 . HA . . c17360_2l7l 1 128 1 . . 2 2 15 15 VAL MG2 H . . . 2 2 12 12 THR HA H . . . . . 3.69 0.0 3.69 . . . . . B . 313 VAL MG2 . . B . 310 THR HA . . . 313 . HG2# . . . . . 310 . HA . . c17360_2l7l 1 129 1 . . 2 2 12 12 THR MG H . . . 2 2 12 12 THR HA H . . . . . 3.18 0.0 3.18 . . . . . B . 310 THR MG . . B . 310 THR HA . . . 310 . HG2# . . . . . 310 . HA . . c17360_2l7l 1 130 1 . . 2 2 11 11 ALA MB H . . . 2 2 12 12 THR HA H . . . . . 4.54 0.0 4.54 . . . . . B . 309 ALA MB . . B . 310 THR HA . . . 309 . HB# . . . . . 310 . HA . . c17360_2l7l 1 131 1 . . 2 2 15 15 VAL HB H . . . 2 2 12 12 THR HA H . . . . . 3.89 0.0 3.89 . . . . . B . 313 VAL HB . . B . 310 THR HA . . . 313 . HB . . . . . 310 . HA . . c17360_2l7l 1 132 1 . . 2 2 11 11 ALA HA H . . . 2 2 14 14 VAL HB H . . . . . 5.12 0.0 5.12 . . . . . B . 309 ALA HA . . B . 312 VAL HB . . . 309 . HA . . . . . 312 . HB . . c17360_2l7l 1 133 1 . . 2 2 19 19 ARG HA H . . . 2 2 19 19 ARG HG3 H . . . . . 3.95 0.0 3.95 . . . . . B . 317 ARG HA . . B . 317 ARG HG3 . . . 317 . HA . . . . . 317 . HG1 . . c17360_2l7l 1 134 1 . . 2 2 19 19 ARG HA H . . . 2 2 19 19 ARG HG2 H . . . . . 3.95 0.0 3.95 . . . . . B . 317 ARG HA . . B . 317 ARG HG2 . . . 317 . HA . . . . . 317 . HG2 . . c17360_2l7l 1 135 1 . . 2 2 21 21 LEU HG H . . . 2 2 21 21 LEU HA H . . . . . 3.50 0.0 3.50 . . . . . B . 319 LEU HG . . B . 319 LEU HA . . . 319 . HG . . . . . 319 . HA . . c17360_2l7l 1 136 1 . . 2 2 8 8 ALA MB H . . . 2 2 5 5 TRP HA H . . . . . 3.66 0.0 3.66 . . . . . B . 306 ALA MB . . B . 303 TRP HA . . . 306 . HB# . . . . . 303 . HA . . c17360_2l7l 1 137 1 . . 2 2 11 11 ALA HA H . . . 2 2 15 15 VAL MG2 H . . . . . 4.72 0.0 4.72 . . . . . B . 309 ALA HA . . B . 313 VAL MG2 . . . 309 . HA . . . . . 313 . HG2# . . c17360_2l7l 1 138 1 . . 2 2 13 13 ALA MB H . . . 2 2 10 10 ASN HA H . . . . . 3.50 0.0 3.50 . . . . . B . 311 ALA MB . . B . 308 ASN HA . . . 311 . HB# . . . . . 308 . HA . . c17360_2l7l 1 139 1 . . 2 2 11 11 ALA MB H . . . 2 2 7 7 GLN HA H . . . . . 5.08 0.0 5.08 . . . . . B . 309 ALA MB . . B . 305 GLN HA . . . 309 . HB# . . . . . 305 . HA . . c17360_2l7l 1 140 1 . . 2 2 19 19 ARG H H . . . 2 2 16 16 ARG HA H . . . . . 4.30 0.0 4.30 . . . . . B . 317 ARG H . . B . 314 ARG HA . . . 317 . HN . . . . . 314 . HA . . c17360_2l7l 1 141 1 . . 2 2 17 17 HIS HA H . . . 2 2 20 20 LYS H H . . . . . 4.34 0.0 4.34 . . . . . B . 315 HIS HA . . B . 318 LYS H . . . 315 . HA . . . . . 318 . HN . . c17360_2l7l 1 142 1 OR . 2 2 2 2 LYS H H . . . 2 2 2 2 LYS HB2 H . . . . . 3.07 0.0 3.07 . . . . . B . 300 LYS H . . B . 300 LYS HB2 . . . 300 . HN . . . . . 300 . HB# . . c17360_2l7l 1 142 2 OR . 2 2 2 2 LYS H H . . . 2 2 2 2 LYS HB3 H . . . . . 3.07 0.0 3.07 . . . . . B . 300 LYS H . . B . 300 LYS HB3 . . . 300 . HN . . . . . 300 . HB# . . c17360_2l7l 1 143 1 OR . 2 2 2 2 LYS H H . . . 2 2 2 2 LYS HG2 H . . . . . 4.63 0.0 4.63 . . . . . B . 300 LYS H . . B . 300 LYS HG2 . . . 300 . HN . . . . . 300 . HG# . . c17360_2l7l 1 143 2 OR . 2 2 2 2 LYS H H . . . 2 2 2 2 LYS HG3 H . . . . . 4.63 0.0 4.63 . . . . . B . 300 LYS H . . B . 300 LYS HG3 . . . 300 . HN . . . . . 300 . HG# . . c17360_2l7l 1 144 1 OR . 2 2 2 2 LYS H H . . . 2 2 2 2 LYS HD2 H . . . . . 5.34 0.0 5.34 . . . . . B . 300 LYS H . . B . 300 LYS HD2 . . . 300 . HN . . . . . 300 . HD# . . c17360_2l7l 1 144 2 OR . 2 2 2 2 LYS H H . . . 2 2 2 2 LYS HD3 H . . . . . 5.34 0.0 5.34 . . . . . B . 300 LYS H . . B . 300 LYS HD3 . . . 300 . HN . . . . . 300 . HD# . . c17360_2l7l 1 145 1 OR . 2 2 2 2 LYS HA H . . . 2 2 2 2 LYS HG2 H . . . . . 3.54 0.0 3.54 . . . . . B . 300 LYS HA . . B . 300 LYS HG2 . . . 300 . HA . . . . . 300 . HG# . . c17360_2l7l 1 145 2 OR . 2 2 2 2 LYS HA H . . . 2 2 2 2 LYS HG3 H . . . . . 3.54 0.0 3.54 . . . . . B . 300 LYS HA . . B . 300 LYS HG3 . . . 300 . HA . . . . . 300 . HG# . . c17360_2l7l 1 146 1 OR . 2 2 2 2 LYS HA H . . . 2 2 2 2 LYS HD2 H . . . . . 3.68 0.0 3.68 . . . . . B . 300 LYS HA . . B . 300 LYS HD2 . . . 300 . HA . . . . . 300 . HD# . . c17360_2l7l 1 146 2 OR . 2 2 2 2 LYS HA H . . . 2 2 2 2 LYS HD3 H . . . . . 3.68 0.0 3.68 . . . . . B . 300 LYS HA . . B . 300 LYS HD3 . . . 300 . HA . . . . . 300 . HD# . . c17360_2l7l 1 147 1 OR . 2 2 3 3 SER H H . . . 2 2 2 2 LYS HB2 H . . . . . 3.96 0.0 3.96 . . . . . B . 301 SER H . . B . 300 LYS HB2 . . . 301 . HN . . . . . 300 . HB# . . c17360_2l7l 1 147 2 OR . 2 2 3 3 SER H H . . . 2 2 2 2 LYS HB3 H . . . . . 3.96 0.0 3.96 . . . . . B . 301 SER H . . B . 300 LYS HB3 . . . 301 . HN . . . . . 300 . HB# . . c17360_2l7l 1 148 1 OR . 2 2 5 5 TRP HD1 H . . . 2 2 2 2 LYS HB2 H . . . . . 5.03 0.0 5.03 . . . . . B . 303 TRP HD1 . . B . 300 LYS HB2 . . . 303 . HD1 . . . . . 300 . HB# . . c17360_2l7l 1 148 2 OR . 2 2 5 5 TRP HD1 H . . . 2 2 2 2 LYS HB3 H . . . . . 5.03 0.0 5.03 . . . . . B . 303 TRP HD1 . . B . 300 LYS HB3 . . . 303 . HD1 . . . . . 300 . HB# . . c17360_2l7l 1 149 1 OR . 2 2 2 2 LYS HE2 H . . . 2 2 2 2 LYS HG2 H . . . . . 3.30 0.0 3.30 . . . . . B . 300 LYS HE2 . . B . 300 LYS HG2 . . . 300 . HE# . . . . . 300 . HG# . . c17360_2l7l 1 149 2 OR . 2 2 2 2 LYS HG3 H . . . 2 2 2 2 LYS HE2 H . . . . . 3.30 0.0 3.30 . . . . . B . 300 LYS HG3 . . B . 300 LYS HE2 . . . 300 . HG# . . . . . 300 . HE# . . c17360_2l7l 1 149 3 OR . 2 2 2 2 LYS HG3 H . . . 2 2 2 2 LYS HE3 H . . . . . 3.30 0.0 3.30 . . . . . B . 300 LYS HG3 . . B . 300 LYS HE3 . . . 300 . HG# . . . . . 300 . HE# . . c17360_2l7l 1 149 4 OR . 2 2 2 2 LYS HE3 H . . . 2 2 2 2 LYS HG2 H . . . . . 3.30 0.0 3.30 . . . . . B . 300 LYS HE3 . . B . 300 LYS HG2 . . . 300 . HE# . . . . . 300 . HG# . . c17360_2l7l 1 150 1 OR . 2 2 5 5 TRP HD1 H . . . 2 2 2 2 LYS HG2 H . . . . . 4.22 0.0 4.22 . . . . . B . 303 TRP HD1 . . B . 300 LYS HG2 . . . 303 . HD1 . . . . . 300 . HG# . . c17360_2l7l 1 150 2 OR . 2 2 5 5 TRP HD1 H . . . 2 2 2 2 LYS HG3 H . . . . . 4.22 0.0 4.22 . . . . . B . 303 TRP HD1 . . B . 300 LYS HG3 . . . 303 . HD1 . . . . . 300 . HG# . . c17360_2l7l 1 151 1 OR . 2 2 6 6 LYS H H . . . 2 2 2 2 LYS HG2 H . . . . . 5.04 0.0 5.04 . . . . . B . 304 LYS H . . B . 300 LYS HG2 . . . 304 . HN . . . . . 300 . HG# . . c17360_2l7l 1 151 2 OR . 2 2 6 6 LYS H H . . . 2 2 2 2 LYS HG3 H . . . . . 5.04 0.0 5.04 . . . . . B . 304 LYS H . . B . 300 LYS HG3 . . . 304 . HN . . . . . 300 . HG# . . c17360_2l7l 1 152 1 OR . 2 2 2 2 LYS HD2 H . . . 2 2 2 2 LYS HE2 H . . . . . 2.20 0.0 2.20 . . . . . B . 300 LYS HD2 . . B . 300 LYS HE2 . . . 300 . HD# . . . . . 300 . HE# . . c17360_2l7l 1 152 2 OR . 2 2 2 2 LYS HD3 H . . . 2 2 2 2 LYS HE2 H . . . . . 2.20 0.0 2.20 . . . . . B . 300 LYS HD3 . . B . 300 LYS HE2 . . . 300 . HD# . . . . . 300 . HE# . . c17360_2l7l 1 152 3 OR . 2 2 2 2 LYS HE3 H . . . 2 2 2 2 LYS HD2 H . . . . . 2.20 0.0 2.20 . . . . . B . 300 LYS HE3 . . B . 300 LYS HD2 . . . 300 . HE# . . . . . 300 . HD# . . c17360_2l7l 1 152 4 OR . 2 2 2 2 LYS HD3 H . . . 2 2 2 2 LYS HE3 H . . . . . 2.20 0.0 2.20 . . . . . B . 300 LYS HD3 . . B . 300 LYS HE3 . . . 300 . HD# . . . . . 300 . HE# . . c17360_2l7l 1 153 1 OR . 2 2 5 5 TRP H H . . . 2 2 2 2 LYS HD2 H . . . . . 5.34 0.0 5.34 . . . . . B . 303 TRP H . . B . 300 LYS HD2 . . . 303 . HN . . . . . 300 . HD# . . c17360_2l7l 1 153 2 OR . 2 2 5 5 TRP H H . . . 2 2 2 2 LYS HD3 H . . . . . 5.34 0.0 5.34 . . . . . B . 303 TRP H . . B . 300 LYS HD3 . . . 303 . HN . . . . . 300 . HD# . . c17360_2l7l 1 154 1 OR . 2 2 5 5 TRP HD1 H . . . 2 2 2 2 LYS HD2 H . . . . . 4.55 0.0 4.55 . . . . . B . 303 TRP HD1 . . B . 300 LYS HD2 . . . 303 . HD1 . . . . . 300 . HD# . . c17360_2l7l 1 154 2 OR . 2 2 5 5 TRP HD1 H . . . 2 2 2 2 LYS HD3 H . . . . . 4.55 0.0 4.55 . . . . . B . 303 TRP HD1 . . B . 300 LYS HD3 . . . 303 . HD1 . . . . . 300 . HD# . . c17360_2l7l 1 155 1 OR . 2 2 6 6 LYS H H . . . 2 2 2 2 LYS HD2 H . . . . . 4.49 0.0 4.49 . . . . . B . 304 LYS H . . B . 300 LYS HD2 . . . 304 . HN . . . . . 300 . HD# . . c17360_2l7l 1 155 2 OR . 2 2 6 6 LYS H H . . . 2 2 2 2 LYS HD3 H . . . . . 4.49 0.0 4.49 . . . . . B . 304 LYS H . . B . 300 LYS HD3 . . . 304 . HN . . . . . 300 . HD# . . c17360_2l7l 1 156 1 OR . 2 2 9 9 PHE QD H . . . 2 2 2 2 LYS HE2 H . . . . . 5.34 0.0 5.34 . . . . . B . 307 PHE QD . . B . 300 LYS HE2 . . . 307 . HD# . . . . . 300 . HE# . . c17360_2l7l 1 156 2 OR . 2 2 9 9 PHE QD H . . . 2 2 2 2 LYS HE3 H . . . . . 5.34 0.0 5.34 . . . . . B . 307 PHE QD . . B . 300 LYS HE3 . . . 307 . HD# . . . . . 300 . HE# . . c17360_2l7l 1 157 1 OR . 2 2 3 3 SER H H . . . 2 2 3 3 SER HB2 H . . . . . 3.42 0.0 3.42 . . . . . B . 301 SER H . . B . 301 SER HB2 . . . 301 . HN . . . . . 301 . HB# . . c17360_2l7l 1 157 2 OR . 2 2 3 3 SER H H . . . 2 2 3 3 SER HB3 H . . . . . 3.42 0.0 3.42 . . . . . B . 301 SER H . . B . 301 SER HB3 . . . 301 . HN . . . . . 301 . HB# . . c17360_2l7l 1 158 1 OR . 2 2 3 3 SER HA H . . . 2 2 6 6 LYS HB2 H . . . . . 3.89 0.0 3.89 . . . . . B . 301 SER HA . . B . 304 LYS HB2 . . . 301 . HA . . . . . 304 . HB# . . c17360_2l7l 1 158 2 OR . 2 2 3 3 SER HA H . . . 2 2 6 6 LYS HB3 H . . . . . 3.89 0.0 3.89 . . . . . B . 301 SER HA . . B . 304 LYS HB3 . . . 301 . HA . . . . . 304 . HB# . . c17360_2l7l 1 159 1 OR . 2 2 4 4 LYS H H . . . 2 2 3 3 SER HB2 H . . . . . 3.65 0.0 3.65 . . . . . B . 302 LYS H . . B . 301 SER HB2 . . . 302 . HN . . . . . 301 . HB# . . c17360_2l7l 1 159 2 OR . 2 2 4 4 LYS H H . . . 2 2 3 3 SER HB3 H . . . . . 3.65 0.0 3.65 . . . . . B . 302 LYS H . . B . 301 SER HB3 . . . 302 . HN . . . . . 301 . HB# . . c17360_2l7l 1 160 1 OR . 2 2 3 3 SER HB2 H . . . 2 2 4 4 LYS HD2 H . . . . . 4.67 0.0 4.67 . . . . . B . 301 SER HB2 . . B . 302 LYS HD2 . . . 301 . HB# . . . . . 302 . HD# . . c17360_2l7l 1 160 2 OR . 2 2 3 3 SER HB3 H . . . 2 2 4 4 LYS HD2 H . . . . . 4.67 0.0 4.67 . . . . . B . 301 SER HB3 . . B . 302 LYS HD2 . . . 301 . HB# . . . . . 302 . HD# . . c17360_2l7l 1 160 3 OR . 2 2 4 4 LYS HD3 H . . . 2 2 3 3 SER HB2 H . . . . . 4.67 0.0 4.67 . . . . . B . 302 LYS HD3 . . B . 301 SER HB2 . . . 302 . HD# . . . . . 301 . HB# . . c17360_2l7l 1 160 4 OR . 2 2 3 3 SER HB3 H . . . 2 2 4 4 LYS HD3 H . . . . . 4.67 0.0 4.67 . . . . . B . 301 SER HB3 . . B . 302 LYS HD3 . . . 301 . HB# . . . . . 302 . HD# . . c17360_2l7l 1 161 1 OR . 2 2 5 5 TRP H H . . . 2 2 3 3 SER HB2 H . . . . . 5.34 0.0 5.34 . . . . . B . 303 TRP H . . B . 301 SER HB2 . . . 303 . HN . . . . . 301 . HB# . . c17360_2l7l 1 161 2 OR . 2 2 5 5 TRP H H . . . 2 2 3 3 SER HB3 H . . . . . 5.34 0.0 5.34 . . . . . B . 303 TRP H . . B . 301 SER HB3 . . . 303 . HN . . . . . 301 . HB# . . c17360_2l7l 1 162 1 OR . 2 2 4 4 LYS H H . . . 2 2 4 4 LYS HB2 H . . . . . 3.45 0.0 3.45 . . . . . B . 302 LYS H . . B . 302 LYS HB2 . . . 302 . HN . . . . . 302 . HB# . . c17360_2l7l 1 162 2 OR . 2 2 4 4 LYS H H . . . 2 2 4 4 LYS HB3 H . . . . . 3.45 0.0 3.45 . . . . . B . 302 LYS H . . B . 302 LYS HB3 . . . 302 . HN . . . . . 302 . HB# . . c17360_2l7l 1 163 1 OR . 2 2 4 4 LYS H H . . . 2 2 4 4 LYS HG3 H . . . . . 3.94 0.0 3.94 . . . . . B . 302 LYS H . . B . 302 LYS HG3 . . . 302 . HN . . . . . 302 . HG# . . c17360_2l7l 1 163 2 OR . 2 2 4 4 LYS H H . . . 2 2 4 4 LYS HG2 H . . . . . 3.94 0.0 3.94 . . . . . B . 302 LYS H . . B . 302 LYS HG2 . . . 302 . HN . . . . . 302 . HG# . . c17360_2l7l 1 164 1 OR . 2 2 4 4 LYS H H . . . 2 2 4 4 LYS HD2 H . . . . . 4.03 0.0 4.03 . . . . . B . 302 LYS H . . B . 302 LYS HD2 . . . 302 . HN . . . . . 302 . HD# . . c17360_2l7l 1 164 2 OR . 2 2 4 4 LYS H H . . . 2 2 4 4 LYS HD3 H . . . . . 4.03 0.0 4.03 . . . . . B . 302 LYS H . . B . 302 LYS HD3 . . . 302 . HN . . . . . 302 . HD# . . c17360_2l7l 1 165 1 OR . 2 2 4 4 LYS HA H . . . 2 2 4 4 LYS HG3 H . . . . . 3.44 0.0 3.44 . . . . . B . 302 LYS HA . . B . 302 LYS HG3 . . . 302 . HA . . . . . 302 . HG# . . c17360_2l7l 1 165 2 OR . 2 2 4 4 LYS HA H . . . 2 2 4 4 LYS HG2 H . . . . . 3.44 0.0 3.44 . . . . . B . 302 LYS HA . . B . 302 LYS HG2 . . . 302 . HA . . . . . 302 . HG# . . c17360_2l7l 1 166 1 OR . 2 2 4 4 LYS HA H . . . 2 2 4 4 LYS HD2 H . . . . . 3.32 0.0 3.32 . . . . . B . 302 LYS HA . . B . 302 LYS HD2 . . . 302 . HA . . . . . 302 . HD# . . c17360_2l7l 1 166 2 OR . 2 2 4 4 LYS HA H . . . 2 2 4 4 LYS HD3 H . . . . . 3.32 0.0 3.32 . . . . . B . 302 LYS HA . . B . 302 LYS HD3 . . . 302 . HA . . . . . 302 . HD# . . c17360_2l7l 1 167 1 OR . 2 2 4 4 LYS HA H . . . 2 2 7 7 GLN HB2 H . . . . . 3.90 0.0 3.90 . . . . . B . 302 LYS HA . . B . 305 GLN HB2 . . . 302 . HA . . . . . 305 . HB# . . c17360_2l7l 1 167 2 OR . 2 2 4 4 LYS HA H . . . 2 2 7 7 GLN HB3 H . . . . . 3.90 0.0 3.90 . . . . . B . 302 LYS HA . . B . 305 GLN HB3 . . . 302 . HA . . . . . 305 . HB# . . c17360_2l7l 1 168 1 OR . 2 2 4 4 LYS HA H . . . 2 2 7 7 GLN HG2 H . . . . . 4.36 0.0 4.36 . . . . . B . 302 LYS HA . . B . 305 GLN HG2 . . . 302 . HA . . . . . 305 . HG# . . c17360_2l7l 1 168 2 OR . 2 2 4 4 LYS HA H . . . 2 2 7 7 GLN HG3 H . . . . . 4.36 0.0 4.36 . . . . . B . 302 LYS HA . . B . 305 GLN HG3 . . . 302 . HA . . . . . 305 . HG# . . c17360_2l7l 1 169 1 OR . 2 2 5 5 TRP H H . . . 2 2 4 4 LYS HB2 H . . . . . 4.08 0.0 4.08 . . . . . B . 303 TRP H . . B . 302 LYS HB2 . . . 303 . HN . . . . . 302 . HB# . . c17360_2l7l 1 169 2 OR . 2 2 5 5 TRP H H . . . 2 2 4 4 LYS HB3 H . . . . . 4.08 0.0 4.08 . . . . . B . 303 TRP H . . B . 302 LYS HB3 . . . 303 . HN . . . . . 302 . HB# . . c17360_2l7l 1 170 1 OR . 2 2 4 4 LYS HE2 H . . . 2 2 4 4 LYS HG3 H . . . . . 3.20 0.0 3.20 . . . . . B . 302 LYS HE2 . . B . 302 LYS HG3 . . . 302 . HE# . . . . . 302 . HG# . . c17360_2l7l 1 170 2 OR . 2 2 4 4 LYS HE3 H . . . 2 2 4 4 LYS HG3 H . . . . . 3.20 0.0 3.20 . . . . . B . 302 LYS HE3 . . B . 302 LYS HG3 . . . 302 . HE# . . . . . 302 . HG# . . c17360_2l7l 1 170 3 OR . 2 2 4 4 LYS HG2 H . . . 2 2 4 4 LYS HE2 H . . . . . 3.20 0.0 3.20 . . . . . B . 302 LYS HG2 . . B . 302 LYS HE2 . . . 302 . HG# . . . . . 302 . HE# . . c17360_2l7l 1 170 4 OR . 2 2 4 4 LYS HG2 H . . . 2 2 4 4 LYS HE3 H . . . . . 3.20 0.0 3.20 . . . . . B . 302 LYS HG2 . . B . 302 LYS HE3 . . . 302 . HG# . . . . . 302 . HE# . . c17360_2l7l 1 171 1 OR . 2 2 5 5 TRP H H . . . 2 2 4 4 LYS HG3 H . . . . . 5.34 0.0 5.34 . . . . . B . 303 TRP H . . B . 302 LYS HG3 . . . 303 . HN . . . . . 302 . HG# . . c17360_2l7l 1 171 2 OR . 2 2 5 5 TRP H H . . . 2 2 4 4 LYS HG2 H . . . . . 5.34 0.0 5.34 . . . . . B . 303 TRP H . . B . 302 LYS HG2 . . . 303 . HN . . . . . 302 . HG# . . c17360_2l7l 1 172 1 OR . 2 2 5 5 TRP H H . . . 2 2 4 4 LYS HD2 H . . . . . 5.34 0.0 5.34 . . . . . B . 303 TRP H . . B . 302 LYS HD2 . . . 303 . HN . . . . . 302 . HD# . . c17360_2l7l 1 172 2 OR . 2 2 5 5 TRP H H . . . 2 2 4 4 LYS HD3 H . . . . . 5.34 0.0 5.34 . . . . . B . 303 TRP H . . B . 302 LYS HD3 . . . 303 . HN . . . . . 302 . HD# . . c17360_2l7l 1 173 1 OR . 2 2 6 6 LYS H H . . . 2 2 6 6 LYS HB2 H . . . . . 3.34 0.0 3.34 . . . . . B . 304 LYS H . . B . 304 LYS HB2 . . . 304 . HN . . . . . 304 . HB# . . c17360_2l7l 1 173 2 OR . 2 2 6 6 LYS H H . . . 2 2 6 6 LYS HB3 H . . . . . 3.34 0.0 3.34 . . . . . B . 304 LYS H . . B . 304 LYS HB3 . . . 304 . HN . . . . . 304 . HB# . . c17360_2l7l 1 174 1 OR . 2 2 6 6 LYS H H . . . 2 2 6 6 LYS HG2 H . . . . . 5.31 0.0 5.31 . . . . . B . 304 LYS H . . B . 304 LYS HG2 . . . 304 . HN . . . . . 304 . HG# . . c17360_2l7l 1 174 2 OR . 2 2 6 6 LYS H H . . . 2 2 6 6 LYS HG3 H . . . . . 5.31 0.0 5.31 . . . . . B . 304 LYS H . . B . 304 LYS HG3 . . . 304 . HN . . . . . 304 . HG# . . c17360_2l7l 1 175 1 OR . 2 2 6 6 LYS H H . . . 2 2 6 6 LYS HD2 H . . . . . 4.71 0.0 4.71 . . . . . B . 304 LYS H . . B . 304 LYS HD2 . . . 304 . HN . . . . . 304 . HD# . . c17360_2l7l 1 175 2 OR . 2 2 6 6 LYS H H . . . 2 2 6 6 LYS HD3 H . . . . . 4.71 0.0 4.71 . . . . . B . 304 LYS H . . B . 304 LYS HD3 . . . 304 . HN . . . . . 304 . HD# . . c17360_2l7l 1 176 1 OR . 2 2 6 6 LYS HA H . . . 2 2 6 6 LYS HG2 H . . . . . 3.63 0.0 3.63 . . . . . B . 304 LYS HA . . B . 304 LYS HG2 . . . 304 . HA . . . . . 304 . HG# . . c17360_2l7l 1 176 2 OR . 2 2 6 6 LYS HA H . . . 2 2 6 6 LYS HG3 H . . . . . 3.63 0.0 3.63 . . . . . B . 304 LYS HA . . B . 304 LYS HG3 . . . 304 . HA . . . . . 304 . HG# . . c17360_2l7l 1 177 1 OR . 2 2 7 7 GLN H H . . . 2 2 6 6 LYS HB2 H . . . . . 3.93 0.0 3.93 . . . . . B . 305 GLN H . . B . 304 LYS HB2 . . . 305 . HN . . . . . 304 . HB# . . c17360_2l7l 1 177 2 OR . 2 2 7 7 GLN H H . . . 2 2 6 6 LYS HB3 H . . . . . 3.93 0.0 3.93 . . . . . B . 305 GLN H . . B . 304 LYS HB3 . . . 305 . HN . . . . . 304 . HB# . . c17360_2l7l 1 178 1 OR . 2 2 9 9 PHE QD H . . . 2 2 6 6 LYS HB2 H . . . . . 5.34 0.0 5.34 . . . . . B . 307 PHE QD . . B . 304 LYS HB2 . . . 307 . HD# . . . . . 304 . HB# . . c17360_2l7l 1 178 2 OR . 2 2 9 9 PHE QD H . . . 2 2 6 6 LYS HB3 H . . . . . 5.34 0.0 5.34 . . . . . B . 307 PHE QD . . B . 304 LYS HB3 . . . 307 . HD# . . . . . 304 . HB# . . c17360_2l7l 1 179 1 OR . 2 2 7 7 GLN H H . . . 2 2 7 7 GLN HB2 H . . . . . 3.32 0.0 3.32 . . . . . B . 305 GLN H . . B . 305 GLN HB2 . . . 305 . HN . . . . . 305 . HB# . . c17360_2l7l 1 179 2 OR . 2 2 7 7 GLN H H . . . 2 2 7 7 GLN HB3 H . . . . . 3.32 0.0 3.32 . . . . . B . 305 GLN H . . B . 305 GLN HB3 . . . 305 . HN . . . . . 305 . HB# . . c17360_2l7l 1 180 1 OR . 2 2 7 7 GLN H H . . . 2 2 7 7 GLN HG2 H . . . . . 4.49 0.0 4.49 . . . . . B . 305 GLN H . . B . 305 GLN HG2 . . . 305 . HN . . . . . 305 . HG# . . c17360_2l7l 1 180 2 OR . 2 2 7 7 GLN H H . . . 2 2 7 7 GLN HG3 H . . . . . 4.49 0.0 4.49 . . . . . B . 305 GLN H . . B . 305 GLN HG3 . . . 305 . HN . . . . . 305 . HG# . . c17360_2l7l 1 181 1 OR . 2 2 7 7 GLN HA H . . . 2 2 7 7 GLN HG2 H . . . . . 3.55 0.0 3.55 . . . . . B . 305 GLN HA . . B . 305 GLN HG2 . . . 305 . HA . . . . . 305 . HG# . . c17360_2l7l 1 181 2 OR . 2 2 7 7 GLN HA H . . . 2 2 7 7 GLN HG3 H . . . . . 3.55 0.0 3.55 . . . . . B . 305 GLN HA . . B . 305 GLN HG3 . . . 305 . HA . . . . . 305 . HG# . . c17360_2l7l 1 182 1 OR . 2 2 7 7 GLN HA H . . . 2 2 10 10 ASN HD21 H . . . . . 4.75 0.0 4.75 . . . . . B . 305 GLN HA . . B . 308 ASN HD21 . . . 305 . HA . . . . . 308 . HD2# . . c17360_2l7l 1 182 2 OR . 2 2 7 7 GLN HA H . . . 2 2 10 10 ASN HD22 H . . . . . 4.75 0.0 4.75 . . . . . B . 305 GLN HA . . B . 308 ASN HD22 . . . 305 . HA . . . . . 308 . HD2# . . c17360_2l7l 1 183 1 OR . 2 2 8 8 ALA H H . . . 2 2 7 7 GLN HB2 H . . . . . 3.50 0.0 3.50 . . . . . B . 306 ALA H . . B . 305 GLN HB2 . . . 306 . HN . . . . . 305 . HB# . . c17360_2l7l 1 183 2 OR . 2 2 8 8 ALA H H . . . 2 2 7 7 GLN HB3 H . . . . . 3.50 0.0 3.50 . . . . . B . 306 ALA H . . B . 305 GLN HB3 . . . 306 . HN . . . . . 305 . HB# . . c17360_2l7l 1 184 1 OR . 2 2 7 7 GLN HE22 H . . . 2 2 7 7 GLN HG2 H . . . . . 3.19 0.0 3.19 . . . . . B . 305 GLN HE22 . . B . 305 GLN HG2 . . . 305 . HE2# . . . . . 305 . HG# . . c17360_2l7l 1 184 2 OR . 2 2 7 7 GLN HE21 H . . . 2 2 7 7 GLN HG2 H . . . . . 3.19 0.0 3.19 . . . . . B . 305 GLN HE21 . . B . 305 GLN HG2 . . . 305 . HE2# . . . . . 305 . HG# . . c17360_2l7l 1 184 3 OR . 2 2 7 7 GLN HG3 H . . . 2 2 7 7 GLN HE22 H . . . . . 3.19 0.0 3.19 . . . . . B . 305 GLN HG3 . . B . 305 GLN HE22 . . . 305 . HG# . . . . . 305 . HE2# . . c17360_2l7l 1 184 4 OR . 2 2 7 7 GLN HG3 H . . . 2 2 7 7 GLN HE21 H . . . . . 3.19 0.0 3.19 . . . . . B . 305 GLN HG3 . . B . 305 GLN HE21 . . . 305 . HG# . . . . . 305 . HE2# . . c17360_2l7l 1 185 1 OR . 2 2 8 8 ALA H H . . . 2 2 7 7 GLN HG2 H . . . . . 4.61 0.0 4.61 . . . . . B . 306 ALA H . . B . 305 GLN HG2 . . . 306 . HN . . . . . 305 . HG# . . c17360_2l7l 1 185 2 OR . 2 2 8 8 ALA H H . . . 2 2 7 7 GLN HG3 H . . . . . 4.61 0.0 4.61 . . . . . B . 306 ALA H . . B . 305 GLN HG3 . . . 306 . HN . . . . . 305 . HG# . . c17360_2l7l 1 186 1 OR . 2 2 8 8 ALA H H . . . 2 2 9 9 PHE HB2 H . . . . . 5.34 0.0 5.34 . . . . . B . 306 ALA H . . B . 307 PHE HB2 . . . 306 . HN . . . . . 307 . HB# . . c17360_2l7l 1 186 2 OR . 2 2 8 8 ALA H H . . . 2 2 9 9 PHE HB3 H . . . . . 5.34 0.0 5.34 . . . . . B . 306 ALA H . . B . 307 PHE HB3 . . . 306 . HN . . . . . 307 . HB# . . c17360_2l7l 1 187 1 OR . 2 2 9 9 PHE H H . . . 2 2 9 9 PHE HB2 H . . . . . 3.19 0.0 3.19 . . . . . B . 307 PHE H . . B . 307 PHE HB2 . . . 307 . HN . . . . . 307 . HB# . . c17360_2l7l 1 187 2 OR . 2 2 9 9 PHE H H . . . 2 2 9 9 PHE HB3 H . . . . . 3.19 0.0 3.19 . . . . . B . 307 PHE H . . B . 307 PHE HB3 . . . 307 . HN . . . . . 307 . HB# . . c17360_2l7l 1 188 1 OR . 2 2 9 9 PHE HZ H . . . 2 2 9 9 PHE HB2 H . . . . . 5.02 0.0 5.02 . . . . . B . 307 PHE HZ . . B . 307 PHE HB2 . . . 307 . HZ . . . . . 307 . HB# . . c17360_2l7l 1 188 2 OR . 2 2 9 9 PHE HZ H . . . 2 2 9 9 PHE HB3 H . . . . . 5.02 0.0 5.02 . . . . . B . 307 PHE HZ . . B . 307 PHE HB3 . . . 307 . HZ . . . . . 307 . HB# . . c17360_2l7l 1 189 1 OR . 2 2 10 10 ASN H H . . . 2 2 9 9 PHE HB2 H . . . . . 3.66 0.0 3.66 . . . . . B . 308 ASN H . . B . 307 PHE HB2 . . . 308 . HN . . . . . 307 . HB# . . c17360_2l7l 1 189 2 OR . 2 2 10 10 ASN H H . . . 2 2 9 9 PHE HB3 H . . . . . 3.66 0.0 3.66 . . . . . B . 308 ASN H . . B . 307 PHE HB3 . . . 308 . HN . . . . . 307 . HB# . . c17360_2l7l 1 190 1 OR . 2 2 9 9 PHE QD H . . . 2 2 10 10 ASN HB2 H . . . . . 5.34 0.0 5.34 . . . . . B . 307 PHE QD . . B . 308 ASN HB2 . . . 307 . HD# . . . . . 308 . HB# . . c17360_2l7l 1 190 2 OR . 2 2 9 9 PHE QD H . . . 2 2 10 10 ASN HB3 H . . . . . 5.34 0.0 5.34 . . . . . B . 307 PHE QD . . B . 308 ASN HB3 . . . 307 . HD# . . . . . 308 . HB# . . c17360_2l7l 1 191 1 OR . 2 2 10 10 ASN H H . . . 2 2 10 10 ASN HB2 H . . . . . 3.60 0.0 3.60 . . . . . B . 308 ASN H . . B . 308 ASN HB2 . . . 308 . HN . . . . . 308 . HB# . . c17360_2l7l 1 191 2 OR . 2 2 10 10 ASN H H . . . 2 2 10 10 ASN HB3 H . . . . . 3.60 0.0 3.60 . . . . . B . 308 ASN H . . B . 308 ASN HB3 . . . 308 . HN . . . . . 308 . HB# . . c17360_2l7l 1 192 1 OR . 2 2 10 10 ASN H H . . . 2 2 10 10 ASN HD21 H . . . . . 5.34 0.0 5.34 . . . . . B . 308 ASN H . . B . 308 ASN HD21 . . . 308 . HN . . . . . 308 . HD2# . . c17360_2l7l 1 192 2 OR . 2 2 10 10 ASN H H . . . 2 2 10 10 ASN HD22 H . . . . . 5.34 0.0 5.34 . . . . . B . 308 ASN H . . B . 308 ASN HD22 . . . 308 . HN . . . . . 308 . HD2# . . c17360_2l7l 1 193 1 OR . 2 2 10 10 ASN HA H . . . 2 2 14 14 VAL MG1 H . . . . . 5.40 0.0 5.40 . . . . . B . 308 ASN HA . . B . 312 VAL MG1 . . . 308 . HA . . . . . 312 . HG## . . c17360_2l7l 1 193 2 OR . 2 2 10 10 ASN HA H . . . 2 2 14 14 VAL MG2 H . . . . . 5.40 0.0 5.40 . . . . . B . 308 ASN HA . . B . 312 VAL MG2 . . . 308 . HA . . . . . 312 . HG## . . c17360_2l7l 1 194 1 OR . 2 2 11 11 ALA H H . . . 2 2 10 10 ASN HB2 H . . . . . 4.39 0.0 4.39 . . . . . B . 309 ALA H . . B . 308 ASN HB2 . . . 309 . HN . . . . . 308 . HB# . . c17360_2l7l 1 194 2 OR . 2 2 11 11 ALA H H . . . 2 2 10 10 ASN HB3 H . . . . . 4.39 0.0 4.39 . . . . . B . 309 ALA H . . B . 308 ASN HB3 . . . 309 . HN . . . . . 308 . HB# . . c17360_2l7l 1 195 1 OR . 2 2 11 11 ALA HA H . . . 2 2 10 10 ASN HB2 H . . . . . 4.80 0.0 4.80 . . . . . B . 309 ALA HA . . B . 308 ASN HB2 . . . 309 . HA . . . . . 308 . HB# . . c17360_2l7l 1 195 2 OR . 2 2 11 11 ALA HA H . . . 2 2 10 10 ASN HB3 H . . . . . 4.80 0.0 4.80 . . . . . B . 309 ALA HA . . B . 308 ASN HB3 . . . 309 . HA . . . . . 308 . HB# . . c17360_2l7l 1 196 1 OR . 2 2 10 10 ASN HD22 H . . . 2 2 14 14 VAL MG1 H . . . . . 5.27 0.0 5.27 . . . . . B . 308 ASN HD22 . . B . 312 VAL MG1 . . . 308 . HD2# . . . . . 312 . HG## . . c17360_2l7l 1 196 2 OR . 2 2 10 10 ASN HD21 H . . . 2 2 14 14 VAL MG1 H . . . . . 5.27 0.0 5.27 . . . . . B . 308 ASN HD21 . . B . 312 VAL MG1 . . . 308 . HD2# . . . . . 312 . HG## . . c17360_2l7l 1 196 3 OR . 2 2 14 14 VAL MG2 H . . . 2 2 10 10 ASN HD21 H . . . . . 5.27 0.0 5.27 . . . . . B . 312 VAL MG2 . . B . 308 ASN HD21 . . . 312 . HG## . . . . . 308 . HD2# . . c17360_2l7l 1 196 4 OR . 2 2 10 10 ASN HD22 H . . . 2 2 14 14 VAL MG2 H . . . . . 5.27 0.0 5.27 . . . . . B . 308 ASN HD22 . . B . 312 VAL MG2 . . . 308 . HD2# . . . . . 312 . HG## . . c17360_2l7l 1 197 1 OR . 2 2 11 11 ALA H H . . . 2 2 14 14 VAL MG1 H . . . . . 5.44 0.0 5.44 . . . . . B . 309 ALA H . . B . 312 VAL MG1 . . . 309 . HN . . . . . 312 . HG## . . c17360_2l7l 1 197 2 OR . 2 2 11 11 ALA H H . . . 2 2 14 14 VAL MG2 H . . . . . 5.44 0.0 5.44 . . . . . B . 309 ALA H . . B . 312 VAL MG2 . . . 309 . HN . . . . . 312 . HG## . . c17360_2l7l 1 198 1 OR . 2 2 11 11 ALA HA H . . . 2 2 14 14 VAL MG1 H . . . . . 4.00 0.0 4.00 . . . . . B . 309 ALA HA . . B . 312 VAL MG1 . . . 309 . HA . . . . . 312 . HG## . . c17360_2l7l 1 198 2 OR . 2 2 11 11 ALA HA H . . . 2 2 14 14 VAL MG2 H . . . . . 4.00 0.0 4.00 . . . . . B . 309 ALA HA . . B . 312 VAL MG2 . . . 309 . HA . . . . . 312 . HG## . . c17360_2l7l 1 199 1 OR . 2 2 13 13 ALA H H . . . 2 2 14 14 VAL MG1 H . . . . . 5.26 0.0 5.26 . . . . . B . 311 ALA H . . B . 312 VAL MG1 . . . 311 . HN . . . . . 312 . HG## . . c17360_2l7l 1 199 2 OR . 2 2 13 13 ALA H H . . . 2 2 14 14 VAL MG2 H . . . . . 5.26 0.0 5.26 . . . . . B . 311 ALA H . . B . 312 VAL MG2 . . . 311 . HN . . . . . 312 . HG## . . c17360_2l7l 1 200 1 OR . 2 2 14 14 VAL H H . . . 2 2 14 14 VAL MG1 H . . . . . 3.24 0.0 3.24 . . . . . B . 312 VAL H . . B . 312 VAL MG1 . . . 312 . HN . . . . . 312 . HG## . . c17360_2l7l 1 200 2 OR . 2 2 14 14 VAL H H . . . 2 2 14 14 VAL MG2 H . . . . . 3.24 0.0 3.24 . . . . . B . 312 VAL H . . B . 312 VAL MG2 . . . 312 . HN . . . . . 312 . HG## . . c17360_2l7l 1 201 1 OR . 2 2 15 15 VAL H H . . . 2 2 14 14 VAL MG1 H . . . . . 3.88 0.0 3.88 . . . . . B . 313 VAL H . . B . 312 VAL MG1 . . . 313 . HN . . . . . 312 . HG## . . c17360_2l7l 1 201 2 OR . 2 2 15 15 VAL H H . . . 2 2 14 14 VAL MG2 H . . . . . 3.88 0.0 3.88 . . . . . B . 313 VAL H . . B . 312 VAL MG2 . . . 313 . HN . . . . . 312 . HG## . . c17360_2l7l 1 202 1 OR . 2 2 15 15 VAL MG2 H . . . 2 2 14 14 VAL MG1 H . . . . . 3.81 0.0 3.81 . . . . . B . 313 VAL MG2 . . B . 312 VAL MG1 . . . 313 . HG2# . . . . . 312 . HG## . . c17360_2l7l 1 202 2 OR . 2 2 15 15 VAL MG2 H . . . 2 2 14 14 VAL MG2 H . . . . . 3.81 0.0 3.81 . . . . . B . 313 VAL MG2 . . B . 312 VAL MG2 . . . 313 . HG2# . . . . . 312 . HG## . . c17360_2l7l 1 203 1 OR . 2 2 17 17 HIS H H . . . 2 2 14 14 VAL MG1 H . . . . . 5.44 0.0 5.44 . . . . . B . 315 HIS H . . B . 312 VAL MG1 . . . 315 . HN . . . . . 312 . HG## . . c17360_2l7l 1 203 2 OR . 2 2 17 17 HIS H H . . . 2 2 14 14 VAL MG2 H . . . . . 5.44 0.0 5.44 . . . . . B . 315 HIS H . . B . 312 VAL MG2 . . . 315 . HN . . . . . 312 . HG## . . c17360_2l7l 1 204 1 OR . 2 2 17 17 HIS HD2 H . . . 2 2 14 14 VAL MG1 H . . . . . 4.11 0.0 4.11 . . . . . B . 315 HIS HD2 . . B . 312 VAL MG1 . . . 315 . HD2 . . . . . 312 . HG## . . c17360_2l7l 1 204 2 OR . 2 2 17 17 HIS HD2 H . . . 2 2 14 14 VAL MG2 H . . . . . 4.11 0.0 4.11 . . . . . B . 315 HIS HD2 . . B . 312 VAL MG2 . . . 315 . HD2 . . . . . 312 . HG## . . c17360_2l7l 1 205 1 OR . 2 2 18 18 MET H H . . . 2 2 14 14 VAL MG1 H . . . . . 5.44 0.0 5.44 . . . . . B . 316 MET H . . B . 312 VAL MG1 . . . 316 . HN . . . . . 312 . HG## . . c17360_2l7l 1 205 2 OR . 2 2 18 18 MET H H . . . 2 2 14 14 VAL MG2 H . . . . . 5.44 0.0 5.44 . . . . . B . 316 MET H . . B . 312 VAL MG2 . . . 316 . HN . . . . . 312 . HG## . . c17360_2l7l 1 206 1 OR . 2 2 16 16 ARG H H . . . 2 2 16 16 ARG HB2 H . . . . . 3.29 0.0 3.29 . . . . . B . 314 ARG H . . B . 314 ARG HB2 . . . 314 . HN . . . . . 314 . HB# . . c17360_2l7l 1 206 2 OR . 2 2 16 16 ARG H H . . . 2 2 16 16 ARG HB3 H . . . . . 3.29 0.0 3.29 . . . . . B . 