data_19164 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19164 _Entry.Title ; solution structure of cerebral dopamine neurotrophic factor (CDNF) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-04-15 _Entry.Accession_date 2013-04-15 _Entry.Last_release_date 2015-06-19 _Entry.Original_release_date 2015-06-19 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.1.32 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 C. Latge . . . . 19164 2 K. Cabral . m.s. . . 19164 3 D. Raymundo . p. . . 19164 4 D. Foguel . . . . 19164 5 T. Herrmann . . . . 19164 6 Marcius Almeida . da.silva. . . 19164 7 M. Al . . . . 19164 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 19164 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . almeidaGroup . 19164 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'SIGNALING PROTEIN' . 19164 'neurotrophic factor' . 19164 parkinson . 19164 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 19164 heteronucl_NOEs 1 19164 heteronucl_T1_relaxation 1 19164 heteronucl_T2_relaxation 1 19164 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 709 19164 '15N chemical shifts' 149 19164 '1H chemical shifts' 1156 19164 'T1 relaxation values' 81 19164 'T2 relaxation values' 81 19164 'heteronuclear NOE values' 122 19164 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 3 . . 2020-01-06 2013-04-15 update author 'update sample and conditions' 19164 2 . . 2015-06-18 2013-04-15 update author 'adding T1, T2 and NOE data' 19164 1 . . 2013-08-15 2013-04-15 original author 'original release' 19164 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 4BIT 'solution structure of cerebral dopamine neurotrophic factor (CDNF)' 19164 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19164 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22528768 _Citation.Full_citation . _Citation.Title ; (1)H-, (13)C- and (15)N-NMR assignment of the N-terminal domain of human cerebral dopamine neurotrophic factor (CDNF). ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 7 _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 101 _Citation.Page_last 103 _Citation.Year 2013 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Cristiane Latge . . . . 19164 1 2 Katia Cabral . M.S. . . 19164 1 3 Marcius Almeida . S. . . 19164 1 4 Debora Foguel . . . . 19164 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19164 _Assembly.ID 1 _Assembly.Name 'cerebral dopamine neurotrophic factor (CDNF)' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds yes _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'all disulfide bound' _Assembly.Molecular_mass 18318.1787 _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 'CEREBRAL DOPAMINE NEUROTROPHIC FACTOR' 1 $CEREBRAL_DOPAMINE_NEUROTROPHIC_FACTOR A . yes native no no . . . 19164 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_asym_ID_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_asym_ID_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 11 11 SG . 1 . 1 CYS 98 98 SG . 'CEREBRAL DOPAMINE NEUROTROPHIC FACTOR' . 11 CYS SG . 'CEREBRAL DOPAMINE NEUROTROPHIC FACTOR' . 98 CYS SG 19164 1 2 disulfide single . 1 . 1 CYS 14 14 SG . 1 . 1 CYS 87 87 SG . 'CEREBRAL DOPAMINE NEUROTROPHIC FACTOR' . 14 CYS SG . 'CEREBRAL DOPAMINE NEUROTROPHIC FACTOR' . 87 CYS SG 19164 1 3 disulfide single . 1 . 1 CYS 132 132 SG . 1 . 1 CYS 135 135 SG . 'CEREBRAL DOPAMINE NEUROTROPHIC FACTOR' . 132 CYS SG . 'CEREBRAL DOPAMINE NEUROTROPHIC FACTOR' . 135 CYS SG 19164 1 4 disulfide single . 1 . 1 CYS 45 45 SG . 1 . 1 CYS 56 56 SG . 'CEREBRAL DOPAMINE NEUROTROPHIC FACTOR' . 45 CYS SG . 'CEREBRAL DOPAMINE NEUROTROPHIC FACTOR' . 56 CYS SG 19164 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_CEREBRAL_DOPAMINE_NEUROTROPHIC_FACTOR _Entity.Sf_category entity _Entity.Sf_framecode CEREBRAL_DOPAMINE_NEUROTROPHIC_FACTOR _Entity.Entry_ID 19164 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name CEREBRAL_DOPAMINE_NEUROTROPHIC_FACTOR _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 ; QEAGGRPGADCEVCKEFLNR FYKSLIDRGVNFSLDTIEKE LISFCLDTKGKENRLCYYLG ATKDAATKILSEVTRPMSVH MPAMKICEKLKKLDSQICEL KYEKTLDLASVDLRKMRVAE LKQILHSWGEECRACAEKTD YVNLIQELAPKYAATHPKTE L ; _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 161 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 18318.1787 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UNP CDNF_HUMAN . Q49AH0 . . . 'the structure contains only the mature aminoacid sequence.' . . . . . . . . . . 19164 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 . GLN . 19164 1 2 . GLU . 19164 1 3 . ALA . 19164 1 4 . GLY . 19164 1 5 . GLY . 19164 1 6 . ARG . 19164 1 7 . PRO . 19164 1 8 . GLY . 19164 1 9 . ALA . 19164 1 10 . ASP . 19164 1 11 . CYS . 19164 1 12 . GLU . 19164 1 13 . VAL . 19164 1 14 . CYS . 19164 1 15 . LYS . 19164 1 16 . GLU . 19164 1 17 . PHE . 19164 1 18 . LEU . 19164 1 19 . ASN . 19164 1 20 . ARG . 19164 1 21 . PHE . 19164 1 22 . TYR . 19164 1 23 . LYS . 19164 1 24 . SER . 19164 1 25 . LEU . 19164 1 26 . ILE . 19164 1 27 . ASP . 19164 1 28 . ARG . 19164 1 29 . GLY . 19164 1 30 . VAL . 19164 1 31 . ASN . 19164 1 32 . PHE . 19164 1 33 . SER . 19164 1 34 . LEU . 19164 1 35 . ASP . 19164 1 36 . THR . 19164 1 37 . ILE . 19164 1 38 . GLU . 19164 1 39 . LYS . 19164 1 40 . GLU . 19164 1 41 . LEU . 19164 1 42 . ILE . 19164 1 43 . SER . 19164 1 44 . PHE . 19164 1 45 . CYS . 19164 1 46 . LEU . 19164 1 47 . ASP . 19164 1 48 . THR . 19164 1 49 . LYS . 19164 1 50 . GLY . 19164 1 51 . LYS . 19164 1 52 . GLU . 19164 1 53 . ASN . 19164 1 54 . ARG . 19164 1 55 . LEU . 19164 1 56 . CYS . 19164 1 57 . TYR . 19164 1 58 . TYR . 19164 1 59 . LEU . 19164 1 60 . GLY . 19164 1 61 . ALA . 19164 1 62 . THR . 19164 1 63 . LYS . 19164 1 64 . ASP . 19164 1 65 . ALA . 19164 1 66 . ALA . 19164 1 67 . THR . 19164 1 68 . LYS . 19164 1 69 . ILE . 19164 1 70 . LEU . 19164 1 71 . SER . 19164 1 72 . GLU . 19164 1 73 . VAL . 19164 1 74 . THR . 19164 1 75 . ARG . 19164 1 76 . PRO . 19164 1 77 . MET . 19164 1 78 . SER . 19164 1 79 . VAL . 19164 1 80 . HIS . 19164 1 81 . MET . 19164 1 82 . PRO . 19164 1 83 . ALA . 19164 1 84 . MET . 19164 1 85 . LYS . 19164 1 86 . ILE . 19164 1 87 . CYS . 19164 1 88 . GLU . 19164 1 89 . LYS . 19164 1 90 . LEU . 19164 1 91 . LYS . 19164 1 92 . LYS . 19164 1 93 . LEU . 19164 1 94 . ASP . 19164 1 95 . SER . 19164 1 96 . GLN . 19164 1 97 . ILE . 19164 1 98 . CYS . 19164 1 99 . GLU . 19164 1 100 . LEU . 19164 1 101 . LYS . 19164 1 102 . TYR . 19164 1 103 . GLU . 19164 1 104 . LYS . 19164 1 105 . THR . 19164 1 106 . LEU . 19164 1 107 . ASP . 19164 1 108 . LEU . 19164 1 109 . ALA . 19164 1 110 . SER . 19164 1 111 . VAL . 19164 1 112 . ASP . 19164 1 113 . LEU . 19164 1 114 . ARG . 19164 1 115 . LYS . 19164 1 116 . MET . 19164 1 117 . ARG . 19164 1 118 . VAL . 19164 1 119 . ALA . 19164 1 120 . GLU . 19164 1 121 . LEU . 19164 1 122 . LYS . 19164 1 123 . GLN . 19164 1 124 . ILE . 19164 1 125 . LEU . 19164 1 126 . HIS . 19164 1 127 . SER . 19164 1 128 . TRP . 19164 1 129 . GLY . 19164 1 130 . GLU . 19164 1 131 . GLU . 19164 1 132 . CYS . 19164 1 133 . ARG . 19164 1 134 . ALA . 19164 1 135 . CYS . 19164 1 136 . ALA . 19164 1 137 . GLU . 19164 1 138 . LYS . 19164 1 139 . THR . 19164 1 140 . ASP . 19164 1 141 . TYR . 19164 1 142 . VAL . 19164 1 143 . ASN . 19164 1 144 . LEU . 19164 1 145 . ILE . 19164 1 146 . GLN . 19164 1 147 . GLU . 19164 1 148 . LEU . 19164 1 149 . ALA . 19164 1 150 . PRO . 19164 1 151 . LYS . 19164 1 152 . TYR . 19164 1 153 . ALA . 19164 1 154 . ALA . 19164 1 155 . THR . 19164 1 156 . HIS . 19164 1 157 . PRO . 19164 1 158 . LYS . 19164 1 159 . THR . 19164 1 160 . GLU . 19164 1 161 . LEU . 19164 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 . GLN 1 1 19164 1 . GLU 2 2 19164 1 . ALA 3 3 19164 1 . GLY 4 4 19164 1 . GLY 5 5 19164 1 . ARG 6 6 19164 1 . PRO 7 7 19164 1 . GLY 8 8 19164 1 . ALA 9 9 19164 1 . ASP 10 10 19164 1 . CYS 11 11 19164 1 . GLU 12 12 19164 1 . VAL 13 13 19164 1 . CYS 14 14 19164 1 . LYS 15 15 19164 1 . GLU 16 16 19164 1 . PHE 17 17 19164 1 . LEU 18 18 19164 1 . ASN 19 19 19164 1 . ARG 20 20 19164 1 . PHE 21 21 19164 1 . TYR 22 22 19164 1 . LYS 23 23 19164 1 . SER 24 24 19164 1 . LEU 25 25 19164 1 . ILE 26 26 19164 1 . ASP 27 27 19164 1 . ARG 28 28 19164 1 . GLY 29 29 19164 1 . VAL 30 30 19164 1 . ASN 31 31 19164 1 . PHE 32 32 19164 1 . SER 33 33 19164 1 . LEU 34 34 19164 1 . ASP 35 35 19164 1 . THR 36 36 19164 1 . ILE 37 37 19164 1 . GLU 38 38 19164 1 . LYS 39 39 19164 1 . GLU 40 40 19164 1 . LEU 41 41 19164 1 . ILE 42 42 19164 1 . SER 43 43 19164 1 . PHE 44 44 19164 1 . CYS 45 45 19164 1 . LEU 46 46 19164 1 . ASP 47 47 19164 1 . THR 48 48 19164 1 . LYS 49 49 19164 1 . GLY 50 50 19164 1 . LYS 51 51 19164 1 . GLU 52 52 19164 1 . ASN 53 53 19164 1 . ARG 54 54 19164 1 . LEU 55 55 19164 1 . CYS 56 56 19164 1 . TYR 57 57 19164 1 . TYR 58 58 19164 1 . LEU 59 59 19164 1 . GLY 60 60 19164 1 . ALA 61 61 19164 1 . THR 62 62 19164 1 . LYS 63 63 19164 1 . ASP 64 64 19164 1 . ALA 65 65 19164 1 . ALA 66 66 19164 1 . THR 67 67 19164 1 . LYS 68 68 19164 1 . ILE 69 69 19164 1 . LEU 70 70 19164 1 . SER 71 71 19164 1 . GLU 72 72 19164 1 . VAL 73 73 19164 1 . THR 74 74 19164 1 . ARG 75 75 19164 1 . PRO 76 76 19164 1 . MET 77 77 19164 1 . SER 78 78 19164 1 . VAL 79 79 19164 1 . HIS 80 80 19164 1 . MET 81 81 19164 1 . PRO 82 82 19164 1 . ALA 83 83 19164 1 . MET 84 84 19164 1 . LYS 85 85 19164 1 . ILE 86 86 19164 1 . CYS 87 87 19164 1 . GLU 88 88 19164 1 . LYS 89 89 19164 1 . LEU 90 90 19164 1 . LYS 91 91 19164 1 . LYS 92 92 19164 1 . LEU 93 93 19164 1 . ASP 94 94 19164 1 . SER 95 95 19164 1 . GLN 96 96 19164 1 . ILE 97 97 19164 1 . CYS 98 98 19164 1 . GLU 99 99 19164 1 . LEU 100 100 19164 1 . LYS 101 101 19164 1 . TYR 102 102 19164 1 . GLU 103 103 19164 1 . LYS 104 104 19164 1 . THR 105 105 19164 1 . LEU 106 106 19164 1 . ASP 107 107 19164 1 . LEU 108 108 19164 1 . ALA 109 109 19164 1 . SER 110 110 19164 1 . VAL 111 111 19164 1 . ASP 112 112 19164 1 . LEU 113 113 19164 1 . ARG 114 114 19164 1 . LYS 115 115 19164 1 . MET 116 116 19164 1 . ARG 117 117 19164 1 . VAL 118 118 19164 1 . ALA 119 119 19164 1 . GLU 120 120 19164 1 . LEU 121 121 19164 1 . LYS 122 122 19164 1 . GLN 123 123 19164 1 . ILE 124 124 19164 1 . LEU 125 125 19164 1 . HIS 126 126 19164 1 . SER 127 127 19164 1 . TRP 128 128 19164 1 . GLY 129 129 19164 1 . GLU 130 130 19164 1 . GLU 131 131 19164 1 . CYS 132 132 19164 1 . ARG 133 133 19164 1 . ALA 134 134 19164 1 . CYS 135 135 19164 1 . ALA 136 136 19164 1 . GLU 137 137 19164 1 . LYS 138 138 19164 1 . THR 139 139 19164 1 . ASP 140 140 19164 1 . TYR 141 141 19164 1 . VAL 142 142 19164 1 . ASN 143 143 19164 1 . LEU 144 144 19164 1 . ILE 145 145 19164 1 . GLN 146 146 19164 1 . GLU 147 147 19164 1 . LEU 148 148 19164 1 . ALA 149 149 19164 1 . PRO 150 150 19164 1 . LYS 151 151 19164 1 . TYR 152 152 19164 1 . ALA 153 153 19164 1 . ALA 154 154 19164 1 . THR 155 155 19164 1 . HIS 156 156 19164 1 . PRO 157 157 19164 1 . LYS 158 158 19164 1 . THR 159 159 19164 1 . GLU 160 160 19164 1 . LEU 161 161 19164 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 19164 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $CEREBRAL_DOPAMINE_NEUROTROPHIC_FACTOR . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . brain brain . . neuron . . . . . . 19164 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 19164 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $CEREBRAL_DOPAMINE_NEUROTROPHIC_FACTOR . 'recombinant technology' 'escherichia coli' 'escherichia coli' . . escherichia coli BL21(DE3) 'ROSETTA B 4' . n/a . . pet25b . . . 19164 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19164 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '[U-13C; U-15N], 0.7 mM; MES 20 mM; NaCl 150 mM; NaN3 5 mM' _Sample.Aggregate_sample_number . _Sample.Solvent_system '10% D20' _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 'CEREBRAL DOPAMINE NEUROTROPHIC FACTOR' '[U-13C; U-15N]' . . 1 $CEREBRAL_DOPAMINE_NEUROTROPHIC_FACTOR . . 0.7 . . mM . . . . 19164 1 2 MES 'natural abundance' . . . . . . 20 . . mM . . . . 19164 1 3 NaCl 'natural abundance' . . . . . . 150 . . mM . . . . 19164 1 4 NaN3 'natural abundance' . . . . . . 5 . . mM . . . . 19164 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 19164 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '[U-13C; U-15N], 0.65 mM; Sodium Phosphate 20 mM; NaCl 100 mM; NaN3 3 mM; EDTA 1 mM' _Sample.Aggregate_sample_number . _Sample.Solvent_system '10% D20' _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 'CEREBRAL DOPAMINE NEUROTROPHIC FACTOR' '[U-13C; U-15N]' . . 1 $CEREBRAL_DOPAMINE_NEUROTROPHIC_FACTOR . . 0.65 . . mM . . . . 19164 2 2 'Sodium Phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 19164 2 3 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 19164 2 4 NaN3 'natural abundance' . . . . . . 3 . . mM . . . . 19164 2 5 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 19164 2 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 19164 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details 'pH [6.0], temp [298], pressure [1], ionStrength [170.0]' loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 170.000 . mM 19164 1 pH 6.000 . pH 19164 1 pressure 1.000 . atm 19164 1 temperature 298.000 . K 19164 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 19164 _Sample_condition_list.ID 2 _Sample_condition_list.Name . _Sample_condition_list.Details 'pH [6.0], temp [298], pressure [1], ionStrength [120.0]' loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 120.000 . mM 19164 2 pH 6.000 . pH 19164 2 pressure 1.000 . atm 19164 2 temperature 298.000 . K 19164 2 stop_ save_ ############################ # Computer software used # ############################ save_AutoDep _Software.Sf_category software _Software.Sf_framecode AutoDep _Software.Entry_ID 19164 _Software.ID 1 _Software.Type . _Software.Name AutoDep _Software.Version 4.3 _Software.DOI . _Software.Details . loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . collection 19164 1 stop_ save_ save_UNIO _Software.Sf_category software _Software.Sf_framecode UNIO _Software.Entry_ID 19164 _Software.ID 2 _Software.Type . _Software.Name UNIO _Software.Version 10 _Software.DOI . _Software.Details . loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 19164 2 stop_ save_ save_cns _Software.Sf_category software _Software.Sf_framecode cns _Software.Entry_ID 19164 _Software.ID 3 _Software.Type . _Software.Name CNS _Software.Version 1.3 _Software.DOI . _Software.Details 'Using RECOORD scripts.' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 19164 3 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 19164 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_Bruker_Avance-1000 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode Bruker_Avance-1000 _NMR_spectrometer.Entry_ID 19164 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 1000 save_ save_Bruker_Avance-800 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode Bruker_Avance-800 _NMR_spectrometer.Entry_ID 19164 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_Bruker_Avance-600 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode Bruker_Avance-600 _NMR_spectrometer.Entry_ID 19164 _NMR_spectrometer.ID 3 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 19164 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 Bruker_Avance-1000 Bruker Avance . 1000 . . . 19164 1 2 Bruker_Avance-800 Bruker Avance . 800 . . . 19164 1 3 Bruker_Avance-600 Bruker Avance . 600 . . . 19164 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 19164 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 NOESY no . . . . . . . . . . 2 $sample_2 solution . . 2 $sample_conditions_2 . . . 1 $Bruker_Avance-1000 . . . . . . . . . . . . . . . . 19164 1 2 NOESY no . . . . . . . . . . 2 $sample_2 solution . . 2 $sample_conditions_2 . . . 2 $Bruker_Avance-800 . . . . . . . . . . . . . . . . 19164 1 3 TOCSY no . . . . . . . . . . 1 $sample_1 solution . . 1 $sample_conditions_1 . . . 2 $Bruker_Avance-800 . . . . . . . . . . . . . . . . 19164 1 4 HSQC no . . . . . . . . . . 1 $sample_1 solution . . 1 $sample_conditions_1 . . . 2 $Bruker_Avance-800 . . . . . . . . . . . . . . . . 19164 1 5 COSY no . . . . . . . . . . 1 $sample_1 solution . . 1 $sample_conditions_1 . . . 2 $Bruker_Avance-800 . . . . . . . . . . . . . . . . 19164 1 6 HNCACB no . . . . . . . . . . 1 $sample_1 solution . . 1 $sample_conditions_1 . . . 3 $Bruker_Avance-600 . . . . . . . . . . . . . . . . 19164 1 7 CBCACONH no . . . . . . . . . . 1 $sample_1 solution . . 1 $sample_conditions_1 . . . 3 $Bruker_Avance-600 . . . . . . . . . . . . . . . . 19164 1 8 HBHACONH no . . . . . . . . . . 1 $sample_1 solution . . 1 $sample_conditions_1 . . . 3 $Bruker_Avance-600 . . . . . . . . . . . . . . . . 19164 1 9 HNCO no . . . . . . . . . . 1 $sample_1 solution . . 1 $sample_conditions_1 . . . 3 $Bruker_Avance-600 . . . . . . . . . . . . . . . . 19164 1 10 HSQC no . . . . . . . . . . 1 $sample_1 solution . . 1 $sample_conditions_1 . . . 3 $Bruker_Avance-600 . . . . . . . . . . . . . . . . 19164 1 11 TOCSY no . . . . . . . . . . 1 $sample_1 solution . . 1 $sample_conditions_1 . . . 1 $Bruker_Avance-1000 . . . . . . . . . . . . . . . . 19164 1 12 HSQC no . . . . . . . . . . 1 $sample_1 solution . . 1 $sample_conditions_1 . . . 1 $Bruker_Avance-1000 . . . . . . . . . . . . . . . . 19164 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 19164 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details ; The 13C and 15N chemical shifts were referenced indirectly to DSS, using the absolute frequency ratios, which give corrections of 2.664 ppm and 0.127 ppm, for 13C and 15N, respectively. ; loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 internal indirect . . . . . . 19164 1 H 1 DSS 'methyl protons' . . . . ppm -0.103 internal direct 1 . . . . . 19164 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 internal indirect . . . . . . 19164 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list _Assigned_chem_shift_list.Entry_ID 19164 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $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 ; Origin xeasy file /home/ccpn/svn_web/ccpnmrweb/webapps/uploads/E9dV1pY2vP0dM0dQ3kL8vY9rY9iX9iB0cH5rB8pU1pZ8xX8gE8wC0wQ3qA6u/CDNF-xeasy.prot Origin nmrStar file /ebi/msd/pdb_root/Processing/prepare/4bit/ebi/shift.project.csh ; _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 NOESY 1 $sample_1 solution 19164 1 3 TOCSY 1 $sample_1 solution 19164 1 4 HSQC 1 $sample_1 solution 19164 1 5 COSY 1 $sample_1 solution 19164 1 6 HNCACB 1 $sample_1 solution 19164 1 7 CBCACONH 1 $sample_1 solution 19164 1 8 HBHACONH 1 $sample_1 solution 19164 1 9 HNCO 1 $sample_1 solution 19164 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLN HA H 1 4.413 0.043 . 1 . . 815 . . 1 GLN HA . 19164 1 2 . 1 1 1 1 GLN HB2 H 1 2.125 0.043 . 1 . . 819 . . 1 GLN HB2 . 19164 1 3 . 1 1 1 1 GLN HB3 H 1 2.048 0.043 . 1 . . 816 . . 1 GLN HB3 . 19164 1 4 . 1 1 1 1 GLN HG2 H 1 2.406 0.043 . 1 . . 1736 . . 1 GLN HG2 . 19164 1 5 . 1 1 1 1 GLN HG3 H 1 2.406 0.043 . 1 . . 817 . . 1 GLN HG3 . 19164 1 6 . 1 1 1 1 GLN HE21 H 1 7.615 0.043 . 1 . . 1540 . . 1 GLN HE21 . 19164 1 7 . 1 1 1 1 GLN HE22 H 1 6.908 0.043 . 1 . . 1542 . . 1 GLN HE22 . 19164 1 8 . 1 1 1 1 GLN C C 13 175.350 0.313 . 1 . . 1545 . . 1 GLN C . 19164 1 9 . 1 1 1 1 GLN CA C 13 56.022 0.313 . 1 . . 813 . . 1 GLN CA . 19164 1 10 . 1 1 1 1 GLN CB C 13 29.365 0.313 . 1 . . 814 . . 1 GLN CB . 19164 1 11 . 1 1 1 1 GLN CG C 13 33.595 0.313 . 1 . . 818 . . 1 GLN CG . 19164 1 12 . 1 1 1 1 GLN NE2 N 15 112.474 0.125 . 1 . . 1541 . . 1 GLN NE2 . 19164 1 13 . 1 1 2 2 GLU H H 1 8.716 0.043 . 1 . . 272 . . 2 GLU H . 19164 1 14 . 1 1 2 2 GLU HA H 1 4.307 0.043 . 1 . . 759 . . 2 GLU HA . 19164 1 15 . 1 1 2 2 GLU HB2 H 1 2.076 0.043 . 1 . . 762 . . 2 GLU HB2 . 19164 1 16 . 1 1 2 2 GLU HB3 H 1 1.974 0.043 . 1 . . 760 . . 2 GLU HB3 . 19164 1 17 . 1 1 2 2 GLU HG2 H 1 2.314 0.043 . 1 . . 1737 . . 2 GLU HG2 . 19164 1 18 . 1 1 2 2 GLU HG3 H 1 2.314 0.043 . 1 . . 761 . . 2 GLU HG3 . 19164 1 19 . 1 1 2 2 GLU C C 13 176.206 0.313 . 1 . . 1546 . . 2 GLU C . 19164 1 20 . 1 1 2 2 GLU CA C 13 56.377 0.313 . 1 . . 378 . . 2 GLU CA . 19164 1 21 . 1 1 2 2 GLU CB C 13 30.074 0.313 . 1 . . 436 . . 2 GLU CB . 19164 1 22 . 1 1 2 2 GLU CG C 13 35.959 0.313 . 1 . . 763 . . 2 GLU CG . 19164 1 23 . 1 1 2 2 GLU N N 15 123.736 0.125 . 1 . . 273 . . 2 GLU N . 19164 1 24 . 1 1 3 3 ALA H H 1 8.571 0.043 . 1 . . 61 . . 3 ALA H . 19164 1 25 . 1 1 3 3 ALA HA H 1 4.367 0.043 . 1 . . 515 . . 3 ALA HA . 19164 1 26 . 1 1 3 3 ALA HB1 H 1 1.446 0.043 . 1 . . 220 . . 3 ALA HB1 . 19164 1 27 . 1 1 3 3 ALA HB2 H 1 1.446 0.043 . 1 . . 220 . . 3 ALA HB2 . 19164 1 28 . 1 1 3 3 ALA HB3 H 1 1.446 0.043 . 1 . . 220 . . 3 ALA HB3 . 19164 1 29 . 1 1 3 3 ALA C C 13 178.202 0.313 . 1 . . 1547 . . 3 ALA C . 19164 1 30 . 1 1 3 3 ALA CA C 13 52.598 0.313 . 1 . . 423 . . 3 ALA CA . 19164 1 31 . 1 1 3 3 ALA CB C 13 19.095 0.313 . 1 . . 422 . . 3 ALA CB . 19164 1 32 . 1 1 3 3 ALA N N 15 125.784 0.125 . 1 . . 62 . . 3 ALA N . 19164 1 33 . 1 1 4 4 GLY H H 1 8.490 0.043 . 1 . . 9 . . 4 GLY H . 19164 1 34 . 1 1 4 4 GLY HA2 H 1 4.001 0.043 . 1 . . 1738 . . 4 GLY HA2 . 19164 1 35 . 1 1 4 4 GLY HA3 H 1 4.001 0.043 . 1 . . 190 . . 4 GLY HA3 . 19164 1 36 . 1 1 4 4 GLY C C 13 174.587 0.313 . 1 . . 1548 . . 4 GLY C . 19164 1 37 . 1 1 4 4 GLY CA C 13 45.137 0.313 . 1 . . 315 . . 4 GLY CA . 19164 1 38 . 1 1 4 4 GLY N N 15 108.365 0.125 . 1 . . 10 . . 4 GLY N . 19164 1 39 . 1 1 5 5 GLY H H 1 8.277 0.043 . 1 . . 7 . . 5 GLY H . 19164 1 40 . 1 1 5 5 GLY HA2 H 1 3.988 0.043 . 1 . . 1739 . . 5 GLY HA2 . 19164 1 41 . 1 1 5 5 GLY HA3 H 1 3.988 0.043 . 1 . . 189 . . 5 GLY HA3 . 19164 1 42 . 1 1 5 5 GLY C C 13 173.691 0.313 . 1 . . 1549 . . 5 GLY C . 19164 1 43 . 1 1 5 5 GLY CA C 13 44.754 0.313 . 1 . . 437 . . 5 GLY CA . 19164 1 44 . 1 1 5 5 GLY N N 15 108.403 0.125 . 1 . . 8 . . 5 GLY N . 19164 1 45 . 1 1 6 6 ARG H H 1 8.285 0.043 . 1 . . 277 . . 6 ARG H . 19164 1 46 . 1 1 6 6 ARG HA H 1 4.686 0.043 . 1 . . 439 . . 6 ARG HA . 19164 1 47 . 1 1 6 6 ARG HB2 H 1 1.893 0.043 . 1 . . 766 . . 6 ARG HB2 . 19164 1 48 . 1 1 6 6 ARG HB3 H 1 1.780 0.043 . 1 . . 438 . . 6 ARG HB3 . 19164 1 49 . 1 1 6 6 ARG HG2 H 1 1.706 0.043 . 1 . . 1741 . . 6 ARG HG2 . 19164 1 50 . 1 1 6 6 ARG HG3 H 1 1.706 0.043 . 1 . . 767 . . 6 ARG HG3 . 19164 1 51 . 1 1 6 6 ARG HD2 H 1 3.245 0.043 . 1 . . 1740 . . 6 ARG HD2 . 19164 1 52 . 1 1 6 6 ARG HD3 H 1 3.245 0.043 . 1 . . 765 . . 6 ARG HD3 . 19164 1 53 . 1 1 6 6 ARG CA C 13 53.808 0.313 . 1 . . 280 . . 6 ARG CA . 19164 1 54 . 1 1 6 6 ARG CB C 13 29.975 0.313 . 1 . . 279 . . 6 ARG CB . 19164 1 55 . 1 1 6 6 ARG CG C 13 26.706 0.313 . 1 . . 768 . . 6 ARG CG . 19164 1 56 . 1 1 6 6 ARG CD C 13 43.242 0.313 . 1 . . 769 . . 6 ARG CD . 19164 1 57 . 1 1 6 6 ARG N N 15 121.465 0.125 . 1 . . 278 . . 6 ARG N . 19164 1 58 . 1 1 7 7 PRO HA H 1 4.500 0.043 . 1 . . 786 . . 7 PRO HA . 19164 1 59 . 1 1 7 7 PRO HB2 H 1 2.356 0.043 . 1 . . 788 . . 7 PRO HB2 . 19164 1 60 . 1 1 7 7 PRO HB3 H 1 1.985 0.043 . 1 . . 787 . . 7 PRO HB3 . 19164 1 61 . 1 1 7 7 PRO HG2 H 1 2.096 0.043 . 1 . . 790 . . 7 PRO HG2 . 19164 1 62 . 1 1 7 7 PRO HG3 H 1 2.057 0.043 . 1 . . 789 . . 7 PRO HG3 . 19164 1 63 . 1 1 7 7 PRO HD2 H 1 3.872 0.043 . 1 . . 792 . . 7 PRO HD2 . 19164 1 64 . 1 1 7 7 PRO HD3 H 1 3.694 0.043 . 1 . . 791 . . 7 PRO HD3 . 19164 1 65 . 1 1 7 7 PRO C C 13 177.530 0.313 . 1 . . 1550 . . 7 PRO C . 19164 1 66 . 1 1 7 7 PRO CA C 13 63.140 0.313 . 1 . . 785 . . 7 PRO CA . 19164 1 67 . 1 1 7 7 PRO CB C 13 31.931 0.313 . 1 . . 793 . . 7 PRO CB . 19164 1 68 . 1 1 7 7 PRO CG C 13 27.085 0.313 . 1 . . 794 . . 7 PRO CG . 19164 1 69 . 1 1 7 7 PRO CD C 13 50.455 0.313 . 1 . . 795 . . 7 PRO CD . 19164 1 70 . 1 1 8 8 GLY H H 1 8.671 0.043 . 1 . . 3 . . 8 GLY H . 19164 1 71 . 1 1 8 8 GLY HA2 H 1 3.991 0.043 . 1 . . 1742 . . 8 GLY HA2 . 19164 1 72 . 1 1 8 8 GLY HA3 H 1 3.991 0.043 . 1 . . 188 . . 8 GLY HA3 . 19164 1 73 . 1 1 8 8 GLY C C 13 173.772 0.313 . 1 . . 1551 . . 8 GLY C . 19164 1 74 . 1 1 8 8 GLY CA C 13 45.176 0.313 . 1 . . 411 . . 8 GLY CA . 19164 1 75 . 1 1 8 8 GLY N N 15 109.714 0.125 . 1 . . 4 . . 8 GLY N . 19164 1 76 . 1 1 9 9 ALA H H 1 8.210 0.043 . 1 . . 29 . . 9 ALA H . 19164 1 77 . 1 1 9 9 ALA HA H 1 4.449 0.043 . 1 . . 154 . . 9 ALA HA . 19164 1 78 . 1 1 9 9 ALA HB1 H 1 1.438 0.043 . 1 . . 153 . . 9 ALA HB1 . 19164 1 79 . 1 1 9 9 ALA HB2 H 1 1.438 0.043 . 1 . . 153 . . 9 ALA HB2 . 19164 1 80 . 1 1 9 9 ALA HB3 H 1 1.438 0.043 . 1 . . 153 . . 9 ALA HB3 . 19164 1 81 . 1 1 9 9 ALA C C 13 176.878 0.313 . 1 . . 1552 . . 9 ALA C . 19164 1 82 . 1 1 9 9 ALA CA C 13 51.826 0.313 . 1 . . 415 . . 9 ALA CA . 19164 1 83 . 1 1 9 9 ALA CB C 13 19.093 0.313 . 1 . . 414 . . 9 ALA CB . 19164 1 84 . 1 1 9 9 ALA N N 15 123.980 0.125 . 1 . . 30 . . 9 ALA N . 19164 1 85 . 1 1 10 10 ASP H H 1 8.269 0.043 . 1 . . 115 . . 10 ASP H . 19164 1 86 . 