data_16317 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16317 _Entry.Title ; Solution structure of human interleukin-33 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-05-26 _Entry.Accession_date 2009-05-26 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.125 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Andreas Lingel . . . 16317 2 Wayne Fairbrother . . . 16317 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'not applicable' 'not applicable' . 16317 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID beta-trefoil . 16317 interleukin . 16317 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16317 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 548 16317 '15N chemical shifts' 151 16317 '1H chemical shifts' 1046 16317 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 . . 2010-05-28 2009-05-26 update BMRB 'edit entity/assembly name' 16317 2 . . 2009-11-25 2009-05-26 update BMRB 'complete entry citation' 16317 1 . . 2009-07-23 2009-05-26 original author 'original release' 16317 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2KLL 'BMRB Entry Tracking System' 16317 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16317 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1007/s12104-009-9180-6 _Citation.PubMed_ID 19888696 _Citation.Full_citation . _Citation.Title 'NMR assignments of the human cytokine interleukin-33' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 3 _Citation.Journal_issue 2 _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 223 _Citation.Page_last 225 _Citation.Year 2009 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Andreas Lingel . . . 16317 1 2 Wayne Fairbrother . J. . 16317 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16317 _Assembly.ID 1 _Assembly.Name 'human interleukin-33' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'human interleukin-33' 1 $entity A . yes native no no . . . 16317 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 16317 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'human interleukin-33' _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 ; GSSITGISPITEYLASLSTY NDQSITFALEDESYEIYVED LKKDEKKDKVLLSYYESQHP SNESGDGVDGKMLMVTLSPT KDFWLHANNKEHSVELHKCE KPLPDQAFFVLHNMHSNCVS FECKTDPGVFIGVKDNHLAL IKVDSSENLCTENILFKLSE T ; _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 free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2KLL . "Solution Structure Of Human Interleukin-33" . . . . . 100.00 161 100.00 100.00 8.71e-113 . . . . 16317 1 2 no PDB 4KC3 . "Cytokine/receptor Binary Complex" . . . . . 98.76 159 98.11 98.11 4.49e-108 . . . . 16317 1 3 no DBJ BAA75892 . "DVS27-related protein [Homo sapiens]" . . . . . 99.38 270 100.00 100.00 5.81e-112 . . . . 16317 1 4 no DBJ BAG36208 . "unnamed protein product [Homo sapiens]" . . . . . 99.38 270 99.38 99.38 9.07e-111 . . . . 16317 1 5 no DBJ BAG58697 . "unnamed protein product [Homo sapiens]" . . . . . 70.81 144 99.12 100.00 5.19e-77 . . . . 16317 1 6 no DBJ BAJ20898 . "interleukin 33 [synthetic construct]" . . . . . 99.38 270 100.00 100.00 5.81e-112 . . . . 16317 1 7 no EMBL CAG28547 . "C9orf26 [Homo sapiens]" . . . . . 99.38 270 100.00 100.00 5.81e-112 . . . . 16317 1 8 no GB AAH47085 . "Interleukin 33 [Homo sapiens]" . . . . . 99.38 270 100.00 100.00 5.81e-112 . . . . 16317 1 9 no GB AAX86998 . "interleukin-33 [Homo sapiens]" . . . . . 99.38 270 100.00 100.00 5.81e-112 . . . . 16317 1 10 no GB ADR77828 . "interleukin 33 variant 2 [Homo sapiens]" . . . . . 97.52 228 100.00 100.00 3.32e-110 . . . . 16317 1 11 no GB AIC52722 . "IL33, partial [synthetic construct]" . . . . . 99.38 270 100.00 100.00 5.81e-112 . . . . 16317 1 12 no GB EAW58748 . "chromosome 9 open reading frame 26 (NF-HEV), isoform CRA_a [Homo sapiens]" . . . . . 99.38 270 100.00 100.00 5.81e-112 . . . . 16317 1 13 no REF NP_001186570 . "interleukin-33 isoform c [Homo sapiens]" . . . . . 70.81 144 99.12 100.00 5.19e-77 . . . . 16317 1 14 no REF NP_001300973 . "interleukin-33 isoform a [Homo sapiens]" . . . . . 99.38 270 100.00 100.00 5.81e-112 . . . . 16317 1 15 no REF NP_001300974 . "interleukin-33 isoform a [Homo sapiens]" . . . . . 99.38 270 100.00 100.00 5.81e-112 . . . . 16317 1 16 no REF NP_001300975 . "interleukin-33 isoform d [Homo sapiens]" . . . . . 95.65 264 99.35 99.35 1.95e-106 . . . . 16317 1 17 no REF NP_001300976 . "interleukin-33 isoform d [Homo sapiens]" . . . . . 95.65 264 99.35 99.35 1.95e-106 . . . . 16317 1 18 no SP O95760 . "RecName: Full=Interleukin-33; Short=IL-33; AltName: Full=Interleukin-1 family member 11; Short=IL-1F11; AltName: Full=Nuclear f" . . . . . 99.38 270 100.00 100.00 5.81e-112 . . . . 16317 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 0 GLY . 16317 1 2 1 SER . 16317 1 3 2 SER . 16317 1 4 3 ILE . 16317 1 5 4 THR . 16317 1 6 5 GLY . 16317 1 7 6 ILE . 16317 1 8 7 SER . 16317 1 9 8 PRO . 16317 1 10 9 ILE . 16317 1 11 10 THR . 16317 1 12 11 GLU . 16317 1 13 12 TYR . 16317 1 14 13 LEU . 16317 1 15 14 ALA . 16317 1 16 15 SER . 16317 1 17 16 LEU . 16317 1 18 17 SER . 16317 1 19 18 THR . 16317 1 20 19 TYR . 16317 1 21 20 ASN . 16317 1 22 21 ASP . 16317 1 23 22 GLN . 16317 1 24 23 SER . 16317 1 25 24 ILE . 16317 1 26 25 THR . 16317 1 27 26 PHE . 16317 1 28 27 ALA . 16317 1 29 28 LEU . 16317 1 30 29 GLU . 16317 1 31 30 ASP . 16317 1 32 31 GLU . 16317 1 33 32 SER . 16317 1 34 33 TYR . 16317 1 35 34 GLU . 16317 1 36 35 ILE . 16317 1 37 36 TYR . 16317 1 38 37 VAL . 16317 1 39 38 GLU . 16317 1 40 39 ASP . 16317 1 41 40 LEU . 16317 1 42 41 LYS . 16317 1 43 42 LYS . 16317 1 44 43 ASP . 16317 1 45 44 GLU . 16317 1 46 45 LYS . 16317 1 47 46 LYS . 16317 1 48 47 ASP . 16317 1 49 48 LYS . 16317 1 50 49 VAL . 16317 1 51 50 LEU . 16317 1 52 51 LEU . 16317 1 53 52 SER . 16317 1 54 53 TYR . 16317 1 55 54 TYR . 16317 1 56 55 GLU . 16317 1 57 56 SER . 16317 1 58 57 GLN . 16317 1 59 58 HIS . 16317 1 60 59 PRO . 16317 1 61 60 SER . 16317 1 62 61 ASN . 16317 1 63 62 GLU . 16317 1 64 63 SER . 16317 1 65 64 GLY . 16317 1 66 65 ASP . 16317 1 67 66 GLY . 16317 1 68 67 VAL . 16317 1 69 68 ASP . 16317 1 70 69 GLY . 16317 1 71 70 LYS . 16317 1 72 71 MET . 16317 1 73 72 LEU . 16317 1 74 73 MET . 16317 1 75 74 VAL . 16317 1 76 75 THR . 16317 1 77 76 LEU . 16317 1 78 77 SER . 16317 1 79 78 PRO . 16317 1 80 79 THR . 16317 1 81 80 LYS . 16317 1 82 81 ASP . 16317 1 83 82 PHE . 16317 1 84 83 TRP . 16317 1 85 84 LEU . 16317 1 86 85 HIS . 16317 1 87 86 ALA . 16317 1 88 87 ASN . 16317 1 89 88 ASN . 16317 1 90 89 LYS . 16317 1 91 90 GLU . 16317 1 92 91 HIS . 16317 1 93 92 SER . 16317 1 94 93 VAL . 16317 1 95 94 GLU . 16317 1 96 95 LEU . 16317 1 97 96 HIS . 16317 1 98 97 LYS . 16317 1 99 98 CYS . 16317 1 100 99 GLU . 16317 1 101 100 LYS . 16317 1 102 101 PRO . 16317 1 103 102 LEU . 16317 1 104 103 PRO . 16317 1 105 104 ASP . 16317 1 106 105 GLN . 16317 1 107 106 ALA . 16317 1 108 107 PHE . 16317 1 109 108 PHE . 16317 1 110 109 VAL . 16317 1 111 110 LEU . 16317 1 112 111 HIS . 16317 1 113 112 ASN . 16317 1 114 113 MET . 16317 1 115 114 HIS . 16317 1 116 115 SER . 16317 1 117 116 ASN . 16317 1 118 117 CYS . 16317 1 119 118 VAL . 16317 1 120 119 SER . 16317 1 121 120 PHE . 16317 1 122 121 GLU . 16317 1 123 122 CYS . 16317 1 124 123 LYS . 16317 1 125 124 THR . 16317 1 126 125 ASP . 16317 1 127 126 PRO . 16317 1 128 127 GLY . 16317 1 129 128 VAL . 16317 1 130 129 PHE . 16317 1 131 130 ILE . 16317 1 132 131 GLY . 16317 1 133 132 VAL . 16317 1 134 133 LYS . 16317 1 135 134 ASP . 16317 1 136 135 ASN . 16317 1 137 136 HIS . 16317 1 138 137 LEU . 16317 1 139 138 ALA . 16317 1 140 139 LEU . 16317 1 141 140 ILE . 16317 1 142 141 LYS . 16317 1 143 142 VAL . 16317 1 144 143 ASP . 16317 1 145 144 SER . 16317 1 146 145 SER . 16317 1 147 146 GLU . 16317 1 148 147 ASN . 16317 1 149 148 LEU . 16317 1 150 149 CYS . 16317 1 151 150 THR . 16317 1 152 151 GLU . 16317 1 153 152 ASN . 16317 1 154 153 ILE . 16317 1 155 154 LEU . 16317 1 156 155 PHE . 16317 1 157 156 LYS . 16317 1 158 157 LEU . 16317 1 159 158 SER . 16317 1 160 159 GLU . 16317 1 161 160 THR . 16317 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 16317 1 . SER 2 2 16317 1 . SER 3 3 16317 1 . ILE 4 4 16317 1 . THR 5 5 16317 1 . GLY 6 6 16317 1 . ILE 7 7 16317 1 . SER 8 8 16317 1 . PRO 9 9 16317 1 . ILE 10 10 16317 1 . THR 11 11 16317 1 . GLU 12 12 16317 1 . TYR 13 13 16317 1 . LEU 14 14 16317 1 . ALA 15 15 16317 1 . SER 16 16 16317 1 . LEU 17 17 16317 1 . SER 18 18 16317 1 . THR 19 19 16317 1 . TYR 20 20 16317 1 . ASN 21 21 16317 1 . ASP 22 22 16317 1 . GLN 23 23 16317 1 . SER 24 24 16317 1 . ILE 25 25 16317 1 . THR 26 26 16317 1 . PHE 27 27 16317 1 . ALA 28 28 16317 1 . LEU 29 29 16317 1 . GLU 30 30 16317 1 . ASP 31 31 16317 1 . GLU 32 32 16317 1 . SER 33 33 16317 1 . TYR 34 34 16317 1 . GLU 35 35 16317 1 . ILE 36 36 16317 1 . TYR 37 37 16317 1 . VAL 38 38 16317 1 . GLU 39 39 16317 1 . ASP 40 40 16317 1 . LEU 41 41 16317 1 . LYS 42 42 16317 1 . LYS 43 43 16317 1 . ASP 44 44 16317 1 . GLU 45 45 16317 1 . LYS 46 46 16317 1 . LYS 47 47 16317 1 . ASP 48 48 16317 1 . LYS 49 49 16317 1 . VAL 50 50 16317 1 . LEU 51 51 16317 1 . LEU 52 52 16317 1 . SER 53 53 16317 1 . TYR 54 54 16317 1 . TYR 55 55 16317 1 . GLU 56 56 16317 1 . SER 57 57 16317 1 . GLN 58 58 16317 1 . HIS 59 59 16317 1 . PRO 60 60 16317 1 . SER 61 61 16317 1 . ASN 62 62 16317 1 . GLU 63 63 16317 1 . SER 64 64 16317 1 . GLY 65 65 16317 1 . ASP 66 66 16317 1 . GLY 67 67 16317 1 . VAL 68 68 16317 1 . ASP 69 69 16317 1 . GLY 70 70 16317 1 . LYS 71 71 16317 1 . MET 72 72 16317 1 . LEU 73 73 16317 1 . MET 74 74 16317 1 . VAL 75 75 16317 1 . THR 76 76 16317 1 . LEU 77 77 16317 1 . SER 78 78 16317 1 . PRO 79 79 16317 1 . THR 80 80 16317 1 . LYS 81 81 16317 1 . ASP 82 82 16317 1 . PHE 83 83 16317 1 . TRP 84 84 16317 1 . LEU 85 85 16317 1 . HIS 86 86 16317 1 . ALA 87 87 16317 1 . ASN 88 88 16317 1 . ASN 89 89 16317 1 . LYS 90 90 16317 1 . GLU 91 91 16317 1 . HIS 92 92 16317 1 . SER 93 93 16317 1 . VAL 94 94 16317 1 . GLU 95 95 16317 1 . LEU 96 96 16317 1 . HIS 97 97 16317 1 . LYS 98 98 16317 1 . CYS 99 99 16317 1 . GLU 100 100 16317 1 . LYS 101 101 16317 1 . PRO 102 102 16317 1 . LEU 103 103 16317 1 . PRO 104 104 16317 1 . ASP 105 105 16317 1 . GLN 106 106 16317 1 . ALA 107 107 16317 1 . PHE 108 108 16317 1 . PHE 109 109 16317 1 . VAL 110 110 16317 1 . LEU 111 111 16317 1 . HIS 112 112 16317 1 . ASN 113 113 16317 1 . MET 114 114 16317 1 . HIS 115 115 16317 1 . SER 116 116 16317 1 . ASN 117 117 16317 1 . CYS 118 118 16317 1 . VAL 119 119 16317 1 . SER 120 120 16317 1 . PHE 121 121 16317 1 . GLU 122 122 16317 1 . CYS 123 123 16317 1 . LYS 124 124 16317 1 . THR 125 125 16317 1 . ASP 126 126 16317 1 . PRO 127 127 16317 1 . GLY 128 128 16317 1 . VAL 129 129 16317 1 . PHE 130 130 16317 1 . ILE 131 131 16317 1 . GLY 132 132 16317 1 . VAL 133 133 16317 1 . LYS 134 134 16317 1 . ASP 135 135 16317 1 . ASN 136 136 16317 1 . HIS 137 137 16317 1 . LEU 138 138 16317 1 . ALA 139 139 16317 1 . LEU 140 140 16317 1 . ILE 141 141 16317 1 . LYS 142 142 16317 1 . VAL 143 143 16317 1 . ASP 144 144 16317 1 . SER 145 145 16317 1 . SER 146 146 16317 1 . GLU 147 147 16317 1 . ASN 148 148 16317 1 . LEU 149 149 16317 1 . CYS 150 150 16317 1 . THR 151 151 16317 1 . GLU 152 152 16317 1 . ASN 153 153 16317 1 . ILE 154 154 16317 1 . LEU 155 155 16317 1 . PHE 156 156 16317 1 . LYS 157 157 16317 1 . LEU 158 158 16317 1 . SER 159 159 16317 1 . GLU 160 160 16317 1 . THR 161 161 16317 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 16317 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 16317 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 16317 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET101 . . . . . . 16317 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_15N_sample _Sample.Sf_category sample _Sample.Sf_framecode 15N_sample _Sample.Entry_ID 16317 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Interleukin-33 '[U-100% 15N]' . . 1 $entity . . 1 . . mM . . . . 16317 1 2 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 16317 1 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 16317 1 4 beta-mercaptoethanol 'natural abundance' . . . . . . 5 . . mM . . . . 16317 1 5 H2O 'natural abundance' . . . . . . 95 . . % . . . . 16317 1 6 D2O 'natural abundance' . . . . . . 5 . . % . . . . 16317 1 stop_ save_ save_unlabeled_sample _Sample.Sf_category sample _Sample.Sf_framecode unlabeled_sample _Sample.Entry_ID 16317 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Interleukin-33 'natural abundance' . . 1 $entity . . 1 . . mM . . . . 16317 2 2 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 16317 2 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 16317 2 4 beta-mercaptoethanol '[U-100% 2H]' . . . . . . 5 . . mM . . . . 16317 2 5 D2O 'natural abundance' . . . . . . 100 . . % . . . . 16317 2 stop_ save_ save_15N_13C_sample _Sample.Sf_category sample _Sample.Sf_framecode 15N_13C_sample _Sample.Entry_ID 16317 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Interleukin-33 '[U-100% 13C; U-100% 15N]' . . 1 $entity . . 1 . . mM . . . . 16317 3 2 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 16317 3 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 16317 3 4 beta-mercaptoethanol 'natural abundance' . . . . . . 5 . . mM . . . . 16317 3 5 H2O 'natural abundance' . . . . . . 95 . . % . . . . 16317 3 6 D2O 'natural abundance' . . . . . . 5 . . % . . . . 16317 3 stop_ save_ save_15N_13C_sample_D2O _Sample.Sf_category sample _Sample.Sf_framecode 15N_13C_sample_D2O _Sample.Entry_ID 16317 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Interleukin-33 '[U-100% 13C; U-100% 15N]' . . 1 $entity . . 1 . . mM . . . . 16317 4 2 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 16317 4 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 16317 4 4 beta-mercaptoethanol '[U-100% 2H]' . . . . . . 5 . . mM . . . . 16317 4 5 D2O 'natural abundance' . . . . . . 100 . . % . . . . 16317 4 stop_ save_ ####################### # Sample conditions # ####################### save_Condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Condition_1 _Sample_condition_list.Entry_ID 16317 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.1 . M 16317 1 pH 6.5 . pH 16317 1 pressure 1 . atm 16317 1 temperature 308 . K 16317 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 16317 _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 16317 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 16317 1 stop_ save_ save_CCPN _Software.Sf_category software _Software.Sf_framecode CCPN _Software.Entry_ID 16317 _Software.ID 2 _Software.Name CCPN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 16317 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 16317 2 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 16317 _Software.ID 3 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 16317 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 16317 3 stop_ save_ save_ARIA _Software.Sf_category software _Software.Sf_framecode ARIA _Software.Entry_ID 16317 _Software.ID 4 _Software.Name ARIA _Software.Version 2.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Linge, O'Donoghue and Nilges' . . 16317 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 16317 4 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 16317 _Software.ID 5 _Software.Name CNS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 16317 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 16317 5 stop_ save_ save_Molmol _Software.Sf_category software _Software.Sf_framecode Molmol _Software.Entry_ID 16317 _Software.ID 6 _Software.Name Molmol _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Koradi, Billeter and Wuthrich' . . 16317 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID Display 16317 6 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 16317 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'cryogenic triple-resonance probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 16317 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'room temperature triple-resonance probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 16317 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details 'cryogenic triple-resonance probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 16317 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DRX . 