314 ARG H . . B . 314 ARG HB3 . . . 314 . HN . . . . . 314 . HB# . . c17360_2l7l 1 207 1 OR . 2 2 16 16 ARG H H . . . 2 2 16 16 ARG HG2 H . . . . . 4.63 0.0 4.63 . . . . . B . 314 ARG H . . B . 314 ARG HG2 . . . 314 . HN . . . . . 314 . HG# . . c17360_2l7l 1 207 2 OR . 2 2 16 16 ARG H H . . . 2 2 16 16 ARG HG3 H . . . . . 4.63 0.0 4.63 . . . . . B . 314 ARG H . . B . 314 ARG HG3 . . . 314 . HN . . . . . 314 . HG# . . c17360_2l7l 1 208 1 OR . 2 2 16 16 ARG HA H . . . 2 2 16 16 ARG HG2 H . . . . . 3.45 0.0 3.45 . . . . . B . 314 ARG HA . . B . 314 ARG HG2 . . . 314 . HA . . . . . 314 . HG# . . c17360_2l7l 1 208 2 OR . 2 2 16 16 ARG HA H . . . 2 2 16 16 ARG HG3 H . . . . . 3.45 0.0 3.45 . . . . . B . 314 ARG HA . . B . 314 ARG HG3 . . . 314 . HA . . . . . 314 . HG# . . c17360_2l7l 1 209 1 OR . 2 2 16 16 ARG HA H . . . 2 2 19 19 ARG HB2 H . . . . . 4.36 0.0 4.36 . . . . . B . 314 ARG HA . . B . 317 ARG HB2 . . . 314 . HA . . . . . 317 . HB# . . c17360_2l7l 1 209 2 OR . 2 2 16 16 ARG HA H . . . 2 2 19 19 ARG HB3 H . . . . . 4.36 0.0 4.36 . . . . . B . 314 ARG HA . . B . 317 ARG HB3 . . . 314 . HA . . . . . 317 . HB# . . c17360_2l7l 1 210 1 OR . 2 2 17 17 HIS H H . . . 2 2 16 16 ARG HB2 H . . . . . 3.77 0.0 3.77 . . . . . B . 315 HIS H . . B . 314 ARG HB2 . . . 315 . HN . . . . . 314 . HB# . . c17360_2l7l 1 210 2 OR . 2 2 17 17 HIS H H . . . 2 2 16 16 ARG HB3 H . . . . . 3.77 0.0 3.77 . . . . . B . 315 HIS H . . B . 314 ARG HB3 . . . 315 . HN . . . . . 314 . HB# . . c17360_2l7l 1 211 1 OR . 2 2 16 16 ARG HD3 H . . . 2 2 16 16 ARG HG2 H . . . . . 2.35 0.0 2.35 . . . . . B . 314 ARG HD3 . . B . 314 ARG HG2 . . . 314 . HD# . . . . . 314 . HG# . . c17360_2l7l 1 211 2 OR . 2 2 16 16 ARG HD2 H . . . 2 2 16 16 ARG HG2 H . . . . . 2.35 0.0 2.35 . . . . . B . 314 ARG HD2 . . B . 314 ARG HG2 . . . 314 . HD# . . . . . 314 . HG# . . c17360_2l7l 1 211 3 OR . 2 2 16 16 ARG HG3 H . . . 2 2 16 16 ARG HD2 H . . . . . 2.35 0.0 2.35 . . . . . B . 314 ARG HG3 . . B . 314 ARG HD2 . . . 314 . HG# . . . . . 314 . HD# . . c17360_2l7l 1 211 4 OR . 2 2 16 16 ARG HG3 H . . . 2 2 16 16 ARG HD3 H . . . . . 2.35 0.0 2.35 . . . . . B . 314 ARG HG3 . . B . 314 ARG HD3 . . . 314 . HG# . . . . . 314 . HD# . . c17360_2l7l 1 212 1 OR . 2 2 17 17 HIS H H . . . 2 2 17 17 HIS HB2 H . . . . . 3.31 0.0 3.31 . . . . . B . 315 HIS H . . B . 315 HIS HB2 . . . 315 . HN . . . . . 315 . HB# . . c17360_2l7l 1 212 2 OR . 2 2 17 17 HIS H H . . . 2 2 17 17 HIS HB3 H . . . . . 3.31 0.0 3.31 . . . . . B . 315 HIS H . . B . 315 HIS HB3 . . . 315 . HN . . . . . 315 . HB# . . c17360_2l7l 1 213 1 OR . 2 2 17 17 HIS HD2 H . . . 2 2 17 17 HIS HB2 H . . . . . 3.37 0.0 3.37 . . . . . B . 315 HIS HD2 . . B . 315 HIS HB2 . . . 315 . HD2 . . . . . 315 . HB# . . c17360_2l7l 1 213 2 OR . 2 2 17 17 HIS HD2 H . . . 2 2 17 17 HIS HB3 H . . . . . 3.37 0.0 3.37 . . . . . B . 315 HIS HD2 . . B . 315 HIS HB3 . . . 315 . HD2 . . . . . 315 . HB# . . c17360_2l7l 1 214 1 OR . 2 2 18 18 MET H H . . . 2 2 17 17 HIS HB2 H . . . . . 4.20 0.0 4.20 . . . . . B . 316 MET H . . B . 315 HIS HB2 . . . 316 . HN . . . . . 315 . HB# . . c17360_2l7l 1 214 2 OR . 2 2 18 18 MET H H . . . 2 2 17 17 HIS HB3 H . . . . . 4.20 0.0 4.20 . . . . . B . 316 MET H . . B . 315 HIS HB3 . . . 316 . HN . . . . . 315 . HB# . . c17360_2l7l 1 215 1 OR . 2 2 17 17 HIS HD2 H . . . 2 2 18 18 MET HG3 H . . . . . 4.24 0.0 4.24 . . . . . B . 315 HIS HD2 . . B . 316 MET HG3 . . . 315 . HD2 . . . . . 316 . HG# . . c17360_2l7l 1 215 2 OR . 2 2 17 17 HIS HD2 H . . . 2 2 18 18 MET HG2 H . . . . . 4.24 0.0 4.24 . . . . . B . 315 HIS HD2 . . B . 316 MET HG2 . . . 315 . HD2 . . . . . 316 . HG# . . c17360_2l7l 1 216 1 OR . 2 2 17 17 HIS HD2 H . . . 2 2 21 21 LEU MD1 H . . . . . 3.88 0.0 3.88 . . . . . B . 315 HIS HD2 . . B . 319 LEU MD1 . . . 315 . HD2 . . . . . 319 . HD## . . c17360_2l7l 1 216 2 OR . 2 2 17 17 HIS HD2 H . . . 2 2 21 21 LEU MD2 H . . . . . 3.88 0.0 3.88 . . . . . B . 315 HIS HD2 . . B . 319 LEU MD2 . . . 315 . HD2 . . . . . 319 . HD## . . c17360_2l7l 1 217 1 OR . 2 2 18 18 MET H H . . . 2 2 18 18 MET HB2 H . . . . . 3.48 0.0 3.48 . . . . . B . 316 MET H . . B . 316 MET HB2 . . . 316 . HN . . . . . 316 . HB# . . c17360_2l7l 1 217 2 OR . 2 2 18 18 MET H H . . . 2 2 18 18 MET HB3 H . . . . . 3.48 0.0 3.48 . . . . . B . 316 MET H . . B . 316 MET HB3 . . . 316 . HN . . . . . 316 . HB# . . c17360_2l7l 1 218 1 OR . 2 2 18 18 MET H H . . . 2 2 18 18 MET HG3 H . . . . . 3.58 0.0 3.58 . . . . . B . 316 MET H . . B . 316 MET HG3 . . . 316 . HN . . . . . 316 . HG# . . c17360_2l7l 1 218 2 OR . 2 2 18 18 MET H H . . . 2 2 18 18 MET HG2 H . . . . . 3.58 0.0 3.58 . . . . . B . 316 MET H . . B . 316 MET HG2 . . . 316 . HN . . . . . 316 . HG# . . c17360_2l7l 1 219 1 OR . 2 2 18 18 MET H H . . . 2 2 19 19 ARG HG3 H . . . . . 5.34 0.0 5.34 . . . . . B . 316 MET H . . B . 317 ARG HG3 . . . 316 . HN . . . . . 317 . HG# . . c17360_2l7l 1 219 2 OR . 2 2 18 18 MET H H . . . 2 2 19 19 ARG HG2 H . . . . . 5.34 0.0 5.34 . . . . . B . 316 MET H . . B . 317 ARG HG2 . . . 316 . HN . . . . . 317 . HG# . . c17360_2l7l 1 220 1 OR . 2 2 19 19 ARG H H . . . 2 2 19 19 ARG HB2 H . . . . . 2.97 0.0 2.97 . . . . . B . 317 ARG H . . B . 317 ARG HB2 . . . 317 . HN . . . . . 317 . HB# . . c17360_2l7l 1 220 2 OR . 2 2 19 19 ARG H H . . . 2 2 19 19 ARG HB3 H . . . . . 2.97 0.0 2.97 . . . . . B . 317 ARG H . . B . 317 ARG HB3 . . . 317 . HN . . . . . 317 . HB# . . c17360_2l7l 1 221 1 OR . 2 2 19 19 ARG H H . . . 2 2 19 19 ARG HG3 H . . . . . 3.48 0.0 3.48 . . . . . B . 317 ARG H . . B . 317 ARG HG3 . . . 317 . HN . . . . . 317 . HG# . . c17360_2l7l 1 221 2 OR . 2 2 19 19 ARG H H . . . 2 2 19 19 ARG HG2 H . . . . . 3.48 0.0 3.48 . . . . . B . 317 ARG H . . B . 317 ARG HG2 . . . 317 . HN . . . . . 317 . HG# . . c17360_2l7l 1 222 1 OR . 2 2 19 19 ARG H H . . . 2 2 19 19 ARG HD2 H . . . . . 5.34 0.0 5.34 . . . . . B . 317 ARG H . . B . 317 ARG HD2 . . . 317 . HN . . . . . 317 . HD# . . c17360_2l7l 1 222 2 OR . 2 2 19 19 ARG H H . . . 2 2 19 19 ARG HD3 H . . . . . 5.34 0.0 5.34 . . . . . B . 317 ARG H . . B . 317 ARG HD3 . . . 317 . HN . . . . . 317 . HD# . . c17360_2l7l 1 223 1 OR . 2 2 19 19 ARG HA H . . . 2 2 22 22 GLN HG2 H . . . . . 4.89 0.0 4.89 . . . . . B . 317 ARG HA . . B . 320 GLN HG2 . . . 317 . HA . . . . . 320 . HG# . . c17360_2l7l 1 223 2 OR . 2 2 19 19 ARG HA H . . . 2 2 22 22 GLN HG3 H . . . . . 4.89 0.0 4.89 . . . . . B . 317 ARG HA . . B . 320 GLN HG3 . . . 317 . HA . . . . . 320 . HG# . . c17360_2l7l 1 224 1 OR . 2 2 19 19 ARG HB2 H . . . 2 2 19 19 ARG HD2 H . . . . . 3.34 0.0 3.34 . . . . . B . 317 ARG HB2 . . B . 317 ARG HD2 . . . 317 . HB# . . . . . 317 . HD# . . c17360_2l7l 1 224 2 OR . 2 2 19 19 ARG HB3 H . . . 2 2 19 19 ARG HD2 H . . . . . 3.34 0.0 3.34 . . . . . B . 317 ARG HB3 . . B . 317 ARG HD2 . . . 317 . HB# . . . . . 317 . HD# . . c17360_2l7l 1 224 3 OR . 2 2 19 19 ARG HD3 H . . . 2 2 19 19 ARG HB2 H . . . . . 3.34 0.0 3.34 . . . . . B . 317 ARG HD3 . . B . 317 ARG HB2 . . . 317 . HD# . . . . . 317 . HB# . . c17360_2l7l 1 224 4 OR . 2 2 19 19 ARG HB3 H . . . 2 2 19 19 ARG HD3 H . . . . . 3.34 0.0 3.34 . . . . . B . 317 ARG HB3 . . B . 317 ARG HD3 . . . 317 . HB# . . . . . 317 . HD# . . c17360_2l7l 1 225 1 OR . 2 2 20 20 LYS H H . . . 2 2 20 20 LYS HB2 H . . . . . 3.02 0.0 3.02 . . . . . B . 318 LYS H . . B . 318 LYS HB2 . . . 318 . HN . . . . . 318 . HB# . . c17360_2l7l 1 225 2 OR . 2 2 20 20 LYS H H . . . 2 2 20 20 LYS HB3 H . . . . . 3.02 0.0 3.02 . . . . . B . 318 LYS H . . B . 318 LYS HB3 . . . 318 . HN . . . . . 318 . HB# . . c17360_2l7l 1 226 1 OR . 2 2 20 20 LYS H H . . . 2 2 20 20 LYS HG2 H . . . . . 4.89 0.0 4.89 . . . . . B . 318 LYS H . . B . 318 LYS HG2 . . . 318 . HN . . . . . 318 . HG# . . c17360_2l7l 1 226 2 OR . 2 2 20 20 LYS H H . . . 2 2 20 20 LYS HG3 H . . . . . 4.89 0.0 4.89 . . . . . B . 318 LYS H . . B . 318 LYS HG3 . . . 318 . HN . . . . . 318 . HG# . . c17360_2l7l 1 227 1 OR . 2 2 20 20 LYS HA H . . . 2 2 20 20 LYS HG2 H . . . . . 3.24 0.0 3.24 . . . . . B . 318 LYS HA . . B . 318 LYS HG2 . . . 318 . HA . . . . . 318 . HG# . . c17360_2l7l 1 227 2 OR . 2 2 20 20 LYS HG3 H . . . 2 2 20 20 LYS HA H . . . . . 3.24 0.0 3.24 . . . . . B . 318 LYS HG3 . . B . 318 LYS HA . . . 318 . HG# . . . . . 318 . HA . . c17360_2l7l 1 228 1 OR . 2 2 20 20 LYS HA H . . . 2 2 20 20 LYS HD2 H . . . . . 3.51 0.0 3.51 . . . . . B . 318 LYS HA . . B . 318 LYS HD2 . . . 318 . HA . . . . . 318 . HD# . . c17360_2l7l 1 228 2 OR . 2 2 20 20 LYS HA H . . . 2 2 20 20 LYS HD3 H . . . . . 3.51 0.0 3.51 . . . . . B . 318 LYS HA . . B . 318 LYS HD3 . . . 318 . HA . . . . . 318 . HD# . . c17360_2l7l 1 229 1 OR . 2 2 20 20 LYS HB3 H . . . 2 2 20 20 LYS HE2 H . . . . . 4.37 0.0 4.37 . . . . . B . 318 LYS HB3 . . B . 318 LYS HE2 . . . 318 . HB# . . . . . 318 . HE# . . c17360_2l7l 1 229 2 OR . 2 2 20 20 LYS HB2 H . . . 2 2 20 20 LYS HE2 H . . . . . 4.37 0.0 4.37 . . . . . B . 318 LYS HB2 . . B . 318 LYS HE2 . . . 318 . HB# . . . . . 318 . HE# . . c17360_2l7l 1 229 3 OR . 2 2 20 20 LYS HE3 H . . . 2 2 20 20 LYS HB2 H . . . . . 4.37 0.0 4.37 . . . . . B . 318 LYS HE3 . . B . 318 LYS HB2 . . . 318 . HE# . . . . . 318 . HB# . . c17360_2l7l 1 229 4 OR . 2 2 20 20 LYS HB3 H . . . 2 2 20 20 LYS HE3 H . . . . . 4.37 0.0 4.37 . . . . . B . 318 LYS HB3 . . B . 318 LYS HE3 . . . 318 . HB# . . . . . 318 . HE# . . c17360_2l7l 1 230 1 OR . 2 2 22 22 GLN H H . . . 2 2 20 20 LYS HB2 H . . . . . 5.34 0.0 5.34 . . . . . B . 320 GLN H . . B . 318 LYS HB2 . . . 320 . HN . . . . . 318 . HB# . . c17360_2l7l 1 230 2 OR . 2 2 22 22 GLN H H . . . 2 2 20 20 LYS HB3 H . . . . . 5.34 0.0 5.34 . . . . . B . 320 GLN H . . B . 318 LYS HB3 . . . 320 . HN . . . . . 318 . HB# . . c17360_2l7l 1 231 1 OR . 2 2 20 20 LYS HE3 H . . . 2 2 20 20 LYS HG2 H . . . . . 3.31 0.0 3.31 . . . . . B . 318 LYS HE3 . . B . 318 LYS HG2 . . . 318 . HE# . . . . . 318 . HG# . . c17360_2l7l 1 231 2 OR . 2 2 20 20 LYS HE2 H . . . 2 2 20 20 LYS HG2 H . . . . . 3.31 0.0 3.31 . . . . . B . 318 LYS HE2 . . B . 318 LYS HG2 . . . 318 . HE# . . . . . 318 . HG# . . c17360_2l7l 1 231 3 OR . 2 2 20 20 LYS HG3 H . . . 2 2 20 20 LYS HE2 H . . . . . 3.31 0.0 3.31 . . . . . B . 318 LYS HG3 . . B . 318 LYS HE2 . . . 318 . HG# . . . . . 318 . HE# . . c17360_2l7l 1 231 4 OR . 2 2 20 20 LYS HG3 H . . . 2 2 20 20 LYS HE3 H . . . . . 3.31 0.0 3.31 . . . . . B . 318 LYS HG3 . . B . 318 LYS HE3 . . . 318 . HG# . . . . . 318 . HE# . . c17360_2l7l 1 232 1 OR . 2 2 21 21 LEU H H . . . 2 2 20 20 LYS HG2 H . . . . . 5.34 0.0 5.34 . . . . . B . 319 LEU H . . B . 318 LYS HG2 . . . 319 . HN . . . . . 318 . HG# . . c17360_2l7l 1 232 2 OR . 2 2 21 21 LEU H H . . . 2 2 20 20 LYS HG3 H . . . . . 5.34 0.0 5.34 . . . . . B . 319 LEU H . . B . 318 LYS HG3 . . . 319 . HN . . . . . 318 . HG# . . c17360_2l7l 1 233 1 OR . 2 2 22 22 GLN H H . . . 2 2 20 20 LYS HG2 H . . . . . 5.34 0.0 5.34 . . . . . B . 320 GLN H . . B . 318 LYS HG2 . . . 320 . HN . . . . . 318 . HG# . . c17360_2l7l 1 233 2 OR . 2 2 22 22 GLN H H . . . 2 2 20 20 LYS HG3 H . . . . . 5.34 0.0 5.34 . . . . . B . 320 GLN H . . B . 318 LYS HG3 . . . 320 . HN . . . . . 318 . HG# . . c17360_2l7l 1 234 1 OR . 2 2 20 20 LYS HD2 H . . . 2 2 20 20 LYS HE2 H . . . . . 2.35 0.0 2.35 . . . . . B . 318 LYS HD2 . . B . 318 LYS HE2 . . . 318 . HD# . . . . . 318 . HE# . . c17360_2l7l 1 234 2 OR . 2 2 20 20 LYS HD3 H . . . 2 2 20 20 LYS HE2 H . . . . . 2.35 0.0 2.35 . . . . . B . 318 LYS HD3 . . B . 318 LYS HE2 . . . 318 . HD# . . . . . 318 . HE# . . c17360_2l7l 1 234 3 OR . 2 2 20 20 LYS HE3 H . . . 2 2 20 20 LYS HD2 H . . . . . 2.35 0.0 2.35 . . . . . B . 318 LYS HE3 . . B . 318 LYS HD2 . . . 318 . HE# . . . . . 318 . HD# . . c17360_2l7l 1 234 4 OR . 2 2 20 20 LYS HD3 H . . . 2 2 20 20 LYS HE3 H . . . . . 2.35 0.0 2.35 . . . . . B . 318 LYS HD3 . . B . 318 LYS HE3 . . . 318 . HD# . . . . . 318 . HE# . . c17360_2l7l 1 235 1 OR . 2 2 21 21 LEU H H . . . 2 2 21 21 LEU HB2 H . . . . . 3.21 0.0 3.21 . . . . . B . 319 LEU H . . B . 319 LEU HB2 . . . 319 . HN . . . . . 319 . HB# . . c17360_2l7l 1 235 2 OR . 2 2 21 21 LEU H H . . . 2 2 21 21 LEU HB3 H . . . . . 3.21 0.0 3.21 . . . . . B . 319 LEU H . . B . 319 LEU HB3 . . . 319 . HN . . . . . 319 . HB# . . c17360_2l7l 1 236 1 OR . 2 2 21 21 LEU H H . . . 2 2 21 21 LEU MD1 H . . . . . 3.38 0.0 3.38 . . . . . B . 319 LEU H . . B . 319 LEU MD1 . . . 319 . HN . . . . . 319 . HD## . . c17360_2l7l 1 236 2 OR . 2 2 21 21 LEU H H . . . 2 2 21 21 LEU MD2 H . . . . . 3.38 0.0 3.38 . . . . . B . 319 LEU H . . B . 319 LEU MD2 . . . 319 . HN . . . . . 319 . HD## . . c17360_2l7l 1 237 1 OR . 2 2 21 21 LEU HA H . . . 2 2 21 21 LEU MD1 H . . . . . 3.02 0.0 3.02 . . . . . B . 319 LEU HA . . B . 319 LEU MD1 . . . 319 . HA . . . . . 319 . HD## . . c17360_2l7l 1 237 2 OR . 2 2 21 21 LEU HA H . . . 2 2 21 21 LEU MD2 H . . . . . 3.02 0.0 3.02 . . . . . B . 319 LEU HA . . B . 319 LEU MD2 . . . 319 . HA . . . . . 319 . HD## . . c17360_2l7l 1 238 1 OR . 2 2 21 21 LEU HB2 H . . . 2 2 21 21 LEU MD1 H . . . . . 2.82 0.0 2.82 . . . . . B . 319 LEU HB2 . . B . 319 LEU MD1 . . . 319 . HB# . . . . . 319 . HD## . . c17360_2l7l 1 238 2 OR . 2 2 21 21 LEU HB3 H . . . 2 2 21 21 LEU MD1 H . . . . . 2.82 0.0 2.82 . . . . . B . 319 LEU HB3 . . B . 319 LEU MD1 . . . 319 . HB# . . . . . 319 . HD## . . c17360_2l7l 1 238 3 OR . 2 2 21 21 LEU MD2 H . . . 2 2 21 21 LEU HB2 H . . . . . 2.82 0.0 2.82 . . . . . B . 319 LEU MD2 . . B . 319 LEU HB2 . . . 319 . HD## . . . . . 319 . HB# . . c17360_2l7l 1 238 4 OR . 2 2 21 21 LEU MD2 H . . . 2 2 21 21 LEU HB3 H . . . . . 2.82 0.0 2.82 . . . . . B . 319 LEU MD2 . . B . 319 LEU HB3 . . . 319 . HD## . . . . . 319 . HB# . . c17360_2l7l 1 239 1 OR . 2 2 22 22 GLN HA H . . . 2 2 21 21 LEU HB2 H . . . . . 5.34 0.0 5.34 . . . . . B . 320 GLN HA . . B . 319 LEU HB2 . . . 320 . HA . . . . . 319 . HB# . . c17360_2l7l 1 239 2 OR . 2 2 21 21 LEU HB3 H . . . 2 2 22 22 GLN HA H . . . . . 5.34 0.0 5.34 . . . . . B . 319 LEU HB3 . . B . 320 GLN HA . . . 319 . HB# . . . . . 320 . HA . . c17360_2l7l 1 240 1 OR . 2 2 22 22 GLN H H . . . 2 2 22 22 GLN HG2 H . . . . . 3.88 0.0 3.88 . . . . . B . 320 GLN H . . B . 320 GLN HG2 . . . 320 . HN . . . . . 320 . HG# . . c17360_2l7l 1 240 2 OR . 2 2 22 22 GLN H H . . . 2 2 22 22 GLN HG3 H . . . . . 3.88 0.0 3.88 . . . . . B . 320 GLN H . . B . 320 GLN HG3 . . . 320 . HN . . . . . 320 . HG# . . c17360_2l7l 1 241 1 OR . 2 2 22 22 GLN H H . . . 2 2 22 22 GLN HE22 H . . . . . 5.08 0.0 5.08 . . . . . B . 320 GLN H . . B . 320 GLN HE22 . . . 320 . HN . . . . . 320 . HE2# . . c17360_2l7l 1 241 2 OR . 2 2 22 22 GLN H H . . . 2 2 22 22 GLN HE21 H . . . . . 5.08 0.0 5.08 . . . . . B . 320 GLN H . . B . 320 GLN HE21 . . . 320 . HN . . . . . 320 . HE2# . . c17360_2l7l 1 242 1 OR . 2 2 22 22 GLN HA H . . . 2 2 22 22 GLN HG2 H . . . . . 3.59 0.0 3.59 . . . . . B . 320 GLN HA . . B . 320 GLN HG2 . . . 320 . HA . . . . . 320 . HG# . . c17360_2l7l 1 242 2 OR . 2 2 22 22 GLN HG3 H . . . 2 2 22 22 GLN HA H . . . . . 3.59 0.0 3.59 . . . . . B . 320 GLN HG3 . . B . 320 GLN HA . . . 320 . HG# . . . . . 320 . HA . . c17360_2l7l 1 243 1 OR . 2 2 22 22 GLN HB3 H . . . 2 2 22 22 GLN HG2 H . . . . . 2.34 0.0 2.34 . . . . . B . 320 GLN HB3 . . B . 320 GLN HG2 . . . 320 . HB# . . . . . 320 . HG# . . c17360_2l7l 1 243 2 OR . 2 2 22 22 GLN HB2 H . . . 2 2 22 22 GLN HG2 H . . . . . 2.34 0.0 2.34 . . . . . B . 320 GLN HB2 . . B . 320 GLN HG2 . . . 320 . HB# . . . . . 320 . HG# . . c17360_2l7l 1 243 3 OR . 2 2 22 22 GLN HG3 H . . . 2 2 22 22 GLN HB3 H . . . . . 2.34 0.0 2.34 . . . . . B . 320 GLN HG3 . . B . 320 GLN HB3 . . . 320 . HG# . . . . . 320 . HB# . . c17360_2l7l 1 243 4 OR . 2 2 22 22 GLN HG3 H . . . 2 2 22 22 GLN HB2 H . . . . . 2.34 0.0 2.34 . . . . . B . 320 GLN HG3 . . B . 320 GLN HB2 . . . 320 . HG# . . . . . 320 . HB# . . c17360_2l7l 1 244 1 OR . 2 2 22 22 GLN HE22 H . . . 2 2 22 22 GLN HG2 H . . . . . 3.15 0.0 3.15 . . . . . B . 320 GLN HE22 . . B . 320 GLN HG2 . . . 320 . HE2# . . . . . 320 . HG# . . c17360_2l7l 1 244 2 OR . 2 2 22 22 GLN HG3 H . . . 2 2 22 22 GLN HE22 H . . . . . 3.15 0.0 3.15 . . . . . B . 320 GLN HG3 . . B . 320 GLN HE22 . . . 320 . HG# . . . . . 320 . HE2# . . c17360_2l7l 1 244 3 OR . 2 2 22 22 GLN HG3 H . . . 2 2 22 22 GLN HE21 H . . . . . 3.15 0.0 3.15 . . . . . B . 320 GLN HG3 . . B . 320 GLN HE21 . . . 320 . HG# . . . . . 320 . HE2# . . c17360_2l7l 1 244 4 OR . 2 2 22 22 GLN HE21 H . . . 2 2 22 22 GLN HG2 H . . . . . 3.15 0.0 3.15 . . . . . B . 320 GLN HE21 . . B . 320 GLN HG2 . . . 320 . HE2# . . . . . 320 . HG# . . c17360_2l7l 1 stop_ loop_ _Gen_dist_constraint_parse_err.ID _Gen_dist_constraint_parse_err.Content _Gen_dist_constraint_parse_err.Begin_line _Gen_dist_constraint_parse_err.Begin_column _Gen_dist_constraint_parse_err.End_line _Gen_dist_constraint_parse_err.End_column _Gen_dist_constraint_parse_err.Entry_ID _Gen_dist_constraint_parse_err.Gen_dist_constraint_list_ID 1 ; ###################################################################################### #######################PEPTIDE'S NOES FROM CYANA UPL FILE########################### ##################################################################################### ; 1 1 3 85 c17360_2l7l 1 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_5 _Gen_dist_constraint_list.Entry_ID c17360_2l7l _Gen_dist_constraint_list.ID 3 _Gen_dist_constraint_list.Constraint_type 'general distance' _Gen_dist_constraint_list.Details 'Generated by Wattos' _Gen_dist_constraint_list.Constraint_file_ID 1 _Gen_dist_constraint_list.Block_ID 5 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 . . . . c17360_2l7l 2 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 20 20 ASP OD2 O . . . 3 3 1 1 CA CA Ca . . . . . 2.5 0.0 2.5 . . . . . A . 20 ASP OD2 . . A . 401 CA CA . . . 20 . OD2 . . . . . 401 . CA . . c17360_2l7l 2 2 1 . . 3 3 1 1 CA CA Ca . . . 1 1 22 22 ASP OD1 O . . . . . 2.5 0.0 2.5 . . . . . A . 401 CA CA . . A . 22 ASP OD1 . . . 401 . CA . . . . . 22 . OD1 . . c17360_2l7l 2 3 1 . . 3 3 1 1 CA CA Ca . . . 1 1 24 24 ASP OD2 O . . . . . 2.5 0.0 2.5 . . . . . A . 401 CA CA . . A . 24 ASP OD2 . . . 401 . CA . . . . . 24 . OD2 . . c17360_2l7l 2 4 1 . . 3 3 1 1 CA CA Ca . . . 1 1 26 26 THR O O . . . . . 2.5 0.0 2.5 . . . . . A . 401 CA CA . . A . 26 THR O . . . 401 . CA . . . . . 26 . O . . c17360_2l7l 2 5 1 . . 3 3 1 1 CA CA Ca . . . 1 1 31 31 GLU OE1 O . . . . . 2.5 0.0 2.5 . . . . . A . 401 CA CA . . A . 31 GLU OE1 . . . 401 . CA . . . . . 31 . OE1 . . c17360_2l7l 2 6 1 . . 3 3 1 1 CA CA Ca . . . 1 1 31 31 GLU OE2 O . . . . . 2.5 0.0 2.5 . . . . . A . 401 CA CA . . A . 31 GLU OE2 . . . 401 . CA . . . . . 31 . OE2 . . c17360_2l7l 2 7 1 . . 1 1 56 56 ASP OD2 O . . . 4 3 1 1 CA CA Ca . . . . . 2.5 0.0 2.5 . . . . . A . 56 ASP OD2 . . A . 402 CA CA . . . 56 . OD2 . . . . . 402 . CA . . c17360_2l7l 2 8 1 . . 4 3 1 1 CA CA Ca . . . 1 1 58 58 ASP OD2 O . . . . . 2.5 0.0 2.5 . . . . . A . 402 CA CA . . A . 58 ASP OD2 . . . 402 . CA . . . . . 58 . OD2 . . c17360_2l7l 2 9 1 . . 4 3 1 1 CA CA Ca . . . 1 1 60 60 ASN OD1 O . . . . . 2.5 0.0 2.5 . . . . . A . 402 CA CA . . A . 60 ASN OD1 . . . 402 . CA . . . . . 60 . OD1 . . c17360_2l7l 2 10 1 . . 4 3 1 1 CA CA Ca . . . 1 1 62 62 THR O O . . . . . 2.5 0.0 2.5 . . . . . A . 402 CA CA . . A . 62 THR O . . . 402 . CA . . . . . 62 . O . . c17360_2l7l 2 11 1 . . 4 3 1 1 CA CA Ca . . . 1 1 67 67 GLU OE1 O . . . . . 2.5 0.0 2.5 . . . . . A . 402 CA CA . . A . 67 GLU OE1 . . . 402 . CA . . . . . 67 . OE1 . . c17360_2l7l 2 12 1 . . 4 3 1 1 CA CA Ca . . . 1 1 67 67 GLU OE2 O . . . . . 2.5 0.0 2.5 . . . . . A . 402 CA CA . . A . 67 GLU OE2 . . . 402 . CA . . . . . 67 . OE2 . . c17360_2l7l 2 13 1 . . 1 1 93 93 ASP OD2 O . . . 5 3 1 1 CA CA Ca . . . . . 2.5 0.0 2.5 . . . . . A . 93 ASP OD2 . . A . 403 CA CA . . . 93 . OD2 . . . . . 403 . CA . . c17360_2l7l 2 14 1 . . 5 3 1 1 CA CA Ca . . . 1 1 95 95 ASP OD2 O . . . . . 2.5 0.0 2.5 . . . . . A . 403 CA CA . . A . 95 ASP OD2 . . . 403 . CA . . . . . 95 . OD2 . . c17360_2l7l 2 15 1 . . 5 3 1 1 CA CA Ca . . . 1 1 97 97 ASN OD1 O . . . . . 2.5 0.0 2.5 . . . . . A . 403 CA CA . . A . 97 ASN OD1 . . . 403 . CA . . . . . 97 . OD1 . . c17360_2l7l 2 16 1 . . 5 3 1 1 CA CA Ca . . . 1 1 99 99 TYR O O . . . . . 2.5 0.0 2.5 . . . . . A . 403 CA CA . . A . 99 TYR O . . . 403 . CA . . . . . 99 . O . . c17360_2l7l 2 17 1 . . 5 3 1 1 CA CA Ca . . . 1 1 104 104 GLU OE1 O . . . . . 2.5 0.0 2.5 . . . . . A . 403 CA CA . . A . 104 GLU OE1 . . . 403 . CA . . . . . 104 . OE1 . . c17360_2l7l 2 18 1 . . 5 3 1 1 CA CA Ca . . . 1 1 104 104 GLU OE2 O . . . . . 2.5 0.0 2.5 . . . . . A . 403 CA CA . . A . 104 GLU OE2 . . . 403 . CA . . . . . 104 . OE2 . . c17360_2l7l 2 19 1 . . 1 1 129 129 ASP OD1 O . . . 6 3 1 1 CA CA Ca . . . . . 2.5 0.0 2.5 . . . . . A . 129 ASP OD1 . . A . 404 CA CA . . . 129 . OD1 . . . . . 404 . CA . . c17360_2l7l 2 20 1 . . 6 3 1 1 CA CA Ca . . . 1 1 131 131 ASP OD2 O . . . . . 2.5 0.0 2.5 . . . . . A . 404 CA CA . . A . 131 ASP OD2 . . . 404 . CA . . . . . 131 . OD2 . . c17360_2l7l 2 21 1 . . 6 3 1 1 CA CA Ca . . . 1 1 133 133 ASP OD2 O . . . . . 2.5 0.0 2.5 . . . . . A . 404 CA CA . . A . 133 ASP OD2 . . . 404 . CA . . . . . 133 . OD2 . . c17360_2l7l 2 22 1 . . 6 3 1 1 CA CA Ca . . . 1 1 135 135 GLN O O . . . . . 2.5 0.0 2.5 . . . . . A . 404 CA CA . . A . 135 GLN O . . . 404 . CA . . . . . 135 . O . . c17360_2l7l 2 23 1 . . 6 3 1 1 CA CA Ca . . . 1 1 140 140 GLU OE1 O . . . . . 2.5 0.0 2.5 . . . . . A . 404 CA CA . . A . 140 GLU OE1 . . . 404 . CA . . . . . 140 . OE1 . . c17360_2l7l 2 24 1 . . 6 3 1 1 CA CA Ca . . . 1 1 140 140 GLU OE2 O . . . . . 2.5 0.0 2.5 . . . . . A . 404 CA CA . . A . 140 GLU OE2 . . . 404 . CA . . . . . 140 . OE2 . . c17360_2l7l 2 stop_ loop_ _Gen_dist_constraint_parse_err.ID _Gen_dist_constraint_parse_err.Content _Gen_dist_constraint_parse_err.Begin_line _Gen_dist_constraint_parse_err.Begin_column _Gen_dist_constraint_parse_err.End_line _Gen_dist_constraint_parse_err.End_column _Gen_dist_constraint_parse_err.Entry_ID _Gen_dist_constraint_parse_err.Gen_dist_constraint_list_ID 1 ; ################################################################################## ############################CA2+ CHELATION RESTRAINTS############################ ################################################################################# ; 1 1 3 81 c17360_2l7l 2 stop_ save_ save_CNS/XPLOR_distance_constraints_6 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_6 _Gen_dist_constraint_list.Entry_ID c17360_2l7l _Gen_dist_constraint_list.ID 4 _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 6 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 . . . . c17360_2l7l 3 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 36 36 MET ME H . . . 1 1 36 36 MET HA H . . . . . 6.0 1.8 6.0 . . . . . A . 36 MET ME . . A . 36 MET HA . . . 36 . HE# . . . . . 36 . HA . . c17360_2l7l 3 2 1 . . 1 1 145 145 MET ME H . . . 1 1 124 124 MET ME H . . . . . 6.0 1.8 6.0 . . . . . A . 145 MET ME . . A . 124 MET ME . . . 145 . HE# . . . . . 124 . HE# . . c17360_2l7l 3 3 1 . . 2 2 5 5 TRP HZ3 H . . . 1 1 145 145 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 303 TRP HZ3 . . A . 145 MET ME . . . 303 . HZ3 . . . . . 145 . HE# . . c17360_2l7l 3 4 1 . . 1 1 145 145 MET ME H . . . 2 2 5 5 TRP HH2 H . . . . . 6.0 1.8 6.0 . . . . . A . 145 MET ME . . B . 303 TRP HH2 . . . 145 . HE# . . . . . 303 . HH2 . . c17360_2l7l 3 5 1 . . 2 2 9 9 PHE QE H . . . 1 1 145 145 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 307 PHE QE . . A . 145 MET ME . . . 307 . HE# . . . . . 145 . HE# . . c17360_2l7l 3 6 1 . . 2 2 5 5 TRP HE3 H . . . 1 1 145 145 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 303 TRP HE3 . . A . 145 MET ME . . . 303 . HE3 . . . . . 145 . HE# . . c17360_2l7l 3 7 1 OR . 1 1 51 51 MET ME H . . . 2 2 18 18 MET HG3 H . . . . . 6.0 1.8 6.0 . . . . . A . 51 MET ME . . B . 316 MET HG3 . . . 51 . HE# . . . . . 316 . HG# . . c17360_2l7l 3 7 2 OR . 2 2 18 18 MET HG2 H . . . 1 1 51 51 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 316 MET HG2 . . A . 51 MET ME . . . 316 . HG# . . . . . 51 . HE# . . c17360_2l7l 3 8 1 . . 2 2 15 15 VAL HA H . . . 1 1 51 51 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 313 VAL HA . . A . 51 MET ME . . . 313 . HA . . . . . 51 . HE# . . c17360_2l7l 3 9 1 . . 2 2 15 15 VAL HA H . . . 1 1 71 71 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 313 VAL HA . . A . 71 MET ME . . . 313 . HA . . . . . 71 . HE# . . c17360_2l7l 3 10 1 OR . 2 2 17 17 HIS HD2 H . . . 1 1 71 71 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 315 HIS HD2 . . A . 71 MET ME . . . 315 . HD# . . . . . 71 . HE# . . c17360_2l7l 3 10 2 OR . 1 1 71 71 MET ME H . . . 2 2 17 17 HIS HD1 H . . . . . 6.0 1.8 6.0 . . . . . A . 71 MET ME . . B . 315 HIS HD1 . . . 71 . HE# . . . . . 315 . HD# . . c17360_2l7l 3 11 1 . . 2 2 15 15 VAL HA H . . . 1 1 72 72 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 313 VAL HA . . A . 72 MET ME . . . 313 . HA . . . . . 72 . HE# . . c17360_2l7l 3 12 1 . . 1 1 124 124 MET ME H . . . 1 1 109 109 MET ME H . . . . . 6.0 1.8 6.0 . . . . . A . 124 MET ME . . A . 109 MET ME . . . 124 . HE# . . . . . 109 . HE# . . c17360_2l7l 3 13 1 . . 1 1 124 124 MET ME H . . . 1 1 144 144 MET ME H . . . . . 6.0 1.8 6.0 . . . . . A . 124 MET ME . . A . 144 MET ME . . . 124 . HE# . . . . . 144 . HE# . . c17360_2l7l 3 14 1 . . 2 2 5 5 TRP HZ3 H . . . 1 1 144 144 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 303 TRP HZ3 . . A . 144 MET ME . . . 303 . HZ3 . . . . . 144 . HE# . . c17360_2l7l 3 15 1 . . 2 2 5 5 TRP HE3 H . . . 1 1 144 144 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 303 TRP HE3 . . A . 144 MET ME . . . 303 . HE3 . . . . . 144 . HE# . . c17360_2l7l 3 16 1 . . 2 2 5 5 TRP HZ3 H . . . 1 1 124 124 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 303 TRP HZ3 . . A . 124 MET ME . . . 303 . HZ3 . . . . . 124 . HE# . . c17360_2l7l 3 17 1 . . 1 1 124 124 MET ME H . . . 2 2 5 5 TRP HH2 H . . . . . 6.0 1.8 6.0 . . . . . A . 124 MET ME . . B . 303 TRP HH2 . . . 124 . HE# . . . . . 303 . HH2 . . c17360_2l7l 3 18 1 . . 2 2 5 5 TRP HE3 H . . . 1 1 124 124 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 303 TRP HE3 . . A . 124 MET ME . . . 303 . HE3 . . . . . 124 . HE# . . c17360_2l7l 3 19 1 . . 1 1 36 36 MET ME H . . . 1 1 71 71 MET ME H . . . . . 6.0 1.8 6.0 . . . . . A . 36 MET ME . . A . 71 MET ME . . . 36 . HE# . . . . . 71 . HE# . . c17360_2l7l 3 20 1 . . 2 2 18 18 MET HG2 H . . . 1 1 36 36 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 316 MET HG2 . . A . 36 MET ME . . . 316 . HG2 . . . . . 36 . HE# . . c17360_2l7l 3 21 1 . . 2 2 15 15 VAL HA H . . . 1 1 36 36 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 313 VAL HA . . A . 36 MET ME . . . 313 . HA . . . . . 36 . HE# . . c17360_2l7l 3 22 1 . . 1 1 36 36 MET ME H . . . 1 1 51 51 MET HA H . . . . . 6.0 1.8 6.0 . . . . . A . 36 MET ME . . A . 51 MET HA . . . 36 . HE# . . . . . 51 . HA . . c17360_2l7l 3 23 1 OR . 1 1 145 145 MET ME H . . . 2 2 6 6 LYS HB2 H . . . . . 6.0 1.8 6.0 . . . . . A . 145 MET ME . . B . 304 LYS HB2 . . . 145 . HE# . . . . . 304 . HB# . . c17360_2l7l 3 23 2 OR . 2 2 6 6 LYS HB3 H . . . 1 1 145 145 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 304 LYS HB3 . . A . 145 MET ME . . . 