1 1 10 10 ASP HA H 1 4.672 0.043 . 1 . . 314 . . 10 ASP HA . 19164 1 87 . 1 1 10 10 ASP HB2 H 1 2.774 0.043 . 1 . . 580 . . 10 ASP HB2 . 19164 1 88 . 1 1 10 10 ASP HB3 H 1 2.645 0.043 . 1 . . 581 . . 10 ASP HB3 . 19164 1 89 . 1 1 10 10 ASP CA C 13 54.404 0.313 . 1 . . 241 . . 10 ASP CA . 19164 1 90 . 1 1 10 10 ASP CB C 13 41.337 0.313 . 1 . . 242 . . 10 ASP CB . 19164 1 91 . 1 1 10 10 ASP N N 15 119.649 0.125 . 1 . . 116 . . 10 ASP N . 19164 1 92 . 1 1 11 11 CYS HA H 1 4.593 0.043 . 1 . . 995 . . 11 CYS HA . 19164 1 93 . 1 1 11 11 CYS HB2 H 1 3.214 0.043 . 1 . . 1743 . . 11 CYS HB2 . 19164 1 94 . 1 1 11 11 CYS HB3 H 1 3.214 0.043 . 1 . . 993 . . 11 CYS HB3 . 19164 1 95 . 1 1 11 11 CYS CA C 13 54.556 0.313 . 1 . . 996 . . 11 CYS CA . 19164 1 96 . 1 1 11 11 CYS CB C 13 40.218 0.313 . 1 . . 994 . . 11 CYS CB . 19164 1 97 . 1 1 12 12 GLU HA H 1 3.975 0.043 . 1 . . 974 . . 12 GLU HA . 19164 1 98 . 1 1 12 12 GLU HB2 H 1 2.494 0.043 . 1 . . 957 . . 12 GLU HB2 . 19164 1 99 . 1 1 12 12 GLU HB3 H 1 2.223 0.043 . 1 . . 956 . . 12 GLU HB3 . 19164 1 100 . 1 1 12 12 GLU HG2 H 1 2.462 0.043 . 1 . . 958 . . 12 GLU HG2 . 19164 1 101 . 1 1 12 12 GLU HG3 H 1 2.337 0.043 . 1 . . 952 . . 12 GLU HG3 . 19164 1 102 . 1 1 12 12 GLU CA C 13 61.279 0.313 . 1 . . 955 . . 12 GLU CA . 19164 1 103 . 1 1 12 12 GLU CB C 13 31.121 0.313 . 1 . . 959 . . 12 GLU CB . 19164 1 104 . 1 1 12 12 GLU CG C 13 36.735 0.313 . 1 . . 1519 . . 12 GLU CG . 19164 1 105 . 1 1 13 13 VAL H H 1 7.046 0.043 . 1 . . 1509 . . 13 VAL H . 19164 1 106 . 1 1 13 13 VAL HA H 1 3.756 0.043 . 1 . . 1511 . . 13 VAL HA . 19164 1 107 . 1 1 13 13 VAL HB H 1 1.693 0.043 . 1 . . 1513 . . 13 VAL HB . 19164 1 108 . 1 1 13 13 VAL HG11 H 1 0.715 0.043 . 1 . . 1514 . . 13 VAL HG11 . 19164 1 109 . 1 1 13 13 VAL HG12 H 1 0.715 0.043 . 1 . . 1514 . . 13 VAL HG12 . 19164 1 110 . 1 1 13 13 VAL HG13 H 1 0.715 0.043 . 1 . . 1514 . . 13 VAL HG13 . 19164 1 111 . 1 1 13 13 VAL HG21 H 1 -0.058 0.043 . 1 . . 1512 . . 13 VAL HG21 . 19164 1 112 . 1 1 13 13 VAL HG22 H 1 -0.058 0.043 . 1 . . 1512 . . 13 VAL HG22 . 19164 1 113 . 1 1 13 13 VAL HG23 H 1 -0.058 0.043 . 1 . . 1512 . . 13 VAL HG23 . 19164 1 114 . 1 1 13 13 VAL CA C 13 64.968 0.313 . 1 . . 1515 . . 13 VAL CA . 19164 1 115 . 1 1 13 13 VAL CB C 13 31.059 0.313 . 1 . . 1516 . . 13 VAL CB . 19164 1 116 . 1 1 13 13 VAL CG1 C 13 20.419 0.313 . 1 . . 1517 . . 13 VAL CG1 . 19164 1 117 . 1 1 13 13 VAL CG2 C 13 21.011 0.313 . 1 . . 1518 . . 13 VAL CG2 . 19164 1 118 . 1 1 13 13 VAL N N 15 117.280 0.125 . 1 . . 1510 . . 13 VAL N . 19164 1 119 . 1 1 14 14 CYS HA H 1 4.094 0.043 . 1 . . 944 . . 14 CYS HA . 19164 1 120 . 1 1 14 14 CYS HB2 H 1 3.238 0.043 . 1 . . 946 . . 14 CYS HB2 . 19164 1 121 . 1 1 14 14 CYS HB3 H 1 2.907 0.043 . 1 . . 947 . . 14 CYS HB3 . 19164 1 122 . 1 1 14 14 CYS CA C 13 61.445 0.313 . 1 . . 945 . . 14 CYS CA . 19164 1 123 . 1 1 14 14 CYS CB C 13 41.017 0.313 . 1 . . 948 . . 14 CYS CB . 19164 1 124 . 1 1 15 15 LYS HA H 1 4.062 0.043 . 1 . . 982 . . 15 LYS HA . 19164 1 125 . 1 1 15 15 LYS HB2 H 1 1.962 0.043 . 1 . . 986 . . 15 LYS HB2 . 19164 1 126 . 1 1 15 15 LYS HB3 H 1 1.914 0.043 . 1 . . 985 . . 15 LYS HB3 . 19164 1 127 . 1 1 15 15 LYS HG2 H 1 1.517 0.043 . 1 . . 1508 . . 15 LYS HG2 . 19164 1 128 . 1 1 15 15 LYS HG3 H 1 1.662 0.043 . 1 . . 989 . . 15 LYS HG3 . 19164 1 129 . 1 1 15 15 LYS HD2 H 1 1.743 0.043 . 1 . . 1744 . . 15 LYS HD2 . 19164 1 130 . 1 1 15 15 LYS HD3 H 1 1.743 0.043 . 1 . . 988 . . 15 LYS HD3 . 19164 1 131 . 1 1 15 15 LYS HE2 H 1 3.053 0.043 . 1 . . 1745 . . 15 LYS HE2 . 19164 1 132 . 1 1 15 15 LYS HE3 H 1 3.053 0.043 . 1 . . 984 . . 15 LYS HE3 . 19164 1 133 . 1 1 15 15 LYS CA C 13 57.405 0.313 . 1 . . 983 . . 15 LYS CA . 19164 1 134 . 1 1 15 15 LYS CB C 13 32.162 0.313 . 1 . . 987 . . 15 LYS CB . 19164 1 135 . 1 1 15 15 LYS CG C 13 25.104 0.313 . 1 . . 991 . . 15 LYS CG . 19164 1 136 . 1 1 15 15 LYS CD C 13 28.898 0.313 . 1 . . 990 . . 15 LYS CD . 19164 1 137 . 1 1 15 15 LYS CE C 13 42.131 0.313 . 1 . . 992 . . 15 LYS CE . 19164 1 138 . 1 1 16 16 GLU HA H 1 4.341 0.043 . 1 . . 807 . . 16 GLU HA . 19164 1 139 . 1 1 16 16 GLU HB2 H 1 2.568 0.043 . 1 . . 1746 . . 16 GLU HB2 . 19164 1 140 . 1 1 16 16 GLU HB3 H 1 2.568 0.043 . 1 . . 808 . . 16 GLU HB3 . 19164 1 141 . 1 1 16 16 GLU HG2 H 1 2.705 0.043 . 1 . . 812 . . 16 GLU HG2 . 19164 1 142 . 1 1 16 16 GLU HG3 H 1 2.564 0.043 . 1 . . 809 . . 16 GLU HG3 . 19164 1 143 . 1 1 16 16 GLU C C 13 179.607 0.313 . 1 . . 1553 . . 16 GLU C . 19164 1 144 . 1 1 16 16 GLU CA C 13 59.100 0.313 . 1 . . 806 . . 16 GLU CA . 19164 1 145 . 1 1 16 16 GLU CB C 13 29.258 0.313 . 1 . . 810 . . 16 GLU CB . 19164 1 146 . 1 1 16 16 GLU CG C 13 35.794 0.313 . 1 . . 811 . . 16 GLU CG . 19164 1 147 . 1 1 17 17 PHE H H 1 9.121 0.043 . 1 . . 24 . . 17 PHE H . 19164 1 148 . 1 1 17 17 PHE HA H 1 4.323 0.043 . 1 . . 319 . . 17 PHE HA . 19164 1 149 . 1 1 17 17 PHE HB2 H 1 3.258 0.043 . 1 . . 505 . . 17 PHE HB2 . 19164 1 150 . 1 1 17 17 PHE HB3 H 1 3.087 0.043 . 1 . . 506 . . 17 PHE HB3 . 19164 1 151 . 1 1 17 17 PHE HD1 H 1 7.064 0.043 . 3 . . 932 . . 17 PHE HD1 . 19164 1 152 . 1 1 17 17 PHE HD2 H 1 7.064 0.043 . 3 . . 933 . . 17 PHE HD2 . 19164 1 153 . 1 1 17 17 PHE HE1 H 1 7.046 0.043 . 3 . . 936 . . 17 PHE HE1 . 19164 1 154 . 1 1 17 17 PHE HE2 H 1 7.046 0.043 . 3 . . 937 . . 17 PHE HE2 . 19164 1 155 . 1 1 17 17 PHE C C 13 177.438 0.313 . 1 . . 1554 . . 17 PHE C . 19164 1 156 . 1 1 17 17 PHE CA C 13 62.397 0.313 . 1 . . 161 . . 17 PHE CA . 19164 1 157 . 1 1 17 17 PHE CB C 13 40.343 0.313 . 1 . . 160 . . 17 PHE CB . 19164 1 158 . 1 1 17 17 PHE CD1 C 13 131.254 0.313 . 3 . . 934 . . 17 PHE CD1 . 19164 1 159 . 1 1 17 17 PHE CD2 C 13 131.254 0.313 . 3 . . 935 . . 17 PHE CD2 . 19164 1 160 . 1 1 17 17 PHE CE1 C 13 131.170 0.313 . 3 . . 1721 . . 17 PHE CE1 . 19164 1 161 . 1 1 17 17 PHE CE2 C 13 131.170 0.313 . 3 . . 1722 . . 17 PHE CE2 . 19164 1 162 . 1 1 17 17 PHE N N 15 120.772 0.125 . 1 . . 25 . . 17 PHE N . 19164 1 163 . 1 1 18 18 LEU H H 1 8.511 0.043 . 1 . . 119 . . 18 LEU H . 19164 1 164 . 1 1 18 18 LEU HA H 1 4.150 0.043 . 1 . . 283 . . 18 LEU HA . 19164 1 165 . 1 1 18 18 LEU HB2 H 1 2.197 0.043 . 1 . . 582 . . 18 LEU HB2 . 19164 1 166 . 1 1 18 18 LEU HB3 H 1 1.270 0.043 . 1 . . 677 . . 18 LEU HB3 . 19164 1 167 . 1 1 18 18 LEU HG H 1 2.304 0.043 . 1 . . 680 . . 18 LEU HG . 19164 1 168 . 1 1 18 18 LEU HD11 H 1 1.041 0.043 . 1 . . 678 . . 18 LEU HD11 . 19164 1 169 . 1 1 18 18 LEU HD12 H 1 1.041 0.043 . 1 . . 678 . . 18 LEU HD12 . 19164 1 170 . 1 1 18 18 LEU HD13 H 1 1.041 0.043 . 1 . . 678 . . 18 LEU HD13 . 19164 1 171 . 1 1 18 18 LEU HD21 H 1 0.917 0.043 . 1 . . 679 . . 18 LEU HD21 . 19164 1 172 . 1 1 18 18 LEU HD22 H 1 0.917 0.043 . 1 . . 679 . . 18 LEU HD22 . 19164 1 173 . 1 1 18 18 LEU HD23 H 1 0.917 0.043 . 1 . . 679 . . 18 LEU HD23 . 19164 1 174 . 1 1 18 18 LEU C C 13 179.515 0.313 . 1 . . 1555 . . 18 LEU C . 19164 1 175 . 1 1 18 18 LEU CA C 13 57.824 0.313 . 1 . . 214 . . 18 LEU CA . 19164 1 176 . 1 1 18 18 LEU CB C 13 40.872 0.313 . 1 . . 215 . . 18 LEU CB . 19164 1 177 . 1 1 18 18 LEU CG C 13 27.273 0.313 . 1 . . 681 . . 18 LEU CG . 19164 1 178 . 1 1 18 18 LEU CD1 C 13 26.736 0.313 . 1 . . 682 . . 18 LEU CD1 . 19164 1 179 . 1 1 18 18 LEU CD2 C 13 21.788 0.313 . 1 . . 683 . . 18 LEU CD2 . 19164 1 180 . 1 1 18 18 LEU N N 15 115.833 0.125 . 1 . . 120 . . 18 LEU N . 19164 1 181 . 1 1 19 19 ASN H H 1 8.405 0.043 . 1 . . 39 . . 19 ASN H . 19164 1 182 . 1 1 19 19 ASN HA H 1 4.884 0.043 . 1 . . 512 . . 19 ASN HA . 19164 1 183 . 1 1 19 19 ASN HB2 H 1 3.127 0.043 . 1 . . 513 . . 19 ASN HB2 . 19164 1 184 . 1 1 19 19 ASN HB3 H 1 2.886 0.043 . 1 . . 323 . . 19 ASN HB3 . 19164 1 185 . 1 1 19 19 ASN HD21 H 1 7.691 0.043 . 1 . . 857 . . 19 ASN HD21 . 19164 1 186 . 1 1 19 19 ASN HD22 H 1 7.045 0.043 . 1 . . 856 . . 19 ASN HD22 . 19164 1 187 . 1 1 19 19 ASN C C 13 177.917 0.313 . 1 . . 1556 . . 19 ASN C . 19164 1 188 . 1 1 19 19 ASN CA C 13 56.475 0.313 . 1 . . 51 . . 19 ASN CA . 19164 1 189 . 1 1 19 19 ASN CB C 13 38.250 0.313 . 1 . . 157 . . 19 ASN CB . 19164 1 190 . 1 1 19 19 ASN N N 15 117.708 0.125 . 1 . . 40 . . 19 ASN N . 19164 1 191 . 1 1 19 19 ASN ND2 N 15 112.543 0.125 . 1 . . 855 . . 19 ASN ND2 . 19164 1 192 . 1 1 20 20 ARG H H 1 8.312 0.043 . 1 . . 91 . . 20 ARG H . 19164 1 193 . 1 1 20 20 ARG HA H 1 4.127 0.043 . 1 . . 265 . . 20 ARG HA . 19164 1 194 . 1 1 20 20 ARG HB2 H 1 2.140 0.043 . 1 . . 1747 . . 20 ARG HB2 . 19164 1 195 . 1 1 20 20 ARG HB3 H 1 2.140 0.043 . 1 . . 531 . . 20 ARG HB3 . 19164 1 196 . 1 1 20 20 ARG HG2 H 1 2.009 0.043 . 1 . . 576 . . 20 ARG HG2 . 19164 1 197 . 1 1 20 20 ARG HG3 H 1 1.805 0.043 . 1 . . 532 . . 20 ARG HG3 . 19164 1 198 . 1 1 20 20 ARG HD2 H 1 3.500 0.043 . 1 . . 578 . . 20 ARG HD2 . 19164 1 199 . 1 1 20 20 ARG HD3 H 1 3.448 0.043 . 1 . . 577 . . 20 ARG HD3 . 19164 1 200 . 1 1 20 20 ARG HE H 1 7.557 0.043 . 1 . . 864 . . 20 ARG HE . 19164 1 201 . 1 1 20 20 ARG C C 13 179.006 0.313 . 1 . . 1557 . . 20 ARG C . 19164 1 202 . 1 1 20 20 ARG CA C 13 60.183 0.313 . 1 . . 179 . . 20 ARG CA . 19164 1 203 . 1 1 20 20 ARG CB C 13 30.179 0.313 . 1 . . 180 . . 20 ARG CB . 19164 1 204 . 1 1 20 20 ARG CG C 13 29.204 0.313 . 1 . . 533 . . 20 ARG CG . 19164 1 205 . 1 1 20 20 ARG CD C 13 43.489 0.313 . 1 . . 579 . . 20 ARG CD . 19164 1 206 . 1 1 20 20 ARG N N 15 122.847 0.125 . 1 . . 92 . . 20 ARG N . 19164 1 207 . 1 1 20 20 ARG NE N 15 83.343 0.125 . 1 . . 865 . . 20 ARG NE . 19164 1 208 . 1 1 21 21 PHE H H 1 8.439 0.043 . 1 . . 109 . . 21 PHE H . 19164 1 209 . 1 1 21 21 PHE HA H 1 3.286 0.043 . 1 . . 609 . . 21 PHE HA . 19164 1 210 . 1 1 21 21 PHE HB2 H 1 2.632 0.043 . 1 . . 339 . . 21 PHE HB2 . 19164 1 211 . 1 1 21 21 PHE HB3 H 1 2.263 0.043 . 1 . . 684 . . 21 PHE HB3 . 19164 1 212 . 1 1 21 21 PHE HD1 H 1 6.181 0.043 . 3 . . 916 . . 21 PHE HD1 . 19164 1 213 . 1 1 21 21 PHE HD2 H 1 6.181 0.043 . 3 . . 917 . . 21 PHE HD2 . 19164 1 214 . 1 1 21 21 PHE HE1 H 1 6.883 0.043 . 3 . . 920 . . 21 PHE HE1 . 19164 1 215 . 1 1 21 21 PHE HE2 H 1 6.883 0.043 . 3 . . 921 . . 21 PHE HE2 . 19164 1 216 . 1 1 21 21 PHE HZ H 1 7.155 0.043 . 1 . . 930 . . 21 PHE HZ . 19164 1 217 . 1 1 21 21 PHE C C 13 176.858 0.313 . 1 . . 1558 . . 21 PHE C . 19164 1 218 . 1 1 21 21 PHE CA C 13 58.946 0.313 . 1 . . 238 . . 21 PHE CA . 19164 1 219 . 1 1 21 21 PHE CB C 13 37.905 0.313 . 1 . . 276 . . 21 PHE CB . 19164 1 220 . 1 1 21 21 PHE CD1 C 13 131.237 0.313 . 3 . . 918 . . 21 PHE CD1 . 19164 1 221 . 1 1 21 21 PHE CD2 C 13 131.237 0.313 . 3 . . 919 . . 21 PHE CD2 . 19164 1 222 . 1 1 21 21 PHE CE1 C 13 130.785 0.313 . 3 . . 1730 . . 21 PHE CE1 . 19164 1 223 . 1 1 21 21 PHE CE2 C 13 130.785 0.313 . 3 . . 1731 . . 21 PHE CE2 . 19164 1 224 . 1 1 21 21 PHE CZ C 13 129.095 0.313 . 1 . . 931 . . 21 PHE CZ . 19164 1 225 . 1 1 21 21 PHE N N 15 121.792 0.125 . 1 . . 110 . . 21 PHE N . 19164 1 226 . 1 1 22 22 TYR H H 1 8.707 0.043 . 1 . . 99 . . 22 TYR H . 19164 1 227 . 1 1 22 22 TYR HA H 1 3.797 0.043 . 1 . . 336 . . 22 TYR HA . 19164 1 228 . 1 1 22 22 TYR HB2 H 1 3.283 0.043 . 1 . . 597 . . 22 TYR HB2 . 19164 1 229 . 1 1 22 22 TYR HB3 H 1 3.095 0.043 . 1 . . 598 . . 22 TYR HB3 . 19164 1 230 . 1 1 22 22 TYR HD1 H 1 7.159 0.043 . 3 . . 898 . . 22 TYR HD1 . 19164 1 231 . 1 1 22 22 TYR HD2 H 1 7.159 0.043 . 3 . . 899 . . 22 TYR HD2 . 19164 1 232 . 1 1 22 22 TYR HE1 H 1 6.900 0.043 . 3 . . 902 . . 22 TYR HE1 . 19164 1 233 . 1 1 22 22 TYR HE2 H 1 6.900 0.043 . 3 . . 903 . . 22 TYR HE2 . 19164 1 234 . 1 1 22 22 TYR C C 13 177.438 0.313 . 1 . . 1559 . . 22 TYR C . 19164 1 235 . 1 1 22 22 TYR CA C 13 61.546 0.313 . 1 . . 185 . . 22 TYR CA . 19164 1 236 . 1 1 22 22 TYR CB C 13 38.162 0.313 . 1 . . 270 . . 22 TYR CB . 19164 1 237 . 1 1 22 22 TYR CD1 C 13 132.242 0.313 . 3 . . 900 . . 22 TYR CD1 . 19164 1 238 . 1 1 22 22 TYR CD2 C 13 132.242 0.313 . 3 . . 901 . . 22 TYR CD2 . 19164 1 239 . 1 1 22 22 TYR CE1 C 13 118.049 0.313 . 3 . . 1718 . . 22 TYR CE1 . 19164 1 240 . 1 1 22 22 TYR CE2 C 13 118.049 0.313 . 3 . . 1719 . . 22 TYR CE2 . 19164 1 241 . 1 1 22 22 TYR N N 15 120.028 0.125 . 1 . . 100 . . 22 TYR N . 19164 1 242 . 1 1 23 23 LYS H H 1 7.938 0.043 . 1 . . 63 . . 23 LYS H . 19164 1 243 . 1 1 23 23 LYS HA H 1 3.863 0.043 . 1 . . 225 . . 23 LYS HA . 19164 1 244 . 1 1 23 23 LYS HB2 H 1 1.931 0.043 . 1 . . 1748 . . 23 LYS HB2 . 19164 1 245 . 1 1 23 23 LYS HB3 H 1 1.931 0.043 . 1 . . 491 . . 23 LYS HB3 . 19164 1 246 . 1 1 23 23 LYS HG2 H 1 1.584 0.043 . 1 . . 494 . . 23 LYS HG2 . 19164 1 247 . 1 1 23 23 LYS HG3 H 1 1.482 0.043 . 1 . . 492 . . 23 LYS HG3 . 19164 1 248 . 1 1 23 23 LYS HD2 H 1 1.768 0.043 . 1 . . 516 . . 23 LYS HD2 . 19164 1 249 . 1 1 23 23 LYS HD3 H 1 1.669 0.043 . 1 . . 536 . . 23 LYS HD3 . 19164 1 250 . 1 1 23 23 LYS HE2 H 1 3.005 0.043 . 1 . . 1749 . . 23 LYS HE2 . 19164 1 251 . 1 1 23 23 LYS HE3 H 1 3.005 0.043 . 1 . . 537 . . 23 LYS HE3 . 19164 1 252 . 1 1 23 23 LYS C C 13 177.550 0.313 . 1 . . 1560 . . 23 LYS C . 19164 1 253 . 1 1 23 23 LYS CA C 13 59.043 0.313 . 1 . . 327 . . 23 LYS CA . 19164 1 254 . 1 1 23 23 LYS CB C 13 31.940 0.313 . 1 . . 165 . . 23 LYS CB . 19164 1 255 . 1 1 23 23 LYS CG C 13 25.142 0.313 . 1 . . 493 . . 23 LYS CG . 19164 1 256 . 1 1 23 23 LYS CD C 13 29.020 0.313 . 1 . . 538 . . 23 LYS CD . 19164 1 257 . 1 1 23 23 LYS CE C 13 42.093 0.313 . 1 . . 490 . . 23 LYS CE . 19164 1 258 . 1 1 23 23 LYS N N 15 116.431 0.125 . 1 . . 64 . . 23 LYS N . 19164 1 259 . 1 1 24 24 SER H H 1 7.661 0.043 . 1 . . 149 . . 24 SER H . 19164 1 260 . 1 1 24 24 SER HA H 1 4.333 0.043 . 1 . . 360 . . 24 SER HA . 19164 1 261 . 1 1 24 24 SER HB2 H 1 4.053 0.043 . 1 . . 361 . . 24 SER HB2 . 19164 1 262 . 1 1 24 24 SER HB3 H 1 4.016 0.043 . 1 . . 558 . . 24 SER HB3 . 19164 1 263 . 1 1 24 24 SER C C 13 176.807 0.313 . 1 . . 1561 . . 24 SER C . 19164 1 264 . 1 1 24 24 SER CA C 13 61.027 0.313 . 1 . . 258 . . 24 SER CA . 19164 1 265 . 1 1 24 24 SER CB C 13 62.589 0.313 . 1 . . 257 . . 24 SER CB . 19164 1 266 . 1 1 24 24 SER N N 15 113.941 0.125 . 1 . . 150 . . 24 SER N . 19164 1 267 . 1 1 25 25 LEU H H 1 7.566 0.043 . 1 . . 230 . . 25 LEU H . 19164 1 268 . 1 1 25 25 LEU HA H 1 3.687 0.043 . 1 . . 685 . . 25 LEU HA . 19164 1 269 . 1 1 25 25 LEU HB2 H 1 1.864 0.043 . 1 . . 686 . . 25 LEU HB2 . 19164 1 270 . 1 1 25 25 LEU HB3 H 1 0.898 0.043 . 1 . . 693 . . 25 LEU HB3 . 19164 1 271 . 1 1 25 25 LEU HG H 1 0.847 0.043 . 1 . . 689 . . 25 LEU HG . 19164 1 272 . 1 1 25 25 LEU HD11 H 1 0.224 0.043 . 1 . . 687 . . 25 LEU HD11 . 19164 1 273 . 1 1 25 25 LEU HD12 H 1 0.224 0.043 . 1 . . 687 . . 25 LEU HD12 . 19164 1 274 . 1 1 25 25 LEU HD13 H 1 0.224 0.043 . 1 . . 687 . . 25 LEU HD13 . 19164 1 275 . 1 1 25 25 LEU HD21 H 1 -0.186 0.043 . 1 . . 688 . . 25 LEU HD21 . 19164 1 276 . 1 1 25 25 LEU HD22 H 1 -0.186 0.043 . 1 . . 688 . . 25 LEU HD22 . 19164 1 277 . 1 1 25 25 LEU HD23 H 1 -0.186 0.043 . 1 . . 688 . . 25 LEU HD23 . 19164 1 278 . 1 1 25 25 LEU C C 13 179.821 0.313 . 1 . . 1562 . . 25 LEU C . 19164 1 279 . 1 1 25 25 LEU CA C 13 57.369 0.313 . 1 . . 376 . . 25 LEU CA . 19164 1 280 . 1 1 25 25 LEU CB C 13 41.781 0.313 . 1 . . 375 . . 25 LEU CB . 19164 1 281 . 1 1 25 25 LEU CG C 13 25.389 0.313 . 1 . . 692 . . 25 LEU CG . 19164 1 282 . 1 1 25 25 LEU CD1 C 13 21.749 0.313 . 1 . . 691 . . 25 LEU CD1 . 19164 1 283 . 1 1 25 25 LEU CD2 C 13 25.482 0.313 . 1 . . 690 . . 25 LEU CD2 . 19164 1 284 . 1 1 25 25 LEU N N 15 119.734 0.125 . 1 . . 231 . . 25 LEU N . 19164 1 285 . 1 1 26 26 ILE H H 1 8.086 0.043 . 1 . . 131 . . 26 ILE H . 19164 1 286 . 1 1 26 26 ILE HA H 1 3.862 0.043 . 1 . . 352 . . 26 ILE HA . 19164 1 287 . 1 1 26 26 ILE HB H 1 1.973 0.043 . 1 . . 694 . . 26 ILE HB . 19164 1 288 . 1 1 26 26 ILE HG12 H 1 1.584 0.043 . 1 . . 583 . . 26 ILE HG12 . 19164 1 289 . 1 1 26 26 ILE HG13 H 1 1.202 0.043 . 1 . . 696 . . 26 ILE HG13 . 19164 1 290 . 1 1 26 26 ILE HG21 H 1 0.931 0.043 . 1 . . 584 . . 26 ILE HG21 . 19164 1 291 . 1 1 26 26 ILE HG22 H 1 0.931 0.043 . 1 . . 584 . . 26 ILE HG22 . 19164 1 292 . 1 1 26 26 ILE HG23 H 1 0.931 0.043 . 1 . . 584 . . 26 ILE HG23 . 19164 1 293 . 1 1 26 26 ILE HD11 H 1 0.727 0.043 . 1 . . 695 . . 26 ILE HD11 . 19164 1 294 . 1 1 26 26 ILE HD12 H 1 0.727 0.043 . 1 . . 695 . . 26 ILE HD12 . 19164 1 295 . 1 1 26 26 ILE HD13 H 1 0.727 0.043 . 1 . . 695 . . 26 ILE HD13 . 19164 1 296 . 1 1 26 26 ILE C C 13 180.737 0.313 . 1 . . 1563 . . 26 ILE C . 19164 1 297 . 1 1 26 26 ILE CA C 13 63.364 0.313 . 1 . . 351 . . 26 ILE CA . 19164 1 298 . 1 1 26 26 ILE CB C 13 37.197 0.313 . 1 . . 350 . . 26 ILE CB . 19164 1 299 . 1 1 26 26 ILE CG1 C 13 28.042 0.313 . 1 . . 697 . . 26 ILE CG1 . 19164 1 300 . 1 1 26 26 ILE CG2 C 13 16.891 0.313 . 1 . . 698 . . 26 ILE CG2 . 19164 1 301 . 1 1 26 26 ILE CD1 C 13 11.543 0.313 . 1 . . 699 . . 26 ILE CD1 . 19164 1 302 . 1 1 26 26 ILE N N 15 119.672 0.125 . 1 . . 132 . . 26 ILE N . 19164 1 303 . 1 1 27 27 ASP H H 1 9.082 0.043 . 1 . . 37 . . 27 ASP H . 19164 1 304 . 1 1 27 27 ASP HA H 1 4.385 0.043 . 1 . . 155 . . 27 ASP HA . 19164 1 305 . 1 1 27 27 ASP HB2 H 1 2.858 0.043 . 1 . . 156 . . 27 ASP HB2 . 19164 1 306 . 1 1 27 27 ASP HB3 H 1 2.663 0.043 . 1 . . 511 . . 27 ASP HB3 . 19164 1 307 . 1 1 27 27 ASP C C 13 178.660 0.313 . 1 . . 1564 . . 27 ASP C . 19164 1 308 . 1 1 27 27 ASP CA C 13 57.197 0.313 . 1 . . 408 . . 27 ASP CA . 19164 1 309 . 1 1 27 27 ASP CB C 13 39.980 0.313 . 1 . . 407 . . 27 ASP CB . 19164 1 310 . 1 1 27 27 ASP N N 15 122.442 0.125 . 1 . . 38 . . 27 ASP N . 19164 1 311 . 1 1 28 28 ARG H H 1 7.584 0.043 . 1 . . 151 . . 28 ARG H . 19164 1 312 . 1 1 28 28 ARG HA H 1 4.313 0.043 . 1 . . 290 . . 28 ARG HA . 19164 1 313 . 1 1 28 28 ARG HB2 H 1 2.010 0.043 . 1 . . 362 . . 28 ARG HB2 . 19164 1 314 . 1 1 28 28 ARG HB3 H 1 1.769 0.043 . 1 . . 559 . . 28 ARG HB3 . 19164 1 315 . 1 1 28 28 ARG HG2 H 1 1.966 0.043 . 1 . . 1750 . . 28 ARG HG2 . 19164 1 316 . 1 1 28 28 ARG HG3 H 1 1.966 0.043 . 1 . . 868 . . 28 ARG HG3 . 19164 1 317 . 1 1 28 28 ARG HD2 H 1 3.295 0.043 . 1 . . 870 . . 28 ARG HD2 . 19164 1 318 . 1 1 28 28 ARG HD3 H 1 3.238 0.043 . 1 . . 869 . . 28 ARG HD3 . 19164 1 319 . 1 1 28 28 ARG HE H 1 6.626 0.043 . 1 . . 873 . . 28 ARG HE . 19164 1 320 . 1 1 28 28 ARG C C 13 177.061 0.313 . 1 . . 1565 . . 28 ARG C . 19164 1 321 . 1 1 28 28 ARG CA C 13 56.347 0.313 . 1 . . 431 . . 28 ARG CA . 19164 1 322 . 1 1 28 28 ARG CB C 13 31.463 0.313 . 1 . . 430 . . 28 ARG CB . 19164 1 323 . 1 1 28 28 ARG CG C 13 28.462 0.313 . 1 . . 872 . . 28 ARG CG . 19164 1 324 . 1 1 28 28 ARG CD C 13 43.622 0.313 . 1 . . 871 . . 28 ARG CD . 19164 1 325 . 1 1 28 28 ARG N N 15 115.375 0.125 . 1 . . 152 . . 28 ARG N . 19164 1 326 . 1 1 28 28 ARG NE N 15 84.909 0.125 . 1 . . 874 . . 28 ARG NE . 19164 1 327 . 1 1 29 29 GLY H H 1 7.907 0.043 . 1 . . 18 . . 29 GLY H . 19164 1 328 . 1 1 29 29 GLY HA2 H 1 3.994 0.043 . 1 . . 701 . . 29 GLY HA2 . 19164 1 329 . 1 1 29 29 GLY HA3 H 1 3.920 0.043 . 1 . . 700 . . 29 GLY HA3 . 19164 1 330 . 1 1 29 29 GLY C C 13 174.923 0.313 . 1 . . 1566 . . 29 GLY C . 19164 1 331 . 1 1 29 29 GLY CA C 13 46.546 0.313 . 1 . . 409 . . 29 GLY CA . 19164 1 332 . 1 1 29 29 GLY N N 15 110.023 0.125 . 1 . . 19 . . 29 GLY N . 19164 1 333 . 1 1 30 30 VAL H H 1 7.698 0.043 . 1 . . 57 . . 30 VAL H . 19164 1 334 . 1 1 30 30 VAL HA H 1 3.771 0.043 . 1 . . 216 . . 30 VAL HA . 19164 1 335 . 1 1 30 30 VAL HB H 1 1.752 0.043 . 1 . . 502 . . 30 VAL HB . 19164 1 336 . 1 1 30 30 VAL HG11 H 1 0.825 0.043 . 1 . . 500 . . 30 VAL HG11 . 19164 1 337 . 1 1 30 30 VAL HG12 H 1 0.825 0.043 . 1 . . 500 . . 30 VAL HG12 . 19164 1 338 . 1 1 30 30 VAL HG13 H 1 0.825 0.043 . 1 . . 500 . . 30 VAL HG13 . 19164 1 339 . 1 1 30 30 VAL HG21 H 1 0.790 0.043 . 1 . . 501 . . 30 VAL HG21 . 19164 1 340 . 1 1 30 30 VAL HG22 H 1 0.790 0.043 . 1 . . 501 . . 30 VAL HG22 . 19164 1 341 . 1 1 30 30 VAL HG23 H 1 0.790 0.043 . 1 . . 501 . . 30 VAL HG23 . 19164 1 342 . 1 1 30 30 VAL C C 13 175.157 0.313 . 1 . . 1567 . . 30 VAL C . 19164 1 343 . 1 1 30 30 VAL CA C 13 62.366 0.313 . 1 . . 59 . . 30 VAL CA . 19164 1 344 . 1 1 30 30 VAL CB C 13 32.180 0.313 . 1 . . 60 . . 30 VAL CB . 19164 1 345 . 1 1 30 30 VAL CG1 C 13 21.586 0.313 . 1 . . 503 . . 30 VAL CG1 . 19164 1 346 . 1 1 30 30 VAL CG2 C 13 21.833 0.313 . 1 . . 504 . . 30 VAL CG2 . 19164 1 347 . 1 1 30 30 VAL N N 15 118.743 0.125 . 1 . . 58 . . 30 VAL N . 19164 1 348 . 1 1 31 31 ASN H H 1 8.497 0.043 . 1 . . 89 . . 31 ASN H . 19164 1 349 . 1 1 31 31 ASN HA H 1 4.731 0.043 . 1 . . 263 . . 31 ASN HA . 19164 1 350 . 1 1 31 31 ASN HB2 H 1 2.893 0.043 . 1 . . 530 . . 31 ASN HB2 . 19164 1 351 . 1 1 31 31 ASN HB3 H 1 2.852 0.043 . 1 . . 575 . . 31 ASN HB3 . 19164 1 352 . 1 1 31 31 ASN HD21 H 1 7.700 0.043 . 1 . . 862 . . 31 ASN HD21 . 19164 1 353 . 1 1 31 31 ASN HD22 H 1 7.068 0.043 . 1 . . 863 . . 31 ASN HD22 . 19164 1 354 . 1 1 31 31 ASN C C 13 174.880 0.313 . 1 . . 1568 . . 31 ASN C . 19164 1 355 . 1 1 31 31 ASN CA C 13 53.322 0.313 . 1 . . 264 . . 31 ASN CA . 19164 1 356 . 1 1 31 31 ASN CB C 13 39.091 0.313 . 1 . . 178 . . 31 ASN CB . 19164 1 357 . 1 1 31 31 ASN N N 15 123.326 0.125 . 1 . . 90 . . 31 ASN N . 19164 1 358 . 1 1 31 31 ASN ND2 N 15 113.240 0.125 . 1 . . 861 . . 31 ASN ND2 . 19164 1 359 . 1 1 32 32 PHE H H 1 8.794 0.043 . 1 . . 79 . . 32 PHE H . 19164 1 360 . 1 1 32 32 PHE HA H 1 4.154 0.043 . 1 . . 259 . . 32 PHE HA . 19164 1 361 . 1 1 32 32 PHE HB2 H 1 3.281 0.043 . 1 . . 572 . . 32 PHE HB2 . 19164 1 362 . 1 1 32 32 PHE HB3 H 1 3.153 0.043 . 1 . . 330 . . 32 PHE HB3 . 19164 1 363 . 1 1 32 32 PHE HD1 H 1 7.337 0.043 . 3 . . 938 . . 32 PHE HD1 . 19164 1 364 . 1 1 32 32 PHE HD2 H 1 7.337 0.043 . 3 . . 939 . . 32 PHE HD2 . 19164 1 365 . 1 1 32 32 PHE HE1 H 1 7.042 0.043 . 3 . . 942 . . 32 PHE HE1 . 19164 1 366 . 1 1 32 32 PHE HE2 H 1 7.042 0.043 . 3 . . 943 . . 32 PHE HE2 . 19164 1 367 . 1 1 32 32 PHE HZ H 1 6.902 0.043 . 1 . . 1720 . . 32 PHE HZ . 19164 1 368 . 1 1 32 32 PHE C C 13 175.381 0.313 . 1 . . 1569 . . 32 PHE C . 19164 1 369 . 1 1 32 32 PHE CA C 13 58.528 0.313 . 1 . . 425 . . 32 PHE CA . 19164 1 370 . 1 1 32 32 PHE CB C 13 36.602 0.313 . 1 . . 424 . . 32 PHE CB . 19164 1 371 . 1 1 32 32 PHE CD1 C 13 131.030 0.313 . 3 . . 940 . . 32 PHE CD1 . 19164 1 372 . 1 1 32 32 PHE CD2 C 13 131.030 0.313 . 3 . . 941 . . 32 PHE CD2 . 19164 1 373 . 1 1 32 32 PHE CE1 C 13 131.093 0.313 . 3 . . 1724 . . 32 PHE CE1 . 19164 1 374 . 1 1 32 32 PHE CE2 C 13 131.093 0.313 . 3 . . 1725 . . 32 PHE CE2 . 19164 1 375 . 1 1 32 32 PHE CZ C 13 128.875 0.313 . 1 . . 1723 . . 32 PHE CZ . 19164 1 376 . 1 1 32 32 PHE N N 15 126.170 0.125 . 1 . . 80 . . 32 PHE N . 19164 1 377 . 1 1 33 33 SER H H 1 7.699 0.043 . 1 . . 206 . . 33 SER H . 19164 1 378 . 1 1 33 33 SER HA H 1 4.748 0.043 . 1 . . 370 . . 33 SER HA . 19164 1 379 . 1 1 33 33 SER HB2 H 1 4.136 0.043 . 1 . . 562 . . 33 SER HB2 . 19164 1 380 . 1 1 33 33 SER HB3 H 1 3.987 0.043 . 1 . . 294 . . 33 SER HB3 . 19164 1 381 . 1 1 33 33 SER C C 13 174.892 0.313 . 1 . . 1570 . . 33 SER C . 19164 1 382 . 1 1 33 33 SER CA C 13 56.616 0.313 . 1 . . 371 . . 33 SER CA . 19164 1 383 . 1 1 33 33 SER CB C 13 64.848 0.313 . 1 . . 372 . . 33 SER CB . 19164 1 384 . 1 1 33 33 SER N N 15 116.015 0.125 . 1 . . 207 . . 33 SER N . 19164 1 385 . 1 1 34 34 LEU H H 1 8.938 0.043 . 1 . . 33 . . 34 LEU H . 19164 1 386 . 1 1 34 34 LEU HA H 1 3.861 0.043 . 1 . . 321 . . 34 LEU HA . 19164 1 387 . 1 1 34 34 LEU HB2 H 1 1.792 0.043 . 1 . . 483 . . 34 LEU HB2 . 19164 1 388 . 1 1 34 34 LEU HB3 H 1 1.694 0.043 . 1 . . 322 . . 34 LEU HB3 . 19164 1 389 . 1 1 34 34 LEU HG H 1 1.802 0.043 . 1 . . 488 . . 34 LEU HG . 19164 1 390 . 1 1 34 34 LEU HD11 H 1 1.002 0.043 . 1 . . 484 . . 34 LEU HD11 . 19164 1 391 . 1 1 34 34 LEU HD12 H 1 1.002 0.043 . 1 . . 484 . . 34 LEU HD12 . 19164 1 392 . 1 1 34 34 LEU HD13 H 1 1.002 0.043 . 1 . . 484 . . 34 LEU HD13 . 19164 1 393 . 1 1 34 34 LEU HD21 H 1 0.940 0.043 . 1 . . 486 . . 34 LEU HD21 . 19164 1 394 . 1 1 34 34 LEU HD22 H 1 0.940 0.043 . 1 . . 486 . . 34 LEU HD22 . 19164 1 395 . 1 1 34 34 LEU HD23 H 1 0.940 0.043 . 1 . . 486 . . 34 LEU HD23 . 19164 1 396 . 1 1 34 34 LEU C C 13 178.314 0.313 . 1 . . 1571 . . 34 LEU C . 19164 1 397 . 1 1 34 34 LEU CA C 13 59.671 0.313 . 1 . . 417 . . 34 LEU CA . 19164 1 398 . 1 1 34 34 LEU CB C 13 41.367 0.313 . 1 . . 416 . . 34 LEU CB . 19164 1 399 . 1 1 34 34 LEU CG C 13 27.104 0.313 . 1 . . 489 . . 34 LEU CG . 19164 1 400 . 1 1 34 34 LEU CD1 C 13 24.761 0.313 . 1 . . 485 . . 34 LEU CD1 . 19164 1 401 . 1 1 34 34 LEU CD2 C 13 23.738 0.313 . 1 . . 487 . . 34 LEU CD2 . 19164 1 402 . 1 1 34 34 LEU N N 15 124.403 0.125 . 1 . . 34 . . 34 LEU N . 19164 1 403 . 1 1 35 35 ASP H H 1 8.572 0.043 . 1 . . 117 . . 35 ASP H . 19164 1 404 . 1 1 35 35 ASP HA H 1 4.387 0.043 . 1 . . 282 . . 35 ASP HA . 19164 1 405 . 1 1 35 35 ASP HB2 H 1 2.689 0.043 . 1 . . 281 . . 35 ASP HB2 . 19164 1 406 . 1 1 35 35 ASP HB3 H 1 2.658 0.043 . 1 . . 1336 . . 35 ASP HB3 . 19164 1 407 . 1 1 35 35 ASP C C 13 177.010 0.313 . 1 . . 1572 . . 35 ASP C . 19164 1 408 . 1 1 35 35 ASP CA C 13 56.858 0.313 . 1 . . 426 . . 35 ASP CA . 19164 1 409 . 1 1 35 35 ASP CB C 13 40.160 0.313 . 