600 'cryogenic triple-resonance probe' . . 16317 1 2 spectrometer_2 Bruker DRX . 800 'room temperature triple-resonance probe' . . 16317 1 3 spectrometer_3 Bruker DRX . 900 'cryogenic triple-resonance probe' . . 16317 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 16317 _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 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $15N_sample isotropic . . 1 $Condition_1 . . . . . . . . . . . . . . . . . . . . . 16317 1 2 '3D 1H-13C NOESY' no . . . . . . . . . . 4 $15N_13C_sample_D2O isotropic . . 1 $Condition_1 . . . . . . . . . . . . . . . . . . . . . 16317 1 3 '3D HNHA' no . . . . . . . . . . 1 $15N_sample isotropic . . 1 $Condition_1 . . . . . . . . . . . . . . . . . . . . . 16317 1 4 '2D 1H-1H NOESY' no . . . . . . . . . . 2 $unlabeled_sample isotropic . . 1 $Condition_1 . . . . . . . . . . . . . . . . . . . . . 16317 1 5 '3D HNCA' no . . . . . . . . . . 3 $15N_13C_sample isotropic . . 1 $Condition_1 . . . . . . . . . . . . . . . . . . . . . 16317 1 6 '3D HNCACB' no . . . . . . . . . . 3 $15N_13C_sample isotropic . . 1 $Condition_1 . . . . . . . . . . . . . . . . . . . . . 16317 1 7 '3D CBCA(CO)NH' no . . . . . . . . . . 3 $15N_13C_sample isotropic . . 1 $Condition_1 . . . . . . . . . . . . . . . . . . . . . 16317 1 8 '3D C(CO)NH' no . . . . . . . . . . 3 $15N_13C_sample isotropic . . 1 $Condition_1 . . . . . . . . . . . . . . . . . . . . . 16317 1 9 '3D H(CCO)NH' no . . . . . . . . . . 3 $15N_13C_sample isotropic . . 1 $Condition_1 . . . . . . . . . . . . . . . . . . . . . 16317 1 10 '3D HCCH-TOCSY' no . . . . . . . . . . 4 $15N_13C_sample_D2O isotropic . . 1 $Condition_1 . . . . . . . . . . . . . . . . . . . . . 16317 1 11 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $15N_sample isotropic . . 1 $Condition_1 . . . . . . . . . . . . . . . . . . . . . 16317 1 12 '2D 1H-13C HSQC' no . . . . . . . . . . 3 $15N_13C_sample isotropic . . 1 $Condition_1 . . . . . . . . . . . . . . . . . . . . . 16317 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 16317 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 16317 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 16317 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 16317 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 16317 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 1H-15N NOESY' . . . 16317 1 2 '3D 1H-13C NOESY' . . . 16317 1 3 '3D HNHA' . . . 16317 1 5 '3D HNCA' . . . 16317 1 6 '3D HNCACB' . . . 16317 1 7 '3D CBCA(CO)NH' . . . 16317 1 8 '3D C(CO)NH' . . . 16317 1 9 '3D H(CCO)NH' . . . 16317 1 10 '3D HCCH-TOCSY' . . . 16317 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 4 4 ILE H H 1 8.198 0.02 . 1 . . . . 3 ILE HN . 16317 1 2 . 1 1 4 4 ILE HA H 1 4.246 0.02 . 1 . . . . 3 ILE HA . 16317 1 3 . 1 1 4 4 ILE HB H 1 1.821 0.02 . 1 . . . . 3 ILE HB . 16317 1 4 . 1 1 4 4 ILE HD11 H 1 0.748 0.02 . 1 . . . . 3 ILE QD1 . 16317 1 5 . 1 1 4 4 ILE HD12 H 1 0.748 0.02 . 1 . . . . 3 ILE QD1 . 16317 1 6 . 1 1 4 4 ILE HD13 H 1 0.748 0.02 . 1 . . . . 3 ILE QD1 . 16317 1 7 . 1 1 4 4 ILE HG12 H 1 1.087 0.02 . 2 . . . . 3 ILE HG12 . 16317 1 8 . 1 1 4 4 ILE HG13 H 1 1.371 0.02 . 2 . . . . 3 ILE HG13 . 16317 1 9 . 1 1 4 4 ILE HG21 H 1 0.808 0.02 . 1 . . . . 3 ILE QG2 . 16317 1 10 . 1 1 4 4 ILE HG22 H 1 0.808 0.02 . 1 . . . . 3 ILE QG2 . 16317 1 11 . 1 1 4 4 ILE HG23 H 1 0.808 0.02 . 1 . . . . 3 ILE QG2 . 16317 1 12 . 1 1 4 4 ILE CA C 13 61.002 0.2 . 1 . . . . 3 ILE CA . 16317 1 13 . 1 1 4 4 ILE CB C 13 38.400 0.2 . 1 . . . . 3 ILE CB . 16317 1 14 . 1 1 4 4 ILE CD1 C 13 12.910 0.2 . 1 . . . . 3 ILE CD1 . 16317 1 15 . 1 1 4 4 ILE CG1 C 13 27.000 0.2 . 1 . . . . 3 ILE CG1 . 16317 1 16 . 1 1 4 4 ILE CG2 C 13 17.400 0.2 . 1 . . . . 3 ILE CG2 . 16317 1 17 . 1 1 4 4 ILE N N 15 121.904 0.1 . 1 . . . . 3 ILE N . 16317 1 18 . 1 1 5 5 THR H H 1 8.045 0.02 . 1 . . . . 4 THR HN . 16317 1 19 . 1 1 5 5 THR HA H 1 4.328 0.02 . 1 . . . . 4 THR HA . 16317 1 20 . 1 1 5 5 THR HB H 1 4.153 0.02 . 1 . . . . 4 THR HB . 16317 1 21 . 1 1 5 5 THR HG21 H 1 1.152 0.02 . 1 . . . . 4 THR QG2 . 16317 1 22 . 1 1 5 5 THR HG22 H 1 1.152 0.02 . 1 . . . . 4 THR QG2 . 16317 1 23 . 1 1 5 5 THR HG23 H 1 1.152 0.02 . 1 . . . . 4 THR QG2 . 16317 1 24 . 1 1 5 5 THR CA C 13 61.754 0.2 . 1 . . . . 4 THR CA . 16317 1 25 . 1 1 5 5 THR CB C 13 69.755 0.2 . 1 . . . . 4 THR CB . 16317 1 26 . 1 1 5 5 THR CG2 C 13 21.408 0.2 . 1 . . . . 4 THR CG2 . 16317 1 27 . 1 1 5 5 THR N N 15 117.078 0.1 . 1 . . . . 4 THR N . 16317 1 28 . 1 1 6 6 GLY H H 1 8.294 0.02 . 1 . . . . 5 GLY HN . 16317 1 29 . 1 1 6 6 GLY HA2 H 1 3.978 0.02 . 2 . . . . 5 GLY HA1 . 16317 1 30 . 1 1 6 6 GLY HA3 H 1 4.040 0.02 . 2 . . . . 5 GLY HA2 . 16317 1 31 . 1 1 6 6 GLY CA C 13 45.204 0.2 . 1 . . . . 5 GLY CA . 16317 1 32 . 1 1 6 6 GLY N N 15 110.823 0.1 . 1 . . . . 5 GLY N . 16317 1 33 . 1 1 7 7 ILE H H 1 7.850 0.02 . 1 . . . . 6 ILE HN . 16317 1 34 . 1 1 7 7 ILE HA H 1 4.507 0.02 . 1 . . . . 6 ILE HA . 16317 1 35 . 1 1 7 7 ILE HB H 1 1.923 0.02 . 1 . . . . 6 ILE HB . 16317 1 36 . 1 1 7 7 ILE HD11 H 1 0.690 0.02 . 1 . . . . 6 ILE QD1 . 16317 1 37 . 1 1 7 7 ILE HD12 H 1 0.690 0.02 . 1 . . . . 6 ILE QD1 . 16317 1 38 . 1 1 7 7 ILE HD13 H 1 0.690 0.02 . 1 . . . . 6 ILE QD1 . 16317 1 39 . 1 1 7 7 ILE HG12 H 1 1.139 0.02 . 2 . . . . 6 ILE HG12 . 16317 1 40 . 1 1 7 7 ILE HG13 H 1 1.471 0.02 . 2 . . . . 6 ILE HG13 . 16317 1 41 . 1 1 7 7 ILE HG21 H 1 0.911 0.02 . 1 . . . . 6 ILE QG2 . 16317 1 42 . 1 1 7 7 ILE HG22 H 1 0.911 0.02 . 1 . . . . 6 ILE QG2 . 16317 1 43 . 1 1 7 7 ILE HG23 H 1 0.911 0.02 . 1 . . . . 6 ILE QG2 . 16317 1 44 . 1 1 7 7 ILE CA C 13 61.058 0.2 . 1 . . . . 6 ILE CA . 16317 1 45 . 1 1 7 7 ILE CB C 13 39.405 0.2 . 1 . . . . 6 ILE CB . 16317 1 46 . 1 1 7 7 ILE CD1 C 13 13.159 0.2 . 1 . . . . 6 ILE CD1 . 16317 1 47 . 1 1 7 7 ILE CG1 C 13 26.637 0.2 . 1 . . . . 6 ILE CG1 . 16317 1 48 . 1 1 7 7 ILE CG2 C 13 17.628 0.2 . 1 . . . . 6 ILE CG2 . 16317 1 49 . 1 1 7 7 ILE N N 15 117.894 0.1 . 1 . . . . 6 ILE N . 16317 1 50 . 1 1 8 8 SER H H 1 8.484 0.02 . 1 . . . . 7 SER HN . 16317 1 51 . 1 1 8 8 SER HA H 1 5.138 0.02 . 1 . . . . 7 SER HA . 16317 1 52 . 1 1 8 8 SER HB2 H 1 3.800 0.02 . 2 . . . . 7 SER HB2 . 16317 1 53 . 1 1 8 8 SER HB3 H 1 3.931 0.02 . 2 . . . . 7 SER HB3 . 16317 1 54 . 1 1 8 8 SER CA C 13 55.586 0.2 . 1 . . . . 7 SER CA . 16317 1 55 . 1 1 8 8 SER CB C 13 63.867 0.2 . 1 . . . . 7 SER CB . 16317 1 56 . 1 1 8 8 SER N N 15 119.581 0.1 . 1 . . . . 7 SER N . 16317 1 57 . 1 1 9 9 PRO HA H 1 4.070 0.02 . 1 . . . . 8 PRO HA . 16317 1 58 . 1 1 9 9 PRO HB2 H 1 1.573 0.02 . 2 . . . . 8 PRO HB2 . 16317 1 59 . 1 1 9 9 PRO HB3 H 1 1.707 0.02 . 2 . . . . 8 PRO HB3 . 16317 1 60 . 1 1 9 9 PRO HD2 H 1 3.845 0.02 . 2 . . . . 8 PRO HD2 . 16317 1 61 . 1 1 9 9 PRO HD3 H 1 3.898 0.02 . 2 . . . . 8 PRO HD3 . 16317 1 62 . 1 1 9 9 PRO HG2 H 1 1.900 0.02 . 2 . . . . 8 PRO HG2 . 16317 1 63 . 1 1 9 9 PRO HG3 H 1 1.991 0.02 . 2 . . . . 8 PRO HG3 . 16317 1 64 . 1 1 9 9 PRO CA C 13 62.783 0.2 . 1 . . . . 8 PRO CA . 16317 1 65 . 1 1 9 9 PRO CB C 13 32.390 0.2 . 1 . . . . 8 PRO CB . 16317 1 66 . 1 1 9 9 PRO CD C 13 50.620 0.2 . 1 . . . . 8 PRO CD . 16317 1 67 . 1 1 9 9 PRO CG C 13 26.374 0.2 . 1 . . . . 8 PRO CG . 16317 1 68 . 1 1 10 10 ILE H H 1 8.916 0.02 . 1 . . . . 9 ILE HN . 16317 1 69 . 1 1 10 10 ILE HA H 1 4.231 0.02 . 1 . . . . 9 ILE HA . 16317 1 70 . 1 1 10 10 ILE HB H 1 1.827 0.02 . 1 . . . . 9 ILE HB . 16317 1 71 . 1 1 10 10 ILE HD11 H 1 0.916 0.02 . 1 . . . . 9 ILE QD1 . 16317 1 72 . 1 1 10 10 ILE HD12 H 1 0.916 0.02 . 1 . . . . 9 ILE QD1 . 16317 1 73 . 1 1 10 10 ILE HD13 H 1 0.916 0.02 . 1 . . . . 9 ILE QD1 . 16317 1 74 . 1 1 10 10 ILE HG12 H 1 1.170 0.02 . 2 . . . . 9 ILE HG12 . 16317 1 75 . 1 1 10 10 ILE HG13 H 1 1.567 0.02 . 2 . . . . 9 ILE HG13 . 16317 1 76 . 1 1 10 10 ILE HG21 H 1 1.017 0.02 . 1 . . . . 9 ILE QG2 . 16317 1 77 . 1 1 10 10 ILE HG22 H 1 1.017 0.02 . 1 . . . . 9 ILE QG2 . 16317 1 78 . 1 1 10 10 ILE HG23 H 1 1.017 0.02 . 1 . . . . 9 ILE QG2 . 16317 1 79 . 1 1 10 10 ILE CA C 13 62.297 0.2 . 1 . . . . 9 ILE CA . 16317 1 80 . 1 1 10 10 ILE CB C 13 39.145 0.2 . 1 . . . . 9 ILE CB . 16317 1 81 . 1 1 10 10 ILE CD1 C 13 13.661 0.2 . 1 . . . . 9 ILE CD1 . 16317 1 82 . 1 1 10 10 ILE CG1 C 13 27.277 0.2 . 1 . . . . 9 ILE CG1 . 16317 1 83 . 1 1 10 10 ILE CG2 C 13 17.857 0.2 . 1 . . . . 9 ILE CG2 . 16317 1 84 . 1 1 10 10 ILE N N 15 119.667 0.1 . 1 . . . . 9 ILE N . 16317 1 85 . 1 1 11 11 THR H H 1 7.263 0.02 . 1 . . . . 10 THR HN . 16317 1 86 . 1 1 11 11 THR HA H 1 4.577 0.02 . 1 . . . . 10 THR HA . 16317 1 87 . 1 1 11 11 THR HB H 1 4.151 0.02 . 1 . . . . 10 THR HB . 16317 1 88 . 1 1 11 11 THR HG21 H 1 1.009 0.02 . 1 . . . . 10 THR QG2 . 16317 1 89 . 1 1 11 11 THR HG22 H 1 1.009 0.02 . 1 . . . . 10 THR QG2 . 16317 1 90 . 1 1 11 11 THR HG23 H 1 1.009 0.02 . 1 . . . . 10 THR QG2 . 16317 1 91 . 1 1 11 11 THR CA C 13 60.889 0.2 . 1 . . . . 10 THR CA . 16317 1 92 . 1 1 11 11 THR CB C 13 69.698 0.2 . 1 . . . . 10 THR CB . 16317 1 93 . 1 1 11 11 THR CG2 C 13 19.919 0.2 . 1 . . . . 10 THR CG2 . 16317 1 94 . 1 1 11 11 THR N N 15 112.847 0.1 . 1 . . . . 10 THR N . 16317 1 95 . 1 1 12 12 GLU H H 1 8.157 0.02 . 1 . . . . 11 GLU HN . 16317 1 96 . 1 1 12 12 GLU HA H 1 5.689 0.02 . 1 . . . . 11 GLU HA . 16317 1 97 . 1 1 12 12 GLU HB2 H 1 1.983 0.02 . 2 . . . . 11 GLU HB2 . 16317 1 98 . 1 1 12 12 GLU HB3 H 1 2.091 0.02 . 2 . . . . 11 GLU HB3 . 16317 1 99 . 1 1 12 12 GLU HG2 H 1 2.202 0.02 . 2 . . . . 11 GLU HG2 . 16317 1 100 . 1 1 12 12 GLU CA C 13 54.700 0.2 . 1 . . . . 11 GLU CA . 16317 1 101 . 1 1 12 12 GLU CB C 13 33.384 0.2 . 1 . . . . 11 GLU CB . 16317 1 102 . 1 1 12 12 GLU CG C 13 36.681 0.2 . 1 . . . . 11 GLU CG . 16317 1 103 . 1 1 12 12 GLU N N 15 122.192 0.1 . 1 . . . . 11 GLU N . 16317 1 104 . 1 1 13 13 TYR H H 1 8.917 0.02 . 1 . . . . 12 TYR HN . 16317 1 105 . 1 1 13 13 TYR HA H 1 4.919 0.02 . 1 . . . . 12 TYR HA . 16317 1 106 . 1 1 13 13 TYR HB2 H 1 3.144 0.02 . 2 . . . . 12 TYR HB2 . 16317 1 107 . 1 1 13 13 TYR HB3 H 1 3.351 0.02 . 2 . . . . 12 TYR HB3 . 16317 1 108 . 1 1 13 13 TYR HD1 H 1 7.033 0.02 . 3 . . . . 12 TYR QD . 16317 1 109 . 1 1 13 13 TYR HD2 H 1 7.033 0.02 . 3 . . . . 12 TYR QD . 16317 1 110 . 1 1 13 13 TYR HE1 H 1 6.672 0.02 . 3 . . . . 12 TYR QE . 16317 1 111 . 1 1 13 13 TYR HE2 H 1 6.672 0.02 . 3 . . . . 12 TYR QE . 16317 1 112 . 1 1 13 13 TYR CA C 13 56.453 0.2 . 1 . . . . 12 TYR CA . 16317 1 113 . 1 1 13 13 TYR CB C 13 40.158 0.2 . 1 . . . . 12 TYR CB . 16317 1 114 . 1 1 13 13 TYR CD1 C 13 133.549 0.2 . 3 . . . . 12 TYR CD . 16317 1 115 . 1 1 13 13 TYR CD2 C 13 133.549 0.2 . 3 . . . . 12 TYR CD . 16317 1 116 . 1 1 13 13 TYR CE1 C 13 118.391 0.2 . 3 . . . . 12 TYR CE . 16317 1 117 . 1 1 13 13 TYR CE2 C 13 118.391 0.2 . 3 . . . . 12 TYR CE . 16317 1 118 . 1 1 13 13 TYR N N 15 119.678 0.1 . 1 . . . . 12 TYR N . 16317 1 119 . 1 1 14 14 LEU H H 1 8.420 0.02 . 1 . . . . 13 LEU HN . 16317 1 120 . 1 1 14 14 LEU HA H 1 5.201 0.02 . 1 . . . . 13 LEU HA . 16317 1 121 . 1 1 14 14 LEU HB2 H 1 1.290 0.02 . 2 . . . . 13 LEU HB2 . 16317 1 122 . 1 1 14 14 LEU HB3 H 1 1.761 0.02 . 2 . . . . 13 LEU HB3 . 16317 1 123 . 1 1 14 14 LEU HD11 H 1 0.882 0.02 . 1 . . . . 13 LEU QD1 . 16317 1 124 . 1 1 14 14 LEU HD12 H 1 0.882 0.02 . 1 . . . . 13 LEU QD1 . 16317 1 125 . 1 1 14 14 LEU HD13 H 1 0.882 0.02 . 1 . . . . 13 LEU QD1 . 16317 1 126 . 1 1 14 14 LEU HD21 H 1 0.745 0.02 . 1 . . . . 13 LEU QD2 . 16317 1 127 . 1 1 14 14 LEU HD22 H 1 0.745 0.02 . 1 . . . . 13 LEU QD2 . 16317 1 128 . 1 1 14 14 LEU HD23 H 1 0.745 0.02 . 1 . . . . 13 LEU QD2 . 16317 1 129 . 1 1 14 14 LEU HG H 1 1.586 0.02 . 1 . . . . 13 LEU HG . 16317 1 130 . 1 1 14 14 LEU CA C 13 53.778 0.2 . 1 . . . . 13 LEU CA . 16317 1 131 . 1 1 14 14 LEU CB C 13 43.570 0.2 . 1 . . . . 13 LEU CB . 16317 1 132 . 1 1 14 14 LEU CD1 C 13 25.267 0.2 . 2 . . . . 13 LEU CD1 . 16317 1 133 . 1 1 14 14 LEU CD2 C 13 23.862 0.2 . 2 . . . . 13 LEU CD2 . 16317 1 134 . 1 1 14 14 LEU CG C 13 26.836 0.2 . 1 . . . . 13 LEU CG . 16317 1 135 . 1 1 14 14 LEU N N 15 121.655 0.1 . 1 . . . . 13 LEU N . 16317 1 136 . 1 1 15 15 ALA H H 1 9.227 0.02 . 1 . . . . 14 ALA HN . 16317 1 137 . 1 1 15 15 ALA HA H 1 4.979 0.02 . 1 . . . . 14 ALA HA . 16317 1 138 . 1 1 15 15 ALA HB1 H 1 1.420 0.02 . 1 . . . . 14 ALA QB . 16317 1 139 . 1 1 15 15 ALA HB2 H 1 1.420 0.02 . 1 . . . . 14 ALA QB . 16317 1 140 . 1 1 15 15 ALA HB3 H 1 1.420 0.02 . 1 . . . . 14 ALA QB . 16317 1 141 . 1 1 15 15 ALA CA C 13 50.832 0.2 . 1 . . . . 14 ALA CA . 16317 1 142 . 1 1 15 15 ALA CB C 13 23.479 0.2 . 1 . . . . 14 ALA CB . 16317 1 143 . 1 1 15 15 ALA N N 15 124.927 0.1 . 1 . . . . 14 ALA N . 16317 1 144 . 1 1 16 16 SER H H 1 9.006 0.02 . 1 . . . . 15 SER HN . 16317 1 145 . 1 1 16 16 SER HA H 1 5.044 0.02 . 1 . . . . 15 SER HA . 16317 1 146 . 1 1 16 16 SER HB2 H 1 3.886 0.02 . 2 . . . . 15 SER HB2 . 16317 1 147 . 1 1 16 16 SER HB3 H 1 3.922 0.02 . 2 . . . . 15 SER HB3 . 16317 1 148 . 1 1 16 16 SER CA C 13 57.379 0.2 . 1 . . . . 15 SER CA . 16317 1 149 . 1 1 16 16 SER CB C 13 64.811 0.2 . 1 . . . . 15 SER CB . 16317 1 150 . 1 1 16 16 SER N N 15 115.217 0.1 . 1 . . . . 15 SER N . 16317 1 151 . 1 1 17 17 LEU H H 1 9.299 0.02 . 1 . . . . 16 LEU HN . 16317 1 152 . 1 1 17 17 LEU HA H 1 5.350 0.02 . 1 . . . . 16 LEU HA . 16317 1 153 . 1 1 17 17 LEU HB2 H 1 1.509 0.02 . 2 . . . . 16 LEU HB2 . 16317 1 154 . 1 1 17 17 LEU HB3 H 1 1.750 0.02 . 2 . . . . 16 LEU HB3 . 16317 1 155 . 1 1 17 17 LEU HD11 H 1 0.823 0.02 . 1 . . . . 16 LEU QD1 . 16317 1 156 . 1 1 17 17 LEU HD12 H 1 0.823 0.02 . 1 . . . . 16 LEU QD1 . 16317 1 157 . 1 1 17 17 LEU HD13 H 1 0.823 0.02 . 1 . . . . 16 LEU QD1 . 16317 1 158 . 1 1 17 17 LEU HD21 H 1 0.613 0.02 . 1 . . . . 16 LEU QD2 . 16317 1 159 . 1 1 17 17 LEU HD22 H 1 0.613 0.02 . 1 . . . . 16 LEU QD2 . 16317 1 160 . 1 1 17 17 LEU HD23 H 1 0.613 0.02 . 1 . . . . 16 LEU QD2 . 16317 1 161 . 1 1 17 17 LEU HG H 1 1.645 0.02 . 1 . . . . 16 LEU HG . 16317 1 162 . 1 1 17 17 LEU CA C 13 54.150 0.2 . 1 . . . . 16 LEU CA . 16317 1 163 . 1 1 17 17 LEU CB C 13 45.483 0.2 . 1 . . . . 16 LEU CB . 16317 1 164 . 1 1 17 17 LEU CD1 C 13 24.550 0.2 . 2 . . . . 16 LEU CD1 . 16317 1 165 . 1 1 17 17 LEU CD2 C 13 24.618 0.2 . 2 . . . . 16 LEU CD2 . 16317 1 166 . 1 1 17 17 LEU CG C 13 27.466 0.2 . 1 . . . . 16 LEU CG . 16317 1 167 . 1 1 17 17 LEU N N 15 125.526 0.1 . 1 . . . . 16 LEU N . 16317 1 168 . 1 1 18 18 SER H H 1 9.032 0.02 . 1 . . . . 17 SER HN . 16317 1 169 . 1 1 18 18 SER HA H 1 5.707 0.02 . 1 . . . . 17 SER HA . 16317 1 170 . 1 1 18 18 SER HB2 H 1 3.800 0.02 . 2 . . . . 17 SER HB2 . 16317 1 171 . 1 1 18 18 SER HB3 H 1 3.929 0.02 . 2 . . . . 17 SER HB3 . 16317 1 172 . 1 1 18 18 SER CA C 13 56.078 0.2 . 1 . . . . 17 SER CA . 16317 1 173 . 1 1 18 18 SER CB C 13 66.504 0.2 . 1 . . . . 17 SER CB . 16317 1 174 . 1 1 18 18 SER N N 15 118.219 0.1 . 1 . . . . 17 SER N . 16317 1 175 . 1 1 19 19 THR H H 1 9.122 0.02 . 1 . . . . 18 THR HN . 16317 1 176 . 1 1 19 19 THR HA H 1 4.651 0.02 . 1 . . . . 18 THR HA . 16317 1 177 . 1 1 19 19 THR HB H 1 4.834 0.02 . 1 . . . . 18 THR HB . 16317 1 178 . 1 1 19 19 THR HG1 H 1 6.008 0.02 . 1 . . . . 18 THR HG1 . 16317 1 179 . 1 1 19 19 THR HG21 H 1 1.270 0.02 . 1 . . . . 18 THR QG2 . 16317 1 180 . 1 1 19 19 THR HG22 H 1 1.270 0.02 . 1 . . . . 18 THR QG2 . 16317 1 181 . 1 1 19 19 THR HG23 H 1 1.270 0.02 . 1 . . . . 18 THR QG2 . 16317 1 182 . 1 1 19 19 THR CA C 13 60.871 0.2 . 1 . . . . 18 THR CA . 16317 1 183 . 1 1 19 19 THR CB C 13 71.214 0.2 . 1 . . . . 18 THR CB . 16317 1 184 . 1 1 19 19 THR CG2 C 13 22.894 0.2 . 1 . . . . 18 THR CG2 . 16317 1 185 . 1 1 19 19 THR N N 15 110.542 0.1 . 1 . . . . 18 THR N . 16317 1 186 . 1 1 20 20 TYR H H 1 7.890 0.02 . 1 . . . . 19 TYR HN . 16317 1 187 . 1 1 20 20 TYR HA H 1 3.895 0.02 . 1 . . . . 19 TYR HA . 16317 1 188 . 1 1 20 20 TYR HB2 H 1 2.816 0.02 . 2 . . . . 19 TYR HB2 . 16317 1 189 . 1 1 20 20 TYR HB3 H 1 3.256 0.02 . 2 . . . . 19 TYR HB3 . 16317 1 190 . 1 1 20 20 TYR HD1 H 1 7.056 0.02 . 3 . . . . 19 TYR QD . 16317 1 191 . 1 1 20 20 TYR HD2 H 1 7.056 0.02 . 3 . . . . 19 TYR QD . 16317 1 192 . 1 1 20 20 TYR HE1 H 1 6.770 0.02 . 3 . . . . 19 TYR QE . 16317 1 193 . 1 1 20 20 TYR HE2 H 1 6.770 0.02 . 