304 . HB# . . . . . 145 . HE# . . c17360_2l7l 3 24 1 OR . 1 1 145 145 MET ME H . . . 2 2 7 7 GLN HB2 H . . . . . 6.0 1.8 6.0 . . . . . A . 145 MET ME . . B . 305 GLN HB2 . . . 145 . HE# . . . . . 305 . HB# . . c17360_2l7l 3 24 2 OR . 2 2 7 7 GLN HB3 H . . . 1 1 145 145 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 305 GLN HB3 . . A . 145 MET ME . . . 305 . HB# . . . . . 145 . HE# . . c17360_2l7l 3 25 1 . . 1 1 51 51 MET ME H . . . 1 1 71 71 MET ME H . . . . . 6.0 1.8 6.0 . . . . . A . 51 MET ME . . A . 71 MET ME . . . 51 . HE# . . . . . 71 . HE# . . c17360_2l7l 3 26 1 OR . 1 1 51 51 MET ME H . . . 2 2 22 22 GLN HB3 H . . . . . 6.0 1.8 6.0 . . . . . A . 51 MET ME . . B . 320 GLN HB3 . . . 51 . HE# . . . . . 320 . HB# . . c17360_2l7l 3 26 2 OR . 2 2 22 22 GLN HB2 H . . . 1 1 51 51 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 320 GLN HB2 . . A . 51 MET ME . . . 320 . HB# . . . . . 51 . HE# . . c17360_2l7l 3 27 1 OR . 1 1 51 51 MET ME H . . . 2 2 22 22 GLN HG2 H . . . . . 6.0 1.8 6.0 . . . . . A . 51 MET ME . . B . 320 GLN HG2 . . . 51 . HE# . . . . . 320 . HG# . . c17360_2l7l 3 27 2 OR . 2 2 22 22 GLN HG3 H . . . 1 1 51 51 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 320 GLN HG3 . . A . 51 MET ME . . . 320 . HG# . . . . . 51 . HE# . . c17360_2l7l 3 28 1 . . 1 1 51 51 MET ME H . . . 1 1 71 71 MET ME H . . . . . 6.0 1.8 6.0 . . . . . A . 51 MET ME . . A . 71 MET ME . . . 51 . HE# . . . . . 71 . HE# . . c17360_2l7l 3 29 1 . . 1 1 71 71 MET ME H . . . 1 1 76 76 MET ME H . . . . . 6.0 1.8 6.0 . . . . . A . 71 MET ME . . A . 76 MET ME . . . 71 . HE# . . . . . 76 . HE# . . c17360_2l7l 3 30 1 . . 2 2 15 15 VAL HB H . . . 1 1 71 71 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 313 VAL HB . . A . 71 MET ME . . . 313 . HB . . . . . 71 . HE# . . c17360_2l7l 3 31 1 . . 2 2 18 18 MET HG2 H . . . 1 1 71 71 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 316 MET HG2 . . A . 71 MET ME . . . 316 . HG2 . . . . . 71 . HE# . . c17360_2l7l 3 32 1 . . 2 2 14 14 VAL HA H . . . 1 1 71 71 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 312 VAL HA . . A . 71 MET ME . . . 312 . HA . . . . . 71 . HE# . . c17360_2l7l 3 33 1 . . 2 2 10 10 ASN HA H . . . 1 1 71 71 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 308 ASN HA . . A . 71 MET ME . . . 308 . HA . . . . . 71 . HE# . . c17360_2l7l 3 34 1 OR . 1 1 72 72 MET ME H . . . 2 2 14 14 VAL MG1 H . . . . . 6.0 1.8 6.0 . . . . . A . 72 MET ME . . B . 312 VAL MG1 . . . 72 . HE# . . . . . 312 . HG## . . c17360_2l7l 3 34 2 OR . 2 2 14 14 VAL MG2 H . . . 1 1 72 72 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 312 VAL MG2 . . A . 72 MET ME . . . 312 . HG## . . . . . 72 . HE# . . c17360_2l7l 3 35 1 . . 1 1 51 51 MET ME H . . . 1 1 72 72 MET ME H . . . . . 6.0 1.8 6.0 . . . . . A . 51 MET ME . . A . 72 MET ME . . . 51 . HE# . . . . . 72 . HE# . . c17360_2l7l 3 36 1 . . 1 1 72 72 MET ME H . . . 1 1 76 76 MET ME H . . . . . 6.0 1.8 6.0 . . . . . A . 72 MET ME . . A . 76 MET ME . . . 72 . HE# . . . . . 76 . HE# . . c17360_2l7l 3 37 1 OR . 1 1 72 72 MET ME H . . . 2 2 10 10 ASN HB2 H . . . . . 6.0 1.8 6.0 . . . . . A . 72 MET ME . . B . 308 ASN HB2 . . . 72 . HE# . . . . . 308 . HB# . . c17360_2l7l 3 37 2 OR . 2 2 10 10 ASN HB3 H . . . 1 1 72 72 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 308 ASN HB3 . . A . 72 MET ME . . . 308 . HB# . . . . . 72 . HE# . . c17360_2l7l 3 38 1 . . 2 2 10 10 ASN HA H . . . 1 1 72 72 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 308 ASN HA . . A . 72 MET ME . . . 308 . HA . . . . . 72 . HE# . . c17360_2l7l 3 39 1 . . 2 2 9 9 PHE QD H . . . 1 1 72 72 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 307 PHE QD . . A . 72 MET ME . . . 307 . HD# . . . . . 72 . HE# . . c17360_2l7l 3 40 1 . . 1 1 109 109 MET ME H . . . 1 1 144 144 MET ME H . . . . . 6.0 1.8 6.0 . . . . . A . 109 MET ME . . A . 144 MET ME . . . 109 . HE# . . . . . 144 . HE# . . c17360_2l7l 3 41 1 OR . 1 1 109 109 MET ME H . . . 2 2 7 7 GLN HB2 H . . . . . 6.0 1.8 6.0 . . . . . A . 109 MET ME . . B . 305 GLN HB2 . . . 109 . HE# . . . . . 305 . HB# . . c17360_2l7l 3 41 2 OR . 2 2 7 7 GLN HB3 H . . . 1 1 109 109 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 305 GLN HB3 . . A . 109 MET ME . . . 305 . HB# . . . . . 109 . HE# . . c17360_2l7l 3 42 1 OR . 1 1 109 109 MET ME H . . . 2 2 7 7 GLN HG2 H . . . . . 6.0 1.8 6.0 . . . . . A . 109 MET ME . . B . 305 GLN HG2 . . . 109 . HE# . . . . . 305 . HG# . . c17360_2l7l 3 42 2 OR . 2 2 7 7 GLN HG3 H . . . 1 1 109 109 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 305 GLN HG3 . . A . 109 MET ME . . . 305 . HG# . . . . . 109 . HE# . . c17360_2l7l 3 43 1 . . 2 2 5 5 TRP HH2 H . . . 1 1 144 144 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 303 TRP HH2 . . A . 144 MET ME . . . 303 . HH2 . . . . . 144 . HE# . . c17360_2l7l 3 44 1 OR . 1 1 124 124 MET ME H . . . 2 2 4 4 LYS HD2 H . . . . . 6.0 1.8 6.0 . . . . . A . 124 MET ME . . B . 302 LYS HD2 . . . 124 . HE# . . . . . 302 . HD# . . c17360_2l7l 3 44 2 OR . 2 2 4 4 LYS HD3 H . . . 1 1 124 124 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 302 LYS HD3 . . A . 124 MET ME . . . 302 . HD# . . . . . 124 . HE# . . c17360_2l7l 3 45 1 . . 1 1 124 124 MET ME H . . . 1 1 109 109 MET ME H . . . . . 6.0 1.8 6.0 . . . . . A . 124 MET ME . . A . 109 MET ME . . . 124 . HE# . . . . . 109 . HE# . . c17360_2l7l 3 46 1 OR . 1 1 124 124 MET ME H . . . 2 2 4 4 LYS HE2 H . . . . . 6.0 1.8 6.0 . . . . . A . 124 MET ME . . B . 302 LYS HE2 . . . 124 . HE# . . . . . 302 . HE# . . c17360_2l7l 3 46 2 OR . 2 2 4 4 LYS HE3 H . . . 1 1 124 124 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 302 LYS HE3 . . A . 124 MET ME . . . 302 . HE# . . . . . 124 . HE# . . c17360_2l7l 3 47 1 . . 1 1 124 124 MET ME H . . . 2 2 5 5 TRP HB3 H . . . . . 6.0 1.8 6.0 . . . . . A . 124 MET ME . . B . 303 TRP HB3 . . . 124 . HE# . . . . . 303 . HB1 . . c17360_2l7l 3 48 1 . . 1 1 124 124 MET ME H . . . 2 2 5 5 TRP HB2 H . . . . . 6.0 1.8 6.0 . . . . . A . 124 MET ME . . B . 303 TRP HB2 . . . 124 . HE# . . . . . 303 . HB2 . . c17360_2l7l 3 49 1 . . 2 2 9 9 PHE HA H . . . 1 1 124 124 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 307 PHE HA . . A . 124 MET ME . . . 307 . HA . . . . . 124 . HE# . . c17360_2l7l 3 50 1 . . 1 1 36 36 MET ME H . . . 1 1 71 71 MET HA H . . . . . 6.0 1.8 6.0 . . . . . A . 36 MET ME . . A . 71 MET HA . . . 36 . HE# . . . . . 71 . HA . . c17360_2l7l 3 51 1 . . 1 1 51 51 MET ME H . . . 1 1 71 71 MET HA H . . . . . 6.0 1.8 6.0 . . . . . A . 51 MET ME . . A . 71 MET HA . . . 51 . HE# . . . . . 71 . HA . . c17360_2l7l 3 52 1 OR . 1 1 36 36 MET ME H . . . 2 2 14 14 VAL MG1 H . . . . . 6.0 1.8 6.0 . . . . . A . 36 MET ME . . B . 312 VAL MG1 . . . 36 . HE# . . . . . 312 . HG## . . c17360_2l7l 3 52 2 OR . 2 2 14 14 VAL MG2 H . . . 1 1 36 36 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 312 VAL MG2 . . A . 36 MET ME . . . 312 . HG## . . . . . 36 . HE# . . c17360_2l7l 3 53 1 . . 2 2 15 15 VAL MG1 H . . . 1 1 36 36 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 313 VAL MG1 . . A . 36 MET ME . . . 313 . HG1# . . . . . 36 . HE# . . c17360_2l7l 3 54 1 OR . 1 1 36 36 MET ME H . . . 2 2 19 19 ARG HG3 H . . . . . 6.0 1.8 6.0 . . . . . A . 36 MET ME . . B . 317 ARG HG3 . . . 36 . HE# . . . . . 317 . HG# . . c17360_2l7l 3 54 2 OR . 2 2 19 19 ARG HG2 H . . . 1 1 36 36 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 317 ARG HG2 . . A . 36 MET ME . . . 317 . HG# . . . . . 36 . HE# . . c17360_2l7l 3 55 1 OR . 1 1 36 36 MET ME H . . . 2 2 10 10 ASN HB2 H . . . . . 6.0 1.8 6.0 . . . . . A . 36 MET ME . . B . 308 ASN HB2 . . . 36 . HE# . . . . . 308 . HB# . . c17360_2l7l 3 55 2 OR . 2 2 10 10 ASN HB3 H . . . 1 1 36 36 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 308 ASN HB3 . . A . 36 MET ME . . . 308 . HB# . . . . . 36 . HE# . . c17360_2l7l 3 56 1 . . 2 2 14 14 VAL HA H . . . 1 1 36 36 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 312 VAL HA . . A . 36 MET ME . . . 312 . HA . . . . . 36 . HE# . . c17360_2l7l 3 57 1 . . 2 2 19 19 ARG HA H . . . 1 1 36 36 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 317 ARG HA . . A . 36 MET ME . . . 317 . HA . . . . . 36 . HE# . . c17360_2l7l 3 58 1 . . 2 2 11 11 ALA HA H . . . 1 1 36 36 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 309 ALA HA . . A . 36 MET ME . . . 309 . HA . . . . . 36 . HE# . . c17360_2l7l 3 59 1 OR . 1 1 145 145 MET ME H . . . 2 2 9 9 PHE HB2 H . . . . . 6.0 1.8 6.0 . . . . . A . 145 MET ME . . B . 307 PHE HB2 . . . 145 . HE# . . . . . 307 . HB# . . c17360_2l7l 3 59 2 OR . 2 2 9 9 PHE HB3 H . . . 1 1 145 145 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 307 PHE HB3 . . A . 145 MET ME . . . 307 . HB# . . . . . 145 . HE# . . c17360_2l7l 3 60 1 . . 2 2 9 9 PHE HA H . . . 1 1 145 145 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 307 PHE HA . . A . 145 MET ME . . . 307 . HA . . . . . 145 . HE# . . c17360_2l7l 3 61 1 . . 2 2 10 10 ASN HA H . . . 1 1 145 145 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 308 ASN HA . . A . 145 MET ME . . . 308 . HA . . . . . 145 . HE# . . c17360_2l7l 3 62 1 . . 2 2 9 9 PHE QD H . . . 1 1 145 145 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 307 PHE QD . . A . 145 MET ME . . . 307 . HD# . . . . . 145 . HE# . . c17360_2l7l 3 63 1 . . 2 2 15 15 VAL MG2 H . . . 1 1 51 51 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 313 VAL MG2 . . A . 51 MET ME . . . 313 . HG2# . . . . . 51 . HE# . . c17360_2l7l 3 64 1 . . 1 1 51 51 MET ME H . . . 1 1 72 72 MET ME H . . . . . 6.0 1.8 6.0 . . . . . A . 51 MET ME . . A . 72 MET ME . . . 51 . HE# . . . . . 72 . HE# . . c17360_2l7l 3 65 1 . . 2 2 19 19 ARG HA H . . . 1 1 51 51 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 317 ARG HA . . A . 51 MET ME . . . 317 . HA . . . . . 51 . HE# . . c17360_2l7l 3 66 1 . . 1 1 71 71 MET ME H . . . 2 2 14 14 VAL MG1 H . . . . . 6.0 1.8 6.0 . . . . . A . 71 MET ME . . B . 312 VAL MG1 . . . 71 . HE# . . . . . 312 . HG1# . . c17360_2l7l 3 67 1 . . 2 2 14 14 VAL MG2 H . . . 1 1 71 71 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 312 VAL MG2 . . A . 71 MET ME . . . 312 . HG2# . . . . . 71 . HE# . . c17360_2l7l 3 68 1 . . 2 2 18 18 MET ME H . . . 1 1 71 71 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 316 MET ME . . A . 71 MET ME . . . 316 . HE# . . . . . 71 . HE# . . c17360_2l7l 3 69 1 OR . 1 1 71 71 MET ME H . . . 2 2 17 17 HIS HB2 H . . . . . 6.0 1.8 6.0 . . . . . A . 71 MET ME . . B . 315 HIS HB2 . . . 71 . HE# . . . . . 315 . HB# . . c17360_2l7l 3 69 2 OR . 2 2 17 17 HIS HB3 H . . . 1 1 71 71 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 315 HIS HB3 . . A . 71 MET ME . . . 315 . HB# . . . . . 71 . HE# . . c17360_2l7l 3 70 1 . . 1 1 71 71 MET ME H . . . 1 1 72 72 MET HA H . . . . . 6.0 1.8 6.0 . . . . . A . 71 MET ME . . A . 72 MET HA . . . 71 . HE# . . . . . 72 . HA . . c17360_2l7l 3 71 1 . . 2 2 11 11 ALA HA H . . . 1 1 71 71 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 309 ALA HA . . A . 71 MET ME . . . 309 . HA . . . . . 71 . HE# . . c17360_2l7l 3 72 1 . . 1 1 72 72 MET ME H . . . 2 2 14 14 VAL MG1 H . . . . . 6.0 1.8 6.0 . . . . . A . 72 MET ME . . B . 312 VAL MG1 . . . 72 . HE# . . . . . 312 . HG1# . . c17360_2l7l 3 73 1 . . 2 2 14 14 VAL MG2 H . . . 1 1 72 72 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 312 VAL MG2 . . A . 72 MET ME . . . 312 . HG2# . . . . . 72 . HE# . . c17360_2l7l 3 74 1 . . 1 1 51 51 MET ME H . . . 1 1 72 72 MET ME H . . . . . 6.0 1.8 6.0 . . . . . A . 51 MET ME . . A . 72 MET ME . . . 51 . HE# . . . . . 72 . HE# . . c17360_2l7l 3 75 1 . . 1 1 72 72 MET ME H . . . 1 1 76 76 MET ME H . . . . . 6.0 1.8 6.0 . . . . . A . 72 MET ME . . A . 76 MET ME . . . 72 . HE# . . . . . 76 . HE# . . c17360_2l7l 3 76 1 . . 2 2 14 14 VAL HB H . . . 1 1 72 72 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 312 VAL HB . . A . 72 MET ME . . . 312 . HB . . . . . 72 . HE# . . c17360_2l7l 3 77 1 . . 2 2 14 14 VAL HA H . . . 1 1 72 72 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 312 VAL HA . . A . 72 MET ME . . . 312 . HA . . . . . 72 . HE# . . c17360_2l7l 3 78 1 . . 2 2 11 11 ALA HA H . . . 1 1 72 72 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 309 ALA HA . . A . 72 MET ME . . . 309 . HA . . . . . 72 . HE# . . c17360_2l7l 3 79 1 OR . 1 1 109 109 MET ME H . . . 2 2 4 4 LYS HE2 H . . . . . 6.0 1.8 6.0 . . . . . A . 109 MET ME . . B . 302 LYS HE2 . . . 109 . HE# . . . . . 302 . HE# . . c17360_2l7l 3 79 2 OR . 2 2 4 4 LYS HE3 H . . . 1 1 109 109 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 302 LYS HE3 . . A . 109 MET ME . . . 302 . HE# . . . . . 109 . HE# . . c17360_2l7l 3 80 1 . . 2 2 8 8 ALA HA H . . . 1 1 109 109 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 306 ALA HA . . A . 109 MET ME . . . 306 . HA . . . . . 109 . HE# . . c17360_2l7l 3 81 1 . . 2 2 7 7 GLN HA H . . . 1 1 109 109 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 305 GLN HA . . A . 109 MET ME . . . 305 . HA . . . . . 109 . HE# . . c17360_2l7l 3 82 1 OR . 1 1 144 144 MET ME H . . . 2 2 2 2 LYS HD2 H . . . . . 6.0 1.8 6.0 . . . . . A . 144 MET ME . . B . 300 LYS HD2 . . . 144 . HE# . . . . . 300 . HD# . . c17360_2l7l 3 82 2 OR . 2 2 2 2 LYS HD3 H . . . 1 1 144 144 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 300 LYS HD3 . . A . 144 MET ME . . . 300 . HD# . . . . . 144 . HE# . . c17360_2l7l 3 83 1 . . 1 1 144 144 MET ME H . . . 2 2 5 5 TRP HB3 H . . . . . 6.0 1.8 6.0 . . . . . A . 144 MET ME . . B . 303 TRP HB3 . . . 144 . HE# . . . . . 303 . HB1 . . c17360_2l7l 3 84 1 . . 1 1 144 144 MET ME H . . . 2 2 5 5 TRP HB2 H . . . . . 6.0 1.8 6.0 . . . . . A . 144 MET ME . . B . 303 TRP HB2 . . . 144 . HE# . . . . . 303 . HB2 . . c17360_2l7l 3 85 1 . . 1 1 144 144 MET ME H . . . 2 2 5 5 TRP HZ2 H . . . . . 6.0 1.8 6.0 . . . . . A . 144 MET ME . . B . 303 TRP HZ2 . . . 144 . HE# . . . . . 303 . HZ2 . . c17360_2l7l 3 86 1 . . 1 1 124 124 MET ME H . . . 1 1 144 144 MET ME H . . . . . 6.0 1.8 6.0 . . . . . A . 124 MET ME . . A . 144 MET ME . . . 124 . HE# . . . . . 144 . HE# . . c17360_2l7l 3 87 1 . . 1 1 124 124 MET ME H . . . 2 2 4 4 LYS HG3 H . . . . . 6.0 1.8 6.0 . . . . . A . 124 MET ME . . B . 302 LYS HG3 . . . 124 . HE# . . . . . 302 . HG1 . . c17360_2l7l 3 88 1 . . 2 2 4 4 LYS HG2 H . . . 1 1 124 124 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 302 LYS HG2 . . A . 124 MET ME . . . 302 . HG2 . . . . . 124 . HE# . . c17360_2l7l 3 89 1 OR . 1 1 124 124 MET ME H . . . 2 2 4 4 LYS HB2 H . . . . . 6.0 1.8 6.0 . . . . . A . 124 MET ME . . B . 302 LYS HB2 . . . 124 . HE# . . . . . 302 . HB# . . c17360_2l7l 3 89 2 OR . 2 2 4 4 LYS HB3 H . . . 1 1 124 124 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 302 LYS HB3 . . A . 124 MET ME . . . 302 . HB# . . . . . 124 . HE# . . c17360_2l7l 3 90 1 . . 2 2 1 1 ALA HA H . . . 1 1 124 124 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 299 ALA HA . . A . 124 MET ME . . . 299 . HA . . . . . 124 . HE# . . c17360_2l7l 3 91 1 . . 2 2 5 5 TRP HA H . . . 1 1 124 124 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 303 TRP HA . . A . 124 MET ME . . . 303 . HA . . . . . 124 . HE# . . c17360_2l7l 3 92 1 . . 1 1 124 124 MET ME H . . . 2 2 5 5 TRP HZ2 H . . . . . 6.0 1.8 6.0 . . . . . A . 124 MET ME . . B . 303 TRP HZ2 . . . 124 . HE# . . . . . 303 . HZ2 . . c17360_2l7l 3 93 1 . . 2 2 15 15 VAL MG2 H . . . 1 1 36 36 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 313 VAL MG2 . . A . 36 MET ME . . . 313 . HG2# . . . . . 36 . HE# . . c17360_2l7l 3 94 1 . . 2 2 18 18 MET ME H . . . 1 1 36 36 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 316 MET ME . . A . 36 MET ME . . . 316 . HE# . . . . . 36 . HE# . . c17360_2l7l 3 95 1 . . 1 1 36 36 MET ME H . . . 2 2 18 18 MET HG3 H . . . . . 6.0 1.8 6.0 . . . . . A . 36 MET ME . . B . 316 MET HG3 . . . 36 . HE# . . . . . 316 . HG1 . . c17360_2l7l 3 96 1 OR . 1 1 36 36 MET ME H . . . 2 2 17 17 HIS HB2 H . . . . . 6.0 1.8 6.0 . . . . . A . 36 MET ME . . B . 315 HIS HB2 . . . 36 . HE# . . . . . 315 . HB# . . c17360_2l7l 3 96 2 OR . 2 2 17 17 HIS HB3 H . . . 1 1 36 36 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 315 HIS HB3 . . A . 36 MET ME . . . 315 . HB# . . . . . 36 . HE# . . c17360_2l7l 3 97 1 OR . 1 1 36 36 MET ME H . . . 2 2 19 19 ARG HD2 H . . . . . 6.0 1.8 6.0 . . . . . A . 36 MET ME . . B . 317 ARG HD2 . . . 36 . HE# . . . . . 317 . HD# . . c17360_2l7l 3 97 2 OR . 2 2 19 19 ARG HD3 H . . . 1 1 36 36 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 317 ARG HD3 . . A . 36 MET ME . . . 317 . HD# . . . . . 36 . HE# . . c17360_2l7l 3 98 1 OR . 1 1 145 145 MET ME H . . . 2 2 6 6 LYS HG2 H . . . . . 6.0 1.8 6.0 . . . . . A . 145 MET ME . . B . 304 LYS HG2 . . . 145 . HE# . . . . . 304 . HG# . . c17360_2l7l 3 98 2 OR . 2 2 6 6 LYS HG3 H . . . 1 1 145 145 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 304 LYS HG3 . . A . 145 MET ME . . . 304 . HG# . . . . . 145 . HE# . . c17360_2l7l 3 99 1 OR . 1 1 145 145 MET ME H . . . 2 2 2 2 LYS HD2 H . . . . . 6.0 1.8 6.0 . . . . . A . 145 MET ME . . B . 300 LYS HD2 . . . 145 . HE# . . . . . 300 . HD# . . c17360_2l7l 3 99 2 OR . 2 2 2 2 LYS HD3 H . . . 1 1 145 145 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 300 LYS HD3 . . A . 145 MET ME . . . 300 . HD# . . . . . 145 . HE# . . c17360_2l7l 3 100 1 OR . 1 1 145 145 MET ME H . . . 2 2 2 2 LYS HB2 H . . . . . 6.0 1.8 6.0 . . . . . A . 145 MET ME . . B . 300 LYS HB2 . . . 145 . HE# . . . . . 300 . HB# . . c17360_2l7l 3 100 2 OR . 2 2 2 2 LYS HB3 H . . . 1 1 145 145 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 300 LYS HB3 . . A . 145 MET ME . . . 300 . HB# . . . . . 145 . HE# . . c17360_2l7l 3 101 1 OR . 1 1 145 145 MET ME H . . . 2 2 5 5 TRP HB3 H . . . . . 6.0 1.8 6.0 . . . . . A . 145 MET ME . . B . 303 TRP HB3 . . . 145 . HE# . . . . . 303 . HB# . . c17360_2l7l 3 101 2 OR . 1 1 145 145 MET ME H . . . 2 2 5 5 TRP HB2 H . . . . . 6.0 1.8 6.0 . . . . . A . 145 MET ME . . B . 303 TRP HB2 . . . 145 . HE# . . . . . 303 . HB# . . c17360_2l7l 3 102 1 . . 2 2 6 6 LYS HA H . . . 1 1 145 145 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 304 LYS HA . . A . 145 MET ME . . . 304 . HA . . . . . 145 . HE# . . c17360_2l7l 3 103 1 OR . 1 1 51 51 MET ME H . . . 2 2 14 14 VAL MG1 H . . . . . 6.0 1.8 6.0 . . . . . A . 51 MET ME . . B . 312 VAL MG1 . . . 51 . HE# . . . . . 312 . HG## . . c17360_2l7l 3 103 2 OR . 2 2 14 14 VAL MG2 H . . . 1 1 51 51 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 312 VAL MG2 . . A . 51 MET ME . . . 312 . HG## . . . . . 51 . HE# . . c17360_2l7l 3 104 1 . . 2 2 15 15 VAL MG1 H . . . 1 1 51 51 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 313 VAL MG1 . . A . 51 MET ME . . . 313 . HG1# . . . . . 51 . HE# . . c17360_2l7l 3 105 1 OR . 1 1 51 51 MET ME H . . . 2 2 21 21 LEU HB2 H . . . . . 6.0 1.8 6.0 . . . . . A . 51 MET ME . . B . 319 LEU HB2 . . . 51 . HE# . . . . . 319 . HB# . . c17360_2l7l 3 105 2 OR . 2 2 21 21 LEU HB3 H . . . 1 1 51 51 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 319 LEU HB3 . . A . 51 MET ME . . . 319 . HB# . . . . . 51 . HE# . . c17360_2l7l 3 106 1 OR . 1 1 51 51 MET ME H . . . 2 2 17 17 HIS HB2 H . . . . . 6.0 1.8 6.0 . . . . . A . 51 MET ME . . B . 315 HIS HB2 . . . 51 . HE# . . . . . 315 . HB# . . c17360_2l7l 3 106 2 OR . 2 2 17 17 HIS HB3 H . . . 1 1 51 51 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 315 HIS HB3 . . A . 51 MET ME . . . 315 . HB# . . . . . 51 . HE# . . c17360_2l7l 3 107 1 OR . 1 1 51 51 MET ME H . . . 2 2 19 19 ARG HD2 H . . . . . 6.0 1.8 6.0 . . . . . A . 51 MET ME . . B . 317 ARG HD2 . . . 51 . HE# . . . . . 317 . HD# . . c17360_2l7l 3 107 2 OR . 2 2 19 19 ARG HD3 H . . . 1 1 51 51 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 317 ARG HD3 . . A . 51 MET ME . . . 317 . HD# . . . . . 51 . HE# . . c17360_2l7l 3 108 1 . . 2 2 17 17 HIS HA H . . . 1 1 51 51 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 315 HIS HA . . A . 51 MET ME . . . 315 . HA . . . . . 51 . HE# . . c17360_2l7l 3 109 1 . . 2 2 14 14 VAL HB H . . . 1 1 71 71 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 312 VAL HB . . A . 71 MET ME . . . 312 . HB . . . . . 71 . HE# . . c17360_2l7l 3 110 1 . . 1 1 71 71 MET ME H . . . 2 2 18 18 MET HG3 H . . . . . 6.0 1.8 6.0 . . . . . A . 71 MET ME . . B . 316 MET HG3 . . . 71 . HE# . . . . . 316 . HG1 . . c17360_2l7l 3 111 1 OR . 1 1 72 72 MET ME H . . . 2 2 16 16 ARG HG2 H . . . . . 6.0 1.8 6.0 . . . . . A . 72 MET ME . . B . 314 ARG HG2 . . . 72 . HE# . . . . . 314 . HG# . . c17360_2l7l 3 111 2 OR . 2 2 16 16 ARG HG3 H . . . 1 1 72 72 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 314 ARG HG3 . . A . 72 MET ME . . . 314 . HG# . . . . . 72 . HE# . . c17360_2l7l 3 112 1 . . 1 1 109 109 MET ME H . . . 1 1 109 109 MET HA H . . . . . 6.0 1.8 6.0 . . . . . A . 109 MET ME . . A . 109 MET HA . . . 109 . HE# . . . . . 109 . HA . . c17360_2l7l 3 113 1 OR . 1 1 144 144 MET ME H . . . 2 2 2 2 LYS HB2 H . . . . . 6.0 1.8 6.0 . . . . . A . 144 MET ME . . B . 300 LYS HB2 . . . 144 . HE# . . . . . 300 . HB# . . c17360_2l7l 3 113 2 OR . 2 2 2 2 LYS HB3 H . . . 1 1 144 144 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 300 LYS HB3 . . A . 144 MET ME . . . 300 . HB# . . . . . 144 . HE# . . c17360_2l7l 3 114 1 . . 2 2 2 2 LYS HA H . . . 1 1 144 144 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 300 LYS HA . . A . 144 MET ME . . . 300 . HA . . . . . 144 . HE# . . c17360_2l7l 3 115 1 . . 2 2 5 5 TRP HD1 H . . . 1 1 144 144 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 303 TRP HD1 . . A . 144 MET ME . . . 303 . HD1 . . . . . 144 . HE# . . c17360_2l7l 3 116 1 . . 2 2 5 5 TRP HD1 H . . . 1 1 124 124 MET ME H . . . . . 6.0 1.8 6.0 . . . . . B . 303 TRP HD1 . . A . 124 MET ME . . . 303 . HD1 . . . . . 124 . HE# . . c17360_2l7l 3 stop_ loop_ _Gen_dist_constraint_parse_err.ID _Gen_dist_constraint_parse_err.Content _Gen_dist_constraint_parse_err.Begin_line _Gen_dist_constraint_parse_err.Begin_column _Gen_dist_constraint_parse_err.End_line _Gen_dist_constraint_parse_err.End_column _Gen_dist_constraint_parse_err.Entry_ID _Gen_dist_constraint_parse_err.Gen_dist_constraint_list_ID 1 ; ##################################################################################### ################################INTERMOLECULAR NOES################################## #################################################################################### ; 1 1 3 84 c17360_2l7l 3 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_3 _Gen_dist_constraint_list.Entry_ID c17360_2l7l _Gen_dist_constraint_list.ID 1 _Gen_dist_constraint_list.Constraint_type 'hydrogen bond' _Gen_dist_constraint_list.Details 'Generated by Wattos' _Gen_dist_constraint_list.Constraint_file_ID 1 _Gen_dist_constraint_list.Block_ID 3 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 . . . . c17360_2l7l 4 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 27 27 ILE H H . . . 1 1 63 63 ILE O O . . . . . 2.1 0.0 2.1 . . . . . A . 27 ILE H . . A . 63 ILE O . . . 27 . HN . . . . . 63 . O . . c17360_2l7l 4 2 1 . . 1 1 63 63 ILE O O . . . 1 1 27 27 ILE N N . . . . . 3.1 0.0 3.1 . . . . . A . 63 ILE O . . A . 27 ILE N . . . 63 . O . . . . . 27 . N . . c17360_2l7l 4 3 1 . . 1 1 63 63 ILE H H . . . 1 1 27 27 ILE O O . . . . . 2.1 0.0 2.1 . . . . . A . 63 ILE H . . A . 27 ILE O . . . 63 . HN . . . . . 27 . O . . c17360_2l7l 4 4 1 . . 1 1 27 27 ILE O O . . . 1 1 63 63 ILE N N . . . . . 3.1 0.0 3.1 . . . . . A . 27 ILE O . . A . 63 ILE N . . . 27 . O . . . . . 63 . N . . c17360_2l7l 4 5 1 . . 1 1 6 6 GLU O O . . . 1 1 10 10 ALA H H . . . . . 2.1 0.0 2.1 . . . . . A . 6 GLU O . . A . 10 ALA H . . . 6 . O . . . . . 10 . HN . . c17360_2l7l 4 6 1 . . 1 1 6 6 GLU O O . . . 1 1 10 10 ALA N N . . . . . 3.1 0.0 3.1 . . . . . A . 6 GLU O . . A . 10 ALA N . . . 6 . O . . . . . 10 . N . . c17360_2l7l 4 7 1 . . 1 1 7 7 GLU O O . . . 1 1 11 11 GLU H H . . . . . 2.1 0.0 2.1 . . . . . A . 7 GLU O . . A . 11 GLU H . . . 7 . O . . . . . 11 . HN . . c17360_2l7l 4 8 1 . . 1 1 7 7 GLU O O . . . 1 1 11 11 GLU N N . . . . . 3.1 0.0 3.1 . . . . . A . 7 GLU O . . A . 11 GLU N . . . 7 . O . . . . . 11 . N . . c17360_2l7l 4 9 1 . . 1 1 8 8 GLN O O . . . 1 1 12 12 PHE H H . . . . . 2.1 0.0 2.1 . . . . . A . 8 GLN O . . A . 12 PHE H . . . 8 . O . . . . . 12 . HN . . c17360_2l7l 4 10 1 . . 1 1 8 8 GLN O O . . . 1 1 12 12 PHE N N . . . . . 3.1 0.0 3.1 . . . . . A . 8 GLN O . . A . 12 PHE N . . . 8 . O . . . . . 12 . N . . c17360_2l7l 4 11 1 . . 1 1 9 9 ILE O O . . . 1 1 13 13 LYS H H . . . . . 2.1 0.0 2.1 . . . . . A . 9 ILE O . . A . 13 LYS H . . . 9 . O . . . . . 13 . HN . . c17360_2l7l 4 12 1 . . 1 1 9 9 ILE O O . . . 1 1 13 13 LYS N N . . . . . 3.1 0.0 3.1 . . . . . A . 9 ILE O . . A . 13 LYS N . . . 9 . O . . . . . 13 . N . . c17360_2l7l 4 13 1 . . 1 1 10 10 ALA O O . . . 1 1 14 14 GLU H H . . . . . 2.1 0.0 2.1 . . . . . A . 10 ALA O . . A . 14 GLU H . . . 10 . O . . . . . 14 . HN . . c17360_2l7l 4 14 1 . . 1 1 10 10 ALA O O . . . 1 1 14 14 GLU N N . . . . . 3.1 0.0 3.1 . . . . . A . 10 ALA O . . A . 14 GLU N . . . 10 . O . . . . . 14 . N . . c17360_2l7l 4 15 1 . . 1 1 11 11 GLU O O . . . 1 1 15 15 ALA H H . . . . . 2.1 0.0 2.1 . . . . . A . 11 GLU O . . A . 15 ALA H . . . 11 . O . . . . . 15 . HN . . c17360_2l7l 4 16 1 . . 1 1 11 11 GLU O O . . . 1 1 15 15 ALA N N . . . . . 3.1 0.0 3.1 . . . . . A . 11 GLU O . . A . 15 ALA N . . . 11 . O . . . . . 15 . N . . c17360_2l7l 4 17 1 . . 1 1 12 12 PHE O O . . . 1 1 16 16 PHE H H . . . . . 2.1 0.0 2.1 . . . . . A . 12 PHE O . . A . 16 PHE H . . . 12 . O . . . . . 16 . HN . . c17360_2l7l 4 18 1 . . 1 1 12 12 PHE O O . . . 1 1 16 16 PHE N N . . . . . 3.1 0.0 3.1 . . . . . A . 12 PHE O . . A . 16 PHE N . . . 12 . O . . . . . 16 . N . . c17360_2l7l 4 19 1 . . 1 1 13 13 LYS O O . . . 1 1 17 17 SER H H . . . . . 2.1 0.0 2.1 . . . . . A . 13 LYS O . . A . 17 SER H . . . 13 . O . . . . . 17 . HN . . c17360_2l7l 4 20 1 . . 1 1 13 13 LYS O O . . . 1 1 17 17 SER N N . . . . . 3.1 0.0 3.1 . . . . . A . 13 LYS O . . A . 17 SER N . . . 13 . O . . . . . 17 . N . . c17360_2l7l 4 21 1 . . 1 1 14 14 GLU O O . . . 1 1 18 18 LEU H H . . . . . 2.1 0.0 2.1 . . . . . A . 14 GLU O . . A . 18 LEU H . . . 14 . O . . . . . 18 . HN . . c17360_2l7l 4 22 1 . . 1 1 14 14 GLU O O . . . 1 1 18 18 LEU N N . . . . . 3.1 0.0 3.1 . . . . . A . 14 GLU O . . A . 18 LEU N . . . 14 . O . . . . . 18 . N . . c17360_2l7l 4 23 1 . . 1 1 15 15 ALA O O . . . 1 1 19 19 PHE H H . . . . . 2.1 0.0 2.1 . . . . . A . 15 ALA O . . A . 19 PHE H . . . 15 . O . . . . . 19 . HN . . c17360_2l7l 4 24 1 . . 1 1 15 15 ALA O O . . . 1 1 19 19 PHE N N . . . . . 3.1 0.0 3.1 . . . . . A . 15 ALA O . . A . 19 PHE N . . . 15 . O . . . . . 19 . N . . c17360_2l7l 4 25 1 . . 1 1 29 29 THR O O . . . 1 1 33 33 GLY H H . . . . . 2.1 0.0 2.1 . . . . . A . 29 THR O . . A . 33 GLY H . . . 29 . O . . . . . 33 . HN . . c17360_2l7l 4 26 1 . . 1 1 29 29 THR O O . . . 1 1 33 33 GLY N N . . . . . 3.1 0.0 3.1 . . . . . A . 29 THR O . . A . 33 GLY N . . . 29 . O . . . . . 33 . N . . c17360_2l7l 4 27 1 . . 1 1 30 30 LYS O O . . . 1 1 34 34 THR H H . . . . . 2.1 0.0 2.1 . . . . . A . 30 LYS O . . A . 34 THR H . . . 30 . O . . . . . 34 . HN . . c17360_2l7l 4 28 1 . . 1 1 30 30 LYS O O . . . 