1 . . 427 . . 35 ASP CB . 19164 1 410 . 1 1 35 35 ASP N N 15 115.371 0.125 . 1 . . 118 . . 35 ASP N . 19164 1 411 . 1 1 36 36 THR H H 1 7.589 0.043 . 1 . . 235 . . 36 THR H . 19164 1 412 . 1 1 36 36 THR HA H 1 4.024 0.043 . 1 . . 611 . . 36 THR HA . 19164 1 413 . 1 1 36 36 THR HB H 1 4.291 0.043 . 1 . . 377 . . 36 THR HB . 19164 1 414 . 1 1 36 36 THR HG21 H 1 1.295 0.043 . 1 . . 612 . . 36 THR HG21 . 19164 1 415 . 1 1 36 36 THR HG22 H 1 1.295 0.043 . 1 . . 612 . . 36 THR HG22 . 19164 1 416 . 1 1 36 36 THR HG23 H 1 1.295 0.043 . 1 . . 612 . . 36 THR HG23 . 19164 1 417 . 1 1 36 36 THR C C 13 176.012 0.313 . 1 . . 1573 . . 36 THR C . 19164 1 418 . 1 1 36 36 THR CA C 13 65.896 0.313 . 1 . . 434 . . 36 THR CA . 19164 1 419 . 1 1 36 36 THR CB C 13 68.550 0.313 . 1 . . 435 . . 36 THR CB . 19164 1 420 . 1 1 36 36 THR CG2 C 13 23.153 0.313 . 1 . . 614 . . 36 THR CG2 . 19164 1 421 . 1 1 36 36 THR N N 15 116.848 0.125 . 1 . . 236 . . 36 THR N . 19164 1 422 . 1 1 37 37 ILE H H 1 8.433 0.043 . 1 . . 105 . . 37 ILE H . 19164 1 423 . 1 1 37 37 ILE HA H 1 3.373 0.043 . 1 . . 275 . . 37 ILE HA . 19164 1 424 . 1 1 37 37 ILE HB H 1 1.770 0.043 . 1 . . 603 . . 37 ILE HB . 19164 1 425 . 1 1 37 37 ILE HG12 H 1 1.585 0.043 . 1 . . 620 . . 37 ILE HG12 . 19164 1 426 . 1 1 37 37 ILE HG13 H 1 0.573 0.043 . 1 . . 616 . . 37 ILE HG13 . 19164 1 427 . 1 1 37 37 ILE HG21 H 1 0.934 0.043 . 1 . . 613 . . 37 ILE HG21 . 19164 1 428 . 1 1 37 37 ILE HG22 H 1 0.934 0.043 . 1 . . 613 . . 37 ILE HG22 . 19164 1 429 . 1 1 37 37 ILE HG23 H 1 0.934 0.043 . 1 . . 613 . . 37 ILE HG23 . 19164 1 430 . 1 1 37 37 ILE HD11 H 1 0.376 0.043 . 1 . . 615 . . 37 ILE HD11 . 19164 1 431 . 1 1 37 37 ILE HD12 H 1 0.376 0.043 . 1 . . 615 . . 37 ILE HD12 . 19164 1 432 . 1 1 37 37 ILE HD13 H 1 0.376 0.043 . 1 . . 615 . . 37 ILE HD13 . 19164 1 433 . 1 1 37 37 ILE C C 13 177.061 0.313 . 1 . . 1574 . . 37 ILE C . 19164 1 434 . 1 1 37 37 ILE CA C 13 65.800 0.313 . 1 . . 338 . . 37 ILE CA . 19164 1 435 . 1 1 37 37 ILE CB C 13 37.035 0.313 . 1 . . 337 . . 37 ILE CB . 19164 1 436 . 1 1 37 37 ILE CG1 C 13 28.676 0.313 . 1 . . 617 . . 37 ILE CG1 . 19164 1 437 . 1 1 37 37 ILE CG2 C 13 18.507 0.313 . 1 . . 618 . . 37 ILE CG2 . 19164 1 438 . 1 1 37 37 ILE CD1 C 13 12.799 0.313 . 1 . . 619 . . 37 ILE CD1 . 19164 1 439 . 1 1 37 37 ILE N N 15 120.728 0.125 . 1 . . 106 . . 37 ILE N . 19164 1 440 . 1 1 38 38 GLU H H 1 8.121 0.043 . 1 . . 127 . . 38 GLU H . 19164 1 441 . 1 1 38 38 GLU HA H 1 3.680 0.043 . 1 . . 348 . . 38 GLU HA . 19164 1 442 . 1 1 38 38 GLU HB2 H 1 2.277 0.043 . 1 . . 621 . . 38 GLU HB2 . 19164 1 443 . 1 1 38 38 GLU HB3 H 1 2.173 0.043 . 1 . . 610 . . 38 GLU HB3 . 19164 1 444 . 1 1 38 38 GLU HG2 H 1 2.185 0.043 . 1 . . 1337 . . 38 GLU HG2 . 19164 1 445 . 1 1 38 38 GLU HG3 H 1 2.164 0.043 . 1 . . 622 . . 38 GLU HG3 . 19164 1 446 . 1 1 38 38 GLU C C 13 178.660 0.313 . 1 . . 1575 . . 38 GLU C . 19164 1 447 . 1 1 38 38 GLU CA C 13 60.957 0.313 . 1 . . 246 . . 38 GLU CA . 19164 1 448 . 1 1 38 38 GLU CB C 13 29.733 0.313 . 1 . . 245 . . 38 GLU CB . 19164 1 449 . 1 1 38 38 GLU CG C 13 37.085 0.313 . 1 . . 623 . . 38 GLU CG . 19164 1 450 . 1 1 38 38 GLU N N 15 118.859 0.125 . 1 . . 128 . . 38 GLU N . 19164 1 451 . 1 1 39 39 LYS H H 1 7.591 0.043 . 1 . . 75 . . 39 LYS H . 19164 1 452 . 1 1 39 39 LYS HA H 1 3.995 0.043 . 1 . . 329 . . 39 LYS HA . 19164 1 453 . 1 1 39 39 LYS HB2 H 1 2.043 0.043 . 1 . . 624 . . 39 LYS HB2 . 19164 1 454 . 1 1 39 39 LYS HB3 H 1 1.988 0.043 . 1 . . 625 . . 39 LYS HB3 . 19164 1 455 . 1 1 39 39 LYS HG2 H 1 1.522 0.043 . 1 . . 1753 . . 39 LYS HG2 . 19164 1 456 . 1 1 39 39 LYS HG3 H 1 1.522 0.043 . 1 . . 626 . . 39 LYS HG3 . 19164 1 457 . 1 1 39 39 LYS HD2 H 1 1.670 0.043 . 1 . . 1751 . . 39 LYS HD2 . 19164 1 458 . 1 1 39 39 LYS HD3 H 1 1.670 0.043 . 1 . . 627 . . 39 LYS HD3 . 19164 1 459 . 1 1 39 39 LYS HE2 H 1 3.004 0.043 . 1 . . 1752 . . 39 LYS HE2 . 19164 1 460 . 1 1 39 39 LYS HE3 H 1 3.004 0.043 . 1 . . 628 . . 39 LYS HE3 . 19164 1 461 . 1 1 39 39 LYS C C 13 180.452 0.313 . 1 . . 1576 . . 39 LYS C . 19164 1 462 . 1 1 39 39 LYS CA C 13 59.607 0.313 . 1 . . 234 . . 39 LYS CA . 19164 1 463 . 1 1 39 39 LYS CB C 13 32.279 0.313 . 1 . . 233 . . 39 LYS CB . 19164 1 464 . 1 1 39 39 LYS CG C 13 25.134 0.313 . 1 . . 629 . . 39 LYS CG . 19164 1 465 . 1 1 39 39 LYS CD C 13 28.877 0.313 . 1 . . 1338 . . 39 LYS CD . 19164 1 466 . 1 1 39 39 LYS CE C 13 42.064 0.313 . 1 . . 630 . . 39 LYS CE . 19164 1 467 . 1 1 39 39 LYS N N 15 116.992 0.125 . 1 . . 76 . . 39 LYS N . 19164 1 468 . 1 1 40 40 GLU H H 1 8.688 0.043 . 1 . . 95 . . 40 GLU H . 19164 1 469 . 1 1 40 40 GLU HA H 1 4.205 0.043 . 1 . . 269 . . 40 GLU HA . 19164 1 470 . 1 1 40 40 GLU HB2 H 1 2.379 0.043 . 1 . . 534 . . 40 GLU HB2 . 19164 1 471 . 1 1 40 40 GLU HB3 H 1 2.160 0.043 . 1 . . 535 . . 40 GLU HB3 . 19164 1 472 . 1 1 40 40 GLU HG2 H 1 2.614 0.043 . 1 . . 594 . . 40 GLU HG2 . 19164 1 473 . 1 1 40 40 GLU HG3 H 1 2.082 0.043 . 1 . . 596 . . 40 GLU HG3 . 19164 1 474 . 1 1 40 40 GLU C C 13 178.864 0.313 . 1 . . 1577 . . 40 GLU C . 19164 1 475 . 1 1 40 40 GLU CA C 13 58.359 0.313 . 1 . . 182 . . 40 GLU CA . 19164 1 476 . 1 1 40 40 GLU CB C 13 28.437 0.313 . 1 . . 181 . . 40 GLU CB . 19164 1 477 . 1 1 40 40 GLU CG C 13 36.012 0.313 . 1 . . 595 . . 40 GLU CG . 19164 1 478 . 1 1 40 40 GLU N N 15 117.929 0.125 . 1 . . 96 . . 40 GLU N . 19164 1 479 . 1 1 41 41 LEU H H 1 8.974 0.043 . 1 . . 81 . . 41 LEU H . 19164 1 480 . 1 1 41 41 LEU HA H 1 3.557 0.043 . 1 . . 332 . . 41 LEU HA . 19164 1 481 . 1 1 41 41 LEU HB2 H 1 1.847 0.043 . 1 . . 331 . . 41 LEU HB2 . 19164 1 482 . 1 1 41 41 LEU HB3 H 1 1.297 0.043 . 1 . . 461 . . 41 LEU HB3 . 19164 1 483 . 1 1 41 41 LEU HG H 1 1.262 0.043 . 1 . . 466 . . 41 LEU HG . 19164 1 484 . 1 1 41 41 LEU HD11 H 1 0.671 0.043 . 1 . . 462 . . 41 LEU HD11 . 19164 1 485 . 1 1 41 41 LEU HD12 H 1 0.671 0.043 . 1 . . 462 . . 41 LEU HD12 . 19164 1 486 . 1 1 41 41 LEU HD13 H 1 0.671 0.043 . 1 . . 462 . . 41 LEU HD13 . 19164 1 487 . 1 1 41 41 LEU HD21 H 1 0.261 0.043 . 1 . . 463 . . 41 LEU HD21 . 19164 1 488 . 1 1 41 41 LEU HD22 H 1 0.261 0.043 . 1 . . 463 . . 41 LEU HD22 . 19164 1 489 . 1 1 41 41 LEU HD23 H 1 0.261 0.043 . 1 . . 463 . . 41 LEU HD23 . 19164 1 490 . 1 1 41 41 LEU C C 13 178.079 0.313 . 1 . . 1578 . . 41 LEU C . 19164 1 491 . 1 1 41 41 LEU CA C 13 57.747 0.313 . 1 . . 172 . . 41 LEU CA . 19164 1 492 . 1 1 41 41 LEU CB C 13 40.253 0.313 . 1 . . 171 . . 41 LEU CB . 19164 1 493 . 1 1 41 41 LEU CG C 13 26.545 0.313 . 1 . . 467 . . 41 LEU CG . 19164 1 494 . 1 1 41 41 LEU CD1 C 13 26.451 0.313 . 1 . . 464 . . 41 LEU CD1 . 19164 1 495 . 1 1 41 41 LEU CD2 C 13 21.091 0.313 . 1 . . 465 . . 41 LEU CD2 . 19164 1 496 . 1 1 41 41 LEU N N 15 125.924 0.125 . 1 . . 82 . . 41 LEU N . 19164 1 497 . 1 1 42 42 ILE H H 1 7.884 0.043 . 1 . . 133 . . 42 ILE H . 19164 1 498 . 1 1 42 42 ILE HA H 1 3.591 0.043 . 1 . . 353 . . 42 ILE HA . 19164 1 499 . 1 1 42 42 ILE HB H 1 1.925 0.043 . 1 . . 585 . . 42 ILE HB . 19164 1 500 . 1 1 42 42 ILE HG12 H 1 1.769 0.043 . 1 . . 586 . . 42 ILE HG12 . 19164 1 501 . 1 1 42 42 ILE HG13 H 1 1.083 0.043 . 1 . . 587 . . 42 ILE HG13 . 19164 1 502 . 1 1 42 42 ILE HG21 H 1 0.920 0.043 . 1 . . 588 . . 42 ILE HG21 . 19164 1 503 . 1 1 42 42 ILE HG22 H 1 0.920 0.043 . 1 . . 588 . . 42 ILE HG22 . 19164 1 504 . 1 1 42 42 ILE HG23 H 1 0.920 0.043 . 1 . . 588 . . 42 ILE HG23 . 19164 1 505 . 1 1 42 42 ILE HD11 H 1 0.871 0.043 . 1 . . 676 . . 42 ILE HD11 . 19164 1 506 . 1 1 42 42 ILE HD12 H 1 0.871 0.043 . 1 . . 676 . . 42 ILE HD12 . 19164 1 507 . 1 1 42 42 ILE HD13 H 1 0.871 0.043 . 1 . . 676 . . 42 ILE HD13 . 19164 1 508 . 1 1 42 42 ILE C C 13 179.373 0.313 . 1 . . 1579 . . 42 ILE C . 19164 1 509 . 1 1 42 42 ILE CA C 13 65.686 0.313 . 1 . . 248 . . 42 ILE CA . 19164 1 510 . 1 1 42 42 ILE CB C 13 37.723 0.313 . 1 . . 247 . . 42 ILE CB . 19164 1 511 . 1 1 42 42 ILE CG1 C 13 29.240 0.313 . 1 . . 673 . . 42 ILE CG1 . 19164 1 512 . 1 1 42 42 ILE CG2 C 13 16.895 0.313 . 1 . . 674 . . 42 ILE CG2 . 19164 1 513 . 1 1 42 42 ILE CD1 C 13 13.222 0.313 . 1 . . 675 . . 42 ILE CD1 . 19164 1 514 . 1 1 42 42 ILE N N 15 119.902 0.125 . 1 . . 134 . . 42 ILE N . 19164 1 515 . 1 1 43 43 SER H H 1 7.788 0.043 . 1 . . 147 . . 43 SER H . 19164 1 516 . 1 1 43 43 SER HA H 1 4.281 0.043 . 1 . . 359 . . 43 SER HA . 19164 1 517 . 1 1 43 43 SER HB2 H 1 4.091 0.043 . 1 . . 950 . . 43 SER HB2 . 19164 1 518 . 1 1 43 43 SER HB3 H 1 4.054 0.043 . 1 . . 410 . . 43 SER HB3 . 19164 1 519 . 1 1 43 43 SER C C 13 177.061 0.313 . 1 . . 1580 . . 43 SER C . 19164 1 520 . 1 1 43 43 SER CA C 13 61.559 0.313 . 1 . . 256 . . 43 SER CA . 19164 1 521 . 1 1 43 43 SER CB C 13 62.728 0.313 . 1 . . 255 . . 43 SER CB . 19164 1 522 . 1 1 43 43 SER N N 15 114.093 0.125 . 1 . . 148 . . 43 SER N . 19164 1 523 . 1 1 44 44 PHE H H 1 9.051 0.043 . 1 . . 43 . . 44 PHE H . 19164 1 524 . 1 1 44 44 PHE HA H 1 4.338 0.043 . 1 . . 324 . . 44 PHE HA . 19164 1 525 . 1 1 44 44 PHE HB2 H 1 3.552 0.043 . 1 . . 635 . . 44 PHE HB2 . 19164 1 526 . 1 1 44 44 PHE HB3 H 1 2.840 0.043 . 1 . . 634 . . 44 PHE HB3 . 19164 1 527 . 1 1 44 44 PHE HD1 H 1 7.113 0.043 . 3 . . 922 . . 44 PHE HD1 . 19164 1 528 . 1 1 44 44 PHE HD2 H 1 7.113 0.043 . 3 . . 923 . . 44 PHE HD2 . 19164 1 529 . 1 1 44 44 PHE HE1 H 1 6.844 0.043 . 3 . . 926 . . 44 PHE HE1 . 19164 1 530 . 1 1 44 44 PHE HE2 H 1 6.844 0.043 . 3 . . 927 . . 44 PHE HE2 . 19164 1 531 . 1 1 44 44 PHE HZ H 1 6.959 0.043 . 1 . . 928 . . 44 PHE HZ . 19164 1 532 . 1 1 44 44 PHE C C 13 177.886 0.313 . 1 . . 1581 . . 44 PHE C . 19164 1 533 . 1 1 44 44 PHE CA C 13 61.095 0.313 . 1 . . 325 . . 44 PHE CA . 19164 1 534 . 1 1 44 44 PHE CB C 13 40.513 0.313 . 1 . . 326 . . 44 PHE CB . 19164 1 535 . 1 1 44 44 PHE CD1 C 13 132.338 0.313 . 3 . . 924 . . 44 PHE CD1 . 19164 1 536 . 1 1 44 44 PHE CD2 C 13 132.338 0.313 . 3 . . 925 . . 44 PHE CD2 . 19164 1 537 . 1 1 44 44 PHE CE1 C 13 130.923 0.313 . 3 . . 1732 . . 44 PHE CE1 . 19164 1 538 . 1 1 44 44 PHE CE2 C 13 130.923 0.313 . 3 . . 1733 . . 44 PHE CE2 . 19164 1 539 . 1 1 44 44 PHE CZ C 13 128.815 0.313 . 1 . . 929 . . 44 PHE CZ . 19164 1 540 . 1 1 44 44 PHE N N 15 125.103 0.125 . 1 . . 44 . . 44 PHE N . 19164 1 541 . 1 1 45 45 CYS H H 1 8.253 0.043 . 1 . . 20 . . 45 CYS H . 19164 1 542 . 1 1 45 45 CYS HA H 1 4.614 0.043 . 1 . . 193 . . 45 CYS HA . 19164 1 543 . 1 1 45 45 CYS HB2 H 1 3.344 0.043 . 1 . . 318 . . 45 CYS HB2 . 19164 1 544 . 1 1 45 45 CYS HB3 H 1 2.820 0.043 . 1 . . 317 . . 45 CYS HB3 . 19164 1 545 . 1 1 45 45 CYS C C 13 176.878 0.313 . 1 . . 1582 . . 45 CYS C . 19164 1 546 . 1 1 45 45 CYS CA C 13 59.107 0.313 . 1 . . 379 . . 45 CYS CA . 19164 1 547 . 1 1 45 45 CYS CB C 13 42.523 0.313 . 1 . . 380 . . 45 CYS CB . 19164 1 548 . 1 1 45 45 CYS N N 15 112.885 0.125 . 1 . . 21 . . 45 CYS N . 19164 1 549 . 1 1 46 46 LEU H H 1 7.773 0.043 . 1 . . 27 . . 46 LEU H . 19164 1 550 . 1 1 46 46 LEU HA H 1 4.185 0.043 . 1 . . 320 . . 46 LEU HA . 19164 1 551 . 1 1 46 46 LEU HB2 H 1 1.973 0.043 . 1 . . 400 . . 46 LEU HB2 . 19164 1 552 . 1 1 46 46 LEU HB3 H 1 1.659 0.043 . 1 . . 706 . . 46 LEU HB3 . 19164 1 553 . 1 1 46 46 LEU HG H 1 1.979 0.043 . 1 . . 702 . . 46 LEU HG . 19164 1 554 . 1 1 46 46 LEU HD11 H 1 1.023 0.043 . 1 . . 704 . . 46 LEU HD11 . 19164 1 555 . 1 1 46 46 LEU HD12 H 1 1.023 0.043 . 1 . . 704 . . 46 LEU HD12 . 19164 1 556 . 1 1 46 46 LEU HD13 H 1 1.023 0.043 . 1 . . 704 . . 46 LEU HD13 . 19164 1 557 . 1 1 46 46 LEU HD21 H 1 0.961 0.043 . 1 . . 703 . . 46 LEU HD21 . 19164 1 558 . 1 1 46 46 LEU HD22 H 1 0.961 0.043 . 1 . . 703 . . 46 LEU HD22 . 19164 1 559 . 1 1 46 46 LEU HD23 H 1 0.961 0.043 . 1 . . 703 . . 46 LEU HD23 . 19164 1 560 . 1 1 46 46 LEU C C 13 177.784 0.313 . 1 . . 1583 . . 46 LEU C . 19164 1 561 . 1 1 46 46 LEU CA C 13 58.060 0.313 . 1 . . 382 . . 46 LEU CA . 19164 1 562 . 1 1 46 46 LEU CB C 13 42.119 0.313 . 1 . . 381 . . 46 LEU CB . 19164 1 563 . 1 1 46 46 LEU CG C 13 26.294 0.313 . 1 . . 705 . . 46 LEU CG . 19164 1 564 . 1 1 46 46 LEU CD1 C 13 24.789 0.313 . 1 . . 708 . . 46 LEU CD1 . 19164 1 565 . 1 1 46 46 LEU CD2 C 13 23.553 0.313 . 1 . . 707 . . 46 LEU CD2 . 19164 1 566 . 1 1 46 46 LEU N N 15 123.927 0.125 . 1 . . 28 . . 46 LEU N . 19164 1 567 . 1 1 47 47 ASP H H 1 7.857 0.043 . 1 . . 221 . . 47 ASP H . 19164 1 568 . 1 1 47 47 ASP HA H 1 4.922 0.043 . 1 . . 709 . . 47 ASP HA . 19164 1 569 . 1 1 47 47 ASP HB2 H 1 2.826 0.043 . 1 . . 373 . . 47 ASP HB2 . 19164 1 570 . 1 1 47 47 ASP HB3 H 1 2.565 0.043 . 1 . . 374 . . 47 ASP HB3 . 19164 1 571 . 1 1 47 47 ASP C C 13 176.216 0.313 . 1 . . 1584 . . 47 ASP C . 19164 1 572 . 1 1 47 47 ASP CA C 13 53.425 0.313 . 1 . . 433 . . 47 ASP CA . 19164 1 573 . 1 1 47 47 ASP CB C 13 40.301 0.313 . 1 . . 432 . . 47 ASP CB . 19164 1 574 . 1 1 47 47 ASP N N 15 116.910 0.125 . 1 . . 222 . . 47 ASP N . 19164 1 575 . 1 1 48 48 THR H H 1 7.141 0.043 . 1 . . 16 . . 48 THR H . 19164 1 576 . 1 1 48 48 THR HA H 1 4.480 0.043 . 1 . . 192 . . 48 THR HA . 19164 1 577 . 1 1 48 48 THR HB H 1 4.022 0.043 . 1 . . 711 . . 48 THR HB . 19164 1 578 . 1 1 48 48 THR HG21 H 1 1.524 0.043 . 1 . . 710 . . 48 THR HG21 . 19164 1 579 . 1 1 48 48 THR HG22 H 1 1.524 0.043 . 1 . . 710 . . 48 THR HG22 . 19164 1 580 . 1 1 48 48 THR HG23 H 1 1.524 0.043 . 1 . . 710 . . 48 THR HG23 . 19164 1 581 . 1 1 48 48 THR C C 13 174.628 0.313 . 1 . . 1585 . . 48 THR C . 19164 1 582 . 1 1 48 48 THR CA C 13 60.766 0.313 . 1 . . 383 . . 48 THR CA . 19164 1 583 . 1 1 48 48 THR CB C 13 73.395 0.313 . 1 . . 384 . . 48 THR CB . 19164 1 584 . 1 1 48 48 THR CG2 C 13 23.718 0.313 . 1 . . 951 . . 48 THR CG2 . 19164 1 585 . 1 1 48 48 THR N N 15 108.105 0.125 . 1 . . 17 . . 48 THR N . 19164 1 586 . 1 1 49 49 LYS H H 1 8.754 0.043 . 1 . . 93 . . 49 LYS H . 19164 1 587 . 1 1 49 49 LYS HA H 1 4.735 0.043 . 1 . . 266 . . 49 LYS HA . 19164 1 588 . 1 1 49 49 LYS HB2 H 1 1.940 0.043 . 1 . . 267 . . 49 LYS HB2 . 19164 1 589 . 1 1 49 49 LYS HB3 H 1 1.755 0.043 . 1 . . 268 . . 49 LYS HB3 . 19164 1 590 . 1 1 49 49 LYS HG2 H 1 1.429 0.043 . 1 . . 1756 . . 49 LYS HG2 . 19164 1 591 . 1 1 49 49 LYS HG3 H 1 1.429 0.043 . 1 . . 712 . . 49 LYS HG3 . 19164 1 592 . 1 1 49 49 LYS HD2 H 1 1.674 0.043 . 1 . . 1754 . . 49 LYS HD2 . 19164 1 593 . 1 1 49 49 LYS HD3 H 1 1.674 0.043 . 1 . . 715 . . 49 LYS HD3 . 19164 1 594 . 1 1 49 49 LYS HE2 H 1 2.990 0.043 . 1 . . 1755 . . 49 LYS HE2 . 19164 1 595 . 1 1 49 49 LYS HE3 H 1 2.990 0.043 . 1 . . 713 . . 49 LYS HE3 . 19164 1 596 . 1 1 49 49 LYS C C 13 177.275 0.313 . 1 . . 1586 . . 49 LYS C . 19164 1 597 . 1 1 49 49 LYS CA C 13 53.938 0.313 . 1 . . 334 . . 49 LYS CA . 19164 1 598 . 1 1 49 49 LYS CB C 13 36.517 0.313 . 1 . . 335 . . 49 LYS CB . 19164 1 599 . 1 1 49 49 LYS CG C 13 24.366 0.313 . 1 . . 714 . . 49 LYS CG . 19164 1 600 . 1 1 49 49 LYS CD C 13 28.956 0.313 . 1 . . 716 . . 49 LYS CD . 19164 1 601 . 1 1 49 49 LYS CE C 13 42.223 0.313 . 1 . . 717 . . 49 LYS CE . 19164 1 602 . 1 1 49 49 LYS N N 15 118.361 0.125 . 1 . . 94 . . 49 LYS N . 19164 1 603 . 1 1 50 50 GLY H H 1 8.892 0.043 . 1 . . 5 . . 50 GLY H . 19164 1 604 . 1 1 50 50 GLY HA2 H 1 4.130 0.043 . 1 . . 399 . . 50 GLY HA2 . 19164 1 605 . 1 1 50 50 GLY HA3 H 1 3.850 0.043 . 1 . . 398 . . 50 GLY HA3 . 19164 1 606 . 1 1 50 50 GLY C C 13 176.683 0.313 . 1 . . 1587 . . 50 GLY C . 19164 1 607 . 1 1 50 50 GLY CA C 13 46.763 0.313 . 1 . . 385 . . 50 GLY CA . 19164 1 608 . 1 1 50 50 GLY N N 15 109.090 0.125 . 1 . . 6 . . 50 GLY N . 19164 1 609 . 1 1 51 51 LYS H H 1 9.310 0.043 . 1 . . 202 . . 51 LYS H . 19164 1 610 . 1 1 51 51 LYS HA H 1 3.972 0.043 . 1 . . 367 . . 51 LYS HA . 19164 1 611 . 1 1 51 51 LYS HB2 H 1 1.910 0.043 . 1 . . 592 . . 51 LYS HB2 . 19164 1 612 . 1 1 51 51 LYS HB3 H 1 1.584 0.043 . 1 . . 593 . . 51 LYS HB3 . 19164 1 613 . 1 1 51 51 LYS HG2 H 1 1.864 0.043 . 1 . . 720 . . 51 LYS HG2 . 19164 1 614 . 1 1 51 51 LYS HG3 H 1 1.844 0.043 . 1 . . 1507 . . 51 LYS HG3 . 19164 1 615 . 1 1 51 51 LYS HD2 H 1 1.586 0.043 . 1 . . 1757 . . 51 LYS HD2 . 19164 1 616 . 1 1 51 51 LYS HD3 H 1 1.586 0.043 . 1 . . 719 . . 51 LYS HD3 . 19164 1 617 . 1 1 51 51 LYS HE2 H 1 3.206 0.043 . 1 . . 722 . . 51 LYS HE2 . 19164 1 618 . 1 1 51 51 LYS HE3 H 1 3.155 0.043 . 1 . . 718 . . 51 LYS HE3 . 19164 1 619 . 1 1 51 51 LYS C C 13 178.660 0.313 . 1 . . 1588 . . 51 LYS C . 19164 1 620 . 1 1 51 51 LYS CA C 13 58.110 0.313 . 1 . . 365 . . 51 LYS CA . 19164 1 621 . 1 1 51 51 LYS CB C 13 32.401 0.313 . 1 . . 366 . . 51 LYS CB . 19164 1 622 . 1 1 51 51 LYS CG C 13 24.737 0.313 . 1 . . 721 . . 51 LYS CG . 19164 1 623 . 1 1 51 51 LYS CD C 13 28.533 0.313 . 1 . . 724 . . 51 LYS CD . 19164 1 624 . 1 1 51 51 LYS CE C 13 42.338 0.313 . 1 . . 723 . . 51 LYS CE . 19164 1 625 . 1 1 51 51 LYS N N 15 126.155 0.125 . 1 . . 203 . . 51 LYS N . 19164 1 626 . 1 1 52 52 GLU H H 1 8.230 0.043 . 1 . . 125 . . 52 GLU H . 19164 1 627 . 1 1 52 52 GLU HA H 1 3.542 0.043 . 1 . . 303 . . 52 GLU HA . 19164 1 628 . 1 1 52 52 GLU HB2 H 1 2.244 0.043 . 1 . . 304 . . 52 GLU HB2 . 19164 1 629 . 1 1 52 52 GLU HB3 H 1 1.834 0.043 . 1 . . 555 . . 52 GLU HB3 . 19164 1 630 . 1 1 52 52 GLU HG2 H 1 2.932 0.043 . 1 . . 556 . . 52 GLU HG2 . 19164 1 631 . 1 1 52 52 GLU HG3 H 1 2.204 0.043 . 1 . . 725 . . 52 GLU HG3 . 19164 1 632 . 1 1 52 52 GLU C C 13 177.153 0.313 . 1 . . 1589 . . 52 GLU C . 19164 1 633 . 1 1 52 52 GLU CA C 13 59.352 0.313 . 1 . . 346 . . 52 GLU CA . 19164 1 634 . 1 1 52 52 GLU CB C 13 28.416 0.313 . 1 . . 347 . . 52 GLU CB . 19164 1 635 . 1 1 52 52 GLU CG C 13 38.519 0.313 . 1 . . 557 . . 52 GLU CG . 19164 1 636 . 1 1 52 52 GLU N N 15 116.565 0.125 . 1 . . 126 . . 52 GLU N . 19164 1 637 . 1 1 53 53 ASN H H 1 6.847 0.043 . 1 . . 22 . . 53 ASN H . 19164 1 638 . 1 1 53 53 ASN HA H 1 4.374 0.043 . 1 . . 302 . . 53 ASN HA . 19164 1 639 . 1 1 53 53 ASN HB2 H 1 2.515 0.043 . 1 . . 308 . . 53 ASN HB2 . 19164 1 640 . 1 1 53 53 ASN HB3 H 1 2.165 0.043 . 1 . . 307 . . 53 ASN HB3 . 19164 1 641 . 1 1 53 53 ASN HD21 H 1 7.214 0.043 . 1 . . 853 . . 53 ASN HD21 . 19164 1 642 . 1 1 53 53 ASN HD22 H 1 7.000 0.043 . 1 . . 854 . . 53 ASN HD22 . 19164 1 643 . 1 1 53 53 ASN C C 13 176.807 0.313 . 1 . . 1590 . . 53 ASN C . 19164 1 644 . 1 1 53 53 ASN CA C 13 56.851 0.313 . 1 . . 387 . . 53 ASN CA . 19164 1 645 . 1 1 53 53 ASN CB C 13 39.319 0.313 . 1 . . 386 . . 53 ASN CB . 19164 1 646 . 1 1 53 53 ASN N N 15 119.063 0.125 . 1 . . 23 . . 53 ASN N . 19164 1 647 . 1 1 53 53 ASN ND2 N 15 111.978 0.125 . 1 . . 852 . . 53 ASN ND2 . 19164 1 648 . 1 1 54 54 ARG H H 1 7.471 0.043 . 1 . . 71 . . 54 ARG H . 19164 1 649 . 1 1 54 54 ARG HA H 1 3.779 0.043 . 1 . . 306 . . 54 ARG HA . 19164 1 650 . 1 1 54 54 ARG HB2 H 1 1.852 0.043 . 1 . . 305 . . 54 ARG HB2 . 19164 1 651 . 1 1 54 54 ARG HB3 H 1 1.796 0.043 . 1 . . 522 . . 54 ARG HB3 . 19164 1 652 . 1 1 54 54 ARG HG2 H 1 1.640 0.043 . 1 . . 549 . . 54 ARG HG2 . 19164 1 653 . 1 1 54 54 ARG HG3 H 1 1.500 0.043 . 1 . . 876 . . 54 ARG HG3 . 19164 1 654 . 1 1 54 54 ARG HD2 H 1 3.029 0.043 . 1 . . 877 . . 54 ARG HD2 . 19164 1 655 . 1 1 54 54 ARG HD3 H 1 2.916 0.043 . 1 . . 875 . . 54 ARG HD3 . 19164 1 656 . 1 1 54 54 ARG C C 13 176.980 0.313 . 1 . . 1591 . . 54 ARG C . 19164 1 657 . 1 1 54 54 ARG CA C 13 57.339 0.313 . 1 . . 388 . . 54 ARG CA . 19164 1 658 . 1 1 54 54 ARG CB C 13 28.641 0.313 . 1 . . 389 . . 54 ARG CB . 19164 1 659 . 1 1 54 54 ARG CG C 13 25.371 0.313 . 1 . . 550 . . 54 ARG CG . 19164 1 660 . 1 1 54 54 ARG CD C 13 42.407 0.313 . 1 . . 548 . . 54 ARG CD . 19164 1 661 . 1 1 54 54 ARG N N 15 118.553 0.125 . 1 . . 72 . . 54 ARG N . 19164 1 662 . 1 1 55 55 LEU H H 1 7.848 0.043 . 1 . . 129 . . 55 LEU H . 19164 1 663 . 1 1 55 55 LEU HA H 1 3.821 0.043 . 1 . . 349 . . 55 LEU HA . 19164 1 664 . 1 1 55 55 LEU HB2 H 1 1.795 0.043 . 1 . . 445 . . 55 LEU HB2 . 19164 1 665 . 1 1 55 55 LEU HB3 H 1 1.233 0.043 . 1 . . 447 . . 55 LEU HB3 . 19164 1 666 . 1 1 55 55 LEU HG H 1 1.310 0.043 . 1 . . 451 . . 55 LEU HG . 19164 1 667 . 1 1 55 55 LEU HD11 H 1 0.887 0.043 . 1 . . 446 . . 55 LEU HD11 . 19164 1 668 . 1 1 55 55 LEU HD12 H 1 0.887 0.043 . 1 . . 446 . . 55 LEU HD12 . 19164 1 669 . 1 1 55 55 LEU HD13 H 1 0.887 0.043 . 1 . . 446 . . 55 LEU HD13 . 19164 1 670 . 1 1 55 55 LEU HD21 H 1 0.718 0.043 . 1 . . 449 . . 55 LEU HD21 . 19164 1 671 . 1 1 55 55 LEU HD22 H 1 0.718 0.043 . 1 . . 449 . . 55 LEU HD22 . 19164 1 672 . 1 1 55 55 LEU HD23 H 1 0.718 0.043 . 1 . . 449 . . 55 LEU HD23 . 19164 1 673 . 1 1 55 55 LEU C C 13 177.570 0.313 . 1 . . 1592 . . 55 LEU C . 19164 1 674 . 1 1 55 55 LEU CA C 13 58.459 0.313 . 1 . . 391 . . 55 LEU CA . 19164 1 675 . 1 1 55 55 LEU CB C 13 40.126 0.313 . 1 . . 390 . . 55 LEU CB . 19164 1 676 . 1 1 55 55 LEU CG C 13 26.702 0.313 . 1 . . 452 . . 55 LEU CG . 19164 1 677 . 1 1 55 55 LEU CD1 C 13 24.653 0.313 . 1 . . 448 . . 55 LEU CD1 . 19164 1 678 . 1 1 55 55 LEU CD2 C 13 28.505 0.313 . 1 . . 450 . . 55 LEU CD2 . 19164 1 679 . 1 1 55 55 LEU N N 15 118.727 0.125 . 1 . . 130 . . 55 LEU N . 19164 1 680 . 1 1 56 56 CYS H H 1 7.751 0.043 . 1 . . 204 . . 56 CYS H . 19164 1 681 . 1 1 56 56 CYS HA H 1 3.887 0.043 . 1 . . 293 . . 56 CYS HA . 19164 1 682 . 1 1 56 56 CYS HB2 H 1 3.399 0.043 . 1 . . 560 . . 56 CYS HB2 . 19164 1 683 . 1 1 56 56 CYS HB3 H 1 2.533 0.043 . 1 . . 561 . . 56 CYS HB3 . 19164 1 684 . 1 1 56 56 CYS C C 13 175.422 0.313 . 1 . . 1593 . . 56 CYS C . 19164 1 685 . 1 1 56 56 CYS CA C 13 62.894 0.313 . 1 . . 368 . . 56 CYS CA . 19164 1 686 . 1 1 56 56 CYS CB C 13 41.844 0.313 . 1 . . 369 . . 56 CYS CB . 19164 1 687 . 1 1 56 56 CYS N N 15 115.995 0.125 . 1 . . 205 . . 56 CYS N . 19164 1 688 . 1 1 57 57 TYR H H 1 7.918 0.043 . 1 . . 65 . . 57 TYR H . 19164 1 689 . 1 1 57 57 TYR HA H 1 4.154 0.043 . 1 . . 394 . . 57 TYR HA . 19164 1 690 . 1 1 57 57 TYR HB2 H 1 3.064 0.043 . 1 . . 396 . . 57 TYR HB2 . 19164 1 691 . 1 1 57 57 TYR HB3 H 1 2.930 0.043 . 1 . . 517 . . 57 TYR HB3 . 19164 1 692 . 1 1 57 57 TYR HD1 H 1 6.738 0.043 . 3 . . 904 . . 57 TYR HD1 . 19164 1 693 . 1 1 57 57 TYR HD2 H 1 6.738 0.043 . 3 . . 905 . . 57 TYR HD2 . 19164 1 694 . 1 1 57 57 TYR HE1 H 1 6.749 0.043 . 3 . . 908 . . 57 TYR HE1 . 19164 1 695 . 1 1 57 57 TYR HE2 H 1 6.749 0.043 . 3 . . 909 . . 57 TYR HE2 . 19164 1 696 . 1 1 57 57 TYR C C 13 179.383 0.313 . 1 . . 1594 . . 57 TYR C . 19164 1 697 . 1 1 57 57 TYR CA C 13 61.217 0.313 . 1 . . 393 . . 57 TYR CA . 19164 1 698 . 1 1 57 57 TYR CB C 13 36.898 0.313 . 1 . . 392 . . 57 TYR CB . 19164 1 699 . 1 1 57 57 TYR CD1 C 13 133.131 0.313 . 3 . . 906 . . 57 TYR CD1 . 19164 1 700 . 1 1 57 57 TYR CD2 C 13 133.131 0.313 . 3 . . 907 . . 57 TYR CD2 . 19164 1 701 . 1 1 57 57 TYR CE1 C 13 117.886 0.313 . 3 . . 1712 . . 57 TYR CE1 . 19164 1 702 . 1 1 57 57 TYR CE2 C 13 117.886 0.313 . 3 . . 1713 . . 57 TYR CE2 . 19164 1 703 . 1 1 57 57 TYR N N 15 121.867 0.125 . 1 . . 66 . . 57 TYR N . 19164 1 704 . 1 1 58 58 TYR H H 1 8.336 0.043 . 1 . . 111 . . 58 TYR H . 19164 1 705 . 1 1 58 58 TYR HA H 1 4.378 0.043 . 1 . . 395 . . 58 TYR HA . 19164 1 706 . 1 1 58 58 TYR HB2 H 1 3.105 0.043 . 1 . . 554 . . 58 TYR HB2 . 19164 1 707 . 1 1 58 58 TYR HB3 H 1 3.007 0.043 . 1 . . 397 . . 58 TYR HB3 . 19164 1 708 . 1 1 58 58 TYR HD1 H 1 7.018 0.043 . 3 . . 910 . . 58 TYR HD1 . 19164 1 709 . 1 1 58 58 TYR HD2 H 1 7.018 0.043 . 3 . . 911 . . 58 TYR HD2 . 19164 1 710 . 1 1 58 58 TYR HE1 H 1 6.741 0.043 . 3 . . 914 . . 58 TYR HE1 . 19164 1 711 . 1 1 58 58 TYR HE2 H 1 6.741 0.043 . 3 . . 915 . . 58 TYR HE2 . 19164 1 712 . 1 1 58 58 TYR C C 13 177.927 0.313 . 1 . . 1595 . . 58 TYR C . 19164 1 713 . 1 1 58 58 TYR CA C 13 58.920 0.313 . 1 . . 341 . . 58 TYR CA . 19164 1 714 . 1 1 58 58 TYR CB C 13 37.927 0.313 . 1 . . 340 . . 58 TYR CB . 19164 1 715 . 1 1 58 58 TYR CD1 C 13 131.761 0.313 . 3 . . 912 . . 58 TYR CD1 . 19164 1 716 . 1 1 58 58 TYR CD2 C 13 131.761 0.313 . 3 . . 913 . . 58 TYR CD2 . 19164 1 717 . 1 1 58 58 TYR CE1 C 13 117.945 0.313 . 3 . . 1714 . . 58 TYR CE1 . 19164 1 718 . 1 1 58 58 TYR CE2 C 13 117.945 0.313 . 3 . . 1715 . . 58 TYR CE2 . 19164 1 719 . 1 1 58 58 TYR N N 15 122.003 0.125 . 1 . . 112 . . 58 TYR N . 19164 1 720 . 1 1 59 59 LEU H H 1 8.078 0.043 . 1 . . 47 . . 59 LEU H . 19164 1 721 . 1 1 59 59 LEU HA H 1 4.127 0.043 . 1 . . 199 . . 59 LEU HA . 19164 1 722 . 1 1 59 59 LEU HB2 H 1 1.854 0.043 . 1 . . 454 . . 59 LEU HB2 . 19164 1 723 . 1 1 59 59 LEU HB3 H 1 1.495 0.043 . 1 . . 453 . . 59 LEU HB3 . 19164 1 724 . 1 1 59 59 LEU HG H 1 2.077 0.043 . 1 . . 459 . . 59 LEU HG . 19164 1 725 . 1 1 59 59 LEU HD11 H 1 0.780 0.043 . 1 . . 455 . . 59 LEU HD11 . 19164 1 726 . 1 1 59 59 LEU HD12 H 1 0.780 0.043 . 1 . . 455 . . 59 LEU HD12 . 19164 1 727 . 1 1 59 59 LEU HD13 H 1 0.780 0.043 . 1 . . 455 . . 59 LEU HD13 . 19164 1 728 . 1 1 59 59 LEU HD21 H 1 0.790 0.043 . 1 . . 457 . . 59 LEU HD21 . 19164 1 729 . 1 1 59 59 LEU HD22 H 1 0.790 0.043 . 1 . . 457 . . 59 LEU HD22 . 19164 1 730 . 1 1 59 59 LEU HD23 H 1 0.790 0.043 . 1 . . 457 . . 59 LEU HD23 . 19164 1 731 . 1 1 59 59 LEU C C 13 175.401 0.313 . 1 . . 1596 . . 59 LEU C . 19164 1 732 . 1 1 59 59 LEU CA C 13 55.048 0.313 . 1 . . 419 . . 59 LEU CA . 19164 1 733 . 