3 . . . . 19 TYR QE . 16317 1 194 . 1 1 20 20 TYR CA C 13 61.228 0.2 . 1 . . . . 19 TYR CA . 16317 1 195 . 1 1 20 20 TYR CB C 13 39.123 0.2 . 1 . . . . 19 TYR CB . 16317 1 196 . 1 1 20 20 TYR CD1 C 13 133.499 0.2 . 3 . . . . 19 TYR CD . 16317 1 197 . 1 1 20 20 TYR CD2 C 13 133.499 0.2 . 3 . . . . 19 TYR CD . 16317 1 198 . 1 1 20 20 TYR CE1 C 13 117.666 0.2 . 3 . . . . 19 TYR CE . 16317 1 199 . 1 1 20 20 TYR CE2 C 13 117.666 0.2 . 3 . . . . 19 TYR CE . 16317 1 200 . 1 1 20 20 TYR N N 15 119.460 0.1 . 1 . . . . 19 TYR N . 16317 1 201 . 1 1 21 21 ASN H H 1 7.312 0.02 . 1 . . . . 20 ASN HN . 16317 1 202 . 1 1 21 21 ASN HA H 1 4.663 0.02 . 1 . . . . 20 ASN HA . 16317 1 203 . 1 1 21 21 ASN HB2 H 1 2.596 0.02 . 2 . . . . 20 ASN HB2 . 16317 1 204 . 1 1 21 21 ASN HB3 H 1 2.787 0.02 . 2 . . . . 20 ASN HB3 . 16317 1 205 . 1 1 21 21 ASN CA C 13 52.035 0.2 . 1 . . . . 20 ASN CA . 16317 1 206 . 1 1 21 21 ASN CB C 13 37.228 0.2 . 1 . . . . 20 ASN CB . 16317 1 207 . 1 1 21 21 ASN N N 15 112.235 0.1 . 1 . . . . 20 ASN N . 16317 1 208 . 1 1 22 22 ASP H H 1 7.919 0.02 . 1 . . . . 21 ASP HN . 16317 1 209 . 1 1 22 22 ASP HA H 1 4.210 0.02 . 1 . . . . 21 ASP HA . 16317 1 210 . 1 1 22 22 ASP HB2 H 1 2.810 0.02 . 2 . . . . 21 ASP HB2 . 16317 1 211 . 1 1 22 22 ASP HB3 H 1 2.923 0.02 . 2 . . . . 21 ASP HB3 . 16317 1 212 . 1 1 22 22 ASP CA C 13 56.289 0.2 . 1 . . . . 21 ASP CA . 16317 1 213 . 1 1 22 22 ASP CB C 13 38.389 0.2 . 1 . . . . 21 ASP CB . 16317 1 214 . 1 1 22 22 ASP N N 15 113.136 0.1 . 1 . . . . 21 ASP N . 16317 1 215 . 1 1 23 23 GLN H H 1 7.621 0.02 . 1 . . . . 22 GLN HN . 16317 1 216 . 1 1 23 23 GLN HA H 1 4.576 0.02 . 1 . . . . 22 GLN HA . 16317 1 217 . 1 1 23 23 GLN HB2 H 1 1.949 0.02 . 2 . . . . 22 GLN HB2 . 16317 1 218 . 1 1 23 23 GLN HB3 H 1 1.985 0.02 . 2 . . . . 22 GLN HB3 . 16317 1 219 . 1 1 23 23 GLN HG2 H 1 2.020 0.02 . 2 . . . . 22 GLN HG2 . 16317 1 220 . 1 1 23 23 GLN HG3 H 1 2.223 0.02 . 2 . . . . 22 GLN HG3 . 16317 1 221 . 1 1 23 23 GLN CA C 13 55.474 0.2 . 1 . . . . 22 GLN CA . 16317 1 222 . 1 1 23 23 GLN CB C 13 29.609 0.2 . 1 . . . . 22 GLN CB . 16317 1 223 . 1 1 23 23 GLN CG C 13 33.962 0.2 . 1 . . . . 22 GLN CG . 16317 1 224 . 1 1 23 23 GLN N N 15 115.930 0.1 . 1 . . . . 22 GLN N . 16317 1 225 . 1 1 24 24 SER H H 1 8.847 0.02 . 1 . . . . 23 SER HN . 16317 1 226 . 1 1 24 24 SER HA H 1 4.699 0.02 . 1 . . . . 23 SER HA . 16317 1 227 . 1 1 24 24 SER HB2 H 1 3.769 0.02 . 2 . . . . 23 SER HB2 . 16317 1 228 . 1 1 24 24 SER HB3 H 1 3.945 0.02 . 2 . . . . 23 SER HB3 . 16317 1 229 . 1 1 24 24 SER CA C 13 59.518 0.2 . 1 . . . . 23 SER CA . 16317 1 230 . 1 1 24 24 SER CB C 13 64.710 0.2 . 1 . . . . 23 SER CB . 16317 1 231 . 1 1 24 24 SER N N 15 118.760 0.1 . 1 . . . . 23 SER N . 16317 1 232 . 1 1 25 25 ILE H H 1 7.851 0.02 . 1 . . . . 24 ILE HN . 16317 1 233 . 1 1 25 25 ILE HA H 1 4.685 0.02 . 1 . . . . 24 ILE HA . 16317 1 234 . 1 1 25 25 ILE HB H 1 1.837 0.02 . 1 . . . . 24 ILE HB . 16317 1 235 . 1 1 25 25 ILE HD11 H 1 0.815 0.02 . 1 . . . . 24 ILE QD1 . 16317 1 236 . 1 1 25 25 ILE HD12 H 1 0.815 0.02 . 1 . . . . 24 ILE QD1 . 16317 1 237 . 1 1 25 25 ILE HD13 H 1 0.815 0.02 . 1 . . . . 24 ILE QD1 . 16317 1 238 . 1 1 25 25 ILE HG12 H 1 1.297 0.02 . 2 . . . . 24 ILE HG12 . 16317 1 239 . 1 1 25 25 ILE HG13 H 1 1.355 0.02 . 2 . . . . 24 ILE HG13 . 16317 1 240 . 1 1 25 25 ILE HG21 H 1 0.329 0.02 . 1 . . . . 24 ILE QG2 . 16317 1 241 . 1 1 25 25 ILE HG22 H 1 0.329 0.02 . 1 . . . . 24 ILE QG2 . 16317 1 242 . 1 1 25 25 ILE HG23 H 1 0.329 0.02 . 1 . . . . 24 ILE QG2 . 16317 1 243 . 1 1 25 25 ILE CA C 13 59.480 0.2 . 1 . . . . 24 ILE CA . 16317 1 244 . 1 1 25 25 ILE CB C 13 36.204 0.2 . 1 . . . . 24 ILE CB . 16317 1 245 . 1 1 25 25 ILE CD1 C 13 12.920 0.2 . 1 . . . . 24 ILE CD1 . 16317 1 246 . 1 1 25 25 ILE CG1 C 13 28.189 0.2 . 1 . . . . 24 ILE CG1 . 16317 1 247 . 1 1 25 25 ILE CG2 C 13 18.377 0.2 . 1 . . . . 24 ILE CG2 . 16317 1 248 . 1 1 25 25 ILE N N 15 122.951 0.1 . 1 . . . . 24 ILE N . 16317 1 249 . 1 1 26 26 THR H H 1 8.865 0.02 . 1 . . . . 25 THR HN . 16317 1 250 . 1 1 26 26 THR HA H 1 4.615 0.02 . 1 . . . . 25 THR HA . 16317 1 251 . 1 1 26 26 THR HB H 1 3.743 0.02 . 1 . . . . 25 THR HB . 16317 1 252 . 1 1 26 26 THR HG21 H 1 1.047 0.02 . 1 . . . . 25 THR QG2 . 16317 1 253 . 1 1 26 26 THR HG22 H 1 1.047 0.02 . 1 . . . . 25 THR QG2 . 16317 1 254 . 1 1 26 26 THR HG23 H 1 1.047 0.02 . 1 . . . . 25 THR QG2 . 16317 1 255 . 1 1 26 26 THR CA C 13 59.720 0.2 . 1 . . . . 25 THR CA . 16317 1 256 . 1 1 26 26 THR CB C 13 70.755 0.2 . 1 . . . . 25 THR CB . 16317 1 257 . 1 1 26 26 THR CG2 C 13 21.919 0.2 . 1 . . . . 25 THR CG2 . 16317 1 258 . 1 1 26 26 THR N N 15 123.404 0.1 . 1 . . . . 25 THR N . 16317 1 259 . 1 1 27 27 PHE H H 1 8.614 0.02 . 1 . . . . 26 PHE HN . 16317 1 260 . 1 1 27 27 PHE HA H 1 4.986 0.02 . 1 . . . . 26 PHE HA . 16317 1 261 . 1 1 27 27 PHE HB2 H 1 2.583 0.02 . 2 . . . . 26 PHE HB2 . 16317 1 262 . 1 1 27 27 PHE HB3 H 1 2.916 0.02 . 2 . . . . 26 PHE HB3 . 16317 1 263 . 1 1 27 27 PHE HD1 H 1 7.121 0.02 . 3 . . . . 26 PHE QD . 16317 1 264 . 1 1 27 27 PHE HD2 H 1 7.121 0.02 . 3 . . . . 26 PHE QD . 16317 1 265 . 1 1 27 27 PHE HE1 H 1 6.963 0.02 . 3 . . . . 26 PHE QE . 16317 1 266 . 1 1 27 27 PHE HE2 H 1 6.963 0.02 . 3 . . . . 26 PHE QE . 16317 1 267 . 1 1 27 27 PHE HZ H 1 6.651 0.02 . 1 . . . . 26 PHE HZ . 16317 1 268 . 1 1 27 27 PHE CA C 13 55.673 0.2 . 1 . . . . 26 PHE CA . 16317 1 269 . 1 1 27 27 PHE CB C 13 40.422 0.2 . 1 . . . . 26 PHE CB . 16317 1 270 . 1 1 27 27 PHE CD1 C 13 132.625 0.2 . 3 . . . . 26 PHE CD . 16317 1 271 . 1 1 27 27 PHE CD2 C 13 132.625 0.2 . 3 . . . . 26 PHE CD . 16317 1 272 . 1 1 27 27 PHE CE1 C 13 130.702 0.2 . 3 . . . . 26 PHE CE . 16317 1 273 . 1 1 27 27 PHE CE2 C 13 130.702 0.2 . 3 . . . . 26 PHE CE . 16317 1 274 . 1 1 27 27 PHE CZ C 13 127.806 0.2 . 1 . . . . 26 PHE CZ . 16317 1 275 . 1 1 27 27 PHE N N 15 120.710 0.1 . 1 . . . . 26 PHE N . 16317 1 276 . 1 1 28 28 ALA H H 1 8.989 0.02 . 1 . . . . 27 ALA HN . 16317 1 277 . 1 1 28 28 ALA HA H 1 4.719 0.02 . 1 . . . . 27 ALA HA . 16317 1 278 . 1 1 28 28 ALA HB1 H 1 1.496 0.02 . 1 . . . . 27 ALA QB . 16317 1 279 . 1 1 28 28 ALA HB2 H 1 1.496 0.02 . 1 . . . . 27 ALA QB . 16317 1 280 . 1 1 28 28 ALA HB3 H 1 1.496 0.02 . 1 . . . . 27 ALA QB . 16317 1 281 . 1 1 28 28 ALA CA C 13 51.105 0.2 . 1 . . . . 27 ALA CA . 16317 1 282 . 1 1 28 28 ALA CB C 13 20.169 0.2 . 1 . . . . 27 ALA CB . 16317 1 283 . 1 1 28 28 ALA N N 15 127.571 0.1 . 1 . . . . 27 ALA N . 16317 1 284 . 1 1 29 29 LEU H H 1 8.302 0.02 . 1 . . . . 28 LEU HN . 16317 1 285 . 1 1 29 29 LEU HA H 1 4.388 0.02 . 1 . . . . 28 LEU HA . 16317 1 286 . 1 1 29 29 LEU HB2 H 1 1.337 0.02 . 2 . . . . 28 LEU HB2 . 16317 1 287 . 1 1 29 29 LEU HB3 H 1 1.432 0.02 . 2 . . . . 28 LEU HB3 . 16317 1 288 . 1 1 29 29 LEU HD11 H 1 0.441 0.02 . 1 . . . . 28 LEU QD1 . 16317 1 289 . 1 1 29 29 LEU HD12 H 1 0.441 0.02 . 1 . . . . 28 LEU QD1 . 16317 1 290 . 1 1 29 29 LEU HD13 H 1 0.441 0.02 . 1 . . . . 28 LEU QD1 . 16317 1 291 . 1 1 29 29 LEU HD21 H 1 0.397 0.02 . 1 . . . . 28 LEU QD2 . 16317 1 292 . 1 1 29 29 LEU HD22 H 1 0.397 0.02 . 1 . . . . 28 LEU QD2 . 16317 1 293 . 1 1 29 29 LEU HD23 H 1 0.397 0.02 . 1 . . . . 28 LEU QD2 . 16317 1 294 . 1 1 29 29 LEU HG H 1 1.313 0.02 . 1 . . . . 28 LEU HG . 16317 1 295 . 1 1 29 29 LEU CA C 13 54.689 0.2 . 1 . . . . 28 LEU CA . 16317 1 296 . 1 1 29 29 LEU CB C 13 42.072 0.2 . 1 . . . . 28 LEU CB . 16317 1 297 . 1 1 29 29 LEU CD1 C 13 24.197 0.2 . 2 . . . . 28 LEU CD1 . 16317 1 298 . 1 1 29 29 LEU CD2 C 13 24.183 0.2 . 2 . . . . 28 LEU CD2 . 16317 1 299 . 1 1 29 29 LEU CG C 13 26.622 0.2 . 1 . . . . 28 LEU CG . 16317 1 300 . 1 1 29 29 LEU N N 15 123.967 0.1 . 1 . . . . 28 LEU N . 16317 1 301 . 1 1 30 30 GLU H H 1 8.426 0.02 . 1 . . . . 29 GLU HN . 16317 1 302 . 1 1 30 30 GLU HA H 1 4.383 0.02 . 1 . . . . 29 GLU HA . 16317 1 303 . 1 1 30 30 GLU HB2 H 1 1.942 0.02 . 2 . . . . 29 GLU HB2 . 16317 1 304 . 1 1 30 30 GLU HB3 H 1 2.072 0.02 . 2 . . . . 29 GLU HB3 . 16317 1 305 . 1 1 30 30 GLU HG2 H 1 2.225 0.02 . 2 . . . . 29 GLU HG2 . 16317 1 306 . 1 1 30 30 GLU CA C 13 55.674 0.2 . 1 . . . . 29 GLU CA . 16317 1 307 . 1 1 30 30 GLU CB C 13 30.616 0.2 . 1 . . . . 29 GLU CB . 16317 1 308 . 1 1 30 30 GLU CG C 13 35.921 0.2 . 1 . . . . 29 GLU CG . 16317 1 309 . 1 1 30 30 GLU N N 15 123.800 0.1 . 1 . . . . 29 GLU N . 16317 1 310 . 1 1 31 31 ASP H H 1 8.504 0.02 . 1 . . . . 30 ASP HN . 16317 1 311 . 1 1 31 31 ASP HA H 1 4.359 0.02 . 1 . . . . 30 ASP HA . 16317 1 312 . 1 1 31 31 ASP HB2 H 1 2.793 0.02 . 2 . . . . 30 ASP HB2 . 16317 1 313 . 1 1 31 31 ASP HB3 H 1 2.846 0.02 . 2 . . . . 30 ASP HB3 . 16317 1 314 . 1 1 31 31 ASP CA C 13 55.650 0.2 . 1 . . . . 30 ASP CA . 16317 1 315 . 1 1 31 31 ASP CB C 13 39.912 0.2 . 1 . . . . 30 ASP CB . 16317 1 316 . 1 1 31 31 ASP N N 15 121.263 0.1 . 1 . . . . 30 ASP N . 16317 1 317 . 1 1 32 32 GLU H H 1 8.235 0.02 . 1 . . . . 31 GLU HN . 16317 1 318 . 1 1 32 32 GLU HA H 1 4.039 0.02 . 1 . . . . 31 GLU HA . 16317 1 319 . 1 1 32 32 GLU HB2 H 1 2.072 0.02 . 2 . . . . 31 GLU HB2 . 16317 1 320 . 1 1 32 32 GLU HB3 H 1 2.311 0.02 . 2 . . . . 31 GLU HB3 . 16317 1 321 . 1 1 32 32 GLU HG2 H 1 2.248 0.02 . 2 . . . . 31 GLU HG2 . 16317 1 322 . 1 1 32 32 GLU HG3 H 1 2.296 0.02 . 2 . . . . 31 GLU HG3 . 16317 1 323 . 1 1 32 32 GLU CA C 13 56.572 0.2 . 1 . . . . 31 GLU CA . 16317 1 324 . 1 1 32 32 GLU CB C 13 29.099 0.2 . 1 . . . . 31 GLU CB . 16317 1 325 . 1 1 32 32 GLU CG C 13 36.576 0.2 . 1 . . . . 31 GLU CG . 16317 1 326 . 1 1 32 32 GLU N N 15 115.284 0.1 . 1 . . . . 31 GLU N . 16317 1 327 . 1 1 33 33 SER H H 1 7.854 0.02 . 1 . . . . 32 SER HN . 16317 1 328 . 1 1 33 33 SER HA H 1 4.556 0.02 . 1 . . . . 32 SER HA . 16317 1 329 . 1 1 33 33 SER HB2 H 1 3.866 0.02 . 2 . . . . 32 SER HB2 . 16317 1 330 . 1 1 33 33 SER CA C 13 57.848 0.2 . 1 . . . . 32 SER CA . 16317 1 331 . 1 1 33 33 SER CB C 13 64.080 0.2 . 1 . . . . 32 SER CB . 16317 1 332 . 1 1 33 33 SER N N 15 114.403 0.1 . 1 . . . . 32 SER N . 16317 1 333 . 1 1 34 34 TYR H H 1 8.117 0.02 . 1 . . . . 33 TYR HN . 16317 1 334 . 1 1 34 34 TYR HA H 1 4.995 0.02 . 1 . . . . 33 TYR HA . 16317 1 335 . 1 1 34 34 TYR HB2 H 1 2.892 0.02 . 2 . . . . 33 TYR HB2 . 16317 1 336 . 1 1 34 34 TYR HB3 H 1 2.990 0.02 . 2 . . . . 33 TYR HB3 . 16317 1 337 . 1 1 34 34 TYR HD1 H 1 6.777 0.02 . 3 . . . . 33 TYR QD . 16317 1 338 . 1 1 34 34 TYR HD2 H 1 6.777 0.02 . 3 . . . . 33 TYR QD . 16317 1 339 . 1 1 34 34 TYR HE1 H 1 6.528 0.02 . 3 . . . . 33 TYR QE . 16317 1 340 . 1 1 34 34 TYR HE2 H 1 6.528 0.02 . 3 . . . . 33 TYR QE . 16317 1 341 . 1 1 34 34 TYR CA C 13 56.928 0.2 . 1 . . . . 33 TYR CA . 16317 1 342 . 1 1 34 34 TYR CB C 13 39.116 0.2 . 1 . . . . 33 TYR CB . 16317 1 343 . 1 1 34 34 TYR CD1 C 13 132.661 0.2 . 3 . . . . 33 TYR CD . 16317 1 344 . 1 1 34 34 TYR CD2 C 13 132.661 0.2 . 3 . . . . 33 TYR CD . 16317 1 345 . 1 1 34 34 TYR CE1 C 13 117.666 0.2 . 3 . . . . 33 TYR CE . 16317 1 346 . 1 1 34 34 TYR CE2 C 13 117.666 0.2 . 3 . . . . 33 TYR CE . 16317 1 347 . 1 1 34 34 TYR N N 15 119.987 0.1 . 1 . . . . 33 TYR N . 16317 1 348 . 1 1 35 35 GLU H H 1 8.466 0.02 . 1 . . . . 34 GLU HN . 16317 1 349 . 1 1 35 35 GLU HA H 1 4.574 0.02 . 1 . . . . 34 GLU HA . 16317 1 350 . 1 1 35 35 GLU HB2 H 1 1.866 0.02 . 2 . . . . 34 GLU HB2 . 16317 1 351 . 1 1 35 35 GLU HG2 H 1 2.269 0.02 . 2 . . . . 34 GLU HG2 . 16317 1 352 . 1 1 35 35 GLU CA C 13 55.417 0.2 . 1 . . . . 34 GLU CA . 16317 1 353 . 1 1 35 35 GLU CB C 13 33.071 0.2 . 1 . . . . 34 GLU CB . 16317 1 354 . 1 1 35 35 GLU CG C 13 35.921 0.2 . 1 . . . . 34 GLU CG . 16317 1 355 . 1 1 35 35 GLU N N 15 120.614 0.1 . 1 . . . . 34 GLU N . 16317 1 356 . 1 1 36 36 ILE H H 1 8.485 0.02 . 1 . . . . 35 ILE HN . 16317 1 357 . 1 1 36 36 ILE HA H 1 4.713 0.02 . 1 . . . . 35 ILE HA . 16317 1 358 . 1 1 36 36 ILE HB H 1 1.773 0.02 . 1 . . . . 35 ILE HB . 16317 1 359 . 1 1 36 36 ILE HD11 H 1 0.827 0.02 . 1 . . . . 35 ILE QD1 . 16317 1 360 . 1 1 36 36 ILE HD12 H 1 0.827 0.02 . 1 . . . . 35 ILE QD1 . 16317 1 361 . 1 1 36 36 ILE HD13 H 1 0.827 0.02 . 1 . . . . 35 ILE QD1 . 16317 1 362 . 1 1 36 36 ILE HG12 H 1 0.913 0.02 . 2 . . . . 35 ILE HG12 . 16317 1 363 . 1 1 36 36 ILE HG13 H 1 1.723 0.02 . 2 . . . . 35 ILE HG13 . 16317 1 364 . 1 1 36 36 ILE HG21 H 1 0.447 0.02 . 1 . . . . 35 ILE QG2 . 16317 1 365 . 1 1 36 36 ILE HG22 H 1 0.447 0.02 . 1 . . . . 35 ILE QG2 . 16317 1 366 . 1 1 36 36 ILE HG23 H 1 0.447 0.02 . 1 . . . . 35 ILE QG2 . 16317 1 367 . 1 1 36 36 ILE CA C 13 60.138 0.2 . 1 . . . . 35 ILE CA . 16317 1 368 . 1 1 36 36 ILE CB C 13 39.383 0.2 . 1 . . . . 35 ILE CB . 16317 1 369 . 1 1 36 36 ILE CD1 C 13 14.400 0.2 . 1 . . . . 35 ILE CD1 . 16317 1 370 . 1 1 36 36 ILE CG1 C 13 27.108 0.2 . 1 . . . . 35 ILE CG1 . 16317 1 371 . 1 1 36 36 ILE CG2 C 13 17.943 0.2 . 1 . . . . 35 ILE CG2 . 16317 1 372 . 1 1 36 36 ILE N N 15 121.673 0.1 . 1 . . . . 35 ILE N . 16317 1 373 . 1 1 37 37 TYR H H 1 8.725 0.02 . 1 . . . . 36 TYR HN . 16317 1 374 . 1 1 37 37 TYR HA H 1 5.148 0.02 . 1 . . . . 36 TYR HA . 16317 1 375 . 1 1 37 37 TYR HB2 H 1 2.816 0.02 . 2 . . . . 36 TYR HB2 . 16317 1 376 . 1 1 37 37 TYR HD1 H 1 6.937 0.02 . 3 . . . . 36 TYR QD . 16317 1 377 . 1 1 37 37 TYR HD2 H 1 6.937 0.02 . 3 . . . . 36 TYR QD . 16317 1 378 . 1 1 37 37 TYR HE1 H 1 6.737 0.02 . 3 . . . . 36 TYR QE . 16317 1 379 . 1 1 37 37 TYR HE2 H 1 6.737 0.02 . 3 . . . . 36 TYR QE . 16317 1 380 . 1 1 37 37 TYR CA C 13 55.698 0.2 . 1 . . . . 36 TYR CA . 16317 1 381 . 1 1 37 37 TYR CB C 13 40.866 0.2 . 1 . . . . 36 TYR CB . 16317 1 382 . 1 1 37 37 TYR CD1 C 13 132.625 0.2 . 3 . . . . 36 TYR CD . 16317 1 383 . 1 1 37 37 TYR CD2 C 13 132.625 0.2 . 3 . . . . 36 TYR CD . 16317 1 384 . 1 1 37 37 TYR CE1 C 13 117.666 0.2 . 3 . . . . 36 TYR CE . 16317 1 385 . 1 1 37 37 TYR CE2 C 13 117.666 0.2 . 3 . . . . 36 TYR CE . 16317 1 386 . 1 1 37 37 TYR N N 15 125.169 0.1 . 1 . . . . 36 TYR N . 16317 1 387 . 1 1 38 38 VAL H H 1 7.859 0.02 . 1 . . . . 37 VAL HN . 16317 1 388 . 1 1 38 38 VAL HA H 1 4.636 0.02 . 1 . . . . 37 VAL HA . 16317 1 389 . 1 1 38 38 VAL HB H 1 1.750 0.02 . 1 . . . . 37 VAL HB . 16317 1 390 . 1 1 38 38 VAL HG11 H 1 0.758 0.02 . 1 . . . . 37 VAL QG1 . 16317 1 391 . 1 1 38 38 VAL HG12 H 1 0.758 0.02 . 1 . . . . 37 VAL QG1 . 16317 1 392 . 1 1 38 38 VAL HG13 H 1 0.758 0.02 . 1 . . . . 37 VAL QG1 . 16317 1 393 . 1 1 38 38 VAL HG21 H 1 0.679 0.02 . 1 . . . . 37 VAL QG2 . 16317 1 394 . 1 1 38 38 VAL HG22 H 1 0.679 0.02 . 1 . . . . 37 VAL QG2 . 16317 1 395 . 1 1 38 38 VAL HG23 H 1 0.679 0.02 . 1 . . . . 37 VAL QG2 . 16317 1 396 . 1 1 38 38 VAL CA C 13 60.937 0.2 . 1 . . . . 37 VAL CA . 16317 1 397 . 1 1 38 38 VAL CB C 13 32.382 0.2 . 1 . . . . 37 VAL CB . 16317 1 398 . 1 1 38 38 VAL CG1 C 13 21.883 0.2 . 2 . . . . 37 VAL CG1 . 16317 1 399 . 1 1 38 38 VAL CG2 C 13 20.165 0.2 . 2 . . . . 37 VAL CG2 . 16317 1 400 . 1 1 38 38 VAL N N 15 120.727 0.1 . 1 . . . . 37 VAL N . 16317 1 401 . 1 1 39 39 GLU H H 1 8.885 0.02 . 1 . . . . 38 GLU HN . 16317 1 402 . 1 1 39 39 GLU HA H 1 4.690 0.02 . 1 . . . . 38 GLU HA . 16317 1 403 . 1 1 39 39 GLU HB2 H 1 1.874 0.02 . 2 . . . . 38 GLU HB2 . 16317 1 404 . 1 1 39 39 GLU HB3 H 1 2.044 0.02 . 2 . . . . 38 GLU HB3 . 16317 1 405 . 1 1 39 39 GLU HG2 H 1 2.124 0.02 . 2 . . . . 38 GLU HG2 . 16317 1 406 . 1 1 39 39 GLU HG3 H 1 2.151 0.02 . 2 . . . . 38 GLU HG3 . 16317 1 407 . 1 1 39 39 GLU CA C 13 55.174 0.2 . 1 . . . . 38 GLU CA . 16317 1 408 . 1 1 39 39 GLU CB C 13 33.421 0.2 . 1 . . . . 38 GLU CB . 16317 1 409 . 1 1 39 39 GLU CG C 13 35.421 0.2 . 1 . . . . 38 GLU CG . 16317 1 410 . 1 1 39 39 GLU N N 15 124.823 0.1 . 1 . . . . 38 GLU N . 16317 1 411 . 1 1 40 40 ASP H H 1 8.646 0.02 . 1 . . . . 39 ASP HN . 16317 1 412 . 1 1 40 40 ASP HA H 1 4.721 0.02 . 1 . . . . 39 ASP HA . 16317 1 413 . 1 1 40 40 ASP HB2 H 1 2.593 0.02 . 2 . . . . 39 ASP HB2 . 16317 1 414 . 1 1 40 40 ASP HB3 H 1 2.716 0.02 . 2 . . . . 39 ASP HB3 . 16317 1 415 . 1 1 40 40 ASP CA C 13 54.340 0.2 . 1 . . . . 39 ASP CA . 16317 1 416 . 1 1 40 40 ASP CB C 13 40.839 0.2 . 1 . . . . 39 ASP CB . 16317 1 417 . 1 1 40 40 ASP N N 15 122.400 0.1 . 1 . . . . 39 ASP N . 16317 1 418 . 1 1 41 41 LEU H H 1 8.133 0.02 . 1 . . . . 40 LEU HN . 16317 1 419 . 1 1 41 41 LEU HA H 1 4.430 0.02 . 1 . . . . 40 LEU HA . 16317 1 420 . 