1 1 34 34 THR N N . . . . . 3.1 0.0 3.1 . . . . . A . 30 LYS O . . A . 34 THR N . . . 30 . O . . . . . 34 . N . . c17360_2l7l 4 29 1 . . 1 1 31 31 GLU O O . . . 1 1 35 35 VAL H H . . . . . 2.1 0.0 2.1 . . . . . A . 31 GLU O . . A . 35 VAL H . . . 31 . O . . . . . 35 . HN . . c17360_2l7l 4 30 1 . . 1 1 31 31 GLU O O . . . 1 1 35 35 VAL N N . . . . . 3.1 0.0 3.1 . . . . . A . 31 GLU O . . A . 35 VAL N . . . 31 . O . . . . . 35 . N . . c17360_2l7l 4 31 1 . . 1 1 32 32 LEU O O . . . 1 1 36 36 MET H H . . . . . 2.1 0.0 2.1 . . . . . A . 32 LEU O . . A . 36 MET H . . . 32 . O . . . . . 36 . HN . . c17360_2l7l 4 32 1 . . 1 1 32 32 LEU O O . . . 1 1 36 36 MET N N . . . . . 3.1 0.0 3.1 . . . . . A . 32 LEU O . . A . 36 MET N . . . 32 . O . . . . . 36 . N . . c17360_2l7l 4 33 1 . . 1 1 33 33 GLY O O . . . 1 1 37 37 ARG H H . . . . . 2.1 0.0 2.1 . . . . . A . 33 GLY O . . A . 37 ARG H . . . 33 . O . . . . . 37 . HN . . c17360_2l7l 4 34 1 . . 1 1 33 33 GLY O O . . . 1 1 37 37 ARG N N . . . . . 3.1 0.0 3.1 . . . . . A . 33 GLY O . . A . 37 ARG N . . . 33 . O . . . . . 37 . N . . c17360_2l7l 4 35 1 . . 1 1 34 34 THR O O . . . 1 1 38 38 SER H H . . . . . 2.1 0.0 2.1 . . . . . A . 34 THR O . . A . 38 SER H . . . 34 . O . . . . . 38 . HN . . c17360_2l7l 4 36 1 . . 1 1 34 34 THR O O . . . 1 1 38 38 SER N N . . . . . 3.1 0.0 3.1 . . . . . A . 34 THR O . . A . 38 SER N . . . 34 . O . . . . . 38 . N . . c17360_2l7l 4 37 1 . . 1 1 45 45 GLU O O . . . 1 1 49 49 GLN H H . . . . . 2.1 0.0 2.1 . . . . . A . 45 GLU O . . A . 49 GLN H . . . 45 . O . . . . . 49 . HN . . c17360_2l7l 4 38 1 . . 1 1 45 45 GLU O O . . . 1 1 49 49 GLN N N . . . . . 3.1 0.0 3.1 . . . . . A . 45 GLU O . . A . 49 GLN N . . . 45 . O . . . . . 49 . N . . c17360_2l7l 4 39 1 . . 1 1 46 46 ALA O O . . . 1 1 50 50 ASP H H . . . . . 2.1 0.0 2.1 . . . . . A . 46 ALA O . . A . 50 ASP H . . . 46 . O . . . . . 50 . HN . . c17360_2l7l 4 40 1 . . 1 1 46 46 ALA O O . . . 1 1 50 50 ASP N N . . . . . 3.1 0.0 3.1 . . . . . A . 46 ALA O . . A . 50 ASP N . . . 46 . O . . . . . 50 . N . . c17360_2l7l 4 41 1 . . 1 1 47 47 GLU O O . . . 1 1 51 51 MET H H . . . . . 2.1 0.0 2.1 . . . . . A . 47 GLU O . . A . 51 MET H . . . 47 . O . . . . . 51 . HN . . c17360_2l7l 4 42 1 . . 1 1 47 47 GLU O O . . . 1 1 51 51 MET N N . . . . . 3.1 0.0 3.1 . . . . . A . 47 GLU O . . A . 51 MET N . . . 47 . O . . . . . 51 . N . . c17360_2l7l 4 43 1 . . 1 1 48 48 LEU O O . . . 1 1 52 52 ILE H H . . . . . 2.1 0.0 2.1 . . . . . A . 48 LEU O . . A . 52 ILE H . . . 48 . O . . . . . 52 . HN . . c17360_2l7l 4 44 1 . . 1 1 48 48 LEU O O . . . 1 1 52 52 ILE N N . . . . . 3.1 0.0 3.1 . . . . . A . 48 LEU O . . A . 52 ILE N . . . 48 . O . . . . . 52 . N . . c17360_2l7l 4 45 1 . . 1 1 49 49 GLN O O . . . 1 1 53 53 ASN H H . . . . . 2.1 0.0 2.1 . . . . . A . 49 GLN O . . A . 53 ASN H . . . 49 . O . . . . . 53 . HN . . c17360_2l7l 4 46 1 . . 1 1 49 49 GLN O O . . . 1 1 53 53 ASN N N . . . . . 3.1 0.0 3.1 . . . . . A . 49 GLN O . . A . 53 ASN N . . . 49 . O . . . . . 53 . N . . c17360_2l7l 4 47 1 . . 1 1 50 50 ASP O O . . . 1 1 54 54 GLU H H . . . . . 2.1 0.0 2.1 . . . . . A . 50 ASP O . . A . 54 GLU H . . . 50 . O . . . . . 54 . HN . . c17360_2l7l 4 48 1 . . 1 1 50 50 ASP O O . . . 1 1 54 54 GLU N N . . . . . 3.1 0.0 3.1 . . . . . A . 50 ASP O . . A . 54 GLU N . . . 50 . O . . . . . 54 . N . . c17360_2l7l 4 49 1 . . 1 1 65 65 PHE O O . . . 1 1 69 69 LEU H H . . . . . 2.1 0.0 2.1 . . . . . A . 65 PHE O . . A . 69 LEU H . . . 65 . O . . . . . 69 . HN . . c17360_2l7l 4 50 1 . . 1 1 65 65 PHE O O . . . 1 1 69 69 LEU N N . . . . . 3.1 0.0 3.1 . . . . . A . 65 PHE O . . A . 69 LEU N . . . 65 . O . . . . . 69 . N . . c17360_2l7l 4 51 1 . . 1 1 66 66 PRO O O . . . 1 1 70 70 THR H H . . . . . 2.1 0.0 2.1 . . . . . A . 66 PRO O . . A . 70 THR H . . . 66 . O . . . . . 70 . HN . . c17360_2l7l 4 52 1 . . 1 1 66 66 PRO O O . . . 1 1 70 70 THR N N . . . . . 3.1 0.0 3.1 . . . . . A . 66 PRO O . . A . 70 THR N . . . 66 . O . . . . . 70 . N . . c17360_2l7l 4 53 1 . . 1 1 67 67 GLU O O . . . 1 1 71 71 MET H H . . . . . 2.1 0.0 2.1 . . . . . A . 67 GLU O . . A . 71 MET H . . . 67 . O . . . . . 71 . HN . . c17360_2l7l 4 54 1 . . 1 1 67 67 GLU O O . . . 1 1 71 71 MET N N . . . . . 3.1 0.0 3.1 . . . . . A . 67 GLU O . . A . 71 MET N . . . 67 . O . . . . . 71 . N . . c17360_2l7l 4 55 1 . . 1 1 68 68 PHE O O . . . 1 1 72 72 MET H H . . . . . 2.1 0.0 2.1 . . . . . A . 68 PHE O . . A . 72 MET H . . . 68 . O . . . . . 72 . HN . . c17360_2l7l 4 56 1 . . 1 1 68 68 PHE O O . . . 1 1 72 72 MET N N . . . . . 3.1 0.0 3.1 . . . . . A . 68 PHE O . . A . 72 MET N . . . 68 . O . . . . . 72 . N . . c17360_2l7l 4 57 1 . . 1 1 69 69 LEU O O . . . 1 1 73 73 ALA H H . . . . . 2.1 0.0 2.1 . . . . . A . 69 LEU O . . A . 73 ALA H . . . 69 . O . . . . . 73 . HN . . c17360_2l7l 4 58 1 . . 1 1 69 69 LEU O O . . . 1 1 73 73 ALA N N . . . . . 3.1 0.0 3.1 . . . . . A . 69 LEU O . . A . 73 ALA N . . . 69 . O . . . . . 73 . N . . c17360_2l7l 4 59 1 . . 1 1 70 70 THR O O . . . 1 1 74 74 ARG H H . . . . . 2.1 0.0 2.1 . . . . . A . 70 THR O . . A . 74 ARG H . . . 70 . O . . . . . 74 . HN . . c17360_2l7l 4 60 1 . . 1 1 70 70 THR O O . . . 1 1 74 74 ARG N N . . . . . 3.1 0.0 3.1 . . . . . A . 70 THR O . . A . 74 ARG N . . . 70 . O . . . . . 74 . N . . c17360_2l7l 4 61 1 . . 1 1 71 71 MET O O . . . 1 1 75 75 LYS H H . . . . . 2.1 0.0 2.1 . . . . . A . 71 MET O . . A . 75 LYS H . . . 71 . O . . . . . 75 . HN . . c17360_2l7l 4 62 1 . . 1 1 71 71 MET O O . . . 1 1 75 75 LYS N N . . . . . 3.1 0.0 3.1 . . . . . A . 71 MET O . . A . 75 LYS N . . . 71 . O . . . . . 75 . N . . c17360_2l7l 4 63 1 . . 1 1 72 72 MET O O . . . 1 1 76 76 MET H H . . . . . 2.1 0.0 2.1 . . . . . A . 72 MET O . . A . 76 MET H . . . 72 . O . . . . . 76 . HN . . c17360_2l7l 4 64 1 . . 1 1 72 72 MET O O . . . 1 1 76 76 MET N N . . . . . 3.1 0.0 3.1 . . . . . A . 72 MET O . . A . 76 MET N . . . 72 . O . . . . . 76 . N . . c17360_2l7l 4 65 1 . . 1 1 73 73 ALA O O . . . 1 1 77 77 LYS H H . . . . . 2.1 0.0 2.1 . . . . . A . 73 ALA O . . A . 77 LYS H . . . 73 . O . . . . . 77 . HN . . c17360_2l7l 4 66 1 . . 1 1 73 73 ALA O O . . . 1 1 77 77 LYS N N . . . . . 3.1 0.0 3.1 . . . . . A . 73 ALA O . . A . 77 LYS N . . . 73 . O . . . . . 77 . N . . c17360_2l7l 4 67 1 . . 1 1 100 100 ILE H H . . . 1 1 136 136 VAL O O . . . . . 2.1 0.0 2.1 . . . . . A . 100 ILE H . . A . 136 VAL O . . . 100 . HN . . . . . 136 . O . . c17360_2l7l 4 68 1 . . 1 1 136 136 VAL O O . . . 1 1 100 100 ILE N N . . . . . 3.1 0.0 3.1 . . . . . A . 136 VAL O . . A . 100 ILE N . . . 136 . O . . . . . 100 . N . . c17360_2l7l 4 69 1 . . 1 1 136 136 VAL H H . . . 1 1 100 100 ILE O O . . . . . 2.1 0.0 2.1 . . . . . A . 136 VAL H . . A . 100 ILE O . . . 136 . HN . . . . . 100 . O . . c17360_2l7l 4 70 1 . . 1 1 100 100 ILE O O . . . 1 1 136 136 VAL N N . . . . . 3.1 0.0 3.1 . . . . . A . 100 ILE O . . A . 136 VAL N . . . 100 . O . . . . . 136 . N . . c17360_2l7l 4 71 1 . . 1 1 80 80 ASP O O . . . 1 1 84 84 GLU H H . . . . . 2.1 0.0 2.1 . . . . . A . 80 ASP O . . A . 84 GLU H . . . 80 . O . . . . . 84 . HN . . c17360_2l7l 4 72 1 . . 1 1 80 80 ASP O O . . . 1 1 84 84 GLU N N . . . . . 3.1 0.0 3.1 . . . . . A . 80 ASP O . . A . 84 GLU N . . . 80 . O . . . . . 84 . N . . c17360_2l7l 4 73 1 . . 1 1 81 81 SER O O . . . 1 1 85 85 ILE H H . . . . . 2.1 0.0 2.1 . . . . . A . 81 SER O . . A . 85 ILE H . . . 81 . O . . . . . 85 . HN . . c17360_2l7l 4 74 1 . . 1 1 81 81 SER O O . . . 1 1 85 85 ILE N N . . . . . 3.1 0.0 3.1 . . . . . A . 81 SER O . . A . 85 ILE N . . . 81 . O . . . . . 85 . N . . c17360_2l7l 4 75 1 . . 1 1 82 82 GLU O O . . . 1 1 86 86 ARG H H . . . . . 2.1 0.0 2.1 . . . . . A . 82 GLU O . . A . 86 ARG H . . . 82 . O . . . . . 86 . HN . . c17360_2l7l 4 76 1 . . 1 1 82 82 GLU O O . . . 1 1 86 86 ARG N N . . . . . 3.1 0.0 3.1 . . . . . A . 82 GLU O . . A . 86 ARG N . . . 82 . O . . . . . 86 . N . . c17360_2l7l 4 77 1 . . 1 1 83 83 GLU O O . . . 1 1 87 87 GLU H H . . . . . 2.1 0.0 2.1 . . . . . A . 83 GLU O . . A . 87 GLU H . . . 83 . O . . . . . 87 . HN . . c17360_2l7l 4 78 1 . . 1 1 83 83 GLU O O . . . 1 1 87 87 GLU N N . . . . . 3.1 0.0 3.1 . . . . . A . 83 GLU O . . A . 87 GLU N . . . 83 . O . . . . . 87 . N . . c17360_2l7l 4 79 1 . . 1 1 84 84 GLU O O . . . 1 1 88 88 ALA H H . . . . . 2.1 0.0 2.1 . . . . . A . 84 GLU O . . A . 88 ALA H . . . 84 . O . . . . . 88 . HN . . c17360_2l7l 4 80 1 . . 1 1 84 84 GLU O O . . . 1 1 88 88 ALA N N . . . . . 3.1 0.0 3.1 . . . . . A . 84 GLU O . . A . 88 ALA N . . . 84 . O . . . . . 88 . N . . c17360_2l7l 4 81 1 . . 1 1 85 85 ILE O O . . . 1 1 89 89 PHE H H . . . . . 2.1 0.0 2.1 . . . . . A . 85 ILE O . . A . 89 PHE H . . . 85 . O . . . . . 89 . HN . . c17360_2l7l 4 82 1 . . 1 1 85 85 ILE O O . . . 1 1 89 89 PHE N N . . . . . 3.1 0.0 3.1 . . . . . A . 85 ILE O . . A . 89 PHE N . . . 85 . O . . . . . 89 . N . . c17360_2l7l 4 83 1 . . 1 1 86 86 ARG O O . . . 1 1 90 90 ARG H H . . . . . 2.1 0.0 2.1 . . . . . A . 86 ARG O . . A . 90 ARG H . . . 86 . O . . . . . 90 . HN . . c17360_2l7l 4 84 1 . . 1 1 86 86 ARG O O . . . 1 1 90 90 ARG N N . . . . . 3.1 0.0 3.1 . . . . . A . 86 ARG O . . A . 90 ARG N . . . 86 . O . . . . . 90 . N . . c17360_2l7l 4 85 1 . . 1 1 87 87 GLU O O . . . 1 1 91 91 VAL H H . . . . . 2.1 0.0 2.1 . . . . . A . 87 GLU O . . A . 91 VAL H . . . 87 . O . . . . . 91 . HN . . c17360_2l7l 4 86 1 . . 1 1 87 87 GLU O O . . . 1 1 91 91 VAL N N . . . . . 3.1 0.0 3.1 . . . . . A . 87 GLU O . . A . 91 VAL N . . . 87 . O . . . . . 91 . N . . c17360_2l7l 4 87 1 . . 1 1 88 88 ALA O O . . . 1 1 92 92 PHE H H . . . . . 2.1 0.0 2.1 . . . . . A . 88 ALA O . . A . 92 PHE H . . . 88 . O . . . . . 92 . HN . . c17360_2l7l 4 88 1 . . 1 1 88 88 ALA O O . . . 1 1 92 92 PHE N N . . . . . 3.1 0.0 3.1 . . . . . A . 88 ALA O . . A . 92 PHE N . . . 88 . O . . . . . 92 . N . . c17360_2l7l 4 89 1 . . 1 1 102 102 ALA O O . . . 1 1 106 106 ARG H H . . . . . 2.1 0.0 2.1 . . . . . A . 102 ALA O . . A . 106 ARG H . . . 102 . O . . . . . 106 . HN . . c17360_2l7l 4 90 1 . . 1 1 102 102 ALA O O . . . 1 1 106 106 ARG N N . . . . . 3.1 0.0 3.1 . . . . . A . 102 ALA O . . A . 106 ARG N . . . 102 . O . . . . . 106 . N . . c17360_2l7l 4 91 1 . . 1 1 103 103 ALA O O . . . 1 1 107 107 HIS H H . . . . . 2.1 0.0 2.1 . . . . . A . 103 ALA O . . A . 107 HIS H . . . 103 . O . . . . . 107 . HN . . c17360_2l7l 4 92 1 . . 1 1 103 103 ALA O O . . . 1 1 107 107 HIS N N . . . . . 3.1 0.0 3.1 . . . . . A . 103 ALA O . . A . 107 HIS N . . . 103 . O . . . . . 107 . N . . c17360_2l7l 4 93 1 . . 1 1 104 104 GLU O O . . . 1 1 108 108 VAL H H . . . . . 2.1 0.0 2.1 . . . . . A . 104 GLU O . . A . 108 VAL H . . . 104 . O . . . . . 108 . HN . . c17360_2l7l 4 94 1 . . 1 1 104 104 GLU O O . . . 1 1 108 108 VAL N N . . . . . 3.1 0.0 3.1 . . . . . A . 104 GLU O . . A . 108 VAL N . . . 104 . O . . . . . 108 . N . . c17360_2l7l 4 95 1 . . 1 1 105 105 LEU O O . . . 1 1 109 109 MET H H . . . . . 2.1 0.0 2.1 . . . . . A . 105 LEU O . . A . 109 MET H . . . 105 . O . . . . . 109 . HN . . c17360_2l7l 4 96 1 . . 1 1 105 105 LEU O O . . . 1 1 109 109 MET N N . . . . . 3.1 0.0 3.1 . . . . . A . 105 LEU O . . A . 109 MET N . . . 105 . O . . . . . 109 . N . . c17360_2l7l 4 97 1 . . 1 1 106 106 ARG O O . . . 1 1 110 110 THR H H . . . . . 2.1 0.0 2.1 . . . . . A . 106 ARG O . . A . 110 THR H . . . 106 . O . . . . . 110 . HN . . c17360_2l7l 4 98 1 . . 1 1 106 106 ARG O O . . . 1 1 110 110 THR N N . . . . . 3.1 0.0 3.1 . . . . . A . 106 ARG O . . A . 110 THR N . . . 106 . O . . . . . 110 . N . . c17360_2l7l 4 99 1 . . 1 1 107 107 HIS O O . . . 1 1 111 111 ASN H H . . . . . 2.1 0.0 2.1 . . . . . A . 107 HIS O . . A . 111 ASN H . . . 107 . O . . . . . 111 . HN . . c17360_2l7l 4 100 1 . . 1 1 107 107 HIS O O . . . 1 1 111 111 ASN N N . . . . . 3.1 0.0 3.1 . . . . . A . 107 HIS O . . A . 111 ASN N . . . 107 . O . . . . . 111 . N . . c17360_2l7l 4 101 1 . . 1 1 118 118 ASP O O . . . 1 1 122 122 ASP H H . . . . . 2.1 0.0 2.1 . . . . . A . 118 ASP O . . A . 122 ASP H . . . 118 . O . . . . . 122 . HN . . c17360_2l7l 4 102 1 . . 1 1 118 118 ASP O O . . . 1 1 122 122 ASP N N . . . . . 3.1 0.0 3.1 . . . . . A . 118 ASP O . . A . 122 ASP N . . . 118 . O . . . . . 122 . N . . c17360_2l7l 4 103 1 . . 1 1 119 119 GLU O O . . . 1 1 123 123 GLU H H . . . . . 2.1 0.0 2.1 . . . . . A . 119 GLU O . . A . 123 GLU H . . . 119 . O . . . . . 123 . HN . . c17360_2l7l 4 104 1 . . 1 1 119 119 GLU O O . . . 1 1 123 123 GLU N N . . . . . 3.1 0.0 3.1 . . . . . A . 119 GLU O . . A . 123 GLU N . . . 119 . O . . . . . 123 . N . . c17360_2l7l 4 105 1 . . 1 1 120 120 GLU O O . . . 1 1 124 124 MET H H . . . . . 2.1 0.0 2.1 . . . . . A . 120 GLU O . . A . 124 MET H . . . 120 . O . . . . . 124 . HN . . c17360_2l7l 4 106 1 . . 1 1 120 120 GLU O O . . . 1 1 124 124 MET N N . . . . . 3.1 0.0 3.1 . . . . . A . 120 GLU O . . A . 124 MET N . . . 120 . O . . . . . 124 . N . . c17360_2l7l 4 107 1 . . 1 1 121 121 VAL O O . . . 1 1 125 125 ILE H H . . . . . 2.1 0.0 2.1 . . . . . A . 121 VAL O . . A . 125 ILE H . . . 121 . O . . . . . 125 . HN . . c17360_2l7l 4 108 1 . . 1 1 121 121 VAL O O . . . 1 1 125 125 ILE N N . . . . . 3.1 0.0 3.1 . . . . . A . 121 VAL O . . A . 125 ILE N . . . 121 . O . . . . . 125 . N . . c17360_2l7l 4 109 1 . . 1 1 122 122 ASP O O . . . 1 1 126 126 ARG H H . . . . . 2.1 0.0 2.1 . . . . . A . 122 ASP O . . A . 126 ARG H . . . 122 . O . . . . . 126 . HN . . c17360_2l7l 4 110 1 . . 1 1 122 122 ASP O O . . . 1 1 126 126 ARG N N . . . . . 3.1 0.0 3.1 . . . . . A . 122 ASP O . . A . 126 ARG N . . . 122 . O . . . . . 126 . N . . c17360_2l7l 4 111 1 . . 1 1 123 123 GLU O O . . . 1 1 127 127 GLU H H . . . . . 2.1 0.0 2.1 . . . . . A . 123 GLU O . . A . 127 GLU H . . . 123 . O . . . . . 127 . HN . . c17360_2l7l 4 112 1 . . 1 1 123 123 GLU O O . . . 1 1 127 127 GLU N N . . . . . 3.1 0.0 3.1 . . . . . A . 123 GLU O . . A . 127 GLU N . . . 123 . O . . . . . 127 . N . . c17360_2l7l 4 113 1 . . 1 1 138 138 TYR O O . . . 1 1 142 142 VAL H H . . . . . 2.1 0.0 2.1 . . . . . A . 138 TYR O . . A . 142 VAL H . . . 138 . O . . . . . 142 . HN . . c17360_2l7l 4 114 1 . . 1 1 138 138 TYR O O . . . 1 1 142 142 VAL N N . . . . . 3.1 0.0 3.1 . . . . . A . 138 TYR O . . A . 142 VAL N . . . 138 . O . . . . . 142 . N . . c17360_2l7l 4 115 1 . . 1 1 139 139 GLU O O . . . 1 1 143 143 GLN H H . . . . . 2.1 0.0 2.1 . . . . . A . 139 GLU O . . A . 143 GLN H . . . 139 . O . . . . . 143 . HN . . c17360_2l7l 4 116 1 . . 1 1 139 139 GLU O O . . . 1 1 143 143 GLN N N . . . . . 3.1 0.0 3.1 . . . . . A . 139 GLU O . . A . 143 GLN N . . . 139 . O . . . . . 143 . N . . c17360_2l7l 4 117 1 . . 1 1 140 140 GLU O O . . . 1 1 144 144 MET H H . . . . . 2.1 0.0 2.1 . . . . . A . 140 GLU O . . A . 144 MET H . . . 140 . O . . . . . 144 . HN . . c17360_2l7l 4 118 1 . . 1 1 140 140 GLU O O . . . 1 1 144 144 MET N N . . . . . 3.1 0.0 3.1 . . . . . A . 140 GLU O . . A . 144 MET N . . . 140 . O . . . . . 144 . N . . c17360_2l7l 4 119 1 . . 2 2 7 7 GLN H H . . . 2 2 3 3 SER O O . . . . . 2.1 0.0 2.1 . . . . . B . 305 GLN H . . B . 301 SER O . . . 305 . HN . . . . . 301 . O . . c17360_2l7l 4 120 1 . . 2 2 3 3 SER O O . . . 2 2 7 7 GLN N N . . . . . 3.1 0.0 3.1 . . . . . B . 301 SER O . . B . 305 GLN N . . . 301 . O . . . . . 305 . N . . c17360_2l7l 4 121 1 . . 2 2 8 8 ALA H H . . . 2 2 4 4 LYS O O . . . . . 2.1 0.0 2.1 . . . . . B . 306 ALA H . . B . 302 LYS O . . . 306 . HN . . . . . 302 . O . . c17360_2l7l 4 122 1 . . 2 2 4 4 LYS O O . . . 2 2 8 8 ALA N N . . . . . 3.1 0.0 3.1 . . . . . B . 302 LYS O . . B . 306 ALA N . . . 302 . O . . . . . 306 . N . . c17360_2l7l 4 123 1 . . 2 2 9 9 PHE H H . . . 2 2 5 5 TRP O O . . . . . 2.1 0.0 2.1 . . . . . B . 307 PHE H . . B . 303 TRP O . . . 307 . HN . . . . . 303 . O . . c17360_2l7l 4 124 1 . . 2 2 5 5 TRP O O . . . 2 2 9 9 PHE N N . . . . . 3.1 0.0 3.1 . . . . . B . 303 TRP O . . B . 307 PHE N . . . 303 . O . . . . . 307 . N . . c17360_2l7l 4 125 1 . . 2 2 10 10 ASN H H . . . 2 2 6 6 LYS O O . . . . . 2.1 0.0 2.1 . . . . . B . 308 ASN H . . B . 304 LYS O . . . 308 . HN . . . . . 304 . O . . c17360_2l7l 4 126 1 . . 2 2 6 6 LYS O O . . . 2 2 10 10 ASN N N . . . . . 3.1 0.0 3.1 . . . . . B . 304 LYS O . . B . 308 ASN N . . . 304 . O . . . . . 308 . N . . c17360_2l7l 4 127 1 . . 2 2 11 11 ALA H H . . . 2 2 7 7 GLN O O . . . . . 2.1 0.0 2.1 . . . . . B . 309 ALA H . . B . 305 GLN O . . . 309 . HN . . . . . 305 . O . . c17360_2l7l 4 128 1 . . 2 2 7 7 GLN O O . . . 2 2 11 11 ALA N N . . . . . 3.1 0.0 3.1 . . . . . B . 305 GLN O . . B . 309 ALA N . . . 305 . O . . . . . 309 . N . . c17360_2l7l 4 129 1 . . 2 2 12 12 THR H H . . . 2 2 8 8 ALA O O . . . . . 2.1 0.0 2.1 . . . . . B . 310 THR H . . B . 306 ALA O . . . 310 . HN . . . . . 306 . O . . c17360_2l7l 4 130 1 . . 2 2 8 8 ALA O O . . . 2 2 12 12 THR N N . . . . . 3.1 0.0 3.1 . . . . . B . 306 ALA O . . B . 310 THR N . . . 306 . O . . . . . 310 . N . . c17360_2l7l 4 131 1 . . 2 2 13 13 ALA H H . . . 2 2 9 9 PHE O O . . . . . 2.1 0.0 2.1 . . . . . B . 311 ALA H . . B . 307 PHE O . . . 311 . HN . . . . . 307 . O . . c17360_2l7l 4 132 1 . . 2 2 9 9 PHE O O . . . 2 2 13 13 ALA N N . . . . . 3.1 0.0 3.1 . . . . . B . 307 PHE O . . B . 311 ALA N . . . 307 . O . . . . . 311 . N . . c17360_2l7l 4 133 1 . . 2 2 14 14 VAL H H . . . 2 2 10 10 ASN O O . . . . . 2.1 0.0 2.1 . . . . . B . 312 VAL H . . B . 308 ASN O . . . 312 . HN . . . . . 308 . O . . c17360_2l7l 4 134 1 . . 2 2 10 10 ASN O O . . . 2 2 14 14 VAL N N . . . . . 3.1 0.0 3.1 . . . . . B . 308 ASN O . . B . 312 VAL N . . . 308 . O . . . . . 312 . N . . c17360_2l7l 4 135 1 . . 2 2 15 15 VAL H H . . . 2 2 11 11 ALA O O . . . . . 2.1 0.0 2.1 . . . . . B . 313 VAL H . . B . 309 ALA O . . . 313 . HN . . . . . 309 . O . . c17360_2l7l 4 136 1 . . 2 2 11 11 ALA O O . . . 2 2 15 15 VAL N N . . . . . 3.1 0.0 3.1 . . . . . B . 309 ALA O . . B . 313 VAL N . . . 309 . O . . . . . 313 . N . . c17360_2l7l 4 137 1 . . 2 2 16 16 ARG H H . . . 2 2 12 12 THR O O . . . . . 2.1 0.0 2.1 . . . . . B . 314 ARG H . . B . 310 THR O . . . 314 . HN . . . . . 310 . O . . c17360_2l7l 4 138 1 . . 2 2 12 12 THR O O . . . 2 2 16 16 ARG N N . . . . . 3.1 0.0 3.1 . . . . . B . 310 THR O . . B . 314 ARG N . . . 310 . O . . . . . 314 . N . . c17360_2l7l 4 139 1 . . 2 2 17 17 HIS H H . . . 2 2 13 13 ALA O O . . . . . 2.1 0.0 2.1 . . . . . B . 315 HIS H . . B . 311 ALA O . . . 315 . HN . . . . . 311 . O . . c17360_2l7l 4 140 1 . . 2 2 13 13 ALA O O . . . 2 2 17 17 HIS N N . . . . . 3.1 0.0 3.1 . . . . . B . 311 ALA O . . B . 315 HIS N . . . 311 . O . . . . . 315 . N . . c17360_2l7l 4 141 1 . . 2 2 18 18 MET H H . . . 2 2 14 14 VAL O O . . . . . 2.1 0.0 2.1 . . . . . B . 316 MET H . . B . 312 VAL O . . . 316 . HN . . . . . 312 . O . . c17360_2l7l 4 142 1 . . 2 2 14 14 VAL O O . . . 2 2 18 18 MET N N . . . . . 3.1 0.0 3.1 . . . . . B . 312 VAL O . . B . 316 MET N . . . 312 . O . . . . . 316 . N . . c17360_2l7l 4 143 1 . . 2 2 19 19 ARG H H . . . 2 2 15 15 VAL O O . . . . . 2.1 0.0 2.1 . . . . . B . 317 ARG H . . B . 313 VAL O . . . 317 . HN . . . . . 313 . O . . c17360_2l7l 4 144 1 . . 2 2 15 15 VAL O O . . . 2 2 19 19 ARG N N . . . . . 3.1 0.0 3.1 . . . . . B . 313 VAL O . . B . 317 ARG N . . . 313 . O . . . . . 317 . N . . c17360_2l7l 4 stop_ loop_ _Gen_dist_constraint_parse_err.ID _Gen_dist_constraint_parse_err.Content _Gen_dist_constraint_parse_err.Begin_line _Gen_dist_constraint_parse_err.Begin_column _Gen_dist_constraint_parse_err.End_line _Gen_dist_constraint_parse_err.End_column _Gen_dist_constraint_parse_err.Entry_ID _Gen_dist_constraint_parse_err.Gen_dist_constraint_list_ID 1 ; ############################################################################ ############################################################################## ############################################################################## #################################################################################### ############################CaM H-BONDING RESTRAINTS############################ ################################################################################## ; 1 1 6 82 c17360_2l7l 4 2 ; ################################################################################## ##########################PEPTIDE H-BONDING RESTRAINTS############################ #################################################################################### ; 125 1 127 84 c17360_2l7l 4 stop_ save_ save_CNS/XPLOR_dihedral_2 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_2 _Torsion_angle_constraint_list.Entry_ID c17360_2l7l _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Details 'Generated by Wattos' _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 2 loop_ _Torsion_angle_constraint_software.Software_ID _Torsion_angle_constraint_software.Software_label _Torsion_angle_constraint_software.Method_ID _Torsion_angle_constraint_software.Method_label _Torsion_angle_constraint_software.Entry_ID _Torsion_angle_constraint_software.Torsion_angle_constraint_list_ID . . . . c17360_2l7l 1 stop_ loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Assembly_atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Seq_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Atom_type_1 _Torsion_angle_constraint.Resonance_ID_1 _Torsion_angle_constraint.Assembly_atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Seq_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Atom_type_2 _Torsion_angle_constraint.Resonance_ID_2 _Torsion_angle_constraint.Assembly_atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Seq_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Atom_type_3 _Torsion_angle_constraint.Resonance_ID_3 _Torsion_angle_constraint.Assembly_atom_ID_4 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Seq_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Atom_type_4 _Torsion_angle_constraint.Resonance_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Source_experiment_ID _Torsion_angle_constraint.PDB_record_ID_1 _Torsion_angle_constraint.PDB_model_num_1 _Torsion_angle_constraint.PDB_strand_ID_1 _Torsion_angle_constraint.PDB_ins_code_1 _Torsion_angle_constraint.PDB_residue_no_1 _Torsion_angle_constraint.PDB_residue_name_1 _Torsion_angle_constraint.PDB_atom_name_1 _Torsion_angle_constraint.PDB_record_ID_2 _Torsion_angle_constraint.PDB_model_num_2 _Torsion_angle_constraint.PDB_strand_ID_2 _Torsion_angle_constraint.PDB_ins_code_2 _Torsion_angle_constraint.PDB_residue_no_2 _Torsion_angle_constraint.PDB_residue_name_2 _Torsion_angle_constraint.PDB_atom_name_2 _Torsion_angle_constraint.PDB_record_ID_3 _Torsion_angle_constraint.PDB_model_num_3 _Torsion_angle_constraint.PDB_strand_ID_3 _Torsion_angle_constraint.PDB_ins_code_3 _Torsion_angle_constraint.PDB_residue_no_3 _Torsion_angle_constraint.PDB_residue_name_3 _Torsion_angle_constraint.PDB_atom_name_3 _Torsion_angle_constraint.PDB_record_ID_4 _Torsion_angle_constraint.PDB_model_num_4 _Torsion_angle_constraint.PDB_strand_ID_4 _Torsion_angle_constraint.PDB_ins_code_4 _Torsion_angle_constraint.PDB_residue_no_4 _Torsion_angle_constraint.PDB_residue_name_4 _Torsion_angle_constraint.PDB_atom_name_4 _Torsion_angle_constraint.Auth_entity_assembly_ID_1 _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_chain_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_alt_ID_1 _Torsion_angle_constraint.Auth_atom_name_1 _Torsion_angle_constraint.Auth_entity_assembly_ID_2 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_chain_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_alt_ID_2 _Torsion_angle_constraint.Auth_atom_name_2 _Torsion_angle_constraint.Auth_entity_assembly_ID_3 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_chain_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_alt_ID_3 _Torsion_angle_constraint.Auth_atom_name_3 _Torsion_angle_constraint.Auth_entity_assembly_ID_4 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_chain_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Auth_alt_ID_4 _Torsion_angle_constraint.Auth_atom_name_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . . 1 1 1 1 ALA N N . . 1 1 1 1 ALA CA C . . 1 1 1 1 ALA C C . . 1 1 2 2 ASP N N . -136.8 -126.8 . . . A . 1 ALA N . . A . 1 ALA CA . . A . 1 ALA C . . A . 2 ASP N . . . 1 . N . . . . . 1 . CA . . . . . 1 . C . . . . . 2 . N . . c17360_2l7l 1 2 . . 1 1 1 1 ALA C C . . 1 1 2 2 ASP N N . . 1 1 2 2 ASP CA C . . 1 1 2 2 ASP C C . -96.3 -86.3 . . . A . 1 ALA C . . A . 2 ASP N . . A . 2 ASP CA . . A . 2 ASP C . . . 1 . C . . . . . 2 . N . . . . . 2 . CA . . . . . 2 . C . . c17360_2l7l 1 3 . . 1 1 2 2 ASP N N . . 1 1 2 2 ASP CA C . . 1 1 2 2 ASP C C . . 1 1 3 3 GLN N N . 2.9 12.9 . . . A . 2 ASP N . . A . 2 ASP CA . . A . 2 ASP C . . A . 3 GLN N . . . 2 . N . . . . . 2 . CA . . . . . 2 . C . . . . . 3 . N . . c17360_2l7l 1 4 . . 1 1 2 2 ASP C C . . 1 1 3 3 GLN N N . . 1 1 3 3 GLN CA C . . 1 1 3 3 GLN C C . -145.5 -135.5 . . . A . 2 ASP C . . A . 3 GLN N . . A . 3 GLN CA . . A . 3 GLN C . . . 2 . C . . . . . 3 . N . . . . . 3 . CA . . . . . 3 . C . . c17360_2l7l 1 5 . . 1 1 3 3 GLN N N . . 1 1 3 3 GLN CA C . . 1 1 3 3 GLN C C . . 1 1 4 4 LEU N N . 90.9 100.9 . . . A . 3 GLN N . . A . 3 GLN CA . . A . 3 GLN C . . A . 4 LEU N . . . 3 . N . . . . . 3 . CA . . . . . 3 . C . . . . . 4 . N . . c17360_2l7l 1 6 . . 1 1 3 3 GLN C C . . 1 1 4 4 LEU N N . . 1 1 4 4 LEU CA C . . 1 1 4 4 LEU C C . -107.7 -97.7 . . . A . 3 GLN C . . A . 4 LEU N . . A . 4 LEU CA . . A . 4 LEU C . . . 3 . C . . . . . 4 . N . . . . . 4 . CA . . . . . 4 . C . . c17360_2l7l 1 7 . . 1 1 4 4 LEU N N . . 1 1 4 4 LEU CA C . . 1 1 4 4 LEU C C . . 1 1 5 5 THR N N . 135.1 145.1 . . . A . 4 LEU N . . A . 4 LEU CA . . A . 4 LEU C . . A . 5 THR N . . . 4 . N . . . . . 4 . CA . . . . . 4 . C . . . . . 5 . N . . c17360_2l7l 1 8 . . 1 1 4 4 LEU C C . . 1 1 5 5 THR N N . . 1 1 5 5 THR CA C . . 1 1 5 5 THR C C . -82.3 -72.3 . . . A . 4 LEU C . . A . 5 THR N . . A . 5 THR CA . . A . 5 THR C . . . 4 . C . . . . . 5 . N . . . . . 5 . CA . . . . . 5 . C . . c17360_2l7l 1 9 . . 1 1 5 5 THR N N . . 1 1 5 5 THR CA C . . 1 1 5 5 THR C C . . 1 1 6 6 GLU N N . 163.5 173.5 . . . A . 5 THR N . . A . 5 THR CA . . A . 5 THR C . . A . 6 GLU N . . . 5 . N . . . . . 5 . CA . . . . . 5 . C . . . . . 6 . N . . c17360_2l7l 1 10 . . 1 1 5 5 THR C C . . 1 1 6 6 GLU N N . . 1 1 6 6 GLU CA C . . 1 1 6 6 GLU C C . -67.1 -57.1 . . . A . 5 THR C . . A . 6 GLU N . . A . 6 GLU CA . . A . 6 GLU C . . . 5 . C . . . . . 6 . N . . . . . 6 . CA . . . . . 6 . C . . c17360_2l7l 1 11 . . 1 1 6 6 GLU N N . . 1 1 6 6 GLU CA C . . 1 1 6 6 GLU C C . . 1 1 7 7 GLU N N . -32.8 -22.8 . . . A . 6 GLU N . . A . 6 GLU CA . . A . 6 GLU C . . A . 7 GLU N . . . 6 . N . . . . . 6 . CA . . . . . 6 . C . . . . . 7 . N . . c17360_2l7l 1 12 . . 1 1 6 6 GLU C C . . 1 1 7 7 GLU N N . . 1 1 7 7 GLU CA C . . 1 1 7 7 GLU C C . -74.8 -64.8 . . . A . 6 GLU C . . A . 7 GLU N . . A . 7 GLU CA . . A . 7 GLU C . . . 6 . C . . . . . 7 . N . . . . . 7 . CA . . . . . 7 . C . . c17360_2l7l 1 13 . . 1 1 7 7 GLU N N . . 1 1 7 7 GLU CA C . . 1 1 7 7 GLU C C . . 1 1 8 8 GLN N N . -45.7 -35.7 . . . A . 7 GLU N . . A . 7 GLU CA . . A . 7 GLU C . . A . 8 GLN N . . . 7 . N . . . . . 7 . CA . . . . . 7 . C . . . . . 8 . N . . c17360_2l7l 1 14 . . 1 1 7 7 GLU C C . . 1 1 8 8 GLN N N . . 1 1 8 8 GLN CA C . . 