1 1 59 59 LEU CB C 13 41.817 0.313 . 1 . . 418 . . 59 LEU CB . 19164 1 734 . 1 1 59 59 LEU CG C 13 25.724 0.313 . 1 . . 460 . . 59 LEU CG . 19164 1 735 . 1 1 59 59 LEU CD1 C 13 25.206 0.313 . 1 . . 456 . . 59 LEU CD1 . 19164 1 736 . 1 1 59 59 LEU CD2 C 13 22.867 0.313 . 1 . . 458 . . 59 LEU CD2 . 19164 1 737 . 1 1 59 59 LEU N N 15 114.500 0.125 . 1 . . 48 . . 59 LEU N . 19164 1 738 . 1 1 60 60 GLY H H 1 7.561 0.043 . 1 . . 11 . . 60 GLY H . 19164 1 739 . 1 1 60 60 GLY HA2 H 1 4.252 0.043 . 1 . . 26 . . 60 GLY HA2 . 19164 1 740 . 1 1 60 60 GLY HA3 H 1 3.664 0.043 . 1 . . 316 . . 60 GLY HA3 . 19164 1 741 . 1 1 60 60 GLY C C 13 174.821 0.313 . 1 . . 1597 . . 60 GLY C . 19164 1 742 . 1 1 60 60 GLY CA C 13 45.528 0.313 . 1 . . 15 . . 60 GLY CA . 19164 1 743 . 1 1 60 60 GLY N N 15 102.642 0.125 . 1 . . 12 . . 60 GLY N . 19164 1 744 . 1 1 61 61 ALA H H 1 7.996 0.043 . 1 . . 135 . . 61 ALA H . 19164 1 745 . 1 1 61 61 ALA HA H 1 4.411 0.043 . 1 . . 285 . . 61 ALA HA . 19164 1 746 . 1 1 61 61 ALA HB1 H 1 1.324 0.043 . 1 . . 284 . . 61 ALA HB1 . 19164 1 747 . 1 1 61 61 ALA HB2 H 1 1.324 0.043 . 1 . . 284 . . 61 ALA HB2 . 19164 1 748 . 1 1 61 61 ALA HB3 H 1 1.324 0.043 . 1 . . 284 . . 61 ALA HB3 . 19164 1 749 . 1 1 61 61 ALA C C 13 175.615 0.313 . 1 . . 1598 . . 61 ALA C . 19164 1 750 . 1 1 61 61 ALA CA C 13 51.173 0.313 . 1 . . 429 . . 61 ALA CA . 19164 1 751 . 1 1 61 61 ALA CB C 13 20.173 0.313 . 1 . . 428 . . 61 ALA CB . 19164 1 752 . 1 1 61 61 ALA N N 15 120.391 0.125 . 1 . . 136 . . 61 ALA N . 19164 1 753 . 1 1 62 62 THR H H 1 7.156 0.043 . 1 . . 13 . . 62 THR H . 19164 1 754 . 1 1 62 62 THR HA H 1 4.530 0.043 . 1 . . 191 . . 62 THR HA . 19164 1 755 . 1 1 62 62 THR HB H 1 4.425 0.043 . 1 . . 496 . . 62 THR HB . 19164 1 756 . 1 1 62 62 THR HG21 H 1 1.009 0.043 . 1 . . 495 . . 62 THR HG21 . 19164 1 757 . 1 1 62 62 THR HG22 H 1 1.009 0.043 . 1 . . 495 . . 62 THR HG22 . 19164 1 758 . 1 1 62 62 THR HG23 H 1 1.009 0.043 . 1 . . 495 . . 62 THR HG23 . 19164 1 759 . 1 1 62 62 THR C C 13 175.320 0.313 . 1 . . 1599 . . 62 THR C . 19164 1 760 . 1 1 62 62 THR CA C 13 59.908 0.313 . 1 . . 401 . . 62 THR CA . 19164 1 761 . 1 1 62 62 THR CB C 13 70.419 0.313 . 1 . . 402 . . 62 THR CB . 19164 1 762 . 1 1 62 62 THR CG2 C 13 21.889 0.313 . 1 . . 497 . . 62 THR CG2 . 19164 1 763 . 1 1 62 62 THR N N 15 106.938 0.125 . 1 . . 14 . . 62 THR N . 19164 1 764 . 1 1 63 63 LYS H H 1 8.628 0.043 . 1 . . 103 . . 63 LYS H . 19164 1 765 . 1 1 63 63 LYS HA H 1 4.110 0.043 . 1 . . 301 . . 63 LYS HA . 19164 1 766 . 1 1 63 63 LYS HB2 H 1 1.860 0.043 . 1 . . 1758 . . 63 LYS HB2 . 19164 1 767 . 1 1 63 63 LYS HB3 H 1 1.860 0.043 . 1 . . 551 . . 63 LYS HB3 . 19164 1 768 . 1 1 63 63 LYS HG2 H 1 1.463 0.043 . 1 . . 1761 . . 63 LYS HG2 . 19164 1 769 . 1 1 63 63 LYS HG3 H 1 1.463 0.043 . 1 . . 552 . . 63 LYS HG3 . 19164 1 770 . 1 1 63 63 LYS HD2 H 1 1.690 0.043 . 1 . . 1759 . . 63 LYS HD2 . 19164 1 771 . 1 1 63 63 LYS HD3 H 1 1.690 0.043 . 1 . . 600 . . 63 LYS HD3 . 19164 1 772 . 1 1 63 63 LYS HE2 H 1 3.000 0.043 . 1 . . 1760 . . 63 LYS HE2 . 19164 1 773 . 1 1 63 63 LYS HE3 H 1 3.000 0.043 . 1 . . 599 . . 63 LYS HE3 . 19164 1 774 . 1 1 63 63 LYS C C 13 176.684 0.313 . 1 . . 1600 . . 63 LYS C . 19164 1 775 . 1 1 63 63 LYS CA C 13 58.140 0.313 . 1 . . 404 . . 63 LYS CA . 19164 1 776 . 1 1 63 63 LYS CB C 13 32.037 0.313 . 1 . . 403 . . 63 LYS CB . 19164 1 777 . 1 1 63 63 LYS CG C 13 24.415 0.313 . 1 . . 553 . . 63 LYS CG . 19164 1 778 . 1 1 63 63 LYS CD C 13 29.067 0.313 . 1 . . 601 . . 63 LYS CD . 19164 1 779 . 1 1 63 63 LYS CE C 13 42.031 0.313 . 1 . . 602 . . 63 LYS CE . 19164 1 780 . 1 1 63 63 LYS N N 15 121.357 0.125 . 1 . . 104 . . 63 LYS N . 19164 1 781 . 1 1 64 64 ASP H H 1 8.447 0.043 . 1 . . 121 . . 64 ASP H . 19164 1 782 . 1 1 64 64 ASP HA H 1 4.571 0.043 . 1 . . 300 . . 64 ASP HA . 19164 1 783 . 1 1 64 64 ASP HB2 H 1 2.784 0.043 . 1 . . 1762 . . 64 ASP HB2 . 19164 1 784 . 1 1 64 64 ASP HB3 H 1 2.784 0.043 . 1 . . 299 . . 64 ASP HB3 . 19164 1 785 . 1 1 64 64 ASP C C 13 175.167 0.313 . 1 . . 1601 . . 64 ASP C . 19164 1 786 . 1 1 64 64 ASP CA C 13 53.794 0.313 . 1 . . 343 . . 64 ASP CA . 19164 1 787 . 1 1 64 64 ASP CB C 13 40.091 0.313 . 1 . . 344 . . 64 ASP CB . 19164 1 788 . 1 1 64 64 ASP N N 15 116.498 0.125 . 1 . . 122 . . 64 ASP N . 19164 1 789 . 1 1 65 65 ALA H H 1 7.368 0.043 . 1 . . 53 . . 65 ALA H . 19164 1 790 . 1 1 65 65 ALA HA H 1 4.095 0.043 . 1 . . 200 . . 65 ALA HA . 19164 1 791 . 1 1 65 65 ALA HB1 H 1 1.347 0.043 . 1 . . 201 . . 65 ALA HB1 . 19164 1 792 . 1 1 65 65 ALA HB2 H 1 1.347 0.043 . 1 . . 201 . . 65 ALA HB2 . 19164 1 793 . 1 1 65 65 ALA HB3 H 1 1.347 0.043 . 1 . . 201 . . 65 ALA HB3 . 19164 1 794 . 1 1 65 65 ALA C C 13 176.919 0.313 . 1 . . 1602 . . 65 ALA C . 19164 1 795 . 1 1 65 65 ALA CA C 13 52.549 0.313 . 1 . . 55 . . 65 ALA CA . 19164 1 796 . 1 1 65 65 ALA CB C 13 19.483 0.313 . 1 . . 56 . . 65 ALA CB . 19164 1 797 . 1 1 65 65 ALA N N 15 122.578 0.125 . 1 . . 54 . . 65 ALA N . 19164 1 798 . 1 1 66 66 ALA H H 1 8.309 0.043 . 1 . . 31 . . 66 ALA H . 19164 1 799 . 1 1 66 66 ALA HA H 1 4.459 0.043 . 1 . . 195 . . 66 ALA HA . 19164 1 800 . 1 1 66 66 ALA HB1 H 1 1.427 0.043 . 1 . . 194 . . 66 ALA HB1 . 19164 1 801 . 1 1 66 66 ALA HB2 H 1 1.427 0.043 . 1 . . 194 . . 66 ALA HB2 . 19164 1 802 . 1 1 66 66 ALA HB3 H 1 1.427 0.043 . 1 . . 194 . . 66 ALA HB3 . 19164 1 803 . 1 1 66 66 ALA C C 13 177.764 0.313 . 1 . . 1603 . . 66 ALA C . 19164 1 804 . 1 1 66 66 ALA CA C 13 52.572 0.313 . 1 . . 406 . . 66 ALA CA . 19164 1 805 . 1 1 66 66 ALA CB C 13 19.268 0.313 . 1 . . 405 . . 66 ALA CB . 19164 1 806 . 1 1 66 66 ALA N N 15 124.269 0.125 . 1 . . 32 . . 66 ALA N . 19164 1 807 . 1 1 67 67 THR H H 1 7.734 0.043 . 1 . . 145 . . 67 THR H . 19164 1 808 . 1 1 67 67 THR HA H 1 4.501 0.043 . 1 . . 289 . . 67 THR HA . 19164 1 809 . 1 1 67 67 THR HB H 1 4.295 0.043 . 1 . . 498 . . 67 THR HB . 19164 1 810 . 1 1 67 67 THR HG21 H 1 1.217 0.043 . 1 . . 358 . . 67 THR HG21 . 19164 1 811 . 1 1 67 67 THR HG22 H 1 1.217 0.043 . 1 . . 358 . . 67 THR HG22 . 19164 1 812 . 1 1 67 67 THR HG23 H 1 1.217 0.043 . 1 . . 358 . . 67 THR HG23 . 19164 1 813 . 1 1 67 67 THR C C 13 174.291 0.313 . 1 . . 1604 . . 67 THR C . 19164 1 814 . 1 1 67 67 THR CA C 13 60.715 0.313 . 1 . . 253 . . 67 THR CA . 19164 1 815 . 1 1 67 67 THR CB C 13 70.072 0.313 . 1 . . 254 . . 67 THR CB . 19164 1 816 . 1 1 67 67 THR CG2 C 13 21.361 0.313 . 1 . . 499 . . 67 THR CG2 . 19164 1 817 . 1 1 67 67 THR N N 15 111.751 0.125 . 1 . . 146 . . 67 THR N . 19164 1 818 . 1 1 68 68 LYS H H 1 8.494 0.043 . 1 . . 441 . . 68 LYS H . 19164 1 819 . 1 1 68 68 LYS HA H 1 4.550 0.043 . 1 . . 444 . . 68 LYS HA . 19164 1 820 . 1 1 68 68 LYS HB2 H 1 1.982 0.043 . 1 . . 726 . . 68 LYS HB2 . 19164 1 821 . 1 1 68 68 LYS HB3 H 1 1.879 0.043 . 1 . . 728 . . 68 LYS HB3 . 19164 1 822 . 1 1 68 68 LYS HG2 H 1 1.493 0.043 . 1 . . 1765 . . 68 LYS HG2 . 19164 1 823 . 1 1 68 68 LYS HG3 H 1 1.493 0.043 . 1 . . 727 . . 68 LYS HG3 . 19164 1 824 . 1 1 68 68 LYS HD2 H 1 1.725 0.043 . 1 . . 1763 . . 68 LYS HD2 . 19164 1 825 . 1 1 68 68 LYS HD3 H 1 1.725 0.043 . 1 . . 731 . . 68 LYS HD3 . 19164 1 826 . 1 1 68 68 LYS HE2 H 1 3.038 0.043 . 1 . . 1764 . . 68 LYS HE2 . 19164 1 827 . 1 1 68 68 LYS HE3 H 1 3.038 0.043 . 1 . . 733 . . 68 LYS HE3 . 19164 1 828 . 1 1 68 68 LYS CA C 13 56.435 0.313 . 1 . . 443 . . 68 LYS CA . 19164 1 829 . 1 1 68 68 LYS CB C 13 32.908 0.313 . 1 . . 729 . . 68 LYS CB . 19164 1 830 . 1 1 68 68 LYS CG C 13 24.596 0.313 . 1 . . 730 . . 68 LYS CG . 19164 1 831 . 1 1 68 68 LYS CD C 13 29.117 0.313 . 1 . . 732 . . 68 LYS CD . 19164 1 832 . 1 1 68 68 LYS CE C 13 42.297 0.313 . 1 . . 734 . . 68 LYS CE . 19164 1 833 . 1 1 68 68 LYS N N 15 121.777 0.125 . 1 . . 442 . . 68 LYS N . 19164 1 834 . 1 1 69 69 ILE HA H 1 4.352 0.043 . 1 . . 821 . . 69 ILE HA . 19164 1 835 . 1 1 69 69 ILE HB H 1 1.989 0.043 . 1 . . 822 . . 69 ILE HB . 19164 1 836 . 1 1 69 69 ILE HG12 H 1 1.502 0.043 . 1 . . 830 . . 69 ILE HG12 . 19164 1 837 . 1 1 69 69 ILE HG13 H 1 1.213 0.043 . 1 . . 829 . . 69 ILE HG13 . 19164 1 838 . 1 1 69 69 ILE HG21 H 1 0.917 0.043 . 1 . . 827 . . 69 ILE HG21 . 19164 1 839 . 1 1 69 69 ILE HG22 H 1 0.917 0.043 . 1 . . 827 . . 69 ILE HG22 . 19164 1 840 . 1 1 69 69 ILE HG23 H 1 0.917 0.043 . 1 . . 827 . . 69 ILE HG23 . 19164 1 841 . 1 1 69 69 ILE HD11 H 1 0.866 0.043 . 1 . . 825 . . 69 ILE HD11 . 19164 1 842 . 1 1 69 69 ILE HD12 H 1 0.866 0.043 . 1 . . 825 . . 69 ILE HD12 . 19164 1 843 . 1 1 69 69 ILE HD13 H 1 0.866 0.043 . 1 . . 825 . . 69 ILE HD13 . 19164 1 844 . 1 1 69 69 ILE CA C 13 61.642 0.313 . 1 . . 820 . . 69 ILE CA . 19164 1 845 . 1 1 69 69 ILE CB C 13 37.673 0.313 . 1 . . 823 . . 69 ILE CB . 19164 1 846 . 1 1 69 69 ILE CG1 C 13 27.805 0.313 . 1 . . 824 . . 69 ILE CG1 . 19164 1 847 . 1 1 69 69 ILE CG2 C 13 17.684 0.313 . 1 . . 828 . . 69 ILE CG2 . 19164 1 848 . 1 1 69 69 ILE CD1 C 13 13.393 0.313 . 1 . . 826 . . 69 ILE CD1 . 19164 1 849 . 1 1 70 70 LEU HA H 1 4.129 0.043 . 1 . . 964 . . 70 LEU HA . 19164 1 850 . 1 1 70 70 LEU HB2 H 1 1.839 0.043 . 1 . . 972 . . 70 LEU HB2 . 19164 1 851 . 1 1 70 70 LEU HB3 H 1 1.664 0.043 . 1 . . 966 . . 70 LEU HB3 . 19164 1 852 . 1 1 70 70 LEU HG H 1 1.742 0.043 . 1 . . 970 . . 70 LEU HG . 19164 1 853 . 1 1 70 70 LEU HD11 H 1 0.896 0.043 . 1 . . 968 . . 70 LEU HD11 . 19164 1 854 . 1 1 70 70 LEU HD12 H 1 0.896 0.043 . 1 . . 968 . . 70 LEU HD12 . 19164 1 855 . 1 1 70 70 LEU HD13 H 1 0.896 0.043 . 1 . . 968 . . 70 LEU HD13 . 19164 1 856 . 1 1 70 70 LEU HD21 H 1 0.854 0.043 . 1 . . 963 . . 70 LEU HD21 . 19164 1 857 . 1 1 70 70 LEU HD22 H 1 0.854 0.043 . 1 . . 963 . . 70 LEU HD22 . 19164 1 858 . 1 1 70 70 LEU HD23 H 1 0.854 0.043 . 1 . . 963 . . 70 LEU HD23 . 19164 1 859 . 1 1 70 70 LEU CA C 13 58.616 0.313 . 1 . . 967 . . 70 LEU CA . 19164 1 860 . 1 1 70 70 LEU CB C 13 41.712 0.313 . 1 . . 969 . . 70 LEU CB . 19164 1 861 . 1 1 70 70 LEU CG C 13 26.796 0.313 . 1 . . 973 . . 70 LEU CG . 19164 1 862 . 1 1 70 70 LEU CD1 C 13 24.927 0.313 . 1 . . 971 . . 70 LEU CD1 . 19164 1 863 . 1 1 70 70 LEU CD2 C 13 25.139 0.313 . 1 . . 965 . . 70 LEU CD2 . 19164 1 864 . 1 1 71 71 SER HA H 1 4.808 0.043 . 1 . . 953 . . 71 SER HA . 19164 1 865 . 1 1 71 71 SER HB2 H 1 3.962 0.043 . 1 . . 1766 . . 71 SER HB2 . 19164 1 866 . 1 1 71 71 SER HB3 H 1 3.962 0.043 . 1 . . 980 . . 71 SER HB3 . 19164 1 867 . 1 1 71 71 SER CA C 13 60.556 0.313 . 1 . . 954 . . 71 SER CA . 19164 1 868 . 1 1 71 71 SER CB C 13 62.582 0.313 . 1 . . 981 . . 71 SER CB . 19164 1 869 . 1 1 72 72 GLU HA H 1 4.274 0.043 . 1 . . 977 . . 72 GLU HA . 19164 1 870 . 1 1 72 72 GLU HB2 H 1 2.090 0.043 . 1 . . 1767 . . 72 GLU HB2 . 19164 1 871 . 1 1 72 72 GLU HB3 H 1 2.090 0.043 . 1 . . 961 . . 72 GLU HB3 . 19164 1 872 . 1 1 72 72 GLU HG2 H 1 2.309 0.043 . 1 . . 1768 . . 72 GLU HG2 . 19164 1 873 . 1 1 72 72 GLU HG3 H 1 2.309 0.043 . 1 . . 960 . . 72 GLU HG3 . 19164 1 874 . 1 1 72 72 GLU C C 13 176.104 0.313 . 1 . . 1605 . . 72 GLU C . 19164 1 875 . 1 1 72 72 GLU CA C 13 56.603 0.313 . 1 . . 978 . . 72 GLU CA . 19164 1 876 . 1 1 72 72 GLU CB C 13 28.140 0.313 . 1 . . 976 . . 72 GLU CB . 19164 1 877 . 1 1 72 72 GLU CG C 13 35.989 0.313 . 1 . . 979 . . 72 GLU CG . 19164 1 878 . 1 1 73 73 VAL H H 1 7.801 0.043 . 1 . . 143 . . 73 VAL H . 19164 1 879 . 1 1 73 73 VAL HA H 1 4.114 0.043 . 1 . . 288 . . 73 VAL HA . 19164 1 880 . 1 1 73 73 VAL HB H 1 2.267 0.043 . 1 . . 770 . . 73 VAL HB . 19164 1 881 . 1 1 73 73 VAL HG11 H 1 1.007 0.043 . 1 . . 772 . . 73 VAL HG11 . 19164 1 882 . 1 1 73 73 VAL HG12 H 1 1.007 0.043 . 1 . . 772 . . 73 VAL HG12 . 19164 1 883 . 1 1 73 73 VAL HG13 H 1 1.007 0.043 . 1 . . 772 . . 73 VAL HG13 . 19164 1 884 . 1 1 73 73 VAL HG21 H 1 1.081 0.043 . 1 . . 771 . . 73 VAL HG21 . 19164 1 885 . 1 1 73 73 VAL HG22 H 1 1.081 0.043 . 1 . . 771 . . 73 VAL HG22 . 19164 1 886 . 1 1 73 73 VAL HG23 H 1 1.081 0.043 . 1 . . 771 . . 73 VAL HG23 . 19164 1 887 . 1 1 73 73 VAL CA C 13 63.610 0.313 . 1 . . 251 . . 73 VAL CA . 19164 1 888 . 1 1 73 73 VAL CB C 13 33.080 0.313 . 1 . . 252 . . 73 VAL CB . 19164 1 889 . 1 1 73 73 VAL CG1 C 13 22.137 0.313 . 1 . . 774 . . 73 VAL CG1 . 19164 1 890 . 1 1 73 73 VAL CG2 C 13 23.451 0.313 . 1 . . 773 . . 73 VAL CG2 . 19164 1 891 . 1 1 73 73 VAL N N 15 114.771 0.125 . 1 . . 144 . . 73 VAL N . 19164 1 892 . 1 1 74 74 THR HA H 1 3.775 0.043 . 1 . . 842 . . 74 THR HA . 19164 1 893 . 1 1 74 74 THR HB H 1 4.218 0.043 . 1 . . 843 . . 74 THR HB . 19164 1 894 . 1 1 74 74 THR HG21 H 1 1.244 0.043 . 1 . . 845 . . 74 THR HG21 . 19164 1 895 . 1 1 74 74 THR HG22 H 1 1.244 0.043 . 1 . . 845 . . 74 THR HG22 . 19164 1 896 . 1 1 74 74 THR HG23 H 1 1.244 0.043 . 1 . . 845 . . 74 THR HG23 . 19164 1 897 . 1 1 74 74 THR CA C 13 65.537 0.313 . 1 . . 844 . . 74 THR CA . 19164 1 898 . 1 1 74 74 THR CB C 13 67.454 0.313 . 1 . . 841 . . 74 THR CB . 19164 1 899 . 1 1 74 74 THR CG2 C 13 22.564 0.313 . 1 . . 846 . . 74 THR CG2 . 19164 1 900 . 1 1 75 75 ARG HA H 1 4.250 0.043 . 1 . . 831 . . 75 ARG HA . 19164 1 901 . 1 1 75 75 ARG HB2 H 1 1.856 0.043 . 1 . . 833 . . 75 ARG HB2 . 19164 1 902 . 1 1 75 75 ARG HB3 H 1 1.663 0.043 . 1 . . 835 . . 75 ARG HB3 . 19164 1 903 . 1 1 75 75 ARG HG2 H 1 2.098 0.043 . 1 . . 840 . . 75 ARG HG2 . 19164 1 904 . 1 1 75 75 ARG HG3 H 1 1.991 0.043 . 1 . . 834 . . 75 ARG HG3 . 19164 1 905 . 1 1 75 75 ARG HD2 H 1 3.247 0.043 . 1 . . 1769 . . 75 ARG HD2 . 19164 1 906 . 1 1 75 75 ARG HD3 H 1 3.247 0.043 . 1 . . 836 . . 75 ARG HD3 . 19164 1 907 . 1 1 75 75 ARG CA C 13 61.383 0.313 . 1 . . 832 . . 75 ARG CA . 19164 1 908 . 1 1 75 75 ARG CB C 13 28.572 0.313 . 1 . . 838 . . 75 ARG CB . 19164 1 909 . 1 1 75 75 ARG CG C 13 26.774 0.313 . 1 . . 839 . . 75 ARG CG . 19164 1 910 . 1 1 75 75 ARG CD C 13 43.175 0.313 . 1 . . 837 . . 75 ARG CD . 19164 1 911 . 1 1 76 76 PRO HA H 1 4.492 0.043 . 1 . . 797 . . 76 PRO HA . 19164 1 912 . 1 1 76 76 PRO HB2 H 1 2.502 0.043 . 1 . . 799 . . 76 PRO HB2 . 19164 1 913 . 1 1 76 76 PRO HB3 H 1 1.868 0.043 . 1 . . 798 . . 76 PRO HB3 . 19164 1 914 . 1 1 76 76 PRO HG2 H 1 2.302 0.043 . 1 . . 801 . . 76 PRO HG2 . 19164 1 915 . 1 1 76 76 PRO HG3 H 1 2.035 0.043 . 1 . . 800 . . 76 PRO HG3 . 19164 1 916 . 1 1 76 76 PRO HD2 H 1 3.535 0.043 . 1 . . 1770 . . 76 PRO HD2 . 19164 1 917 . 1 1 76 76 PRO HD3 H 1 3.535 0.043 . 1 . . 803 . . 76 PRO HD3 . 19164 1 918 . 1 1 76 76 PRO C C 13 179.108 0.313 . 1 . . 1606 . . 76 PRO C . 19164 1 919 . 1 1 76 76 PRO CA C 13 65.570 0.313 . 1 . . 796 . . 76 PRO CA . 19164 1 920 . 1 1 76 76 PRO CB C 13 30.892 0.313 . 1 . . 802 . . 76 PRO CB . 19164 1 921 . 1 1 76 76 PRO CG C 13 27.900 0.313 . 1 . . 804 . . 76 PRO CG . 19164 1 922 . 1 1 76 76 PRO CD C 13 50.041 0.313 . 1 . . 805 . . 76 PRO CD . 19164 1 923 . 1 1 77 77 MET H H 1 7.689 0.043 . 1 . . 141 . . 77 MET H . 19164 1 924 . 1 1 77 77 MET HA H 1 4.684 0.043 . 1 . . 356 . . 77 MET HA . 19164 1 925 . 1 1 77 77 MET HB2 H 1 2.195 0.043 . 1 . . 357 . . 77 MET HB2 . 19164 1 926 . 1 1 77 77 MET HB3 H 1 1.900 0.043 . 1 . . 591 . . 77 MET HB3 . 19164 1 927 . 1 1 77 77 MET HG2 H 1 2.946 0.043 . 1 . . 589 . . 77 MET HG2 . 19164 1 928 . 1 1 77 77 MET HG3 H 1 2.288 0.043 . 1 . . 590 . . 77 MET HG3 . 19164 1 929 . 1 1 77 77 MET HE1 H 1 1.572 0.043 . 1 . . 890 . . 77 MET HE1 . 19164 1 930 . 1 1 77 77 MET HE2 H 1 1.572 0.043 . 1 . . 890 . . 77 MET HE2 . 19164 1 931 . 1 1 77 77 MET HE3 H 1 1.572 0.043 . 1 . . 890 . . 77 MET HE3 . 19164 1 932 . 1 1 77 77 MET C C 13 179.413 0.313 . 1 . . 1607 . . 77 MET C . 19164 1 933 . 1 1 77 77 MET CA C 13 59.340 0.313 . 1 . . 355 . . 77 MET CA . 19164 1 934 . 1 1 77 77 MET CB C 13 32.463 0.313 . 1 . . 354 . . 77 MET CB . 19164 1 935 . 1 1 77 77 MET CG C 13 33.559 0.313 . 1 . . 631 . . 77 MET CG . 19164 1 936 . 1 1 77 77 MET CE C 13 17.312 0.313 . 1 . . 891 . . 77 MET CE . 19164 1 937 . 1 1 77 77 MET N N 15 117.629 0.125 . 1 . . 142 . . 77 MET N . 19164 1 938 . 1 1 78 78 SER H H 1 8.281 0.043 . 1 . . 41 . . 78 SER H . 19164 1 939 . 1 1 78 78 SER HA H 1 4.231 0.043 . 1 . . 197 . . 78 SER HA . 19164 1 940 . 1 1 78 78 SER HB2 H 1 4.066 0.043 . 1 . . 633 . . 78 SER HB2 . 19164 1 941 . 1 1 78 78 SER HB3 H 1 3.998 0.043 . 1 . . 632 . . 78 SER HB3 . 19164 1 942 . 1 1 78 78 SER C C 13 174.353 0.313 . 1 . . 1608 . . 78 SER C . 19164 1 943 . 1 1 78 78 SER CA C 13 61.922 0.313 . 1 . . 52 . . 78 SER CA . 19164 1 944 . 1 1 78 78 SER CB C 13 62.406 0.313 . 1 . . 164 . . 78 SER CB . 19164 1 945 . 1 1 78 78 SER N N 15 114.579 0.125 . 1 . . 42 . . 78 SER N . 19164 1 946 . 1 1 79 79 VAL H H 1 6.999 0.043 . 1 . . 85 . . 79 VAL H . 19164 1 947 . 1 1 79 79 VAL HA H 1 4.751 0.043 . 1 . . 311 . . 79 VAL HA . 19164 1 948 . 1 1 79 79 VAL HB H 1 2.626 0.043 . 1 . . 636 . . 79 VAL HB . 19164 1 949 . 1 1 79 79 VAL HG11 H 1 1.032 0.043 . 1 . . 638 . . 79 VAL HG11 . 19164 1 950 . 1 1 79 79 VAL HG12 H 1 1.032 0.043 . 1 . . 638 . . 79 VAL HG12 . 19164 1 951 . 1 1 79 79 VAL HG13 H 1 1.032 0.043 . 1 . . 638 . . 79 VAL HG13 . 19164 1 952 . 1 1 79 79 VAL HG21 H 1 0.974 0.043 . 1 . . 637 . . 79 VAL HG21 . 19164 1 953 . 1 1 79 79 VAL HG22 H 1 0.974 0.043 . 1 . . 637 . . 79 VAL HG22 . 19164 1 954 . 1 1 79 79 VAL HG23 H 1 0.974 0.043 . 1 . . 637 . . 79 VAL HG23 . 19164 1 955 . 1 1 79 79 VAL C C 13 175.809 0.313 . 1 . . 1609 . . 79 VAL C . 19164 1 956 . 1 1 79 79 VAL CA C 13 60.126 0.313 . 1 . . 175 . . 79 VAL CA . 19164 1 957 . 1 1 79 79 VAL CB C 13 30.214 0.313 . 1 . . 176 . . 79 VAL CB . 19164 1 958 . 1 1 79 79 VAL CG1 C 13 18.991 0.313 . 1 . . 639 . . 79 VAL CG1 . 19164 1 959 . 1 1 79 79 VAL CG2 C 13 21.361 0.313 . 1 . . 640 . . 79 VAL CG2 . 19164 1 960 . 1 1 79 79 VAL N N 15 111.333 0.125 . 1 . . 86 . . 79 VAL N . 19164 1 961 . 1 1 80 80 HIS H H 1 8.282 0.043 . 1 . . 123 . . 80 HIS H . 19164 1 962 . 1 1 80 80 HIS HA H 1 4.126 0.043 . 1 . . 345 . . 80 HIS HA . 19164 1 963 . 1 1 80 80 HIS HB2 H 1 3.252 0.043 . 1 . . 1771 . . 80 HIS HB2 . 19164 1 964 . 1 1 80 80 HIS HB3 H 1 3.252 0.043 . 1 . . 641 . . 80 HIS HB3 . 19164 1 965 . 1 1 80 80 HIS C C 13 174.933 0.313 . 1 . . 1610 . . 80 HIS C . 19164 1 966 . 1 1 80 80 HIS CA C 13 56.699 0.313 . 1 . . 243 . . 80 HIS CA . 19164 1 967 . 1 1 80 80 HIS CB C 13 25.836 0.313 . 1 . . 244 . . 80 HIS CB . 19164 1 968 . 1 1 80 80 HIS N N 15 116.748 0.125 . 1 . . 124 . . 80 HIS N . 19164 1 969 . 1 1 81 81 MET H H 1 8.003 0.043 . 1 . . 137 . . 81 MET H . 19164 1 970 . 1 1 81 81 MET HA H 1 4.526 0.043 . 1 . . 642 . . 81 MET HA . 19164 1 971 . 1 1 81 81 MET HB2 H 1 2.022 0.043 . 1 . . 646 . . 81 MET HB2 . 19164 1 972 . 1 1 81 81 MET HB3 H 1 1.616 0.043 . 1 . . 643 . . 81 MET HB3 . 19164 1 973 . 1 1 81 81 MET HG2 H 1 2.739 0.043 . 1 . . 645 . . 81 MET HG2 . 19164 1 974 . 1 1 81 81 MET HG3 H 1 2.698 0.043 . 1 . . 644 . . 81 MET HG3 . 19164 1 975 . 1 1 81 81 MET HE1 H 1 2.090 0.043 . 1 . . 886 . . 81 MET HE1 . 19164 1 976 . 1 1 81 81 MET HE2 H 1 2.090 0.043 . 1 . . 886 . . 81 MET HE2 . 19164 1 977 . 1 1 81 81 MET HE3 H 1 2.090 0.043 . 1 . . 886 . . 81 MET HE3 . 19164 1 978 . 1 1 81 81 MET CA C 13 54.873 0.313 . 1 . . 250 . . 81 MET CA . 19164 1 979 . 1 1 81 81 MET CB C 13 33.214 0.313 . 1 . . 249 . . 81 MET CB . 19164 1 980 . 1 1 81 81 MET CG C 13 31.639 0.313 . 1 . . 647 . . 81 MET CG . 19164 1 981 . 1 1 81 81 MET CE C 13 16.404 0.313 . 1 . . 887 . . 81 MET CE . 19164 1 982 . 1 1 81 81 MET N N 15 121.069 0.125 . 1 . . 138 . . 81 MET N . 19164 1 983 . 1 1 82 82 PRO HA H 1 4.349 0.043 . 1 . . 775 . . 82 PRO HA . 19164 1 984 . 1 1 82 82 PRO HB2 H 1 2.567 0.043 . 1 . . 780 . . 82 PRO HB2 . 19164 1 985 . 1 1 82 82 PRO HB3 H 1 1.886 0.043 . 1 . . 777 . . 82 PRO HB3 . 19164 1 986 . 1 1 82 82 PRO HG2 H 1 2.152 0.043 . 1 . . 1772 . . 82 PRO HG2 . 19164 1 987 . 1 1 82 82 PRO HG3 H 1 2.152 0.043 . 1 . . 779 . . 82 PRO HG3 . 19164 1 988 . 1 1 82 82 PRO HD2 H 1 4.109 0.043 . 1 . . 783 . . 82 PRO HD2 . 19164 1 989 . 1 1 82 82 PRO HD3 H 1 3.602 0.043 . 1 . . 782 . . 82 PRO HD3 . 19164 1 990 . 1 1 82 82 PRO C C 13 177.723 0.313 . 1 . . 1611 . . 82 PRO C . 19164 1 991 . 1 1 82 82 PRO CA C 13 63.092 0.313 . 1 . . 776 . . 82 PRO CA . 19164 1 992 . 1 1 82 82 PRO CB C 13 32.614 0.313 . 1 . . 778 . . 82 PRO CB . 19164 1 993 . 1 1 82 82 PRO CG C 13 27.945 0.313 . 1 . . 781 . . 82 PRO CG . 19164 1 994 . 1 1 82 82 PRO CD C 13 50.992 0.313 . 1 . . 784 . . 82 PRO CD . 19164 1 995 . 1 1 83 83 ALA H H 1 9.188 0.043 . 1 . . 49 . . 83 ALA H . 19164 1 996 . 1 1 83 83 ALA HA H 1 3.956 0.043 . 1 . . 740 . . 83 ALA HA . 19164 1 997 . 1 1 83 83 ALA HB1 H 1 1.615 0.043 . 1 . . 739 . . 83 ALA HB1 . 19164 1 998 . 1 1 83 83 ALA HB2 H 1 1.615 0.043 . 1 . . 739 . . 83 ALA HB2 . 19164 1 999 . 1 1 83 83 ALA HB3 H 1 1.615 0.043 . 1 . . 739 . . 83 ALA HB3 . 19164 1 1000 . 1 1 83 83 ALA C C 13 179.026 0.313 . 1 . . 1612 . . 83 ALA C . 19164 1 1001 . 1 1 83 83 ALA CA C 13 55.876 0.313 . 1 . . 421 . . 83 ALA CA . 19164 1 1002 . 1 1 83 83 ALA CB C 13 19.339 0.313 . 1 . . 420 . . 83 ALA CB . 19164 1 1003 . 1 1 83 83 ALA N N 15 126.626 0.125 . 1 . . 50 . . 83 ALA N . 19164 1 1004 . 1 1 84 84 MET H H 1 9.310 0.043 . 1 . . 1 . . 84 MET H . 19164 1 1005 . 1 1 84 84 MET HA H 1 4.030 0.043 . 1 . . 309 . . 84 MET HA . 19164 1 1006 . 1 1 84 84 MET HB2 H 1 2.115 0.043 . 1 . . 1773 . . 84 MET HB2 . 19164 1 1007 . 1 1 84 84 MET HB3 H 1 2.115 0.043 . 1 . . 737 . . 84 MET HB3 . 19164 1 1008 . 1 1 84 84 MET HG2 H 1 2.702 0.043 . 1 . . 735 . . 84 MET HG2 . 19164 1 1009 . 1 1 84 84 MET HG3 H 1 2.617 0.043 . 1 . . 736 . . 84 MET HG3 . 19164 1 1010 . 1 1 84 84 MET HE1 H 1 2.156 0.043 . 1 . . 888 . . 84 MET HE1 . 19164 1 1011 . 1 1 84 84 MET HE2 H 1 2.156 0.043 . 1 . . 888 . . 84 MET HE2 . 19164 1 1012 . 1 1 84 84 MET HE3 H 1 2.156 0.043 . 1 . . 888 . . 84 MET HE3 . 19164 1 1013 . 1 1 84 84 MET C C 13 177.458 0.313 . 1 . . 1613 . . 84 MET C . 19164 1 1014 . 1 1 84 84 MET CA C 13 58.716 0.313 . 1 . . 413 . . 84 MET CA . 19164 1 1015 . 1 1 84 84 MET CB C 13 32.114 0.313 . 1 . . 738 . . 84 MET CB . 19164 1 1016 . 1 1 84 84 MET CG C 13 32.038 0.313 . 1 . . 412 . . 84 MET CG . 19164 1 1017 . 1 1 84 84 MET CE C 13 17.860 0.313 . 1 . . 889 . . 84 MET CE . 19164 1 1018 . 1 1 84 84 MET N N 15 114.741 0.125 . 1 . . 2 . . 84 MET N . 19164 1 1019 . 1 1 85 85 LYS H H 1 6.985 0.043 . 1 . . 77 . . 85 LYS H . 19164 1 1020 . 1 1 85 85 LYS HA H 1 4.204 0.043 . 1 . . 310 . . 85 LYS HA . 19164 1 1021 . 1 1 85 85 LYS HB2 H 1 1.972 0.043 . 1 . . 1774 . . 85 LYS HB2 . 19164 1 1022 . 1 1 85 85 LYS HB3 H 1 1.972 0.043 . 1 . . 313 . . 85 LYS HB3 . 19164 1 1023 . 1 1 85 85 LYS HG2 H 1 1.625 0.043 . 1 . . 1777 . . 85 LYS HG2 . 19164 1 1024 . 1 1 85 85 LYS HG3 H 1 1.625 0.043 . 1 . . 523 . . 85 LYS HG3 . 19164 1 1025 . 1 1 85 85 LYS HD2 H 1 1.642 0.043 . 1 . . 1775 . . 85 LYS HD2 . 19164 1 1026 . 1 1 85 85 LYS HD3 H 1 1.642 0.043 . 1 . . 571 . . 85 LYS HD3 . 19164 1 1027 . 1 1 85 85 LYS HE2 H 1 3.012 0.043 . 1 . . 1776 . . 85 LYS HE2 . 19164 1 1028 . 1 1 85 85 LYS HE3 H 1 3.012 0.043 . 1 . . 568 . . 85 LYS HE3 . 19164 1 1029 . 1 1 85 85 LYS C C 13 179.434 0.313 . 1 . . 1614 . . 85 LYS C . 19164 1 1030 . 1 1 85 85 LYS CA C 13 57.903 0.313 . 1 . . 170 . . 85 LYS CA . 19164 1 1031 . 1 1 85 85 LYS CB C 13 31.664 0.313 . 1 . . 237 . . 85 LYS CB . 19164 1 1032 . 1 1 85 85 LYS CG C 13 25.141 0.313 . 1 . . 524 . . 85 LYS CG . 19164 1 1033 . 1 1 85 85 LYS CD C 13 28.808 0.313 . 1 . . 570 . . 85 LYS CD . 19164 1 1034 . 1 1 85 85 LYS CE C 13 41.902 0.313 . 1 . . 569 . . 85 LYS CE . 19164 1 1035 . 1 1 85 85 LYS N N 15 116.520 0.125 . 1 . . 78 . . 85 LYS N . 19164 1 1036 . 1 1 86 86 ILE H H 1 7.876 0.043 . 1 . . 139 . . 86 ILE H . 19164 1 1037 . 1 1 86 86 ILE HA H 1 3.624 0.043 . 1 . . 440 . . 86 ILE HA . 19164 1 1038 . 1 1 86 86 ILE HB H 1 2.028 0.043 . 1 . . 741 . . 86 ILE HB . 19164 1 1039 . 1 1 86 86 ILE HG12 H 1 0.887 0.043 . 1 . . 975 . . 86 ILE HG12 . 19164 1 1040 . 1 1 86 86 ILE HG13 H 1 1.746 0.043 . 1 . . 744 . . 86 ILE HG13 . 19164 1 1041 . 1 1 86 86 ILE HG21 H 1 0.977 0.043 . 1 . . 742 . . 86 ILE HG21 . 19164 1 1042 . 1 1 86 86 ILE HG22 H 1 0.977 0.043 . 1 . . 742 . . 86 ILE HG22 . 19164 1 1043 . 1 1 86 86 ILE HG23 H 1 0.977 0.043 . 1 . . 742 . . 86 ILE HG23 . 19164 1 1044 . 1 1 86 86 ILE HD11 H 1 0.937 0.043 . 1 . . 746 . . 86 ILE HD11 . 19164 1 1045 . 1 1 86 86 ILE HD12 H 1 0.937 0.043 . 1 . . 746 . . 86 ILE HD12 . 19164 1 1046 . 1 1 86 86 ILE HD13 H 1 0.937 0.043 . 1 . . 746 . . 86 ILE HD13 . 19164 1 1047 . 1 1 86 86 ILE C C 13 178.589 0.313 . 1 . . 1615 . . 86 ILE C . 19164 1 1048 . 1 1 86 86 ILE CA C 13 66.152 0.313 . 1 . . 286 . . 86 ILE CA . 19164 1 1049 . 1 1 86 86 ILE CB C 13 37.648 0.313 . 1 . . 287 . . 86 ILE CB . 19164 1 1050 . 1 1 86 86 ILE CG1 C 13 28.136 0.313 . 1 . . 745 . . 86 ILE CG1 . 19164 1 1051 . 1 1 86 86 ILE CG2 C 13 17.122 0.313 . 1 . . 743 . . 86 ILE CG2 . 19164 1 1052 . 1 1 86 86 ILE CD1 C 13 13.886 0.313 . 1 . . 747 . . 86 ILE CD1 . 19164 1 1053 . 1 1 86 86 ILE N N 15 120.617 0.125 . 1 . . 140 . . 86 ILE N . 19164 1 1054 . 1 1 87 87 CYS H H 1 8.643 0.043 . 1 . . 97 . . 87 CYS H . 19164 1 1055 . 1 1 87 87 CYS HA H 1 4.088 0.043 . 1 . . 748 . . 87 CYS HA . 19164 1 1056 . 1 1 87 87 CYS HB2 H 1 3.260 0.043 . 