1 1 41 41 LEU HB2 H 1 1.573 0.02 . 2 . . . . 40 LEU HB2 . 16317 1 421 . 1 1 41 41 LEU HB3 H 1 1.646 0.02 . 2 . . . . 40 LEU HB3 . 16317 1 422 . 1 1 41 41 LEU HD11 H 1 0.912 0.02 . 1 . . . . 40 LEU QD1 . 16317 1 423 . 1 1 41 41 LEU HD12 H 1 0.912 0.02 . 1 . . . . 40 LEU QD1 . 16317 1 424 . 1 1 41 41 LEU HD13 H 1 0.912 0.02 . 1 . . . . 40 LEU QD1 . 16317 1 425 . 1 1 41 41 LEU HD21 H 1 0.868 0.02 . 1 . . . . 40 LEU QD2 . 16317 1 426 . 1 1 41 41 LEU HD22 H 1 0.868 0.02 . 1 . . . . 40 LEU QD2 . 16317 1 427 . 1 1 41 41 LEU HD23 H 1 0.868 0.02 . 1 . . . . 40 LEU QD2 . 16317 1 428 . 1 1 41 41 LEU HG H 1 1.564 0.02 . 1 . . . . 40 LEU HG . 16317 1 429 . 1 1 41 41 LEU CA C 13 54.553 0.2 . 1 . . . . 40 LEU CA . 16317 1 430 . 1 1 41 41 LEU CB C 13 42.942 0.2 . 1 . . . . 40 LEU CB . 16317 1 431 . 1 1 41 41 LEU CD1 C 13 24.854 0.2 . 2 . . . . 40 LEU CD1 . 16317 1 432 . 1 1 41 41 LEU CD2 C 13 23.665 0.2 . 2 . . . . 40 LEU CD2 . 16317 1 433 . 1 1 41 41 LEU CG C 13 26.785 0.2 . 1 . . . . 40 LEU CG . 16317 1 434 . 1 1 41 41 LEU N N 15 122.394 0.1 . 1 . . . . 40 LEU N . 16317 1 435 . 1 1 42 42 LYS H H 1 8.659 0.02 . 1 . . . . 41 LYS HN . 16317 1 436 . 1 1 42 42 LYS HA H 1 4.357 0.02 . 1 . . . . 41 LYS HA . 16317 1 437 . 1 1 42 42 LYS HB2 H 1 1.758 0.02 . 2 . . . . 41 LYS HB2 . 16317 1 438 . 1 1 42 42 LYS HB3 H 1 1.912 0.02 . 2 . . . . 41 LYS HB3 . 16317 1 439 . 1 1 42 42 LYS HD2 H 1 1.717 0.02 . 2 . . . . 41 LYS HD2 . 16317 1 440 . 1 1 42 42 LYS HE2 H 1 3.012 0.02 . 2 . . . . 41 LYS HE2 . 16317 1 441 . 1 1 42 42 LYS HG2 H 1 1.487 0.02 . 2 . . . . 41 LYS HG2 . 16317 1 442 . 1 1 42 42 LYS CA C 13 55.924 0.2 . 1 . . . . 41 LYS CA . 16317 1 443 . 1 1 42 42 LYS CB C 13 32.421 0.2 . 1 . . . . 41 LYS CB . 16317 1 444 . 1 1 42 42 LYS CD C 13 28.670 0.2 . 1 . . . . 41 LYS CD . 16317 1 445 . 1 1 42 42 LYS CE C 13 41.922 0.2 . 1 . . . . 41 LYS CE . 16317 1 446 . 1 1 42 42 LYS CG C 13 24.670 0.2 . 1 . . . . 41 LYS CG . 16317 1 447 . 1 1 42 42 LYS N N 15 122.920 0.1 . 1 . . . . 41 LYS N . 16317 1 448 . 1 1 43 43 LYS H H 1 8.371 0.02 . 1 . . . . 42 LYS HN . 16317 1 449 . 1 1 43 43 LYS HA H 1 4.223 0.02 . 1 . . . . 42 LYS HA . 16317 1 450 . 1 1 43 43 LYS HB2 H 1 1.791 0.02 . 2 . . . . 42 LYS HB2 . 16317 1 451 . 1 1 43 43 LYS HB3 H 1 1.851 0.02 . 2 . . . . 42 LYS HB3 . 16317 1 452 . 1 1 43 43 LYS HD2 H 1 1.715 0.02 . 2 . . . . 42 LYS HD2 . 16317 1 453 . 1 1 43 43 LYS HE2 H 1 3.010 0.02 . 2 . . . . 42 LYS HE2 . 16317 1 454 . 1 1 43 43 LYS HG2 H 1 1.464 0.02 . 2 . . . . 42 LYS HG2 . 16317 1 455 . 1 1 43 43 LYS CA C 13 56.924 0.2 . 1 . . . . 42 LYS CA . 16317 1 456 . 1 1 43 43 LYS CB C 13 32.671 0.2 . 1 . . . . 42 LYS CB . 16317 1 457 . 1 1 43 43 LYS CD C 13 28.670 0.2 . 1 . . . . 42 LYS CD . 16317 1 458 . 1 1 43 43 LYS CE C 13 41.922 0.2 . 1 . . . . 42 LYS CE . 16317 1 459 . 1 1 43 43 LYS CG C 13 24.420 0.2 . 1 . . . . 42 LYS CG . 16317 1 460 . 1 1 43 43 LYS N N 15 121.924 0.1 . 1 . . . . 42 LYS N . 16317 1 461 . 1 1 44 44 ASP H H 1 8.355 0.02 . 1 . . . . 43 ASP HN . 16317 1 462 . 1 1 44 44 ASP HA H 1 4.556 0.02 . 1 . . . . 43 ASP HA . 16317 1 463 . 1 1 44 44 ASP HB2 H 1 2.720 0.02 . 2 . . . . 43 ASP HB2 . 16317 1 464 . 1 1 44 44 ASP CA C 13 54.243 0.2 . 1 . . . . 43 ASP CA . 16317 1 465 . 1 1 44 44 ASP CB C 13 40.582 0.2 . 1 . . . . 43 ASP CB . 16317 1 466 . 1 1 44 44 ASP N N 15 118.485 0.1 . 1 . . . . 43 ASP N . 16317 1 467 . 1 1 45 45 GLU H H 1 8.011 0.02 . 1 . . . . 44 GLU HN . 16317 1 468 . 1 1 45 45 GLU HA H 1 4.313 0.02 . 1 . . . . 44 GLU HA . 16317 1 469 . 1 1 45 45 GLU HB2 H 1 2.009 0.02 . 2 . . . . 44 GLU HB2 . 16317 1 470 . 1 1 45 45 GLU HB3 H 1 2.099 0.02 . 2 . . . . 44 GLU HB3 . 16317 1 471 . 1 1 45 45 GLU HG2 H 1 2.237 0.02 . 2 . . . . 44 GLU HG2 . 16317 1 472 . 1 1 45 45 GLU HG3 H 1 2.297 0.02 . 2 . . . . 44 GLU HG3 . 16317 1 473 . 1 1 45 45 GLU CA C 13 56.362 0.2 . 1 . . . . 44 GLU CA . 16317 1 474 . 1 1 45 45 GLU CB C 13 30.265 0.2 . 1 . . . . 44 GLU CB . 16317 1 475 . 1 1 45 45 GLU CG C 13 36.787 0.2 . 1 . . . . 44 GLU CG . 16317 1 476 . 1 1 45 45 GLU N N 15 119.516 0.1 . 1 . . . . 44 GLU N . 16317 1 477 . 1 1 46 46 LYS H H 1 8.304 0.02 . 1 . . . . 45 LYS HN . 16317 1 478 . 1 1 46 46 LYS HA H 1 4.307 0.02 . 1 . . . . 45 LYS HA . 16317 1 479 . 1 1 46 46 LYS HB2 H 1 1.812 0.02 . 2 . . . . 45 LYS HB2 . 16317 1 480 . 1 1 46 46 LYS HB3 H 1 1.869 0.02 . 2 . . . . 45 LYS HB3 . 16317 1 481 . 1 1 46 46 LYS HD2 H 1 1.718 0.02 . 2 . . . . 45 LYS HD2 . 16317 1 482 . 1 1 46 46 LYS HE2 H 1 3.006 0.02 . 2 . . . . 45 LYS HE2 . 16317 1 483 . 1 1 46 46 LYS HG2 H 1 1.427 0.02 . 2 . . . . 45 LYS HG2 . 16317 1 484 . 1 1 46 46 LYS HG3 H 1 1.511 0.02 . 2 . . . . 45 LYS HG3 . 16317 1 485 . 1 1 46 46 LYS CA C 13 56.424 0.2 . 1 . . . . 45 LYS CA . 16317 1 486 . 1 1 46 46 LYS CB C 13 32.421 0.2 . 1 . . . . 45 LYS CB . 16317 1 487 . 1 1 46 46 LYS CD C 13 28.920 0.2 . 1 . . . . 45 LYS CD . 16317 1 488 . 1 1 46 46 LYS CE C 13 41.922 0.2 . 1 . . . . 45 LYS CE . 16317 1 489 . 1 1 46 46 LYS CG C 13 24.420 0.2 . 1 . . . . 45 LYS CG . 16317 1 490 . 1 1 46 46 LYS N N 15 121.875 0.1 . 1 . . . . 45 LYS N . 16317 1 491 . 1 1 47 47 LYS H H 1 8.280 0.02 . 1 . . . . 46 LYS HN . 16317 1 492 . 1 1 47 47 LYS HA H 1 4.469 0.02 . 1 . . . . 46 LYS HA . 16317 1 493 . 1 1 47 47 LYS HB2 H 1 1.770 0.02 . 2 . . . . 46 LYS HB2 . 16317 1 494 . 1 1 47 47 LYS HB3 H 1 1.971 0.02 . 2 . . . . 46 LYS HB3 . 16317 1 495 . 1 1 47 47 LYS HD2 H 1 1.709 0.02 . 2 . . . . 46 LYS HD2 . 16317 1 496 . 1 1 47 47 LYS HE2 H 1 3.012 0.02 . 2 . . . . 46 LYS HE2 . 16317 1 497 . 1 1 47 47 LYS HG2 H 1 1.500 0.02 . 2 . . . . 46 LYS HG2 . 16317 1 498 . 1 1 47 47 LYS CA C 13 55.514 0.2 . 1 . . . . 46 LYS CA . 16317 1 499 . 1 1 47 47 LYS CB C 13 33.264 0.2 . 1 . . . . 46 LYS CB . 16317 1 500 . 1 1 47 47 LYS CD C 13 28.758 0.2 . 1 . . . . 46 LYS CD . 16317 1 501 . 1 1 47 47 LYS CE C 13 42.085 0.2 . 1 . . . . 46 LYS CE . 16317 1 502 . 1 1 47 47 LYS CG C 13 24.758 0.2 . 1 . . . . 46 LYS CG . 16317 1 503 . 1 1 47 47 LYS N N 15 122.374 0.1 . 1 . . . . 46 LYS N . 16317 1 504 . 1 1 48 48 ASP H H 1 8.778 0.02 . 1 . . . . 47 ASP HN . 16317 1 505 . 1 1 48 48 ASP HA H 1 4.811 0.02 . 1 . . . . 47 ASP HA . 16317 1 506 . 1 1 48 48 ASP HB2 H 1 2.870 0.02 . 2 . . . . 47 ASP HB2 . 16317 1 507 . 1 1 48 48 ASP CA C 13 54.357 0.2 . 1 . . . . 47 ASP CA . 16317 1 508 . 1 1 48 48 ASP CB C 13 41.842 0.2 . 1 . . . . 47 ASP CB . 16317 1 509 . 1 1 48 48 ASP N N 15 122.211 0.1 . 1 . . . . 47 ASP N . 16317 1 510 . 1 1 49 49 LYS H H 1 8.388 0.02 . 1 . . . . 48 LYS HN . 16317 1 511 . 1 1 49 49 LYS HA H 1 4.593 0.02 . 1 . . . . 48 LYS HA . 16317 1 512 . 1 1 49 49 LYS HB2 H 1 1.554 0.02 . 2 . . . . 48 LYS HB2 . 16317 1 513 . 1 1 49 49 LYS HB3 H 1 1.773 0.02 . 2 . . . . 48 LYS HB3 . 16317 1 514 . 1 1 49 49 LYS HD2 H 1 1.551 0.02 . 2 . . . . 48 LYS HD2 . 16317 1 515 . 1 1 49 49 LYS HD3 H 1 1.595 0.02 . 2 . . . . 48 LYS HD3 . 16317 1 516 . 1 1 49 49 LYS HE2 H 1 3.000 0.02 . 2 . . . . 48 LYS HE2 . 16317 1 517 . 1 1 49 49 LYS HG2 H 1 1.346 0.02 . 2 . . . . 48 LYS HG2 . 16317 1 518 . 1 1 49 49 LYS HG3 H 1 1.546 0.02 . 2 . . . . 48 LYS HG3 . 16317 1 519 . 1 1 49 49 LYS CA C 13 55.134 0.2 . 1 . . . . 48 LYS CA . 16317 1 520 . 1 1 49 49 LYS CB C 13 34.993 0.2 . 1 . . . . 48 LYS CB . 16317 1 521 . 1 1 49 49 LYS CD C 13 29.349 0.2 . 1 . . . . 48 LYS CD . 16317 1 522 . 1 1 49 49 LYS CE C 13 41.922 0.2 . 1 . . . . 48 LYS CE . 16317 1 523 . 1 1 49 49 LYS CG C 13 25.336 0.2 . 1 . . . . 48 LYS CG . 16317 1 524 . 1 1 49 49 LYS N N 15 120.889 0.1 . 1 . . . . 48 LYS N . 16317 1 525 . 1 1 50 50 VAL H H 1 9.063 0.02 . 1 . . . . 49 VAL HN . 16317 1 526 . 1 1 50 50 VAL HA H 1 4.097 0.02 . 1 . . . . 49 VAL HA . 16317 1 527 . 1 1 50 50 VAL HB H 1 1.696 0.02 . 1 . . . . 49 VAL HB . 16317 1 528 . 1 1 50 50 VAL HG11 H 1 0.543 0.02 . 1 . . . . 49 VAL QG1 . 16317 1 529 . 1 1 50 50 VAL HG12 H 1 0.543 0.02 . 1 . . . . 49 VAL QG1 . 16317 1 530 . 1 1 50 50 VAL HG13 H 1 0.543 0.02 . 1 . . . . 49 VAL QG1 . 16317 1 531 . 1 1 50 50 VAL HG21 H 1 0.724 0.02 . 1 . . . . 49 VAL QG2 . 16317 1 532 . 1 1 50 50 VAL HG22 H 1 0.724 0.02 . 1 . . . . 49 VAL QG2 . 16317 1 533 . 1 1 50 50 VAL HG23 H 1 0.724 0.02 . 1 . . . . 49 VAL QG2 . 16317 1 534 . 1 1 50 50 VAL CA C 13 59.275 0.2 . 1 . . . . 49 VAL CA . 16317 1 535 . 1 1 50 50 VAL CB C 13 33.958 0.2 . 1 . . . . 49 VAL CB . 16317 1 536 . 1 1 50 50 VAL CG1 C 13 21.702 0.2 . 2 . . . . 49 VAL CG1 . 16317 1 537 . 1 1 50 50 VAL CG2 C 13 20.701 0.2 . 2 . . . . 49 VAL CG2 . 16317 1 538 . 1 1 50 50 VAL N N 15 118.350 0.1 . 1 . . . . 49 VAL N . 16317 1 539 . 1 1 51 51 LEU H H 1 8.238 0.02 . 1 . . . . 50 LEU HN . 16317 1 540 . 1 1 51 51 LEU HA H 1 4.561 0.02 . 1 . . . . 50 LEU HA . 16317 1 541 . 1 1 51 51 LEU HB2 H 1 1.251 0.02 . 2 . . . . 50 LEU HB2 . 16317 1 542 . 1 1 51 51 LEU HB3 H 1 1.997 0.02 . 2 . . . . 50 LEU HB3 . 16317 1 543 . 1 1 51 51 LEU HD11 H 1 0.726 0.02 . 1 . . . . 50 LEU QD1 . 16317 1 544 . 1 1 51 51 LEU HD12 H 1 0.726 0.02 . 1 . . . . 50 LEU QD1 . 16317 1 545 . 1 1 51 51 LEU HD13 H 1 0.726 0.02 . 1 . . . . 50 LEU QD1 . 16317 1 546 . 1 1 51 51 LEU HD21 H 1 0.830 0.02 . 1 . . . . 50 LEU QD2 . 16317 1 547 . 1 1 51 51 LEU HD22 H 1 0.830 0.02 . 1 . . . . 50 LEU QD2 . 16317 1 548 . 1 1 51 51 LEU HD23 H 1 0.830 0.02 . 1 . . . . 50 LEU QD2 . 16317 1 549 . 1 1 51 51 LEU HG H 1 1.241 0.02 . 1 . . . . 50 LEU HG . 16317 1 550 . 1 1 51 51 LEU CA C 13 54.877 0.2 . 1 . . . . 50 LEU CA . 16317 1 551 . 1 1 51 51 LEU CB C 13 42.481 0.2 . 1 . . . . 50 LEU CB . 16317 1 552 . 1 1 51 51 LEU CD1 C 13 23.342 0.2 . 2 . . . . 50 LEU CD1 . 16317 1 553 . 1 1 51 51 LEU CD2 C 13 25.638 0.2 . 2 . . . . 50 LEU CD2 . 16317 1 554 . 1 1 51 51 LEU CG C 13 26.904 0.2 . 1 . . . . 50 LEU CG . 16317 1 555 . 1 1 51 51 LEU N N 15 125.236 0.1 . 1 . . . . 50 LEU N . 16317 1 556 . 1 1 52 52 LEU H H 1 9.286 0.02 . 1 . . . . 51 LEU HN . 16317 1 557 . 1 1 52 52 LEU HA H 1 5.190 0.02 . 1 . . . . 51 LEU HA . 16317 1 558 . 1 1 52 52 LEU HB2 H 1 1.328 0.02 . 2 . . . . 51 LEU HB2 . 16317 1 559 . 1 1 52 52 LEU HB3 H 1 1.413 0.02 . 2 . . . . 51 LEU HB3 . 16317 1 560 . 1 1 52 52 LEU HD11 H 1 0.884 0.02 . 1 . . . . 51 LEU QD1 . 16317 1 561 . 1 1 52 52 LEU HD12 H 1 0.884 0.02 . 1 . . . . 51 LEU QD1 . 16317 1 562 . 1 1 52 52 LEU HD13 H 1 0.884 0.02 . 1 . . . . 51 LEU QD1 . 16317 1 563 . 1 1 52 52 LEU HD21 H 1 0.834 0.02 . 1 . . . . 51 LEU QD2 . 16317 1 564 . 1 1 52 52 LEU HD22 H 1 0.834 0.02 . 1 . . . . 51 LEU QD2 . 16317 1 565 . 1 1 52 52 LEU HD23 H 1 0.834 0.02 . 1 . . . . 51 LEU QD2 . 16317 1 566 . 1 1 52 52 LEU HG H 1 1.503 0.02 . 1 . . . . 51 LEU HG . 16317 1 567 . 1 1 52 52 LEU CA C 13 54.228 0.2 . 1 . . . . 51 LEU CA . 16317 1 568 . 1 1 52 52 LEU CB C 13 42.961 0.2 . 1 . . . . 51 LEU CB . 16317 1 569 . 1 1 52 52 LEU CD1 C 13 25.971 0.2 . 2 . . . . 51 LEU CD1 . 16317 1 570 . 1 1 52 52 LEU CD2 C 13 25.971 0.2 . 2 . . . . 51 LEU CD2 . 16317 1 571 . 1 1 52 52 LEU CG C 13 27.956 0.2 . 1 . . . . 51 LEU CG . 16317 1 572 . 1 1 52 52 LEU N N 15 134.513 0.1 . 1 . . . . 51 LEU N . 16317 1 573 . 1 1 53 53 SER H H 1 7.992 0.02 . 1 . . . . 52 SER HN . 16317 1 574 . 1 1 53 53 SER HA H 1 5.233 0.02 . 1 . . . . 52 SER HA . 16317 1 575 . 1 1 53 53 SER HB2 H 1 3.737 0.02 . 2 . . . . 52 SER HB2 . 16317 1 576 . 1 1 53 53 SER HB3 H 1 4.116 0.02 . 2 . . . . 52 SER HB3 . 16317 1 577 . 1 1 53 53 SER CA C 13 56.869 0.2 . 1 . . . . 52 SER CA . 16317 1 578 . 1 1 53 53 SER CB C 13 62.776 0.2 . 1 . . . . 52 SER CB . 16317 1 579 . 1 1 53 53 SER N N 15 117.641 0.1 . 1 . . . . 52 SER N . 16317 1 580 . 1 1 54 54 TYR H H 1 8.703 0.02 . 1 . . . . 53 TYR HN . 16317 1 581 . 1 1 54 54 TYR HA H 1 5.611 0.02 . 1 . . . . 53 TYR HA . 16317 1 582 . 1 1 54 54 TYR HB2 H 1 2.875 0.02 . 2 . . . . 53 TYR HB2 . 16317 1 583 . 1 1 54 54 TYR HB3 H 1 3.060 0.02 . 2 . . . . 53 TYR HB3 . 16317 1 584 . 1 1 54 54 TYR HD1 H 1 7.054 0.02 . 3 . . . . 53 TYR QD . 16317 1 585 . 1 1 54 54 TYR HD2 H 1 7.054 0.02 . 3 . . . . 53 TYR QD . 16317 1 586 . 1 1 54 54 TYR HE1 H 1 6.694 0.02 . 3 . . . . 53 TYR QE . 16317 1 587 . 1 1 54 54 TYR HE2 H 1 6.694 0.02 . 3 . . . . 53 TYR QE . 16317 1 588 . 1 1 54 54 TYR CA C 13 56.264 0.2 . 1 . . . . 53 TYR CA . 16317 1 589 . 1 1 54 54 TYR CB C 13 40.455 0.2 . 1 . . . . 53 TYR CB . 16317 1 590 . 1 1 54 54 TYR CD1 C 13 132.151 0.2 . 3 . . . . 53 TYR CD . 16317 1 591 . 1 1 54 54 TYR CD2 C 13 132.151 0.2 . 3 . . . . 53 TYR CD . 16317 1 592 . 1 1 54 54 TYR CE1 C 13 118.391 0.2 . 3 . . . . 53 TYR CE . 16317 1 593 . 1 1 54 54 TYR CE2 C 13 118.391 0.2 . 3 . . . . 53 TYR CE . 16317 1 594 . 1 1 54 54 TYR N N 15 122.503 0.1 . 1 . . . . 53 TYR N . 16317 1 595 . 1 1 55 55 TYR H H 1 9.813 0.02 . 1 . . . . 54 TYR HN . 16317 1 596 . 1 1 55 55 TYR HA H 1 4.983 0.02 . 1 . . . . 54 TYR HA . 16317 1 597 . 1 1 55 55 TYR HB2 H 1 2.700 0.02 . 2 . . . . 54 TYR HB2 . 16317 1 598 . 1 1 55 55 TYR HB3 H 1 3.055 0.02 . 2 . . . . 54 TYR HB3 . 16317 1 599 . 1 1 55 55 TYR HD1 H 1 7.088 0.02 . 3 . . . . 54 TYR QD . 16317 1 600 . 1 1 55 55 TYR HD2 H 1 7.088 0.02 . 3 . . . . 54 TYR QD . 16317 1 601 . 1 1 55 55 TYR HE1 H 1 6.767 0.02 . 3 . . . . 54 TYR QE . 16317 1 602 . 1 1 55 55 TYR HE2 H 1 6.767 0.02 . 3 . . . . 54 TYR QE . 16317 1 603 . 1 1 55 55 TYR CA C 13 56.465 0.2 . 1 . . . . 54 TYR CA . 16317 1 604 . 1 1 55 55 TYR CB C 13 41.898 0.2 . 1 . . . . 54 TYR CB . 16317 1 605 . 1 1 55 55 TYR CD1 C 13 133.599 0.2 . 3 . . . . 54 TYR CD . 16317 1 606 . 1 1 55 55 TYR CD2 C 13 133.599 0.2 . 3 . . . . 54 TYR CD . 16317 1 607 . 1 1 55 55 TYR CE1 C 13 117.666 0.2 . 3 . . . . 54 TYR CE . 16317 1 608 . 1 1 55 55 TYR CE2 C 13 117.666 0.2 . 3 . . . . 54 TYR CE . 16317 1 609 . 1 1 55 55 TYR N N 15 120.204 0.1 . 1 . . . . 54 TYR N . 16317 1 610 . 1 1 56 56 GLU H H 1 8.804 0.02 . 1 . . . . 55 GLU HN . 16317 1 611 . 1 1 56 56 GLU HA H 1 4.913 0.02 . 1 . . . . 55 GLU HA . 16317 1 612 . 1 1 56 56 GLU HB2 H 1 2.039 0.02 . 2 . . . . 55 GLU HB2 . 16317 1 613 . 1 1 56 56 GLU HB3 H 1 2.090 0.02 . 2 . . . . 55 GLU HB3 . 16317 1 614 . 1 1 56 56 GLU HG2 H 1 2.284 0.02 . 2 . . . . 55 GLU HG2 . 16317 1 615 . 1 1 56 56 GLU HG3 H 1 2.344 0.02 . 2 . . . . 55 GLU HG3 . 16317 1 616 . 1 1 56 56 GLU CA C 13 55.700 0.2 . 1 . . . . 55 GLU CA . 16317 1 617 . 1 1 56 56 GLU CB C 13 31.684 0.2 . 1 . . . . 55 GLU CB . 16317 1 618 . 1 1 56 56 GLU CG C 13 36.680 0.2 . 1 . . . . 55 GLU CG . 16317 1 619 . 1 1 56 56 GLU N N 15 120.472 0.1 . 1 . . . . 55 GLU N . 16317 1 620 . 1 1 57 57 SER H H 1 8.580 0.02 . 1 . . . . 56 SER HN . 16317 1 621 . 1 1 57 57 SER HA H 1 4.619 0.02 . 1 . . . . 56 SER HA . 16317 1 622 . 1 1 57 57 SER HB2 H 1 3.754 0.02 . 2 . . . . 56 SER HB2 . 16317 1 623 . 1 1 57 57 SER HB3 H 1 3.821 0.02 . 2 . . . . 56 SER HB3 . 16317 1 624 . 1 1 57 57 SER CA C 13 57.332 0.2 . 1 . . . . 56 SER CA . 16317 1 625 . 1 1 57 57 SER CB C 13 64.338 0.2 . 1 . . . . 56 SER CB . 16317 1 626 . 1 1 57 57 SER N N 15 117.342 0.1 . 1 . . . . 56 SER N . 16317 1 627 . 1 1 58 58 GLN H H 1 8.426 0.02 . 1 . . . . 57 GLN HN . 16317 1 628 . 1 1 58 58 GLN HA H 1 4.482 0.02 . 1 . . . . 57 GLN HA . 16317 1 629 . 1 1 58 58 GLN HB2 H 1 1.907 0.02 . 2 . . . . 57 GLN HB2 . 16317 1 630 . 1 1 58 58 GLN HB3 H 1 2.076 0.02 . 2 . . . . 57 GLN HB3 . 16317 1 631 . 1 1 58 58 GLN HG2 H 1 2.310 0.02 . 2 . . . . 57 GLN HG2 . 16317 1 632 . 1 1 58 58 GLN CA C 13 55.364 0.2 . 1 . . . . 57 GLN CA . 16317 1 633 . 1 1 58 58 GLN CB C 13 29.603 0.2 . 1 . . . . 57 GLN CB . 16317 1 634 . 1 1 58 58 GLN CG C 13 33.421 0.2 . 1 . . . . 57 GLN CG . 16317 1 635 . 1 1 58 58 GLN N N 15 121.444 0.1 . 1 . . . . 57 GLN N . 16317 1 636 . 1 1 59 59 HIS H H 1 8.481 0.02 . 1 . . . . 58 HIS HN . 16317 1 637 . 1 1 59 59 HIS HA H 1 4.862 0.02 . 1 . . . . 58 HIS HA . 16317 1 638 . 1 1 59 59 HIS HB2 H 1 3.039 0.02 . 2 . . . . 58 HIS HB2 . 16317 1 639 . 1 1 59 59 HIS HB3 H 1 3.143 0.02 . 2 . . . . 58 HIS HB3 . 16317 1 640 . 1 1 59 59 HIS HD2 H 1 7.136 0.02 . 1 . . . . 58 HIS HD2 . 16317 1 641 . 1 1 59 59 HIS CA C 13 54.055 0.2 . 1 . . . . 58 HIS CA . 16317 1 642 . 1 1 59 59 HIS CB C 13 30.237 0.2 . 1 . . . . 58 HIS CB . 16317 1 643 . 1 1 59 59 HIS N N 15 122.199 0.1 . 1 . . . . 58 HIS N . 16317 1 644 . 1 1 60 60 PRO HA H 1 4.506 0.02 . 1 . . . . 59 PRO HA . 16317 1 645 . 1 1 60 60 PRO HB2 H 1 1.984 0.02 . 2 . . . . 59 PRO HB2 . 16317 1 646 . 1 1 60 60 PRO HB3 H 1 2.323 0.02 . 2 . . . . 59 PRO HB3 . 16317 1 647 . 