1 1 8 8 GLN C C . -69.6 -59.6 . . . A . 7 GLU C . . A . 8 GLN N . . A . 8 GLN CA . . A . 8 GLN C . . . 7 . C . . . . . 8 . N . . . . . 8 . CA . . . . . 8 . C . . c17360_2l7l 1 15 . . 1 1 8 8 GLN N N . . 1 1 8 8 GLN CA C . . 1 1 8 8 GLN C C . . 1 1 9 9 ILE N N . -42.2 -32.2 . . . A . 8 GLN N . . A . 8 GLN CA . . A . 8 GLN C . . A . 9 ILE N . . . 8 . N . . . . . 8 . CA . . . . . 8 . C . . . . . 9 . N . . c17360_2l7l 1 16 . . 1 1 8 8 GLN C C . . 1 1 9 9 ILE N N . . 1 1 9 9 ILE CA C . . 1 1 9 9 ILE C C . -67.3 -57.3 . . . A . 8 GLN C . . A . 9 ILE N . . A . 9 ILE CA . . A . 9 ILE C . . . 8 . C . . . . . 9 . N . . . . . 9 . CA . . . . . 9 . C . . c17360_2l7l 1 17 . . 1 1 9 9 ILE N N . . 1 1 9 9 ILE CA C . . 1 1 9 9 ILE C C . . 1 1 10 10 ALA N N . -48.1 -38.1 . . . A . 9 ILE N . . A . 9 ILE CA . . A . 9 ILE C . . A . 10 ALA N . . . 9 . N . . . . . 9 . CA . . . . . 9 . C . . . . . 10 . N . . c17360_2l7l 1 18 . . 1 1 9 9 ILE C C . . 1 1 10 10 ALA N N . . 1 1 10 10 ALA CA C . . 1 1 10 10 ALA C C . -74.3 -64.3 . . . A . 9 ILE C . . A . 10 ALA N . . A . 10 ALA CA . . A . 10 ALA C . . . 9 . C . . . . . 10 . N . . . . . 10 . CA . . . . . 10 . C . . c17360_2l7l 1 19 . . 1 1 10 10 ALA N N . . 1 1 10 10 ALA CA C . . 1 1 10 10 ALA C C . . 1 1 11 11 GLU N N . -48.4 -38.4 . . . A . 10 ALA N . . A . 10 ALA CA . . A . 10 ALA C . . A . 11 GLU N . . . 10 . N . . . . . 10 . CA . . . . . 10 . C . . . . . 11 . N . . c17360_2l7l 1 20 . . 1 1 10 10 ALA C C . . 1 1 11 11 GLU N N . . 1 1 11 11 GLU CA C . . 1 1 11 11 GLU C C . -67.9 -57.9 . . . A . 10 ALA C . . A . 11 GLU N . . A . 11 GLU CA . . A . 11 GLU C . . . 10 . C . . . . . 11 . N . . . . . 11 . CA . . . . . 11 . C . . c17360_2l7l 1 21 . . 1 1 11 11 GLU N N . . 1 1 11 11 GLU CA C . . 1 1 11 11 GLU C C . . 1 1 12 12 PHE N N . -42.9 -32.9 . . . A . 11 GLU N . . A . 11 GLU CA . . A . 11 GLU C . . A . 12 PHE N . . . 11 . N . . . . . 11 . CA . . . . . 11 . C . . . . . 12 . N . . c17360_2l7l 1 22 . . 1 1 11 11 GLU C C . . 1 1 12 12 PHE N N . . 1 1 12 12 PHE CA C . . 1 1 12 12 PHE C C . -78.3 -68.3 . . . A . 11 GLU C . . A . 12 PHE N . . A . 12 PHE CA . . A . 12 PHE C . . . 11 . C . . . . . 12 . N . . . . . 12 . CA . . . . . 12 . C . . c17360_2l7l 1 23 . . 1 1 12 12 PHE N N . . 1 1 12 12 PHE CA C . . 1 1 12 12 PHE C C . . 1 1 13 13 LYS N N . -33.8 -23.8 . . . A . 12 PHE N . . A . 12 PHE CA . . A . 12 PHE C . . A . 13 LYS N . . . 12 . N . . . . . 12 . CA . . . . . 12 . C . . . . . 13 . N . . c17360_2l7l 1 24 . . 1 1 12 12 PHE C C . . 1 1 13 13 LYS N N . . 1 1 13 13 LYS CA C . . 1 1 13 13 LYS C C . -68.1 -58.1 . . . A . 12 PHE C . . A . 13 LYS N . . A . 13 LYS CA . . A . 13 LYS C . . . 12 . C . . . . . 13 . N . . . . . 13 . CA . . . . . 13 . C . . c17360_2l7l 1 25 . . 1 1 13 13 LYS N N . . 1 1 13 13 LYS CA C . . 1 1 13 13 LYS C C . . 1 1 14 14 GLU N N . -49.3 -39.3 . . . A . 13 LYS N . . A . 13 LYS CA . . A . 13 LYS C . . A . 14 GLU N . . . 13 . N . . . . . 13 . CA . . . . . 13 . C . . . . . 14 . N . . c17360_2l7l 1 26 . . 1 1 13 13 LYS C C . . 1 1 14 14 GLU N N . . 1 1 14 14 GLU CA C . . 1 1 14 14 GLU C C . -70.0 -60.0 . . . A . 13 LYS C . . A . 14 GLU N . . A . 14 GLU CA . . A . 14 GLU C . . . 13 . C . . . . . 14 . N . . . . . 14 . CA . . . . . 14 . C . . c17360_2l7l 1 27 . . 1 1 14 14 GLU N N . . 1 1 14 14 GLU CA C . . 1 1 14 14 GLU C C . . 1 1 15 15 ALA N N . -57.9 -47.9 . . . A . 14 GLU N . . A . 14 GLU CA . . A . 14 GLU C . . A . 15 ALA N . . . 14 . N . . . . . 14 . CA . . . . . 14 . C . . . . . 15 . N . . c17360_2l7l 1 28 . . 1 1 14 14 GLU C C . . 1 1 15 15 ALA N N . . 1 1 15 15 ALA CA C . . 1 1 15 15 ALA C C . -64.2 -54.2 . . . A . 14 GLU C . . A . 15 ALA N . . A . 15 ALA CA . . A . 15 ALA C . . . 14 . C . . . . . 15 . N . . . . . 15 . CA . . . . . 15 . C . . c17360_2l7l 1 29 . . 1 1 15 15 ALA N N . . 1 1 15 15 ALA CA C . . 1 1 15 15 ALA C C . . 1 1 16 16 PHE N N . -44.5 -34.5 . . . A . 15 ALA N . . A . 15 ALA CA . . A . 15 ALA C . . A . 16 PHE N . . . 15 . N . . . . . 15 . CA . . . . . 15 . C . . . . . 16 . N . . c17360_2l7l 1 30 . . 1 1 15 15 ALA C C . . 1 1 16 16 PHE N N . . 1 1 16 16 PHE CA C . . 1 1 16 16 PHE C C . -63.8 -53.8 . . . A . 15 ALA C . . A . 16 PHE N . . A . 16 PHE CA . . A . 16 PHE C . . . 15 . C . . . . . 16 . N . . . . . 16 . CA . . . . . 16 . C . . c17360_2l7l 1 31 . . 1 1 16 16 PHE N N . . 1 1 16 16 PHE CA C . . 1 1 16 16 PHE C C . . 1 1 17 17 SER N N . -50.2 -40.2 . . . A . 16 PHE N . . A . 16 PHE CA . . A . 16 PHE C . . A . 17 SER N . . . 16 . N . . . . . 16 . CA . . . . . 16 . C . . . . . 17 . N . . c17360_2l7l 1 32 . . 1 1 16 16 PHE C C . . 1 1 17 17 SER N N . . 1 1 17 17 SER CA C . . 1 1 17 17 SER C C . -65.5 -55.5 . . . A . 16 PHE C . . A . 17 SER N . . A . 17 SER CA . . A . 17 SER C . . . 16 . C . . . . . 17 . N . . . . . 17 . CA . . . . . 17 . C . . c17360_2l7l 1 33 . . 1 1 17 17 SER N N . . 1 1 17 17 SER CA C . . 1 1 17 17 SER C C . . 1 1 18 18 LEU N N . -38.0 -28.0 . . . A . 17 SER N . . A . 17 SER CA . . A . 17 SER C . . A . 18 LEU N . . . 17 . N . . . . . 17 . CA . . . . . 17 . C . . . . . 18 . N . . c17360_2l7l 1 34 . . 1 1 17 17 SER C C . . 1 1 18 18 LEU N N . . 1 1 18 18 LEU CA C . . 1 1 18 18 LEU C C . -80.5 -70.5 . . . A . 17 SER C . . A . 18 LEU N . . A . 18 LEU CA . . A . 18 LEU C . . . 17 . C . . . . . 18 . N . . . . . 18 . CA . . . . . 18 . C . . c17360_2l7l 1 35 . . 1 1 18 18 LEU N N . . 1 1 18 18 LEU CA C . . 1 1 18 18 LEU C C . . 1 1 19 19 PHE N N . -26.8 -16.8 . . . A . 18 LEU N . . A . 18 LEU CA . . A . 18 LEU C . . A . 19 PHE N . . . 18 . N . . . . . 18 . CA . . . . . 18 . C . . . . . 19 . N . . c17360_2l7l 1 36 . . 1 1 18 18 LEU C C . . 1 1 19 19 PHE N N . . 1 1 19 19 PHE CA C . . 1 1 19 19 PHE C C . -93.9 -83.9 . . . A . 18 LEU C . . A . 19 PHE N . . A . 19 PHE CA . . A . 19 PHE C . . . 18 . C . . . . . 19 . N . . . . . 19 . CA . . . . . 19 . C . . c17360_2l7l 1 37 . . 1 1 19 19 PHE N N . . 1 1 19 19 PHE CA C . . 1 1 19 19 PHE C C . . 1 1 20 20 ASP N N . -45.7 -35.7 . . . A . 19 PHE N . . A . 19 PHE CA . . A . 19 PHE C . . A . 20 ASP N . . . 19 . N . . . . . 19 . CA . . . . . 19 . C . . . . . 20 . N . . c17360_2l7l 1 38 . . 1 1 19 19 PHE C C . . 1 1 20 20 ASP N N . . 1 1 20 20 ASP CA C . . 1 1 20 20 ASP C C . -93.5 -83.5 . . . A . 19 PHE C . . A . 20 ASP N . . A . 20 ASP CA . . A . 20 ASP C . . . 19 . C . . . . . 20 . N . . . . . 20 . CA . . . . . 20 . C . . c17360_2l7l 1 39 . . 1 1 20 20 ASP N N . . 1 1 20 20 ASP CA C . . 1 1 20 20 ASP C C . . 1 1 21 21 LYS N N . 72.9 82.9 . . . A . 20 ASP N . . A . 20 ASP CA . . A . 20 ASP C . . A . 21 LYS N . . . 20 . N . . . . . 20 . CA . . . . . 20 . C . . . . . 21 . N . . c17360_2l7l 1 40 . . 1 1 20 20 ASP C C . . 1 1 21 21 LYS N N . . 1 1 21 21 LYS CA C . . 1 1 21 21 LYS C C . -64.4 -54.4 . . . A . 20 ASP C . . A . 21 LYS N . . A . 21 LYS CA . . A . 21 LYS C . . . 20 . C . . . . . 21 . N . . . . . 21 . CA . . . . . 21 . C . . c17360_2l7l 1 41 . . 1 1 21 21 LYS N N . . 1 1 21 21 LYS CA C . . 1 1 21 21 LYS C C . . 1 1 22 22 ASP N N . -38.1 -28.1 . . . A . 21 LYS N . . A . 21 LYS CA . . A . 21 LYS C . . A . 22 ASP N . . . 21 . N . . . . . 21 . CA . . . . . 21 . C . . . . . 22 . N . . c17360_2l7l 1 42 . . 1 1 21 21 LYS C C . . 1 1 22 22 ASP N N . . 1 1 22 22 ASP CA C . . 1 1 22 22 ASP C C . -92.1 -82.1 . . . A . 21 LYS C . . A . 22 ASP N . . A . 22 ASP CA . . A . 22 ASP C . . . 21 . C . . . . . 22 . N . . . . . 22 . CA . . . . . 22 . C . . c17360_2l7l 1 43 . . 1 1 22 22 ASP N N . . 1 1 22 22 ASP CA C . . 1 1 22 22 ASP C C . . 1 1 23 23 GLY N N . -11.7 -1.7 . . . A . 22 ASP N . . A . 22 ASP CA . . A . 22 ASP C . . A . 23 GLY N . . . 22 . N . . . . . 22 . CA . . . . . 22 . C . . . . . 23 . N . . c17360_2l7l 1 44 . . 1 1 22 22 ASP C C . . 1 1 23 23 GLY N N . . 1 1 23 23 GLY CA C . . 1 1 23 23 GLY C C . 48.8 58.8 . . . A . 22 ASP C . . A . 23 GLY N . . A . 23 GLY CA . . A . 23 GLY C . . . 22 . C . . . . . 23 . N . . . . . 23 . CA . . . . . 23 . C . . c17360_2l7l 1 45 . . 1 1 23 23 GLY N N . . 1 1 23 23 GLY CA C . . 1 1 23 23 GLY C C . . 1 1 24 24 ASP N N . 27.1 37.1 . . . A . 23 GLY N . . A . 23 GLY CA . . A . 23 GLY C . . A . 24 ASP N . . . 23 . N . . . . . 23 . CA . . . . . 23 . C . . . . . 24 . N . . c17360_2l7l 1 46 . . 1 1 23 23 GLY C C . . 1 1 24 24 ASP N N . . 1 1 24 24 ASP CA C . . 1 1 24 24 ASP C C . -84.3 -74.3 . . . A . 23 GLY C . . A . 24 ASP N . . A . 24 ASP CA . . A . 24 ASP C . . . 23 . C . . . . . 24 . N . . . . . 24 . CA . . . . . 24 . C . . c17360_2l7l 1 47 . . 1 1 24 24 ASP N N . . 1 1 24 24 ASP CA C . . 1 1 24 24 ASP C C . . 1 1 25 25 GLY N N . -8.7 1.3 . . . A . 24 ASP N . . A . 24 ASP CA . . A . 24 ASP C . . A . 25 GLY N . . . 24 . N . . . . . 24 . CA . . . . . 24 . C . . . . . 25 . N . . c17360_2l7l 1 48 . . 1 1 24 24 ASP C C . . 1 1 25 25 GLY N N . . 1 1 25 25 GLY CA C . . 1 1 25 25 GLY C C . 79.2 89.2 . . . A . 24 ASP C . . A . 25 GLY N . . A . 25 GLY CA . . A . 25 GLY C . . . 24 . C . . . . . 25 . N . . . . . 25 . CA . . . . . 25 . C . . c17360_2l7l 1 49 . . 1 1 25 25 GLY N N . . 1 1 25 25 GLY CA C . . 1 1 25 25 GLY C C . . 1 1 26 26 THR N N . 1.6 11.6 . . . A . 25 GLY N . . A . 25 GLY CA . . A . 25 GLY C . . A . 26 THR N . . . 25 . N . . . . . 25 . CA . . . . . 25 . C . . . . . 26 . N . . c17360_2l7l 1 50 . . 1 1 25 25 GLY C C . . 1 1 26 26 THR N N . . 1 1 26 26 THR CA C . . 1 1 26 26 THR C C . -149.5 -139.5 . . . A . 25 GLY C . . A . 26 THR N . . A . 26 THR CA . . A . 26 THR C . . . 25 . C . . . . . 26 . N . . . . . 26 . CA . . . . . 26 . C . . c17360_2l7l 1 51 . . 1 1 26 26 THR N N . . 1 1 26 26 THR CA C . . 1 1 26 26 THR C C . . 1 1 27 27 ILE N N . 143.5 153.5 . . . A . 26 THR N . . A . 26 THR CA . . A . 26 THR C . . A . 27 ILE N . . . 26 . N . . . . . 26 . CA . . . . . 26 . C . . . . . 27 . N . . c17360_2l7l 1 52 . . 1 1 26 26 THR C C . . 1 1 27 27 ILE N N . . 1 1 27 27 ILE CA C . . 1 1 27 27 ILE C C . -115.8 -105.8 . . . A . 26 THR C . . A . 27 ILE N . . A . 27 ILE CA . . A . 27 ILE C . . . 26 . C . . . . . 27 . N . . . . . 27 . CA . . . . . 27 . C . . c17360_2l7l 1 53 . . 1 1 27 27 ILE N N . . 1 1 27 27 ILE CA C . . 1 1 27 27 ILE C C . . 1 1 28 28 THR N N . 121.1 131.1 . . . A . 27 ILE N . . A . 27 ILE CA . . A . 27 ILE C . . A . 28 THR N . . . 27 . N . . . . . 27 . CA . . . . . 27 . C . . . . . 28 . N . . c17360_2l7l 1 54 . . 1 1 27 27 ILE C C . . 1 1 28 28 THR N N . . 1 1 28 28 THR CA C . . 1 1 28 28 THR C C . -97.5 -87.5 . . . A . 27 ILE C . . A . 28 THR N . . A . 28 THR CA . . A . 28 THR C . . . 27 . C . . . . . 28 . N . . . . . 28 . CA . . . . . 28 . C . . c17360_2l7l 1 55 . . 1 1 28 28 THR N N . . 1 1 28 28 THR CA C . . 1 1 28 28 THR C C . . 1 1 29 29 THR N N . 159.0 169.0 . . . A . 28 THR N . . A . 28 THR CA . . A . 28 THR C . . A . 29 THR N . . . 28 . N . . . . . 28 . CA . . . . . 28 . C . . . . . 29 . N . . c17360_2l7l 1 56 . . 1 1 28 28 THR C C . . 1 1 29 29 THR N N . . 1 1 29 29 THR CA C . . 1 1 29 29 THR C C . -62.9 -52.9 . . . A . 28 THR C . . A . 29 THR N . . A . 29 THR CA . . A . 29 THR C . . . 28 . C . . . . . 29 . N . . . . . 29 . CA . . . . . 29 . C . . c17360_2l7l 1 57 . . 1 1 29 29 THR N N . . 1 1 29 29 THR CA C . . 1 1 29 29 THR C C . . 1 1 30 30 LYS N N . -45.5 -35.5 . . . A . 29 THR N . . A . 29 THR CA . . A . 29 THR C . . A . 30 LYS N . . . 29 . N . . . . . 29 . CA . . . . . 29 . C . . . . . 30 . N . . c17360_2l7l 1 58 . . 1 1 29 29 THR C C . . 1 1 30 30 LYS N N . . 1 1 30 30 LYS CA C . . 1 1 30 30 LYS C C . -68.0 -58.0 . . . A . 29 THR C . . A . 30 LYS N . . A . 30 LYS CA . . A . 30 LYS C . . . 29 . C . . . . . 30 . N . . . . . 30 . CA . . . . . 30 . C . . c17360_2l7l 1 59 . . 1 1 30 30 LYS N N . . 1 1 30 30 LYS CA C . . 1 1 30 30 LYS C C . . 1 1 31 31 GLU N N . -47.7 -37.7 . . . A . 30 LYS N . . A . 30 LYS CA . . A . 30 LYS C . . A . 31 GLU N . . . 30 . N . . . . . 30 . CA . . . . . 30 . C . . . . . 31 . N . . c17360_2l7l 1 60 . . 1 1 30 30 LYS C C . . 1 1 31 31 GLU N N . . 1 1 31 31 GLU CA C . . 1 1 31 31 GLU C C . -70.6 -60.6 . . . A . 30 LYS C . . A . 31 GLU N . . A . 31 GLU CA . . A . 31 GLU C . . . 30 . C . . . . . 31 . N . . . . . 31 . CA . . . . . 31 . C . . c17360_2l7l 1 61 . . 1 1 31 31 GLU N N . . 1 1 31 31 GLU CA C . . 1 1 31 31 GLU C C . . 1 1 32 32 LEU N N . -54.2 -44.2 . . . A . 31 GLU N . . A . 31 GLU CA . . A . 31 GLU C . . A . 32 LEU N . . . 31 . N . . . . . 31 . CA . . . . . 31 . C . . . . . 32 . N . . c17360_2l7l 1 62 . . 1 1 31 31 GLU C C . . 1 1 32 32 LEU N N . . 1 1 32 32 LEU CA C . . 1 1 32 32 LEU C C . -66.6 -56.6 . . . A . 31 GLU C . . A . 32 LEU N . . A . 32 LEU CA . . A . 32 LEU C . . . 31 . C . . . . . 32 . N . . . . . 32 . CA . . . . . 32 . C . . c17360_2l7l 1 63 . . 1 1 32 32 LEU N N . . 1 1 32 32 LEU CA C . . 1 1 32 32 LEU C C . . 1 1 33 33 GLY N N . -44.8 -34.8 . . . A . 32 LEU N . . A . 32 LEU CA . . A . 32 LEU C . . A . 33 GLY N . . . 32 . N . . . . . 32 . CA . . . . . 32 . C . . . . . 33 . N . . c17360_2l7l 1 64 . . 1 1 32 32 LEU C C . . 1 1 33 33 GLY N N . . 1 1 33 33 GLY CA C . . 1 1 33 33 GLY C C . -75.1 -65.1 . . . A . 32 LEU C . . A . 33 GLY N . . A . 33 GLY CA . . A . 33 GLY C . . . 32 . C . . . . . 33 . N . . . . . 33 . CA . . . . . 33 . C . . c17360_2l7l 1 65 . . 1 1 33 33 GLY N N . . 1 1 33 33 GLY CA C . . 1 1 33 33 GLY C C . . 1 1 34 34 THR N N . -50.6 -40.6 . . . A . 33 GLY N . . A . 33 GLY CA . . A . 33 GLY C . . A . 34 THR N . . . 33 . N . . . . . 33 . CA . . . . . 33 . C . . . . . 34 . N . . c17360_2l7l 1 66 . . 1 1 33 33 GLY C C . . 1 1 34 34 THR N N . . 1 1 34 34 THR CA C . . 1 1 34 34 THR C C . -63.9 -53.9 . . . A . 33 GLY C . . A . 34 THR N . . A . 34 THR CA . . A . 34 THR C . . . 33 . C . . . . . 34 . N . . . . . 34 . CA . . . . . 34 . C . . c17360_2l7l 1 67 . . 1 1 34 34 THR N N . . 1 1 34 34 THR CA C . . 1 1 34 34 THR C C . . 1 1 35 35 VAL N N . -55.9 -45.9 . . . A . 34 THR N . . A . 34 THR CA . . A . 34 THR C . . A . 35 VAL N . . . 34 . N . . . . . 34 . CA . . . . . 34 . C . . . . . 35 . N . . c17360_2l7l 1 68 . . 1 1 34 34 THR C C . . 1 1 35 35 VAL N N . . 1 1 35 35 VAL CA C . . 1 1 35 35 VAL C C . -70.3 -60.3 . . . A . 34 THR C . . A . 35 VAL N . . A . 35 VAL CA . . A . 35 VAL C . . . 34 . C . . . . . 35 . N . . . . . 35 . CA . . . . . 35 . C . . c17360_2l7l 1 69 . . 1 1 35 35 VAL N N . . 1 1 35 35 VAL CA C . . 1 1 35 35 VAL C C . . 1 1 36 36 MET N N . -50.8 -40.8 . . . A . 35 VAL N . . A . 35 VAL CA . . A . 35 VAL C . . A . 36 MET N . . . 35 . N . . . . . 35 . CA . . . . . 35 . C . . . . . 36 . N . . c17360_2l7l 1 70 . . 1 1 35 35 VAL C C . . 1 1 36 36 MET N N . . 1 1 36 36 MET CA C . . 1 1 36 36 MET C C . -66.7 -56.7 . . . A . 35 VAL C . . A . 36 MET N . . A . 36 MET CA . . A . 36 MET C . . . 35 . C . . . . . 36 . N . . . . . 36 . CA . . . . . 36 . C . . c17360_2l7l 1 71 . . 1 1 36 36 MET N N . . 1 1 36 36 MET CA C . . 1 1 36 36 MET C C . . 1 1 37 37 ARG N N . -52.8 -42.8 . . . A . 36 MET N . . A . 36 MET CA . . A . 36 MET C . . A . 37 ARG N . . . 36 . N . . . . . 36 . CA . . . . . 36 . C . . . . . 37 . N . . c17360_2l7l 1 72 . . 1 1 36 36 MET C C . . 1 1 37 37 ARG N N . . 1 1 37 37 ARG CA C . . 1 1 37 37 ARG C C . -65.9 -55.9 . . . A . 36 MET C . . A . 37 ARG N . . A . 37 ARG CA . . A . 37 ARG C . . . 36 . C . . . . . 37 . N . . . . . 37 . CA . . . . . 37 . C . . c17360_2l7l 1 73 . . 1 1 37 37 ARG N N . . 1 1 37 37 ARG CA C . . 1 1 37 37 ARG C C . . 1 1 38 38 SER N N . -35.7 -25.7 . . . A . 37 ARG N . . A . 37 ARG CA . . A . 37 ARG C . . A . 38 SER N . . . 37 . N . . . . . 37 . CA . . . . . 37 . C . . . . . 38 . N . . c17360_2l7l 1 74 . . 1 1 37 37 ARG C C . . 1 1 38 38 SER N N . . 1 1 38 38 SER CA C . . 1 1 38 38 SER C C . -67.4 -57.4 . . . A . 37 ARG C . . A . 38 SER N . . A . 38 SER CA . . A . 38 SER C . . . 37 . C . . . . . 38 . N . . . . . 38 . CA . . . . . 38 . C . . c17360_2l7l 1 75 . . 1 1 38 38 SER N N . . 1 1 38 38 SER CA C . . 1 1 38 38 SER C C . . 1 1 39 39 LEU N N . -23.5 -13.5 . . . A . 38 SER N . . A . 38 SER CA . . A . 38 SER C . . A . 39 LEU N . . . 38 . N . . . . . 38 . CA . . . . . 38 . C . . . . . 39 . N . . c17360_2l7l 1 76 . . 1 1 38 38 SER C C . . 1 1 39 39 LEU N N . . 1 1 39 39 LEU CA C . . 1 1 39 39 LEU C C . -83.1 -73.1 . . . A . 38 SER C . . A . 39 LEU N . . A . 39 LEU CA . . A . 39 LEU C . . . 38 . C . . . . . 39 . N . . . . . 39 . CA . . . . . 39 . C . . c17360_2l7l 1 77 . . 1 1 39 39 LEU N N . . 1 1 39 39 LEU CA C . . 1 1 39 39 LEU C C . . 1 1 40 40 GLY N N . 12.2 22.2 . . . A . 39 LEU N . . A . 39 LEU CA . . A . 39 LEU C . . A . 40 GLY N . . . 39 . N . . . . . 39 . CA . . . . . 39 . C . . . . . 40 . N . . c17360_2l7l 1 78 . . 1 1 39 39 LEU C C . . 1 1 40 40 GLY N N . . 1 1 40 40 GLY CA C . . 1 1 40 40 GLY C C . 87.2 97.2 . . . A . 39 LEU C . . A . 40 GLY N . . A . 40 GLY CA . . A . 40 GLY C . . . 39 . C . . . . . 40 . N . . . . . 40 . CA . . . . . 40 . C . . c17360_2l7l 1 79 . . 1 1 40 40 GLY N N . . 1 1 40 40 GLY CA C . . 1 1 40 40 GLY C C . . 1 1 41 41 GLN N N . -3.2 6.8 . . . A . 40 GLY N . . A . 40 GLY CA . . A . 40 GLY C . . A . 41 GLN N . . . 40 . N . . . . . 40 . CA . . . . . 40 . C . . . . . 41 . N . . c17360_2l7l 1 80 . . 1 1 40 40 GLY C C . . 1 1 41 41 GLN N N . . 1 1 41 41 GLN CA C . . 1 1 41 41 GLN C C . -106.0 -96.0 . . . A . 40 GLY C . . A . 41 GLN N . . A . 41 GLN CA . . A . 41 GLN C . . . 40 . C . . . . . 41 . N . . . . . 41 . CA . . . . . 41 . C . . c17360_2l7l 1 81 . . 1 1 41 41 GLN N N . . 1 1 41 41 GLN CA C . . 1 1 41 41 GLN C C . . 1 1 42 42 ASN N N . 153.4 163.4 . . . A . 41 GLN N . . A . 41 GLN CA . . A . 41 GLN C . . A . 42 ASN N . . . 41 . N . . . . . 41 . CA . . . . . 41 . C . . . . . 42 . N . . c17360_2l7l 1 82 . . 1 1 41 41 GLN C C . . 1 1 42 42 ASN N N . . 1 1 42 42 ASN CA C . . 1 1 42 42 ASN C C . -147.9 -137.9 . . . A . 41 GLN C . . A . 42 ASN N . . A . 42 ASN CA . . A . 42 ASN C . . . 41 . C . . . . . 42 . N . . . . . 42 . CA . . . . . 42 . C . . c17360_2l7l 1 83 . . 1 1 42 42 ASN N N . . 1 1 42 42 ASN CA C . . 1 1 42 42 ASN C C . . 1 1 43 43 PRO N N . 48.4 58.4 . . . A . 42 ASN N . . A . 42 ASN CA . . A . 42 ASN C . . A . 43 PRO N . . . 42 . N . . . . . 42 . CA . . . . . 42 . C . . . . . 43 . N . . c17360_2l7l 1 84 . . 1 1 43 43 PRO N N . . 1 1 43 43 PRO CA C . . 1 1 43 43 PRO C C . . 1 1 44 44 THR N N . 149.0 159.0 . . . A . 43 PRO N . . A . 43 PRO CA . . A . 43 PRO C . . A . 44 THR N . . . 43 . N . . . . . 43 . CA . . . . . 43 . C . . . . . 44 . N . . c17360_2l7l 1 85 . . 1 1 43 43 PRO C C . . 1 1 44 44 THR N N . . 1 1 44 44 THR CA C . . 1 1 44 44 THR C C . -86.5 -76.5 . . . A . 43 PRO C . . A . 44 THR N . . A . 44 THR CA . . A . 44 THR C . . . 43 . C . . . . . 44 . N . . . . . 44 . CA . . . . . 44 . C . . c17360_2l7l 1 86 . . 1 1 44 44 THR N N . . 1 1 44 44 THR CA C . . 1 1 44 44 THR C C . . 1 1 45 45 GLU N N . 158.6 168.6 . . . A . 44 THR N . . A . 44 THR CA . . A . 44 THR C . . A . 45 GLU N . . . 44 . N . . . . . 44 . CA . . . . . 44 . C . . . . . 45 . N . . c17360_2l7l 1 87 . . 1 1 44 44 THR C C . . 1 1 45 45 GLU N N . . 1 1 45 45 GLU CA C . . 1 1 45 45 GLU C C . -60.1 -50.1 . . . A . 44 THR C . . A . 45 GLU N . . A . 45 GLU CA . . A . 45 GLU C . . . 44 . C . . . . . 45 . N . . . . . 45 . CA . . . . . 45 . C . . c17360_2l7l 1 88 . . 1 1 45 45 GLU N N . . 1 1 45 45 GLU CA C . . 1 1 45 45 GLU C C . . 1 1 46 46 ALA N N . -42.7 -32.7 . . . A . 45 GLU N . . A . 45 GLU CA . . A . 45 GLU C . . A . 46 ALA N . . . 45 . N . . . . . 45 . CA . . . . . 45 . C . . . . . 46 . N . . c17360_2l7l 1 89 . . 1 1 45 45 GLU C C . . 1 1 46 46 ALA N N . . 1 1 46 46 ALA CA C . . 1 1 46 46 ALA C C . -68.1 -58.1 . . . A . 45 GLU C . . A . 46 ALA N . . A . 46 ALA CA . . A . 46 ALA C . . . 45 . C . . . . . 46 . N . . . . . 46 . CA . . . . . 46 . C . . c17360_2l7l 1 90 . . 1 1 46 46 ALA N N . . 1 1 46 46 ALA CA C . . 1 1 46 46 ALA C C . . 1 1 47 47 GLU N N . -42.9 -32.9 . . . A . 46 ALA N . . A . 46 ALA CA . . A . 46 ALA C . . A . 47 GLU N . . . 46 . N . . . . . 46 . CA . . . . . 46 . C . . . . . 47 . N . . c17360_2l7l 1 91 . . 1 1 46 46 ALA C C . . 1 1 47 47 GLU N N . . 1 1 47 47 GLU CA C . . 1 1 47 47 GLU C C . -72.5 -62.5 . . . A . 46 ALA C . . A . 47 GLU N . . A . 47 GLU CA . . A . 47 GLU C . . . 46 . C . . . . . 47 . N . . . . . 47 . CA . . . . . 47 . C . . c17360_2l7l 1 92 . . 1 1 47 47 GLU N N . . 1 1 47 47 GLU CA C . . 1 1 47 47 GLU C C . . 1 1 48 48 LEU N N . -50.5 -40.5 . . . A . 47 GLU N . . A . 47 GLU CA . . A . 47 GLU C . . A . 48 LEU N . . . 47 . N . . . . . 47 . CA . . . . . 47 . C . . . . . 48 . N . . c17360_2l7l 1 93 . . 1 1 47 47 GLU C C . . 1 1 48 48 LEU N N . . 1 1 48 48 LEU CA C . . 1 1 48 48 LEU C C . -71.9 -61.9 . . . A . 47 GLU C . . A . 48 LEU N . . A . 48 LEU CA . . A . 48 LEU C . . . 47 . C . . . . . 48 . N . . . . . 48 . CA . . . . . 48 . C . . c17360_2l7l 1 94 . . 1 1 48 48 LEU N N . . 1 1 48 48 LEU CA C . . 1 1 48 48 LEU C C . . 1 1 49 49 GLN N N . -52.9 -42.9 . . . A . 48 LEU N . . A . 48 LEU CA . . A . 48 LEU C . . A . 49 GLN N . . . 48 . N . . . . . 48 . CA . . . . . 48 . C . . . . . 49 . N . . c17360_2l7l 1 95 . . 1 1 48 48 LEU C C . . 1 1 49 49 GLN N N . . 1 1 49 49 GLN CA C . . 1 1 49 49 GLN C C . -60.3 -50.3 . . . A . 48 LEU C . . A . 49 GLN N . . A . 49 GLN CA . . A . 49 GLN C . . . 48 . C . . . . . 49 . N . . . . . 49 . CA . . . . . 49 . C . . c17360_2l7l 1 96 . . 1 1 49 49 GLN N N . . 1 1 49 49 GLN CA C . . 1 1 49 49 GLN C C . . 1 1 50 50 ASP N N . -47.4 -37.4 . . . A . 49 GLN N . . A . 49 GLN CA . . A . 49 GLN C . . A . 50 ASP N . . . 49 . N . . . . . 49 . CA . . . . . 49 . C . . . . . 50 . N . . c17360_2l7l 1 97 . . 1 1 49 49 GLN C C . . 1 1 50 50 ASP N N . . 1 1 50 50 ASP CA C . . 1 1 50 50 ASP C C . -67.4 -57.4 . . . A . 49 GLN C . . A . 50 ASP N . . A . 50 ASP CA . . A . 50 ASP C . . . 49 . C . . . . . 50 . N . . . . . 50 . CA . . . . . 50 . C . . c17360_2l7l 1 98 . . 1 1 50 50 ASP N N . . 1 1 50 50 ASP CA C . . 1 1 50 50 ASP C C . . 1 1 51 51 MET N N . -48.6 -38.6 . . . A . 50 ASP N . . A . 50 ASP CA . . A . 50 ASP C . . A . 51 MET N . . . 50 . N . . . . . 50 . CA . . . . . 50 . C . . . . . 51 . N . . c17360_2l7l 1 99 . . 1 1 50 50 ASP C C . . 1 1 51 51 MET N N . . 1 1 51 51 MET CA C . . 1 1 51 51 MET C C . -64.7 -54.7 . . . A . 50 ASP C . . A . 51 MET N . . A . 51 MET CA . . A . 51 MET C . . . 50 . C . . . . . 51 . N . . . . . 51 . CA . . . . . 51 . C . . c17360_2l7l 1 100 . . 1 1 51 51 MET N N . . 1 1 51 51 MET CA C . . 1 1 51 51 MET C C . . 1 1 52 52 ILE N N . -54.9 -44.9 . . . A . 51 MET N . . A . 51 MET CA . . A . 51 MET C . . A . 52 ILE N . . . 51 . N . . . . . 51 . CA . . . . . 51 . C . . . . . 52 . N . . c17360_2l7l 1 101 . . 1 1 51 51 MET C C . . 1 1 52 52 ILE N N . . 1 1 52 52 ILE CA C . . 1 1 52 52 ILE C C . -70.5 -60.5 . . . A . 51 MET C . . A . 52 ILE N . . A . 52 ILE CA . . A . 52 ILE C . . . 51 . C . . . . . 52 . N . . . . . 52 . CA . . . . . 52 . C . . c17360_2l7l 1 102 . . 1 1 52 52 ILE N N . . 1 1 52 52 ILE CA C . . 1 1 52 52 ILE C C . . 1 1 53 53 ASN N N . -58.7 -48.7 . . . A . 52 ILE N . . A . 52 ILE CA . . A . 52 ILE C . . A . 53 ASN N . . . 52 . N . . . . . 52 . CA . . . . . 52 . C . . . . . 53 . N . . c17360_2l7l 1 103 . . 1 1 52 52 ILE C C . . 1 1 53 53 ASN N N . . 1 1 53 53 ASN CA C . . 1 1 53 53 ASN C C . -58.8 -48.8 . . . A . 52 ILE C . . A . 53 ASN N . . A . 53 ASN CA . . A . 53 ASN C . . . 52 . C . . . . . 53 . N . . . . . 53 . CA . . . . . 53 . C . . c17360_2l7l 1 104 . . 1 1 53 53 ASN N N . . 1 1 53 53 ASN CA C . . 1 1 53 53 ASN C C . . 1 1 54 54 GLU N N . -43.5 -33.5 . . . A . 53 ASN N . . A . 53 ASN CA . . A . 53 ASN C . . A . 54 GLU N . . . 53 . N . . . . . 53 . CA . . . . . 53 . C . . . . . 54 . N . . c17360_2l7l 1 105 . . 1 1 53 53 ASN C C . . 1 1 54 54 GLU N N . . 1 1 54 54 GLU CA C . . 1 1 54 54 GLU C C . -61.9 -51.9 . . . A . 53 ASN C . . A . 54 GLU N . . A . 54 GLU CA . . A . 54 GLU C . . . 53 . C . . . . . 54 . N . . . . . 54 . CA . . . . . 54 . C . . c17360_2l7l 1 106 . . 1 1 54 54 GLU N N . . 1 1 54 54 GLU CA C . . 1 1 54 54 GLU C C . . 1 1 55 55 VAL N N . -44.2 -34.2 . . . A . 54 GLU N . . A . 54 GLU CA . . A . 54 GLU C . . A . 55 VAL N . . . 54 . N . . . . . 54 . CA . . . . . 54 . C . . . . . 55 . N . . c17360_2l7l 1 107 . . 1 1 54 54 GLU C C . . 1 1 55 55 VAL N N . . 1 1 55 55 VAL CA C . . 1 1 55 55 VAL C C . -102.8 -92.8 . . . A . 54 GLU C . . A . 55 VAL N . . A . 55 VAL CA . . A . 55 VAL C . . . 54 . C . . . . . 55 . N . . . . . 55 . CA . . . . . 55 . C . . c17360_2l7l 1 108 . . 1 1 55 55 VAL N N . . 1 1 55 55 VAL CA C . . 1 1 55 55 VAL C C . . 1 1 56 56 ASP N N . -16.4 -6.4 . . . A . 55 VAL N . . A . 55 VAL CA . . A . 55 VAL C . . A . 56 ASP N . . . 55 . N . . . . . 55 . CA . . . . . 55 . C . . . . . 56 . N . . c17360_2l7l 1 109 . . 1 1 55 55 VAL C C . . 1 1 56 56 ASP N N . . 1 1 56 56 ASP CA C . . 1 1 56 56 ASP C C . -76.8 -66.8 . . . A . 55 VAL C . . A . 56 ASP N . . A . 56 ASP CA . . A . 56 ASP C . . . 55 . C . . . . . 56 . N . . . . . 56 . CA . . . . . 56 . C . . c17360_2l7l 1 110 . . 1 1 56 56 ASP N N . . 1 1 56 56 ASP CA C . . 1 1 56 56 ASP C C . . 1 1 57 57 ALA N N . 79.0 89.0 . . . A . 56 ASP N . . A . 56 ASP CA . . A . 56 ASP C . . A . 57 ALA N . . . 56 . N . . . . . 56 . CA . . . . . 56 . C . . . . . 57 . N . . c17360_2l7l 1 111 . . 1 1 56 56 ASP C C . . 1 1 57 57 ALA N N . . 1 1 57 57 ALA CA C . . 1 1 57 57 ALA C C . -57.8 -47.8 . . . A . 56 ASP C . . A . 57 ALA N . . A . 57 ALA CA . . A . 57 ALA C . . . 56 . C . . . . . 57 . N . . . . . 57 . CA . . . . . 57 . C . . c17360_2l7l 1 112 . . 1 1 57 57 ALA N N . . 1 1 57 57 ALA CA C . . 1 1 57 57 ALA C C . . 1 1 58 58 ASP N N . -44.5 -34.5 . . . A . 57 ALA N . . A . 57 ALA CA . . A . 57 ALA C . . A . 58 ASP N . . . 57 . N . . . . . 57 . CA . . . . . 57 . C . . . . . 58 . N . . c17360_2l7l 1 113 . . 1 1 57 57 ALA C C . . 1 1 58 58 ASP N N . . 1 1 58 58 ASP CA C . . 1 1 58 58 ASP C C . -96.7 -86.7 . . . A . 57 ALA C . . A . 58 ASP N . . A . 58 ASP CA . . A . 58 ASP C . . . 57 . C . . . . . 58 . N . . . . . 58 . CA . . . . . 58 . C . . c17360_2l7l 1 114 . . 1 1 58 58 ASP N N . . 1 1 58 58 ASP CA C . . 1 1 58 58 ASP C C . . 1 1 59 59 GLY N N . -11.6 -1.6 . . . A . 58 ASP N . . A . 58 ASP CA . . A . 58 ASP C . . A . 59 GLY N . . . 58 . N . . . . . 58 . CA . . . . . 58 . C . . . . . 59 . N . . c17360_2l7l 1 115 . . 1 1 58 58 ASP C C . . 1 1 59 59 GLY N N . . 1 1 59 59 GLY CA C . . 1 1 59 59 GLY C C . 54.2 64.2 . . . A . 58 ASP C . . A . 59 GLY N . . A . 59 GLY CA . . A . 59 GLY C . . . 58 . C . . . . . 59 . N . . . . . 59 . CA . . . . . 59 . C . . c17360_2l7l 1 116 . . 1 1 59 59 GLY N N . . 1 1 59 59 GLY CA C . . 1 1 59 59 GLY C C . . 1 1 60 60 ASN N N . 30.9 40.9 . . . A . 59 GLY N . . A . 59 GLY CA . . A . 59 GLY C . . A . 60 ASN N . . . 59 . N . . . . . 59 . CA . . . . . 59 . C . . . . . 60 . N . . c17360_2l7l 1 117 . . 1 1 59 59 GLY C C . . 1 1 60 60 ASN N N . . 1 1 60 60 ASN CA C . . 1 1 60 60 ASN C C . -87.2 -77.2 . . . A . 59 GLY C . . A . 60 ASN N . . A . 60 ASN CA . . A . 60 ASN C . . . 59 . C . . . . . 60 . N . . . . . 60 . CA . . . . . 60 . C . . c17360_2l7l 1 118 . . 1 1 60 60 ASN N N . . 1 1 60 60 ASN CA C . . 1 1 60 60 ASN C C . . 1 1 61 61 GLY N N . -0.2 9.8 . . . A . 60 ASN N . . A . 60 ASN CA . . A . 60 ASN C . . A . 61 GLY N . . . 60 . N . . . . . 60 . CA . . . . . 60 . C . . . . . 61 . N . . c17360_2l7l 1 119 . . 1 1 60 60 ASN C C . . 1 1 61 61 GLY N N . . 1 1 61 61 GLY CA C . . 1 1 61 61 GLY C C . 