1 . . 1340 . . 87 CYS HB2 . 19164 1 1057 . 1 1 87 87 CYS HB3 H 1 2.767 0.043 . 1 . . 1339 . . 87 CYS HB3 . 19164 1 1058 . 1 1 87 87 CYS CA C 13 61.931 0.313 . 1 . . 184 . . 87 CYS CA . 19164 1 1059 . 1 1 87 87 CYS CB C 13 39.716 0.313 . 1 . . 183 . . 87 CYS CB . 19164 1 1060 . 1 1 87 87 CYS N N 15 117.368 0.125 . 1 . . 98 . . 87 CYS N . 19164 1 1061 . 1 1 88 88 GLU H H 1 8.032 0.043 . 1 . . 749 . . 88 GLU H . 19164 1 1062 . 1 1 88 88 GLU HA H 1 3.948 0.043 . 1 . . 751 . . 88 GLU HA . 19164 1 1063 . 1 1 88 88 GLU HB2 H 1 2.214 0.043 . 1 . . 757 . . 88 GLU HB2 . 19164 1 1064 . 1 1 88 88 GLU HB3 H 1 2.092 0.043 . 1 . . 752 . . 88 GLU HB3 . 19164 1 1065 . 1 1 88 88 GLU HG2 H 1 2.551 0.043 . 1 . . 758 . . 88 GLU HG2 . 19164 1 1066 . 1 1 88 88 GLU HG3 H 1 2.274 0.043 . 1 . . 753 . . 88 GLU HG3 . 19164 1 1067 . 1 1 88 88 GLU C C 13 178.904 0.313 . 1 . . 1616 . . 88 GLU C . 19164 1 1068 . 1 1 88 88 GLU CA C 13 59.667 0.313 . 1 . . 755 . . 88 GLU CA . 19164 1 1069 . 1 1 88 88 GLU CB C 13 29.628 0.313 . 1 . . 754 . . 88 GLU CB . 19164 1 1070 . 1 1 88 88 GLU CG C 13 36.631 0.313 . 1 . . 756 . . 88 GLU CG . 19164 1 1071 . 1 1 88 88 GLU N N 15 118.115 0.125 . 1 . . 750 . . 88 GLU N . 19164 1 1072 . 1 1 89 89 LYS H H 1 7.526 0.043 . 1 . . 67 . . 89 LYS H . 19164 1 1073 . 1 1 89 89 LYS HA H 1 4.141 0.043 . 1 . . 228 . . 89 LYS HA . 19164 1 1074 . 1 1 89 89 LYS HB2 H 1 2.097 0.043 . 1 . . 1778 . . 89 LYS HB2 . 19164 1 1075 . 1 1 89 89 LYS HB3 H 1 2.097 0.043 . 1 . . 229 . . 89 LYS HB3 . 19164 1 1076 . 1 1 89 89 LYS HG2 H 1 1.698 0.043 . 1 . . 672 . . 89 LYS HG2 . 19164 1 1077 . 1 1 89 89 LYS HG3 H 1 1.507 0.043 . 1 . . 519 . . 89 LYS HG3 . 19164 1 1078 . 1 1 89 89 LYS HD2 H 1 1.721 0.043 . 1 . . 1779 . . 89 LYS HD2 . 19164 1 1079 . 1 1 89 89 LYS HD3 H 1 1.721 0.043 . 1 . . 518 . . 89 LYS HD3 . 19164 1 1080 . 1 1 89 89 LYS HE2 H 1 3.063 0.043 . 1 . . 541 . . 89 LYS HE2 . 19164 1 1081 . 1 1 89 89 LYS HE3 H 1 2.995 0.043 . 1 . . 540 . . 89 LYS HE3 . 19164 1 1082 . 1 1 89 89 LYS C C 13 180.004 0.313 . 1 . . 1617 . . 89 LYS C . 19164 1 1083 . 1 1 89 89 LYS CA C 13 59.130 0.313 . 1 . . 211 . . 89 LYS CA . 19164 1 1084 . 1 1 89 89 LYS CB C 13 31.565 0.313 . 1 . . 210 . . 89 LYS CB . 19164 1 1085 . 1 1 89 89 LYS CG C 13 24.940 0.313 . 1 . . 520 . . 89 LYS CG . 19164 1 1086 . 1 1 89 89 LYS CD C 13 28.993 0.313 . 1 . . 539 . . 89 LYS CD . 19164 1 1087 . 1 1 89 89 LYS CE C 13 41.864 0.313 . 1 . . 671 . . 89 LYS CE . 19164 1 1088 . 1 1 89 89 LYS N N 15 119.710 0.125 . 1 . . 68 . . 89 LYS N . 19164 1 1089 . 1 1 90 90 LEU H H 1 8.420 0.043 . 1 . . 113 . . 90 LEU H . 19164 1 1090 . 1 1 90 90 LEU HA H 1 3.971 0.043 . 1 . . 342 . . 90 LEU HA . 19164 1 1091 . 1 1 90 90 LEU HB2 H 1 2.134 0.043 . 1 . . 469 . . 90 LEU HB2 . 19164 1 1092 . 1 1 90 90 LEU HB3 H 1 1.481 0.043 . 1 . . 468 . . 90 LEU HB3 . 19164 1 1093 . 1 1 90 90 LEU HG H 1 2.062 0.043 . 1 . . 470 . . 90 LEU HG . 19164 1 1094 . 1 1 90 90 LEU HD11 H 1 0.872 0.043 . 1 . . 472 . . 90 LEU HD11 . 19164 1 1095 . 1 1 90 90 LEU HD12 H 1 0.872 0.043 . 1 . . 472 . . 90 LEU HD12 . 19164 1 1096 . 1 1 90 90 LEU HD13 H 1 0.872 0.043 . 1 . . 472 . . 90 LEU HD13 . 19164 1 1097 . 1 1 90 90 LEU HD21 H 1 0.750 0.043 . 1 . . 473 . . 90 LEU HD21 . 19164 1 1098 . 1 1 90 90 LEU HD22 H 1 0.750 0.043 . 1 . . 473 . . 90 LEU HD22 . 19164 1 1099 . 1 1 90 90 LEU HD23 H 1 0.750 0.043 . 1 . . 473 . . 90 LEU HD23 . 19164 1 1100 . 1 1 90 90 LEU C C 13 178.599 0.313 . 1 . . 1618 . . 90 LEU C . 19164 1 1101 . 1 1 90 90 LEU CA C 13 57.311 0.313 . 1 . . 239 . . 90 LEU CA . 19164 1 1102 . 1 1 90 90 LEU CB C 13 40.959 0.313 . 1 . . 240 . . 90 LEU CB . 19164 1 1103 . 1 1 90 90 LEU CG C 13 25.989 0.313 . 1 . . 471 . . 90 LEU CG . 19164 1 1104 . 1 1 90 90 LEU CD1 C 13 26.211 0.313 . 1 . . 474 . . 90 LEU CD1 . 19164 1 1105 . 1 1 90 90 LEU CD2 C 13 22.038 0.313 . 1 . . 475 . . 90 LEU CD2 . 19164 1 1106 . 1 1 90 90 LEU N N 15 119.641 0.125 . 1 . . 114 . . 90 LEU N . 19164 1 1107 . 1 1 91 91 LYS H H 1 8.217 0.043 . 1 . . 295 . . 91 LYS H . 19164 1 1108 . 1 1 91 91 LYS HA H 1 3.874 0.043 . 1 . . 661 . . 91 LYS HA . 19164 1 1109 . 1 1 91 91 LYS HB2 H 1 1.951 0.043 . 1 . . 663 . . 91 LYS HB2 . 19164 1 1110 . 1 1 91 91 LYS HB3 H 1 2.300 0.043 . 1 . . 662 . . 91 LYS HB3 . 19164 1 1111 . 1 1 91 91 LYS HG2 H 1 1.381 0.043 . 1 . . 666 . . 91 LYS HG2 . 19164 1 1112 . 1 1 91 91 LYS HG3 H 1 1.505 0.043 . 1 . . 667 . . 91 LYS HG3 . 19164 1 1113 . 1 1 91 91 LYS HD2 H 1 1.754 0.043 . 1 . . 1780 . . 91 LYS HD2 . 19164 1 1114 . 1 1 91 91 LYS HD3 H 1 1.754 0.043 . 1 . . 665 . . 91 LYS HD3 . 19164 1 1115 . 1 1 91 91 LYS HE2 H 1 3.012 0.043 . 1 . . 1781 . . 91 LYS HE2 . 19164 1 1116 . 1 1 91 91 LYS HE3 H 1 3.012 0.043 . 1 . . 664 . . 91 LYS HE3 . 19164 1 1117 . 1 1 91 91 LYS C C 13 177.071 0.313 . 1 . . 1619 . . 91 LYS C . 19164 1 1118 . 1 1 91 91 LYS CA C 13 58.678 0.313 . 1 . . 298 . . 91 LYS CA . 19164 1 1119 . 1 1 91 91 LYS CB C 13 32.257 0.313 . 1 . . 297 . . 91 LYS CB . 19164 1 1120 . 1 1 91 91 LYS CG C 13 25.293 0.313 . 1 . . 670 . . 91 LYS CG . 19164 1 1121 . 1 1 91 91 LYS CD C 13 29.877 0.313 . 1 . . 669 . . 91 LYS CD . 19164 1 1122 . 1 1 91 91 LYS CE C 13 42.013 0.313 . 1 . . 668 . . 91 LYS CE . 19164 1 1123 . 1 1 91 91 LYS N N 15 119.157 0.125 . 1 . . 296 . . 91 LYS N . 19164 1 1124 . 1 1 92 92 LYS H H 1 6.975 0.043 . 1 . . 87 . . 92 LYS H . 19164 1 1125 . 1 1 92 92 LYS HA H 1 4.053 0.043 . 1 . . 261 . . 92 LYS HA . 19164 1 1126 . 1 1 92 92 LYS HB2 H 1 1.896 0.043 . 1 . . 1782 . . 92 LYS HB2 . 19164 1 1127 . 1 1 92 92 LYS HB3 H 1 1.896 0.043 . 1 . . 260 . . 92 LYS HB3 . 19164 1 1128 . 1 1 92 92 LYS HG2 H 1 1.497 0.043 . 1 . . 1785 . . 92 LYS HG2 . 19164 1 1129 . 1 1 92 92 LYS HG3 H 1 1.497 0.043 . 1 . . 527 . . 92 LYS HG3 . 19164 1 1130 . 1 1 92 92 LYS HD2 H 1 1.657 0.043 . 1 . . 1783 . . 92 LYS HD2 . 19164 1 1131 . 1 1 92 92 LYS HD3 H 1 1.657 0.043 . 1 . . 526 . . 92 LYS HD3 . 19164 1 1132 . 1 1 92 92 LYS HE2 H 1 3.032 0.043 . 1 . . 1784 . . 92 LYS HE2 . 19164 1 1133 . 1 1 92 92 LYS HE3 H 1 3.032 0.043 . 1 . . 573 . . 92 LYS HE3 . 19164 1 1134 . 1 1 92 92 LYS C C 13 177.479 0.313 . 1 . . 1620 . . 92 LYS C . 19164 1 1135 . 1 1 92 92 LYS CA C 13 57.350 0.313 . 1 . . 177 . . 92 LYS CA . 19164 1 1136 . 1 1 92 92 LYS CB C 13 31.934 0.313 . 1 . . 262 . . 92 LYS CB . 19164 1 1137 . 1 1 92 92 LYS CG C 13 24.966 0.313 . 1 . . 529 . . 92 LYS CG . 19164 1 1138 . 1 1 92 92 LYS CD C 13 28.929 0.313 . 1 . . 528 . . 92 LYS CD . 19164 1 1139 . 1 1 92 92 LYS CE C 13 42.139 0.313 . 1 . . 574 . . 92 LYS CE . 19164 1 1140 . 1 1 92 92 LYS N N 15 113.688 0.125 . 1 . . 88 . . 92 LYS N . 19164 1 1141 . 1 1 93 93 LEU H H 1 7.448 0.043 . 1 . . 69 . . 93 LEU H . 19164 1 1142 . 1 1 93 93 LEU HA H 1 4.299 0.043 . 1 . . 232 . . 93 LEU HA . 19164 1 1143 . 1 1 93 93 LEU HB2 H 1 1.883 0.043 . 1 . . 312 . . 93 LEU HB2 . 19164 1 1144 . 1 1 93 93 LEU HB3 H 1 1.573 0.043 . 1 . . 521 . . 93 LEU HB3 . 19164 1 1145 . 1 1 93 93 LEU HG H 1 1.759 0.043 . 1 . . 542 . . 93 LEU HG . 19164 1 1146 . 1 1 93 93 LEU HD11 H 1 0.937 0.043 . 1 . . 543 . . 93 LEU HD11 . 19164 1 1147 . 1 1 93 93 LEU HD12 H 1 0.937 0.043 . 1 . . 543 . . 93 LEU HD12 . 19164 1 1148 . 1 1 93 93 LEU HD13 H 1 0.937 0.043 . 1 . . 543 . . 93 LEU HD13 . 19164 1 1149 . 1 1 93 93 LEU HD21 H 1 0.876 0.043 . 1 . . 544 . . 93 LEU HD21 . 19164 1 1150 . 1 1 93 93 LEU HD22 H 1 0.876 0.043 . 1 . . 544 . . 93 LEU HD22 . 19164 1 1151 . 1 1 93 93 LEU HD23 H 1 0.876 0.043 . 1 . . 544 . . 93 LEU HD23 . 19164 1 1152 . 1 1 93 93 LEU C C 13 177.693 0.313 . 1 . . 1621 . . 93 LEU C . 19164 1 1153 . 1 1 93 93 LEU CA C 13 56.126 0.313 . 1 . . 166 . . 93 LEU CA . 19164 1 1154 . 1 1 93 93 LEU CB C 13 42.100 0.313 . 1 . . 167 . . 93 LEU CB . 19164 1 1155 . 1 1 93 93 LEU CG C 13 26.813 0.313 . 1 . . 545 . . 93 LEU CG . 19164 1 1156 . 1 1 93 93 LEU CD1 C 13 25.682 0.313 . 1 . . 546 . . 93 LEU CD1 . 19164 1 1157 . 1 1 93 93 LEU CD2 C 13 22.719 0.313 . 1 . . 547 . . 93 LEU CD2 . 19164 1 1158 . 1 1 93 93 LEU N N 15 119.142 0.125 . 1 . . 70 . . 93 LEU N . 19164 1 1159 . 1 1 94 94 ASP H H 1 7.908 0.043 . 1 . . 208 . . 94 ASP H . 19164 1 1160 . 1 1 94 94 ASP HA H 1 4.566 0.043 . 1 . . 226 . . 94 ASP HA . 19164 1 1161 . 1 1 94 94 ASP HB2 H 1 2.546 0.043 . 1 . . 1786 . . 94 ASP HB2 . 19164 1 1162 . 1 1 94 94 ASP HB3 H 1 2.546 0.043 . 1 . . 227 . . 94 ASP HB3 . 19164 1 1163 . 1 1 94 94 ASP C C 13 176.196 0.313 . 1 . . 1622 . . 94 ASP C . 19164 1 1164 . 1 1 94 94 ASP CA C 13 54.175 0.313 . 1 . . 223 . . 94 ASP CA . 19164 1 1165 . 1 1 94 94 ASP CB C 13 41.033 0.313 . 1 . . 224 . . 94 ASP CB . 19164 1 1166 . 1 1 94 94 ASP N N 15 116.828 0.125 . 1 . . 209 . . 94 ASP N . 19164 1 1167 . 1 1 95 95 SER H H 1 8.902 0.043 . 1 . . 83 . . 95 SER H . 19164 1 1168 . 1 1 95 95 SER HA H 1 4.190 0.043 . 1 . . 333 . . 95 SER HA . 19164 1 1169 . 1 1 95 95 SER HB2 H 1 4.010 0.043 . 1 . . 1787 . . 95 SER HB2 . 19164 1 1170 . 1 1 95 95 SER HB3 H 1 4.010 0.043 . 1 . . 525 . . 95 SER HB3 . 19164 1 1171 . 1 1 95 95 SER C C 13 177.224 0.313 . 1 . . 1623 . . 95 SER C . 19164 1 1172 . 1 1 95 95 SER CA C 13 61.313 0.313 . 1 . . 173 . . 95 SER CA . 19164 1 1173 . 1 1 95 95 SER CB C 13 62.568 0.313 . 1 . . 174 . . 95 SER CB . 19164 1 1174 . 1 1 95 95 SER N N 15 122.474 0.125 . 1 . . 84 . . 95 SER N . 19164 1 1175 . 1 1 96 96 GLN H H 1 8.603 0.043 . 1 . . 107 . . 96 GLN H . 19164 1 1176 . 1 1 96 96 GLN HA H 1 3.870 0.043 . 1 . . 274 . . 96 GLN HA . 19164 1 1177 . 1 1 96 96 GLN HB2 H 1 1.668 0.043 . 1 . . 605 . . 96 GLN HB2 . 19164 1 1178 . 1 1 96 96 GLN HB3 H 1 1.433 0.043 . 1 . . 604 . . 96 GLN HB3 . 19164 1 1179 . 1 1 96 96 GLN HG2 H 1 2.291 0.043 . 1 . . 606 . . 96 GLN HG2 . 19164 1 1180 . 1 1 96 96 GLN HG3 H 1 2.125 0.043 . 1 . . 607 . . 96 GLN HG3 . 19164 1 1181 . 1 1 96 96 GLN HE21 H 1 7.976 0.043 . 1 . . 859 . . 96 GLN HE21 . 19164 1 1182 . 1 1 96 96 GLN HE22 H 1 6.692 0.043 . 1 . . 860 . . 96 GLN HE22 . 19164 1 1183 . 1 1 96 96 GLN C C 13 178.589 0.313 . 1 . . 1624 . . 96 GLN C . 19164 1 1184 . 1 1 96 96 GLN CA C 13 58.185 0.313 . 1 . . 212 . . 96 GLN CA . 19164 1 1185 . 1 1 96 96 GLN CB C 13 28.324 0.313 . 1 . . 213 . . 96 GLN CB . 19164 1 1186 . 1 1 96 96 GLN CG C 13 34.374 0.313 . 1 . . 608 . . 96 GLN CG . 19164 1 1187 . 1 1 96 96 GLN N N 15 120.807 0.125 . 1 . . 108 . . 96 GLN N . 19164 1 1188 . 1 1 96 96 GLN NE2 N 15 113.114 0.125 . 1 . . 858 . . 96 GLN NE2 . 19164 1 1189 . 1 1 97 97 ILE H H 1 7.467 0.043 . 1 . . 73 . . 97 ILE H . 19164 1 1190 . 1 1 97 97 ILE HA H 1 3.413 0.043 . 1 . . 328 . . 97 ILE HA . 19164 1 1191 . 1 1 97 97 ILE HB H 1 1.741 0.043 . 1 . . 563 . . 97 ILE HB . 19164 1 1192 . 1 1 97 97 ILE HG12 H 1 1.557 0.043 . 1 . . 566 . . 97 ILE HG12 . 19164 1 1193 . 1 1 97 97 ILE HG13 H 1 0.929 0.043 . 1 . . 962 . . 97 ILE HG13 . 19164 1 1194 . 1 1 97 97 ILE HG21 H 1 0.871 0.043 . 1 . . 564 . . 97 ILE HG21 . 19164 1 1195 . 1 1 97 97 ILE HG22 H 1 0.871 0.043 . 1 . . 564 . . 97 ILE HG22 . 19164 1 1196 . 1 1 97 97 ILE HG23 H 1 0.871 0.043 . 1 . . 564 . . 97 ILE HG23 . 19164 1 1197 . 1 1 97 97 ILE HD11 H 1 0.972 0.043 . 1 . . 648 . . 97 ILE HD11 . 19164 1 1198 . 1 1 97 97 ILE HD12 H 1 0.972 0.043 . 1 . . 648 . . 97 ILE HD12 . 19164 1 1199 . 1 1 97 97 ILE HD13 H 1 0.972 0.043 . 1 . . 648 . . 97 ILE HD13 . 19164 1 1200 . 1 1 97 97 ILE C C 13 174.475 0.313 . 1 . . 1625 . . 97 ILE C . 19164 1 1201 . 1 1 97 97 ILE CA C 13 65.703 0.313 . 1 . . 168 . . 97 ILE CA . 19164 1 1202 . 1 1 97 97 ILE CB C 13 38.250 0.313 . 1 . . 169 . . 97 ILE CB . 19164 1 1203 . 1 1 97 97 ILE CG1 C 13 31.575 0.313 . 1 . . 567 . . 97 ILE CG1 . 19164 1 1204 . 1 1 97 97 ILE CG2 C 13 16.699 0.313 . 1 . . 649 . . 97 ILE CG2 . 19164 1 1205 . 1 1 97 97 ILE CD1 C 13 14.716 0.313 . 1 . . 565 . . 97 ILE CD1 . 19164 1 1206 . 1 1 97 97 ILE N N 15 117.402 0.125 . 1 . . 74 . . 97 ILE N . 19164 1 1207 . 1 1 98 98 CYS H H 1 7.403 0.043 . 1 . . 45 . . 98 CYS H . 19164 1 1208 . 1 1 98 98 CYS HA H 1 5.071 0.043 . 1 . . 198 . . 98 CYS HA . 19164 1 1209 . 1 1 98 98 CYS HB2 H 1 3.401 0.043 . 1 . . 1788 . . 98 CYS HB2 . 19164 1 1210 . 1 1 98 98 CYS HB3 H 1 3.401 0.043 . 1 . . 514 . . 98 CYS HB3 . 19164 1 1211 . 1 1 98 98 CYS C C 13 173.362 0.313 . 1 . . 1626 . . 98 CYS C . 19164 1 1212 . 1 1 98 98 CYS CA C 13 61.973 0.313 . 1 . . 764 . . 98 CYS CA . 19164 1 1213 . 1 1 98 98 CYS CB C 13 48.586 0.313 . 1 . . 949 . . 98 CYS CB . 19164 1 1214 . 1 1 98 98 CYS N N 15 113.576 0.125 . 1 . . 46 . . 98 CYS N . 19164 1 1215 . 1 1 99 99 GLU H H 1 7.310 0.043 . 1 . . 866 . . 99 GLU H . 19164 1 1216 . 1 1 99 99 GLU HA H 1 4.322 0.043 . 1 . . 882 . . 99 GLU HA . 19164 1 1217 . 1 1 99 99 GLU HB2 H 1 1.943 0.043 . 1 . . 1789 . . 99 GLU HB2 . 19164 1 1218 . 1 1 99 99 GLU HB3 H 1 1.943 0.043 . 1 . . 883 . . 99 GLU HB3 . 19164 1 1219 . 1 1 99 99 GLU HG2 H 1 2.287 0.043 . 1 . . 1790 . . 99 GLU HG2 . 19164 1 1220 . 1 1 99 99 GLU HG3 H 1 2.287 0.043 . 1 . . 884 . . 99 GLU HG3 . 19164 1 1221 . 1 1 99 99 GLU CA C 13 56.726 0.313 . 1 . . 881 . . 99 GLU CA . 19164 1 1222 . 1 1 99 99 GLU CB C 13 29.979 0.313 . 1 . . 880 . . 99 GLU CB . 19164 1 1223 . 1 1 99 99 GLU CG C 13 36.012 0.313 . 1 . . 885 . . 99 GLU CG . 19164 1 1224 . 1 1 99 99 GLU N N 15 119.261 0.125 . 1 . . 867 . . 99 GLU N . 19164 1 1225 . 1 1 100 100 LEU H H 1 6.502 0.043 . 1 . . 158 . . 100 LEU H . 19164 1 1226 . 1 1 100 100 LEU HA H 1 4.298 0.043 . 1 . . 363 . . 100 LEU HA . 19164 1 1227 . 1 1 100 100 LEU HB2 H 1 1.818 0.043 . 1 . . 364 . . 100 LEU HB2 . 19164 1 1228 . 1 1 100 100 LEU HB3 H 1 1.037 0.043 . 1 . . 476 . . 100 LEU HB3 . 19164 1 1229 . 1 1 100 100 LEU HG H 1 2.013 0.043 . 1 . . 477 . . 100 LEU HG . 19164 1 1230 . 1 1 100 100 LEU HD11 H 1 1.028 0.043 . 1 . . 479 . . 100 LEU HD11 . 19164 1 1231 . 1 1 100 100 LEU HD12 H 1 1.028 0.043 . 1 . . 479 . . 100 LEU HD12 . 19164 1 1232 . 1 1 100 100 LEU HD13 H 1 1.028 0.043 . 1 . . 479 . . 100 LEU HD13 . 19164 1 1233 . 1 1 100 100 LEU HD21 H 1 1.011 0.043 . 1 . . 482 . . 100 LEU HD21 . 19164 1 1234 . 1 1 100 100 LEU HD22 H 1 1.011 0.043 . 1 . . 482 . . 100 LEU HD22 . 19164 1 1235 . 1 1 100 100 LEU HD23 H 1 1.011 0.043 . 1 . . 482 . . 100 LEU HD23 . 19164 1 1236 . 1 1 100 100 LEU CA C 13 55.682 0.313 . 1 . . 292 . . 100 LEU CA . 19164 1 1237 . 1 1 100 100 LEU CB C 13 42.682 0.313 . 1 . . 291 . . 100 LEU CB . 19164 1 1238 . 1 1 100 100 LEU CG C 13 25.925 0.313 . 1 . . 478 . . 100 LEU CG . 19164 1 1239 . 1 1 100 100 LEU CD1 C 13 26.587 0.313 . 1 . . 480 . . 100 LEU CD1 . 19164 1 1240 . 1 1 100 100 LEU CD2 C 13 23.731 0.313 . 1 . . 481 . . 100 LEU CD2 . 19164 1 1241 . 1 1 100 100 LEU N N 15 115.779 0.125 . 1 . . 159 . . 100 LEU N . 19164 1 1242 . 1 1 101 101 LYS H H 1 8.740 0.043 . 1 . . 217 . . 101 LYS H . 19164 1 1243 . 1 1 101 101 LYS HA H 1 4.598 0.043 . 1 . . 652 . . 101 LYS HA . 19164 1 1244 . 1 1 101 101 LYS HB2 H 1 2.021 0.043 . 1 . . 653 . . 101 LYS HB2 . 19164 1 1245 . 1 1 101 101 LYS HB3 H 1 1.718 0.043 . 1 . . 660 . . 101 LYS HB3 . 19164 1 1246 . 1 1 101 101 LYS HG2 H 1 1.520 0.043 . 1 . . 1793 . . 101 LYS HG2 . 19164 1 1247 . 1 1 101 101 LYS HG3 H 1 1.520 0.043 . 1 . . 654 . . 101 LYS HG3 . 19164 1 1248 . 1 1 101 101 LYS HD2 H 1 1.700 0.043 . 1 . . 1791 . . 101 LYS HD2 . 19164 1 1249 . 1 1 101 101 LYS HD3 H 1 1.700 0.043 . 1 . . 655 . . 101 LYS HD3 . 19164 1 1250 . 1 1 101 101 LYS HE2 H 1 3.070 0.043 . 1 . . 1792 . . 101 LYS HE2 . 19164 1 1251 . 1 1 101 101 LYS HE3 H 1 3.070 0.043 . 1 . . 656 . . 101 LYS HE3 . 19164 1 1252 . 1 1 101 101 LYS C C 13 175.310 0.313 . 1 . . 1627 . . 101 LYS C . 19164 1 1253 . 1 1 101 101 LYS CA C 13 55.177 0.313 . 1 . . 219 . . 101 LYS CA . 19164 1 1254 . 1 1 101 101 LYS CB C 13 35.632 0.313 . 1 . . 218 . . 101 LYS CB . 19164 1 1255 . 1 1 101 101 LYS CG C 13 24.125 0.313 . 1 . . 657 . . 101 LYS CG . 19164 1 1256 . 1 1 101 101 LYS CD C 13 29.179 0.313 . 1 . . 658 . . 101 LYS CD . 19164 1 1257 . 1 1 101 101 LYS CE C 13 42.160 0.313 . 1 . . 659 . . 101 LYS CE . 19164 1 1258 . 1 1 102 102 TYR H H 1 8.744 0.043 . 1 . . 101 . . 102 TYR H . 19164 1 1259 . 1 1 102 102 TYR HA H 1 4.404 0.043 . 1 . . 271 . . 102 TYR HA . 19164 1 1260 . 1 1 102 102 TYR HB2 H 1 3.164 0.043 . 1 . . 651 . . 102 TYR HB2 . 19164 1 1261 . 1 1 102 102 TYR HB3 H 1 2.756 0.043 . 1 . . 650 . . 102 TYR HB3 . 19164 1 1262 . 1 1 102 102 TYR HD1 H 1 7.254 0.043 . 3 . . 892 . . 102 TYR HD1 . 19164 1 1263 . 1 1 102 102 TYR HD2 H 1 7.254 0.043 . 3 . . 893 . . 102 TYR HD2 . 19164 1 1264 . 1 1 102 102 TYR HE1 H 1 6.833 0.043 . 3 . . 896 . . 102 TYR HE1 . 19164 1 1265 . 1 1 102 102 TYR HE2 H 1 6.833 0.043 . 3 . . 897 . . 102 TYR HE2 . 19164 1 1266 . 1 1 102 102 TYR C C 13 176.888 0.313 . 1 . . 1628 . . 102 TYR C . 19164 1 1267 . 1 1 102 102 TYR CA C 13 59.772 0.313 . 1 . . 187 . . 102 TYR CA . 19164 1 1268 . 1 1 102 102 TYR CB C 13 38.222 0.313 . 1 . . 186 . . 102 TYR CB . 19164 1 1269 . 1 1 102 102 TYR CD1 C 13 133.102 0.313 . 3 . . 894 . . 102 TYR CD1 . 19164 1 1270 . 1 1 102 102 TYR CD2 C 13 133.102 0.313 . 3 . . 895 . . 102 TYR CD2 . 19164 1 1271 . 1 1 102 102 TYR CE1 C 13 118.280 0.313 . 3 . . 1734 . . 102 TYR CE1 . 19164 1 1272 . 1 1 102 102 TYR CE2 C 13 118.280 0.313 . 3 . . 1735 . . 102 TYR CE2 . 19164 1 1273 . 1 1 102 102 TYR N N 15 120.448 0.125 . 1 . . 102 . . 102 TYR N . 19164 1 1274 . 1 1 103 103 GLU H H 1 8.943 0.043 . 1 . . 35 . . 103 GLU H . 19164 1 1275 . 1 1 103 103 GLU HA H 1 4.392 0.043 . 1 . . 196 . . 103 GLU HA . 19164 1 1276 . 1 1 103 103 GLU HB2 H 1 2.142 0.043 . 1 . . 507 . . 103 GLU HB2 . 19164 1 1277 . 1 1 103 103 GLU HB3 H 1 2.056 0.043 . 1 . . 508 . . 103 GLU HB3 . 19164 1 1278 . 1 1 103 103 GLU HG2 H 1 2.379 0.043 . 1 . . 1794 . . 103 GLU HG2 . 19164 1 1279 . 1 1 103 103 GLU HG3 H 1 2.379 0.043 . 1 . . 509 . . 103 GLU HG3 . 19164 1 1280 . 1 1 103 103 GLU C C 13 176.175 0.313 . 1 . . 1629 . . 103 GLU C . 19164 1 1281 . 1 1 103 103 GLU CA C 13 56.327 0.313 . 1 . . 162 . . 103 GLU CA . 19164 1 1282 . 1 1 103 103 GLU CB C 13 30.182 0.313 . 1 . . 163 . . 103 GLU CB . 19164 1 1283 . 1 1 103 103 GLU CG C 13 36.388 0.313 . 1 . . 510 . . 103 GLU CG . 19164 1 1284 . 1 1 103 103 GLU N N 15 121.906 0.125 . 1 . . 36 . . 103 GLU N . 19164 1 1285 . 1 1 104 104 LYS H H 1 8.584 0.043 . 1 . . 1048 . . 104 LYS H . 19164 1 1286 . 1 1 104 104 LYS HA H 1 4.491 0.043 . 1 . . 1113 . . 104 LYS HA . 19164 1 1287 . 1 1 104 104 LYS HB2 H 1 1.847 0.043 . 1 . . 1795 . . 104 LYS HB2 . 19164 1 1288 . 1 1 104 104 LYS HB3 H 1 1.847 0.043 . 1 . . 1214 . . 104 LYS HB3 . 19164 1 1289 . 1 1 104 104 LYS HG2 H 1 1.519 0.043 . 1 . . 1798 . . 104 LYS HG2 . 19164 1 1290 . 1 1 104 104 LYS HG3 H 1 1.519 0.043 . 1 . . 1215 . . 104 LYS HG3 . 19164 1 1291 . 1 1 104 104 LYS HD2 H 1 1.737 0.043 . 1 . . 1796 . . 104 LYS HD2 . 19164 1 1292 . 1 1 104 104 LYS HD3 H 1 1.737 0.043 . 1 . . 1342 . . 104 LYS HD3 . 19164 1 1293 . 1 1 104 104 LYS HE2 H 1 3.038 0.043 . 1 . . 1797 . . 104 LYS HE2 . 19164 1 1294 . 1 1 104 104 LYS HE3 H 1 3.038 0.043 . 1 . . 1344 . . 104 LYS HE3 . 19164 1 1295 . 1 1 104 104 LYS C C 13 176.490 0.313 . 1 . . 1630 . . 104 LYS C . 19164 1 1296 . 1 1 104 104 LYS CA C 13 56.049 0.313 . 1 . . 1051 . . 104 LYS CA . 19164 1 1297 . 1 1 104 104 LYS CB C 13 32.900 0.313 . 1 . . 1050 . . 104 LYS CB . 19164 1 1298 . 1 1 104 104 LYS CG C 13 24.606 0.313 . 1 . . 1341 . . 104 LYS CG . 19164 1 1299 . 1 1 104 104 LYS CD C 13 28.938 0.313 . 1 . . 1343 . . 104 LYS CD . 19164 1 1300 . 1 1 104 104 LYS CE C 13 41.934 0.313 . 1 . . 1345 . . 104 LYS CE . 19164 1 1301 . 1 1 104 104 LYS N N 15 122.902 0.125 . 1 . . 1049 . . 104 LYS N . 19164 1 1302 . 1 1 105 105 THR H H 1 8.290 0.043 . 1 . . 1106 . . 105 THR H . 19164 1 1303 . 1 1 105 105 THR HA H 1 4.423 0.043 . 1 . . 1347 . . 105 THR HA . 19164 1 1304 . 1 1 105 105 THR HB H 1 4.215 0.043 . 1 . . 1346 . . 105 THR HB . 19164 1 1305 . 1 1 105 105 THR HG21 H 1 1.270 0.043 . 1 . . 1348 . . 105 THR HG21 . 19164 1 1306 . 1 1 105 105 THR HG22 H 1 1.270 0.043 . 1 . . 1348 . . 105 THR HG22 . 19164 1 1307 . 1 1 105 105 THR HG23 H 1 1.270 0.043 . 1 . . 1348 . . 105 THR HG23 . 19164 1 1308 . 1 1 105 105 THR C C 13 174.047 0.313 . 1 . . 1631 . . 105 THR C . 19164 1 1309 . 1 1 105 105 THR CA C 13 61.509 0.313 . 1 . . 1232 . . 105 THR CA . 19164 1 1310 . 1 1 105 105 THR CB C 13 69.961 0.313 . 1 . . 1233 . . 105 THR CB . 19164 1 1311 . 1 1 105 105 THR CG2 C 13 21.725 0.313 . 1 . . 1349 . . 105 THR CG2 . 19164 1 1312 . 1 1 105 105 THR N N 15 116.439 0.125 . 1 . . 1107 . . 105 THR N . 19164 1 1313 . 1 1 106 106 LEU H H 1 8.493 0.043 . 1 . . 1040 . . 106 LEU H . 19164 1 1314 . 1 1 106 106 LEU HA H 1 4.381 0.043 . 1 . . 1188 . . 106 LEU HA . 19164 1 1315 . 1 1 106 106 LEU HB2 H 1 1.692 0.043 . 1 . . 1353 . . 106 LEU HB2 . 19164 1 1316 . 1 1 106 106 LEU HB3 H 1 1.650 0.043 . 1 . . 1354 . . 106 LEU HB3 . 19164 1 1317 . 1 1 106 106 LEU HG H 1 1.566 0.043 . 1 . . 1350 . . 106 LEU HG . 19164 1 1318 . 1 1 106 106 LEU HD11 H 1 0.896 0.043 . 1 . . 1799 . . 106 LEU HD11 . 19164 1 1319 . 1 1 106 106 LEU HD12 H 1 0.896 0.043 . 1 . . 1799 . . 106 LEU HD12 . 19164 1 1320 . 1 1 106 106 LEU HD13 H 1 0.896 0.043 . 1 . . 1799 . . 106 LEU HD13 . 19164 1 1321 . 1 1 106 106 LEU HD21 H 1 0.896 0.043 . 1 . . 1352 . . 106 LEU HD21 . 19164 1 1322 . 1 1 106 106 LEU HD22 H 1 0.896 0.043 . 1 . . 1352 . . 106 LEU HD22 . 19164 1 1323 . 1 1 106 106 LEU HD23 H 1 0.896 0.043 . 1 . . 1352 . . 106 LEU HD23 . 19164 1 1324 . 1 1 106 106 LEU C C 13 175.676 0.313 . 1 . . 1632 . . 106 LEU C . 19164 1 1325 . 1 1 106 106 LEU CA C 13 54.994 0.313 . 1 . . 1042 . . 106 LEU CA . 19164 1 1326 . 1 1 106 106 LEU CB C 13 42.997 0.313 . 1 . . 1043 . . 106 LEU CB . 19164 1 1327 . 1 1 106 106 LEU CG C 13 27.026 0.313 . 1 . . 1351 . . 106 LEU CG . 19164 1 1328 . 1 1 106 106 LEU CD1 C 13 24.537 0.313 . 1 . . 1355 . . 106 LEU CD1 . 19164 1 1329 . 1 1 106 106 LEU CD2 C 13 24.524 0.313 . 1 . . 1356 . . 106 LEU CD2 . 19164 1 1330 . 1 1 106 106 LEU N N 15 125.258 0.125 . 1 . . 1041 . . 106 LEU N . 19164 1 1331 . 1 1 107 107 ASP H H 1 8.499 0.043 . 1 . . 1052 . . 107 ASP H . 19164 1 1332 . 1 1 107 107 ASP HA H 1 4.851 0.043 . 1 . . 1185 . . 107 ASP HA . 19164 1 1333 . 1 1 107 107 ASP HB2 H 1 2.886 0.043 . 1 . . 1186 . . 107 ASP HB2 . 19164 1 1334 . 1 1 107 107 ASP HB3 H 1 2.636 0.043 . 1 . . 1187 . . 107 ASP HB3 . 19164 1 1335 . 1 1 107 107 ASP C C 13 176.684 0.313 . 1 . . 1633 . . 107 ASP C . 19164 1 1336 . 1 1 107 107 ASP CA C 13 52.896 0.313 . 1 . . 1055 . . 107 ASP CA . 19164 1 1337 . 1 1 107 107 ASP CB C 13 40.774 0.313 . 1 . . 1054 . . 107 ASP CB . 19164 1 1338 . 1 1 107 107 ASP N N 15 123.915 0.125 . 1 . . 1053 . . 107 ASP N . 19164 1 1339 . 1 1 108 108 LEU H H 1 8.620 0.043 . 1 . . 1018 . . 108 LEU H . 19164 1 1340 . 1 1 108 108 LEU HA H 1 4.231 0.043 . 1 . . 1184 . . 108 LEU HA . 19164 1 1341 . 1 1 108 108 LEU HB2 H 1 1.817 0.043 . 1 . . 1357 . . 108 LEU HB2 . 19164 1 1342 . 1 1 108 108 LEU HB3 H 1 1.710 0.043 . 1 . . 1358 . . 108 LEU HB3 . 19164 1 1343 . 1 1 108 108 LEU HG H 1 1.827 0.043 . 1 . . 1359 . . 108 LEU HG . 19164 1 1344 . 1 1 108 108 LEU HD11 H 1 1.087 0.043 . 1 . . 1361 . . 108 LEU HD11 . 19164 1 1345 . 1 1 108 108 LEU HD12 H 1 1.087 0.043 . 1 . . 1361 . . 108 LEU HD12 . 19164 1 1346 . 1 1 108 108 LEU HD13 H 1 1.087 0.043 . 1 . . 1361 . . 108 LEU HD13 . 19164 1 1347 . 1 1 108 108 LEU HD21 H 1 0.938 0.043 . 1 . . 1363 . . 108 LEU HD21 . 19164 1 1348 . 1 1 108 108 LEU HD22 H 1 0.938 0.043 . 1 . . 1363 . . 108 LEU HD22 . 19164 1 1349 . 1 1 108 108 LEU HD23 H 1 0.938 0.043 . 1 . . 1363 . . 108 LEU HD23 . 19164 1 1350 . 1 1 108 108 LEU C C 13 177.306 0.313 . 1 . . 1634 . . 108 LEU C . 19164 1 1351 . 1 1 108 108 LEU CA C 13 55.966 0.313 . 1 . . 1167 . . 108 LEU CA . 19164 1 1352 . 1 1 108 108 LEU CB C 13 41.467 0.313 . 1 . . 1168 . . 108 LEU CB . 19164 1 1353 . 1 1 108 108 LEU CG C 13 27.077 0.313 . 1 . . 1360 . . 108 LEU CG . 19164 1 1354 . 1 1 108 108 LEU CD1 C 13 25.638 0.313 . 1 . . 1362 . . 108 LEU CD1 . 19164 1 1355 . 1 1 108 108 LEU CD2 C 13 23.600 0.313 . 1 . . 1364 . . 108 LEU CD2 . 19164 1 1356 . 1 1 108 108 LEU N N 15 125.168 0.125 . 1 . . 1019 . . 108 LEU N . 19164 1 1357 . 1 1 109 109 ALA H H 1 8.252 0.043 . 1 . . 1118 . . 109 ALA H . 19164 1 1358 . 1 1 109 109 ALA HA H 1 4.343 0.043 . 1 . . 1366 . . 109 ALA HA . 19164 1 1359 . 1 1 109 109 ALA HB1 H 1 1.516 0.043 . 1 . . 1365 . . 109 ALA HB1 . 19164 1 1360 . 1 1 109 109 ALA HB2 H 1 1.516 0.043 . 1 . . 1365 . . 109 ALA HB2 . 19164 1 1361 . 1 1 109 109 ALA HB3 H 1 1.516 0.043 . 1 . . 1365 . . 109 ALA HB3 . 19164 1 1362 . 1 1 109 109 ALA C C 13 178.711 0.313 . 1 . . 1635 . . 109 ALA C . 19164 1 1363 . 1 1 109 109 ALA CA C 13 53.418 0.313 . 1 . . 1120 . . 109 ALA CA . 19164 1 1364 . 1 1 109 109 ALA CB C 13 18.596 0.313 . 1 . . 1121 . . 109 ALA CB . 19164 1 1365 . 1 1 109 109 ALA N N 15 120.553 0.125 . 1 . . 1119 . . 109 ALA N . 19164 1 1366 . 1 1 110 110 SER H H 1 7.989 0.043 . 1 . . 1028 . . 110 SER H . 19164 1 1367 . 1 1 110 110 SER HA H 1 4.524 0.043 . 1 . . 1245 . . 110 SER HA . 19164 1 1368 . 1 1 110 110 SER HB2 H 1 3.969 0.043 . 1 . . 1367 . . 110 SER HB2 . 19164 1 1369 . 1 1 110 110 SER HB3 H 1 3.929 0.043 . 