1 1 60 60 PRO HD2 H 1 3.403 0.02 . 2 . . . . 59 PRO HD2 . 16317 1 648 . 1 1 60 60 PRO HD3 H 1 3.753 0.02 . 2 . . . . 59 PRO HD3 . 16317 1 649 . 1 1 60 60 PRO HG2 H 1 1.992 0.02 . 2 . . . . 59 PRO HG2 . 16317 1 650 . 1 1 60 60 PRO CA C 13 63.254 0.2 . 1 . . . . 59 PRO CA . 16317 1 651 . 1 1 60 60 PRO CB C 13 31.829 0.2 . 1 . . . . 59 PRO CB . 16317 1 652 . 1 1 60 60 PRO CD C 13 50.595 0.2 . 1 . . . . 59 PRO CD . 16317 1 653 . 1 1 60 60 PRO CG C 13 26.828 0.2 . 1 . . . . 59 PRO CG . 16317 1 654 . 1 1 62 62 ASN H H 1 8.465 0.02 . 1 . . . . 61 ASN HN . 16317 1 655 . 1 1 62 62 ASN HA H 1 4.769 0.02 . 1 . . . . 61 ASN HA . 16317 1 656 . 1 1 62 62 ASN HB2 H 1 2.889 0.02 . 2 . . . . 61 ASN HB2 . 16317 1 657 . 1 1 62 62 ASN CA C 13 53.310 0.2 . 1 . . . . 61 ASN CA . 16317 1 658 . 1 1 62 62 ASN CB C 13 38.545 0.2 . 1 . . . . 61 ASN CB . 16317 1 659 . 1 1 62 62 ASN N N 15 120.049 0.1 . 1 . . . . 61 ASN N . 16317 1 660 . 1 1 63 63 GLU H H 1 8.369 0.02 . 1 . . . . 62 GLU HN . 16317 1 661 . 1 1 63 63 GLU HA H 1 4.348 0.02 . 1 . . . . 62 GLU HA . 16317 1 662 . 1 1 63 63 GLU HB2 H 1 1.957 0.02 . 2 . . . . 62 GLU HB2 . 16317 1 663 . 1 1 63 63 GLU HB3 H 1 2.127 0.02 . 2 . . . . 62 GLU HB3 . 16317 1 664 . 1 1 63 63 GLU HG2 H 1 2.233 0.02 . 2 . . . . 62 GLU HG2 . 16317 1 665 . 1 1 63 63 GLU HG3 H 1 2.299 0.02 . 2 . . . . 62 GLU HG3 . 16317 1 666 . 1 1 63 63 GLU CA C 13 56.828 0.2 . 1 . . . . 62 GLU CA . 16317 1 667 . 1 1 63 63 GLU CB C 13 30.044 0.2 . 1 . . . . 62 GLU CB . 16317 1 668 . 1 1 63 63 GLU CG C 13 36.079 0.2 . 1 . . . . 62 GLU CG . 16317 1 669 . 1 1 63 63 GLU N N 15 120.260 0.1 . 1 . . . . 62 GLU N . 16317 1 670 . 1 1 64 64 SER H H 1 8.254 0.02 . 1 . . . . 63 SER HN . 16317 1 671 . 1 1 64 64 SER HA H 1 4.494 0.02 . 1 . . . . 63 SER HA . 16317 1 672 . 1 1 64 64 SER HB2 H 1 3.911 0.02 . 2 . . . . 63 SER HB2 . 16317 1 673 . 1 1 64 64 SER HB3 H 1 3.950 0.02 . 2 . . . . 63 SER HB3 . 16317 1 674 . 1 1 64 64 SER CA C 13 58.213 0.2 . 1 . . . . 63 SER CA . 16317 1 675 . 1 1 64 64 SER CB C 13 63.799 0.2 . 1 . . . . 63 SER CB . 16317 1 676 . 1 1 64 64 SER N N 15 115.291 0.1 . 1 . . . . 63 SER N . 16317 1 677 . 1 1 65 65 GLY H H 1 8.294 0.02 . 1 . . . . 64 GLY HN . 16317 1 678 . 1 1 65 65 GLY HA2 H 1 4.001 0.02 . 2 . . . . 64 GLY HA1 . 16317 1 679 . 1 1 65 65 GLY CA C 13 45.306 0.2 . 1 . . . . 64 GLY CA . 16317 1 680 . 1 1 65 65 GLY N N 15 110.364 0.1 . 1 . . . . 64 GLY N . 16317 1 681 . 1 1 66 66 ASP H H 1 8.227 0.02 . 1 . . . . 65 ASP HN . 16317 1 682 . 1 1 66 66 ASP HA H 1 4.664 0.02 . 1 . . . . 65 ASP HA . 16317 1 683 . 1 1 66 66 ASP HB2 H 1 2.702 0.02 . 2 . . . . 65 ASP HB2 . 16317 1 684 . 1 1 66 66 ASP CA C 13 54.180 0.2 . 1 . . . . 65 ASP CA . 16317 1 685 . 1 1 66 66 ASP CB C 13 41.160 0.2 . 1 . . . . 65 ASP CB . 16317 1 686 . 1 1 66 66 ASP N N 15 119.894 0.1 . 1 . . . . 65 ASP N . 16317 1 687 . 1 1 67 67 GLY H H 1 8.379 0.02 . 1 . . . . 66 GLY HN . 16317 1 688 . 1 1 67 67 GLY HA2 H 1 3.997 0.02 . 2 . . . . 66 GLY HA1 . 16317 1 689 . 1 1 67 67 GLY CA C 13 45.216 0.2 . 1 . . . . 66 GLY CA . 16317 1 690 . 1 1 67 67 GLY N N 15 108.939 0.1 . 1 . . . . 66 GLY N . 16317 1 691 . 1 1 68 68 VAL H H 1 8.008 0.02 . 1 . . . . 67 VAL HN . 16317 1 692 . 1 1 68 68 VAL HA H 1 4.164 0.02 . 1 . . . . 67 VAL HA . 16317 1 693 . 1 1 68 68 VAL HB H 1 2.126 0.02 . 1 . . . . 67 VAL HB . 16317 1 694 . 1 1 68 68 VAL HG11 H 1 0.913 0.02 . 2 . . . . 67 VAL QG1 . 16317 1 695 . 1 1 68 68 VAL HG12 H 1 0.913 0.02 . 2 . . . . 67 VAL QG1 . 16317 1 696 . 1 1 68 68 VAL HG13 H 1 0.913 0.02 . 2 . . . . 67 VAL QG1 . 16317 1 697 . 1 1 68 68 VAL HG21 H 1 0.942 0.02 . 2 . . . . 67 VAL QG2 . 16317 1 698 . 1 1 68 68 VAL HG22 H 1 0.942 0.02 . 2 . . . . 67 VAL QG2 . 16317 1 699 . 1 1 68 68 VAL HG23 H 1 0.942 0.02 . 2 . . . . 67 VAL QG2 . 16317 1 700 . 1 1 68 68 VAL CA C 13 62.133 0.2 . 1 . . . . 67 VAL CA . 16317 1 701 . 1 1 68 68 VAL CB C 13 32.509 0.2 . 1 . . . . 67 VAL CB . 16317 1 702 . 1 1 68 68 VAL CG1 C 13 20.257 0.2 . 2 . . . . 67 VAL CG1 . 16317 1 703 . 1 1 68 68 VAL CG2 C 13 20.757 0.2 . 2 . . . . 67 VAL CG2 . 16317 1 704 . 1 1 68 68 VAL N N 15 118.651 0.1 . 1 . . . . 67 VAL N . 16317 1 705 . 1 1 69 69 ASP H H 1 8.441 0.02 . 1 . . . . 68 ASP HN . 16317 1 706 . 1 1 69 69 ASP HA H 1 4.664 0.02 . 1 . . . . 68 ASP HA . 16317 1 707 . 1 1 69 69 ASP HB2 H 1 2.680 0.02 . 2 . . . . 68 ASP HB2 . 16317 1 708 . 1 1 69 69 ASP HB3 H 1 2.763 0.02 . 2 . . . . 68 ASP HB3 . 16317 1 709 . 1 1 69 69 ASP CA C 13 54.211 0.2 . 1 . . . . 68 ASP CA . 16317 1 710 . 1 1 69 69 ASP CB C 13 40.995 0.2 . 1 . . . . 68 ASP CB . 16317 1 711 . 1 1 69 69 ASP N N 15 122.953 0.1 . 1 . . . . 68 ASP N . 16317 1 712 . 1 1 70 70 GLY H H 1 8.231 0.02 . 1 . . . . 69 GLY HN . 16317 1 713 . 1 1 70 70 GLY HA2 H 1 3.980 0.02 . 2 . . . . 69 GLY HA1 . 16317 1 714 . 1 1 70 70 GLY CA C 13 45.347 0.2 . 1 . . . . 69 GLY CA . 16317 1 715 . 1 1 70 70 GLY N N 15 108.501 0.1 . 1 . . . . 69 GLY N . 16317 1 716 . 1 1 71 71 LYS H H 1 8.097 0.02 . 1 . . . . 70 LYS HN . 16317 1 717 . 1 1 71 71 LYS HA H 1 4.552 0.02 . 1 . . . . 70 LYS HA . 16317 1 718 . 1 1 71 71 LYS HB2 H 1 1.794 0.02 . 2 . . . . 70 LYS HB2 . 16317 1 719 . 1 1 71 71 LYS HB3 H 1 1.853 0.02 . 2 . . . . 70 LYS HB3 . 16317 1 720 . 1 1 71 71 LYS HD2 H 1 1.665 0.02 . 2 . . . . 70 LYS HD2 . 16317 1 721 . 1 1 71 71 LYS HD3 H 1 1.707 0.02 . 2 . . . . 70 LYS HD3 . 16317 1 722 . 1 1 71 71 LYS HE2 H 1 3.002 0.02 . 2 . . . . 70 LYS HE2 . 16317 1 723 . 1 1 71 71 LYS HG2 H 1 1.408 0.02 . 2 . . . . 70 LYS HG2 . 16317 1 724 . 1 1 71 71 LYS HG3 H 1 1.473 0.02 . 2 . . . . 70 LYS HG3 . 16317 1 725 . 1 1 71 71 LYS CA C 13 55.514 0.2 . 1 . . . . 70 LYS CA . 16317 1 726 . 1 1 71 71 LYS CB C 13 33.267 0.2 . 1 . . . . 70 LYS CB . 16317 1 727 . 1 1 71 71 LYS CD C 13 28.758 0.2 . 1 . . . . 70 LYS CD . 16317 1 728 . 1 1 71 71 LYS CE C 13 42.085 0.2 . 1 . . . . 70 LYS CE . 16317 1 729 . 1 1 71 71 LYS CG C 13 24.758 0.2 . 1 . . . . 70 LYS CG . 16317 1 730 . 1 1 71 71 LYS N N 15 120.089 0.1 . 1 . . . . 70 LYS N . 16317 1 731 . 1 1 72 72 MET H H 1 8.485 0.02 . 1 . . . . 71 MET HN . 16317 1 732 . 1 1 72 72 MET HA H 1 4.622 0.02 . 1 . . . . 71 MET HA . 16317 1 733 . 1 1 72 72 MET HB2 H 1 1.947 0.02 . 2 . . . . 71 MET HB2 . 16317 1 734 . 1 1 72 72 MET HB3 H 1 2.030 0.02 . 2 . . . . 71 MET HB3 . 16317 1 735 . 1 1 72 72 MET HE1 H 1 1.990 0.02 . 1 . . . . 71 MET QE . 16317 1 736 . 1 1 72 72 MET HE2 H 1 1.990 0.02 . 1 . . . . 71 MET QE . 16317 1 737 . 1 1 72 72 MET HE3 H 1 1.990 0.02 . 1 . . . . 71 MET QE . 16317 1 738 . 1 1 72 72 MET HG2 H 1 2.436 0.02 . 2 . . . . 71 MET HG2 . 16317 1 739 . 1 1 72 72 MET HG3 H 1 2.486 0.02 . 2 . . . . 71 MET HG3 . 16317 1 740 . 1 1 72 72 MET CA C 13 54.810 0.2 . 1 . . . . 71 MET CA . 16317 1 741 . 1 1 72 72 MET CB C 13 34.060 0.2 . 1 . . . . 71 MET CB . 16317 1 742 . 1 1 72 72 MET CE C 13 16.805 0.2 . 1 . . . . 71 MET CE . 16317 1 743 . 1 1 72 72 MET CG C 13 31.807 0.2 . 1 . . . . 71 MET CG . 16317 1 744 . 1 1 72 72 MET N N 15 121.815 0.1 . 1 . . . . 71 MET N . 16317 1 745 . 1 1 73 73 LEU H H 1 8.792 0.02 . 1 . . . . 72 LEU HN . 16317 1 746 . 1 1 73 73 LEU HA H 1 5.140 0.02 . 1 . . . . 72 LEU HA . 16317 1 747 . 1 1 73 73 LEU HB2 H 1 1.729 0.02 . 2 . . . . 72 LEU HB2 . 16317 1 748 . 1 1 73 73 LEU HB3 H 1 1.882 0.02 . 2 . . . . 72 LEU HB3 . 16317 1 749 . 1 1 73 73 LEU HD11 H 1 1.019 0.02 . 1 . . . . 72 LEU QD1 . 16317 1 750 . 1 1 73 73 LEU HD12 H 1 1.019 0.02 . 1 . . . . 72 LEU QD1 . 16317 1 751 . 1 1 73 73 LEU HD13 H 1 1.019 0.02 . 1 . . . . 72 LEU QD1 . 16317 1 752 . 1 1 73 73 LEU HD21 H 1 0.979 0.02 . 1 . . . . 72 LEU QD2 . 16317 1 753 . 1 1 73 73 LEU HD22 H 1 0.979 0.02 . 1 . . . . 72 LEU QD2 . 16317 1 754 . 1 1 73 73 LEU HD23 H 1 0.979 0.02 . 1 . . . . 72 LEU QD2 . 16317 1 755 . 1 1 73 73 LEU HG H 1 1.790 0.02 . 1 . . . . 72 LEU HG . 16317 1 756 . 1 1 73 73 LEU CA C 13 53.671 0.2 . 1 . . . . 72 LEU CA . 16317 1 757 . 1 1 73 73 LEU CB C 13 44.258 0.2 . 1 . . . . 72 LEU CB . 16317 1 758 . 1 1 73 73 LEU CD1 C 13 24.983 0.2 . 2 . . . . 72 LEU CD1 . 16317 1 759 . 1 1 73 73 LEU CD2 C 13 24.238 0.2 . 2 . . . . 72 LEU CD2 . 16317 1 760 . 1 1 73 73 LEU CG C 13 27.012 0.2 . 1 . . . . 72 LEU CG . 16317 1 761 . 1 1 73 73 LEU N N 15 124.871 0.1 . 1 . . . . 72 LEU N . 16317 1 762 . 1 1 74 74 MET H H 1 9.089 0.02 . 1 . . . . 73 MET HN . 16317 1 763 . 1 1 74 74 MET HA H 1 5.741 0.02 . 1 . . . . 73 MET HA . 16317 1 764 . 1 1 74 74 MET HB2 H 1 2.102 0.02 . 2 . . . . 73 MET HB2 . 16317 1 765 . 1 1 74 74 MET HE1 H 1 1.763 0.02 . 1 . . . . 73 MET QE . 16317 1 766 . 1 1 74 74 MET HE2 H 1 1.763 0.02 . 1 . . . . 73 MET QE . 16317 1 767 . 1 1 74 74 MET HE3 H 1 1.763 0.02 . 1 . . . . 73 MET QE . 16317 1 768 . 1 1 74 74 MET HG2 H 1 2.456 0.02 . 2 . . . . 73 MET HG2 . 16317 1 769 . 1 1 74 74 MET HG3 H 1 2.545 0.02 . 2 . . . . 73 MET HG3 . 16317 1 770 . 1 1 74 74 MET CA C 13 53.328 0.2 . 1 . . . . 73 MET CA . 16317 1 771 . 1 1 74 74 MET CB C 13 36.526 0.2 . 1 . . . . 73 MET CB . 16317 1 772 . 1 1 74 74 MET CE C 13 16.884 0.2 . 1 . . . . 73 MET CE . 16317 1 773 . 1 1 74 74 MET CG C 13 32.573 0.2 . 1 . . . . 73 MET CG . 16317 1 774 . 1 1 74 74 MET N N 15 119.200 0.1 . 1 . . . . 73 MET N . 16317 1 775 . 1 1 75 75 VAL H H 1 10.046 0.02 . 1 . . . . 74 VAL HN . 16317 1 776 . 1 1 75 75 VAL HA H 1 6.298 0.02 . 1 . . . . 74 VAL HA . 16317 1 777 . 1 1 75 75 VAL HB H 1 2.101 0.02 . 1 . . . . 74 VAL HB . 16317 1 778 . 1 1 75 75 VAL HG11 H 1 0.784 0.02 . 2 . . . . 74 VAL QG1 . 16317 1 779 . 1 1 75 75 VAL HG12 H 1 0.784 0.02 . 2 . . . . 74 VAL QG1 . 16317 1 780 . 1 1 75 75 VAL HG13 H 1 0.784 0.02 . 2 . . . . 74 VAL QG1 . 16317 1 781 . 1 1 75 75 VAL HG21 H 1 0.917 0.02 . 2 . . . . 74 VAL QG2 . 16317 1 782 . 1 1 75 75 VAL HG22 H 1 0.917 0.02 . 2 . . . . 74 VAL QG2 . 16317 1 783 . 1 1 75 75 VAL HG23 H 1 0.917 0.02 . 2 . . . . 74 VAL QG2 . 16317 1 784 . 1 1 75 75 VAL CA C 13 58.377 0.2 . 1 . . . . 74 VAL CA . 16317 1 785 . 1 1 75 75 VAL CB C 13 36.528 0.2 . 1 . . . . 74 VAL CB . 16317 1 786 . 1 1 75 75 VAL CG1 C 13 21.732 0.2 . 2 . . . . 74 VAL CG1 . 16317 1 787 . 1 1 75 75 VAL CG2 C 13 20.463 0.2 . 2 . . . . 74 VAL CG2 . 16317 1 788 . 1 1 75 75 VAL N N 15 116.505 0.1 . 1 . . . . 74 VAL N . 16317 1 789 . 1 1 76 76 THR H H 1 8.519 0.02 . 1 . . . . 75 THR HN . 16317 1 790 . 1 1 76 76 THR HA H 1 4.978 0.02 . 1 . . . . 75 THR HA . 16317 1 791 . 1 1 76 76 THR HB H 1 4.391 0.02 . 1 . . . . 75 THR HB . 16317 1 792 . 1 1 76 76 THR HG21 H 1 0.299 0.02 . 1 . . . . 75 THR QG2 . 16317 1 793 . 1 1 76 76 THR HG22 H 1 0.299 0.02 . 1 . . . . 75 THR QG2 . 16317 1 794 . 1 1 76 76 THR HG23 H 1 0.299 0.02 . 1 . . . . 75 THR QG2 . 16317 1 795 . 1 1 76 76 THR CA C 13 59.451 0.2 . 1 . . . . 75 THR CA . 16317 1 796 . 1 1 76 76 THR CB C 13 71.755 0.2 . 1 . . . . 75 THR CB . 16317 1 797 . 1 1 76 76 THR CG2 C 13 20.154 0.2 . 1 . . . . 75 THR CG2 . 16317 1 798 . 1 1 76 76 THR N N 15 111.166 0.1 . 1 . . . . 75 THR N . 16317 1 799 . 1 1 77 77 LEU H H 1 10.195 0.02 . 1 . . . . 76 LEU HN . 16317 1 800 . 1 1 77 77 LEU HA H 1 5.175 0.02 . 1 . . . . 76 LEU HA . 16317 1 801 . 1 1 77 77 LEU HB2 H 1 0.976 0.02 . 2 . . . . 76 LEU HB2 . 16317 1 802 . 1 1 77 77 LEU HB3 H 1 1.545 0.02 . 2 . . . . 76 LEU HB3 . 16317 1 803 . 1 1 77 77 LEU HD11 H 1 0.220 0.02 . 2 . . . . 76 LEU QD1 . 16317 1 804 . 1 1 77 77 LEU HD12 H 1 0.220 0.02 . 2 . . . . 76 LEU QD1 . 16317 1 805 . 1 1 77 77 LEU HD13 H 1 0.220 0.02 . 2 . . . . 76 LEU QD1 . 16317 1 806 . 1 1 77 77 LEU HD21 H 1 0.244 0.02 . 2 . . . . 76 LEU QD2 . 16317 1 807 . 1 1 77 77 LEU HD22 H 1 0.244 0.02 . 2 . . . . 76 LEU QD2 . 16317 1 808 . 1 1 77 77 LEU HD23 H 1 0.244 0.02 . 2 . . . . 76 LEU QD2 . 16317 1 809 . 1 1 77 77 LEU HG H 1 1.353 0.02 . 1 . . . . 76 LEU HG . 16317 1 810 . 1 1 77 77 LEU CA C 13 55.214 0.2 . 1 . . . . 76 LEU CA . 16317 1 811 . 1 1 77 77 LEU CB C 13 45.718 0.2 . 1 . . . . 76 LEU CB . 16317 1 812 . 1 1 77 77 LEU CD1 C 13 25.712 0.2 . 2 . . . . 76 LEU CD1 . 16317 1 813 . 1 1 77 77 LEU CD2 C 13 25.708 0.2 . 2 . . . . 76 LEU CD2 . 16317 1 814 . 1 1 77 77 LEU CG C 13 27.715 0.2 . 1 . . . . 76 LEU CG . 16317 1 815 . 1 1 77 77 LEU N N 15 121.235 0.1 . 1 . . . . 76 LEU N . 16317 1 816 . 1 1 78 78 SER H H 1 8.596 0.02 . 1 . . . . 77 SER HN . 16317 1 817 . 1 1 78 78 SER HA H 1 5.427 0.02 . 1 . . . . 77 SER HA . 16317 1 818 . 1 1 78 78 SER HB2 H 1 2.449 0.02 . 2 . . . . 77 SER HB2 . 16317 1 819 . 1 1 78 78 SER HB3 H 1 3.247 0.02 . 2 . . . . 77 SER HB3 . 16317 1 820 . 1 1 78 78 SER HG H 1 4.437 0.02 . 1 . . . . 77 SER HG . 16317 1 821 . 1 1 78 78 SER CA C 13 52.060 0.2 . 1 . . . . 77 SER CA . 16317 1 822 . 1 1 78 78 SER CB C 13 63.768 0.2 . 1 . . . . 77 SER CB . 16317 1 823 . 1 1 78 78 SER N N 15 116.108 0.1 . 1 . . . . 77 SER N . 16317 1 824 . 1 1 79 79 PRO HA H 1 4.257 0.02 . 1 . . . . 78 PRO HA . 16317 1 825 . 1 1 79 79 PRO HB2 H 1 0.951 0.02 . 2 . . . . 78 PRO HB2 . 16317 1 826 . 1 1 79 79 PRO HB3 H 1 1.246 0.02 . 2 . . . . 78 PRO HB3 . 16317 1 827 . 1 1 79 79 PRO HD2 H 1 3.128 0.02 . 2 . . . . 78 PRO HD2 . 16317 1 828 . 1 1 79 79 PRO HD3 H 1 3.443 0.02 . 2 . . . . 78 PRO HD3 . 16317 1 829 . 1 1 79 79 PRO HG2 H 1 0.973 0.02 . 2 . . . . 78 PRO HG2 . 16317 1 830 . 1 1 79 79 PRO HG3 H 1 1.260 0.02 . 2 . . . . 78 PRO HG3 . 16317 1 831 . 1 1 79 79 PRO CA C 13 62.972 0.2 . 1 . . . . 78 PRO CA . 16317 1 832 . 1 1 79 79 PRO CB C 13 31.667 0.2 . 1 . . . . 78 PRO CB . 16317 1 833 . 1 1 79 79 PRO CD C 13 49.694 0.2 . 1 . . . . 78 PRO CD . 16317 1 834 . 1 1 79 79 PRO CG C 13 27.166 0.2 . 1 . . . . 78 PRO CG . 16317 1 835 . 1 1 80 80 THR H H 1 6.796 0.02 . 1 . . . . 79 THR HN . 16317 1 836 . 1 1 80 80 THR HA H 1 4.204 0.02 . 1 . . . . 79 THR HA . 16317 1 837 . 1 1 80 80 THR HB H 1 3.917 0.02 . 1 . . . . 79 THR HB . 16317 1 838 . 1 1 80 80 THR HG1 H 1 4.427 0.02 . 1 . . . . 79 THR HG1 . 16317 1 839 . 1 1 80 80 THR HG21 H 1 0.740 0.02 . 1 . . . . 79 THR QG2 . 16317 1 840 . 1 1 80 80 THR HG22 H 1 0.740 0.02 . 1 . . . . 79 THR QG2 . 16317 1 841 . 1 1 80 80 THR HG23 H 1 0.740 0.02 . 1 . . . . 79 THR QG2 . 16317 1 842 . 1 1 80 80 THR CA C 13 60.016 0.2 . 1 . . . . 79 THR CA . 16317 1 843 . 1 1 80 80 THR CB C 13 68.509 0.2 . 1 . . . . 79 THR CB . 16317 1 844 . 1 1 80 80 THR CG2 C 13 19.613 0.2 . 1 . . . . 79 THR CG2 . 16317 1 845 . 1 1 80 80 THR N N 15 110.183 0.1 . 1 . . . . 79 THR N . 16317 1 846 . 1 1 81 81 LYS H H 1 7.638 0.02 . 1 . . . . 80 LYS HN . 16317 1 847 . 1 1 81 81 LYS HA H 1 3.744 0.02 . 1 . . . . 80 LYS HA . 16317 1 848 . 1 1 81 81 LYS HB2 H 1 1.686 0.02 . 2 . . . . 80 LYS HB2 . 16317 1 849 . 1 1 81 81 LYS HB3 H 1 1.753 0.02 . 2 . . . . 80 LYS HB3 . 16317 1 850 . 1 1 81 81 LYS HD2 H 1 1.725 0.02 . 2 . . . . 80 LYS HD2 . 16317 1 851 . 1 1 81 81 LYS HE2 H 1 3.054 0.02 . 2 . . . . 80 LYS HE2 . 16317 1 852 . 1 1 81 81 LYS HG2 H 1 1.367 0.02 . 2 . . . . 80 LYS HG2 . 16317 1 853 . 1 1 81 81 LYS CA C 13 58.578 0.2 . 1 . . . . 80 LYS CA . 16317 1 854 . 1 1 81 81 LYS CB C 13 32.325 0.2 . 1 . . . . 80 LYS CB . 16317 1 855 . 1 1 81 81 LYS CD C 13 28.825 0.2 . 1 . . . . 80 LYS CD . 16317 1 856 . 1 1 81 81 LYS CE C 13 41.826 0.2 . 1 . . . . 80 LYS CE . 16317 1 857 . 1 1 81 81 LYS CG C 13 24.074 0.2 . 1 . . . . 80 LYS CG . 16317 1 858 . 1 1 81 81 LYS N N 15 124.973 0.1 . 1 . . . . 80 LYS N . 16317 1 859 . 1 1 82 82 ASP H H 1 8.255 0.02 . 1 . . . . 81 ASP HN . 16317 1 860 . 1 1 82 82 ASP HA H 1 4.277 0.02 . 1 . . . . 81 ASP HA . 16317 1 861 . 1 1 82 82 ASP HB2 H 1 2.979 0.02 . 2 . . . . 81 ASP HB2 . 16317 1 862 . 1 1 82 82 ASP HB3 H 1 3.199 0.02 . 2 . . . . 81 ASP HB3 . 16317 1 863 . 1 1 82 82 ASP CA C 13 57.378 0.2 . 1 . . . . 81 ASP CA . 16317 1 864 . 1 1 82 82 ASP CB C 13 39.348 0.2 . 1 . . . . 81 ASP CB . 16317 1 865 . 1 1 82 82 ASP N N 15 117.344 0.1 . 1 . . . . 81 ASP N . 16317 1 866 . 1 1 83 83 PHE H H 1 7.880 0.02 . 1 . . . . 82 PHE HN . 16317 1 867 . 1 1 83 83 PHE HA H 1 5.243 0.02 . 1 . . . . 82 PHE HA . 16317 1 868 . 1 1 83 83 PHE HB2 H 1 2.180 0.02 . 2 . . . . 82 PHE HB2 . 16317 1 869 . 1 1 83 83 PHE HB3 H 1 2.677 0.02 . 2 . . . . 82 PHE HB3 . 16317 1 870 . 1 1 83 83 PHE HD1 H 1 6.923 0.02 . 3 . . . . 82 PHE QD . 16317 1 871 . 1 1 83 83 PHE HD2 H 1 6.923 0.02 . 3 . . . . 82 PHE QD . 16317 1 872 . 1 1 83 83 PHE HE1 H 1 7.195 0.02 . 3 . . . . 82 PHE QE . 16317 1 873 . 1 1 83 83 PHE HE2 H 1 7.195 0.02 . 3 . . . . 82 PHE QE . 16317 1 874 . 1 1 83 83 PHE HZ H 1 7.230 0.02 . 