76.9 86.9 . . . A . 60 ASN C . . A . 61 GLY N . . A . 61 GLY CA . . A . 61 GLY C . . . 60 . C . . . . . 61 . N . . . . . 61 . CA . . . . . 61 . C . . c17360_2l7l 1 120 . . 1 1 61 61 GLY N N . . 1 1 61 61 GLY CA C . . 1 1 61 61 GLY C C . . 1 1 62 62 THR N N . -9.1 0.9 . . . A . 61 GLY N . . A . 61 GLY CA . . A . 61 GLY C . . A . 62 THR N . . . 61 . N . . . . . 61 . CA . . . . . 61 . C . . . . . 62 . N . . c17360_2l7l 1 121 . . 1 1 61 61 GLY C C . . 1 1 62 62 THR N N . . 1 1 62 62 THR CA C . . 1 1 62 62 THR C C . -143.8 -133.8 . . . A . 61 GLY C . . A . 62 THR N . . A . 62 THR CA . . A . 62 THR C . . . 61 . C . . . . . 62 . N . . . . . 62 . CA . . . . . 62 . C . . c17360_2l7l 1 122 . . 1 1 62 62 THR N N . . 1 1 62 62 THR CA C . . 1 1 62 62 THR C C . . 1 1 63 63 ILE N N . 152.1 162.1 . . . A . 62 THR N . . A . 62 THR CA . . A . 62 THR C . . A . 63 ILE N . . . 62 . N . . . . . 62 . CA . . . . . 62 . C . . . . . 63 . N . . c17360_2l7l 1 123 . . 1 1 62 62 THR C C . . 1 1 63 63 ILE N N . . 1 1 63 63 ILE CA C . . 1 1 63 63 ILE C C . -118.2 -108.2 . . . A . 62 THR C . . A . 63 ILE N . . A . 63 ILE CA . . A . 63 ILE C . . . 62 . C . . . . . 63 . N . . . . . 63 . CA . . . . . 63 . C . . c17360_2l7l 1 124 . . 1 1 63 63 ILE N N . . 1 1 63 63 ILE CA C . . 1 1 63 63 ILE C C . . 1 1 64 64 ASP N N . 120.3 130.3 . . . A . 63 ILE N . . A . 63 ILE CA . . A . 63 ILE C . . A . 64 ASP N . . . 63 . N . . . . . 63 . CA . . . . . 63 . C . . . . . 64 . N . . c17360_2l7l 1 125 . . 1 1 63 63 ILE C C . . 1 1 64 64 ASP N N . . 1 1 64 64 ASP CA C . . 1 1 64 64 ASP C C . -95.1 -85.1 . . . A . 63 ILE C . . A . 64 ASP N . . A . 64 ASP CA . . A . 64 ASP C . . . 63 . C . . . . . 64 . N . . . . . 64 . CA . . . . . 64 . C . . c17360_2l7l 1 126 . . 1 1 64 64 ASP N N . . 1 1 64 64 ASP CA C . . 1 1 64 64 ASP C C . . 1 1 65 65 PHE N N . 172.3 182.3 . . . A . 64 ASP N . . A . 64 ASP CA . . A . 64 ASP C . . A . 65 PHE N . . . 64 . N . . . . . 64 . CA . . . . . 64 . C . . . . . 65 . N . . c17360_2l7l 1 127 . . 1 1 64 64 ASP C C . . 1 1 65 65 PHE N N . . 1 1 65 65 PHE CA C . . 1 1 65 65 PHE C C . -57.3 -47.3 . . . A . 64 ASP C . . A . 65 PHE N . . A . 65 PHE CA . . A . 65 PHE C . . . 64 . C . . . . . 65 . N . . . . . 65 . CA . . . . . 65 . C . . c17360_2l7l 1 128 . . 1 1 65 65 PHE N N . . 1 1 65 65 PHE CA C . . 1 1 65 65 PHE C C . . 1 1 66 66 PRO N N . -54.7 -44.7 . . . A . 65 PHE N . . A . 65 PHE CA . . A . 65 PHE C . . A . 66 PRO N . . . 65 . N . . . . . 65 . CA . . . . . 65 . C . . . . . 66 . N . . c17360_2l7l 1 129 . . 1 1 66 66 PRO N N . . 1 1 66 66 PRO CA C . . 1 1 66 66 PRO C C . . 1 1 67 67 GLU N N . -49.5 -39.5 . . . A . 66 PRO N . . A . 66 PRO CA . . A . 66 PRO C . . A . 67 GLU N . . . 66 . N . . . . . 66 . CA . . . . . 66 . C . . . . . 67 . N . . c17360_2l7l 1 130 . . 1 1 66 66 PRO C C . . 1 1 67 67 GLU N N . . 1 1 67 67 GLU CA C . . 1 1 67 67 GLU C C . -69.2 -59.2 . . . A . 66 PRO C . . A . 67 GLU N . . A . 67 GLU CA . . A . 67 GLU C . . . 66 . C . . . . . 67 . N . . . . . 67 . CA . . . . . 67 . C . . c17360_2l7l 1 131 . . 1 1 67 67 GLU N N . . 1 1 67 67 GLU CA C . . 1 1 67 67 GLU C C . . 1 1 68 68 PHE N N . -40.0 -30.0 . . . A . 67 GLU N . . A . 67 GLU CA . . A . 67 GLU C . . A . 68 PHE N . . . 67 . N . . . . . 67 . CA . . . . . 67 . C . . . . . 68 . N . . c17360_2l7l 1 132 . . 1 1 67 67 GLU C C . . 1 1 68 68 PHE N N . . 1 1 68 68 PHE CA C . . 1 1 68 68 PHE C C . -63.0 -53.0 . . . A . 67 GLU C . . A . 68 PHE N . . A . 68 PHE CA . . A . 68 PHE C . . . 67 . C . . . . . 68 . N . . . . . 68 . CA . . . . . 68 . C . . c17360_2l7l 1 133 . . 1 1 68 68 PHE N N . . 1 1 68 68 PHE CA C . . 1 1 68 68 PHE C C . . 1 1 69 69 LEU N N . -52.2 -42.2 . . . A . 68 PHE N . . A . 68 PHE CA . . A . 68 PHE C . . A . 69 LEU N . . . 68 . N . . . . . 68 . CA . . . . . 68 . C . . . . . 69 . N . . c17360_2l7l 1 134 . . 1 1 68 68 PHE C C . . 1 1 69 69 LEU N N . . 1 1 69 69 LEU CA C . . 1 1 69 69 LEU C C . -59.8 -49.8 . . . A . 68 PHE C . . A . 69 LEU N . . A . 69 LEU CA . . A . 69 LEU C . . . 68 . C . . . . . 69 . N . . . . . 69 . CA . . . . . 69 . C . . c17360_2l7l 1 135 . . 1 1 69 69 LEU N N . . 1 1 69 69 LEU CA C . . 1 1 69 69 LEU C C . . 1 1 70 70 THR N N . -41.4 -31.4 . . . A . 69 LEU N . . A . 69 LEU CA . . A . 69 LEU C . . A . 70 THR N . . . 69 . N . . . . . 69 . CA . . . . . 69 . C . . . . . 70 . N . . c17360_2l7l 1 136 . . 1 1 69 69 LEU C C . . 1 1 70 70 THR N N . . 1 1 70 70 THR CA C . . 1 1 70 70 THR C C . -67.8 -57.8 . . . A . 69 LEU C . . A . 70 THR N . . A . 70 THR CA . . A . 70 THR C . . . 69 . C . . . . . 70 . N . . . . . 70 . CA . . . . . 70 . C . . c17360_2l7l 1 137 . . 1 1 70 70 THR N N . . 1 1 70 70 THR CA C . . 1 1 70 70 THR C C . . 1 1 71 71 MET N N . -49.8 -39.8 . . . A . 70 THR N . . A . 70 THR CA . . A . 70 THR C . . A . 71 MET N . . . 70 . N . . . . . 70 . CA . . . . . 70 . C . . . . . 71 . N . . c17360_2l7l 1 138 . . 1 1 70 70 THR C C . . 1 1 71 71 MET N N . . 1 1 71 71 MET CA C . . 1 1 71 71 MET C C . -63.2 -53.2 . . . A . 70 THR C . . A . 71 MET N . . A . 71 MET CA . . A . 71 MET C . . . 70 . C . . . . . 71 . N . . . . . 71 . CA . . . . . 71 . C . . c17360_2l7l 1 139 . . 1 1 71 71 MET N N . . 1 1 71 71 MET CA C . . 1 1 71 71 MET C C . . 1 1 72 72 MET N N . -53.7 -43.7 . . . A . 71 MET N . . A . 71 MET CA . . A . 71 MET C . . A . 72 MET N . . . 71 . N . . . . . 71 . CA . . . . . 71 . C . . . . . 72 . N . . c17360_2l7l 1 140 . . 1 1 71 71 MET C C . . 1 1 72 72 MET N N . . 1 1 72 72 MET CA C . . 1 1 72 72 MET C C . -75.5 -65.5 . . . A . 71 MET C . . A . 72 MET N . . A . 72 MET CA . . A . 72 MET C . . . 71 . C . . . . . 72 . N . . . . . 72 . CA . . . . . 72 . C . . c17360_2l7l 1 141 . . 1 1 72 72 MET N N . . 1 1 72 72 MET CA C . . 1 1 72 72 MET C C . . 1 1 73 73 ALA N N . -24.9 -14.9 . . . A . 72 MET N . . A . 72 MET CA . . A . 72 MET C . . A . 73 ALA N . . . 72 . N . . . . . 72 . CA . . . . . 72 . C . . . . . 73 . N . . c17360_2l7l 1 142 . . 1 1 72 72 MET C C . . 1 1 73 73 ALA N N . . 1 1 73 73 ALA CA C . . 1 1 73 73 ALA C C . -82.9 -72.9 . . . A . 72 MET C . . A . 73 ALA N . . A . 73 ALA CA . . A . 73 ALA C . . . 72 . C . . . . . 73 . N . . . . . 73 . CA . . . . . 73 . C . . c17360_2l7l 1 143 . . 1 1 73 73 ALA N N . . 1 1 73 73 ALA CA C . . 1 1 73 73 ALA C C . . 1 1 74 74 ARG N N . -30.2 -20.2 . . . A . 73 ALA N . . A . 73 ALA CA . . A . 73 ALA C . . A . 74 ARG N . . . 73 . N . . . . . 73 . CA . . . . . 73 . C . . . . . 74 . N . . c17360_2l7l 1 144 . . 1 1 73 73 ALA C C . . 1 1 74 74 ARG N N . . 1 1 74 74 ARG CA C . . 1 1 74 74 ARG C C . -73.6 -63.6 . . . A . 73 ALA C . . A . 74 ARG N . . A . 74 ARG CA . . A . 74 ARG C . . . 73 . C . . . . . 74 . N . . . . . 74 . CA . . . . . 74 . C . . c17360_2l7l 1 145 . . 1 1 74 74 ARG N N . . 1 1 74 74 ARG CA C . . 1 1 74 74 ARG C C . . 1 1 75 75 LYS N N . -54.3 -44.3 . . . A . 74 ARG N . . A . 74 ARG CA . . A . 74 ARG C . . A . 75 LYS N . . . 74 . N . . . . . 74 . CA . . . . . 74 . C . . . . . 75 . N . . c17360_2l7l 1 146 . . 1 1 74 74 ARG C C . . 1 1 75 75 LYS N N . . 1 1 75 75 LYS CA C . . 1 1 75 75 LYS C C . -76.8 -66.8 . . . A . 74 ARG C . . A . 75 LYS N . . A . 75 LYS CA . . A . 75 LYS C . . . 74 . C . . . . . 75 . N . . . . . 75 . CA . . . . . 75 . C . . c17360_2l7l 1 147 . . 1 1 75 75 LYS N N . . 1 1 75 75 LYS CA C . . 1 1 75 75 LYS C C . . 1 1 76 76 MET N N . -42.4 -32.4 . . . A . 75 LYS N . . A . 75 LYS CA . . A . 75 LYS C . . A . 76 MET N . . . 75 . N . . . . . 75 . CA . . . . . 75 . C . . . . . 76 . N . . c17360_2l7l 1 148 . . 1 1 75 75 LYS C C . . 1 1 76 76 MET N N . . 1 1 76 76 MET CA C . . 1 1 76 76 MET C C . -61.7 -51.7 . . . A . 75 LYS C . . A . 76 MET N . . A . 76 MET CA . . A . 76 MET C . . . 75 . C . . . . . 76 . N . . . . . 76 . CA . . . . . 76 . C . . c17360_2l7l 1 149 . . 1 1 76 76 MET N N . . 1 1 76 76 MET CA C . . 1 1 76 76 MET C C . . 1 1 77 77 LYS N N . -47.6 -37.6 . . . A . 76 MET N . . A . 76 MET CA . . A . 76 MET C . . A . 77 LYS N . . . 76 . N . . . . . 76 . CA . . . . . 76 . C . . . . . 77 . N . . c17360_2l7l 1 150 . . 1 1 76 76 MET C C . . 1 1 77 77 LYS N N . . 1 1 77 77 LYS CA C . . 1 1 77 77 LYS C C . -67.0 -57.0 . . . A . 76 MET C . . A . 77 LYS N . . A . 77 LYS CA . . A . 77 LYS C . . . 76 . C . . . . . 77 . N . . . . . 77 . CA . . . . . 77 . C . . c17360_2l7l 1 151 . . 1 1 77 77 LYS N N . . 1 1 77 77 LYS CA C . . 1 1 77 77 LYS C C . . 1 1 78 78 ASP N N . -51.5 -41.5 . . . A . 77 LYS N . . A . 77 LYS CA . . A . 77 LYS C . . A . 78 ASP N . . . 77 . N . . . . . 77 . CA . . . . . 77 . C . . . . . 78 . N . . c17360_2l7l 1 152 . . 1 1 77 77 LYS C C . . 1 1 78 78 ASP N N . . 1 1 78 78 ASP CA C . . 1 1 78 78 ASP C C . -104.5 -94.5 . . . A . 77 LYS C . . A . 78 ASP N . . A . 78 ASP CA . . A . 78 ASP C . . . 77 . C . . . . . 78 . N . . . . . 78 . CA . . . . . 78 . C . . c17360_2l7l 1 153 . . 1 1 78 78 ASP N N . . 1 1 78 78 ASP CA C . . 1 1 78 78 ASP C C . . 1 1 79 79 THR N N . 17.1 27.1 . . . A . 78 ASP N . . A . 78 ASP CA . . A . 78 ASP C . . A . 79 THR N . . . 78 . N . . . . . 78 . CA . . . . . 78 . C . . . . . 79 . N . . c17360_2l7l 1 154 . . 1 1 78 78 ASP C C . . 1 1 79 79 THR N N . . 1 1 79 79 THR CA C . . 1 1 79 79 THR C C . -60.8 -50.8 . . . A . 78 ASP C . . A . 79 THR N . . A . 79 THR CA . . A . 79 THR C . . . 78 . C . . . . . 79 . N . . . . . 79 . CA . . . . . 79 . C . . c17360_2l7l 1 155 . . 1 1 79 79 THR N N . . 1 1 79 79 THR CA C . . 1 1 79 79 THR C C . . 1 1 80 80 ASP N N . 93.4 103.4 . . . A . 79 THR N . . A . 79 THR CA . . A . 79 THR C . . A . 80 ASP N . . . 79 . N . . . . . 79 . CA . . . . . 79 . C . . . . . 80 . N . . c17360_2l7l 1 156 . . 1 1 79 79 THR C C . . 1 1 80 80 ASP N N . . 1 1 80 80 ASP CA C . . 1 1 80 80 ASP C C . -98.5 -88.5 . . . A . 79 THR C . . A . 80 ASP N . . A . 80 ASP CA . . A . 80 ASP C . . . 79 . C . . . . . 80 . N . . . . . 80 . CA . . . . . 80 . C . . c17360_2l7l 1 157 . . 1 1 80 80 ASP N N . . 1 1 80 80 ASP CA C . . 1 1 80 80 ASP C C . . 1 1 81 81 SER N N . 81.1 91.1 . . . A . 80 ASP N . . A . 80 ASP CA . . A . 80 ASP C . . A . 81 SER N . . . 80 . N . . . . . 80 . CA . . . . . 80 . C . . . . . 81 . N . . c17360_2l7l 1 158 . . 1 1 80 80 ASP C C . . 1 1 81 81 SER N N . . 1 1 81 81 SER CA C . . 1 1 81 81 SER C C . -49.2 -39.2 . . . A . 80 ASP C . . A . 81 SER N . . A . 81 SER CA . . A . 81 SER C . . . 80 . C . . . . . 81 . N . . . . . 81 . CA . . . . . 81 . C . . c17360_2l7l 1 159 . . 1 1 81 81 SER N N . . 1 1 81 81 SER CA C . . 1 1 81 81 SER C C . . 1 1 82 82 GLU N N . -24.1 -14.1 . . . A . 81 SER N . . A . 81 SER CA . . A . 81 SER C . . A . 82 GLU N . . . 81 . N . . . . . 81 . CA . . . . . 81 . C . . . . . 82 . N . . c17360_2l7l 1 160 . . 1 1 81 81 SER C C . . 1 1 82 82 GLU N N . . 1 1 82 82 GLU CA C . . 1 1 82 82 GLU C C . -83.9 -73.9 . . . A . 81 SER C . . A . 82 GLU N . . A . 82 GLU CA . . A . 82 GLU C . . . 81 . C . . . . . 82 . N . . . . . 82 . CA . . . . . 82 . C . . c17360_2l7l 1 161 . . 1 1 82 82 GLU N N . . 1 1 82 82 GLU CA C . . 1 1 82 82 GLU C C . . 1 1 83 83 GLU N N . -69.0 -59.0 . . . A . 82 GLU N . . A . 82 GLU CA . . A . 82 GLU C . . A . 83 GLU N . . . 82 . N . . . . . 82 . CA . . . . . 82 . C . . . . . 83 . N . . c17360_2l7l 1 162 . . 1 1 82 82 GLU C C . . 1 1 83 83 GLU N N . . 1 1 83 83 GLU CA C . . 1 1 83 83 GLU C C . -70.0 -60.0 . . . A . 82 GLU C . . A . 83 GLU N . . A . 83 GLU CA . . A . 83 GLU C . . . 82 . C . . . . . 83 . N . . . . . 83 . CA . . . . . 83 . C . . c17360_2l7l 1 163 . . 1 1 83 83 GLU N N . . 1 1 83 83 GLU CA C . . 1 1 83 83 GLU C C . . 1 1 84 84 GLU N N . -45.9 -35.9 . . . A . 83 GLU N . . A . 83 GLU CA . . A . 83 GLU C . . A . 84 GLU N . . . 83 . N . . . . . 83 . CA . . . . . 83 . C . . . . . 84 . N . . c17360_2l7l 1 164 . . 1 1 83 83 GLU C C . . 1 1 84 84 GLU N N . . 1 1 84 84 GLU CA C . . 1 1 84 84 GLU C C . -62.5 -52.5 . . . A . 83 GLU C . . A . 84 GLU N . . A . 84 GLU CA . . A . 84 GLU C . . . 83 . C . . . . . 84 . N . . . . . 84 . CA . . . . . 84 . C . . c17360_2l7l 1 165 . . 1 1 84 84 GLU N N . . 1 1 84 84 GLU CA C . . 1 1 84 84 GLU C C . . 1 1 85 85 ILE N N . -53.3 -43.3 . . . A . 84 GLU N . . A . 84 GLU CA . . A . 84 GLU C . . A . 85 ILE N . . . 84 . N . . . . . 84 . CA . . . . . 84 . C . . . . . 85 . N . . c17360_2l7l 1 166 . . 1 1 84 84 GLU C C . . 1 1 85 85 ILE N N . . 1 1 85 85 ILE CA C . . 1 1 85 85 ILE C C . -72.5 -62.5 . . . A . 84 GLU C . . A . 85 ILE N . . A . 85 ILE CA . . A . 85 ILE C . . . 84 . C . . . . . 85 . N . . . . . 85 . CA . . . . . 85 . C . . c17360_2l7l 1 167 . . 1 1 85 85 ILE N N . . 1 1 85 85 ILE CA C . . 1 1 85 85 ILE C C . . 1 1 86 86 ARG N N . -46.9 -36.9 . . . A . 85 ILE N . . A . 85 ILE CA . . A . 85 ILE C . . A . 86 ARG N . . . 85 . N . . . . . 85 . CA . . . . . 85 . C . . . . . 86 . N . . c17360_2l7l 1 168 . . 1 1 85 85 ILE C C . . 1 1 86 86 ARG N N . . 1 1 86 86 ARG CA C . . 1 1 86 86 ARG C C . -67.7 -57.7 . . . A . 85 ILE C . . A . 86 ARG N . . A . 86 ARG CA . . A . 86 ARG C . . . 85 . C . . . . . 86 . N . . . . . 86 . CA . . . . . 86 . C . . c17360_2l7l 1 169 . . 1 1 86 86 ARG N N . . 1 1 86 86 ARG CA C . . 1 1 86 86 ARG C C . . 1 1 87 87 GLU N N . -48.4 -38.4 . . . A . 86 ARG N . . A . 86 ARG CA . . A . 86 ARG C . . A . 87 GLU N . . . 86 . N . . . . . 86 . CA . . . . . 86 . C . . . . . 87 . N . . c17360_2l7l 1 170 . . 1 1 86 86 ARG C C . . 1 1 87 87 GLU N N . . 1 1 87 87 GLU CA C . . 1 1 87 87 GLU C C . -73.4 -63.4 . . . A . 86 ARG C . . A . 87 GLU N . . A . 87 GLU CA . . A . 87 GLU C . . . 86 . C . . . . . 87 . N . . . . . 87 . CA . . . . . 87 . C . . c17360_2l7l 1 171 . . 1 1 87 87 GLU N N . . 1 1 87 87 GLU CA C . . 1 1 87 87 GLU C C . . 1 1 88 88 ALA N N . -47.2 -37.2 . . . A . 87 GLU N . . A . 87 GLU CA . . A . 87 GLU C . . A . 88 ALA N . . . 87 . N . . . . . 87 . CA . . . . . 87 . C . . . . . 88 . N . . c17360_2l7l 1 172 . . 1 1 87 87 GLU C C . . 1 1 88 88 ALA N N . . 1 1 88 88 ALA CA C . . 1 1 88 88 ALA C C . -71.0 -61.0 . . . A . 87 GLU C . . A . 88 ALA N . . A . 88 ALA CA . . A . 88 ALA C . . . 87 . C . . . . . 88 . N . . . . . 88 . CA . . . . . 88 . C . . c17360_2l7l 1 173 . . 1 1 88 88 ALA N N . . 1 1 88 88 ALA CA C . . 1 1 88 88 ALA C C . . 1 1 89 89 PHE N N . -50.0 -40.0 . . . A . 88 ALA N . . A . 88 ALA CA . . A . 88 ALA C . . A . 89 PHE N . . . 88 . N . . . . . 88 . CA . . . . . 88 . C . . . . . 89 . N . . c17360_2l7l 1 174 . . 1 1 88 88 ALA C C . . 1 1 89 89 PHE N N . . 1 1 89 89 PHE CA C . . 1 1 89 89 PHE C C . -58.8 -48.8 . . . A . 88 ALA C . . A . 89 PHE N . . A . 89 PHE CA . . A . 89 PHE C . . . 88 . C . . . . . 89 . N . . . . . 89 . CA . . . . . 89 . C . . c17360_2l7l 1 175 . . 1 1 89 89 PHE N N . . 1 1 89 89 PHE CA C . . 1 1 89 89 PHE C C . . 1 1 90 90 ARG N N . -49.0 -39.0 . . . A . 89 PHE N . . A . 89 PHE CA . . A . 89 PHE C . . A . 90 ARG N . . . 89 . N . . . . . 89 . CA . . . . . 89 . C . . . . . 90 . N . . c17360_2l7l 1 176 . . 1 1 89 89 PHE C C . . 1 1 90 90 ARG N N . . 1 1 90 90 ARG CA C . . 1 1 90 90 ARG C C . -72.0 -62.0 . . . A . 89 PHE C . . A . 90 ARG N . . A . 90 ARG CA . . A . 90 ARG C . . . 89 . C . . . . . 90 . N . . . . . 90 . CA . . . . . 90 . C . . c17360_2l7l 1 177 . . 1 1 90 90 ARG N N . . 1 1 90 90 ARG CA C . . 1 1 90 90 ARG C C . . 1 1 91 91 VAL N N . -40.1 -30.1 . . . A . 90 ARG N . . A . 90 ARG CA . . A . 90 ARG C . . A . 91 VAL N . . . 90 . N . . . . . 90 . CA . . . . . 90 . C . . . . . 91 . N . . c17360_2l7l 1 178 . . 1 1 90 90 ARG C C . . 1 1 91 91 VAL N N . . 1 1 91 91 VAL CA C . . 1 1 91 91 VAL C C . -75.8 -65.8 . . . A . 90 ARG C . . A . 91 VAL N . . A . 91 VAL CA . . A . 91 VAL C . . . 90 . C . . . . . 91 . N . . . . . 91 . CA . . . . . 91 . C . . c17360_2l7l 1 179 . . 1 1 91 91 VAL N N . . 1 1 91 91 VAL CA C . . 1 1 91 91 VAL C C . . 1 1 92 92 PHE N N . -51.1 -41.1 . . . A . 91 VAL N . . A . 91 VAL CA . . A . 91 VAL C . . A . 92 PHE N . . . 91 . N . . . . . 91 . CA . . . . . 91 . C . . . . . 92 . N . . c17360_2l7l 1 180 . . 1 1 91 91 VAL C C . . 1 1 92 92 PHE N N . . 1 1 92 92 PHE CA C . . 1 1 92 92 PHE C C . -74.9 -64.9 . . . A . 91 VAL C . . A . 92 PHE N . . A . 92 PHE CA . . A . 92 PHE C . . . 91 . C . . . . . 92 . N . . . . . 92 . CA . . . . . 92 . C . . c17360_2l7l 1 181 . . 1 1 92 92 PHE N N . . 1 1 92 92 PHE CA C . . 1 1 92 92 PHE C C . . 1 1 93 93 ASP N N . -44.8 -34.8 . . . A . 92 PHE N . . A . 92 PHE CA . . A . 92 PHE C . . A . 93 ASP N . . . 92 . N . . . . . 92 . CA . . . . . 92 . C . . . . . 93 . N . . c17360_2l7l 1 182 . . 1 1 92 92 PHE C C . . 1 1 93 93 ASP N N . . 1 1 93 93 ASP CA C . . 1 1 93 93 ASP C C . -87.1 -77.1 . . . A . 92 PHE C . . A . 93 ASP N . . A . 93 ASP CA . . A . 93 ASP C . . . 92 . C . . . . . 93 . N . . . . . 93 . CA . . . . . 93 . C . . c17360_2l7l 1 183 . . 1 1 93 93 ASP N N . . 1 1 93 93 ASP CA C . . 1 1 93 93 ASP C C . . 1 1 94 94 LYS N N . 69.7 79.7 . . . A . 93 ASP N . . A . 93 ASP CA . . A . 93 ASP C . . A . 94 LYS N . . . 93 . N . . . . . 93 . CA . . . . . 93 . C . . . . . 94 . N . . c17360_2l7l 1 184 . . 1 1 93 93 ASP C C . . 1 1 94 94 LYS N N . . 1 1 94 94 LYS CA C . . 1 1 94 94 LYS C C . -54.0 -44.0 . . . A . 93 ASP C . . A . 94 LYS N . . A . 94 LYS CA . . A . 94 LYS C . . . 93 . C . . . . . 94 . N . . . . . 94 . CA . . . . . 94 . C . . c17360_2l7l 1 185 . . 1 1 94 94 LYS N N . . 1 1 94 94 LYS CA C . . 1 1 94 94 LYS C C . . 1 1 95 95 ASP N N . -50.6 -40.6 . . . A . 94 LYS N . . A . 94 LYS CA . . A . 94 LYS C . . A . 95 ASP N . . . 94 . N . . . . . 94 . CA . . . . . 94 . C . . . . . 95 . N . . c17360_2l7l 1 186 . . 1 1 94 94 LYS C C . . 1 1 95 95 ASP N N . . 1 1 95 95 ASP CA C . . 1 1 95 95 ASP C C . -86.0 -76.0 . . . A . 94 LYS C . . A . 95 ASP N . . A . 95 ASP CA . . A . 95 ASP C . . . 94 . C . . . . . 95 . N . . . . . 95 . CA . . . . . 95 . C . . c17360_2l7l 1 187 . . 1 1 95 95 ASP N N . . 1 1 95 95 ASP CA C . . 1 1 95 95 ASP C C . . 1 1 96 96 GLY N N . -9.5 0.5 . . . A . 95 ASP N . . A . 95 ASP CA . . A . 95 ASP C . . A . 96 GLY N . . . 95 . N . . . . . 95 . CA . . . . . 95 . C . . . . . 96 . N . . c17360_2l7l 1 188 . . 1 1 95 95 ASP C C . . 1 1 96 96 GLY N N . . 1 1 96 96 GLY CA C . . 1 1 96 96 GLY C C . 45.2 55.2 . . . A . 95 ASP C . . A . 96 GLY N . . A . 96 GLY CA . . A . 96 GLY C . . . 95 . C . . . . . 96 . N . . . . . 96 . CA . . . . . 96 . C . . c17360_2l7l 1 189 . . 1 1 96 96 GLY N N . . 1 1 96 96 GLY CA C . . 1 1 96 96 GLY C C . . 1 1 97 97 ASN N N . 32.5 42.5 . . . A . 96 GLY N . . A . 96 GLY CA . . A . 96 GLY C . . A . 97 ASN N . . . 96 . N . . . . . 96 . CA . . . . . 96 . C . . . . . 97 . N . . c17360_2l7l 1 190 . . 1 1 96 96 GLY C C . . 1 1 97 97 ASN N N . . 1 1 97 97 ASN CA C . . 1 1 97 97 ASN C C . -87.0 -77.0 . . . A . 96 GLY C . . A . 97 ASN N . . A . 97 ASN CA . . A . 97 ASN C . . . 96 . C . . . . . 97 . N . . . . . 97 . CA . . . . . 97 . C . . c17360_2l7l 1 191 . . 1 1 97 97 ASN N N . . 1 1 97 97 ASN CA C . . 1 1 97 97 ASN C C . . 1 1 98 98 GLY N N . -6.0 4.0 . . . A . 97 ASN N . . A . 97 ASN CA . . A . 97 ASN C . . A . 98 GLY N . . . 97 . N . . . . . 97 . CA . . . . . 97 . C . . . . . 98 . N . . c17360_2l7l 1 192 . . 1 1 97 97 ASN C C . . 1 1 98 98 GLY N N . . 1 1 98 98 GLY CA C . . 1 1 98 98 GLY C C . 88.1 98.1 . . . A . 97 ASN C . . A . 98 GLY N . . A . 98 GLY CA . . A . 98 GLY C . . . 97 . C . . . . . 98 . N . . . . . 98 . CA . . . . . 98 . C . . c17360_2l7l 1 193 . . 1 1 98 98 GLY N N . . 1 1 98 98 GLY CA C . . 1 1 98 98 GLY C C . . 1 1 99 99 TYR N N . -8.2 1.8 . . . A . 98 GLY N . . A . 98 GLY CA . . A . 98 GLY C . . A . 99 TYR N . . . 98 . N . . . . . 98 . CA . . . . . 98 . C . . . . . 99 . N . . c17360_2l7l 1 194 . . 1 1 98 98 GLY C C . . 1 1 99 99 TYR N N . . 1 1 99 99 TYR CA C . . 1 1 99 99 TYR C C . -136.4 -126.4 . . . A . 98 GLY C . . A . 99 TYR N . . A . 99 TYR CA . . A . 99 TYR C . . . 98 . C . . . . . 99 . N . . . . . 99 . CA . . . . . 99 . C . . c17360_2l7l 1 195 . . 1 1 99 99 TYR N N . . 1 1 99 99 TYR CA C . . 1 1 99 99 TYR C C . . 1 1 100 100 ILE N N . 133.2 143.2 . . . A . 99 TYR N . . A . 99 TYR CA . . A . 99 TYR C . . A . 100 ILE N . . . 99 . N . . . . . 99 . CA . . . . . 99 . C . . . . . 100 . N . . c17360_2l7l 1 196 . . 1 1 99 99 TYR C C . . 1 1 100 100 ILE N N . . 1 1 100 100 ILE CA C . . 1 1 100 100 ILE C C . -99.8 -89.8 . . . A . 99 TYR C . . A . 100 ILE N . . A . 100 ILE CA . . A . 100 ILE C . . . 99 . C . . . . . 100 . N . . . . . 100 . CA . . . . . 100 . C . . c17360_2l7l 1 197 . . 1 1 100 100 ILE N N . . 1 1 100 100 ILE CA C . . 1 1 100 100 ILE C C . . 1 1 101 101 SER N N . 110.9 120.9 . . . A . 100 ILE N . . A . 100 ILE CA . . A . 100 ILE C . . A . 101 SER N . . . 100 . N . . . . . 100 . CA . . . . . 100 . C . . . . . 101 . N . . c17360_2l7l 1 198 . . 1 1 100 100 ILE C C . . 1 1 101 101 SER N N . . 1 1 101 101 SER CA C . . 1 1 101 101 SER C C . -90.6 -80.6 . . . A . 100 ILE C . . A . 101 SER N . . A . 101 SER CA . . A . 101 SER C . . . 100 . C . . . . . 101 . N . . . . . 101 . CA . . . . . 101 . C . . c17360_2l7l 1 199 . . 1 1 101 101 SER N N . . 1 1 101 101 SER CA C . . 1 1 101 101 SER C C . . 1 1 102 102 ALA N N . 154.5 164.5 . . . A . 101 SER N . . A . 101 SER CA . . A . 101 SER C . . A . 102 ALA N . . . 101 . N . . . . . 101 . CA . . . . . 101 . C . . . . . 102 . N . . c17360_2l7l 1 200 . . 1 1 101 101 SER C C . . 1 1 102 102 ALA N N . . 1 1 102 102 ALA CA C . . 1 1 102 102 ALA C C . -69.8 -59.8 . . . A . 101 SER C . . A . 102 ALA N . . A . 102 ALA CA . . A . 102 ALA C . . . 101 . C . . . . . 102 . N . . . . . 102 . CA . . . . . 102 . C . . c17360_2l7l 1 201 . . 1 1 102 102 ALA N N . . 1 1 102 102 ALA CA C . . 1 1 102 102 ALA C C . . 1 1 103 103 ALA N N . -49.8 -39.8 . . . A . 102 ALA N . . A . 102 ALA CA . . A . 102 ALA C . . A . 103 ALA N . . . 102 . N . . . . . 102 . CA . . . . . 102 . C . . . . . 103 . N . . c17360_2l7l 1 202 . . 1 1 102 102 ALA C C . . 1 1 103 103 ALA N N . . 1 1 103 103 ALA CA C . . 1 1 103 103 ALA C C . -60.5 -50.5 . . . A . 102 ALA C . . A . 103 ALA N . . A . 103 ALA CA . . A . 103 ALA C . . . 102 . C . . . . . 103 . N . . . . . 103 . CA . . . . . 103 . C . . c17360_2l7l 1 203 . . 1 1 103 103 ALA N N . . 1 1 103 103 ALA CA C . . 1 1 103 103 ALA C C . . 1 1 104 104 GLU N N . -48.8 -38.8 . . . A . 103 ALA N . . A . 103 ALA CA . . A . 103 ALA C . . A . 104 GLU N . . . 103 . N . . . . . 103 . CA . . . . . 103 . C . . . . . 104 . N . . c17360_2l7l 1 204 . . 1 1 103 103 ALA C C . . 1 1 104 104 GLU N N . . 1 1 104 104 GLU CA C . . 1 1 104 104 GLU C C . -66.5 -56.5 . . . A . 103 ALA C . . A . 104 GLU N . . A . 104 GLU CA . . A . 104 GLU C . . . 103 . C . . . . . 104 . N . . . . . 104 . CA . . . . . 104 . C . . c17360_2l7l 1 205 . . 1 1 104 104 GLU N N . . 1 1 104 104 GLU CA C . . 1 1 104 104 GLU C C . . 1 1 105 105 LEU N N . -50.4 -40.4 . . . A . 104 GLU N . . A . 104 GLU CA . . A . 104 GLU C . . A . 105 LEU N . . . 104 . N . . . . . 104 . CA . . . . . 104 . C . . . . . 105 . N . . c17360_2l7l 1 206 . . 1 1 104 104 GLU C C . . 1 1 105 105 LEU N N . . 1 1 105 105 LEU CA C . . 1 1 105 105 LEU C C . -64.5 -54.5 . . . A . 104 GLU C . . A . 105 LEU N . . A . 105 LEU CA . . A . 105 LEU C . . . 104 . C . . . . . 105 . N . . . . . 105 . CA . . . . . 105 . C . . c17360_2l7l 1 207 . . 1 1 105 105 LEU N N . . 1 1 105 105 LEU CA C . . 1 1 105 105 LEU C C . . 1 1 106 106 ARG N N . -44.2 -34.2 . . . A . 105 LEU N . . A . 105 LEU CA . . A . 105 LEU C . . A . 106 ARG N . . . 105 . N . . . . . 105 . CA . . . . . 105 . C . . . . . 106 . N . . c17360_2l7l 1 208 . . 1 1 105 105 LEU C C . . 1 1 106 106 ARG N N . . 1 1 106 106 ARG CA C . . 1 1 106 106 ARG C C . -65.4 -55.4 . . . A . 105 LEU C . . A . 106 ARG N . . A . 106 ARG CA . . A . 106 ARG C . . . 105 . C . . . . . 106 . N . . . . . 106 . CA . . . . . 106 . C . . c17360_2l7l 1 209 . . 1 1 106 106 ARG N N . . 1 1 106 106 ARG CA C . . 1 1 106 106 ARG C C . . 1 1 107 107 HIS N N . -44.4 -34.4 . . . A . 106 ARG N . . A . 106 ARG CA . . A . 106 ARG C . . A . 107 HIS N . . . 106 . N . . . . . 106 . CA . . . . . 106 . C . . . . . 107 . N . . c17360_2l7l 1 210 . . 1 1 106 106 ARG C C . . 1 1 107 107 HIS N N . . 1 1 107 107 HIS CA C . . 1 1 107 107 HIS C C . -69.5 -59.5 . . . A . 106 ARG C . . A . 107 HIS N . . A . 107 HIS CA . . A . 107 HIS C . . . 106 . C . . . . . 107 . N . . . . . 107 . CA . . . . . 107 . C . . c17360_2l7l 1 211 . . 1 1 107 107 HIS N N . . 1 1 107 107 HIS CA C . . 1 1 107 107 HIS C C . . 1 1 108 108 VAL N N . -56.1 -46.1 . . . A . 107 HIS N . . A . 107 HIS CA . . A . 107 HIS C . . A . 108 VAL N . . . 107 . N . . . . . 107 . CA . . . . . 107 . C . . . . . 108 . N . . c17360_2l7l 1 212 . . 1 1 107 107 HIS C C . . 1 1 108 108 VAL N N . . 1 1 108 108 VAL CA C . . 1 1 108 108 VAL C C . -70.0 -60.0 . . . A . 107 HIS C . . A . 108 VAL N . . A . 108 VAL CA . . A . 108 VAL C . . . 107 . C . . . . . 108 . N . . . . . 108 . CA . . . . . 108 . C . . c17360_2l7l 1 213 . . 1 1 108 108 VAL N N . . 1 1 108 108 VAL CA C . . 1 1 108 108 VAL C C . . 1 1 109 109 MET N N . -46.2 -36.2 . . . A . 108 VAL N . . A . 108 VAL CA . . A . 108 VAL C . . A . 109 MET N . . . 108 . N . . . . . 108 . CA . . . . . 108 . C . . . . . 109 . N . . c17360_2l7l 1 214 . . 1 1 108 108 VAL C C . . 1 1 109 109 MET N N . . 1 1 109 109 MET CA C . . 1 1 109 109 MET C C . -71.6 -61.6 . . . A . 108 VAL C . . A . 109 MET N . . A . 109 MET CA . . A . 109 MET C . . . 108 . C . . . . . 109 . N . . . . . 109 . CA . . . . . 109 . C . . c17360_2l7l 1 215 . . 1 1 109 109 MET N N . . 1 1 109 109 MET CA C . . 1 1 109 109 MET C C . . 1 1 110 110 THR N N . -44.7 -34.7 . . . A . 109 MET N . . A . 109 MET CA . . A . 109 MET C . . A . 110 THR N . . . 109 . N . . . . . 109 . CA . . . . . 109 . C . . . . . 110 . N . . c17360_2l7l 1 216 . . 1 1 109 109 MET C C . . 1 1 110 110 THR N N . . 1 1 110 110 THR CA C . . 1 1 110 110 THR C C . -65.9 -55.9 . . . A . 109 MET C . . A . 110 THR N . . A . 110 THR CA . . A . 110 THR C . . . 109 . C . . . . . 110 . N . . . . . 110 . CA . . . . . 110 . C . . c17360_2l7l 1 217 . . 1 1 110 110 THR N N . . 1 1 110 110 THR CA C . . 1 1 110 110 THR C C . . 1 1 111 111 ASN N N . -44.7 -34.7 . . . A . 110 THR N . . A . 110 THR CA . . A . 110 THR C . . A . 111 ASN N . . . 110 . N . . . . . 110 . CA . . . . . 110 . C . . . . . 111 . N . . c17360_2l7l 1 218 . . 1 1 110 110 THR C C . . 1 1 111 111 ASN N N . . 1 1 111 111 ASN CA C . . 1 1 111 111 ASN C C . -64.6 -54.6 . . . A . 110 THR C . . A . 111 ASN N . . A . 111 ASN CA . . A . 111 ASN C . . . 110 . C . . . . . 111 . N . . . . . 111 . CA . . . . . 111 . C . . c17360_2l7l 1 219 . . 1 1 111 111 ASN N N . . 1 1 111 111 ASN CA C . . 1 1 111 111 ASN C C . . 1 1 112 112 LEU N N . -39.0 -29.0 . . . A . 111 ASN N . . A . 111 ASN CA . . A . 111 ASN C . . A . 112 LEU N . . . 111 . N . . . . . 111 . CA . . . . . 111 . C . . . . . 112 . N . . c17360_2l7l 1 220 . . 1 1 111 111 ASN C C . . 1 1 112 112 LEU N N . . 1 1 112 112 LEU CA C . . 1 1 112 112 LEU C C . -75.5 -65.5 . . . A . 111 ASN C . . A . 112 LEU N . . A . 112 LEU CA . . A . 112 LEU C . . . 111 . C . . . . . 112 . N . . . . . 112 . CA . . . . . 112 . C . . c17360_2l7l 1 221 . . 1 1 112 112 LEU N N . . 1 1 112 112 LEU CA C . . 1 1 112 112 LEU C C . . 1 1 113 113 GLY N N . -10.6 -0.6 . . . A . 112 LEU N . . A . 112 LEU CA . . A . 112 LEU C . . A . 113 GLY N . . . 112 . N . . . . . 112 . CA . . . . . 112 . C . . . . . 113 . N . . c17360_2l7l 1 222 . . 1 1 112 112 LEU C C . . 1 1 113 113 GLY N N . . 1 1 113 113 GLY CA C . . 