1 . . 1244 . . 110 SER HB3 . 19164 1 1370 . 1 1 110 110 SER C C 13 174.210 0.313 . 1 . . 1636 . . 110 SER C . 19164 1 1371 . 1 1 110 110 SER CA C 13 58.639 0.313 . 1 . . 1158 . . 110 SER CA . 19164 1 1372 . 1 1 110 110 SER CB C 13 63.990 0.313 . 1 . . 1157 . . 110 SER CB . 19164 1 1373 . 1 1 110 110 SER N N 15 112.098 0.125 . 1 . . 1029 . . 110 SER N . 19164 1 1374 . 1 1 111 111 VAL H H 1 7.550 0.043 . 1 . . 1086 . . 111 VAL H . 19164 1 1375 . 1 1 111 111 VAL HA H 1 4.238 0.043 . 1 . . 1240 . . 111 VAL HA . 19164 1 1376 . 1 1 111 111 VAL HB H 1 2.071 0.043 . 1 . . 1241 . . 111 VAL HB . 19164 1 1377 . 1 1 111 111 VAL HG11 H 1 0.928 0.043 . 1 . . 1243 . . 111 VAL HG11 . 19164 1 1378 . 1 1 111 111 VAL HG12 H 1 0.928 0.043 . 1 . . 1243 . . 111 VAL HG12 . 19164 1 1379 . 1 1 111 111 VAL HG13 H 1 0.928 0.043 . 1 . . 1243 . . 111 VAL HG13 . 19164 1 1380 . 1 1 111 111 VAL HG21 H 1 0.886 0.043 . 1 . . 1242 . . 111 VAL HG21 . 19164 1 1381 . 1 1 111 111 VAL HG22 H 1 0.886 0.043 . 1 . . 1242 . . 111 VAL HG22 . 19164 1 1382 . 1 1 111 111 VAL HG23 H 1 0.886 0.043 . 1 . . 1242 . . 111 VAL HG23 . 19164 1 1383 . 1 1 111 111 VAL C C 13 174.302 0.313 . 1 . . 1637 . . 111 VAL C . 19164 1 1384 . 1 1 111 111 VAL CA C 13 61.206 0.313 . 1 . . 1204 . . 111 VAL CA . 19164 1 1385 . 1 1 111 111 VAL CB C 13 33.427 0.313 . 1 . . 1205 . . 111 VAL CB . 19164 1 1386 . 1 1 111 111 VAL CG1 C 13 20.327 0.313 . 1 . . 1334 . . 111 VAL CG1 . 19164 1 1387 . 1 1 111 111 VAL CG2 C 13 21.115 0.313 . 1 . . 1335 . . 111 VAL CG2 . 19164 1 1388 . 1 1 111 111 VAL N N 15 118.877 0.125 . 1 . . 1087 . . 111 VAL N . 19164 1 1389 . 1 1 112 112 ASP H H 1 8.193 0.043 . 1 . . 1020 . . 112 ASP H . 19164 1 1390 . 1 1 112 112 ASP HA H 1 4.830 0.043 . 1 . . 1313 . . 112 ASP HA . 19164 1 1391 . 1 1 112 112 ASP HB2 H 1 2.846 0.043 . 1 . . 1314 . . 112 ASP HB2 . 19164 1 1392 . 1 1 112 112 ASP HB3 H 1 2.567 0.043 . 1 . . 1315 . . 112 ASP HB3 . 19164 1 1393 . 1 1 112 112 ASP C C 13 177.611 0.313 . 1 . . 1638 . . 112 ASP C . 19164 1 1394 . 1 1 112 112 ASP CA C 13 52.686 0.313 . 1 . . 1151 . . 112 ASP CA . 19164 1 1395 . 1 1 112 112 ASP CB C 13 40.289 0.313 . 1 . . 1150 . . 112 ASP CB . 19164 1 1396 . 1 1 112 112 ASP N N 15 122.432 0.125 . 1 . . 1021 . . 112 ASP N . 19164 1 1397 . 1 1 113 113 LEU H H 1 8.646 0.043 . 1 . . 1014 . . 113 LEU H . 19164 1 1398 . 1 1 113 113 LEU HA H 1 4.045 0.043 . 1 . . 1197 . . 113 LEU HA . 19164 1 1399 . 1 1 113 113 LEU HB2 H 1 1.486 0.043 . 1 . . 1312 . . 113 LEU HB2 . 19164 1 1400 . 1 1 113 113 LEU HB3 H 1 1.842 0.043 . 1 . . 1198 . . 113 LEU HB3 . 19164 1 1401 . 1 1 113 113 LEU HG H 1 1.918 0.043 . 1 . . 1316 . . 113 LEU HG . 19164 1 1402 . 1 1 113 113 LEU HD11 H 1 0.881 0.043 . 1 . . 1368 . . 113 LEU HD11 . 19164 1 1403 . 1 1 113 113 LEU HD12 H 1 0.881 0.043 . 1 . . 1368 . . 113 LEU HD12 . 19164 1 1404 . 1 1 113 113 LEU HD13 H 1 0.881 0.043 . 1 . . 1368 . . 113 LEU HD13 . 19164 1 1405 . 1 1 113 113 LEU HD21 H 1 1.057 0.043 . 1 . . 1310 . . 113 LEU HD21 . 19164 1 1406 . 1 1 113 113 LEU HD22 H 1 1.057 0.043 . 1 . . 1310 . . 113 LEU HD22 . 19164 1 1407 . 1 1 113 113 LEU HD23 H 1 1.057 0.043 . 1 . . 1310 . . 113 LEU HD23 . 19164 1 1408 . 1 1 113 113 LEU C C 13 178.293 0.313 . 1 . . 1639 . . 113 LEU C . 19164 1 1409 . 1 1 113 113 LEU CA C 13 57.259 0.313 . 1 . . 1149 . . 113 LEU CA . 19164 1 1410 . 1 1 113 113 LEU CB C 13 43.119 0.313 . 1 . . 1148 . . 113 LEU CB . 19164 1 1411 . 1 1 113 113 LEU CG C 13 26.940 0.313 . 1 . . 1317 . . 113 LEU CG . 19164 1 1412 . 1 1 113 113 LEU CD1 C 13 23.056 0.313 . 1 . . 1369 . . 113 LEU CD1 . 19164 1 1413 . 1 1 113 113 LEU CD2 C 13 26.715 0.313 . 1 . . 1318 . . 113 LEU CD2 . 19164 1 1414 . 1 1 113 113 LEU N N 15 125.638 0.125 . 1 . . 1015 . . 113 LEU N . 19164 1 1415 . 1 1 114 114 ARG H H 1 8.046 0.043 . 1 . . 1026 . . 114 ARG H . 19164 1 1416 . 1 1 114 114 ARG HA H 1 3.891 0.043 . 1 . . 1170 . . 114 ARG HA . 19164 1 1417 . 1 1 114 114 ARG HB2 H 1 1.962 0.043 . 1 . . 1800 . . 114 ARG HB2 . 19164 1 1418 . 1 1 114 114 ARG HB3 H 1 1.962 0.043 . 1 . . 1171 . . 114 ARG HB3 . 19164 1 1419 . 1 1 114 114 ARG HG2 H 1 1.811 0.043 . 1 . . 1374 . . 114 ARG HG2 . 19164 1 1420 . 1 1 114 114 ARG HG3 H 1 1.722 0.043 . 1 . . 1372 . . 114 ARG HG3 . 19164 1 1421 . 1 1 114 114 ARG HD2 H 1 3.252 0.043 . 1 . . 1801 . . 114 ARG HD2 . 19164 1 1422 . 1 1 114 114 ARG HD3 H 1 3.252 0.043 . 1 . . 1370 . . 114 ARG HD3 . 19164 1 1423 . 1 1 114 114 ARG C C 13 177.723 0.313 . 1 . . 1640 . . 114 ARG C . 19164 1 1424 . 1 1 114 114 ARG CA C 13 58.380 0.313 . 1 . . 1155 . . 114 ARG CA . 19164 1 1425 . 1 1 114 114 ARG CB C 13 29.533 0.313 . 1 . . 1156 . . 114 ARG CB . 19164 1 1426 . 1 1 114 114 ARG CG C 13 28.113 0.313 . 1 . . 1373 . . 114 ARG CG . 19164 1 1427 . 1 1 114 114 ARG CD C 13 43.091 0.313 . 1 . . 1371 . . 114 ARG CD . 19164 1 1428 . 1 1 114 114 ARG N N 15 112.467 0.125 . 1 . . 1027 . . 114 ARG N . 19164 1 1429 . 1 1 115 115 LYS H H 1 7.365 0.043 . 1 . . 1080 . . 115 LYS H . 19164 1 1430 . 1 1 115 115 LYS HA H 1 4.351 0.043 . 1 . . 1178 . . 115 LYS HA . 19164 1 1431 . 1 1 115 115 LYS HB2 H 1 2.050 0.043 . 1 . . 1194 . . 115 LYS HB2 . 19164 1 1432 . 1 1 115 115 LYS HB3 H 1 1.786 0.043 . 1 . . 1195 . . 115 LYS HB3 . 19164 1 1433 . 1 1 115 115 LYS HG2 H 1 1.490 0.043 . 1 . . 1375 . . 115 LYS HG2 . 19164 1 1434 . 1 1 115 115 LYS HG3 H 1 1.377 0.043 . 1 . . 1196 . . 115 LYS HG3 . 19164 1 1435 . 1 1 115 115 LYS HD2 H 1 1.818 0.043 . 1 . . 1378 . . 115 LYS HD2 . 19164 1 1436 . 1 1 115 115 LYS HD3 H 1 1.717 0.043 . 1 . . 1377 . . 115 LYS HD3 . 19164 1 1437 . 1 1 115 115 LYS HE2 H 1 3.034 0.043 . 1 . . 1802 . . 115 LYS HE2 . 19164 1 1438 . 1 1 115 115 LYS HE3 H 1 3.034 0.043 . 1 . . 1380 . . 115 LYS HE3 . 19164 1 1439 . 1 1 115 115 LYS C C 13 176.959 0.313 . 1 . . 1641 . . 115 LYS C . 19164 1 1440 . 1 1 115 115 LYS CA C 13 55.816 0.313 . 1 . . 1082 . . 115 LYS CA . 19164 1 1441 . 1 1 115 115 LYS CB C 13 32.898 0.313 . 1 . . 1083 . . 115 LYS CB . 19164 1 1442 . 1 1 115 115 LYS CG C 13 25.204 0.313 . 1 . . 1376 . . 115 LYS CG . 19164 1 1443 . 1 1 115 115 LYS CD C 13 29.054 0.313 . 1 . . 1379 . . 115 LYS CD . 19164 1 1444 . 1 1 115 115 LYS CE C 13 42.007 0.313 . 1 . . 1381 . . 115 LYS CE . 19164 1 1445 . 1 1 115 115 LYS N N 15 116.345 0.125 . 1 . . 1081 . . 115 LYS N . 19164 1 1446 . 1 1 116 116 MET H H 1 7.185 0.043 . 1 . . 1000 . . 116 MET H . 19164 1 1447 . 1 1 116 116 MET HA H 1 4.338 0.043 . 1 . . 1138 . . 116 MET HA . 19164 1 1448 . 1 1 116 116 MET HB2 H 1 2.071 0.043 . 1 . . 1385 . . 116 MET HB2 . 19164 1 1449 . 1 1 116 116 MET HB3 H 1 2.006 0.043 . 1 . . 1193 . . 116 MET HB3 . 19164 1 1450 . 1 1 116 116 MET HG2 H 1 2.673 0.043 . 1 . . 1384 . . 116 MET HG2 . 19164 1 1451 . 1 1 116 116 MET HG3 H 1 2.495 0.043 . 1 . . 1382 . . 116 MET HG3 . 19164 1 1452 . 1 1 116 116 MET HE1 H 1 1.940 0.043 . 1 . . 1520 . . 116 MET HE1 . 19164 1 1453 . 1 1 116 116 MET HE2 H 1 1.940 0.043 . 1 . . 1520 . . 116 MET HE2 . 19164 1 1454 . 1 1 116 116 MET HE3 H 1 1.940 0.043 . 1 . . 1520 . . 116 MET HE3 . 19164 1 1455 . 1 1 116 116 MET C C 13 175.687 0.313 . 1 . . 1642 . . 116 MET C . 19164 1 1456 . 1 1 116 116 MET CA C 13 56.317 0.313 . 1 . . 1003 . . 116 MET CA . 19164 1 1457 . 1 1 116 116 MET CB C 13 34.047 0.313 . 1 . . 1002 . . 116 MET CB . 19164 1 1458 . 1 1 116 116 MET CG C 13 33.465 0.313 . 1 . . 1383 . . 116 MET CG . 19164 1 1459 . 1 1 116 116 MET CE C 13 17.950 0.313 . 1 . . 1521 . . 116 MET CE . 19164 1 1460 . 1 1 116 116 MET N N 15 119.387 0.125 . 1 . . 1001 . . 116 MET N . 19164 1 1461 . 1 1 117 117 ARG H H 1 8.830 0.043 . 1 . . 1016 . . 117 ARG H . 19164 1 1462 . 1 1 117 117 ARG HA H 1 4.475 0.043 . 1 . . 1321 . . 117 ARG HA . 19164 1 1463 . 1 1 117 117 ARG HB2 H 1 2.173 0.043 . 1 . . 1319 . . 117 ARG HB2 . 19164 1 1464 . 1 1 117 117 ARG HB3 H 1 1.731 0.043 . 1 . . 1320 . . 117 ARG HB3 . 19164 1 1465 . 1 1 117 117 ARG HG2 H 1 1.851 0.043 . 1 . . 1386 . . 117 ARG HG2 . 19164 1 1466 . 1 1 117 117 ARG HG3 H 1 1.795 0.043 . 1 . . 1322 . . 117 ARG HG3 . 19164 1 1467 . 1 1 117 117 ARG HD2 H 1 3.277 0.043 . 1 . . 1323 . . 117 ARG HD2 . 19164 1 1468 . 1 1 117 117 ARG HD3 H 1 3.208 0.043 . 1 . . 1388 . . 117 ARG HD3 . 19164 1 1469 . 1 1 117 117 ARG C C 13 178.680 0.313 . 1 . . 1643 . . 117 ARG C . 19164 1 1470 . 1 1 117 117 ARG CA C 13 54.967 0.313 . 1 . . 1140 . . 117 ARG CA . 19164 1 1471 . 1 1 117 117 ARG CB C 13 30.949 0.313 . 1 . . 1139 . . 117 ARG CB . 19164 1 1472 . 1 1 117 117 ARG CG C 13 27.716 0.313 . 1 . . 1387 . . 117 ARG CG . 19164 1 1473 . 1 1 117 117 ARG CD C 13 43.154 0.313 . 1 . . 1389 . . 117 ARG CD . 19164 1 1474 . 1 1 117 117 ARG N N 15 118.930 0.125 . 1 . . 1017 . . 117 ARG N . 19164 1 1475 . 1 1 118 118 VAL H H 1 9.089 0.043 . 1 . . 1022 . . 118 VAL H . 19164 1 1476 . 1 1 118 118 VAL HA H 1 3.274 0.043 . 1 . . 1324 . . 118 VAL HA . 19164 1 1477 . 1 1 118 118 VAL HB H 1 1.985 0.043 . 1 . . 1325 . . 118 VAL HB . 19164 1 1478 . 1 1 118 118 VAL HG11 H 1 0.985 0.043 . 1 . . 1391 . . 118 VAL HG11 . 19164 1 1479 . 1 1 118 118 VAL HG12 H 1 0.985 0.043 . 1 . . 1391 . . 118 VAL HG12 . 19164 1 1480 . 1 1 118 118 VAL HG13 H 1 0.985 0.043 . 1 . . 1391 . . 118 VAL HG13 . 19164 1 1481 . 1 1 118 118 VAL HG21 H 1 0.575 0.043 . 1 . . 1390 . . 118 VAL HG21 . 19164 1 1482 . 1 1 118 118 VAL HG22 H 1 0.575 0.043 . 1 . . 1390 . . 118 VAL HG22 . 19164 1 1483 . 1 1 118 118 VAL HG23 H 1 0.575 0.043 . 1 . . 1390 . . 118 VAL HG23 . 19164 1 1484 . 1 1 118 118 VAL C C 13 177.244 0.313 . 1 . . 1644 . . 118 VAL C . 19164 1 1485 . 1 1 118 118 VAL CA C 13 67.730 0.313 . 1 . . 1152 . . 118 VAL CA . 19164 1 1486 . 1 1 118 118 VAL CB C 13 30.904 0.313 . 1 . . 1169 . . 118 VAL CB . 19164 1 1487 . 1 1 118 118 VAL CG1 C 13 23.328 0.313 . 1 . . 1393 . . 118 VAL CG1 . 19164 1 1488 . 1 1 118 118 VAL CG2 C 13 20.654 0.313 . 1 . . 1392 . . 118 VAL CG2 . 19164 1 1489 . 1 1 118 118 VAL N N 15 123.410 0.125 . 1 . . 1023 . . 118 VAL N . 19164 1 1490 . 1 1 119 119 ALA H H 1 8.673 0.043 . 1 . . 1032 . . 119 ALA H . 19164 1 1491 . 1 1 119 119 ALA HA H 1 3.875 0.043 . 1 . . 1394 . . 119 ALA HA . 19164 1 1492 . 1 1 119 119 ALA HB1 H 1 1.365 0.043 . 1 . . 1395 . . 119 ALA HB1 . 19164 1 1493 . 1 1 119 119 ALA HB2 H 1 1.365 0.043 . 1 . . 1395 . . 119 ALA HB2 . 19164 1 1494 . 1 1 119 119 ALA HB3 H 1 1.365 0.043 . 1 . . 1395 . . 119 ALA HB3 . 19164 1 1495 . 1 1 119 119 ALA C C 13 180.554 0.313 . 1 . . 1645 . . 119 ALA C . 19164 1 1496 . 1 1 119 119 ALA CA C 13 55.490 0.313 . 1 . . 1162 . . 119 ALA CA . 19164 1 1497 . 1 1 119 119 ALA CB C 13 18.392 0.313 . 1 . . 1161 . . 119 ALA CB . 19164 1 1498 . 1 1 119 119 ALA N N 15 119.201 0.125 . 1 . . 1033 . . 119 ALA N . 19164 1 1499 . 1 1 120 120 GLU H H 1 6.951 0.043 . 1 . . 1068 . . 120 GLU H . 19164 1 1500 . 1 1 120 120 GLU HA H 1 4.029 0.043 . 1 . . 1175 . . 120 GLU HA . 19164 1 1501 . 1 1 120 120 GLU HB2 H 1 2.374 0.043 . 1 . . 1396 . . 120 GLU HB2 . 19164 1 1502 . 1 1 120 120 GLU HB3 H 1 2.080 0.043 . 1 . . 1397 . . 120 GLU HB3 . 19164 1 1503 . 1 1 120 120 GLU HG2 H 1 2.337 0.043 . 1 . . 1400 . . 120 GLU HG2 . 19164 1 1504 . 1 1 120 120 GLU HG3 H 1 2.206 0.043 . 1 . . 1398 . . 120 GLU HG3 . 19164 1 1505 . 1 1 120 120 GLU C C 13 178.864 0.313 . 1 . . 1646 . . 120 GLU C . 19164 1 1506 . 1 1 120 120 GLU CA C 13 58.607 0.313 . 1 . . 1071 . . 120 GLU CA . 19164 1 1507 . 1 1 120 120 GLU CB C 13 30.188 0.313 . 1 . . 1070 . . 120 GLU CB . 19164 1 1508 . 1 1 120 120 GLU CG C 13 37.512 0.313 . 1 . . 1399 . . 120 GLU CG . 19164 1 1509 . 1 1 120 120 GLU N N 15 115.782 0.125 . 1 . . 1069 . . 120 GLU N . 19164 1 1510 . 1 1 121 121 LEU H H 1 7.651 0.043 . 1 . . 1008 . . 121 LEU H . 19164 1 1511 . 1 1 121 121 LEU HA H 1 3.889 0.043 . 1 . . 1199 . . 121 LEU HA . 19164 1 1512 . 1 1 121 121 LEU HB2 H 1 1.741 0.043 . 1 . . 1301 . . 121 LEU HB2 . 19164 1 1513 . 1 1 121 121 LEU HB3 H 1 1.221 0.043 . 1 . . 1300 . . 121 LEU HB3 . 19164 1 1514 . 1 1 121 121 LEU HG H 1 1.671 0.043 . 1 . . 1304 . . 121 LEU HG . 19164 1 1515 . 1 1 121 121 LEU HD11 H 1 0.892 0.043 . 1 . . 1299 . . 121 LEU HD11 . 19164 1 1516 . 1 1 121 121 LEU HD12 H 1 0.892 0.043 . 1 . . 1299 . . 121 LEU HD12 . 19164 1 1517 . 1 1 121 121 LEU HD13 H 1 0.892 0.043 . 1 . . 1299 . . 121 LEU HD13 . 19164 1 1518 . 1 1 121 121 LEU HD21 H 1 0.795 0.043 . 1 . . 1298 . . 121 LEU HD21 . 19164 1 1519 . 1 1 121 121 LEU HD22 H 1 0.795 0.043 . 1 . . 1298 . . 121 LEU HD22 . 19164 1 1520 . 1 1 121 121 LEU HD23 H 1 0.795 0.043 . 1 . . 1298 . . 121 LEU HD23 . 19164 1 1521 . 1 1 121 121 LEU C C 13 178.925 0.313 . 1 . . 1647 . . 121 LEU C . 19164 1 1522 . 1 1 121 121 LEU CA C 13 57.502 0.313 . 1 . . 1084 . . 121 LEU CA . 19164 1 1523 . 1 1 121 121 LEU CB C 13 40.514 0.313 . 1 . . 1085 . . 121 LEU CB . 19164 1 1524 . 1 1 121 121 LEU CG C 13 26.228 0.313 . 1 . . 1303 . . 121 LEU CG . 19164 1 1525 . 1 1 121 121 LEU CD1 C 13 24.207 0.313 . 1 . . 1305 . . 121 LEU CD1 . 19164 1 1526 . 1 1 121 121 LEU CD2 C 13 26.766 0.313 . 1 . . 1302 . . 121 LEU CD2 . 19164 1 1527 . 1 1 121 121 LEU N N 15 121.387 0.125 . 1 . . 1009 . . 121 LEU N . 19164 1 1528 . 1 1 122 122 LYS H H 1 8.463 0.043 . 1 . . 1064 . . 122 LYS H . 19164 1 1529 . 1 1 122 122 LYS HA H 1 3.700 0.043 . 1 . . 1203 . . 122 LYS HA . 19164 1 1530 . 1 1 122 122 LYS HB2 H 1 1.696 0.043 . 1 . . 1403 . . 122 LYS HB2 . 19164 1 1531 . 1 1 122 122 LYS HB3 H 1 1.650 0.043 . 1 . . 1401 . . 122 LYS HB3 . 19164 1 1532 . 1 1 122 122 LYS HG2 H 1 1.226 0.043 . 1 . . 1804 . . 122 LYS HG2 . 19164 1 1533 . 1 1 122 122 LYS HG3 H 1 1.226 0.043 . 1 . . 1404 . . 122 LYS HG3 . 19164 1 1534 . 1 1 122 122 LYS HD2 H 1 1.563 0.043 . 1 . . 1803 . . 122 LYS HD2 . 19164 1 1535 . 1 1 122 122 LYS HD3 H 1 1.563 0.043 . 1 . . 1406 . . 122 LYS HD3 . 19164 1 1536 . 1 1 122 122 LYS HE2 H 1 2.969 0.043 . 1 . . 1409 . . 122 LYS HE2 . 19164 1 1537 . 1 1 122 122 LYS HE3 H 1 2.804 0.043 . 1 . . 1408 . . 122 LYS HE3 . 19164 1 1538 . 1 1 122 122 LYS C C 13 178.874 0.313 . 1 . . 1648 . . 122 LYS C . 19164 1 1539 . 1 1 122 122 LYS CA C 13 60.049 0.313 . 1 . . 1200 . . 122 LYS CA . 19164 1 1540 . 1 1 122 122 LYS CB C 13 32.392 0.313 . 1 . . 1201 . . 122 LYS CB . 19164 1 1541 . 1 1 122 122 LYS CG C 13 26.281 0.313 . 1 . . 1405 . . 122 LYS CG . 19164 1 1542 . 1 1 122 122 LYS CD C 13 29.624 0.313 . 1 . . 1407 . . 122 LYS CD . 19164 1 1543 . 1 1 122 122 LYS CE C 13 41.718 0.313 . 1 . . 1402 . . 122 LYS CE . 19164 1 1544 . 1 1 122 122 LYS N N 15 117.133 0.125 . 1 . . 1065 . . 122 LYS N . 19164 1 1545 . 1 1 123 123 GLN H H 1 7.325 0.043 . 1 . . 1072 . . 123 GLN H . 19164 1 1546 . 1 1 123 123 GLN HA H 1 4.085 0.043 . 1 . . 1176 . . 123 GLN HA . 19164 1 1547 . 1 1 123 123 GLN HB2 H 1 2.175 0.043 . 1 . . 1805 . . 123 GLN HB2 . 19164 1 1548 . 1 1 123 123 GLN HB3 H 1 2.175 0.043 . 1 . . 1177 . . 123 GLN HB3 . 19164 1 1549 . 1 1 123 123 GLN HG2 H 1 2.482 0.043 . 1 . . 1410 . . 123 GLN HG2 . 19164 1 1550 . 1 1 123 123 GLN HG3 H 1 2.418 0.043 . 1 . . 1202 . . 123 GLN HG3 . 19164 1 1551 . 1 1 123 123 GLN HE21 H 1 7.429 0.043 . 1 . . 1535 . . 123 GLN HE21 . 19164 1 1552 . 1 1 123 123 GLN HE22 H 1 6.840 0.043 . 1 . . 1536 . . 123 GLN HE22 . 19164 1 1553 . 1 1 123 123 GLN C C 13 178.436 0.313 . 1 . . 1649 . . 123 GLN C . 19164 1 1554 . 1 1 123 123 GLN CA C 13 58.628 0.313 . 1 . . 1074 . . 123 GLN CA . 19164 1 1555 . 1 1 123 123 GLN CB C 13 27.777 0.313 . 1 . . 1075 . . 123 GLN CB . 19164 1 1556 . 1 1 123 123 GLN CG C 13 33.468 0.313 . 1 . . 1411 . . 123 GLN CG . 19164 1 1557 . 1 1 123 123 GLN N N 15 118.698 0.125 . 1 . . 1073 . . 123 GLN N . 19164 1 1558 . 1 1 123 123 GLN NE2 N 15 111.646 0.125 . 1 . . 1534 . . 123 GLN NE2 . 19164 1 1559 . 1 1 124 124 ILE H H 1 7.388 0.043 . 1 . . 1006 . . 124 ILE H . 19164 1 1560 . 1 1 124 124 ILE HA H 1 3.204 0.043 . 1 . . 1238 . . 124 ILE HA . 19164 1 1561 . 1 1 124 124 ILE HB H 1 1.650 0.043 . 1 . . 1239 . . 124 ILE HB . 19164 1 1562 . 1 1 124 124 ILE HG12 H 1 0.765 0.043 . 1 . . 1806 . . 124 ILE HG12 . 19164 1 1563 . 1 1 124 124 ILE HG13 H 1 0.765 0.043 . 1 . . 1294 . . 124 ILE HG13 . 19164 1 1564 . 1 1 124 124 ILE HG21 H 1 -0.217 0.043 . 1 . . 1292 . . 124 ILE HG21 . 19164 1 1565 . 1 1 124 124 ILE HG22 H 1 -0.217 0.043 . 1 . . 1292 . . 124 ILE HG22 . 19164 1 1566 . 1 1 124 124 ILE HG23 H 1 -0.217 0.043 . 1 . . 1292 . . 124 ILE HG23 . 19164 1 1567 . 1 1 124 124 ILE HD11 H 1 0.710 0.043 . 1 . . 1295 . . 124 ILE HD11 . 19164 1 1568 . 1 1 124 124 ILE HD12 H 1 0.710 0.043 . 1 . . 1295 . . 124 ILE HD12 . 19164 1 1569 . 1 1 124 124 ILE HD13 H 1 0.710 0.043 . 1 . . 1295 . . 124 ILE HD13 . 19164 1 1570 . 1 1 124 124 ILE C C 13 177.835 0.313 . 1 . . 1650 . . 124 ILE C . 19164 1 1571 . 1 1 124 124 ILE CA C 13 65.069 0.313 . 1 . . 1143 . . 124 ILE CA . 19164 1 1572 . 1 1 124 124 ILE CB C 13 37.394 0.313 . 1 . . 1142 . . 124 ILE CB . 19164 1 1573 . 1 1 124 124 ILE CG1 C 13 28.525 0.313 . 1 . . 1297 . . 124 ILE CG1 . 19164 1 1574 . 1 1 124 124 ILE CG2 C 13 15.505 0.313 . 1 . . 1293 . . 124 ILE CG2 . 19164 1 1575 . 1 1 124 124 ILE CD1 C 13 13.668 0.313 . 1 . . 1296 . . 124 ILE CD1 . 19164 1 1576 . 1 1 124 124 ILE N N 15 121.589 0.125 . 1 . . 1007 . . 124 ILE N . 19164 1 1577 . 1 1 125 125 LEU H H 1 7.026 0.043 . 1 . . 878 . . 125 LEU H . 19164 1 1578 . 1 1 125 125 LEU HA H 1 3.647 0.043 . 1 . . 848 . . 125 LEU HA . 19164 1 1579 . 1 1 125 125 LEU HB2 H 1 1.516 0.043 . 1 . . 1248 . . 125 LEU HB2 . 19164 1 1580 . 1 1 125 125 LEU HB3 H 1 1.813 0.043 . 1 . . 849 . . 125 LEU HB3 . 19164 1 1581 . 1 1 125 125 LEU HG H 1 1.074 0.043 . 1 . . 851 . . 125 LEU HG . 19164 1 1582 . 1 1 125 125 LEU HD11 H 1 0.908 0.043 . 1 . . 1414 . . 125 LEU HD11 . 19164 1 1583 . 1 1 125 125 LEU HD12 H 1 0.908 0.043 . 1 . . 1414 . . 125 LEU HD12 . 19164 1 1584 . 1 1 125 125 LEU HD13 H 1 0.908 0.043 . 1 . . 1414 . . 125 LEU HD13 . 19164 1 1585 . 1 1 125 125 LEU HD21 H 1 1.598 0.043 . 1 . . 1416 . . 125 LEU HD21 . 19164 1 1586 . 1 1 125 125 LEU HD22 H 1 1.598 0.043 . 1 . . 1416 . . 125 LEU HD22 . 19164 1 1587 . 1 1 125 125 LEU HD23 H 1 1.598 0.043 . 1 . . 1416 . . 125 LEU HD23 . 19164 1 1588 . 1 1 125 125 LEU C C 13 178.955 0.313 . 1 . . 1651 . . 125 LEU C . 19164 1 1589 . 1 1 125 125 LEU CA C 13 57.929 0.313 . 1 . . 847 . . 125 LEU CA . 19164 1 1590 . 1 1 125 125 LEU CB C 13 40.901 0.313 . 1 . . 850 . . 125 LEU CB . 19164 1 1591 . 1 1 125 125 LEU CG C 13 27.213 0.313 . 1 . . 1412 . . 125 LEU CG . 19164 1 1592 . 1 1 125 125 LEU CD1 C 13 24.240 0.313 . 1 . . 1415 . . 125 LEU CD1 . 19164 1 1593 . 1 1 125 125 LEU CD2 C 13 26.875 0.313 . 1 . . 1413 . . 125 LEU CD2 . 19164 1 1594 . 1 1 125 125 LEU N N 15 117.304 0.125 . 1 . . 879 . . 125 LEU N . 19164 1 1595 . 1 1 126 126 HIS H H 1 8.583 0.043 . 1 . . 1036 . . 126 HIS H . 19164 1 1596 . 1 1 126 126 HIS HA H 1 4.456 0.043 . 1 . . 1250 . . 126 HIS HA . 19164 1 1597 . 1 1 126 126 HIS HB2 H 1 3.272 0.043 . 1 . . 1807 . . 126 HIS HB2 . 19164 1 1598 . 1 1 126 126 HIS HB3 H 1 3.272 0.043 . 1 . . 1249 . . 126 HIS HB3 . 19164 1 1599 . 1 1 126 126 HIS HD2 H 1 7.276 0.043 . 1 . . 1688 . . 126 HIS HD2 . 19164 1 1600 . 1 1 126 126 HIS C C 13 179.085 0.313 . 1 . . 1652 . . 126 HIS C . 19164 1 1601 . 1 1 126 126 HIS CA C 13 58.810 0.313 . 1 . . 1247 . . 126 HIS CA . 19164 1 1602 . 1 1 126 126 HIS CB C 13 28.665 0.313 . 1 . . 1246 . . 126 HIS CB . 19164 1 1603 . 1 1 126 126 HIS CD2 C 13 120.004 0.313 . 1 . . 1689 . . 126 HIS CD2 . 19164 1 1604 . 1 1 126 126 HIS N N 15 117.688 0.125 . 1 . . 1037 . . 126 HIS N . 19164 1 1605 . 1 1 127 127 SER H H 1 8.276 0.043 . 1 . . 1122 . . 127 SER H . 19164 1 1606 . 1 1 127 127 SER HA H 1 4.253 0.043 . 1 . . 1179 . . 127 SER HA . 19164 1 1607 . 1 1 127 127 SER HB2 H 1 3.991 0.043 . 1 . . 1808 . . 127 SER HB2 . 19164 1 1608 . 1 1 127 127 SER HB3 H 1 3.991 0.043 . 1 . . 1251 . . 127 SER HB3 . 19164 1 1609 . 1 1 127 127 SER C C 13 175.238 0.313 . 1 . . 1653 . . 127 SER C . 19164 1 1610 . 1 1 127 127 SER CA C 13 61.483 0.313 . 1 . . 1125 . . 127 SER CA . 19164 1 1611 . 1 1 127 127 SER CB C 13 62.496 0.313 . 1 . . 1124 . . 127 SER CB . 19164 1 1612 . 1 1 127 127 SER N N 15 118.736 0.125 . 1 . . 1123 . . 127 SER N . 19164 1 1613 . 1 1 128 128 TRP H H 1 7.309 0.043 . 1 . . 1094 . . 128 TRP H . 19164 1 1614 . 1 1 128 128 TRP HA H 1 4.714 0.043 . 1 . . 1180 . . 128 TRP HA . 19164 1 1615 . 1 1 128 128 TRP HB2 H 1 2.967 0.043 . 1 . . 1252 . . 128 TRP HB2 . 19164 1 1616 . 1 1 128 128 TRP HB3 H 1 2.470 0.043 . 1 . . 1253 . . 128 TRP HB3 . 19164 1 1617 . 1 1 128 128 TRP HD1 H 1 6.718 0.043 . 1 . . 1698 . . 128 TRP HD1 . 19164 1 1618 . 1 1 128 128 TRP HE1 H 1 9.718 0.043 . 1 . . 1544 . . 128 TRP HE1 . 19164 1 1619 . 1 1 128 128 TRP HE3 H 1 7.031 0.043 . 1 . . 1726 . . 128 TRP HE3 . 19164 1 1620 . 1 1 128 128 TRP HZ2 H 1 7.298 0.043 . 1 . . 1700 . . 128 TRP HZ2 . 19164 1 1621 . 1 1 128 128 TRP HZ3 H 1 7.024 0.043 . 1 . . 1728 . . 128 TRP HZ3 . 19164 1 1622 . 1 1 128 128 TRP HH2 H 1 7.038 0.043 . 1 . . 1702 . . 128 TRP HH2 . 19164 1 1623 . 1 1 128 128 TRP C C 13 176.124 0.313 . 1 . . 1654 . . 128 TRP C . 19164 1 1624 . 1 1 128 128 TRP CA C 13 54.546 0.313 . 1 . . 1096 . . 128 TRP CA . 19164 1 1625 . 1 1 128 128 TRP CB C 13 29.222 0.313 . 1 . . 1097 . . 128 TRP CB . 19164 1 1626 . 1 1 128 128 TRP CD1 C 13 123.043 0.313 . 1 . . 1699 . . 128 TRP CD1 . 19164 1 1627 . 1 1 128 128 TRP CE3 C 13 119.530 0.313 . 1 . . 1727 . . 128 TRP CE3 . 19164 1 1628 . 1 1 128 128 TRP CZ2 C 13 113.549 0.313 . 1 . . 1701 . . 128 TRP CZ2 . 19164 1 1629 . 1 1 128 128 TRP CZ3 C 13 120.505 0.313 . 1 . . 1729 . . 128 TRP CZ3 . 19164 1 1630 . 1 1 128 128 TRP CH2 C 13 122.734 0.313 . 1 . . 1703 . . 128 TRP CH2 . 19164 1 1631 . 1 1 128 128 TRP N N 15 121.861 0.125 . 1 . . 1095 . . 128 TRP N . 19164 1 1632 . 1 1 128 128 TRP NE1 N 15 125.855 0.125 . 1 . . 1543 . . 128 TRP NE1 . 19164 1 1633 . 1 1 129 129 GLY H H 1 8.041 0.043 . 1 . . 997 . . 129 GLY H . 19164 1 1634 . 1 1 129 129 GLY HA2 H 1 4.144 0.043 . 1 . . 1254 . . 129 GLY HA2 . 19164 1 1635 . 1 1 129 129 GLY HA3 H 1 3.847 0.043 . 1 . . 1255 . . 129 GLY HA3 . 19164 1 1636 . 1 1 129 129 GLY C C 13 174.577 0.313 . 1 . . 1655 . . 129 GLY C . 19164 1 1637 . 1 1 129 129 GLY CA C 13 45.580 0.313 . 1 . . 999 . . 129 GLY CA . 19164 1 1638 . 1 1 129 129 GLY N N 15 107.591 0.125 . 1 . . 998 . . 129 GLY N . 19164 1 1639 . 1 1 130 130 GLU H H 1 7.865 0.043 . 1 . . 1218 . . 130 GLU H . 19164 1 1640 . 1 1 130 130 GLU HA H 1 4.701 0.043 . 1 . . 1256 . . 130 GLU HA . 19164 1 1641 . 1 1 130 130 GLU HB2 H 1 2.159 0.043 . 1 . . 1258 . . 130 GLU HB2 . 19164 1 1642 . 1 1 130 130 GLU HB3 H 1 1.722 0.043 . 1 . . 1257 . . 130 GLU HB3 . 19164 1 1643 . 1 1 130 130 GLU HG2 H 1 2.404 0.043 . 1 . . 1329 . . 130 GLU HG2 . 19164 1 1644 . 1 1 130 130 GLU HG3 H 1 2.292 0.043 . 1 . . 1259 . . 130 GLU HG3 . 19164 1 1645 . 1 1 130 130 GLU C C 13 174.740 0.313 . 1 . . 1656 . . 130 GLU C . 19164 1 1646 . 1 1 130 130 GLU CA C 13 54.452 0.313 . 1 . . 1221 . . 130 GLU CA . 19164 1 1647 . 1 1 130 130 GLU CB C 13 32.135 0.313 . 1 . . 1220 . . 130 GLU CB . 19164 1 1648 . 1 1 130 130 GLU CG C 13 34.549 0.313 . 1 . . 1330 . . 130 GLU CG . 19164 1 1649 . 1 1 130 130 GLU N N 15 119.182 0.125 . 1 . . 1219 . . 130 GLU N . 19164 1 1650 . 1 1 131 131 GLU H H 1 8.601 0.043 . 1 . . 1034 . . 131 GLU H . 19164 1 1651 . 1 1 131 131 GLU HA H 1 4.475 0.043 . 1 . . 1212 . . 131 GLU HA . 19164 1 1652 . 1 1 131 131 GLU HB2 H 1 1.996 0.043 . 1 . . 1680 . . 131 GLU HB2 . 19164 1 1653 . 1 1 131 131 GLU HB3 H 1 1.936 0.043 . 1 . . 1213 . . 131 GLU HB3 . 19164 1 1654 . 1 1 131 131 GLU HG2 H 1 2.211 0.043 . 1 . . 1809 . . 131 GLU HG2 . 19164 1 1655 . 1 1 131 131 GLU HG3 H 1 2.211 0.043 . 1 . . 1681 . . 131 GLU HG3 . 19164 1 1656 . 1 1 131 131 GLU CA C 13 54.865 0.313 . 1 . . 1262 . . 131 GLU CA . 19164 1 1657 . 1 1 131 131 GLU CB C 13 32.248 0.313 . 1 . . 1261 . . 131 GLU CB . 19164 1 1658 . 1 1 131 131 GLU CG C 13 35.622 0.313 . 1 . . 1682 . . 131 GLU CG . 19164 1 1659 . 1 1 131 131 GLU N N 15 119.382 0.125 . 1 . . 1035 . . 131 GLU N . 19164 1 1660 . 1 1 133 133 ARG HA H 1 3.830 0.043 . 1 . . 1526 . . 133 ARG HA . 19164 1 1661 . 1 1 133 133 ARG HB2 H 1 1.951 0.043 . 1 . . 1810 . . 133 ARG HB2 . 19164 1 1662 . 1 1 133 133 ARG HB3 H 1 1.951 0.043 . 1 . . 1528 . . 133 ARG HB3 . 19164 1 1663 . 1 1 133 133 ARG HG2 H 1 1.631 0.043 . 1 . . 1812 . . 133 ARG HG2 . 19164 1 1664 . 1 1 133 133 ARG HG3 H 1 1.631 0.043 . 1 . . 1529 . . 133 ARG HG3 . 19164 1 1665 . 1 1 133 133 ARG HD2 H 1 3.049 0.043 . 1 . . 1811 . . 133 ARG HD2 . 19164 1 1666 . 1 1 133 133 ARG HD3 H 1 3.049 0.043 . 1 . . 1532 . . 133 ARG HD3 . 19164 1 1667 . 1 1 133 133 ARG CA C 13 59.874 0.313 . 1 . . 1527 . . 133 ARG CA . 19164 1 1668 . 1 1 133 133 ARG CB C 13 32.065 0.313 . 1 . . 1530 . . 133 ARG CB . 19164 1 1669 . 1 1 133 133 ARG CG C 13 25.118 0.313 . 1 . . 1531 . . 133 ARG CG . 19164 1 1670 . 1 1 133 133 ARG CD C 13 42.326 0.313 . 1 . . 1533 . . 133 ARG CD . 19164 1 1671 . 1 1 134 134 ALA HA H 1 4.343 0.043 . 1 . . 1524 . . 134 ALA HA . 19164 1 1672 . 1 1 134 134 ALA HB1 H 1 1.368 0.043 . 1 . . 1522 . . 134 ALA HB1 . 19164 1 1673 . 1 1 134 134 ALA HB2 H 1 1.368 0.043 . 1 . . 1522 . . 