1 . . . . 82 PHE HZ . 16317 1 875 . 1 1 83 83 PHE CA C 13 56.927 0.2 . 1 . . . . 82 PHE CA . 16317 1 876 . 1 1 83 83 PHE CB C 13 41.679 0.2 . 1 . . . . 82 PHE CB . 16317 1 877 . 1 1 83 83 PHE CD1 C 13 131.427 0.2 . 3 . . . . 82 PHE CD . 16317 1 878 . 1 1 83 83 PHE CD2 C 13 131.427 0.2 . 3 . . . . 82 PHE CD . 16317 1 879 . 1 1 83 83 PHE CE1 C 13 131.427 0.2 . 3 . . . . 82 PHE CE . 16317 1 880 . 1 1 83 83 PHE CE2 C 13 131.427 0.2 . 3 . . . . 82 PHE CE . 16317 1 881 . 1 1 83 83 PHE N N 15 115.687 0.1 . 1 . . . . 82 PHE N . 16317 1 882 . 1 1 84 84 TRP H H 1 8.718 0.02 . 1 . . . . 83 TRP HN . 16317 1 883 . 1 1 84 84 TRP HA H 1 5.445 0.02 . 1 . . . . 83 TRP HA . 16317 1 884 . 1 1 84 84 TRP HB2 H 1 2.930 0.02 . 2 . . . . 83 TRP HB2 . 16317 1 885 . 1 1 84 84 TRP HB3 H 1 3.549 0.02 . 2 . . . . 83 TRP HB3 . 16317 1 886 . 1 1 84 84 TRP HD1 H 1 7.142 0.02 . 1 . . . . 83 TRP HD1 . 16317 1 887 . 1 1 84 84 TRP HE1 H 1 9.675 0.02 . 1 . . . . 83 TRP HE1 . 16317 1 888 . 1 1 84 84 TRP HE3 H 1 7.463 0.02 . 1 . . . . 83 TRP HE3 . 16317 1 889 . 1 1 84 84 TRP HH2 H 1 7.230 0.02 . 1 . . . . 83 TRP HH2 . 16317 1 890 . 1 1 84 84 TRP HZ2 H 1 7.484 0.02 . 1 . . . . 83 TRP HZ2 . 16317 1 891 . 1 1 84 84 TRP HZ3 H 1 7.145 0.02 . 1 . . . . 83 TRP HZ3 . 16317 1 892 . 1 1 84 84 TRP CA C 13 57.105 0.2 . 1 . . . . 83 TRP CA . 16317 1 893 . 1 1 84 84 TRP CB C 13 33.602 0.2 . 1 . . . . 83 TRP CB . 16317 1 894 . 1 1 84 84 TRP CD1 C 13 126.727 0.2 . 1 . . . . 83 TRP CD1 . 16317 1 895 . 1 1 84 84 TRP CE3 C 13 121.288 0.2 . 1 . . . . 83 TRP CE3 . 16317 1 896 . 1 1 84 84 TRP CH2 C 13 123.948 0.2 . 1 . . . . 83 TRP CH2 . 16317 1 897 . 1 1 84 84 TRP CZ2 C 13 113.506 0.2 . 1 . . . . 83 TRP CZ2 . 16317 1 898 . 1 1 84 84 TRP N N 15 119.999 0.1 . 1 . . . . 83 TRP N . 16317 1 899 . 1 1 84 84 TRP NE1 N 15 128.038 0.1 . 1 . . . . 83 TRP NE1 . 16317 1 900 . 1 1 85 85 LEU H H 1 8.738 0.02 . 1 . . . . 84 LEU HN . 16317 1 901 . 1 1 85 85 LEU HA H 1 4.802 0.02 . 1 . . . . 84 LEU HA . 16317 1 902 . 1 1 85 85 LEU HB2 H 1 1.565 0.02 . 2 . . . . 84 LEU HB2 . 16317 1 903 . 1 1 85 85 LEU HB3 H 1 1.645 0.02 . 2 . . . . 84 LEU HB3 . 16317 1 904 . 1 1 85 85 LEU HD11 H 1 0.654 0.02 . 1 . . . . 84 LEU QD1 . 16317 1 905 . 1 1 85 85 LEU HD12 H 1 0.654 0.02 . 1 . . . . 84 LEU QD1 . 16317 1 906 . 1 1 85 85 LEU HD13 H 1 0.654 0.02 . 1 . . . . 84 LEU QD1 . 16317 1 907 . 1 1 85 85 LEU HD21 H 1 0.575 0.02 . 1 . . . . 84 LEU QD2 . 16317 1 908 . 1 1 85 85 LEU HD22 H 1 0.575 0.02 . 1 . . . . 84 LEU QD2 . 16317 1 909 . 1 1 85 85 LEU HD23 H 1 0.575 0.02 . 1 . . . . 84 LEU QD2 . 16317 1 910 . 1 1 85 85 LEU HG H 1 1.529 0.02 . 1 . . . . 84 LEU HG . 16317 1 911 . 1 1 85 85 LEU CA C 13 56.224 0.2 . 1 . . . . 84 LEU CA . 16317 1 912 . 1 1 85 85 LEU CB C 13 42.532 0.2 . 1 . . . . 84 LEU CB . 16317 1 913 . 1 1 85 85 LEU CD1 C 13 24.459 0.2 . 2 . . . . 84 LEU CD1 . 16317 1 914 . 1 1 85 85 LEU CD2 C 13 24.953 0.2 . 2 . . . . 84 LEU CD2 . 16317 1 915 . 1 1 85 85 LEU CG C 13 28.224 0.2 . 1 . . . . 84 LEU CG . 16317 1 916 . 1 1 85 85 LEU N N 15 123.889 0.1 . 1 . . . . 84 LEU N . 16317 1 917 . 1 1 86 86 HIS H H 1 9.563 0.02 . 1 . . . . 85 HIS HN . 16317 1 918 . 1 1 86 86 HIS HA H 1 5.027 0.02 . 1 . . . . 85 HIS HA . 16317 1 919 . 1 1 86 86 HIS HB2 H 1 2.863 0.02 . 2 . . . . 85 HIS HB2 . 16317 1 920 . 1 1 86 86 HIS HB3 H 1 2.960 0.02 . 2 . . . . 85 HIS HB3 . 16317 1 921 . 1 1 86 86 HIS HD2 H 1 6.710 0.02 . 1 . . . . 85 HIS HD2 . 16317 1 922 . 1 1 86 86 HIS HE1 H 1 7.628 0.02 . 1 . . . . 85 HIS HE1 . 16317 1 923 . 1 1 86 86 HIS CA C 13 54.704 0.2 . 1 . . . . 85 HIS CA . 16317 1 924 . 1 1 86 86 HIS CB C 13 33.214 0.2 . 1 . . . . 85 HIS CB . 16317 1 925 . 1 1 86 86 HIS CE1 C 13 138.669 0.2 . 1 . . . . 85 HIS CE1 . 16317 1 926 . 1 1 86 86 HIS N N 15 121.782 0.1 . 1 . . . . 85 HIS N . 16317 1 927 . 1 1 87 87 ALA H H 1 8.544 0.02 . 1 . . . . 86 ALA HN . 16317 1 928 . 1 1 87 87 ALA HA H 1 4.614 0.02 . 1 . . . . 86 ALA HA . 16317 1 929 . 1 1 87 87 ALA HB1 H 1 1.563 0.02 . 1 . . . . 86 ALA QB . 16317 1 930 . 1 1 87 87 ALA HB2 H 1 1.563 0.02 . 1 . . . . 86 ALA QB . 16317 1 931 . 1 1 87 87 ALA HB3 H 1 1.563 0.02 . 1 . . . . 86 ALA QB . 16317 1 932 . 1 1 87 87 ALA CA C 13 52.098 0.2 . 1 . . . . 86 ALA CA . 16317 1 933 . 1 1 87 87 ALA CB C 13 20.690 0.2 . 1 . . . . 86 ALA CB . 16317 1 934 . 1 1 87 87 ALA N N 15 125.230 0.1 . 1 . . . . 86 ALA N . 16317 1 935 . 1 1 88 88 ASN H H 1 8.846 0.02 . 1 . . . . 87 ASN HN . 16317 1 936 . 1 1 88 88 ASN HA H 1 4.862 0.02 . 1 . . . . 87 ASN HA . 16317 1 937 . 1 1 88 88 ASN HB2 H 1 2.346 0.02 . 2 . . . . 87 ASN HB2 . 16317 1 938 . 1 1 88 88 ASN HB3 H 1 3.650 0.02 . 2 . . . . 87 ASN HB3 . 16317 1 939 . 1 1 88 88 ASN CA C 13 51.444 0.2 . 1 . . . . 87 ASN CA . 16317 1 940 . 1 1 88 88 ASN CB C 13 37.171 0.2 . 1 . . . . 87 ASN CB . 16317 1 941 . 1 1 88 88 ASN N N 15 121.260 0.1 . 1 . . . . 87 ASN N . 16317 1 942 . 1 1 89 89 ASN H H 1 8.638 0.02 . 1 . . . . 88 ASN HN . 16317 1 943 . 1 1 89 89 ASN HA H 1 4.284 0.02 . 1 . . . . 88 ASN HA . 16317 1 944 . 1 1 89 89 ASN HB2 H 1 2.702 0.02 . 2 . . . . 88 ASN HB2 . 16317 1 945 . 1 1 89 89 ASN HB3 H 1 2.854 0.02 . 2 . . . . 88 ASN HB3 . 16317 1 946 . 1 1 89 89 ASN CA C 13 55.788 0.2 . 1 . . . . 88 ASN CA . 16317 1 947 . 1 1 89 89 ASN CB C 13 37.818 0.2 . 1 . . . . 88 ASN CB . 16317 1 948 . 1 1 89 89 ASN N N 15 121.570 0.1 . 1 . . . . 88 ASN N . 16317 1 949 . 1 1 90 90 LYS H H 1 8.196 0.02 . 1 . . . . 89 LYS HN . 16317 1 950 . 1 1 90 90 LYS HA H 1 4.101 0.02 . 1 . . . . 89 LYS HA . 16317 1 951 . 1 1 90 90 LYS HB2 H 1 1.936 0.02 . 2 . . . . 89 LYS HB2 . 16317 1 952 . 1 1 90 90 LYS HB3 H 1 1.987 0.02 . 2 . . . . 89 LYS HB3 . 16317 1 953 . 1 1 90 90 LYS HD2 H 1 1.748 0.02 . 2 . . . . 89 LYS HD2 . 16317 1 954 . 1 1 90 90 LYS HE2 H 1 3.057 0.02 . 2 . . . . 89 LYS HE2 . 16317 1 955 . 1 1 90 90 LYS HG2 H 1 1.474 0.02 . 2 . . . . 89 LYS HG2 . 16317 1 956 . 1 1 90 90 LYS HG3 H 1 1.554 0.02 . 2 . . . . 89 LYS HG3 . 16317 1 957 . 1 1 90 90 LYS CA C 13 58.402 0.2 . 1 . . . . 89 LYS CA . 16317 1 958 . 1 1 90 90 LYS CB C 13 32.018 0.2 . 1 . . . . 89 LYS CB . 16317 1 959 . 1 1 90 90 LYS CD C 13 28.758 0.2 . 1 . . . . 89 LYS CD . 16317 1 960 . 1 1 90 90 LYS CE C 13 42.085 0.2 . 1 . . . . 89 LYS CE . 16317 1 961 . 1 1 90 90 LYS CG C 13 24.758 0.2 . 1 . . . . 89 LYS CG . 16317 1 962 . 1 1 90 90 LYS N N 15 119.566 0.1 . 1 . . . . 89 LYS N . 16317 1 963 . 1 1 91 91 GLU H H 1 6.917 0.02 . 1 . . . . 90 GLU HN . 16317 1 964 . 1 1 91 91 GLU HA H 1 4.378 0.02 . 1 . . . . 90 GLU HA . 16317 1 965 . 1 1 91 91 GLU HB2 H 1 1.596 0.02 . 2 . . . . 90 GLU HB2 . 16317 1 966 . 1 1 91 91 GLU HB3 H 1 2.322 0.02 . 2 . . . . 90 GLU HB3 . 16317 1 967 . 1 1 91 91 GLU HG2 H 1 2.162 0.02 . 2 . . . . 90 GLU HG2 . 16317 1 968 . 1 1 91 91 GLU HG3 H 1 2.294 0.02 . 2 . . . . 90 GLU HG3 . 16317 1 969 . 1 1 91 91 GLU CA C 13 54.864 0.2 . 1 . . . . 90 GLU CA . 16317 1 970 . 1 1 91 91 GLU CB C 13 29.597 0.2 . 1 . . . . 90 GLU CB . 16317 1 971 . 1 1 91 91 GLU CG C 13 36.126 0.2 . 1 . . . . 90 GLU CG . 16317 1 972 . 1 1 91 91 GLU N N 15 114.145 0.1 . 1 . . . . 90 GLU N . 16317 1 973 . 1 1 92 92 HIS H H 1 7.738 0.02 . 1 . . . . 91 HIS HN . 16317 1 974 . 1 1 92 92 HIS HA H 1 4.181 0.02 . 1 . . . . 91 HIS HA . 16317 1 975 . 1 1 92 92 HIS HB2 H 1 3.586 0.02 . 2 . . . . 91 HIS HB2 . 16317 1 976 . 1 1 92 92 HIS HB3 H 1 3.657 0.02 . 2 . . . . 91 HIS HB3 . 16317 1 977 . 1 1 92 92 HIS HD2 H 1 7.127 0.02 . 1 . . . . 91 HIS HD2 . 16317 1 978 . 1 1 92 92 HIS CA C 13 57.189 0.2 . 1 . . . . 91 HIS CA . 16317 1 979 . 1 1 92 92 HIS CB C 13 26.154 0.2 . 1 . . . . 91 HIS CB . 16317 1 980 . 1 1 92 92 HIS N N 15 115.238 0.1 . 1 . . . . 91 HIS N . 16317 1 981 . 1 1 93 93 SER H H 1 8.415 0.02 . 1 . . . . 92 SER HN . 16317 1 982 . 1 1 93 93 SER HA H 1 5.185 0.02 . 1 . . . . 92 SER HA . 16317 1 983 . 1 1 93 93 SER HB2 H 1 3.761 0.02 . 2 . . . . 92 SER HB2 . 16317 1 984 . 1 1 93 93 SER HB3 H 1 4.080 0.02 . 2 . . . . 92 SER HB3 . 16317 1 985 . 1 1 93 93 SER CA C 13 56.374 0.2 . 1 . . . . 92 SER CA . 16317 1 986 . 1 1 93 93 SER CB C 13 67.005 0.2 . 1 . . . . 92 SER CB . 16317 1 987 . 1 1 93 93 SER N N 15 113.966 0.1 . 1 . . . . 92 SER N . 16317 1 988 . 1 1 94 94 VAL H H 1 8.251 0.02 . 1 . . . . 93 VAL HN . 16317 1 989 . 1 1 94 94 VAL HA H 1 4.868 0.02 . 1 . . . . 93 VAL HA . 16317 1 990 . 1 1 94 94 VAL HB H 1 1.837 0.02 . 1 . . . . 93 VAL HB . 16317 1 991 . 1 1 94 94 VAL HG11 H 1 0.817 0.02 . 1 . . . . 93 VAL QG1 . 16317 1 992 . 1 1 94 94 VAL HG12 H 1 0.817 0.02 . 1 . . . . 93 VAL QG1 . 16317 1 993 . 1 1 94 94 VAL HG13 H 1 0.817 0.02 . 1 . . . . 93 VAL QG1 . 16317 1 994 . 1 1 94 94 VAL HG21 H 1 0.777 0.02 . 1 . . . . 93 VAL QG2 . 16317 1 995 . 1 1 94 94 VAL HG22 H 1 0.777 0.02 . 1 . . . . 93 VAL QG2 . 16317 1 996 . 1 1 94 94 VAL HG23 H 1 0.777 0.02 . 1 . . . . 93 VAL QG2 . 16317 1 997 . 1 1 94 94 VAL CA C 13 60.478 0.2 . 1 . . . . 93 VAL CA . 16317 1 998 . 1 1 94 94 VAL CB C 13 33.120 0.2 . 1 . . . . 93 VAL CB . 16317 1 999 . 1 1 94 94 VAL CG1 C 13 22.169 0.2 . 2 . . . . 93 VAL CG1 . 16317 1 1000 . 1 1 94 94 VAL CG2 C 13 21.446 0.2 . 2 . . . . 93 VAL CG2 . 16317 1 1001 . 1 1 94 94 VAL N N 15 116.256 0.1 . 1 . . . . 93 VAL N . 16317 1 1002 . 1 1 95 95 GLU H H 1 8.904 0.02 . 1 . . . . 94 GLU HN . 16317 1 1003 . 1 1 95 95 GLU HA H 1 4.878 0.02 . 1 . . . . 94 GLU HA . 16317 1 1004 . 1 1 95 95 GLU HB2 H 1 1.874 0.02 . 2 . . . . 94 GLU HB2 . 16317 1 1005 . 1 1 95 95 GLU HB3 H 1 2.031 0.02 . 2 . . . . 94 GLU HB3 . 16317 1 1006 . 1 1 95 95 GLU HG2 H 1 2.201 0.02 . 2 . . . . 94 GLU HG2 . 16317 1 1007 . 1 1 95 95 GLU HG3 H 1 2.415 0.02 . 2 . . . . 94 GLU HG3 . 16317 1 1008 . 1 1 95 95 GLU CA C 13 53.455 0.2 . 1 . . . . 94 GLU CA . 16317 1 1009 . 1 1 95 95 GLU CB C 13 34.430 0.2 . 1 . . . . 94 GLU CB . 16317 1 1010 . 1 1 95 95 GLU CG C 13 35.698 0.2 . 1 . . . . 94 GLU CG . 16317 1 1011 . 1 1 95 95 GLU N N 15 122.142 0.1 . 1 . . . . 94 GLU N . 16317 1 1012 . 1 1 96 96 LEU H H 1 8.237 0.02 . 1 . . . . 95 LEU HN . 16317 1 1013 . 1 1 96 96 LEU HA H 1 4.974 0.02 . 1 . . . . 95 LEU HA . 16317 1 1014 . 1 1 96 96 LEU HB2 H 1 1.285 0.02 . 2 . . . . 95 LEU HB2 . 16317 1 1015 . 1 1 96 96 LEU HB3 H 1 1.410 0.02 . 2 . . . . 95 LEU HB3 . 16317 1 1016 . 1 1 96 96 LEU HD11 H 1 0.622 0.02 . 1 . . . . 95 LEU QD1 . 16317 1 1017 . 1 1 96 96 LEU HD12 H 1 0.622 0.02 . 1 . . . . 95 LEU QD1 . 16317 1 1018 . 1 1 96 96 LEU HD13 H 1 0.622 0.02 . 1 . . . . 95 LEU QD1 . 16317 1 1019 . 1 1 96 96 LEU HD21 H 1 0.569 0.02 . 1 . . . . 95 LEU QD2 . 16317 1 1020 . 1 1 96 96 LEU HD22 H 1 0.569 0.02 . 1 . . . . 95 LEU QD2 . 16317 1 1021 . 1 1 96 96 LEU HD23 H 1 0.569 0.02 . 1 . . . . 95 LEU QD2 . 16317 1 1022 . 1 1 96 96 LEU HG H 1 1.464 0.02 . 1 . . . . 95 LEU HG . 16317 1 1023 . 1 1 96 96 LEU CA C 13 53.731 0.2 . 1 . . . . 95 LEU CA . 16317 1 1024 . 1 1 96 96 LEU CB C 13 43.478 0.2 . 1 . . . . 95 LEU CB . 16317 1 1025 . 1 1 96 96 LEU CD1 C 13 25.339 0.2 . 2 . . . . 95 LEU CD1 . 16317 1 1026 . 1 1 96 96 LEU CD2 C 13 24.841 0.2 . 2 . . . . 95 LEU CD2 . 16317 1 1027 . 1 1 96 96 LEU CG C 13 26.983 0.2 . 1 . . . . 95 LEU CG . 16317 1 1028 . 1 1 96 96 LEU N N 15 121.305 0.1 . 1 . . . . 95 LEU N . 16317 1 1029 . 1 1 97 97 HIS H H 1 8.294 0.02 . 1 . . . . 96 HIS HN . 16317 1 1030 . 1 1 97 97 HIS HA H 1 4.947 0.02 . 1 . . . . 96 HIS HA . 16317 1 1031 . 1 1 97 97 HIS HB2 H 1 2.221 0.02 . 2 . . . . 96 HIS HB2 . 16317 1 1032 . 1 1 97 97 HIS HB3 H 1 2.886 0.02 . 2 . . . . 96 HIS HB3 . 16317 1 1033 . 1 1 97 97 HIS HD2 H 1 6.370 0.02 . 1 . . . . 96 HIS HD2 . 16317 1 1034 . 1 1 97 97 HIS CA C 13 54.144 0.2 . 1 . . . . 96 HIS CA . 16317 1 1035 . 1 1 97 97 HIS CB C 13 33.344 0.2 . 1 . . . . 96 HIS CB . 16317 1 1036 . 1 1 97 97 HIS N N 15 119.193 0.1 . 1 . . . . 96 HIS N . 16317 1 1037 . 1 1 98 98 LYS H H 1 8.582 0.02 . 1 . . . . 97 LYS HN . 16317 1 1038 . 1 1 98 98 LYS HA H 1 4.564 0.02 . 1 . . . . 97 LYS HA . 16317 1 1039 . 1 1 98 98 LYS HB2 H 1 0.733 0.02 . 2 . . . . 97 LYS HB2 . 16317 1 1040 . 1 1 98 98 LYS HB3 H 1 1.376 0.02 . 2 . . . . 97 LYS HB3 . 16317 1 1041 . 1 1 98 98 LYS HD2 H 1 1.472 0.02 . 2 . . . . 97 LYS HD2 . 16317 1 1042 . 1 1 98 98 LYS HD3 H 1 1.499 0.02 . 2 . . . . 97 LYS HD3 . 16317 1 1043 . 1 1 98 98 LYS HE2 H 1 2.864 0.02 . 2 . . . . 97 LYS HE2 . 16317 1 1044 . 1 1 98 98 LYS HG2 H 1 0.745 0.02 . 2 . . . . 97 LYS HG2 . 16317 1 1045 . 1 1 98 98 LYS HG3 H 1 0.929 0.02 . 2 . . . . 97 LYS HG3 . 16317 1 1046 . 1 1 98 98 LYS CA C 13 55.190 0.2 . 1 . . . . 97 LYS CA . 16317 1 1047 . 1 1 98 98 LYS CB C 13 31.941 0.2 . 1 . . . . 97 LYS CB . 16317 1 1048 . 1 1 98 98 LYS CD C 13 28.947 0.2 . 1 . . . . 97 LYS CD . 16317 1 1049 . 1 1 98 98 LYS CE C 13 41.907 0.2 . 1 . . . . 97 LYS CE . 16317 1 1050 . 1 1 98 98 LYS CG C 13 24.446 0.2 . 1 . . . . 97 LYS CG . 16317 1 1051 . 1 1 98 98 LYS N N 15 127.478 0.1 . 1 . . . . 97 LYS N . 16317 1 1052 . 1 1 99 99 CYS H H 1 8.695 0.02 . 1 . . . . 98 CYS HN . 16317 1 1053 . 1 1 99 99 CYS HA H 1 4.822 0.02 . 1 . . . . 98 CYS HA . 16317 1 1054 . 1 1 99 99 CYS HB2 H 1 2.857 0.02 . 2 . . . . 98 CYS HB2 . 16317 1 1055 . 1 1 99 99 CYS HB3 H 1 2.952 0.02 . 2 . . . . 98 CYS HB3 . 16317 1 1056 . 1 1 99 99 CYS CA C 13 57.391 0.2 . 1 . . . . 98 CYS CA . 16317 1 1057 . 1 1 99 99 CYS CB C 13 30.916 0.2 . 1 . . . . 98 CYS CB . 16317 1 1058 . 1 1 99 99 CYS N N 15 122.622 0.1 . 1 . . . . 98 CYS N . 16317 1 1059 . 1 1 100 100 GLU H H 1 8.251 0.02 . 1 . . . . 99 GLU HN . 16317 1 1060 . 1 1 100 100 GLU HA H 1 4.513 0.02 . 1 . . . . 99 GLU HA . 16317 1 1061 . 1 1 100 100 GLU HB2 H 1 1.843 0.02 . 2 . . . . 99 GLU HB2 . 16317 1 1062 . 1 1 100 100 GLU HB3 H 1 2.111 0.02 . 2 . . . . 99 GLU HB3 . 16317 1 1063 . 1 1 100 100 GLU HG2 H 1 2.280 0.02 . 2 . . . . 99 GLU HG2 . 16317 1 1064 . 1 1 100 100 GLU CA C 13 54.674 0.2 . 1 . . . . 99 GLU CA . 16317 1 1065 . 1 1 100 100 GLU CB C 13 31.421 0.2 . 1 . . . . 99 GLU CB . 16317 1 1066 . 1 1 100 100 GLU CG C 13 36.421 0.2 . 1 . . . . 99 GLU CG . 16317 1 1067 . 1 1 100 100 GLU N N 15 121.252 0.1 . 1 . . . . 99 GLU N . 16317 1 1068 . 1 1 101 101 LYS H H 1 8.195 0.02 . 1 . . . . 100 LYS HN . 16317 1 1069 . 1 1 101 101 LYS HA H 1 3.953 0.02 . 1 . . . . 100 LYS HA . 16317 1 1070 . 1 1 101 101 LYS HB2 H 1 1.688 0.02 . 2 . . . . 100 LYS HB2 . 16317 1 1071 . 1 1 101 101 LYS HB3 H 1 1.739 0.02 . 2 . . . . 100 LYS HB3 . 16317 1 1072 . 1 1 101 101 LYS HD2 H 1 1.719 0.02 . 2 . . . . 100 LYS HD2 . 16317 1 1073 . 1 1 101 101 LYS HE2 H 1 2.987 0.02 . 2 . . . . 100 LYS HE2 . 16317 1 1074 . 1 1 101 101 LYS HE3 H 1 3.061 0.02 . 2 . . . . 100 LYS HE3 . 16317 1 1075 . 1 1 101 101 LYS HG2 H 1 1.183 0.02 . 2 . . . . 100 LYS HG2 . 16317 1 1076 . 1 1 101 101 LYS HG3 H 1 1.527 0.02 . 2 . . . . 100 LYS HG3 . 16317 1 1077 . 1 1 101 101 LYS CA C 13 55.042 0.2 . 1 . . . . 100 LYS CA . 16317 1 1078 . 1 1 101 101 LYS CB C 13 31.473 0.2 . 1 . . . . 100 LYS CB . 16317 1 1079 . 1 1 101 101 LYS CD C 13 29.200 0.2 . 1 . . . . 100 LYS CD . 16317 1 1080 . 1 1 101 101 LYS CE C 13 41.940 0.2 . 1 . . . . 100 LYS CE . 16317 1 1081 . 1 1 101 101 LYS CG C 13 25.315 0.2 . 1 . . . . 100 LYS CG . 16317 1 1082 . 1 1 101 101 LYS N N 15 118.588 0.1 . 1 . . . . 100 LYS N . 16317 1 1083 . 1 1 102 102 PRO HA H 1 4.447 0.02 . 1 . . . . 101 PRO HA . 16317 1 1084 . 1 1 102 102 PRO HB2 H 1 2.059 0.02 . 2 . . . . 101 PRO HB2 . 16317 1 1085 . 1 1 102 102 PRO HB3 H 1 2.331 0.02 . 2 . . . . 101 PRO HB3 . 16317 1 1086 . 1 1 102 102 PRO HD2 H 1 3.494 0.02 . 2 . . . . 101 PRO HD2 . 16317 1 1087 . 1 1 102 102 PRO HD3 H 1 3.570 0.02 . 2 . . . . 101 PRO HD3 . 16317 1 1088 . 1 1 102 102 PRO HG2 H 1 1.872 0.02 . 2 . . . . 101 PRO HG2 . 16317 1 1089 . 1 1 102 102 PRO HG3 H 1 1.940 0.02 . 2 . . . . 101 PRO HG3 . 16317 1 1090 . 1 1 102 102 PRO CA C 13 61.513 0.2 . 1 . . . . 101 PRO CA . 16317 1 1091 . 1 1 102 102 PRO CB C 13 34.073 0.2 . 1 . . . . 101 PRO CB . 16317 1 1092 . 1 1 102 102 PRO CD C 13 50.575 0.2 . 1 . . . . 101 PRO CD . 16317 1 1093 . 1 1 102 102 PRO CG C 13 24.572 0.2 . 1 . . . . 101 PRO CG . 16317 1 1094 . 1 1 103 103 LEU H H 1 8.384 0.02 . 1 . . . . 102 LEU HN . 16317 1 1095 . 1 1 103 103 LEU HA H 1 4.175 0.02 . 1 . . . . 102 LEU HA . 16317 1 1096 . 1 1 103 103 LEU HB2 H 1 0.808 0.02 . 2 . . . . 102 LEU HB2 . 16317 1 1097 . 1 1 103 103 LEU HB3 H 1 1.369 0.02 . 2 . . . . 102 LEU HB3 . 16317 1 1098 . 1 1 103 103 LEU HD11 H 1 -0.343 0.02 . 