1 1 113 113 GLY C C . 80.0 90.0 . . . A . 112 LEU C . . A . 113 GLY N . . A . 113 GLY CA . . A . 113 GLY C . . . 112 . C . . . . . 113 . N . . . . . 113 . CA . . . . . 113 . C . . c17360_2l7l 1 223 . . 1 1 113 113 GLY N N . . 1 1 113 113 GLY CA C . . 1 1 113 113 GLY C C . . 1 1 114 114 GLU N N . 12.7 22.7 . . . A . 113 GLY N . . A . 113 GLY CA . . A . 113 GLY C . . A . 114 GLU N . . . 113 . N . . . . . 113 . CA . . . . . 113 . C . . . . . 114 . N . . c17360_2l7l 1 224 . . 1 1 113 113 GLY C C . . 1 1 114 114 GLU N N . . 1 1 114 114 GLU CA C . . 1 1 114 114 GLU C C . -96.4 -86.4 . . . A . 113 GLY C . . A . 114 GLU N . . A . 114 GLU CA . . A . 114 GLU C . . . 113 . C . . . . . 114 . N . . . . . 114 . CA . . . . . 114 . C . . c17360_2l7l 1 225 . . 1 1 114 114 GLU N N . . 1 1 114 114 GLU CA C . . 1 1 114 114 GLU C C . . 1 1 115 115 LYS N N . 117.1 127.1 . . . A . 114 GLU N . . A . 114 GLU CA . . A . 114 GLU C . . A . 115 LYS N . . . 114 . N . . . . . 114 . CA . . . . . 114 . C . . . . . 115 . N . . c17360_2l7l 1 226 . . 1 1 114 114 GLU C C . . 1 1 115 115 LYS N N . . 1 1 115 115 LYS CA C . . 1 1 115 115 LYS C C . -86.0 -76.0 . . . A . 114 GLU C . . A . 115 LYS N . . A . 115 LYS CA . . A . 115 LYS C . . . 114 . C . . . . . 115 . N . . . . . 115 . CA . . . . . 115 . C . . c17360_2l7l 1 227 . . 1 1 115 115 LYS N N . . 1 1 115 115 LYS CA C . . 1 1 115 115 LYS C C . . 1 1 116 116 LEU N N . 97.2 107.2 . . . A . 115 LYS N . . A . 115 LYS CA . . A . 115 LYS C . . A . 116 LEU N . . . 115 . N . . . . . 115 . CA . . . . . 115 . C . . . . . 116 . N . . c17360_2l7l 1 228 . . 1 1 115 115 LYS C C . . 1 1 116 116 LEU N N . . 1 1 116 116 LEU CA C . . 1 1 116 116 LEU C C . -133.3 -123.3 . . . A . 115 LYS C . . A . 116 LEU N . . A . 116 LEU CA . . A . 116 LEU C . . . 115 . C . . . . . 116 . N . . . . . 116 . CA . . . . . 116 . C . . c17360_2l7l 1 229 . . 1 1 116 116 LEU N N . . 1 1 116 116 LEU CA C . . 1 1 116 116 LEU C C . . 1 1 117 117 THR N N . 133.6 143.6 . . . A . 116 LEU N . . A . 116 LEU CA . . A . 116 LEU C . . A . 117 THR N . . . 116 . N . . . . . 116 . CA . . . . . 116 . C . . . . . 117 . N . . c17360_2l7l 1 230 . . 1 1 116 116 LEU C C . . 1 1 117 117 THR N N . . 1 1 117 117 THR CA C . . 1 1 117 117 THR C C . -91.1 -81.1 . . . A . 116 LEU C . . A . 117 THR N . . A . 117 THR CA . . A . 117 THR C . . . 116 . C . . . . . 117 . N . . . . . 117 . CA . . . . . 117 . C . . c17360_2l7l 1 231 . . 1 1 117 117 THR N N . . 1 1 117 117 THR CA C . . 1 1 117 117 THR C C . . 1 1 118 118 ASP N N . 161.2 171.2 . . . A . 117 THR N . . A . 117 THR CA . . A . 117 THR C . . A . 118 ASP N . . . 117 . N . . . . . 117 . CA . . . . . 117 . C . . . . . 118 . N . . c17360_2l7l 1 232 . . 1 1 117 117 THR C C . . 1 1 118 118 ASP N N . . 1 1 118 118 ASP CA C . . 1 1 118 118 ASP C C . -65.1 -55.1 . . . A . 117 THR C . . A . 118 ASP N . . A . 118 ASP CA . . A . 118 ASP C . . . 117 . C . . . . . 118 . N . . . . . 118 . CA . . . . . 118 . C . . c17360_2l7l 1 233 . . 1 1 118 118 ASP N N . . 1 1 118 118 ASP CA C . . 1 1 118 118 ASP C C . . 1 1 119 119 GLU N N . -41.7 -31.7 . . . A . 118 ASP N . . A . 118 ASP CA . . A . 118 ASP C . . A . 119 GLU N . . . 118 . N . . . . . 118 . CA . . . . . 118 . C . . . . . 119 . N . . c17360_2l7l 1 234 . . 1 1 118 118 ASP C C . . 1 1 119 119 GLU N N . . 1 1 119 119 GLU CA C . . 1 1 119 119 GLU C C . -74.9 -64.9 . . . A . 118 ASP C . . A . 119 GLU N . . A . 119 GLU CA . . A . 119 GLU C . . . 118 . C . . . . . 119 . N . . . . . 119 . CA . . . . . 119 . C . . c17360_2l7l 1 235 . . 1 1 119 119 GLU N N . . 1 1 119 119 GLU CA C . . 1 1 119 119 GLU C C . . 1 1 120 120 GLU N N . -47.8 -37.8 . . . A . 119 GLU N . . A . 119 GLU CA . . A . 119 GLU C . . A . 120 GLU N . . . 119 . N . . . . . 119 . CA . . . . . 119 . C . . . . . 120 . N . . c17360_2l7l 1 236 . . 1 1 119 119 GLU C C . . 1 1 120 120 GLU N N . . 1 1 120 120 GLU CA C . . 1 1 120 120 GLU C C . -68.9 -58.9 . . . A . 119 GLU C . . A . 120 GLU N . . A . 120 GLU CA . . A . 120 GLU C . . . 119 . C . . . . . 120 . N . . . . . 120 . CA . . . . . 120 . C . . c17360_2l7l 1 237 . . 1 1 120 120 GLU N N . . 1 1 120 120 GLU CA C . . 1 1 120 120 GLU C C . . 1 1 121 121 VAL N N . -45.2 -35.2 . . . A . 120 GLU N . . A . 120 GLU CA . . A . 120 GLU C . . A . 121 VAL N . . . 120 . N . . . . . 120 . CA . . . . . 120 . C . . . . . 121 . N . . c17360_2l7l 1 238 . . 1 1 120 120 GLU C C . . 1 1 121 121 VAL N N . . 1 1 121 121 VAL CA C . . 1 1 121 121 VAL C C . -69.3 -59.3 . . . A . 120 GLU C . . A . 121 VAL N . . A . 121 VAL CA . . A . 121 VAL C . . . 120 . C . . . . . 121 . N . . . . . 121 . CA . . . . . 121 . C . . c17360_2l7l 1 239 . . 1 1 121 121 VAL N N . . 1 1 121 121 VAL CA C . . 1 1 121 121 VAL C C . . 1 1 122 122 ASP N N . -48.9 -38.9 . . . A . 121 VAL N . . A . 121 VAL CA . . A . 121 VAL C . . A . 122 ASP N . . . 121 . N . . . . . 121 . CA . . . . . 121 . C . . . . . 122 . N . . c17360_2l7l 1 240 . . 1 1 121 121 VAL C C . . 1 1 122 122 ASP N N . . 1 1 122 122 ASP CA C . . 1 1 122 122 ASP C C . -66.1 -56.1 . . . A . 121 VAL C . . A . 122 ASP N . . A . 122 ASP CA . . A . 122 ASP C . . . 121 . C . . . . . 122 . N . . . . . 122 . CA . . . . . 122 . C . . c17360_2l7l 1 241 . . 1 1 122 122 ASP N N . . 1 1 122 122 ASP CA C . . 1 1 122 122 ASP C C . . 1 1 123 123 GLU N N . -41.9 -31.9 . . . A . 122 ASP N . . A . 122 ASP CA . . A . 122 ASP C . . A . 123 GLU N . . . 122 . N . . . . . 122 . CA . . . . . 122 . C . . . . . 123 . N . . c17360_2l7l 1 242 . . 1 1 122 122 ASP C C . . 1 1 123 123 GLU N N . . 1 1 123 123 GLU CA C . . 1 1 123 123 GLU C C . -72.0 -62.0 . . . A . 122 ASP C . . A . 123 GLU N . . A . 123 GLU CA . . A . 123 GLU C . . . 122 . C . . . . . 123 . N . . . . . 123 . CA . . . . . 123 . C . . c17360_2l7l 1 243 . . 1 1 123 123 GLU N N . . 1 1 123 123 GLU CA C . . 1 1 123 123 GLU C C . . 1 1 124 124 MET N N . -42.1 -32.1 . . . A . 123 GLU N . . A . 123 GLU CA . . A . 123 GLU C . . A . 124 MET N . . . 123 . N . . . . . 123 . CA . . . . . 123 . C . . . . . 124 . N . . c17360_2l7l 1 244 . . 1 1 123 123 GLU C C . . 1 1 124 124 MET N N . . 1 1 124 124 MET CA C . . 1 1 124 124 MET C C . -66.9 -56.9 . . . A . 123 GLU C . . A . 124 MET N . . A . 124 MET CA . . A . 124 MET C . . . 123 . C . . . . . 124 . N . . . . . 124 . CA . . . . . 124 . C . . c17360_2l7l 1 245 . . 1 1 124 124 MET N N . . 1 1 124 124 MET CA C . . 1 1 124 124 MET C C . . 1 1 125 125 ILE N N . -52.6 -42.6 . . . A . 124 MET N . . A . 124 MET CA . . A . 124 MET C . . A . 125 ILE N . . . 124 . N . . . . . 124 . CA . . . . . 124 . C . . . . . 125 . N . . c17360_2l7l 1 246 . . 1 1 124 124 MET C C . . 1 1 125 125 ILE N N . . 1 1 125 125 ILE CA C . . 1 1 125 125 ILE C C . -70.5 -60.5 . . . A . 124 MET C . . A . 125 ILE N . . A . 125 ILE CA . . A . 125 ILE C . . . 124 . C . . . . . 125 . N . . . . . 125 . CA . . . . . 125 . C . . c17360_2l7l 1 247 . . 1 1 125 125 ILE N N . . 1 1 125 125 ILE CA C . . 1 1 125 125 ILE C C . . 1 1 126 126 ARG N N . -47.4 -37.4 . . . A . 125 ILE N . . A . 125 ILE CA . . A . 125 ILE C . . A . 126 ARG N . . . 125 . N . . . . . 125 . CA . . . . . 125 . C . . . . . 126 . N . . c17360_2l7l 1 248 . . 1 1 125 125 ILE C C . . 1 1 126 126 ARG N N . . 1 1 126 126 ARG CA C . . 1 1 126 126 ARG C C . -64.8 -54.8 . . . A . 125 ILE C . . A . 126 ARG N . . A . 126 ARG CA . . A . 126 ARG C . . . 125 . C . . . . . 126 . N . . . . . 126 . CA . . . . . 126 . C . . c17360_2l7l 1 249 . . 1 1 126 126 ARG N N . . 1 1 126 126 ARG CA C . . 1 1 126 126 ARG C C . . 1 1 127 127 GLU N N . -44.5 -34.5 . . . A . 126 ARG N . . A . 126 ARG CA . . A . 126 ARG C . . A . 127 GLU N . . . 126 . N . . . . . 126 . CA . . . . . 126 . C . . . . . 127 . N . . c17360_2l7l 1 250 . . 1 1 126 126 ARG C C . . 1 1 127 127 GLU N N . . 1 1 127 127 GLU CA C . . 1 1 127 127 GLU C C . -68.6 -58.6 . . . A . 126 ARG C . . A . 127 GLU N . . A . 127 GLU CA . . A . 127 GLU C . . . 126 . C . . . . . 127 . N . . . . . 127 . CA . . . . . 127 . C . . c17360_2l7l 1 251 . . 1 1 127 127 GLU N N . . 1 1 127 127 GLU CA C . . 1 1 127 127 GLU C C . . 1 1 128 128 ALA N N . -40.0 -30.0 . . . A . 127 GLU N . . A . 127 GLU CA . . A . 127 GLU C . . A . 128 ALA N . . . 127 . N . . . . . 127 . CA . . . . . 127 . C . . . . . 128 . N . . c17360_2l7l 1 252 . . 1 1 127 127 GLU C C . . 1 1 128 128 ALA N N . . 1 1 128 128 ALA CA C . . 1 1 128 128 ALA C C . -92.1 -82.1 . . . A . 127 GLU C . . A . 128 ALA N . . A . 128 ALA CA . . A . 128 ALA C . . . 127 . C . . . . . 128 . N . . . . . 128 . CA . . . . . 128 . C . . c17360_2l7l 1 253 . . 1 1 128 128 ALA N N . . 1 1 128 128 ALA CA C . . 1 1 128 128 ALA C C . . 1 1 129 129 ASP N N . -30.7 -20.7 . . . A . 128 ALA N . . A . 128 ALA CA . . A . 128 ALA C . . A . 129 ASP N . . . 128 . N . . . . . 128 . CA . . . . . 128 . C . . . . . 129 . N . . c17360_2l7l 1 254 . . 1 1 128 128 ALA C C . . 1 1 129 129 ASP N N . . 1 1 129 129 ASP CA C . . 1 1 129 129 ASP C C . -85.5 -75.5 . . . A . 128 ALA C . . A . 129 ASP N . . A . 129 ASP CA . . A . 129 ASP C . . . 128 . C . . . . . 129 . N . . . . . 129 . CA . . . . . 129 . C . . c17360_2l7l 1 255 . . 1 1 129 129 ASP N N . . 1 1 129 129 ASP CA C . . 1 1 129 129 ASP C C . . 1 1 130 130 ILE N N . 92.4 102.4 . . . A . 129 ASP N . . A . 129 ASP CA . . A . 129 ASP C . . A . 130 ILE N . . . 129 . N . . . . . 129 . CA . . . . . 129 . C . . . . . 130 . N . . c17360_2l7l 1 256 . . 1 1 129 129 ASP C C . . 1 1 130 130 ILE N N . . 1 1 130 130 ILE CA C . . 1 1 130 130 ILE C C . -79.3 -69.3 . . . A . 129 ASP C . . A . 130 ILE N . . A . 130 ILE CA . . A . 130 ILE C . . . 129 . C . . . . . 130 . N . . . . . 130 . CA . . . . . 130 . C . . c17360_2l7l 1 257 . . 1 1 130 130 ILE N N . . 1 1 130 130 ILE CA C . . 1 1 130 130 ILE C C . . 1 1 131 131 ASP N N . -33.4 -23.4 . . . A . 130 ILE N . . A . 130 ILE CA . . A . 130 ILE C . . A . 131 ASP N . . . 130 . N . . . . . 130 . CA . . . . . 130 . C . . . . . 131 . N . . c17360_2l7l 1 258 . . 1 1 130 130 ILE C C . . 1 1 131 131 ASP N N . . 1 1 131 131 ASP CA C . . 1 1 131 131 ASP C C . -89.0 -79.0 . . . A . 130 ILE C . . A . 131 ASP N . . A . 131 ASP CA . . A . 131 ASP C . . . 130 . C . . . . . 131 . N . . . . . 131 . CA . . . . . 131 . C . . c17360_2l7l 1 259 . . 1 1 131 131 ASP N N . . 1 1 131 131 ASP CA C . . 1 1 131 131 ASP C C . . 1 1 132 132 GLY N N . -20.0 -10.0 . . . A . 131 ASP N . . A . 131 ASP CA . . A . 131 ASP C . . A . 132 GLY N . . . 131 . N . . . . . 131 . CA . . . . . 131 . C . . . . . 132 . N . . c17360_2l7l 1 260 . . 1 1 131 131 ASP C C . . 1 1 132 132 GLY N N . . 1 1 132 132 GLY CA C . . 1 1 132 132 GLY C C . 65.4 75.4 . . . A . 131 ASP C . . A . 132 GLY N . . A . 132 GLY CA . . A . 132 GLY C . . . 131 . C . . . . . 132 . N . . . . . 132 . CA . . . . . 132 . C . . c17360_2l7l 1 261 . . 1 1 132 132 GLY N N . . 1 1 132 132 GLY CA C . . 1 1 132 132 GLY C C . . 1 1 133 133 ASP N N . 21.0 31.0 . . . A . 132 GLY N . . A . 132 GLY CA . . A . 132 GLY C . . A . 133 ASP N . . . 132 . N . . . . . 132 . CA . . . . . 132 . C . . . . . 133 . N . . c17360_2l7l 1 262 . . 1 1 132 132 GLY C C . . 1 1 133 133 ASP N N . . 1 1 133 133 ASP CA C . . 1 1 133 133 ASP C C . -86.7 -76.7 . . . A . 132 GLY C . . A . 133 ASP N . . A . 133 ASP CA . . A . 133 ASP C . . . 132 . C . . . . . 133 . N . . . . . 133 . CA . . . . . 133 . C . . c17360_2l7l 1 263 . . 1 1 133 133 ASP N N . . 1 1 133 133 ASP CA C . . 1 1 133 133 ASP C C . . 1 1 134 134 GLY N N . -7.8 2.2 . . . A . 133 ASP N . . A . 133 ASP CA . . A . 133 ASP C . . A . 134 GLY N . . . 133 . N . . . . . 133 . CA . . . . . 133 . C . . . . . 134 . N . . c17360_2l7l 1 264 . . 1 1 133 133 ASP C C . . 1 1 134 134 GLY N N . . 1 1 134 134 GLY CA C . . 1 1 134 134 GLY C C . 83.2 93.2 . . . A . 133 ASP C . . A . 134 GLY N . . A . 134 GLY CA . . A . 134 GLY C . . . 133 . C . . . . . 134 . N . . . . . 134 . CA . . . . . 134 . C . . c17360_2l7l 1 265 . . 1 1 134 134 GLY N N . . 1 1 134 134 GLY CA C . . 1 1 134 134 GLY C C . . 1 1 135 135 GLN N N . 2.0 12.0 . . . A . 134 GLY N . . A . 134 GLY CA . . A . 134 GLY C . . A . 135 GLN N . . . 134 . N . . . . . 134 . CA . . . . . 134 . C . . . . . 135 . N . . c17360_2l7l 1 266 . . 1 1 134 134 GLY C C . . 1 1 135 135 GLN N N . . 1 1 135 135 GLN CA C . . 1 1 135 135 GLN C C . -144.9 -134.9 . . . A . 134 GLY C . . A . 135 GLN N . . A . 135 GLN CA . . A . 135 GLN C . . . 134 . C . . . . . 135 . N . . . . . 135 . CA . . . . . 135 . C . . c17360_2l7l 1 267 . . 1 1 135 135 GLN N N . . 1 1 135 135 GLN CA C . . 1 1 135 135 GLN C C . . 1 1 136 136 VAL N N . 162.8 172.8 . . . A . 135 GLN N . . A . 135 GLN CA . . A . 135 GLN C . . A . 136 VAL N . . . 135 . N . . . . . 135 . CA . . . . . 135 . C . . . . . 136 . N . . c17360_2l7l 1 268 . . 1 1 135 135 GLN C C . . 1 1 136 136 VAL N N . . 1 1 136 136 VAL CA C . . 1 1 136 136 VAL C C . -123.6 -113.6 . . . A . 135 GLN C . . A . 136 VAL N . . A . 136 VAL CA . . A . 136 VAL C . . . 135 . C . . . . . 136 . N . . . . . 136 . CA . . . . . 136 . C . . c17360_2l7l 1 269 . . 1 1 136 136 VAL N N . . 1 1 136 136 VAL CA C . . 1 1 136 136 VAL C C . . 1 1 137 137 ASN N N . 116.7 126.7 . . . A . 136 VAL N . . A . 136 VAL CA . . A . 136 VAL C . . A . 137 ASN N . . . 136 . N . . . . . 136 . CA . . . . . 136 . C . . . . . 137 . N . . c17360_2l7l 1 270 . . 1 1 136 136 VAL C C . . 1 1 137 137 ASN N N . . 1 1 137 137 ASN CA C . . 1 1 137 137 ASN C C . -94.8 -84.8 . . . A . 136 VAL C . . A . 137 ASN N . . A . 137 ASN CA . . A . 137 ASN C . . . 136 . C . . . . . 137 . N . . . . . 137 . CA . . . . . 137 . C . . c17360_2l7l 1 271 . . 1 1 137 137 ASN N N . . 1 1 137 137 ASN CA C . . 1 1 137 137 ASN C C . . 1 1 138 138 TYR N N . 169.5 179.5 . . . A . 137 ASN N . . A . 137 ASN CA . . A . 137 ASN C . . A . 138 TYR N . . . 137 . N . . . . . 137 . CA . . . . . 137 . C . . . . . 138 . N . . c17360_2l7l 1 272 . . 1 1 137 137 ASN C C . . 1 1 138 138 TYR N N . . 1 1 138 138 TYR CA C . . 1 1 138 138 TYR C C . -67.0 -57.0 . . . A . 137 ASN C . . A . 138 TYR N . . A . 138 TYR CA . . A . 138 TYR C . . . 137 . C . . . . . 138 . N . . . . . 138 . CA . . . . . 138 . C . . c17360_2l7l 1 273 . . 1 1 138 138 TYR N N . . 1 1 138 138 TYR CA C . . 1 1 138 138 TYR C C . . 1 1 139 139 GLU N N . -54.5 -44.5 . . . A . 138 TYR N . . A . 138 TYR CA . . A . 138 TYR C . . A . 139 GLU N . . . 138 . N . . . . . 138 . CA . . . . . 138 . C . . . . . 139 . N . . c17360_2l7l 1 274 . . 1 1 138 138 TYR C C . . 1 1 139 139 GLU N N . . 1 1 139 139 GLU CA C . . 1 1 139 139 GLU C C . -64.6 -54.6 . . . A . 138 TYR C . . A . 139 GLU N . . A . 139 GLU CA . . A . 139 GLU C . . . 138 . C . . . . . 139 . N . . . . . 139 . CA . . . . . 139 . C . . c17360_2l7l 1 275 . . 1 1 139 139 GLU N N . . 1 1 139 139 GLU CA C . . 1 1 139 139 GLU C C . . 1 1 140 140 GLU N N . -41.0 -31.0 . . . A . 139 GLU N . . A . 139 GLU CA . . A . 139 GLU C . . A . 140 GLU N . . . 139 . N . . . . . 139 . CA . . . . . 139 . C . . . . . 140 . N . . c17360_2l7l 1 276 . . 1 1 139 139 GLU C C . . 1 1 140 140 GLU N N . . 1 1 140 140 GLU CA C . . 1 1 140 140 GLU C C . -74.6 -64.6 . . . A . 139 GLU C . . A . 140 GLU N . . A . 140 GLU CA . . A . 140 GLU C . . . 139 . C . . . . . 140 . N . . . . . 140 . CA . . . . . 140 . C . . c17360_2l7l 1 277 . . 1 1 140 140 GLU N N . . 1 1 140 140 GLU CA C . . 1 1 140 140 GLU C C . . 1 1 141 141 PHE N N . -39.9 -29.9 . . . A . 140 GLU N . . A . 140 GLU CA . . A . 140 GLU C . . A . 141 PHE N . . . 140 . N . . . . . 140 . CA . . . . . 140 . C . . . . . 141 . N . . c17360_2l7l 1 278 . . 1 1 140 140 GLU C C . . 1 1 141 141 PHE N N . . 1 1 141 141 PHE CA C . . 1 1 141 141 PHE C C . -65.9 -55.9 . . . A . 140 GLU C . . A . 141 PHE N . . A . 141 PHE CA . . A . 141 PHE C . . . 140 . C . . . . . 141 . N . . . . . 141 . CA . . . . . 141 . C . . c17360_2l7l 1 279 . . 1 1 141 141 PHE N N . . 1 1 141 141 PHE CA C . . 1 1 141 141 PHE C C . . 1 1 142 142 VAL N N . -56.1 -46.1 . . . A . 141 PHE N . . A . 141 PHE CA . . A . 141 PHE C . . A . 142 VAL N . . . 141 . N . . . . . 141 . CA . . . . . 141 . C . . . . . 142 . N . . c17360_2l7l 1 280 . . 1 1 141 141 PHE C C . . 1 1 142 142 VAL N N . . 1 1 142 142 VAL CA C . . 1 1 142 142 VAL C C . -65.6 -55.6 . . . A . 141 PHE C . . A . 142 VAL N . . A . 142 VAL CA . . A . 142 VAL C . . . 141 . C . . . . . 142 . N . . . . . 142 . CA . . . . . 142 . C . . c17360_2l7l 1 281 . . 1 1 142 142 VAL N N . . 1 1 142 142 VAL CA C . . 1 1 142 142 VAL C C . . 1 1 143 143 GLN N N . -48.4 -38.4 . . . A . 142 VAL N . . A . 142 VAL CA . . A . 142 VAL C . . A . 143 GLN N . . . 142 . N . . . . . 142 . CA . . . . . 142 . C . . . . . 143 . N . . c17360_2l7l 1 282 . . 1 1 142 142 VAL C C . . 1 1 143 143 GLN N N . . 1 1 143 143 GLN CA C . . 1 1 143 143 GLN C C . -72.4 -62.4 . . . A . 142 VAL C . . A . 143 GLN N . . A . 143 GLN CA . . A . 143 GLN C . . . 142 . C . . . . . 143 . N . . . . . 143 . CA . . . . . 143 . C . . c17360_2l7l 1 283 . . 1 1 143 143 GLN N N . . 1 1 143 143 GLN CA C . . 1 1 143 143 GLN C C . . 1 1 144 144 MET N N . -42.3 -32.3 . . . A . 143 GLN N . . A . 143 GLN CA . . A . 143 GLN C . . A . 144 MET N . . . 143 . N . . . . . 143 . CA . . . . . 143 . C . . . . . 144 . N . . c17360_2l7l 1 284 . . 1 1 143 143 GLN C C . . 1 1 144 144 MET N N . . 1 1 144 144 MET CA C . . 1 1 144 144 MET C C . -74.0 -64.0 . . . A . 143 GLN C . . A . 144 MET N . . A . 144 MET CA . . A . 144 MET C . . . 143 . C . . . . . 144 . N . . . . . 144 . CA . . . . . 144 . C . . c17360_2l7l 1 285 . . 1 1 144 144 MET N N . . 1 1 144 144 MET CA C . . 1 1 144 144 MET C C . . 1 1 145 145 MET N N . -16.8 -6.8 . . . A . 144 MET N . . A . 144 MET CA . . A . 144 MET C . . A . 145 MET N . . . 144 . N . . . . . 144 . CA . . . . . 144 . C . . . . . 145 . N . . c17360_2l7l 1 286 . . 1 1 144 144 MET C C . . 1 1 145 145 MET N N . . 1 1 145 145 MET CA C . . 1 1 145 145 MET C C . -79.1 -69.1 . . . A . 144 MET C . . A . 145 MET N . . A . 145 MET CA . . A . 145 MET C . . . 144 . C . . . . . 145 . N . . . . . 145 . CA . . . . . 145 . C . . c17360_2l7l 1 287 . . 1 1 145 145 MET N N . . 1 1 145 145 MET CA C . . 1 1 145 145 MET C C . . 1 1 146 146 THR N N . -10.5 -0.5 . . . A . 145 MET N . . A . 145 MET CA . . A . 145 MET C . . A . 146 THR N . . . 145 . N . . . . . 145 . CA . . . . . 145 . C . . . . . 146 . N . . c17360_2l7l 1 288 . . 1 1 145 145 MET C C . . 1 1 146 146 THR N N . . 1 1 146 146 THR CA C . . 1 1 146 146 THR C C . -54.0 -44.0 . . . A . 145 MET C . . A . 146 THR N . . A . 146 THR CA . . A . 146 THR C . . . 145 . C . . . . . 146 . N . . . . . 146 . CA . . . . . 146 . C . . c17360_2l7l 1 289 . . 1 1 146 146 THR N N . . 1 1 146 146 THR CA C . . 1 1 146 146 THR C C . . 1 1 147 147 ALA N N . 105.8 115.8 . . . A . 146 THR N . . A . 146 THR CA . . A . 146 THR C . . A . 147 ALA N . . . 146 . N . . . . . 146 . CA . . . . . 146 . C . . . . . 147 . N . . c17360_2l7l 1 290 . . 1 1 146 146 THR C C . . 1 1 147 147 ALA N N . . 1 1 147 147 ALA CA C . . 1 1 147 147 ALA C C . -70.7 -60.7 . . . A . 146 THR C . . A . 147 ALA N . . A . 147 ALA CA . . A . 147 ALA C . . . 146 . C . . . . . 147 . N . . . . . 147 . CA . . . . . 147 . C . . c17360_2l7l 1 291 . . 1 1 147 147 ALA N N . . 1 1 147 147 ALA CA C . . 1 1 147 147 ALA C C . . 1 1 148 148 LYS N N . 12.1 22.1 . . . A . 147 ALA N . . A . 147 ALA CA . . A . 147 ALA C . . A . 148 LYS N . . . 147 . N . . . . . 147 . CA . . . . . 147 . C . . . . . 148 . N . . c17360_2l7l 1 292 . . 1 1 147 147 ALA C C . . 1 1 148 148 LYS N N . . 1 1 148 148 LYS CA C . . 1 1 148 148 LYS C C . -150.3 -140.3 . . . A . 147 ALA C . . A . 148 LYS N . . A . 148 LYS CA . . A . 148 LYS C . . . 147 . C . . . . . 148 . N . . . . . 148 . CA . . . . . 148 . C . . c17360_2l7l 1 293 . . 2 2 1 1 ALA N N . . 2 2 1 1 ALA CA C . . 2 2 1 1 ALA C C . . 2 2 2 2 LYS N N . -53.0 -43.0 . . . B . 299 ALA N . . B . 299 ALA CA . . B . 299 ALA C . . B . 300 LYS N . . . 299 . N . . . . . 299 . CA . . . . . 299 . C . . . . . 300 . N . . c17360_2l7l 1 294 . . 2 2 1 1 ALA C C . . 2 2 2 2 LYS N N . . 2 2 2 2 LYS CA C . . 2 2 2 2 LYS C C . -69.4 -59.4 . . . B . 299 ALA C . . B . 300 LYS N . . B . 300 LYS CA . . B . 300 LYS C . . . 299 . C . . . . . 300 . N . . . . . 300 . CA . . . . . 300 . C . . c17360_2l7l 1 295 . . 2 2 2 2 LYS N N . . 2 2 2 2 LYS CA C . . 2 2 2 2 LYS C C . . 2 2 3 3 SER N N . -31.6 -21.6 . . . B . 300 LYS N . . B . 300 LYS CA . . B . 300 LYS C . . B . 301 SER N . . . 300 . N . . . . . 300 . CA . . . . . 300 . C . . . . . 301 . N . . c17360_2l7l 1 296 . . 2 2 2 2 LYS C C . . 2 2 3 3 SER N N . . 2 2 3 3 SER CA C . . 2 2 3 3 SER C C . -63.3 -53.3 . . . B . 300 LYS C . . B . 301 SER N . . B . 301 SER CA . . B . 301 SER C . . . 300 . C . . . . . 301 . N . . . . . 301 . CA . . . . . 301 . C . . c17360_2l7l 1 297 . . 2 2 3 3 SER N N . . 2 2 3 3 SER CA C . . 2 2 3 3 SER C C . . 2 2 4 4 LYS N N . -53.3 -43.3 . . . B . 301 SER N . . B . 301 SER CA . . B . 301 SER C . . B . 302 LYS N . . . 301 . N . . . . . 301 . CA . . . . . 301 . C . . . . . 302 . N . . c17360_2l7l 1 298 . . 2 2 3 3 SER C C . . 2 2 4 4 LYS N N . . 2 2 4 4 LYS CA C . . 2 2 4 4 LYS C C . -64.7 -54.7 . . . B . 301 SER C . . B . 302 LYS N . . B . 302 LYS CA . . B . 302 LYS C . . . 301 . C . . . . . 302 . N . . . . . 302 . CA . . . . . 302 . C . . c17360_2l7l 1 299 . . 2 2 4 4 LYS N N . . 2 2 4 4 LYS CA C . . 2 2 4 4 LYS C C . . 2 2 5 5 TRP N N . -46.7 -36.7 . . . B . 302 LYS N . . B . 302 LYS CA . . B . 302 LYS C . . B . 303 TRP N . . . 302 . N . . . . . 302 . CA . . . . . 302 . C . . . . . 303 . N . . c17360_2l7l 1 300 . . 2 2 4 4 LYS C C . . 2 2 5 5 TRP N N . . 2 2 5 5 TRP CA C . . 2 2 5 5 TRP C C . -60.2 -50.2 . . . B . 302 LYS C . . B . 303 TRP N . . B . 303 TRP CA . . B . 303 TRP C . . . 302 . C . . . . . 303 . N . . . . . 303 . CA . . . . . 303 . C . . c17360_2l7l 1 301 . . 2 2 5 5 TRP N N . . 2 2 5 5 TRP CA C . . 2 2 5 5 TRP C C . . 2 2 6 6 LYS N N . -57.1 -47.1 . . . B . 303 TRP N . . B . 303 TRP CA . . B . 303 TRP C . . B . 304 LYS N . . . 303 . N . . . . . 303 . CA . . . . . 303 . C . . . . . 304 . N . . c17360_2l7l 1 302 . . 2 2 5 5 TRP C C . . 2 2 6 6 LYS N N . . 2 2 6 6 LYS CA C . . 2 2 6 6 LYS C C . -64.8 -54.8 . . . B . 303 TRP C . . B . 304 LYS N . . B . 304 LYS CA . . B . 304 LYS C . . . 303 . C . . . . . 304 . N . . . . . 304 . CA . . . . . 304 . C . . c17360_2l7l 1 303 . . 2 2 6 6 LYS N N . . 2 2 6 6 LYS CA C . . 2 2 6 6 LYS C C . . 2 2 7 7 GLN N N . -45.8 -35.8 . . . B . 304 LYS N . . B . 304 LYS CA . . B . 304 LYS C . . B . 305 GLN N . . . 304 . N . . . . . 304 . CA . . . . . 304 . C . . . . . 305 . N . . c17360_2l7l 1 304 . . 2 2 6 6 LYS C C . . 2 2 7 7 GLN N N . . 2 2 7 7 GLN CA C . . 2 2 7 7 GLN C C . -58.6 -48.6 . . . B . 304 LYS C . . B . 305 GLN N . . B . 305 GLN CA . . B . 305 GLN C . . . 304 . C . . . . . 305 . N . . . . . 305 . CA . . . . . 305 . C . . c17360_2l7l 1 305 . . 2 2 7 7 GLN N N . . 2 2 7 7 GLN CA C . . 2 2 7 7 GLN C C . . 2 2 8 8 ALA N N . -75.6 -65.6 . . . B . 305 GLN N . . B . 305 GLN CA . . B . 305 GLN C . . B . 306 ALA N . . . 305 . N . . . . . 305 . CA . . . . . 305 . C . . . . . 306 . N . . c17360_2l7l 1 306 . . 2 2 7 7 GLN C C . . 2 2 8 8 ALA N N . . 2 2 8 8 ALA CA C . . 2 2 8 8 ALA C C . -63.7 -53.7 . . . B . 305 GLN C . . B . 306 ALA N . . B . 306 ALA CA . . B . 306 ALA C . . . 305 . C . . . . . 306 . N . . . . . 306 . CA . . . . . 306 . C . . c17360_2l7l 1 307 . . 2 2 8 8 ALA N N . . 2 2 8 8 ALA CA C . . 2 2 8 8 ALA C C . . 2 2 9 9 PHE N N . -45.0 -35.0 . . . B . 306 ALA N . . B . 306 ALA CA . . B . 306 ALA C . . B . 307 PHE N . . . 306 . N . . . . . 306 . CA . . . . . 306 . C . . . . . 307 . N . . c17360_2l7l 1 308 . . 2 2 8 8 ALA C C . . 2 2 9 9 PHE N N . . 2 2 9 9 PHE CA C . . 2 2 9 9 PHE C C . -57.5 -47.5 . . . B . 306 ALA C . . B . 307 PHE N . . B . 307 PHE CA . . B . 307 PHE C . . . 306 . C . . . . . 307 . N . . . . . 307 . CA . . . . . 307 . C . . c17360_2l7l 1 309 . . 2 2 9 9 PHE N N . . 2 2 9 9 PHE CA C . . 2 2 9 9 PHE C C . . 2 2 10 10 ASN N N . -68.8 -58.8 . . . B . 307 PHE N . . B . 307 PHE CA . . B . 307 PHE C . . B . 308 ASN N . . . 307 . N . . . . . 307 . CA . . . . . 307 . C . . . . . 308 . N . . c17360_2l7l 1 310 . . 2 2 9 9 PHE C C . . 2 2 10 10 ASN N N . . 2 2 10 10 ASN CA C . . 2 2 10 10 ASN C C . -61.8 -51.8 . . . B . 307 PHE C . . B . 308 ASN N . . B . 308 ASN CA . . B . 308 ASN C . . . 307 . C . . . . . 308 . N . . . . . 308 . CA . . . . . 308 . C . . c17360_2l7l 1 311 . . 2 2 10 10 ASN N N . . 2 2 10 10 ASN CA C . . 2 2 10 10 ASN C C . . 2 2 11 11 ALA N N . -43.6 -33.6 . . . B . 308 ASN N . . B . 308 ASN CA . . B . 308 ASN C . . B . 309 ALA N . . . 308 . N . . . . . 308 . CA . . . . . 308 . C . . . . . 309 . N . . c17360_2l7l 1 312 . . 2 2 10 10 ASN C C . . 2 2 11 11 ALA N N . . 2 2 11 11 ALA CA C . . 2 2 11 11 ALA C C . -58.1 -48.1 . . . B . 308 ASN C . . B . 309 ALA N . . B . 309 ALA CA . . B . 309 ALA C . . . 308 . C . . . . . 309 . N . . . . . 309 . CA . . . . . 309 . C . . c17360_2l7l 1 313 . . 2 2 11 11 ALA N N . . 2 2 11 11 ALA CA C . . 2 2 11 11 ALA C C . . 2 2 12 12 THR N N . -62.7 -52.7 . . . B . 309 ALA N . . B . 309 ALA CA . . B . 309 ALA C . . B . 310 THR N . . . 309 . N . . . . . 309 . CA . . . . . 309 . C . . . . . 310 . N . . c17360_2l7l 1 314 . . 2 2 11 11 ALA C C . . 2 2 12 12 THR N N . . 2 2 12 12 THR CA C . . 2 2 12 12 THR C C . -69.8 -59.8 . . . B . 309 ALA C . . B . 310 THR N . . B . 310 THR CA . . B . 310 THR C . . . 309 . C . . . . . 310 . N . . . . . 310 . CA . . . . . 310 . C . . c17360_2l7l 1 315 . . 2 2 12 12 THR N N . . 2 2 12 12 THR CA C . . 2 2 12 12 THR C C . . 2 2 13 13 ALA N N . -44.7 -34.7 . . . B . 310 THR N . . B . 310 THR CA . . B . 310 THR C . . B . 311 ALA N . . . 310 . N . . . . . 310 . CA . . . . . 310 . C . . . . . 311 . N . . c17360_2l7l 1 316 . . 2 2 12 12 THR C C . . 2 2 13 13 ALA N N . . 2 2 13 13 ALA CA C . . 2 2 13 13 ALA C C . -68.0 -58.0 . . . B . 310 THR C . . B . 311 ALA N . . B . 311 ALA CA . . B . 311 ALA C . . . 310 . C . . . . . 311 . N . . . . . 311 . CA . . . . . 311 . C . . c17360_2l7l 1 317 . . 2 2 13 13 ALA N N . . 2 2 13 13 ALA CA C . . 2 2 13 13 ALA C C . . 2 2 14 14 VAL N N . -54.0 -44.0 . . . B . 311 ALA N . . B . 311 ALA CA . . B . 311 ALA C . . B . 312 VAL N . . . 311 . N . . . . . 311 . CA . . . . . 311 . C . . . . . 312 . N . . c17360_2l7l 1 318 . . 2 2 13 13 ALA C C . . 2 2 14 14 VAL N N . . 2 2 14 14 VAL CA C . . 2 2 14 14 VAL C C . -72.1 -62.1 . . . B . 311 ALA C . . B . 312 VAL N . . B . 312 VAL CA . . B . 312 VAL C . . . 311 . C . . . . . 312 . N . . . . . 312 . CA . . . . . 312 . C . . c17360_2l7l 1 319 . . 2 2 14 14 VAL N N . . 2 2 14 14 VAL CA C . . 2 2 14 14 VAL C C . . 2 2 15 15 VAL N N . -43.7 -33.7 . . . B . 312 VAL N . . B . 312 VAL CA . . B . 312 VAL C . . B . 313 VAL N . . . 312 . N . . . . . 312 . CA . . . . . 312 . C . . . . . 313 . N . . c17360_2l7l 1 320 . . 2 2 14 14 VAL C C . . 2 2 15 15 VAL N N . . 2 2 15 15 VAL CA C . . 2 2 15 15 VAL C C . -64.7 -54.7 . . . B . 312 VAL C . . B . 313 VAL N . . B . 313 VAL CA . . B . 313 VAL C . . . 312 . C . . . . . 313 . N . . . . . 313 . CA . . . . . 313 . C . . c17360_2l7l 1 321 . . 2 2 15 15 VAL N N . . 2 2 15 15 VAL CA C . . 2 2 15 15 VAL C C . . 2 2 16 16 ARG N N . -58.2 -48.2 . . . B . 313 VAL N . . B . 313 VAL CA . . B . 313 VAL C . . B . 314 ARG N . . . 313 . N . . . . . 313 . CA . . . . . 313 . C . . . . . 314 . N . . c17360_2l7l 1 322 . . 