134 ALA HB2 . 19164 1 1674 . 1 1 134 134 ALA HB3 H 1 1.368 0.043 . 1 . . 1522 . . 134 ALA HB3 . 19164 1 1675 . 1 1 134 134 ALA C C 13 176.503 0.313 . 1 . . 1687 . . 134 ALA C . 19164 1 1676 . 1 1 134 134 ALA CA C 13 51.807 0.313 . 1 . . 1525 . . 134 ALA CA . 19164 1 1677 . 1 1 134 134 ALA CB C 13 17.916 0.313 . 1 . . 1523 . . 134 ALA CB . 19164 1 1678 . 1 1 135 135 CYS H H 1 7.566 0.043 . 1 . . 1683 . . 135 CYS H . 19164 1 1679 . 1 1 135 135 CYS HA H 1 4.246 0.043 . 1 . . 1686 . . 135 CYS HA . 19164 1 1680 . 1 1 135 135 CYS HB2 H 1 2.721 0.043 . 1 . . 1813 . . 135 CYS HB2 . 19164 1 1681 . 1 1 135 135 CYS HB3 H 1 2.721 0.043 . 1 . . 1685 . . 135 CYS HB3 . 19164 1 1682 . 1 1 135 135 CYS C C 13 173.059 0.313 . 1 . . 1657 . . 135 CYS C . 19164 1 1683 . 1 1 135 135 CYS N N 15 118.731 0.125 . 1 . . 1684 . . 135 CYS N . 19164 1 1684 . 1 1 136 136 ALA H H 1 9.208 0.043 . 1 . . 1234 . . 136 ALA H . 19164 1 1685 . 1 1 136 136 ALA HA H 1 4.625 0.043 . 1 . . 1265 . . 136 ALA HA . 19164 1 1686 . 1 1 136 136 ALA HB1 H 1 1.505 0.043 . 1 . . 1264 . . 136 ALA HB1 . 19164 1 1687 . 1 1 136 136 ALA HB2 H 1 1.505 0.043 . 1 . . 1264 . . 136 ALA HB2 . 19164 1 1688 . 1 1 136 136 ALA HB3 H 1 1.505 0.043 . 1 . . 1264 . . 136 ALA HB3 . 19164 1 1689 . 1 1 136 136 ALA C C 13 176.858 0.313 . 1 . . 1658 . . 136 ALA C . 19164 1 1690 . 1 1 136 136 ALA CA C 13 53.210 0.313 . 1 . . 1236 . . 136 ALA CA . 19164 1 1691 . 1 1 136 136 ALA CB C 13 21.546 0.313 . 1 . . 1237 . . 136 ALA CB . 19164 1 1692 . 1 1 136 136 ALA N N 15 125.625 0.125 . 1 . . 1235 . . 136 ALA N . 19164 1 1693 . 1 1 137 137 GLU H H 1 8.234 0.043 . 1 . . 1126 . . 137 GLU H . 19164 1 1694 . 1 1 137 137 GLU HA H 1 4.811 0.043 . 1 . . 1208 . . 137 GLU HA . 19164 1 1695 . 1 1 137 137 GLU HB2 H 1 1.962 0.043 . 1 . . 1263 . . 137 GLU HB2 . 19164 1 1696 . 1 1 137 137 GLU HB3 H 1 2.381 0.043 . 1 . . 1418 . . 137 GLU HB3 . 19164 1 1697 . 1 1 137 137 GLU HG2 H 1 2.367 0.043 . 1 . . 1814 . . 137 GLU HG2 . 19164 1 1698 . 1 1 137 137 GLU HG3 H 1 2.367 0.043 . 1 . . 1209 . . 137 GLU HG3 . 19164 1 1699 . 1 1 137 137 GLU CA C 13 54.100 0.313 . 1 . . 1128 . . 137 GLU CA . 19164 1 1700 . 1 1 137 137 GLU CB C 13 32.161 0.313 . 1 . . 1129 . . 137 GLU CB . 19164 1 1701 . 1 1 137 137 GLU CG C 13 35.594 0.313 . 1 . . 1417 . . 137 GLU CG . 19164 1 1702 . 1 1 137 137 GLU N N 15 117.468 0.125 . 1 . . 1127 . . 137 GLU N . 19164 1 1703 . 1 1 138 138 LYS H H 1 7.045 0.043 . 1 . . 1432 . . 138 LYS H . 19164 1 1704 . 1 1 138 138 LYS HA H 1 4.012 0.043 . 1 . . 1422 . . 138 LYS HA . 19164 1 1705 . 1 1 138 138 LYS HB2 H 1 1.968 0.043 . 1 . . 1815 . . 138 LYS HB2 . 19164 1 1706 . 1 1 138 138 LYS HB3 H 1 1.968 0.043 . 1 . . 1421 . . 138 LYS HB3 . 19164 1 1707 . 1 1 138 138 LYS HG2 H 1 1.375 0.043 . 1 . . 1818 . . 138 LYS HG2 . 19164 1 1708 . 1 1 138 138 LYS HG3 H 1 1.375 0.043 . 1 . . 1423 . . 138 LYS HG3 . 19164 1 1709 . 1 1 138 138 LYS HD2 H 1 1.727 0.043 . 1 . . 1816 . . 138 LYS HD2 . 19164 1 1710 . 1 1 138 138 LYS HD3 H 1 1.727 0.043 . 1 . . 1428 . . 138 LYS HD3 . 19164 1 1711 . 1 1 138 138 LYS HE2 H 1 3.051 0.043 . 1 . . 1817 . . 138 LYS HE2 . 19164 1 1712 . 1 1 138 138 LYS HE3 H 1 3.051 0.043 . 1 . . 1430 . . 138 LYS HE3 . 19164 1 1713 . 1 1 138 138 LYS C C 13 178.273 0.313 . 1 . . 1659 . . 138 LYS C . 19164 1 1714 . 1 1 138 138 LYS CA C 13 61.430 0.313 . 1 . . 1419 . . 138 LYS CA . 19164 1 1715 . 1 1 138 138 LYS CB C 13 31.874 0.313 . 1 . . 1420 . . 138 LYS CB . 19164 1 1716 . 1 1 138 138 LYS CG C 13 25.226 0.313 . 1 . . 1424 . . 138 LYS CG . 19164 1 1717 . 1 1 138 138 LYS CD C 13 28.941 0.313 . 1 . . 1429 . . 138 LYS CD . 19164 1 1718 . 1 1 138 138 LYS CE C 13 41.849 0.313 . 1 . . 1431 . . 138 LYS CE . 19164 1 1719 . 1 1 139 139 THR H H 1 8.491 0.043 . 1 . . 1024 . . 139 THR H . 19164 1 1720 . 1 1 139 139 THR HA H 1 3.828 0.043 . 1 . . 1425 . . 139 THR HA . 19164 1 1721 . 1 1 139 139 THR HB H 1 4.165 0.043 . 1 . . 1426 . . 139 THR HB . 19164 1 1722 . 1 1 139 139 THR HG21 H 1 1.327 0.043 . 1 . . 1427 . . 139 THR HG21 . 19164 1 1723 . 1 1 139 139 THR HG22 H 1 1.327 0.043 . 1 . . 1427 . . 139 THR HG22 . 19164 1 1724 . 1 1 139 139 THR HG23 H 1 1.327 0.043 . 1 . . 1427 . . 139 THR HG23 . 19164 1 1725 . 1 1 139 139 THR C C 13 174.953 0.313 . 1 . . 1660 . . 139 THR C . 19164 1 1726 . 1 1 139 139 THR CA C 13 65.692 0.313 . 1 . . 1154 . . 139 THR CA . 19164 1 1727 . 1 1 139 139 THR CB C 13 68.520 0.313 . 1 . . 1153 . . 139 THR CB . 19164 1 1728 . 1 1 139 139 THR CG2 C 13 22.263 0.313 . 1 . . 1436 . . 139 THR CG2 . 19164 1 1729 . 1 1 139 139 THR N N 15 110.622 0.125 . 1 . . 1025 . . 139 THR N . 19164 1 1730 . 1 1 140 140 ASP H H 1 7.610 0.043 . 1 . . 1088 . . 140 ASP H . 19164 1 1731 . 1 1 140 140 ASP HA H 1 4.449 0.043 . 1 . . 1181 . . 140 ASP HA . 19164 1 1732 . 1 1 140 140 ASP HB2 H 1 2.910 0.043 . 1 . . 1182 . . 140 ASP HB2 . 19164 1 1733 . 1 1 140 140 ASP HB3 H 1 2.694 0.043 . 1 . . 1183 . . 140 ASP HB3 . 19164 1 1734 . 1 1 140 140 ASP C C 13 178.996 0.313 . 1 . . 1661 . . 140 ASP C . 19164 1 1735 . 1 1 140 140 ASP CA C 13 57.324 0.313 . 1 . . 1090 . . 140 ASP CA . 19164 1 1736 . 1 1 140 140 ASP CB C 13 40.769 0.313 . 1 . . 1091 . . 140 ASP CB . 19164 1 1737 . 1 1 140 140 ASP N N 15 120.061 0.125 . 1 . . 1089 . . 140 ASP N . 19164 1 1738 . 1 1 141 141 TYR H H 1 7.309 0.043 . 1 . . 1076 . . 141 TYR H . 19164 1 1739 . 1 1 141 141 TYR HA H 1 4.087 0.043 . 1 . . 1439 . . 141 TYR HA . 19164 1 1740 . 1 1 141 141 TYR HB2 H 1 3.260 0.043 . 1 . . 1438 . . 141 TYR HB2 . 19164 1 1741 . 1 1 141 141 TYR HB3 H 1 2.776 0.043 . 1 . . 1437 . . 141 TYR HB3 . 19164 1 1742 . 1 1 141 141 TYR HD1 H 1 7.047 0.043 . 3 . . 1704 . . 141 TYR HD1 . 19164 1 1743 . 1 1 141 141 TYR HD2 H 1 7.047 0.043 . 3 . . 1705 . . 141 TYR HD2 . 19164 1 1744 . 1 1 141 141 TYR HE1 H 1 6.659 0.043 . 3 . . 1708 . . 141 TYR HE1 . 19164 1 1745 . 1 1 141 141 TYR HE2 H 1 6.659 0.043 . 3 . . 1709 . . 141 TYR HE2 . 19164 1 1746 . 1 1 141 141 TYR C C 13 177.499 0.313 . 1 . . 1662 . . 141 TYR C . 19164 1 1747 . 1 1 141 141 TYR CA C 13 61.907 0.313 . 1 . . 1078 . . 141 TYR CA . 19164 1 1748 . 1 1 141 141 TYR CB C 13 39.636 0.313 . 1 . . 1079 . . 141 TYR CB . 19164 1 1749 . 1 1 141 141 TYR CD1 C 13 132.899 0.313 . 3 . . 1706 . . 141 TYR CD1 . 19164 1 1750 . 1 1 141 141 TYR CD2 C 13 132.899 0.313 . 3 . . 1707 . . 141 TYR CD2 . 19164 1 1751 . 1 1 141 141 TYR CE1 C 13 118.338 0.313 . 3 . . 1710 . . 141 TYR CE1 . 19164 1 1752 . 1 1 141 141 TYR CE2 C 13 118.338 0.313 . 3 . . 1711 . . 141 TYR CE2 . 19164 1 1753 . 1 1 141 141 TYR N N 15 117.478 0.125 . 1 . . 1077 . . 141 TYR N . 19164 1 1754 . 1 1 142 142 VAL H H 1 8.029 0.043 . 1 . . 1134 . . 142 VAL H . 19164 1 1755 . 1 1 142 142 VAL HA H 1 3.409 0.043 . 1 . . 1434 . . 142 VAL HA . 19164 1 1756 . 1 1 142 142 VAL HB H 1 2.145 0.043 . 1 . . 1435 . . 142 VAL HB . 19164 1 1757 . 1 1 142 142 VAL HG11 H 1 0.971 0.043 . 1 . . 1433 . . 142 VAL HG11 . 19164 1 1758 . 1 1 142 142 VAL HG12 H 1 0.971 0.043 . 1 . . 1433 . . 142 VAL HG12 . 19164 1 1759 . 1 1 142 142 VAL HG13 H 1 0.971 0.043 . 1 . . 1433 . . 142 VAL HG13 . 19164 1 1760 . 1 1 142 142 VAL HG21 H 1 0.954 0.043 . 1 . . 1441 . . 142 VAL HG21 . 19164 1 1761 . 1 1 142 142 VAL HG22 H 1 0.954 0.043 . 1 . . 1441 . . 142 VAL HG22 . 19164 1 1762 . 1 1 142 142 VAL HG23 H 1 0.954 0.043 . 1 . . 1441 . . 142 VAL HG23 . 19164 1 1763 . 1 1 142 142 VAL C C 13 177.173 0.313 . 1 . . 1663 . . 142 VAL C . 19164 1 1764 . 1 1 142 142 VAL CA C 13 67.251 0.313 . 1 . . 1136 . . 142 VAL CA . 19164 1 1765 . 1 1 142 142 VAL CB C 13 31.880 0.313 . 1 . . 1137 . . 142 VAL CB . 19164 1 1766 . 1 1 142 142 VAL CG1 C 13 23.141 0.313 . 1 . . 1440 . . 142 VAL CG1 . 19164 1 1767 . 1 1 142 142 VAL CG2 C 13 20.911 0.313 . 1 . . 1442 . . 142 VAL CG2 . 19164 1 1768 . 1 1 142 142 VAL N N 15 118.707 0.125 . 1 . . 1135 . . 142 VAL N . 19164 1 1769 . 1 1 143 143 ASN H H 1 8.450 0.043 . 1 . . 1062 . . 143 ASN H . 19164 1 1770 . 1 1 143 143 ASN HA H 1 4.487 0.043 . 1 . . 1268 . . 143 ASN HA . 19164 1 1771 . 1 1 143 143 ASN HB2 H 1 2.892 0.043 . 1 . . 1819 . . 143 ASN HB2 . 19164 1 1772 . 1 1 143 143 ASN HB3 H 1 2.892 0.043 . 1 . . 1269 . . 143 ASN HB3 . 19164 1 1773 . 1 1 143 143 ASN C C 13 177.988 0.313 . 1 . . 1664 . . 143 ASN C . 19164 1 1774 . 1 1 143 143 ASN CA C 13 55.749 0.313 . 1 . . 1229 . . 143 ASN CA . 19164 1 1775 . 1 1 143 143 ASN CB C 13 37.421 0.313 . 1 . . 1228 . . 143 ASN CB . 19164 1 1776 . 1 1 143 143 ASN N N 15 116.067 0.125 . 1 . . 1063 . . 143 ASN N . 19164 1 1777 . 1 1 144 144 LEU H H 1 7.478 0.043 . 1 . . 1012 . . 144 LEU H . 19164 1 1778 . 1 1 144 144 LEU HA H 1 4.412 0.043 . 1 . . 1210 . . 144 LEU HA . 19164 1 1779 . 1 1 144 144 LEU HB2 H 1 1.914 0.043 . 1 . . 1270 . . 144 LEU HB2 . 19164 1 1780 . 1 1 144 144 LEU HB3 H 1 1.674 0.043 . 1 . . 1271 . . 144 LEU HB3 . 19164 1 1781 . 1 1 144 144 LEU HG H 1 1.674 0.043 . 1 . . 1307 . . 144 LEU HG . 19164 1 1782 . 1 1 144 144 LEU HD11 H 1 1.088 0.043 . 1 . . 1306 . . 144 LEU HD11 . 19164 1 1783 . 1 1 144 144 LEU HD12 H 1 1.088 0.043 . 1 . . 1306 . . 144 LEU HD12 . 19164 1 1784 . 1 1 144 144 LEU HD13 H 1 1.088 0.043 . 1 . . 1306 . . 144 LEU HD13 . 19164 1 1785 . 1 1 144 144 LEU HD21 H 1 1.080 0.043 . 1 . . 1443 . . 144 LEU HD21 . 19164 1 1786 . 1 1 144 144 LEU HD22 H 1 1.080 0.043 . 1 . . 1443 . . 144 LEU HD22 . 19164 1 1787 . 1 1 144 144 LEU HD23 H 1 1.080 0.043 . 1 . . 1443 . . 144 LEU HD23 . 19164 1 1788 . 1 1 144 144 LEU C C 13 178.538 0.313 . 1 . . 1665 . . 144 LEU C . 19164 1 1789 . 1 1 144 144 LEU CA C 13 57.679 0.313 . 1 . . 1147 . . 144 LEU CA . 19164 1 1790 . 1 1 144 144 LEU CB C 13 41.870 0.313 . 1 . . 1146 . . 144 LEU CB . 19164 1 1791 . 1 1 144 144 LEU CG C 13 26.888 0.313 . 1 . . 1308 . . 144 LEU CG . 19164 1 1792 . 1 1 144 144 LEU CD1 C 13 22.563 0.313 . 1 . . 1311 . . 144 LEU CD1 . 19164 1 1793 . 1 1 144 144 LEU CD2 C 13 26.674 0.313 . 1 . . 1309 . . 144 LEU CD2 . 19164 1 1794 . 1 1 144 144 LEU N N 15 120.933 0.125 . 1 . . 1013 . . 144 LEU N . 19164 1 1795 . 1 1 145 145 ILE H H 1 8.498 0.043 . 1 . . 1038 . . 145 ILE H . 19164 1 1796 . 1 1 145 145 ILE HA H 1 3.863 0.043 . 1 . . 1211 . . 145 ILE HA . 19164 1 1797 . 1 1 145 145 ILE HB H 1 2.006 0.043 . 1 . . 1272 . . 145 ILE HB . 19164 1 1798 . 1 1 145 145 ILE HG12 H 1 1.979 0.043 . 1 . . 1448 . . 145 ILE HG12 . 19164 1 1799 . 1 1 145 145 ILE HG13 H 1 0.803 0.043 . 1 . . 1446 . . 145 ILE HG13 . 19164 1 1800 . 1 1 145 145 ILE HG21 H 1 1.079 0.043 . 1 . . 1444 . . 145 ILE HG21 . 19164 1 1801 . 1 1 145 145 ILE HG22 H 1 1.079 0.043 . 1 . . 1444 . . 145 ILE HG22 . 19164 1 1802 . 1 1 145 145 ILE HG23 H 1 1.079 0.043 . 1 . . 1444 . . 145 ILE HG23 . 19164 1 1803 . 1 1 145 145 ILE HD11 H 1 0.935 0.043 . 1 . . 1449 . . 145 ILE HD11 . 19164 1 1804 . 1 1 145 145 ILE HD12 H 1 0.935 0.043 . 1 . . 1449 . . 145 ILE HD12 . 19164 1 1805 . 1 1 145 145 ILE HD13 H 1 0.935 0.043 . 1 . . 1449 . . 145 ILE HD13 . 19164 1 1806 . 1 1 145 145 ILE C C 13 177.693 0.313 . 1 . . 1666 . . 145 ILE C . 19164 1 1807 . 1 1 145 145 ILE CA C 13 66.289 0.313 . 1 . . 1163 . . 145 ILE CA . 19164 1 1808 . 1 1 145 145 ILE CB C 13 37.685 0.313 . 1 . . 1164 . . 145 ILE CB . 19164 1 1809 . 1 1 145 145 ILE CG1 C 13 31.491 0.313 . 1 . . 1447 . . 145 ILE CG1 . 19164 1 1810 . 1 1 145 145 ILE CG2 C 13 18.280 0.313 . 1 . . 1445 . . 145 ILE CG2 . 19164 1 1811 . 1 1 145 145 ILE CD1 C 13 15.876 0.313 . 1 . . 1450 . . 145 ILE CD1 . 19164 1 1812 . 1 1 145 145 ILE N N 15 119.268 0.125 . 1 . . 1039 . . 145 ILE N . 19164 1 1813 . 1 1 146 146 GLN H H 1 8.364 0.043 . 1 . . 1102 . . 146 GLN H . 19164 1 1814 . 1 1 146 146 GLN HA H 1 4.130 0.043 . 1 . . 1273 . . 146 GLN HA . 19164 1 1815 . 1 1 146 146 GLN HB2 H 1 2.338 0.043 . 1 . . 1274 . . 146 GLN HB2 . 19164 1 1816 . 1 1 146 146 GLN HB3 H 1 2.146 0.043 . 1 . . 1275 . . 146 GLN HB3 . 19164 1 1817 . 1 1 146 146 GLN HG2 H 1 2.721 0.043 . 1 . . 1451 . . 146 GLN HG2 . 19164 1 1818 . 1 1 146 146 GLN HG3 H 1 2.383 0.043 . 1 . . 1452 . . 146 GLN HG3 . 19164 1 1819 . 1 1 146 146 GLN HE21 H 1 7.298 0.043 . 1 . . 1538 . . 146 GLN HE21 . 19164 1 1820 . 1 1 146 146 GLN HE22 H 1 6.841 0.043 . 1 . . 1539 . . 146 GLN HE22 . 19164 1 1821 . 1 1 146 146 GLN C C 13 178.589 0.313 . 1 . . 1667 . . 146 GLN C . 19164 1 1822 . 1 1 146 146 GLN CA C 13 59.248 0.313 . 1 . . 1206 . . 146 GLN CA . 19164 1 1823 . 1 1 146 146 GLN CB C 13 28.283 0.313 . 1 . . 1207 . . 146 GLN CB . 19164 1 1824 . 1 1 146 146 GLN CG C 13 34.895 0.313 . 1 . . 1453 . . 146 GLN CG . 19164 1 1825 . 1 1 146 146 GLN N N 15 115.897 0.125 . 1 . . 1103 . . 146 GLN N . 19164 1 1826 . 1 1 146 146 GLN NE2 N 15 110.153 0.125 . 1 . . 1537 . . 146 GLN NE2 . 19164 1 1827 . 1 1 147 147 GLU H H 1 7.882 0.043 . 1 . . 1216 . . 147 GLU H . 19164 1 1828 . 1 1 147 147 GLU HA H 1 4.162 0.043 . 1 . . 1266 . . 147 GLU HA . 19164 1 1829 . 1 1 147 147 GLU HB2 H 1 2.344 0.043 . 1 . . 1331 . . 147 GLU HB2 . 19164 1 1830 . 1 1 147 147 GLU HB3 H 1 2.294 0.043 . 1 . . 1276 . . 147 GLU HB3 . 19164 1 1831 . 1 1 147 147 GLU HG2 H 1 2.439 0.043 . 1 . . 1332 . . 147 GLU HG2 . 19164 1 1832 . 1 1 147 147 GLU HG3 H 1 2.311 0.043 . 1 . . 1454 . . 147 GLU HG3 . 19164 1 1833 . 1 1 147 147 GLU C C 13 178.507 0.313 . 1 . . 1668 . . 147 GLU C . 19164 1 1834 . 1 1 147 147 GLU CA C 13 58.721 0.313 . 1 . . 1223 . . 147 GLU CA . 19164 1 1835 . 1 1 147 147 GLU CB C 13 29.841 0.313 . 1 . . 1222 . . 147 GLU CB . 19164 1 1836 . 1 1 147 147 GLU CG C 13 35.884 0.313 . 1 . . 1333 . . 147 GLU CG . 19164 1 1837 . 1 1 147 147 GLU N N 15 118.858 0.125 . 1 . . 1217 . . 147 GLU N . 19164 1 1838 . 1 1 148 148 LEU H H 1 8.333 0.043 . 1 . . 1114 . . 148 LEU H . 19164 1 1839 . 1 1 148 148 LEU HA H 1 4.325 0.043 . 1 . . 1267 . . 148 LEU HA . 19164 1 1840 . 1 1 148 148 LEU HB2 H 1 2.167 0.043 . 1 . . 1277 . . 148 LEU HB2 . 19164 1 1841 . 1 1 148 148 LEU HB3 H 1 1.549 0.043 . 1 . . 1278 . . 148 LEU HB3 . 19164 1 1842 . 1 1 148 148 LEU HG H 1 2.068 0.043 . 1 . . 1456 . . 148 LEU HG . 19164 1 1843 . 1 1 148 148 LEU HD11 H 1 1.015 0.043 . 1 . . 1457 . . 148 LEU HD11 . 19164 1 1844 . 1 1 148 148 LEU HD12 H 1 1.015 0.043 . 1 . . 1457 . . 148 LEU HD12 . 19164 1 1845 . 1 1 148 148 LEU HD13 H 1 1.015 0.043 . 1 . . 1457 . . 148 LEU HD13 . 19164 1 1846 . 1 1 148 148 LEU HD21 H 1 0.965 0.043 . 1 . . 1458 . . 148 LEU HD21 . 19164 1 1847 . 1 1 148 148 LEU HD22 H 1 0.965 0.043 . 1 . . 1458 . . 148 LEU HD22 . 19164 1 1848 . 1 1 148 148 LEU HD23 H 1 0.965 0.043 . 1 . . 1458 . . 148 LEU HD23 . 19164 1 1849 . 1 1 148 148 LEU C C 13 177.733 0.313 . 1 . . 1669 . . 148 LEU C . 19164 1 1850 . 1 1 148 148 LEU CA C 13 55.582 0.313 . 1 . . 1117 . . 148 LEU CA . 19164 1 1851 . 1 1 148 148 LEU CB C 13 43.754 0.313 . 1 . . 1116 . . 148 LEU CB . 19164 1 1852 . 1 1 148 148 LEU CG C 13 26.301 0.313 . 1 . . 1455 . . 148 LEU CG . 19164 1 1853 . 1 1 148 148 LEU CD1 C 13 26.138 0.313 . 1 . . 1460 . . 148 LEU CD1 . 19164 1 1854 . 1 1 148 148 LEU CD2 C 13 21.979 0.313 . 1 . . 1459 . . 148 LEU CD2 . 19164 1 1855 . 1 1 148 148 LEU N N 15 117.562 0.125 . 1 . . 1115 . . 148 LEU N . 19164 1 1856 . 1 1 149 149 ALA H H 1 8.530 0.043 . 1 . . 1056 . . 149 ALA H . 19164 1 1857 . 1 1 149 149 ALA HA H 1 4.085 0.043 . 1 . . 1461 . . 149 ALA HA . 19164 1 1858 . 1 1 149 149 ALA HB1 H 1 1.718 0.043 . 1 . . 1279 . . 149 ALA HB1 . 19164 1 1859 . 1 1 149 149 ALA HB2 H 1 1.718 0.043 . 1 . . 1279 . . 149 ALA HB2 . 19164 1 1860 . 1 1 149 149 ALA HB3 H 1 1.718 0.043 . 1 . . 1279 . . 149 ALA HB3 . 19164 1 1861 . 1 1 149 149 ALA CA C 13 56.660 0.313 . 1 . . 1058 . . 149 ALA CA . 19164 1 1862 . 1 1 149 149 ALA CB C 13 16.094 0.313 . 1 . . 1059 . . 149 ALA CB . 19164 1 1863 . 1 1 149 149 ALA N N 15 122.298 0.125 . 1 . . 1057 . . 149 ALA N . 19164 1 1864 . 1 1 150 150 PRO HA H 1 4.321 0.043 . 1 . . 1173 . . 150 PRO HA . 19164 1 1865 . 1 1 150 150 PRO HB2 H 1 2.355 0.043 . 1 . . 1462 . . 150 PRO HB2 . 19164 1 1866 . 1 1 150 150 PRO HB3 H 1 1.749 0.043 . 1 . . 1174 . . 150 PRO HB3 . 19164 1 1867 . 1 1 150 150 PRO HG2 H 1 2.087 0.043 . 1 . . 1466 . . 150 PRO HG2 . 19164 1 1868 . 1 1 150 150 PRO HG3 H 1 1.965 0.043 . 1 . . 1465 . . 150 PRO HG3 . 19164 1 1869 . 1 1 150 150 PRO HD2 H 1 3.732 0.043 . 1 . . 1468 . . 150 PRO HD2 . 19164 1 1870 . 1 1 150 150 PRO HD3 H 1 3.559 0.043 . 1 . . 1469 . . 150 PRO HD3 . 19164 1 1871 . 1 1 150 150 PRO C C 13 178.344 0.313 . 1 . . 1670 . . 150 PRO C . 19164 1 1872 . 1 1 150 150 PRO CA C 13 65.513 0.313 . 1 . . 1463 . . 150 PRO CA . 19164 1 1873 . 1 1 150 150 PRO CB C 13 31.037 0.313 . 1 . . 1464 . . 150 PRO CB . 19164 1 1874 . 1 1 150 150 PRO CG C 13 28.251 0.313 . 1 . . 1467 . . 150 PRO CG . 19164 1 1875 . 1 1 150 150 PRO CD C 13 50.599 0.313 . 1 . . 1470 . . 150 PRO CD . 19164 1 1876 . 1 1 151 151 LYS H H 1 7.544 0.043 . 1 . . 1092 . . 151 LYS H . 19164 1 1877 . 1 1 151 151 LYS HA H 1 3.950 0.043 . 1 . . 1280 . . 151 LYS HA . 19164 1 1878 . 1 1 151 151 LYS HB2 H 1 1.557 0.043 . 1 . . 1281 . . 151 LYS HB2 . 19164 1 1879 . 1 1 151 151 LYS HB3 H 1 1.421 0.043 . 1 . . 1282 . . 151 LYS HB3 . 19164 1 1880 . 1 1 151 151 LYS HG2 H 1 0.773 0.043 . 1 . . 1475 . . 151 LYS HG2 . 19164 1 1881 . 1 1 151 151 LYS HG3 H 1 0.755 0.043 . 1 . . 1472 . . 151 LYS HG3 . 19164 1 1882 . 1 1 151 151 LYS HD2 H 1 1.136 0.043 . 1 . . 1820 . . 151 LYS HD2 . 19164 1 1883 . 1 1 151 151 LYS HD3 H 1 1.136 0.043 . 1 . . 1471 . . 151 LYS HD3 . 19164 1 1884 . 1 1 151 151 LYS HE2 H 1 2.822 0.043 . 1 . . 1821 . . 151 LYS HE2 . 19164 1 1885 . 1 1 151 151 LYS HE3 H 1 2.822 0.043 . 1 . . 1473 . . 151 LYS HE3 . 19164 1 1886 . 1 1 151 151 LYS C C 13 177.387 0.313 . 1 . . 1671 . . 151 LYS C . 19164 1 1887 . 1 1 151 151 LYS CA C 13 57.661 0.313 . 1 . . 1231 . . 151 LYS CA . 19164 1 1888 . 1 1 151 151 LYS CB C 13 32.052 0.313 . 1 . . 1230 . . 151 LYS CB . 19164 1 1889 . 1 1 151 151 LYS CG C 13 24.578 0.313 . 1 . . 1474 . . 151 LYS CG . 19164 1 1890 . 1 1 151 151 LYS CD C 13 29.484 0.313 . 1 . . 1476 . . 151 LYS CD . 19164 1 1891 . 1 1 151 151 LYS CE C 13 41.880 0.313 . 1 . . 1477 . . 151 LYS CE . 19164 1 1892 . 1 1 151 151 LYS N N 15 115.877 0.125 . 1 . . 1093 . . 151 LYS N . 19164 1 1893 . 1 1 152 152 TYR H H 1 7.124 0.043 . 1 . . 1004 . . 152 TYR H . 19164 1 1894 . 1 1 152 152 TYR HA H 1 4.293 0.043 . 1 . . 1141 . . 152 TYR HA . 19164 1 1895 . 1 1 152 152 TYR HB2 H 1 2.349 0.043 . 1 . . 1191 . . 152 TYR HB2 . 19164 1 1896 . 1 1 152 152 TYR HB3 H 1 1.177 0.043 . 1 . . 1192 . . 152 TYR HB3 . 19164 1 1897 . 1 1 152 152 TYR HD1 H 1 6.472 0.043 . 3 . . 1690 . . 152 TYR HD1 . 19164 1 1898 . 1 1 152 152 TYR HD2 H 1 6.472 0.043 . 3 . . 1691 . . 152 TYR HD2 . 19164 1 1899 . 1 1 152 152 TYR HE1 H 1 6.626 0.043 . 3 . . 1694 . . 152 TYR HE1 . 19164 1 1900 . 1 1 152 152 TYR HE2 H 1 6.626 0.043 . 3 . . 1695 . . 152 TYR HE2 . 19164 1 1901 . 1 1 152 152 TYR C C 13 175.849 0.313 . 1 . . 1672 . . 152 TYR C . 19164 1 1902 . 1 1 152 152 TYR CA C 13 58.630 0.313 . 1 . . 1067 . . 152 TYR CA . 19164 1 1903 . 1 1 152 152 TYR CB C 13 38.382 0.313 . 1 . . 1066 . . 152 TYR CB . 19164 1 1904 . 1 1 152 152 TYR CD1 C 13 132.626 0.313 . 3 . . 1692 . . 152 TYR CD1 . 19164 1 1905 . 1 1 152 152 TYR CD2 C 13 132.626 0.313 . 3 . . 1693 . . 152 TYR CD2 . 19164 1 1906 . 1 1 152 152 TYR CE1 C 13 117.352 0.313 . 3 . . 1696 . . 152 TYR CE1 . 19164 1 1907 . 1 1 152 152 TYR CE2 C 13 117.352 0.313 . 3 . . 1697 . . 152 TYR CE2 . 19164 1 1908 . 1 1 152 152 TYR N N 15 116.471 0.125 . 1 . . 1005 . . 152 TYR N . 19164 1 1909 . 1 1 153 153 ALA H H 1 7.906 0.043 . 1 . . 1010 . . 153 ALA H . 19164 1 1910 . 1 1 153 153 ALA HA H 1 4.403 0.043 . 1 . . 1190 . . 153 ALA HA . 19164 1 1911 . 1 1 153 153 ALA HB1 H 1 1.518 0.043 . 1 . . 1291 . . 153 ALA HB1 . 19164 1 1912 . 1 1 153 153 ALA HB2 H 1 1.518 0.043 . 1 . . 1291 . . 153 ALA HB2 . 19164 1 1913 . 1 1 153 153 ALA HB3 H 1 1.518 0.043 . 1 . . 1291 . . 153 ALA HB3 . 19164 1 1914 . 1 1 153 153 ALA C C 13 177.306 0.313 . 1 . . 1673 . . 153 ALA C . 19164 1 1915 . 1 1 153 153 ALA CA C 13 52.708 0.313 . 1 . . 1144 . . 153 ALA CA . 19164 1 1916 . 1 1 153 153 ALA CB C 13 19.159 0.313 . 1 . . 1145 . . 153 ALA CB . 19164 1 1917 . 1 1 153 153 ALA N N 15 123.305 0.125 . 1 . . 1011 . . 153 ALA N . 19164 1 1918 . 1 1 154 154 ALA H H 1 8.100 0.043 . 1 . . 1130 . . 154 ALA H . 19164 1 1919 . 1 1 154 154 ALA HA H 1 4.394 0.043 . 1 . . 1189 . . 154 ALA HA . 19164 1 1920 . 1 1 154 154 ALA HB1 H 1 1.422 0.043 . 1 . . 1290 . . 154 ALA HB1 . 19164 1 1921 . 1 1 154 154 ALA HB2 H 1 1.422 0.043 . 1 . . 1290 . . 154 ALA HB2 . 19164 1 1922 . 1 1 154 154 ALA HB3 H 1 1.422 0.043 . 1 . . 1290 . . 154 ALA HB3 . 19164 1 1923 . 1 1 154 154 ALA C C 13 177.815 0.313 . 1 . . 1674 . . 154 ALA C . 19164 1 1924 . 1 1 154 154 ALA CA C 13 52.623 0.313 . 1 . . 1132 . . 154 ALA CA . 19164 1 1925 . 1 1 154 154 ALA CB C 13 19.002 0.313 . 1 . . 1133 . . 154 ALA CB . 19164 1 1926 . 1 1 154 154 ALA N N 15 121.421 0.125 . 1 . . 1131 . . 154 ALA N . 19164 1 1927 . 1 1 155 155 THR H H 1 7.904 0.043 . 1 . . 1030 . . 155 THR H . 19164 1 1928 . 1 1 155 155 THR HA H 1 4.335 0.043 . 1 . . 1172 . . 155 THR HA . 19164 1 1929 . 1 1 155 155 THR HB H 1 4.198 0.043 . 1 . . 1283 . . 155 THR HB . 19164 1 1930 . 1 1 155 155 THR HG21 H 1 1.205 0.043 . 1 . . 1478 . . 155 THR HG21 . 19164 1 1931 . 1 1 155 155 THR HG22 H 1 1.205 0.043 . 1 . . 1478 . . 155 THR HG22 . 19164 1 1932 . 1 1 155 155 THR HG23 H 1 1.205 0.043 . 1 . . 1478 . . 155 THR HG23 . 19164 1 1933 . 1 1 155 155 THR C C 13 173.884 0.313 . 1 . . 1675 . . 155 THR C . 19164 1 1934 . 1 1 155 155 THR CA C 13 61.317 0.313 . 1 . . 1159 . . 155 THR CA . 19164 1 1935 . 1 1 155 155 THR CB C 13 69.825 0.313 . 1 . . 1160 . . 155 THR CB . 19164 1 1936 . 1 1 155 155 THR CG2 C 13 21.477 0.313 . 1 . . 1479 . . 155 THR CG2 . 19164 1 1937 . 1 1 155 155 THR N N 15 111.673 0.125 . 1 . . 1031 . . 155 THR N . 19164 1 1938 . 1 1 156 156 HIS H H 1 8.359 0.043 . 1 . . 1224 . . 156 HIS H . 19164 1 1939 . 1 1 156 156 HIS HA H 1 5.008 0.043 . 1 . . 1326 . . 156 HIS HA . 19164 1 1940 . 1 1 156 156 HIS HB2 H 1 3.105 0.043 . 1 . . 1328 . . 156 HIS HB2 . 19164 1 1941 . 1 1 156 156 HIS HB3 H 1 3.244 0.043 . 1 . . 1327 . . 156 HIS HB3 . 19164 1 1942 . 1 1 156 156 HIS HD2 H 1 7.252 0.043 . 1 . . 1717 . . 156 HIS HD2 . 19164 1 1943 . 1 1 156 156 HIS CA C 13 53.427 0.313 . 1 . . 1227 . . 156 HIS CA . 19164 1 1944 . 1 1 156 156 HIS CB C 13 28.985 0.313 . 1 . . 1226 . . 156 HIS CB . 19164 1 1945 . 1 1 156 156 HIS CD2 C 13 120.183 0.313 . 1 . . 1716 . . 156 HIS CD2 . 19164 1 1946 . 1 1 156 156 HIS N N 15 121.254 0.125 . 1 . . 1225 . . 156 HIS N . 19164 1 1947 . 1 1 157 157 PRO HA H 1 4.503 0.043 . 1 . . 1480 . . 157 PRO HA . 19164 1 1948 . 1 1 157 157 PRO HB2 H 1 2.352 0.043 . 1 . . 1481 . . 157 PRO HB2 . 19164 1 1949 . 1 1 157 157 PRO HB3 H 1 1.960 0.043 . 1 . . 1482 . . 157 PRO HB3 . 19164 1 1950 . 1 1 157 157 PRO HG2 H 1 2.026 0.043 . 1 . . 1822 . . 157 PRO HG2 . 19164 1 1951 . 1 1 157 157 PRO HG3 H 1 2.026 0.043 . 1 . . 1487 . . 157 PRO HG3 . 19164 1 1952 . 1 1 157 157 PRO HD2 H 1 3.767 0.043 . 1 . . 1488 . . 157 PRO HD2 . 19164 1 1953 . 1 1 157 157 PRO HD3 H 1 3.615 0.043 . 1 . . 1489 . . 157 PRO HD3 . 19164 1 1954 . 1 1 157 157 PRO C C 13 176.715 0.313 . 1 . . 1676 . . 157 PRO C . 19164 1 1955 . 1 1 157 157 PRO CA C 13 62.926 0.313 . 1 . . 1483 . . 157 PRO CA . 19164 1 1956 . 1 1 157 157 PRO CB C 13 32.027 0.313 . 1 . . 1484 . . 157 PRO CB . 19164 1 1957 . 1 1 157 157 PRO CG C 13 27.218 0.313 . 1 . . 1485 . . 157 PRO CG . 19164 1 1958 . 1 1 157 157 PRO CD C 13 50.472 0.313 . 1 . . 1486 . . 157 PRO CD . 19164 1 1959 . 1 1 158 158 LYS H H 1 8.597 0.043 . 1 . . 1060 . . 158 LYS H . 19164 1 1960 . 1 1 158 158 LYS HA H 1 4.446 0.043 . 1 . . 1260 . . 158 LYS HA . 19164 1 1961 . 1 1 158 158 LYS HB2 H 1 1.902 0.043 . 1 . . 1285 . . 158 LYS HB2 . 19164 1 1962 . 1 1 158 158 LYS HB3 H 1 1.828 0.043 . 1 . . 1284 . . 158 LYS HB3 . 19164 1 1963 . 1 1 158 158 LYS HG2 H 1 1.517 0.043 . 1 . . 1496 . . 158 LYS HG2 . 19164 1 1964 . 1 1 158 158 LYS HG3 H 1 1.476 0.043 . 1 . . 1491 . . 158 LYS HG3 . 19164 1 1965 . 1 1 158 158 LYS HD2 H 1 1.733 0.043 . 1 . . 1823 . . 158 LYS HD2 . 19164 1 1966 . 1 1 158 158 LYS HD3 H 1 1.733 0.043 . 1 . . 1492 . . 158 LYS HD3 . 19164 1 1967 . 1 1 158 158 LYS HE2 H 1 3.048 0.043 . 1 . . 1824 . . 158 LYS HE2 . 19164 1 1968 . 1 1 158 158 LYS HE3 H 1 3.048 0.043 . 1 . . 1490 . . 158 LYS HE3 . 19164 1 1969 . 1 1 158 158 LYS C C 13 176.644 0.313 . 1 . . 1677 . . 158 LYS C . 19164 1 1970 . 1 1 158 158 LYS CA C 13 56.249 0.313 . 1 . . 1165 . . 158 LYS CA . 19164 1 1971 . 1 1 158 158 LYS CB C 13 32.902 0.313 . 1 . . 1166 . . 158 LYS CB . 19164 1 1972 . 1 1 158 158 LYS CG C 13 24.494 0.313 . 1 . . 1494 . . 158 LYS CG . 19164 1 1973 . 1 1 158 158 LYS CD C 13 29.048 0.313 . 1 . . 1493 . . 158 LYS CD . 19164 1 1974 . 1 1 158 158 LYS CE C 13 41.916 0.313 . 1 . . 1495 . . 158 LYS CE . 19164 1 1975 . 1 1 158 158 LYS N N 15 122.066 0.125 . 1 . . 1061 . . 158 LYS N . 19164 1 1976 . 1 1 159 159 THR H H 1 8.267 0.043 . 1 . . 1104 . . 159 THR H . 19164 1 1977 . 1 1 159 159 THR HA H 1 4.380 0.043 . 1 . . 1110 . . 159 THR HA . 19164 1 1978 . 