1 . . . . 102 LEU QD1 . 16317 1 1099 . 1 1 103 103 LEU HD12 H 1 -0.343 0.02 . 1 . . . . 102 LEU QD1 . 16317 1 1100 . 1 1 103 103 LEU HD13 H 1 -0.343 0.02 . 1 . . . . 102 LEU QD1 . 16317 1 1101 . 1 1 103 103 LEU HD21 H 1 -0.475 0.02 . 1 . . . . 102 LEU QD2 . 16317 1 1102 . 1 1 103 103 LEU HD22 H 1 -0.475 0.02 . 1 . . . . 102 LEU QD2 . 16317 1 1103 . 1 1 103 103 LEU HD23 H 1 -0.475 0.02 . 1 . . . . 102 LEU QD2 . 16317 1 1104 . 1 1 103 103 LEU HG H 1 1.003 0.02 . 1 . . . . 102 LEU HG . 16317 1 1105 . 1 1 103 103 LEU CA C 13 52.733 0.2 . 1 . . . . 102 LEU CA . 16317 1 1106 . 1 1 103 103 LEU CB C 13 41.000 0.2 . 1 . . . . 102 LEU CB . 16317 1 1107 . 1 1 103 103 LEU CD1 C 13 23.807 0.2 . 2 . . . . 102 LEU CD1 . 16317 1 1108 . 1 1 103 103 LEU CD2 C 13 21.168 0.2 . 2 . . . . 102 LEU CD2 . 16317 1 1109 . 1 1 103 103 LEU CG C 13 26.724 0.2 . 1 . . . . 102 LEU CG . 16317 1 1110 . 1 1 103 103 LEU N N 15 123.679 0.1 . 1 . . . . 102 LEU N . 16317 1 1111 . 1 1 104 104 PRO HA H 1 4.658 0.02 . 1 . . . . 103 PRO HA . 16317 1 1112 . 1 1 104 104 PRO HB2 H 1 2.282 0.02 . 2 . . . . 103 PRO HB2 . 16317 1 1113 . 1 1 104 104 PRO HB3 H 1 2.383 0.02 . 2 . . . . 103 PRO HB3 . 16317 1 1114 . 1 1 104 104 PRO HD2 H 1 3.298 0.02 . 2 . . . . 103 PRO HD2 . 16317 1 1115 . 1 1 104 104 PRO HD3 H 1 3.889 0.02 . 2 . . . . 103 PRO HD3 . 16317 1 1116 . 1 1 104 104 PRO HG2 H 1 1.829 0.02 . 2 . . . . 103 PRO HG2 . 16317 1 1117 . 1 1 104 104 PRO HG3 H 1 2.314 0.02 . 2 . . . . 103 PRO HG3 . 16317 1 1118 . 1 1 104 104 PRO CA C 13 61.564 0.2 . 1 . . . . 103 PRO CA . 16317 1 1119 . 1 1 104 104 PRO CB C 13 32.310 0.2 . 1 . . . . 103 PRO CB . 16317 1 1120 . 1 1 104 104 PRO CD C 13 50.063 0.2 . 1 . . . . 103 PRO CD . 16317 1 1121 . 1 1 104 104 PRO CG C 13 27.060 0.2 . 1 . . . . 103 PRO CG . 16317 1 1122 . 1 1 105 105 ASP H H 1 8.605 0.02 . 1 . . . . 104 ASP HN . 16317 1 1123 . 1 1 105 105 ASP HA H 1 4.275 0.02 . 1 . . . . 104 ASP HA . 16317 1 1124 . 1 1 105 105 ASP HB2 H 1 2.368 0.02 . 2 . . . . 104 ASP HB2 . 16317 1 1125 . 1 1 105 105 ASP HB3 H 1 2.421 0.02 . 2 . . . . 104 ASP HB3 . 16317 1 1126 . 1 1 105 105 ASP CA C 13 57.659 0.2 . 1 . . . . 104 ASP CA . 16317 1 1127 . 1 1 105 105 ASP CB C 13 40.754 0.2 . 1 . . . . 104 ASP CB . 16317 1 1128 . 1 1 105 105 ASP N N 15 119.037 0.1 . 1 . . . . 104 ASP N . 16317 1 1129 . 1 1 106 106 GLN H H 1 8.330 0.02 . 1 . . . . 105 GLN HN . 16317 1 1130 . 1 1 106 106 GLN HA H 1 4.189 0.02 . 1 . . . . 105 GLN HA . 16317 1 1131 . 1 1 106 106 GLN HB2 H 1 1.976 0.02 . 2 . . . . 105 GLN HB2 . 16317 1 1132 . 1 1 106 106 GLN HB3 H 1 2.327 0.02 . 2 . . . . 105 GLN HB3 . 16317 1 1133 . 1 1 106 106 GLN HG2 H 1 2.524 0.02 . 2 . . . . 105 GLN HG2 . 16317 1 1134 . 1 1 106 106 GLN HG3 H 1 2.591 0.02 . 2 . . . . 105 GLN HG3 . 16317 1 1135 . 1 1 106 106 GLN CA C 13 58.516 0.2 . 1 . . . . 105 GLN CA . 16317 1 1136 . 1 1 106 106 GLN CB C 13 27.206 0.2 . 1 . . . . 105 GLN CB . 16317 1 1137 . 1 1 106 106 GLN CG C 13 34.958 0.2 . 1 . . . . 105 GLN CG . 16317 1 1138 . 1 1 106 106 GLN N N 15 113.235 0.1 . 1 . . . . 105 GLN N . 16317 1 1139 . 1 1 107 107 ALA H H 1 7.763 0.02 . 1 . . . . 106 ALA HN . 16317 1 1140 . 1 1 107 107 ALA HA H 1 4.862 0.02 . 1 . . . . 106 ALA HA . 16317 1 1141 . 1 1 107 107 ALA HB1 H 1 0.868 0.02 . 1 . . . . 106 ALA QB . 16317 1 1142 . 1 1 107 107 ALA HB2 H 1 0.868 0.02 . 1 . . . . 106 ALA QB . 16317 1 1143 . 1 1 107 107 ALA HB3 H 1 0.868 0.02 . 1 . . . . 106 ALA QB . 16317 1 1144 . 1 1 107 107 ALA CA C 13 50.856 0.2 . 1 . . . . 106 ALA CA . 16317 1 1145 . 1 1 107 107 ALA CB C 13 18.420 0.2 . 1 . . . . 106 ALA CB . 16317 1 1146 . 1 1 107 107 ALA N N 15 121.188 0.1 . 1 . . . . 106 ALA N . 16317 1 1147 . 1 1 108 108 PHE H H 1 7.291 0.02 . 1 . . . . 107 PHE HN . 16317 1 1148 . 1 1 108 108 PHE HA H 1 4.675 0.02 . 1 . . . . 107 PHE HA . 16317 1 1149 . 1 1 108 108 PHE HB2 H 1 2.573 0.02 . 2 . . . . 107 PHE HB2 . 16317 1 1150 . 1 1 108 108 PHE HB3 H 1 2.918 0.02 . 2 . . . . 107 PHE HB3 . 16317 1 1151 . 1 1 108 108 PHE HD1 H 1 6.900 0.02 . 3 . . . . 107 PHE QD . 16317 1 1152 . 1 1 108 108 PHE HD2 H 1 6.900 0.02 . 3 . . . . 107 PHE QD . 16317 1 1153 . 1 1 108 108 PHE HE1 H 1 6.184 0.02 . 3 . . . . 107 PHE QE . 16317 1 1154 . 1 1 108 108 PHE HE2 H 1 6.184 0.02 . 3 . . . . 107 PHE QE . 16317 1 1155 . 1 1 108 108 PHE HZ H 1 6.596 0.02 . 1 . . . . 107 PHE HZ . 16317 1 1156 . 1 1 108 108 PHE CA C 13 57.225 0.2 . 1 . . . . 107 PHE CA . 16317 1 1157 . 1 1 108 108 PHE CB C 13 41.449 0.2 . 1 . . . . 107 PHE CB . 16317 1 1158 . 1 1 108 108 PHE CD1 C 13 131.427 0.2 . 3 . . . . 107 PHE CD . 16317 1 1159 . 1 1 108 108 PHE CD2 C 13 131.427 0.2 . 3 . . . . 107 PHE CD . 16317 1 1160 . 1 1 108 108 PHE CE1 C 13 131.427 0.2 . 3 . . . . 107 PHE CE . 16317 1 1161 . 1 1 108 108 PHE CE2 C 13 131.427 0.2 . 3 . . . . 107 PHE CE . 16317 1 1162 . 1 1 108 108 PHE CZ C 13 129.254 0.2 . 1 . . . . 107 PHE CZ . 16317 1 1163 . 1 1 108 108 PHE N N 15 114.254 0.1 . 1 . . . . 107 PHE N . 16317 1 1164 . 1 1 109 109 PHE H H 1 9.089 0.02 . 1 . . . . 108 PHE HN . 16317 1 1165 . 1 1 109 109 PHE HA H 1 5.216 0.02 . 1 . . . . 108 PHE HA . 16317 1 1166 . 1 1 109 109 PHE HB2 H 1 2.764 0.02 . 2 . . . . 108 PHE HB2 . 16317 1 1167 . 1 1 109 109 PHE HB3 H 1 2.931 0.02 . 2 . . . . 108 PHE HB3 . 16317 1 1168 . 1 1 109 109 PHE HD1 H 1 6.973 0.02 . 3 . . . . 108 PHE QD . 16317 1 1169 . 1 1 109 109 PHE HD2 H 1 6.973 0.02 . 3 . . . . 108 PHE QD . 16317 1 1170 . 1 1 109 109 PHE HE1 H 1 7.161 0.02 . 3 . . . . 108 PHE QE . 16317 1 1171 . 1 1 109 109 PHE HE2 H 1 7.161 0.02 . 3 . . . . 108 PHE QE . 16317 1 1172 . 1 1 109 109 PHE HZ H 1 6.848 0.02 . 1 . . . . 108 PHE HZ . 16317 1 1173 . 1 1 109 109 PHE CA C 13 55.752 0.2 . 1 . . . . 108 PHE CA . 16317 1 1174 . 1 1 109 109 PHE CB C 13 41.744 0.2 . 1 . . . . 108 PHE CB . 16317 1 1175 . 1 1 109 109 PHE CD1 C 13 132.151 0.2 . 3 . . . . 108 PHE CD . 16317 1 1176 . 1 1 109 109 PHE CD2 C 13 132.151 0.2 . 3 . . . . 108 PHE CD . 16317 1 1177 . 1 1 109 109 PHE CE1 C 13 131.427 0.2 . 3 . . . . 108 PHE CE . 16317 1 1178 . 1 1 109 109 PHE CE2 C 13 131.427 0.2 . 3 . . . . 108 PHE CE . 16317 1 1179 . 1 1 109 109 PHE CZ C 13 127.806 0.2 . 1 . . . . 108 PHE CZ . 16317 1 1180 . 1 1 109 109 PHE N N 15 119.202 0.1 . 1 . . . . 108 PHE N . 16317 1 1181 . 1 1 110 110 VAL H H 1 10.389 0.02 . 1 . . . . 109 VAL HN . 16317 1 1182 . 1 1 110 110 VAL HA H 1 4.299 0.02 . 1 . . . . 109 VAL HA . 16317 1 1183 . 1 1 110 110 VAL HB H 1 2.144 0.02 . 1 . . . . 109 VAL HB . 16317 1 1184 . 1 1 110 110 VAL HG11 H 1 0.796 0.02 . 1 . . . . 109 VAL QG1 . 16317 1 1185 . 1 1 110 110 VAL HG12 H 1 0.796 0.02 . 1 . . . . 109 VAL QG1 . 16317 1 1186 . 1 1 110 110 VAL HG13 H 1 0.796 0.02 . 1 . . . . 109 VAL QG1 . 16317 1 1187 . 1 1 110 110 VAL HG21 H 1 0.938 0.02 . 1 . . . . 109 VAL QG2 . 16317 1 1188 . 1 1 110 110 VAL HG22 H 1 0.938 0.02 . 1 . . . . 109 VAL QG2 . 16317 1 1189 . 1 1 110 110 VAL HG23 H 1 0.938 0.02 . 1 . . . . 109 VAL QG2 . 16317 1 1190 . 1 1 110 110 VAL CA C 13 62.758 0.2 . 1 . . . . 109 VAL CA . 16317 1 1191 . 1 1 110 110 VAL CB C 13 33.099 0.2 . 1 . . . . 109 VAL CB . 16317 1 1192 . 1 1 110 110 VAL CG1 C 13 21.167 0.2 . 2 . . . . 109 VAL CG1 . 16317 1 1193 . 1 1 110 110 VAL CG2 C 13 21.171 0.2 . 2 . . . . 109 VAL CG2 . 16317 1 1194 . 1 1 110 110 VAL N N 15 125.234 0.1 . 1 . . . . 109 VAL N . 16317 1 1195 . 1 1 111 111 LEU H H 1 8.568 0.02 . 1 . . . . 110 LEU HN . 16317 1 1196 . 1 1 111 111 LEU HA H 1 4.872 0.02 . 1 . . . . 110 LEU HA . 16317 1 1197 . 1 1 111 111 LEU HB2 H 1 1.352 0.02 . 2 . . . . 110 LEU HB2 . 16317 1 1198 . 1 1 111 111 LEU HB3 H 1 1.937 0.02 . 2 . . . . 110 LEU HB3 . 16317 1 1199 . 1 1 111 111 LEU HD11 H 1 0.854 0.02 . 1 . . . . 110 LEU QD1 . 16317 1 1200 . 1 1 111 111 LEU HD12 H 1 0.854 0.02 . 1 . . . . 110 LEU QD1 . 16317 1 1201 . 1 1 111 111 LEU HD13 H 1 0.854 0.02 . 1 . . . . 110 LEU QD1 . 16317 1 1202 . 1 1 111 111 LEU HD21 H 1 0.929 0.02 . 1 . . . . 110 LEU QD2 . 16317 1 1203 . 1 1 111 111 LEU HD22 H 1 0.929 0.02 . 1 . . . . 110 LEU QD2 . 16317 1 1204 . 1 1 111 111 LEU HD23 H 1 0.929 0.02 . 1 . . . . 110 LEU QD2 . 16317 1 1205 . 1 1 111 111 LEU HG H 1 1.467 0.02 . 1 . . . . 110 LEU HG . 16317 1 1206 . 1 1 111 111 LEU CA C 13 54.077 0.2 . 1 . . . . 110 LEU CA . 16317 1 1207 . 1 1 111 111 LEU CB C 13 43.562 0.2 . 1 . . . . 110 LEU CB . 16317 1 1208 . 1 1 111 111 LEU CD1 C 13 24.887 0.2 . 2 . . . . 110 LEU CD1 . 16317 1 1209 . 1 1 111 111 LEU CD2 C 13 25.913 0.2 . 2 . . . . 110 LEU CD2 . 16317 1 1210 . 1 1 111 111 LEU CG C 13 27.386 0.2 . 1 . . . . 110 LEU CG . 16317 1 1211 . 1 1 111 111 LEU N N 15 130.826 0.1 . 1 . . . . 110 LEU N . 16317 1 1212 . 1 1 112 112 HIS H H 1 9.070 0.02 . 1 . . . . 111 HIS HN . 16317 1 1213 . 1 1 112 112 HIS HA H 1 4.917 0.02 . 1 . . . . 111 HIS HA . 16317 1 1214 . 1 1 112 112 HIS HB2 H 1 3.041 0.02 . 2 . . . . 111 HIS HB2 . 16317 1 1215 . 1 1 112 112 HIS HB3 H 1 3.316 0.02 . 2 . . . . 111 HIS HB3 . 16317 1 1216 . 1 1 112 112 HIS HD2 H 1 7.232 0.02 . 1 . . . . 111 HIS HD2 . 16317 1 1217 . 1 1 112 112 HIS CA C 13 54.229 0.2 . 1 . . . . 111 HIS CA . 16317 1 1218 . 1 1 112 112 HIS CB C 13 31.745 0.2 . 1 . . . . 111 HIS CB . 16317 1 1219 . 1 1 112 112 HIS N N 15 124.953 0.1 . 1 . . . . 111 HIS N . 16317 1 1220 . 1 1 113 113 ASN H H 1 9.018 0.02 . 1 . . . . 112 ASN HN . 16317 1 1221 . 1 1 113 113 ASN HA H 1 4.912 0.02 . 1 . . . . 112 ASN HA . 16317 1 1222 . 1 1 113 113 ASN HB2 H 1 2.772 0.02 . 2 . . . . 112 ASN HB2 . 16317 1 1223 . 1 1 113 113 ASN HB3 H 1 2.909 0.02 . 2 . . . . 112 ASN HB3 . 16317 1 1224 . 1 1 113 113 ASN CA C 13 54.151 0.2 . 1 . . . . 112 ASN CA . 16317 1 1225 . 1 1 113 113 ASN CB C 13 38.868 0.2 . 1 . . . . 112 ASN CB . 16317 1 1226 . 1 1 113 113 ASN N N 15 122.645 0.1 . 1 . . . . 112 ASN N . 16317 1 1227 . 1 1 114 114 MET H H 1 8.314 0.02 . 1 . . . . 113 MET HN . 16317 1 1228 . 1 1 114 114 MET HA H 1 4.891 0.02 . 1 . . . . 113 MET HA . 16317 1 1229 . 1 1 114 114 MET HB2 H 1 1.527 0.02 . 2 . . . . 113 MET HB2 . 16317 1 1230 . 1 1 114 114 MET HB3 H 1 1.920 0.02 . 2 . . . . 113 MET HB3 . 16317 1 1231 . 1 1 114 114 MET HE1 H 1 1.944 0.02 . 1 . . . . 113 MET QE . 16317 1 1232 . 1 1 114 114 MET HE2 H 1 1.944 0.02 . 1 . . . . 113 MET QE . 16317 1 1233 . 1 1 114 114 MET HE3 H 1 1.944 0.02 . 1 . . . . 113 MET QE . 16317 1 1234 . 1 1 114 114 MET HG2 H 1 2.439 0.02 . 2 . . . . 113 MET HG2 . 16317 1 1235 . 1 1 114 114 MET HG3 H 1 2.599 0.02 . 2 . . . . 113 MET HG3 . 16317 1 1236 . 1 1 114 114 MET CA C 13 53.171 0.2 . 1 . . . . 113 MET CA . 16317 1 1237 . 1 1 114 114 MET CB C 13 32.922 0.2 . 1 . . . . 113 MET CB . 16317 1 1238 . 1 1 114 114 MET CE C 13 16.935 0.2 . 1 . . . . 113 MET CE . 16317 1 1239 . 1 1 114 114 MET CG C 13 31.171 0.2 . 1 . . . . 113 MET CG . 16317 1 1240 . 1 1 114 114 MET N N 15 123.103 0.1 . 1 . . . . 113 MET N . 16317 1 1241 . 1 1 115 115 HIS H H 1 7.453 0.02 . 1 . . . . 114 HIS HN . 16317 1 1242 . 1 1 115 115 HIS HA H 1 4.664 0.02 . 1 . . . . 114 HIS HA . 16317 1 1243 . 1 1 115 115 HIS HB2 H 1 3.205 0.02 . 2 . . . . 114 HIS HB2 . 16317 1 1244 . 1 1 115 115 HIS HB3 H 1 3.320 0.02 . 2 . . . . 114 HIS HB3 . 16317 1 1245 . 1 1 115 115 HIS HD2 H 1 7.105 0.02 . 1 . . . . 114 HIS HD2 . 16317 1 1246 . 1 1 115 115 HIS CA C 13 55.572 0.2 . 1 . . . . 114 HIS CA . 16317 1 1247 . 1 1 115 115 HIS CB C 13 30.856 0.2 . 1 . . . . 114 HIS CB . 16317 1 1248 . 1 1 115 115 HIS N N 15 115.450 0.1 . 1 . . . . 114 HIS N . 16317 1 1249 . 1 1 116 116 SER HB2 H 1 4.124 0.02 . 2 . . . . 115 SER HB2 . 16317 1 1250 . 1 1 116 116 SER CB C 13 61.131 0.2 . 1 . . . . 115 SER CB . 16317 1 1251 . 1 1 117 117 ASN H H 1 8.912 0.02 . 1 . . . . 116 ASN HN . 16317 1 1252 . 1 1 117 117 ASN HA H 1 4.556 0.02 . 1 . . . . 116 ASN HA . 16317 1 1253 . 1 1 117 117 ASN HB2 H 1 3.054 0.02 . 2 . . . . 116 ASN HB2 . 16317 1 1254 . 1 1 117 117 ASN HB3 H 1 3.193 0.02 . 2 . . . . 116 ASN HB3 . 16317 1 1255 . 1 1 117 117 ASN CA C 13 54.106 0.2 . 1 . . . . 116 ASN CA . 16317 1 1256 . 1 1 117 117 ASN CB C 13 37.615 0.2 . 1 . . . . 116 ASN CB . 16317 1 1257 . 1 1 117 117 ASN N N 15 113.703 0.1 . 1 . . . . 116 ASN N . 16317 1 1258 . 1 1 118 118 CYS H H 1 7.532 0.02 . 1 . . . . 117 CYS HN . 16317 1 1259 . 1 1 118 118 CYS HA H 1 5.316 0.02 . 1 . . . . 117 CYS HA . 16317 1 1260 . 1 1 118 118 CYS HB2 H 1 2.772 0.02 . 2 . . . . 117 CYS HB2 . 16317 1 1261 . 1 1 118 118 CYS HB3 H 1 3.005 0.02 . 2 . . . . 117 CYS HB3 . 16317 1 1262 . 1 1 118 118 CYS CA C 13 58.639 0.2 . 1 . . . . 117 CYS CA . 16317 1 1263 . 1 1 118 118 CYS CB C 13 30.949 0.2 . 1 . . . . 117 CYS CB . 16317 1 1264 . 1 1 118 118 CYS N N 15 115.213 0.1 . 1 . . . . 117 CYS N . 16317 1 1265 . 1 1 119 119 VAL H H 1 9.617 0.02 . 1 . . . . 118 VAL HN . 16317 1 1266 . 1 1 119 119 VAL HA H 1 5.397 0.02 . 1 . . . . 118 VAL HA . 16317 1 1267 . 1 1 119 119 VAL HB H 1 1.964 0.02 . 1 . . . . 118 VAL HB . 16317 1 1268 . 1 1 119 119 VAL HG11 H 1 0.935 0.02 . 1 . . . . 118 VAL QG1 . 16317 1 1269 . 1 1 119 119 VAL HG12 H 1 0.935 0.02 . 1 . . . . 118 VAL QG1 . 16317 1 1270 . 1 1 119 119 VAL HG13 H 1 0.935 0.02 . 1 . . . . 118 VAL QG1 . 16317 1 1271 . 1 1 119 119 VAL HG21 H 1 0.506 0.02 . 1 . . . . 118 VAL QG2 . 16317 1 1272 . 1 1 119 119 VAL HG22 H 1 0.506 0.02 . 1 . . . . 118 VAL QG2 . 16317 1 1273 . 1 1 119 119 VAL HG23 H 1 0.506 0.02 . 1 . . . . 118 VAL QG2 . 16317 1 1274 . 1 1 119 119 VAL CA C 13 58.788 0.2 . 1 . . . . 118 VAL CA . 16317 1 1275 . 1 1 119 119 VAL CB C 13 35.745 0.2 . 1 . . . . 118 VAL CB . 16317 1 1276 . 1 1 119 119 VAL CG1 C 13 21.730 0.2 . 2 . . . . 118 VAL CG1 . 16317 1 1277 . 1 1 119 119 VAL CG2 C 13 18.419 0.2 . 2 . . . . 118 VAL CG2 . 16317 1 1278 . 1 1 119 119 VAL N N 15 116.144 0.1 . 1 . . . . 118 VAL N . 16317 1 1279 . 1 1 120 120 SER H H 1 8.578 0.02 . 1 . . . . 119 SER HN . 16317 1 1280 . 1 1 120 120 SER HA H 1 5.089 0.02 . 1 . . . . 119 SER HA . 16317 1 1281 . 1 1 120 120 SER HB2 H 1 3.843 0.02 . 2 . . . . 119 SER HB2 . 16317 1 1282 . 1 1 120 120 SER HB3 H 1 4.180 0.02 . 2 . . . . 119 SER HB3 . 16317 1 1283 . 1 1 120 120 SER CA C 13 57.311 0.2 . 1 . . . . 119 SER CA . 16317 1 1284 . 1 1 120 120 SER CB C 13 67.751 0.2 . 1 . . . . 119 SER CB . 16317 1 1285 . 1 1 120 120 SER N N 15 113.930 0.1 . 1 . . . . 119 SER N . 16317 1 1286 . 1 1 121 121 PHE H H 1 10.612 0.02 . 1 . . . . 120 PHE HN . 16317 1 1287 . 1 1 121 121 PHE HA H 1 5.365 0.02 . 1 . . . . 120 PHE HA . 16317 1 1288 . 1 1 121 121 PHE HB2 H 1 2.562 0.02 . 2 . . . . 120 PHE HB2 . 16317 1 1289 . 1 1 121 121 PHE HB3 H 1 2.799 0.02 . 2 . . . . 120 PHE HB3 . 16317 1 1290 . 1 1 121 121 PHE HD1 H 1 6.877 0.02 . 3 . . . . 120 PHE QD . 16317 1 1291 . 1 1 121 121 PHE HD2 H 1 6.877 0.02 . 3 . . . . 120 PHE QD . 16317 1 1292 . 1 1 121 121 PHE HE1 H 1 6.717 0.02 . 3 . . . . 120 PHE QE . 16317 1 1293 . 1 1 121 121 PHE HE2 H 1 6.717 0.02 . 3 . . . . 120 PHE QE . 16317 1 1294 . 1 1 121 121 PHE CA C 13 55.797 0.2 . 1 . . . . 120 PHE CA . 16317 1 1295 . 1 1 121 121 PHE CB C 13 41.542 0.2 . 1 . . . . 120 PHE CB . 16317 1 1296 . 1 1 121 121 PHE CD1 C 13 131.427 0.2 . 3 . . . . 120 PHE CD . 16317 1 1297 . 1 1 121 121 PHE CD2 C 13 131.427 0.2 . 3 . . . . 120 PHE CD . 16317 1 1298 . 1 1 121 121 PHE CE1 C 13 129.978 0.2 . 3 . . . . 120 PHE CE . 16317 1 1299 . 1 1 121 121 PHE CE2 C 13 129.978 0.2 . 3 . . . . 120 PHE CE . 16317 1 1300 . 1 1 121 121 PHE N N 15 120.777 0.1 . 1 . . . . 120 PHE N . 16317 1 1301 . 1 1 122 122 GLU H H 1 9.509 0.02 . 1 . . . . 121 GLU HN . 16317 1 1302 . 1 1 122 122 GLU HA H 1 4.537 0.02 . 1 . . . . 121 GLU HA . 16317 1 1303 . 1 1 122 122 GLU HB2 H 1 1.396 0.02 . 2 . . . . 121 GLU HB2 . 16317 1 1304 . 1 1 122 122 GLU HB3 H 1 2.180 0.02 . 2 . . . . 121 GLU HB3 . 16317 1 1305 . 1 1 122 122 GLU HG2 H 1 1.267 0.02 . 2 . . . . 121 GLU HG2 . 16317 1 1306 . 1 1 122 122 GLU HG3 H 1 2.196 0.02 . 2 . . . . 121 GLU HG3 . 16317 1 1307 . 1 1 122 122 GLU CA C 13 53.200 0.2 . 1 . . . . 121 GLU CA . 16317 1 1308 . 1 1 122 122 GLU CB C 13 32.943 0.2 . 1 . . . . 121 GLU CB . 16317 1 1309 . 1 1 122 122 GLU CG C 13 34.948 0.2 . 1 . . . . 121 GLU CG . 16317 1 1310 . 1 1 122 122 GLU N N 15 126.070 0.1 . 1 . . . . 121 GLU N . 16317 1 1311 . 1 1 123 123 CYS H H 1 9.405 0.02 . 1 . . . . 122 CYS HN . 16317 1 1312 . 1 1 123 123 CYS HA H 1 4.065 0.02 . 1 . . . . 122 CYS HA . 16317 1 1313 . 1 1 123 123 CYS HB2 H 1 3.025 0.02 . 