2 2 15 15 VAL C C . . 2 2 16 16 ARG N N . . 2 2 16 16 ARG CA C . . 2 2 16 16 ARG C C . -71.9 -61.9 . . . B . 313 VAL C . . B . 314 ARG N . . B . 314 ARG CA . . B . 314 ARG C . . . 313 . C . . . . . 314 . N . . . . . 314 . CA . . . . . 314 . C . . c17360_2l7l 1 323 . . 2 2 16 16 ARG N N . . 2 2 16 16 ARG CA C . . 2 2 16 16 ARG C C . . 2 2 17 17 HIS N N . -39.5 -29.5 . . . B . 314 ARG N . . B . 314 ARG CA . . B . 314 ARG C . . B . 315 HIS N . . . 314 . N . . . . . 314 . CA . . . . . 314 . C . . . . . 315 . N . . c17360_2l7l 1 324 . . 2 2 16 16 ARG C C . . 2 2 17 17 HIS N N . . 2 2 17 17 HIS CA C . . 2 2 17 17 HIS C C . -78.7 -68.7 . . . B . 314 ARG C . . B . 315 HIS N . . B . 315 HIS CA . . B . 315 HIS C . . . 314 . C . . . . . 315 . N . . . . . 315 . CA . . . . . 315 . C . . c17360_2l7l 1 325 . . 2 2 17 17 HIS N N . . 2 2 17 17 HIS CA C . . 2 2 17 17 HIS C C . . 2 2 18 18 MET N N . -51.0 -41.0 . . . B . 315 HIS N . . B . 315 HIS CA . . B . 315 HIS C . . B . 316 MET N . . . 315 . N . . . . . 315 . CA . . . . . 315 . C . . . . . 316 . N . . c17360_2l7l 1 326 . . 2 2 17 17 HIS C C . . 2 2 18 18 MET N N . . 2 2 18 18 MET CA C . . 2 2 18 18 MET C C . -76.2 -66.2 . . . B . 315 HIS C . . B . 316 MET N . . B . 316 MET CA . . B . 316 MET C . . . 315 . C . . . . . 316 . N . . . . . 316 . CA . . . . . 316 . C . . c17360_2l7l 1 327 . . 2 2 18 18 MET N N . . 2 2 18 18 MET CA C . . 2 2 18 18 MET C C . . 2 2 19 19 ARG N N . -49.5 -39.5 . . . B . 316 MET N . . B . 316 MET CA . . B . 316 MET C . . B . 317 ARG N . . . 316 . N . . . . . 316 . CA . . . . . 316 . C . . . . . 317 . N . . c17360_2l7l 1 328 . . 2 2 18 18 MET C C . . 2 2 19 19 ARG N N . . 2 2 19 19 ARG CA C . . 2 2 19 19 ARG C C . -68.8 -58.8 . . . B . 316 MET C . . B . 317 ARG N . . B . 317 ARG CA . . B . 317 ARG C . . . 316 . C . . . . . 317 . N . . . . . 317 . CA . . . . . 317 . C . . c17360_2l7l 1 329 . . 2 2 19 19 ARG N N . . 2 2 19 19 ARG CA C . . 2 2 19 19 ARG C C . . 2 2 20 20 LYS N N . -32.5 -22.5 . . . B . 317 ARG N . . B . 317 ARG CA . . B . 317 ARG C . . B . 318 LYS N . . . 317 . N . . . . . 317 . CA . . . . . 317 . C . . . . . 318 . N . . c17360_2l7l 1 330 . . 2 2 19 19 ARG C C . . 2 2 20 20 LYS N N . . 2 2 20 20 LYS CA C . . 2 2 20 20 LYS C C . -69.0 -59.0 . . . B . 317 ARG C . . B . 318 LYS N . . B . 318 LYS CA . . B . 318 LYS C . . . 317 . C . . . . . 318 . N . . . . . 318 . CA . . . . . 318 . C . . c17360_2l7l 1 331 . . 2 2 20 20 LYS N N . . 2 2 20 20 LYS CA C . . 2 2 20 20 LYS C C . . 2 2 21 21 LEU N N . -48.3 -38.3 . . . B . 318 LYS N . . B . 318 LYS CA . . B . 318 LYS C . . B . 319 LEU N . . . 318 . N . . . . . 318 . CA . . . . . 318 . C . . . . . 319 . N . . c17360_2l7l 1 332 . . 2 2 20 20 LYS C C . . 2 2 21 21 LEU N N . . 2 2 21 21 LEU CA C . . 2 2 21 21 LEU C C . -64.4 -54.4 . . . B . 318 LYS C . . B . 319 LEU N . . B . 319 LEU CA . . B . 319 LEU C . . . 318 . C . . . . . 319 . N . . . . . 319 . CA . . . . . 319 . C . . c17360_2l7l 1 333 . . 2 2 21 21 LEU N N . . 2 2 21 21 LEU CA C . . 2 2 21 21 LEU C C . . 2 2 22 22 GLN N N . -30.1 -20.1 . . . B . 319 LEU N . . B . 319 LEU CA . . B . 319 LEU C . . B . 320 GLN N . . . 319 . N . . . . . 319 . CA . . . . . 319 . C . . . . . 320 . N . . c17360_2l7l 1 334 . . 2 2 21 21 LEU C C . . 2 2 22 22 GLN N N . . 2 2 22 22 GLN CA C . . 2 2 22 22 GLN C C . -83.2 -73.2 . . . B . 319 LEU C . . B . 320 GLN N . . B . 320 GLN CA . . B . 320 GLN C . . . 319 . C . . . . . 320 . N . . . . . 320 . CA . . . . . 320 . C . . c17360_2l7l 1 stop_ loop_ _TA_constraint_parse_err.ID _TA_constraint_parse_err.Content _TA_constraint_parse_err.Begin_line _TA_constraint_parse_err.Begin_column _TA_constraint_parse_err.End_line _TA_constraint_parse_err.End_column _TA_constraint_parse_err.Entry_ID _TA_constraint_parse_err.Torsion_angle_constraint_list_ID 1 ; ######################################################################### #########################CAM DIHEDRALS################################### ########################################################################### ; 1 1 3 75 c17360_2l7l 1 2 ; ############################################################################## #####################PEPTIDE BACKBONE DIHEDRALS############################### ################################################################################ ; 588 1 590 80 c17360_2l7l 1 stop_ save_ save_CNS/XPLOR_dipolar_coupling_7 _RDC_constraint_list.Sf_category RDC_constraints _RDC_constraint_list.Sf_framecode CNS/XPLOR_dipolar_coupling_7 _RDC_constraint_list.Entry_ID c17360_2l7l _RDC_constraint_list.ID 1 _RDC_constraint_list.Details 'Generated by Wattos' _RDC_constraint_list.Constraint_file_ID 1 _RDC_constraint_list.Block_ID 7 loop_ _RDC_constraint_software.Software_ID _RDC_constraint_software.Software_label _RDC_constraint_software.Method_ID _RDC_constraint_software.Method_label _RDC_constraint_software.Entry_ID _RDC_constraint_software.RDC_constraint_list_ID . . . . c17360_2l7l 1 stop_ loop_ _RDC_constraint.ID _RDC_constraint.Assembly_atom_ID_1 _RDC_constraint.Entity_assembly_ID_1 _RDC_constraint.Entity_ID_1 _RDC_constraint.Comp_index_ID_1 _RDC_constraint.Seq_ID_1 _RDC_constraint.Comp_ID_1 _RDC_constraint.Atom_ID_1 _RDC_constraint.Atom_type_1 _RDC_constraint.Atom_isotope_number_1 _RDC_constraint.Resonance_ID_1 _RDC_constraint.Assembly_atom_ID_2 _RDC_constraint.Entity_assembly_ID_2 _RDC_constraint.Entity_ID_2 _RDC_constraint.Comp_index_ID_2 _RDC_constraint.Seq_ID_2 _RDC_constraint.Comp_ID_2 _RDC_constraint.Atom_ID_2 _RDC_constraint.Atom_type_2 _RDC_constraint.Atom_isotope_number_2 _RDC_constraint.Resonance_ID_2 _RDC_constraint.RDC_val _RDC_constraint.RDC_lower_bound _RDC_constraint.RDC_upper_bound _RDC_constraint.RDC_val_err _RDC_constraint.RDC_val_scale_factor _RDC_constraint.RDC_bond_length _RDC_constraint.Source_experiment_ID _RDC_constraint.PDB_record_ID_1 _RDC_constraint.PDB_model_num_1 _RDC_constraint.PDB_strand_ID_1 _RDC_constraint.PDB_ins_code_1 _RDC_constraint.PDB_residue_no_1 _RDC_constraint.PDB_residue_name_1 _RDC_constraint.PDB_atom_name_1 _RDC_constraint.PDB_record_ID_2 _RDC_constraint.PDB_model_num_2 _RDC_constraint.PDB_strand_ID_2 _RDC_constraint.PDB_ins_code_2 _RDC_constraint.PDB_residue_no_2 _RDC_constraint.PDB_residue_name_2 _RDC_constraint.PDB_atom_name_2 _RDC_constraint.Auth_entity_assembly_ID_1 _RDC_constraint.Auth_asym_ID_1 _RDC_constraint.Auth_chain_ID_1 _RDC_constraint.Auth_seq_ID_1 _RDC_constraint.Auth_comp_ID_1 _RDC_constraint.Auth_atom_ID_1 _RDC_constraint.Auth_alt_ID_1 _RDC_constraint.Auth_atom_name_1 _RDC_constraint.Auth_entity_assembly_ID_2 _RDC_constraint.Auth_asym_ID_2 _RDC_constraint.Auth_chain_ID_2 _RDC_constraint.Auth_seq_ID_2 _RDC_constraint.Auth_comp_ID_2 _RDC_constraint.Auth_atom_ID_2 _RDC_constraint.Auth_alt_ID_2 _RDC_constraint.Auth_atom_name_2 _RDC_constraint.Entry_ID _RDC_constraint.RDC_constraint_list_ID 1 . 1 1 3 3 GLN N N . . . 1 1 3 3 GLN H H . . 1.2103 . . . . . . . . A . 3 GLN N . . A . 3 GLN H . . . 3 . N . . . . . 3 . HN . . c17360_2l7l 1 2 . 1 1 4 4 LEU N N . . . 1 1 4 4 LEU H H . . -11.6898 . . . . . . . . A . 4 LEU N . . A . 4 LEU H . . . 4 . N . . . . . 4 . HN . . c17360_2l7l 1 3 . 1 1 5 5 THR N N . . . 1 1 5 5 THR H H . . 0.4764 . . . . . . . . A . 5 THR N . . A . 5 THR H . . . 5 . N . . . . . 5 . HN . . c17360_2l7l 1 4 . 1 1 6 6 GLU N N . . . 1 1 6 6 GLU H H . . 18.4155 . . . . . . . . A . 6 GLU N . . A . 6 GLU H . . . 6 . N . . . . . 6 . HN . . c17360_2l7l 1 5 . 1 1 7 7 GLU N N . . . 1 1 7 7 GLU H H . . 13.7115 . . . . . . . . A . 7 GLU N . . A . 7 GLU H . . . 7 . N . . . . . 7 . HN . . c17360_2l7l 1 6 . 1 1 8 8 GLN N N . . . 1 1 8 8 GLN H H . . 16.9452 . . . . . . . . A . 8 GLN N . . A . 8 GLN H . . . 8 . N . . . . . 8 . HN . . c17360_2l7l 1 7 . 1 1 10 10 ALA N N . . . 1 1 10 10 ALA H H . . 15.6335 . . . . . . . . A . 10 ALA H . . A . 10 ALA N . . . 10 . HN . . . . . 10 . N . . c17360_2l7l 1 8 . 1 1 11 11 GLU N N . . . 1 1 11 11 GLU H H . . 19.0678 . . . . . . . . A . 11 GLU H . . A . 11 GLU N . . . 11 . HN . . . . . 11 . N . . c17360_2l7l 1 9 . 1 1 12 12 PHE N N . . . 1 1 12 12 PHE H H . . 18.9999 . . . . . . . . A . 12 PHE H . . A . 12 PHE N . . . 12 . HN . . . . . 12 . N . . c17360_2l7l 1 10 . 1 1 13 13 LYS N N . . . 1 1 13 13 LYS H H . . 14.4718 . . . . . . . . A . 13 LYS H . . A . 13 LYS N . . . 13 . HN . . . . . 13 . N . . c17360_2l7l 1 11 . 1 1 15 15 ALA N N . . . 1 1 15 15 ALA H H . . 18.3638 . . . . . . . . A . 15 ALA H . . A . 15 ALA N . . . 15 . HN . . . . . 15 . N . . c17360_2l7l 1 12 . 1 1 16 16 PHE N N . . . 1 1 16 16 PHE H H . . 18.1717 . . . . . . . . A . 16 PHE H . . A . 16 PHE N . . . 16 . HN . . . . . 16 . N . . c17360_2l7l 1 13 . 1 1 17 17 SER N N . . . 1 1 17 17 SER H H . . 9.3269 . . . . . . . . A . 17 SER H . . A . 17 SER N . . . 17 . HN . . . . . 17 . N . . c17360_2l7l 1 14 . 1 1 18 18 LEU N N . . . 1 1 18 18 LEU H H . . 16.5747 . . . . . . . . A . 18 LEU H . . A . 18 LEU N . . . 18 . HN . . . . . 18 . N . . c17360_2l7l 1 15 . 1 1 19 19 PHE N N . . . 1 1 19 19 PHE H H . . 18.7237 . . . . . . . . A . 19 PHE H . . A . 19 PHE N . . . 19 . HN . . . . . 19 . N . . c17360_2l7l 1 16 . 1 1 20 20 ASP N N . . . 1 1 20 20 ASP H H . . 7.2539 . . . . . . . . A . 20 ASP N . . A . 20 ASP H . . . 20 . N . . . . . 20 . HN . . c17360_2l7l 1 17 . 1 1 21 21 LYS N N . . . 1 1 21 21 LYS H H . . -1.3827 . . . . . . . . A . 21 LYS N . . A . 21 LYS H . . . 21 . N . . . . . 21 . HN . . c17360_2l7l 1 18 . 1 1 22 22 ASP N N . . . 1 1 22 22 ASP H H . . -3.0355 . . . . . . . . A . 22 ASP N . . A . 22 ASP H . . . 22 . N . . . . . 22 . HN . . c17360_2l7l 1 19 . 1 1 23 23 GLY N N . . . 1 1 23 23 GLY H H . . -3.0319 . . . . . . . . A . 23 GLY N . . A . 23 GLY H . . . 23 . N . . . . . 23 . HN . . c17360_2l7l 1 20 . 1 1 24 24 ASP N N . . . 1 1 24 24 ASP H H . . 6.4967 . . . . . . . . A . 24 ASP N . . A . 24 ASP H . . . 24 . N . . . . . 24 . HN . . c17360_2l7l 1 21 . 1 1 25 25 GLY N N . . . 1 1 25 25 GLY H H . . -11.8352 . . . . . . . . A . 25 GLY N . . A . 25 GLY H . . . 25 . N . . . . . 25 . HN . . c17360_2l7l 1 22 . 1 1 26 26 THR N N . . . 1 1 26 26 THR H H . . 12.9457 . . . . . . . . A . 26 THR N . . A . 26 THR H . . . 26 . N . . . . . 26 . HN . . c17360_2l7l 1 23 . 1 1 27 27 ILE N N . . . 1 1 27 27 ILE H H . . 12.9974 . . . . . . . . A . 27 ILE H . . A . 27 ILE N . . . 27 . HN . . . . . 27 . N . . c17360_2l7l 1 24 . 1 1 28 28 THR N N . . . 1 1 28 28 THR H H . . -4.7896 . . . . . . . . A . 28 THR N . . A . 28 THR H . . . 28 . N . . . . . 28 . HN . . c17360_2l7l 1 25 . 1 1 29 29 THR N N . . . 1 1 29 29 THR H H . . -20.3628 . . . . . . . . A . 29 THR N . . A . 29 THR H . . . 29 . N . . . . . 29 . HN . . c17360_2l7l 1 26 . 1 1 31 31 GLU N N . . . 1 1 31 31 GLU H H . . -12.7328 . . . . . . . . A . 31 GLU N . . A . 31 GLU H . . . 31 . N . . . . . 31 . HN . . c17360_2l7l 1 27 . 1 1 32 32 LEU N N . . . 1 1 32 32 LEU H H . . -17.2412 . . . . . . . . A . 32 LEU N . . A . 32 LEU H . . . 32 . N . . . . . 32 . HN . . c17360_2l7l 1 28 . 1 1 33 33 GLY N N . . . 1 1 33 33 GLY H H . . -14.9847 . . . . . . . . A . 33 GLY H . . A . 33 GLY N . . . 33 . HN . . . . . 33 . N . . c17360_2l7l 1 29 . 1 1 34 34 THR N N . . . 1 1 34 34 THR H H . . -12.2828 . . . . . . . . A . 34 THR H . . A . 34 THR N . . . 34 . HN . . . . . 34 . N . . c17360_2l7l 1 30 . 1 1 35 35 VAL N N . . . 1 1 35 35 VAL H H . . -10.4794 . . . . . . . . A . 35 VAL H . . A . 35 VAL N . . . 35 . HN . . . . . 35 . N . . c17360_2l7l 1 31 . 1 1 37 37 ARG N N . . . 1 1 37 37 ARG H H . . -16.8534 . . . . . . . . A . 37 ARG H . . A . 37 ARG N . . . 37 . HN . . . . . 37 . N . . c17360_2l7l 1 32 . 1 1 38 38 SER N N . . . 1 1 38 38 SER H H . . -4.9463 . . . . . . . . A . 38 SER H . . A . 38 SER N . . . 38 . HN . . . . . 38 . N . . c17360_2l7l 1 33 . 1 1 39 39 LEU N N . . . 1 1 39 39 LEU H H . . -16.1393 . . . . . . . . A . 39 LEU N . . A . 39 LEU H . . . 39 . N . . . . . 39 . HN . . c17360_2l7l 1 34 . 1 1 40 40 GLY N N . . . 1 1 40 40 GLY H H . . 2.1110 . . . . . . . . A . 40 GLY N . . A . 40 GLY H . . . 40 . N . . . . . 40 . HN . . c17360_2l7l 1 35 . 1 1 41 41 GLN N N . . . 1 1 41 41 GLN H H . . 1.2139 . . . . . . . . A . 41 GLN N . . A . 41 GLN H . . . 41 . N . . . . . 41 . HN . . c17360_2l7l 1 36 . 1 1 42 42 ASN N N . . . 1 1 42 42 ASN H H . . 2.1125 . . . . . . . . A . 42 ASN N . . A . 42 ASN H . . . 42 . N . . . . . 42 . HN . . c17360_2l7l 1 37 . 1 1 44 44 THR N N . . . 1 1 44 44 THR H H . . 7.9473 . . . . . . . . A . 44 THR N . . A . 44 THR H . . . 44 . N . . . . . 44 . HN . . c17360_2l7l 1 38 . 1 1 45 45 GLU N N . . . 1 1 45 45 GLU H H . . 19.2614 . . . . . . . . A . 45 GLU N . . A . 45 GLU H . . . 45 . N . . . . . 45 . HN . . c17360_2l7l 1 39 . 1 1 46 46 ALA N N . . . 1 1 46 46 ALA H H . . 13.1971 . . . . . . . . A . 46 ALA N . . A . 46 ALA H . . . 46 . N . . . . . 46 . HN . . c17360_2l7l 1 40 . 1 1 47 47 GLU N N . . . 1 1 47 47 GLU H H . . 17.6213 . . . . . . . . A . 47 GLU N . . A . 47 GLU H . . . 47 . N . . . . . 47 . HN . . c17360_2l7l 1 41 . 1 1 49 49 GLN N N . . . 1 1 49 49 GLN H H . . 17.3076 . . . . . . . . A . 49 GLN H . . A . 49 GLN N . . . 49 . HN . . . . . 49 . N . . c17360_2l7l 1 42 . 1 1 52 52 ILE N N . . . 1 1 52 52 ILE H H . . 18.3334 . . . . . . . . A . 52 ILE H . . A . 52 ILE N . . . 52 . HN . . . . . 52 . N . . c17360_2l7l 1 43 . 1 1 53 53 ASN N N . . . 1 1 53 53 ASN H H . . 16.1545 . . . . . . . . A . 53 ASN H . . A . 53 ASN N . . . 53 . HN . . . . . 53 . N . . c17360_2l7l 1 44 . 1 1 54 54 GLU N N . . . 1 1 54 54 GLU H H . . 6.3548 . . . . . . . . A . 54 GLU H . . A . 54 GLU N . . . 54 . HN . . . . . 54 . N . . c17360_2l7l 1 45 . 1 1 55 55 VAL N N . . . 1 1 55 55 VAL H H . . 17.6218 . . . . . . . . A . 55 VAL N . . A . 55 VAL H . . . 55 . N . . . . . 55 . HN . . c17360_2l7l 1 46 . 1 1 56 56 ASP N N . . . 1 1 56 56 ASP H H . . 8.1297 . . . . . . . . A . 56 ASP N . . A . 56 ASP H . . . 56 . N . . . . . 56 . HN . . c17360_2l7l 1 47 . 1 1 57 57 ALA N N . . . 1 1 57 57 ALA H H . . -13.0608 . . . . . . . . A . 57 ALA N . . A . 57 ALA H . . . 57 . N . . . . . 57 . HN . . c17360_2l7l 1 48 . 1 1 58 58 ASP N N . . . 1 1 58 58 ASP H H . . -9.2321 . . . . . . . . A . 58 ASP N . . A . 58 ASP H . . . 58 . N . . . . . 58 . HN . . c17360_2l7l 1 49 . 1 1 59 59 GLY N N . . . 1 1 59 59 GLY H H . . -14.8007 . . . . . . . . A . 59 GLY N . . A . 59 GLY H . . . 59 . N . . . . . 59 . HN . . c17360_2l7l 1 50 . 1 1 60 60 ASN N N . . . 1 1 60 60 ASN H H . . 0.5646 . . . . . . . . A . 60 ASN N . . A . 60 ASN H . . . 60 . N . . . . . 60 . HN . . c17360_2l7l 1 51 . 1 1 61 61 GLY N N . . . 1 1 61 61 GLY H H . . 14.6051 . . . . . . . . A . 61 GLY N . . A . 61 GLY H . . . 61 . N . . . . . 61 . HN . . c17360_2l7l 1 52 . 1 1 62 62 THR N N . . . 1 1 62 62 THR H H . . 6.2427 . . . . . . . . A . 62 THR N . . A . 62 THR H . . . 62 . N . . . . . 62 . HN . . c17360_2l7l 1 53 . 1 1 63 63 ILE N N . . . 1 1 63 63 ILE H H . . 9.5382 . . . . . . . . A . 63 ILE H . . A . 63 ILE N . . . 63 . HN . . . . . 63 . N . . c17360_2l7l 1 54 . 1 1 64 64 ASP N N . . . 1 1 64 64 ASP H H . . 2.6949 . . . . . . . . A . 64 ASP N . . A . 64 ASP H . . . 64 . N . . . . . 64 . HN . . c17360_2l7l 1 55 . 1 1 65 65 PHE N N . . . 1 1 65 65 PHE H H . . -0.4546 . . . . . . . . A . 65 PHE N . . A . 65 PHE H . . . 65 . N . . . . . 65 . HN . . c17360_2l7l 1 56 . 1 1 68 68 PHE N N . . . 1 1 68 68 PHE H H . . -0.6148 . . . . . . . . A . 68 PHE N . . A . 68 PHE H . . . 68 . N . . . . . 68 . HN . . c17360_2l7l 1 57 . 1 1 69 69 LEU N N . . . 1 1 69 69 LEU H H . . -5.4546 . . . . . . . . A . 69 LEU H . . A . 69 LEU N . . . 69 . HN . . . . . 69 . N . . c17360_2l7l 1 58 . 1 1 70 70 THR N N . . . 1 1 70 70 THR H H . . -3.4521 . . . . . . . . A . 70 THR H . . A . 70 THR N . . . 70 . HN . . . . . 70 . N . . c17360_2l7l 1 59 . 1 1 73 73 ALA N N . . . 1 1 73 73 ALA H H . . -9.3948 . . . . . . . . A . 73 ALA H . . A . 73 ALA N . . . 73 . HN . . . . . 73 . N . . c17360_2l7l 1 60 . 1 1 76 76 MET N N . . . 1 1 76 76 MET H H . . -8.6543 . . . . . . . . A . 76 MET H . . A . 76 MET N . . . 76 . HN . . . . . 76 . N . . c17360_2l7l 1 61 . 1 1 78 78 ASP N N . . . 1 1 78 78 ASP H H . . 2.1683 . . . . . . . . A . 78 ASP N . . A . 78 ASP H . . . 78 . N . . . . . 78 . HN . . c17360_2l7l 1 62 . 1 1 79 79 THR N N . . . 1 1 79 79 THR H H . . 2.4577 . . . . . . . . A . 79 THR N . . A . 79 THR H . . . 79 . N . . . . . 79 . HN . . c17360_2l7l 1 63 . 1 1 80 80 ASP N N . . . 1 1 80 80 ASP H H . . 5.1698 . . . . . . . . A . 80 ASP N . . A . 80 ASP H . . . 80 . N . . . . . 80 . HN . . c17360_2l7l 1 64 . 1 1 81 81 SER N N . . . 1 1 81 81 SER H H . . 16.7597 . . . . . . . . A . 81 SER N . . A . 81 SER H . . . 81 . N . . . . . 81 . HN . . c17360_2l7l 1 65 . 1 1 83 83 GLU N N . . . 1 1 83 83 GLU H H . . 9.4566 . . . . . . . . A . 83 GLU N . . A . 83 GLU H . . . 83 . N . . . . . 83 . HN . . c17360_2l7l 1 66 . 1 1 84 84 GLU N N . . . 1 1 84 84 GLU H H . . 20.0724 . . . . . . . . A . 84 GLU H . . A . 84 GLU N . . . 84 . HN . . . . . 84 . N . . c17360_2l7l 1 67 . 1 1 88 88 ALA N N . . . 1 1 88 88 ALA H H . . 22.1373 . . . . . . . . A . 88 ALA H . . A . 88 ALA N . . . 88 . HN . . . . . 88 . N . . c17360_2l7l 1 68 . 1 1 89 89 PHE N N . . . 1 1 89 89 PHE H H . . 17.9421 . . . . . . . . A . 89 PHE H . . A . 89 PHE N . . . 89 . HN . . . . . 89 . N . . c17360_2l7l 1 69 . 1 1 90 90 ARG N N . . . 1 1 90 90 ARG H H . . 7.0836 . . . . . . . . A . 90 ARG H . . A . 90 ARG N . . . 90 . HN . . . . . 90 . N . . c17360_2l7l 1 70 . 1 1 91 91 VAL N N . . . 1 1 91 91 VAL H H . . 18.7901 . . . . . . . . A . 91 VAL H . . A . 91 VAL N . . . 91 . HN . . . . . 91 . N . . c17360_2l7l 1 71 . 1 1 92 92 PHE N N . . . 1 1 92 92 PHE H H . . 20.1773 . . . . . . . . A . 92 PHE H . . A . 92 PHE N . . . 92 . HN . . . . . 92 . N . . c17360_2l7l 1 72 . 1 1 93 93 ASP N N . . . 1 1 93 93 ASP H H . . 8.1262 . . . . . . . . A . 93 ASP N . . A . 93 ASP H . . . 93 . N . . . . . 93 . HN . . c17360_2l7l 1 73 . 1 1 94 94 LYS N N . . . 1 1 94 94 LYS H H . . -0.1865 . . . . . . . . A . 94 LYS N . . A . 94 LYS H . . . 94 . N . . . . . 94 . HN . . c17360_2l7l 1 74 . 1 1 95 95 ASP N N . . . 1 1 95 95 ASP H H . . -1.0517 . . . . . . . . A . 95 ASP N . . A . 95 ASP H . . . 95 . N . . . . . 95 . HN . . c17360_2l7l 1 75 . 1 1 96 96 GLY N N . . . 1 1 96 96 GLY H H . . -2.3487 . . . . . . . . A . 96 GLY N . . A . 96 GLY H . . . 96 . N . . . . . 96 . HN . . c17360_2l7l 1 76 . 1 1 97 97 ASN N N . . . 1 1 97 97 ASN H H . . 1.6711 . . . . . . . . A . 97 ASN N . . A . 97 ASN H . . . 97 . N . . . . . 97 . HN . . c17360_2l7l 1 77 . 1 1 98 98 GLY N N . . . 1 1 98 98 GLY H H . . -14.1576 . . . . . . . . A . 98 GLY N . . A . 98 GLY H . . . 98 . N . . . . . 98 . HN . . c17360_2l7l 1 78 . 1 1 99 99 TYR N N . . . 1 1 99 99 TYR H H . . 18.3588 . . . . . . . . A . 99 TYR N . . A . 99 TYR H . . . 99 . N . . . . . 99 . HN . . c17360_2l7l 1 79 . 1 1 100 100 ILE N N . . . 1 1 100 100 ILE H H . . 15.1596 . . . . . . . . A . 100 ILE H . . A . 100 ILE N . . . 100 . HN . . . . . 100 . N . . c17360_2l7l 1 80 . 1 1 101 101 SER N N . . . 1 1 101 101 SER H H . . -1.7364 . . . . . . . . A . 101 SER N . . A . 101 SER H . . . 101 . N . . . . . 101 . HN . . c17360_2l7l 1 81 . 1 1 102 102 ALA N N . . . 1 1 102 102 ALA H H . . -20.4211 . . . . . . . . A . 102 ALA N . . A . 102 ALA H . . . 102 . N . . . . . 102 . HN . . c17360_2l7l 1 82 . 1 1 103 103 ALA N N . . . 1 1 103 103 ALA H H . . -18.2984 . . . . . . . . A . 103 ALA N . . A . 103 ALA H . . . 103 . N . . . . . 103 . HN . . c17360_2l7l 1 83 . 1 1 105 105 LEU N N . . . 1 1 105 105 LEU H H . . -19.0901 . . . . . . . . A . 105 LEU N . . A . 105 LEU H . . . 105 . N . . . . . 105 . HN . . c17360_2l7l 1 84 . 1 1 106 106 ARG N N . . . 1 1 106 106 ARG H H . . -18.0825 . . . . . . . . A . 106 ARG H . . A . 106 ARG N . . . 106 . HN . . . . . 106 . N . . c17360_2l7l 1 85 . 1 1 107 107 HIS N N . . . 1 1 107 107 HIS H H . . -13.1581 . . . . . . . . A . 107 HIS H . . A . 107 HIS N . . . 107 . HN . . . . . 107 . N . . c17360_2l7l 1 86 . 1 1 108 108 VAL N N . . . 1 1 108 108 VAL H H . . -16.0440 . . . . . . . . A . 108 VAL H . . A . 108 VAL N . . . 108 . HN . . . . . 108 . N . . c17360_2l7l 1 87 . 1 1 109 109 MET N N . . . 1 1 109 109 MET H H . . -20.7272 . . . . . . . . A . 109 MET H . . A . 109 MET N . . . 109 . HN . . . . . 109 . N . . c17360_2l7l 1 88 . 1 1 110 110 THR N N . . . 1 1 110 110 THR H H . . -12.8256 . . . . . . . . A . 110 THR H . . A . 110 THR N . . . 110 . HN . . . . . 110 . N . . c17360_2l7l 1 89 . 1 1 111 111 ASN N N . . . 1 1 111 111 ASN H H . . -10.6001 . . . . . . . . A . 111 ASN H . . A . 111 ASN N . . . 111 . HN . . . . . 111 . N . . c17360_2l7l 1 90 . 1 1 113 113 GLY N N . . . 1 1 113 113 GLY H H . . -2.6974 . . . . . . . . A . 113 GLY N . . A . 113 GLY H . . . 113 . N . . . . . 113 . HN . . c17360_2l7l 1 91 . 1 1 115 115 LYS N N . . . 1 1 115 115 LYS H H . . -0.0593 . . . . . . . . A . 115 LYS N . . A . 115 LYS H . . . 115 . N . . . . . 115 . HN . . c17360_2l7l 1 92 . 1 1 116 116 LEU N N . . . 1 1 116 116 LEU H H . . 3.9584 . . . . . . . . A . 116 LEU N . . A . 116 LEU H . . . 116 . N . . . . . 116 . HN . . c17360_2l7l 1 93 . 1 1 117 117 THR N N . . . 1 1 117 117 THR H H . . 17.0319 . . . . . . . . A . 117 THR N . . A . 117 THR H . . . 117 . N . . . . . 117 . HN . . c17360_2l7l 1 94 . 1 1 118 118 ASP N N . . . 1 1 118 118 ASP H H . . 14.7450 . . . . . . . . A . 118 ASP N . . A . 118 ASP H . . . 118 . N . . . . . 118 . HN . . c17360_2l7l 1 95 . 1 1 119 119 GLU N N . . . 1 1 119 119 GLU H H . . 4.7141 . . . . . . . . A . 119 GLU N . . A . 119 GLU H . . . 119 . N . . . . . 119 . HN . . c17360_2l7l 1 96 . 1 1 120 120 GLU N N . . . 1 1 120 120 GLU H H . . 10.8869 . . . . . . . . A . 120 GLU N . . A . 120 GLU H . . . 120 . N . . . . . 120 . HN . . c17360_2l7l 1 97 . 1 1 121 121 VAL N N . . . 1 1 121 121 VAL H H . . 16.9573 . . . . . . . . A . 121 VAL N . . A . 121 VAL H . . . 121 . N . . . . . 121 . HN . . c17360_2l7l 1 98 . 1 1 123 123 GLU N N . . . 1 1 123 123 GLU H H . . 4.9549 . . . . . . . . A . 123 GLU H . . A . 123 GLU N . . . 123 . HN . . . . . 123 . N . . c17360_2l7l 1 99 . 1 1 126 126 ARG N N . . . 1 1 126 126 ARG H H . . 9.5164 . . . . . . . . A . 126 ARG H . . A . 126 ARG N . . . 126 . HN . . . . . 126 . N . . c17360_2l7l 1 100 . 1 1 127 127 GLU N N . . . 1 1 127 127 GLU H H . . 5.2645 . . . . . . . . A . 127 GLU H . . A . 127 GLU N . . . 127 . HN . . . . . 127 . N . . c17360_2l7l 1 101 . 1 1 128 128 ALA N N . . . 1 1 128 128 ALA H H . . 20.8002 . . . . . . . . A . 128 ALA N . . A . 128 ALA H . . . 128 . N . . . . . 128 . HN . . c17360_2l7l 1 102 . 1 1 129 129 ASP N N . . . 1 1 129 129 ASP H H . . 7.0684 . . . . . . . . A . 129 ASP N . . A . 129 ASP H . . . 129 . N . . . . . 129 . HN . . c17360_2l7l 1 103 . 1 1 130 130 ILE N N . . . 1 1 130 130 ILE H H . . -7.3755 . . . . . . . . A . 130 ILE N . . A . 130 ILE H . . . 130 . N . . . . . 130 . HN . . c17360_2l7l 1 104 . 1 1 131 131 ASP N N . . . 1 1 131 131 ASP H H . . -11.7531 . . . . . . . . A . 131 ASP N . . A . 131 ASP H . . . 131 . N . . . . . 131 . HN . . c17360_2l7l 1 105 . 1 1 132 132 GLY N N . . . 1 1 132 132 GLY H H . . -17.0901 . . . . . . . . A . 132 GLY N . . A . 132 GLY H . . . 132 . N . . . . . 132 . HN . . c17360_2l7l 1 106 . 1 1 133 133 ASP N N . . . 1 1 133 133 ASP H H . . 1.5666 . . . . . . . . A . 133 ASP N . . A . 133 ASP H . . . 133 . N . . . . . 133 . HN . . c17360_2l7l 1 107 . 1 1 134 134 GLY N N . . . 1 1 134 134 GLY H H . . 17.8884 . . . . . . . . A . 134 GLY N . . A . 134 GLY H . . . 134 . N . . . . . 134 . HN . . c17360_2l7l 1 108 . 1 1 135 135 GLN N N . . . 1 1 135 135 GLN H H . . 2.5722 . . . . . . . . A . 135 GLN N . . A . 135 GLN H . . . 135 . N . . . . . 135 . HN . . c17360_2l7l 1 109 . 1 1 136 136 VAL N N . . . 1 1 136 136 VAL H H . . 7.7242 . . . . . . . . A . 136 VAL H . . A . 136 VAL N . . . 136 . HN . . . . . 136 . N . . c17360_2l7l 1 110 . 1 1 137 137 ASN N N . . . 1 1 137 137 ASN H H . . -0.0426 . . . . . . . . A . 137 ASN N . . A . 137 ASN H . . . 137 . N . . . . . 137 . HN . . c17360_2l7l 1 111 . 1 1 140 140 GLU N N . . . 1 1 140 140 GLU H H . . 11.1632 . . . . . . . . A . 140 GLU N . . A . 140 GLU H . . . 140 . N . . . . . 140 . HN . . c17360_2l7l 1 112 . 1 1 141 141 PHE N N . . . 1 1 141 141 PHE H H . . 3.1627 . . . . . . . . A . 141 PHE N . . A . 141 PHE H . . . 141 . N . . . . . 141 . HN . . c17360_2l7l 1 113 . 1 1 146 146 THR N N . . . 1 1 146 146 THR H H . . -10.6350 . . . . . . . . A . 146 THR N . . A . 146 THR H . . . 146 . N . . . . . 146 . HN . . c17360_2l7l 1 114 . 1 1 147 147 ALA N N . . . 1 1 147 147 ALA H H . . 9.6705 . . . . . . . . A . 147 ALA N . . A . 147 ALA H . . . 147 . N . . . . . 147 . HN . . c17360_2l7l 1 115 . 1 1 148 148 LYS N N . . . 1 1 148 148 LYS H H . . -1.9559 . . . . . . . . A . 148 LYS N . . A . 148 LYS H . . . 148 . N . . . . . 148 . HN . . c17360_2l7l 1 stop_ loop_ _RDC_constraint_parse_err.ID _RDC_constraint_parse_err.Content _RDC_constraint_parse_err.Begin_line _RDC_constraint_parse_err.Begin_column _RDC_constraint_parse_err.End_line _RDC_constraint_parse_err.End_column _RDC_constraint_parse_err.Entry_ID _RDC_constraint_parse_err.RDC_constraint_list_ID 1 ; ################################################################################ ################################################################################ ############################################################################################################################################ ##################CaM NH RDCS############################## ############################################################### ; 1 1 5 63 c17360_2l7l 1 2 ; ###################################################################### ######################################################################## ########################################################################## ; 810 1 812 74 c17360_2l7l 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 c17360_2l7l _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 METAL BINDING PROTEIN/TRANSFERASE 13-DEC-10 2L7L *TITLE SOLUTION STRUCTURE OF CA2+/CALMODULIN COMPLEXED WITH A PEPTIDE *TITLE 2 REPRESENTING THE CALMODULIN-BINDING DOMAIN OF CALMODULIN KINASE I *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: CALMODULIN; *COMPND 3 CHAIN: A; *COMPND 4 SYNONYM: PHOSPHORYLASE KINASE DELTA, ISOFORM CRA_A, CALMODULIN 3, *COMPND 5 PHOSPHORYLASE KINASE DELTA, ISOFORM CRA_B, CDNA FLJ61744; *COMPND 6 ENGINEERED: YES; *COMPND 7 MOL_ID: 2; *COMPND 8 MOLECULE: CALCIUM/CALMODULIN-DEPENDENT PROTEIN KINASE TYPE 1; *COMPND 9 CHAIN: B; *COMPND 10 FRAGMENT: CALMODULIN-BINDING RESIDUES 299-320; *COMPND 11 SYNONYM: CAM KINASE I, CAM-KI, CAM KINASE I ALPHA, CAMKI-ALPHA; *COMPND 12 EC: 2.7.11.17; *COMPND 13 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; *SOURCE 3 ORGANISM_COMMON: HUMAN; *SOURCE 4 ORGANISM_TAXID: 9606; *SOURCE 5 GENE: CALM1, CALM3, HCG_20313, HCG_21749; *SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; *SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; *SOURCE 8 EXPRESSION_SYSTEM_VECTOR: PET30B(+); *SOURCE 9 MOL_ID: 2; *SOURCE 10 SYNTHETIC: YES *KEYWDS CALMODULIN COMPLEX, CALMODULIN-PEPTIDE COMPLEX, CAMKI, METAL BINDING *KEYWDS 2 PROTEIN-TRANSFERASE COMPLEX *EXPDTA SOLUTION NMR *NUMMDL 1 *AUTHOR J.L.GIFFORD, H.ISHIDA, H.J.VOGEL *REVDAT 1 18-MAY-11 2L7L 0' save_