1 1 159 159 THR HB H 1 4.251 0.043 . 1 . . 1498 . . 159 THR HB . 19164 1 1979 . 1 1 159 159 THR HG21 H 1 1.230 0.043 . 1 . . 1497 . . 159 THR HG21 . 19164 1 1980 . 1 1 159 159 THR HG22 H 1 1.230 0.043 . 1 . . 1497 . . 159 THR HG22 . 19164 1 1981 . 1 1 159 159 THR HG23 H 1 1.230 0.043 . 1 . . 1497 . . 159 THR HG23 . 19164 1 1982 . 1 1 159 159 THR C C 13 174.129 0.313 . 1 . . 1678 . . 159 THR C . 19164 1 1983 . 1 1 159 159 THR CA C 13 61.677 0.313 . 1 . . 1108 . . 159 THR CA . 19164 1 1984 . 1 1 159 159 THR CB C 13 69.700 0.313 . 1 . . 1109 . . 159 THR CB . 19164 1 1985 . 1 1 159 159 THR CG2 C 13 21.504 0.313 . 1 . . 1499 . . 159 THR CG2 . 19164 1 1986 . 1 1 159 159 THR N N 15 115.855 0.125 . 1 . . 1105 . . 159 THR N . 19164 1 1987 . 1 1 160 160 GLU H H 1 8.409 0.043 . 1 . . 1044 . . 160 GLU H . 19164 1 1988 . 1 1 160 160 GLU HA H 1 4.417 0.043 . 1 . . 1112 . . 160 GLU HA . 19164 1 1989 . 1 1 160 160 GLU HB2 H 1 2.135 0.043 . 1 . . 1286 . . 160 GLU HB2 . 19164 1 1990 . 1 1 160 160 GLU HB3 H 1 1.952 0.043 . 1 . . 1287 . . 160 GLU HB3 . 19164 1 1991 . 1 1 160 160 GLU HG2 H 1 2.289 0.043 . 1 . . 1825 . . 160 GLU HG2 . 19164 1 1992 . 1 1 160 160 GLU HG3 H 1 2.289 0.043 . 1 . . 1501 . . 160 GLU HG3 . 19164 1 1993 . 1 1 160 160 GLU C C 13 175.086 0.313 . 1 . . 1679 . . 160 GLU C . 19164 1 1994 . 1 1 160 160 GLU CA C 13 56.076 0.313 . 1 . . 1046 . . 160 GLU CA . 19164 1 1995 . 1 1 160 160 GLU CB C 13 30.325 0.313 . 1 . . 1047 . . 160 GLU CB . 19164 1 1996 . 1 1 160 160 GLU CG C 13 35.769 0.313 . 1 . . 1500 . . 160 GLU CG . 19164 1 1997 . 1 1 160 160 GLU N N 15 123.954 0.125 . 1 . . 1045 . . 160 GLU N . 19164 1 1998 . 1 1 161 161 LEU H H 1 7.970 0.043 . 1 . . 1098 . . 161 LEU H . 19164 1 1999 . 1 1 161 161 LEU HA H 1 4.203 0.043 . 1 . . 1111 . . 161 LEU HA . 19164 1 2000 . 1 1 161 161 LEU HB2 H 1 1.613 0.043 . 1 . . 1826 . . 161 LEU HB2 . 19164 1 2001 . 1 1 161 161 LEU HB3 H 1 1.613 0.043 . 1 . . 1289 . . 161 LEU HB3 . 19164 1 2002 . 1 1 161 161 LEU HG H 1 1.625 0.043 . 1 . . 1504 . . 161 LEU HG . 19164 1 2003 . 1 1 161 161 LEU HD11 H 1 0.911 0.043 . 1 . . 1505 . . 161 LEU HD11 . 19164 1 2004 . 1 1 161 161 LEU HD12 H 1 0.911 0.043 . 1 . . 1505 . . 161 LEU HD12 . 19164 1 2005 . 1 1 161 161 LEU HD13 H 1 0.911 0.043 . 1 . . 1505 . . 161 LEU HD13 . 19164 1 2006 . 1 1 161 161 LEU HD21 H 1 0.870 0.043 . 1 . . 1288 . . 161 LEU HD21 . 19164 1 2007 . 1 1 161 161 LEU HD22 H 1 0.870 0.043 . 1 . . 1288 . . 161 LEU HD22 . 19164 1 2008 . 1 1 161 161 LEU HD23 H 1 0.870 0.043 . 1 . . 1288 . . 161 LEU HD23 . 19164 1 2009 . 1 1 161 161 LEU CA C 13 56.519 0.313 . 1 . . 1101 . . 161 LEU CA . 19164 1 2010 . 1 1 161 161 LEU CB C 13 43.164 0.313 . 1 . . 1100 . . 161 LEU CB . 19164 1 2011 . 1 1 161 161 LEU CG C 13 27.347 0.313 . 1 . . 1503 . . 161 LEU CG . 19164 1 2012 . 1 1 161 161 LEU CD1 C 13 23.446 0.313 . 1 . . 1502 . . 161 LEU CD1 . 19164 1 2013 . 1 1 161 161 LEU CD2 C 13 25.016 0.313 . 1 . . 1506 . . 161 LEU CD2 . 19164 1 2014 . 1 1 161 161 LEU N N 15 128.970 0.125 . 1 . . 1099 . . 161 LEU N . 19164 1 stop_ save_ ############################## # Heteronuclear NOE values # ############################## save_heteronuclear_noe_list_1 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronuclear_noe_list_1 _Heteronucl_NOE_list.Entry_ID 19164 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Name . _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 600 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak height' _Heteronucl_NOE_list.NOE_ref_val 1 _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 12 HSQC . . . 19164 1 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 4 4 GLY N N 15 . 1 1 4 4 GLY H H 1 0.00000 . . . . . . . . . . . 19164 1 2 . 1 1 5 5 GLY N N 15 . 1 1 5 5 GLY H H 1 0.12007 . . . . . . . . . . . 19164 1 3 . 1 1 6 6 ARG N N 15 . 1 1 6 6 ARG H H 1 0.20112 . . . . . . . . . . . 19164 1 4 . 1 1 8 8 GLY N N 15 . 1 1 8 8 GLY H H 1 0.32568 . . . . . . . . . . . 19164 1 5 . 1 1 9 9 ALA N N 15 . 1 1 9 9 ALA H H 1 0.50954 . . . . . . . . . . . 19164 1 6 . 1 1 10 10 ASP N N 15 . 1 1 10 10 ASP H H 1 0.68486 . . . . . . . . . . . 19164 1 7 . 1 1 17 17 PHE N N 15 . 1 1 17 17 PHE H H 1 0.99000 . . . . . . . . . . . 19164 1 8 . 1 1 18 18 LEU N N 15 . 1 1 18 18 LEU H H 1 0.99000 . . . . . . . . . . . 19164 1 9 . 1 1 19 19 ASN N N 15 . 1 1 19 19 ASN H H 1 0.82650 . . . . . . . . . . . 19164 1 10 . 1 1 20 20 ARG N N 15 . 1 1 20 20 ARG H H 1 0.77695 . . . . . . . . . . . 19164 1 11 . 1 1 21 21 PHE N N 15 . 1 1 21 21 PHE H H 1 0.65424 . . . . . . . . . . . 19164 1 12 . 1 1 22 22 TYR N N 15 . 1 1 22 22 TYR H H 1 0.75101 . . . . . . . . . . . 19164 1 13 . 1 1 23 23 LYS N N 15 . 1 1 23 23 LYS H H 1 0.94130 . . . . . . . . . . . 19164 1 14 . 1 1 24 24 SER N N 15 . 1 1 24 24 SER H H 1 0.89297 . . . . . . . . . . . 19164 1 15 . 1 1 26 26 ILE N N 15 . 1 1 26 26 ILE H H 1 0.95453 . . . . . . . . . . . 19164 1 16 . 1 1 27 27 ASP N N 15 . 1 1 27 27 ASP H H 1 0.89243 . . . . . . . . . . . 19164 1 17 . 1 1 28 28 ARG N N 15 . 1 1 28 28 ARG H H 1 0.99000 . . . . . . . . . . . 19164 1 18 . 1 1 29 29 GLY N N 15 . 1 1 29 29 GLY H H 1 0.80600 . . . . . . . . . . . 19164 1 19 . 1 1 30 30 VAL N N 15 . 1 1 30 30 VAL H H 1 0.81479 . . . . . . . . . . . 19164 1 20 . 1 1 31 31 ASN N N 15 . 1 1 31 31 ASN H H 1 0.79293 . . . . . . . . . . . 19164 1 21 . 1 1 32 32 PHE N N 15 . 1 1 32 32 PHE H H 1 0.77520 . . . . . . . . . . . 19164 1 22 . 1 1 33 33 SER N N 15 . 1 1 33 33 SER H H 1 0.53134 . . . . . . . . . . . 19164 1 23 . 1 1 34 34 LEU N N 15 . 1 1 34 34 LEU H H 1 0.53624 . . . . . . . . . . . 19164 1 24 . 1 1 35 35 ASP N N 15 . 1 1 35 35 ASP H H 1 0.82765 . . . . . . . . . . . 19164 1 25 . 1 1 36 36 THR N N 15 . 1 1 36 36 THR H H 1 0.82731 . . . . . . . . . . . 19164 1 26 . 1 1 37 37 ILE N N 15 . 1 1 37 37 ILE H H 1 0.67181 . . . . . . . . . . . 19164 1 27 . 1 1 38 38 GLU N N 15 . 1 1 38 38 GLU H H 1 0.85195 . . . . . . . . . . . 19164 1 28 . 1 1 40 40 GLU N N 15 . 1 1 40 40 GLU H H 1 0.76249 . . . . . . . . . . . 19164 1 29 . 1 1 41 41 LEU N N 15 . 1 1 41 41 LEU H H 1 0.99000 . . . . . . . . . . . 19164 1 30 . 1 1 42 42 ILE N N 15 . 1 1 42 42 ILE H H 1 0.99000 . . . . . . . . . . . 19164 1 31 . 1 1 43 43 SER N N 15 . 1 1 43 43 SER H H 1 0.87105 . . . . . . . . . . . 19164 1 32 . 1 1 44 44 PHE N N 15 . 1 1 44 44 PHE H H 1 0.60609 . . . . . . . . . . . 19164 1 33 . 1 1 45 45 CYS N N 15 . 1 1 45 45 CYS H H 1 0.90663 . . . . . . . . . . . 19164 1 34 . 1 1 46 46 LEU N N 15 . 1 1 46 46 LEU H H 1 0.76513 . . . . . . . . . . . 19164 1 35 . 1 1 48 48 THR N N 15 . 1 1 48 48 THR H H 1 0.34460 . . . . . . . . . . . 19164 1 36 . 1 1 49 49 LYS N N 15 . 1 1 49 49 LYS H H 1 0.74919 . . . . . . . . . . . 19164 1 37 . 1 1 50 50 GLY N N 15 . 1 1 50 50 GLY H H 1 0.99000 . . . . . . . . . . . 19164 1 38 . 1 1 52 52 GLU N N 15 . 1 1 52 52 GLU H H 1 0.93542 . . . . . . . . . . . 19164 1 39 . 1 1 53 53 ASN N N 15 . 1 1 53 53 ASN H H 1 0.84773 . . . . . . . . . . . 19164 1 40 . 1 1 54 54 ARG N N 15 . 1 1 54 54 ARG H H 1 0.81920 . . . . . . . . . . . 19164 1 41 . 1 1 55 55 LEU N N 15 . 1 1 55 55 LEU H H 1 0.53920 . . . . . . . . . . . 19164 1 42 . 1 1 56 56 CYS N N 15 . 1 1 56 56 CYS H H 1 0.69590 . . . . . . . . . . . 19164 1 43 . 1 1 57 57 TYR N N 15 . 1 1 57 57 TYR H H 1 0.72794 . . . . . . . . . . . 19164 1 44 . 1 1 58 58 TYR N N 15 . 1 1 58 58 TYR H H 1 0.79012 . . . . . . . . . . . 19164 1 45 . 1 1 59 59 LEU N N 15 . 1 1 59 59 LEU H H 1 0.75234 . . . . . . . . . . . 19164 1 46 . 1 1 60 60 GLY N N 15 . 1 1 60 60 GLY H H 1 0.90954 . . . . . . . . . . . 19164 1 47 . 1 1 61 61 ALA N N 15 . 1 1 61 61 ALA H H 1 0.80513 . . . . . . . . . . . 19164 1 48 . 1 1 62 62 THR N N 15 . 1 1 62 62 THR H H 1 0.68683 . . . . . . . . . . . 19164 1 49 . 1 1 63 63 LYS N N 15 . 1 1 63 63 LYS H H 1 0.92480 . . . . . . . . . . . 19164 1 50 . 1 1 64 64 ASP N N 15 . 1 1 64 64 ASP H H 1 0.72107 . . . . . . . . . . . 19164 1 51 . 1 1 65 65 ALA N N 15 . 1 1 65 65 ALA H H 1 0.61153 . . . . . . . . . . . 19164 1 52 . 1 1 66 66 ALA N N 15 . 1 1 66 66 ALA H H 1 0.43599 . . . . . . . . . . . 19164 1 53 . 1 1 67 67 THR N N 15 . 1 1 67 67 THR H H 1 0.72196 . . . . . . . . . . . 19164 1 54 . 1 1 77 77 MET N N 15 . 1 1 77 77 MET H H 1 0.92679 . . . . . . . . . . . 19164 1 55 . 1 1 78 78 SER N N 15 . 1 1 78 78 SER H H 1 0.90490 . . . . . . . . . . . 19164 1 56 . 1 1 79 79 VAL N N 15 . 1 1 79 79 VAL H H 1 0.75219 . . . . . . . . . . . 19164 1 57 . 1 1 80 80 HIS N N 15 . 1 1 80 80 HIS H H 1 0.85182 . . . . . . . . . . . 19164 1 58 . 1 1 81 81 MET N N 15 . 1 1 81 81 MET H H 1 0.77294 . . . . . . . . . . . 19164 1 59 . 1 1 83 83 ALA N N 15 . 1 1 83 83 ALA H H 1 0.99000 . . . . . . . . . . . 19164 1 60 . 1 1 84 84 MET N N 15 . 1 1 84 84 MET H H 1 0.57423 . . . . . . . . . . . 19164 1 61 . 1 1 86 86 ILE N N 15 . 1 1 86 86 ILE H H 1 0.81124 . . . . . . . . . . . 19164 1 62 . 1 1 87 87 CYS N N 15 . 1 1 87 87 CYS H H 1 0.89559 . . . . . . . . . . . 19164 1 63 . 1 1 89 89 LYS N N 15 . 1 1 89 89 LYS H H 1 0.79258 . . . . . . . . . . . 19164 1 64 . 1 1 90 90 LEU N N 15 . 1 1 90 90 LEU H H 1 0.84474 . . . . . . . . . . . 19164 1 65 . 1 1 92 92 LYS N N 15 . 1 1 92 92 LYS H H 1 0.68900 . . . . . . . . . . . 19164 1 66 . 1 1 93 93 LEU N N 15 . 1 1 93 93 LEU H H 1 0.79172 . . . . . . . . . . . 19164 1 67 . 1 1 94 94 ASP N N 15 . 1 1 94 94 ASP H H 1 0.68003 . . . . . . . . . . . 19164 1 68 . 1 1 95 95 SER N N 15 . 1 1 95 95 SER H H 1 0.88452 . . . . . . . . . . . 19164 1 69 . 1 1 96 96 GLN N N 15 . 1 1 96 96 GLN H H 1 0.97925 . . . . . . . . . . . 19164 1 70 . 1 1 97 97 ILE N N 15 . 1 1 97 97 ILE H H 1 0.76427 . . . . . . . . . . . 19164 1 71 . 1 1 102 102 TYR N N 15 . 1 1 102 102 TYR H H 1 0.99000 . . . . . . . . . . . 19164 1 72 . 1 1 103 103 GLU N N 15 . 1 1 103 103 GLU H H 1 0.46583 . . . . . . . . . . . 19164 1 73 . 1 1 104 104 LYS N N 15 . 1 1 104 104 LYS H H 1 0.57687 . . . . . . . . . . . 19164 1 74 . 1 1 105 105 THR N N 15 . 1 1 105 105 THR H H 1 0.41312 . . . . . . . . . . . 19164 1 75 . 1 1 106 106 LEU N N 15 . 1 1 106 106 LEU H H 1 0.44248 . . . . . . . . . . . 19164 1 76 . 1 1 107 107 ASP N N 15 . 1 1 107 107 ASP H H 1 0.47264 . . . . . . . . . . . 19164 1 77 . 1 1 108 108 LEU N N 15 . 1 1 108 108 LEU H H 1 0.45941 . . . . . . . . . . . 19164 1 78 . 1 1 109 109 ALA N N 15 . 1 1 109 109 ALA H H 1 0.64177 . . . . . . . . . . . 19164 1 79 . 1 1 110 110 SER N N 15 . 1 1 110 110 SER H H 1 0.57112 . . . . . . . . . . . 19164 1 80 . 1 1 111 111 VAL N N 15 . 1 1 111 111 VAL H H 1 0.51043 . . . . . . . . . . . 19164 1 81 . 1 1 112 112 ASP N N 15 . 1 1 112 112 ASP H H 1 0.59929 . . . . . . . . . . . 19164 1 82 . 1 1 113 113 LEU N N 15 . 1 1 113 113 LEU H H 1 0.51370 . . . . . . . . . . . 19164 1 83 . 1 1 114 114 ARG N N 15 . 1 1 114 114 ARG H H 1 0.69284 . . . . . . . . . . . 19164 1 84 . 1 1 115 115 LYS N N 15 . 1 1 115 115 LYS H H 1 0.75318 . . . . . . . . . . . 19164 1 85 . 1 1 116 116 MET N N 15 . 1 1 116 116 MET H H 1 0.73085 . . . . . . . . . . . 19164 1 86 . 1 1 117 117 ARG N N 15 . 1 1 117 117 ARG H H 1 0.75947 . . . . . . . . . . . 19164 1 87 . 1 1 118 118 VAL N N 15 . 1 1 118 118 VAL H H 1 0.83869 . . . . . . . . . . . 19164 1 88 . 1 1 119 119 ALA N N 15 . 1 1 119 119 ALA H H 1 0.86528 . . . . . . . . . . . 19164 1 89 . 1 1 120 120 GLU N N 15 . 1 1 120 120 GLU H H 1 0.78587 . . . . . . . . . . . 19164 1 90 . 1 1 121 121 LEU N N 15 . 1 1 121 121 LEU H H 1 0.84693 . . . . . . . . . . . 19164 1 91 . 1 1 122 122 LYS N N 15 . 1 1 122 122 LYS H H 1 0.82413 . . . . . . . . . . . 19164 1 92 . 1 1 123 123 GLN N N 15 . 1 1 123 123 GLN H H 1 0.76795 . . . . . . . . . . . 19164 1 93 . 1 1 124 124 ILE N N 15 . 1 1 124 124 ILE H H 1 0.90752 . . . . . . . . . . . 19164 1 94 . 1 1 125 125 LEU N N 15 . 1 1 125 125 LEU H H 1 0.82830 . . . . . . . . . . . 19164 1 95 . 1 1 126 126 HIS N N 15 . 1 1 126 126 HIS H H 1 0.71272 . . . . . . . . . . . 19164 1 96 . 1 1 127 127 SER N N 15 . 1 1 127 127 SER H H 1 0.66152 . . . . . . . . . . . 19164 1 97 . 1 1 128 128 TRP N N 15 . 1 1 128 128 TRP H H 1 0.68864 . . . . . . . . . . . 19164 1 98 . 1 1 129 129 GLY N N 15 . 1 1 129 129 GLY H H 1 0.86838 . . . . . . . . . . . 19164 1 99 . 1 1 131 131 GLU N N 15 . 1 1 131 131 GLU H H 1 0.64091 . . . . . . . . . . . 19164 1 100 . 1 1 136 136 ALA N N 15 . 1 1 136 136 ALA H H 1 0.60194 . . . . . . . . . . . 19164 1 101 . 1 1 137 137 GLU N N 15 . 1 1 137 137 GLU H H 1 0.78192 . . . . . . . . . . . 19164 1 102 . 1 1 139 139 THR N N 15 . 1 1 139 139 THR H H 1 0.76818 . . . . . . . . . . . 19164 1 103 . 1 1 140 140 ASP N N 15 . 1 1 140 140 ASP H H 1 0.91717 . . . . . . . . . . . 19164 1 104 . 1 1 141 141 TYR N N 15 . 1 1 141 141 TYR H H 1 0.79196 . . . . . . . . . . . 19164 1 105 . 1 1 142 142 VAL N N 15 . 1 1 142 142 VAL H H 1 0.73903 . . . . . . . . . . . 19164 1 106 . 1 1 143 143 ASN N N 15 . 1 1 143 143 ASN H H 1 0.83622 . . . . . . . . . . . 19164 1 107 . 1 1 144 144 LEU N N 15 . 1 1 144 144 LEU H H 1 0.79202 . . . . . . . . . . . 19164 1 108 . 1 1 145 145 ILE N N 15 . 1 1 145 145 ILE H H 1 0.64880 . . . . . . . . . . . 19164 1 109 . 1 1 146 146 GLN N N 15 . 1 1 146 146 GLN H H 1 0.80322 . . . . . . . . . . . 19164 1 110 . 1 1 147 147 GLU N N 15 . 1 1 147 147 GLU H H 1 0.84817 . . . . . . . . . . . 19164 1 111 . 1 1 148 148 LEU N N 15 . 1 1 148 148 LEU H H 1 0.88173 . . . . . . . . . . . 19164 1 112 . 1 1 149 149 ALA N N 15 . 1 1 149 149 ALA H H 1 0.68636 . . . . . . . . . . . 19164 1 113 . 1 1 151 151 LYS N N 15 . 1 1 151 151 LYS H H 1 0.62687 . . . . . . . . . . . 19164 1 114 . 1 1 152 152 TYR N N 15 . 1 1 152 152 TYR H H 1 0.76895 . . . . . . . . . . . 19164 1 115 . 1 1 153 153 ALA N N 15 . 1 1 153 153 ALA H H 1 0.78569 . . . . . . . . . . . 19164 1 116 . 1 1 154 154 ALA N N 15 . 1 1 154 154 ALA H H 1 0.64755 . . . . . . . . . . . 19164 1 117 . 1 1 155 155 THR N N 15 . 1 1 155 155 THR H H 1 0.53559 . . . . . . . . . . . 19164 1 118 . 1 1 156 156 HIS N N 15 . 1 1 156 156 HIS H H 1 0.48160 . . . . . . . . . . . 19164 1 119 . 1 1 158 158 LYS N N 15 . 1 1 158 158 LYS H H 1 0.38560 . . . . . . . . . . . 19164 1 120 . 1 1 159 159 THR N N 15 . 1 1 159 159 THR H H 1 0.17829 . . . . . . . . . . . 19164 1 121 . 1 1 160 160 GLU N N 15 . 1 1 160 160 GLU H H 1 0.00000 . . . . . . . . . . . 19164 1 122 . 1 1 161 161 LEU N N 15 . 1 1 161 161 LEU H H 1 -0.4963 . . . . . . . . . . . 19164 1 stop_ save_ ######################################## # Heteronuclear T1 relaxation values # ######################################## save_heteronuclear_T1_list_1 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronuclear_T1_list_1 _Heteronucl_T1_list.Entry_ID 19164 _Heteronucl_T1_list.ID 1 _Heteronucl_T1_list.Name . _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 800 _Heteronucl_T1_list.T1_coherence_type Iz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 12 HSQC . . . 19164 1 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 4 4 GLY N N 15 1.150 0.070 . . . . . 19164 1 2 . 1 1 5 5 GLY N N 15 1.210 0.060 . . . . . 19164 1 3 . 1 1 8 8 GLY N N 15 1.260 0.070 . . . . . 19164 1 4 . 1 1 9 9 ALA N N 15 1.340 0.050 . . . . . 19164 1 5 . 1 1 17 17 PHE N N 15 1.000 0.060 . . . . . 19164 1 6 . 1 1 18 18 LEU N N 15 1.029 0.029 . . . . . 19164 1 7 . 1 1 22 22 TYR N N 15 0.986 0.024 . . . . . 19164 1 8 . 1 1 23 23 LYS N N 15 0.953 0.029 . . . . . 19164 1 9 . 1 1 24 24 SER N N 15 0.993 0.023 . . . . . 19164 1 10 . 1 1 27 27 ASP N N 15 1.007 0.028 . . . . . 19164 1 11 . 1 1 28 28 ARG N N 15 0.994 0.012 . . . . . 19164 1 12 . 1 1 29 29 GLY N N 15 0.937 0.029 . . . . . 19164 1 13 . 1 1 30 30 VAL N N 15 0.932 0.031 . . . . . 19164 1 14 . 1 1 32 32 PHE N N 15 0.980 0.070 . . . . . 19164 1 15 . 1 1 33 33 SER N N 15 0.923 0.035 . . . . . 19164 1 16 . 1 1 34 34 LEU N N 15 0.991 0.035 . . . . . 19164 1 17 . 1 1 35 35 ASP N N 15 0.969 0.040 . . . . . 19164 1 18 . 1 1 38 38 GLU N N 15 1.011 0.015 . . . . . 19164 1 19 . 1 1 41 41 LEU N N 15 0.928 0.020 . . . . . 19164 1 20 . 1 1 43 43 SER N N 15 0.951 0.016 . . . . . 19164 1 21 . 1 1 44 44 PHE N N 15 0.949 0.015 . . . . . 19164 1 22 . 1 1 45 45 CYS N N 15 0.843 0.034 . . . . . 19164 1 23 . 1 1 46 46 LEU N N 15 0.948 0.014 . . . . . 19164 1 24 . 1 1 48 48 THR N N 15 0.855 0.019 . . . . . 19164 1 25 . 1 1 49 49 LYS N N 15 1.022 0.035 . . . . . 19164 1 26 . 1 1 50 50 GLY N N 15 1.070 0.080 . . . . . 19164 1 27 . 1 1 53 53 ASN N N 15 0.913 0.038 . . . . . 19164 1 28 . 1 1 56 56 CYS N N 15 0.920 0.031 . . . . . 19164 1 29 . 1 1 57 57 TYR N N 15 1.012 0.036 . . . . . 19164 1 30 . 1 1 59 59 LEU N N 15 0.954 0.017 . . . . . 19164 1 31 . 1 1 60 60 GLY N N 15 0.893 0.040 . . . . . 19164 1 32 . 1 1 62 62 THR N N 15 1.003 0.038 . . . . . 19164 1 33 . 1 1 65 65 ALA N N 15 1.100 0.047 . . . . . 19164 1 34 . 1 1 66 66 ALA N N 15 1.249 0.049 . . . . . 19164 1 35 . 1 1 67 67 THR N N 15 1.153 0.047 . . . . . 19164 1 36 . 1 1 77 77 MET N N 15 1.220 0.130 . . . . . 19164 1 37 . 1 1 78 78 SER N N 15 1.023 0.017 . . . . . 19164 1 38 . 1 1 79 79 VAL N N 15 1.088 0.026 . . . . . 19164 1 39 . 1 1 83 83 ALA N N 15 1.040 0.060 . . . . . 19164 1 40 . 1 1 84 84 MET N N 15 1.080 0.050 . . . . . 19164 1 41 . 1 1 87 87 CYS N N 15 1.028 0.030 . . . . . 19164 1 42 . 1 1 90 90 LEU N N 15 1.091 0.021 . . . . . 19164 1 43 . 1 1 92 92 LYS N N 15 0.986 0.020 . . . . . 19164 1 44 . 1 1 94 94 ASP N N 15 1.016 0.033 . . . . . 19164 1 45 . 1 1 95 95 SER N N 15 1.260 0.110 . . . . . 19164 1 46 . 1 1 97 97 ILE N N 15 1.032 0.036 . . . . . 19164 1 47 . 1 1 102 102 TYR N N 15 1.070 0.035 . . . . . 19164 1 48 . 1 1 103 103 GLU N N 15 0.970 0.060 . . . . . 19164 1 49 . 1 1 106 106 LEU N N 15 1.169 0.037 . . . . . 19164 1 50 . 1 1 110 110 SER N N 15 1.230 0.050 . . . . . 19164 1 51 . 1 1 111 111 VAL N N 15 1.082 0.030 . . . . . 19164 1 52 . 1 1 112 112 ASP N N 15 1.195 0.049 . . . . . 19164 1 53 . 1 1 114 114 ARG N N 15 1.194 0.030 . . . . . 19164 1 54 . 1 1 115 115 LYS N N 15 1.143 0.038 . . . . . 19164 1 55 . 1 1 116 116 MET N N 15 1.160 0.023 . . . . . 19164 1 56 . 1 1 117 117 ARG N N 15 1.040 0.033 . . . . . 19164 1 57 . 1 1 118 118 VAL N N 15 1.170 0.050 . . . . . 19164 1 58 . 1 1 119 119 ALA N N 15 1.287 0.033 . . . . . 19164 1 59 . 1 1 120 120 GLU N N 15 1.095 0.018 . . . . . 19164 1 60 . 1 1 121 121 LEU N N 15 1.159 0.028 . . . . . 19164 1 61 . 1 1 124 124 ILE N N 15 1.234 0.033 . . . . . 19164 1 62 . 1 1 125 125 LEU N N 15 1.126 0.031 . . . . . 19164 1 63 . 1 1 126 126 HIS N N 15 1.249 0.018 . . . . . 19164 1 64 . 1 1 128 128 TRP N N 15 1.101 0.022 . . . . . 19164 1 65 . 1 1 129 129 GLY N N 15 1.205 0.015 . . . . . 19164 1 66 . 1 1 131 131 GLU N N 15 1.083 0.030 . . . . . 19164 1 67 . 1 1 136 136 ALA N N 15 0.986 0.032 . . . . . 19164 1 68 . 1 1 139 139 THR N N 15 1.230 0.050 . . . . . 19164 1 69 . 1 1 140 140 ASP N N 15 1.380 0.100 . . . . . 19164 1 70 . 1 1 141 141 TYR N N 15 1.112 0.028 . . . . . 19164 1 71 . 1 1 142 142 VAL N N 15 1.090 0.028 . . . . . 19164 1 72 . 1 1 144 144 LEU N N 15 1.221 0.023 . . . . . 19164 1 73 . 1 1 145 145 ILE N N 15 1.163 0.022 . . . . . 19164 1 74 . 1 1 146 146 GLN N N 15 1.148 0.020 . . . . . 19164 1 75 . 1 1 148 148 LEU N N 15 1.149 0.023 . . . . . 19164 1 76 . 1 1 152 152 TYR N N 15 1.070 0.040 . . . . . 19164 1 77 . 1 1 153 153 ALA N N 15 1.150 0.020 . . . . . 19164 1 78 . 1 1 154 154 ALA N N 15 1.290 0.043 . . . . . 19164 1 79 . 1 1 155 155 THR N N 15 1.270 0.070 . . . . . 19164 1 80 . 1 1 160 160 GLU N N 15 1.270 0.050 . . . . . 19164 1 81 . 1 1 161 161 LEU N N 15 0.986 0.003 . . . . . 19164 1 stop_ save_ ######################################## # Heteronuclear T2 relaxation values # ######################################## save_heteronuclear_T2_list_1 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronuclear_T2_list_1 _Heteronucl_T2_list.Entry_ID 19164 _Heteronucl_T2_list.ID 1 _Heteronucl_T2_list.Name . _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method . _Heteronucl_T2_list.Temp_control_method . _Heteronucl_T2_list.Spectrometer_frequency_1H 800 _Heteronucl_T2_list.T2_coherence_type I(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 12 HSQC . . . 19164 1 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 4 4 GLY N N 15 2.35 0.13 . . . . . . . 19164 1 2 . 1 1 5 5 GLY N N 15 2.43 0.10 . . . . . . . 19164 1 3 . 1 1 8 8 GLY N N 15 5.27 0.13 . . . . . . . 19164 1 4 . 1 1 9 9 ALA N N 15 6.39 0.09 . . . . . . . 19164 1 5 . 1 1 17 17 PHE N N 15 16.90 0.90 . . . . . . . 19164 1 6 . 1 1 18 18 LEU N N 15 15.28 0.17 . . . . . . . 19164 1 7 . 1 1 22 22 TYR N N 15 17.17 0.41 . . . . . . . 19164 1 8 . 1 1 23 23 LYS N N 15 14.37 0.25 . . . . . . . 19164 1 9 . 1 1 24 24 SER N N 15 14.27 0.16 . . . . . . . 19164 1 10 . 1 1 27 27 ASP N N 15 14.90 0.23 . . . . . . . 19164 1 11 . 1 1 28 28 ARG N N 15 13.35 0.19 . . . . . . . 19164 1 12 . 1 1 29 29 GLY N N 15 15.18 0.35 . . . . . . . 19164 1 13 . 1 1 30 30 VAL N N 15 17.74 0.34 . . . . . . . 19164 1 14 . 1 1 32 32 PHE N N 15 15.23 0.41 . . . . . . . 19164 1 15 . 1 1 33 33 SER N N 15 10.38 0.16 . . . . . . . 19164 1 16 . 1 1 34 34 LEU N N 15 14.76 0.28 . . . . . . . 19164 1 17 . 1 1 35 35 ASP N N 15 15.11 0.18 . . . . . . . 19164 1 18 . 1 1 38 38 GLU N N 15 17.89 0.29 . . . . . . . 19164 1 19 . 1 1 41 41 LEU N N 15 16.58 0.14 . . . . . . . 19164 1 20 . 1 1 43 43 SER N N 15 16.07 0.12 . . . . . . . 19164 1 21 . 1 1 44 44 PHE N N 15 18.04 0.42 . . . . . . . 19164 1 22 . 1 1 45 45 CYS N N 15 17.80 0.60 . . . . . . . 19164 1 23 . 1 1 46 46 LEU N N 15 20.41 0.40 . . . . . . . 19164 1 24 . 1 1 48 48 THR N N 15 12.53 0.11 . . . . . . . 19164 1 25 . 1 1 49 49 LYS N N 15 13.00 0.17 . . . . . . . 19164 1 26 . 1 1 50 50 GLY N N 15 11.80 0.80 . . . . . . . 19164 1 27 . 1 1 53 53 ASN N N 15 16.76 0.39 . . . . . . . 19164 1 28 . 1 1 56 56 CYS N N 15 15.28 0.20 . . . . . . . 19164 1 29 . 1 1 57 57 TYR N N 15 9.60 0.70 . . . . . . . 19164 1 30 . 1 1 59 59 LEU N N 15 14.82 0.31 . . . . . . . 19164 1 31 . 1 1 60 60 GLY N N 15 29.20 1.20 . . . . . . . 19164 1 32 . 1 1 62 62 THR N N 15 14.81 0.44 . . . . . . . 19164 1 33 . 1 1 65 65 ALA N N 15 11.01 0.06 . . . . . . . 19164 1 34 . 1 1 66 66 ALA N N 15 4.23 0.31 . . . . . . . 19164 1 35 . 1 1 67 67 THR N N 15 16.50 0.60 . . . . . . . 19164 1 36 . 1 1 77 77 MET N N 15 19.45 0.48 . . . . . . . 19164 1 37 . 1 1 78 78 SER N N 15 16.60 0.31 . . . . . . . 19164 1 38 . 1 1 79 79 VAL N N 15 17.20 0.50 . . . . . . . 19164 1 39 . 1 1 83 83 ALA N N 15 15.96 0.47 . . . . . . . 19164 1 40 . 1 1 84 84 MET N N 15 14.62 0.47 . . . . . . . 19164 1 41 . 1 1 87 87 CYS N N 15 14.44 0.26 . . . . . . . 19164 1 42 . 1 1 90 90 LEU N N 15 13.19 0.26 . . . . . . . 19164 1 43 . 1 1 92 92 LYS N N 15 15.29 0.27 . . . . . . . 19164 1 44 . 1 1 94 94 ASP N N 15 17.14 0.20 . . . . . . . 19164 1 45 . 1 1 95 95 SER N N 15 10.07 0.32 . . . . . . . 19164 1 46 . 1 1 97 97 ILE N N 15 17.46 0.41 . . . . . . . 19164 1 47 . 1 1 102 102 TYR N N 15 13.51 0.35 . . . . . . . 19164 1 48 . 1 1 103 103 GLU N N 15 13.14 0.29 . . . . . . . 19164 1 49 . 1 1 106 106 LEU N N 15 8.10 0.31 . . . . . . . 19164 1 50 . 1 1 110 110 SER N N 15 10.10 0.38 . . . . . . . 19164 1 51 . 1 1 111 111 VAL N N 15 12.79 0.31 . . . . . . . 19164 1 52 . 1 1 112 112 ASP N N 15 7.57 0.29 . . . . . . . 19164 1 53 . 1 1 114 114 ARG N N 15 14.34 0.37 . . . . . . . 19164 1 54 . 1 1 115 115 LYS N N 15 13.15 0.23 . . . . . . . 19164 1 55 . 1 1 116 116 MET N N 15 11.41 0.08 . . . . . . . 19164 1 56 . 1 1 117 117 ARG N N 15 13.95 0.30 . . . . . . . 19164 1 57 . 1 1 118 118 VAL N N 15 13.25 0.37 . . . . . . . 19164 1 58 . 1 1 119 119 ALA N N 15 16.36 0.12 . . . . . . . 19164 1 59 . 1 1 120 120 GLU N N 15 13.79 0.21 . . . . . . . 19164 1 60 . 1 1 121 121 LEU N N 15 13.59 0.20 . . . . . . . 19164 1 61 . 1 1 124 124 ILE N N 15 13.41 0.26 . . . . . . . 19164 1 62 . 1 1 125 125 LEU N N 15 17.66 0.29 . . . . . . . 19164 1 63 . 1 1 126 126 HIS N N 15 15.12 0.30 . . . . . . . 19164 1 64 . 1 1 128 128 TRP N N 15 12.97 0.21 . . . . . . . 19164 1 65 . 1 1 129 129 GLY N N 15 12.54 0.26 . . . . . . . 19164 1 66 . 1 1 131 131 GLU N N 15 13.34 0.11 . . . . . . . 19164 1 67 . 1 1 136 136 ALA N N 15 10.93 0.24 . . . . . . . 19164 1 68 . 1 1 139 139 THR N N 15 14.45 0.32 . . . . . . . 19164 1 69 . 1 1 140 140 ASP N N 15 14.78 0.20 . . . . . . . 19164 1 70 . 1 1 141 141 TYR N N 15 17.36 0.44 . . . . . . . 19164 1 71 . 1 1 142 142 VAL N N 15 13.56 0.19 . . . . . . . 19164 1 72 . 1 1 144 144 LEU N N 15 13.36 0.23 . . . . . . . 19164 1 73 . 1 1 145 145 ILE N N 15 13.39 0.28 . . . . . . . 19164 1 74 . 1 1 146 146 GLN N N 15 14.32 0.22 . . . . . . . 19164 1 75 . 1 1 148 148 LEU N N 15 13.73 0.30 . . . . . . . 19164 1 76 . 1 1 152 152 TYR N N 15 15.01 0.25 . . . . . . . 19164 1 77 . 1 1 153 153 ALA N N 15 11.52 0.14 . . . . . . . 19164 1 78 . 1 1 154 154 ALA N N 15 8.66 0.13 . . . . . . . 19164 1 79 . 1 1 155 155 THR N N 15 8.50 0.13 . . . . . . . 19164 1 80 . 1 1 160 160 GLU N N 15 3.24 0.09 . . . . . . . 19164 1 81 . 1 1 161 161 LEU N N 15 0.45 0.28 . . . . . . . 19164 1 stop_ save_