2 . . . . 122 CYS HB2 . 16317 1 1314 . 1 1 123 123 CYS HB3 H 1 3.197 0.02 . 2 . . . . 122 CYS HB3 . 16317 1 1315 . 1 1 123 123 CYS CA C 13 61.504 0.2 . 1 . . . . 122 CYS CA . 16317 1 1316 . 1 1 123 123 CYS CB C 13 27.626 0.2 . 1 . . . . 122 CYS CB . 16317 1 1317 . 1 1 123 123 CYS N N 15 127.122 0.1 . 1 . . . . 122 CYS N . 16317 1 1318 . 1 1 124 124 LYS H H 1 7.533 0.02 . 1 . . . . 123 LYS HN . 16317 1 1319 . 1 1 124 124 LYS HA H 1 3.831 0.02 . 1 . . . . 123 LYS HA . 16317 1 1320 . 1 1 124 124 LYS HB2 H 1 1.594 0.02 . 2 . . . . 123 LYS HB2 . 16317 1 1321 . 1 1 124 124 LYS HB3 H 1 1.707 0.02 . 2 . . . . 123 LYS HB3 . 16317 1 1322 . 1 1 124 124 LYS HD2 H 1 1.342 0.02 . 2 . . . . 123 LYS HD2 . 16317 1 1323 . 1 1 124 124 LYS HD3 H 1 1.518 0.02 . 2 . . . . 123 LYS HD3 . 16317 1 1324 . 1 1 124 124 LYS HE2 H 1 2.689 0.02 . 2 . . . . 123 LYS HE2 . 16317 1 1325 . 1 1 124 124 LYS HG2 H 1 1.229 0.02 . 2 . . . . 123 LYS HG2 . 16317 1 1326 . 1 1 124 124 LYS CA C 13 59.245 0.2 . 1 . . . . 123 LYS CA . 16317 1 1327 . 1 1 124 124 LYS CB C 13 32.946 0.2 . 1 . . . . 123 LYS CB . 16317 1 1328 . 1 1 124 124 LYS CD C 13 29.197 0.2 . 1 . . . . 123 LYS CD . 16317 1 1329 . 1 1 124 124 LYS CE C 13 41.842 0.2 . 1 . . . . 123 LYS CE . 16317 1 1330 . 1 1 124 124 LYS CG C 13 24.946 0.2 . 1 . . . . 123 LYS CG . 16317 1 1331 . 1 1 124 124 LYS N N 15 125.643 0.1 . 1 . . . . 123 LYS N . 16317 1 1332 . 1 1 125 125 THR H H 1 8.020 0.02 . 1 . . . . 124 THR HN . 16317 1 1333 . 1 1 125 125 THR HA H 1 4.216 0.02 . 1 . . . . 124 THR HA . 16317 1 1334 . 1 1 125 125 THR HB H 1 4.441 0.02 . 1 . . . . 124 THR HB . 16317 1 1335 . 1 1 125 125 THR HG21 H 1 1.071 0.02 . 1 . . . . 124 THR QG2 . 16317 1 1336 . 1 1 125 125 THR HG22 H 1 1.071 0.02 . 1 . . . . 124 THR QG2 . 16317 1 1337 . 1 1 125 125 THR HG23 H 1 1.071 0.02 . 1 . . . . 124 THR QG2 . 16317 1 1338 . 1 1 125 125 THR CA C 13 61.424 0.2 . 1 . . . . 124 THR CA . 16317 1 1339 . 1 1 125 125 THR CB C 13 68.505 0.2 . 1 . . . . 124 THR CB . 16317 1 1340 . 1 1 125 125 THR CG2 C 13 22.169 0.2 . 1 . . . . 124 THR CG2 . 16317 1 1341 . 1 1 125 125 THR N N 15 102.851 0.1 . 1 . . . . 124 THR N . 16317 1 1342 . 1 1 126 126 ASP H H 1 6.456 0.02 . 1 . . . . 125 ASP HN . 16317 1 1343 . 1 1 126 126 ASP HA H 1 5.125 0.02 . 1 . . . . 125 ASP HA . 16317 1 1344 . 1 1 126 126 ASP HB2 H 1 2.115 0.02 . 2 . . . . 125 ASP HB2 . 16317 1 1345 . 1 1 126 126 ASP HB3 H 1 2.693 0.02 . 2 . . . . 125 ASP HB3 . 16317 1 1346 . 1 1 126 126 ASP CA C 13 51.060 0.2 . 1 . . . . 125 ASP CA . 16317 1 1347 . 1 1 126 126 ASP CB C 13 42.308 0.2 . 1 . . . . 125 ASP CB . 16317 1 1348 . 1 1 126 126 ASP N N 15 119.891 0.1 . 1 . . . . 125 ASP N . 16317 1 1349 . 1 1 127 127 PRO HA H 1 4.366 0.02 . 1 . . . . 126 PRO HA . 16317 1 1350 . 1 1 127 127 PRO HB2 H 1 1.883 0.02 . 2 . . . . 126 PRO HB2 . 16317 1 1351 . 1 1 127 127 PRO HB3 H 1 2.338 0.02 . 2 . . . . 126 PRO HB3 . 16317 1 1352 . 1 1 127 127 PRO HD2 H 1 3.428 0.02 . 2 . . . . 126 PRO HD2 . 16317 1 1353 . 1 1 127 127 PRO HD3 H 1 3.738 0.02 . 2 . . . . 126 PRO HD3 . 16317 1 1354 . 1 1 127 127 PRO HG2 H 1 1.999 0.02 . 2 . . . . 126 PRO HG2 . 16317 1 1355 . 1 1 127 127 PRO HG3 H 1 2.081 0.02 . 2 . . . . 126 PRO HG3 . 16317 1 1356 . 1 1 127 127 PRO CA C 13 63.377 0.2 . 1 . . . . 126 PRO CA . 16317 1 1357 . 1 1 127 127 PRO CB C 13 31.816 0.2 . 1 . . . . 126 PRO CB . 16317 1 1358 . 1 1 127 127 PRO CD C 13 50.063 0.2 . 1 . . . . 126 PRO CD . 16317 1 1359 . 1 1 127 127 PRO CG C 13 27.060 0.2 . 1 . . . . 126 PRO CG . 16317 1 1360 . 1 1 128 128 GLY H H 1 10.553 0.02 . 1 . . . . 127 GLY HN . 16317 1 1361 . 1 1 128 128 GLY HA2 H 1 3.775 0.02 . 2 . . . . 127 GLY HA1 . 16317 1 1362 . 1 1 128 128 GLY HA3 H 1 4.318 0.02 . 2 . . . . 127 GLY HA2 . 16317 1 1363 . 1 1 128 128 GLY CA C 13 44.954 0.2 . 1 . . . . 127 GLY CA . 16317 1 1364 . 1 1 128 128 GLY N N 15 113.361 0.1 . 1 . . . . 127 GLY N . 16317 1 1365 . 1 1 129 129 VAL H H 1 7.846 0.02 . 1 . . . . 128 VAL HN . 16317 1 1366 . 1 1 129 129 VAL HA H 1 4.794 0.02 . 1 . . . . 128 VAL HA . 16317 1 1367 . 1 1 129 129 VAL HB H 1 2.354 0.02 . 1 . . . . 128 VAL HB . 16317 1 1368 . 1 1 129 129 VAL HG11 H 1 0.821 0.02 . 1 . . . . 128 VAL QG1 . 16317 1 1369 . 1 1 129 129 VAL HG12 H 1 0.821 0.02 . 1 . . . . 128 VAL QG1 . 16317 1 1370 . 1 1 129 129 VAL HG13 H 1 0.821 0.02 . 1 . . . . 128 VAL QG1 . 16317 1 1371 . 1 1 129 129 VAL HG21 H 1 0.962 0.02 . 1 . . . . 128 VAL QG2 . 16317 1 1372 . 1 1 129 129 VAL HG22 H 1 0.962 0.02 . 1 . . . . 128 VAL QG2 . 16317 1 1373 . 1 1 129 129 VAL HG23 H 1 0.962 0.02 . 1 . . . . 128 VAL QG2 . 16317 1 1374 . 1 1 129 129 VAL CA C 13 61.754 0.2 . 1 . . . . 128 VAL CA . 16317 1 1375 . 1 1 129 129 VAL CB C 13 31.449 0.2 . 1 . . . . 128 VAL CB . 16317 1 1376 . 1 1 129 129 VAL CG1 C 13 21.439 0.2 . 2 . . . . 128 VAL CG1 . 16317 1 1377 . 1 1 129 129 VAL CG2 C 13 24.189 0.2 . 2 . . . . 128 VAL CG2 . 16317 1 1378 . 1 1 129 129 VAL N N 15 121.005 0.1 . 1 . . . . 128 VAL N . 16317 1 1379 . 1 1 130 130 PHE H H 1 9.293 0.02 . 1 . . . . 129 PHE HN . 16317 1 1380 . 1 1 130 130 PHE HA H 1 5.819 0.02 . 1 . . . . 129 PHE HA . 16317 1 1381 . 1 1 130 130 PHE HB2 H 1 2.818 0.02 . 2 . . . . 129 PHE HB2 . 16317 1 1382 . 1 1 130 130 PHE HB3 H 1 3.493 0.02 . 2 . . . . 129 PHE HB3 . 16317 1 1383 . 1 1 130 130 PHE HD1 H 1 7.336 0.02 . 3 . . . . 129 PHE QD . 16317 1 1384 . 1 1 130 130 PHE HD2 H 1 7.336 0.02 . 3 . . . . 129 PHE QD . 16317 1 1385 . 1 1 130 130 PHE HE1 H 1 6.999 0.02 . 3 . . . . 129 PHE QE . 16317 1 1386 . 1 1 130 130 PHE HE2 H 1 6.999 0.02 . 3 . . . . 129 PHE QE . 16317 1 1387 . 1 1 130 130 PHE HZ H 1 6.823 0.02 . 1 . . . . 129 PHE HZ . 16317 1 1388 . 1 1 130 130 PHE CA C 13 55.600 0.2 . 1 . . . . 129 PHE CA . 16317 1 1389 . 1 1 130 130 PHE CB C 13 42.773 0.2 . 1 . . . . 129 PHE CB . 16317 1 1390 . 1 1 130 130 PHE CD1 C 13 132.625 0.2 . 3 . . . . 129 PHE CD . 16317 1 1391 . 1 1 130 130 PHE CD2 C 13 132.625 0.2 . 3 . . . . 129 PHE CD . 16317 1 1392 . 1 1 130 130 PHE CE1 C 13 130.702 0.2 . 3 . . . . 129 PHE CE . 16317 1 1393 . 1 1 130 130 PHE CE2 C 13 130.702 0.2 . 3 . . . . 129 PHE CE . 16317 1 1394 . 1 1 130 130 PHE CZ C 13 129.254 0.2 . 1 . . . . 129 PHE CZ . 16317 1 1395 . 1 1 130 130 PHE N N 15 126.384 0.1 . 1 . . . . 129 PHE N . 16317 1 1396 . 1 1 131 131 ILE H H 1 8.555 0.02 . 1 . . . . 130 ILE HN . 16317 1 1397 . 1 1 131 131 ILE HA H 1 4.375 0.02 . 1 . . . . 130 ILE HA . 16317 1 1398 . 1 1 131 131 ILE HB H 1 1.832 0.02 . 1 . . . . 130 ILE HB . 16317 1 1399 . 1 1 131 131 ILE HD11 H 1 -0.471 0.02 . 1 . . . . 130 ILE QD1 . 16317 1 1400 . 1 1 131 131 ILE HD12 H 1 -0.471 0.02 . 1 . . . . 130 ILE QD1 . 16317 1 1401 . 1 1 131 131 ILE HD13 H 1 -0.471 0.02 . 1 . . . . 130 ILE QD1 . 16317 1 1402 . 1 1 131 131 ILE HG12 H 1 0.568 0.02 . 2 . . . . 130 ILE HG12 . 16317 1 1403 . 1 1 131 131 ILE HG13 H 1 1.513 0.02 . 2 . . . . 130 ILE HG13 . 16317 1 1404 . 1 1 131 131 ILE HG21 H 1 0.818 0.02 . 1 . . . . 130 ILE QG2 . 16317 1 1405 . 1 1 131 131 ILE HG22 H 1 0.818 0.02 . 1 . . . . 130 ILE QG2 . 16317 1 1406 . 1 1 131 131 ILE HG23 H 1 0.818 0.02 . 1 . . . . 130 ILE QG2 . 16317 1 1407 . 1 1 131 131 ILE CA C 13 63.278 0.2 . 1 . . . . 130 ILE CA . 16317 1 1408 . 1 1 131 131 ILE CB C 13 37.850 0.2 . 1 . . . . 130 ILE CB . 16317 1 1409 . 1 1 131 131 ILE CD1 C 13 10.418 0.2 . 1 . . . . 130 ILE CD1 . 16317 1 1410 . 1 1 131 131 ILE CG1 C 13 27.792 0.2 . 1 . . . . 130 ILE CG1 . 16317 1 1411 . 1 1 131 131 ILE CG2 C 13 17.811 0.2 . 1 . . . . 130 ILE CG2 . 16317 1 1412 . 1 1 131 131 ILE N N 15 118.433 0.1 . 1 . . . . 130 ILE N . 16317 1 1413 . 1 1 132 132 GLY H H 1 9.225 0.02 . 1 . . . . 131 GLY HN . 16317 1 1414 . 1 1 132 132 GLY HA2 H 1 3.693 0.02 . 2 . . . . 131 GLY HA1 . 16317 1 1415 . 1 1 132 132 GLY HA3 H 1 5.248 0.02 . 2 . . . . 131 GLY HA2 . 16317 1 1416 . 1 1 132 132 GLY CA C 13 45.218 0.2 . 1 . . . . 131 GLY CA . 16317 1 1417 . 1 1 132 132 GLY N N 15 113.442 0.1 . 1 . . . . 131 GLY N . 16317 1 1418 . 1 1 133 133 VAL H H 1 8.177 0.02 . 1 . . . . 132 VAL HN . 16317 1 1419 . 1 1 133 133 VAL HA H 1 4.710 0.02 . 1 . . . . 132 VAL HA . 16317 1 1420 . 1 1 133 133 VAL HB H 1 1.988 0.02 . 1 . . . . 132 VAL HB . 16317 1 1421 . 1 1 133 133 VAL HG11 H 1 0.961 0.02 . 1 . . . . 132 VAL QG1 . 16317 1 1422 . 1 1 133 133 VAL HG12 H 1 0.961 0.02 . 1 . . . . 132 VAL QG1 . 16317 1 1423 . 1 1 133 133 VAL HG13 H 1 0.961 0.02 . 1 . . . . 132 VAL QG1 . 16317 1 1424 . 1 1 133 133 VAL HG21 H 1 0.983 0.02 . 1 . . . . 132 VAL QG2 . 16317 1 1425 . 1 1 133 133 VAL HG22 H 1 0.983 0.02 . 1 . . . . 132 VAL QG2 . 16317 1 1426 . 1 1 133 133 VAL HG23 H 1 0.983 0.02 . 1 . . . . 132 VAL QG2 . 16317 1 1427 . 1 1 133 133 VAL CA C 13 61.537 0.2 . 1 . . . . 132 VAL CA . 16317 1 1428 . 1 1 133 133 VAL CB C 13 33.281 0.2 . 1 . . . . 132 VAL CB . 16317 1 1429 . 1 1 133 133 VAL CG1 C 13 21.533 0.2 . 2 . . . . 132 VAL CG1 . 16317 1 1430 . 1 1 133 133 VAL CG2 C 13 21.851 0.2 . 2 . . . . 132 VAL CG2 . 16317 1 1431 . 1 1 133 133 VAL N N 15 118.438 0.1 . 1 . . . . 132 VAL N . 16317 1 1432 . 1 1 134 134 LYS H H 1 8.752 0.02 . 1 . . . . 133 LYS HN . 16317 1 1433 . 1 1 134 134 LYS HA H 1 4.472 0.02 . 1 . . . . 133 LYS HA . 16317 1 1434 . 1 1 134 134 LYS HB2 H 1 1.491 0.02 . 2 . . . . 133 LYS HB2 . 16317 1 1435 . 1 1 134 134 LYS HB3 H 1 1.638 0.02 . 2 . . . . 133 LYS HB3 . 16317 1 1436 . 1 1 134 134 LYS HD2 H 1 1.706 0.02 . 2 . . . . 133 LYS HD2 . 16317 1 1437 . 1 1 134 134 LYS HE2 H 1 3.024 0.02 . 2 . . . . 133 LYS HE2 . 16317 1 1438 . 1 1 134 134 LYS HG2 H 1 1.316 0.02 . 2 . . . . 133 LYS HG2 . 16317 1 1439 . 1 1 134 134 LYS HG3 H 1 1.387 0.02 . 2 . . . . 133 LYS HG3 . 16317 1 1440 . 1 1 134 134 LYS CA C 13 55.257 0.2 . 1 . . . . 133 LYS CA . 16317 1 1441 . 1 1 134 134 LYS CB C 13 35.500 0.2 . 1 . . . . 133 LYS CB . 16317 1 1442 . 1 1 134 134 LYS CD C 13 28.748 0.2 . 1 . . . . 133 LYS CD . 16317 1 1443 . 1 1 134 134 LYS CE C 13 42.000 0.2 . 1 . . . . 133 LYS CE . 16317 1 1444 . 1 1 134 134 LYS CG C 13 24.498 0.2 . 1 . . . . 133 LYS CG . 16317 1 1445 . 1 1 134 134 LYS N N 15 127.706 0.1 . 1 . . . . 133 LYS N . 16317 1 1446 . 1 1 135 135 ASP H H 1 9.321 0.02 . 1 . . . . 134 ASP HN . 16317 1 1447 . 1 1 135 135 ASP HA H 1 4.230 0.02 . 1 . . . . 134 ASP HA . 16317 1 1448 . 1 1 135 135 ASP HB2 H 1 2.839 0.02 . 2 . . . . 134 ASP HB2 . 16317 1 1449 . 1 1 135 135 ASP HB3 H 1 2.933 0.02 . 2 . . . . 134 ASP HB3 . 16317 1 1450 . 1 1 135 135 ASP CA C 13 55.965 0.2 . 1 . . . . 134 ASP CA . 16317 1 1451 . 1 1 135 135 ASP CB C 13 39.212 0.2 . 1 . . . . 134 ASP CB . 16317 1 1452 . 1 1 135 135 ASP N N 15 126.815 0.1 . 1 . . . . 134 ASP N . 16317 1 1453 . 1 1 136 136 ASN H H 1 8.603 0.02 . 1 . . . . 135 ASN HN . 16317 1 1454 . 1 1 136 136 ASN HA H 1 4.380 0.02 . 1 . . . . 135 ASN HA . 16317 1 1455 . 1 1 136 136 ASN HB2 H 1 3.047 0.02 . 2 . . . . 135 ASN HB2 . 16317 1 1456 . 1 1 136 136 ASN HB3 H 1 3.089 0.02 . 2 . . . . 135 ASN HB3 . 16317 1 1457 . 1 1 136 136 ASN CA C 13 54.117 0.2 . 1 . . . . 135 ASN CA . 16317 1 1458 . 1 1 136 136 ASN CB C 13 37.384 0.2 . 1 . . . . 135 ASN CB . 16317 1 1459 . 1 1 136 136 ASN N N 15 113.023 0.1 . 1 . . . . 135 ASN N . 16317 1 1460 . 1 1 137 137 HIS H H 1 8.112 0.02 . 1 . . . . 136 HIS HN . 16317 1 1461 . 1 1 137 137 HIS HA H 1 5.116 0.02 . 1 . . . . 136 HIS HA . 16317 1 1462 . 1 1 137 137 HIS HB2 H 1 3.352 0.02 . 2 . . . . 136 HIS HB2 . 16317 1 1463 . 1 1 137 137 HIS HB3 H 1 3.590 0.02 . 2 . . . . 136 HIS HB3 . 16317 1 1464 . 1 1 137 137 HIS HD2 H 1 7.533 0.02 . 1 . . . . 136 HIS HD2 . 16317 1 1465 . 1 1 137 137 HIS CA C 13 54.190 0.2 . 1 . . . . 136 HIS CA . 16317 1 1466 . 1 1 137 137 HIS CB C 13 31.681 0.2 . 1 . . . . 136 HIS CB . 16317 1 1467 . 1 1 137 137 HIS N N 15 115.753 0.1 . 1 . . . . 136 HIS N . 16317 1 1468 . 1 1 138 138 LEU H H 1 8.553 0.02 . 1 . . . . 137 LEU HN . 16317 1 1469 . 1 1 138 138 LEU HA H 1 5.251 0.02 . 1 . . . . 137 LEU HA . 16317 1 1470 . 1 1 138 138 LEU HB2 H 1 1.427 0.02 . 2 . . . . 137 LEU HB2 . 16317 1 1471 . 1 1 138 138 LEU HB3 H 1 1.650 0.02 . 2 . . . . 137 LEU HB3 . 16317 1 1472 . 1 1 138 138 LEU HD11 H 1 0.700 0.02 . 1 . . . . 137 LEU QD1 . 16317 1 1473 . 1 1 138 138 LEU HD12 H 1 0.700 0.02 . 1 . . . . 137 LEU QD1 . 16317 1 1474 . 1 1 138 138 LEU HD13 H 1 0.700 0.02 . 1 . . . . 137 LEU QD1 . 16317 1 1475 . 1 1 138 138 LEU HD21 H 1 0.764 0.02 . 1 . . . . 137 LEU QD2 . 16317 1 1476 . 1 1 138 138 LEU HD22 H 1 0.764 0.02 . 1 . . . . 137 LEU QD2 . 16317 1 1477 . 1 1 138 138 LEU HD23 H 1 0.764 0.02 . 1 . . . . 137 LEU QD2 . 16317 1 1478 . 1 1 138 138 LEU HG H 1 1.605 0.02 . 1 . . . . 137 LEU HG . 16317 1 1479 . 1 1 138 138 LEU CA C 13 54.147 0.2 . 1 . . . . 137 LEU CA . 16317 1 1480 . 1 1 138 138 LEU CB C 13 42.849 0.2 . 1 . . . . 137 LEU CB . 16317 1 1481 . 1 1 138 138 LEU CD1 C 13 25.075 0.2 . 2 . . . . 137 LEU CD1 . 16317 1 1482 . 1 1 138 138 LEU CD2 C 13 23.348 0.2 . 2 . . . . 137 LEU CD2 . 16317 1 1483 . 1 1 138 138 LEU CG C 13 26.874 0.2 . 1 . . . . 137 LEU CG . 16317 1 1484 . 1 1 138 138 LEU N N 15 118.446 0.1 . 1 . . . . 137 LEU N . 16317 1 1485 . 1 1 139 139 ALA H H 1 9.357 0.02 . 1 . . . . 138 ALA HN . 16317 1 1486 . 1 1 139 139 ALA HA H 1 4.760 0.02 . 1 . . . . 138 ALA HA . 16317 1 1487 . 1 1 139 139 ALA HB1 H 1 1.534 0.02 . 1 . . . . 138 ALA QB . 16317 1 1488 . 1 1 139 139 ALA HB2 H 1 1.534 0.02 . 1 . . . . 138 ALA QB . 16317 1 1489 . 1 1 139 139 ALA HB3 H 1 1.534 0.02 . 1 . . . . 138 ALA QB . 16317 1 1490 . 1 1 139 139 ALA CA C 13 51.091 0.2 . 1 . . . . 138 ALA CA . 16317 1 1491 . 1 1 139 139 ALA CB C 13 22.924 0.2 . 1 . . . . 138 ALA CB . 16317 1 1492 . 1 1 139 139 ALA N N 15 126.689 0.1 . 1 . . . . 138 ALA N . 16317 1 1493 . 1 1 140 140 LEU H H 1 7.287 0.02 . 1 . . . . 139 LEU HN . 16317 1 1494 . 1 1 140 140 LEU HA H 1 5.278 0.02 . 1 . . . . 139 LEU HA . 16317 1 1495 . 1 1 140 140 LEU HB2 H 1 1.236 0.02 . 2 . . . . 139 LEU HB2 . 16317 1 1496 . 1 1 140 140 LEU HB3 H 1 1.324 0.02 . 2 . . . . 139 LEU HB3 . 16317 1 1497 . 1 1 140 140 LEU HD11 H 1 0.869 0.02 . 1 . . . . 139 LEU QD1 . 16317 1 1498 . 1 1 140 140 LEU HD12 H 1 0.869 0.02 . 1 . . . . 139 LEU QD1 . 16317 1 1499 . 1 1 140 140 LEU HD13 H 1 0.869 0.02 . 1 . . . . 139 LEU QD1 . 16317 1 1500 . 1 1 140 140 LEU HD21 H 1 0.697 0.02 . 1 . . . . 139 LEU QD2 . 16317 1 1501 . 1 1 140 140 LEU HD22 H 1 0.697 0.02 . 1 . . . . 139 LEU QD2 . 16317 1 1502 . 1 1 140 140 LEU HD23 H 1 0.697 0.02 . 1 . . . . 139 LEU QD2 . 16317 1 1503 . 1 1 140 140 LEU HG H 1 1.359 0.02 . 1 . . . . 139 LEU HG . 16317 1 1504 . 1 1 140 140 LEU CA C 13 53.026 0.2 . 1 . . . . 139 LEU CA . 16317 1 1505 . 1 1 140 140 LEU CB C 13 42.025 0.2 . 1 . . . . 139 LEU CB . 16317 1 1506 . 1 1 140 140 LEU CD1 C 13 26.263 0.2 . 2 . . . . 139 LEU CD1 . 16317 1 1507 . 1 1 140 140 LEU CD2 C 13 23.245 0.2 . 2 . . . . 139 LEU CD2 . 16317 1 1508 . 1 1 140 140 LEU CG C 13 26.023 0.2 . 1 . . . . 139 LEU CG . 16317 1 1509 . 1 1 140 140 LEU N N 15 116.219 0.1 . 1 . . . . 139 LEU N . 16317 1 1510 . 1 1 141 141 ILE H H 1 9.676 0.02 . 1 . . . . 140 ILE HN . 16317 1 1511 . 1 1 141 141 ILE HA H 1 4.321 0.02 . 1 . . . . 140 ILE HA . 16317 1 1512 . 1 1 141 141 ILE HB H 1 1.748 0.02 . 1 . . . . 140 ILE HB . 16317 1 1513 . 1 1 141 141 ILE HD11 H 1 0.711 0.02 . 1 . . . . 140 ILE QD1 . 16317 1 1514 . 1 1 141 141 ILE HD12 H 1 0.711 0.02 . 1 . . . . 140 ILE QD1 . 16317 1 1515 . 1 1 141 141 ILE HD13 H 1 0.711 0.02 . 1 . . . . 140 ILE QD1 . 16317 1 1516 . 1 1 141 141 ILE HG12 H 1 1.149 0.02 . 2 . . . . 140 ILE HG12 . 16317 1 1517 . 1 1 141 141 ILE HG13 H 1 1.316 0.02 . 2 . . . . 140 ILE HG13 . 16317 1 1518 . 1 1 141 141 ILE HG21 H 1 0.819 0.02 . 1 . . . . 140 ILE QG2 . 16317 1 1519 . 1 1 141 141 ILE HG22 H 1 0.819 0.02 . 1 . . . . 140 ILE QG2 . 16317 1 1520 . 1 1 141 141 ILE HG23 H 1 0.819 0.02 . 1 . . . . 140 ILE QG2 . 16317 1 1521 . 1 1 141 141 ILE CA C 13 59.331 0.2 . 1 . . . . 140 ILE CA . 16317 1 1522 . 1 1 141 141 ILE CB C 13 40.745 0.2 . 1 . . . . 140 ILE CB . 16317 1 1523 . 1 1 141 141 ILE CD1 C 13 12.189 0.2 . 1 . . . . 140 ILE CD1 . 16317 1 1524 . 1 1 141 141 ILE CG1 C 13 26.743 0.2 . 1 . . . . 140 ILE CG1 . 16317 1 1525 . 1 1 141 141 ILE CG2 C 13 16.742 0.2 . 1 . . . . 140 ILE CG2 . 16317 1 1526 . 1 1 141 141 ILE N N 15 124.052 0.1 . 1 . . . . 140 ILE N . 16317 1 1527 . 1 1 142 142 LYS H H 1 8.665 0.02 . 1 . . . . 141 LYS HN . 16317 1 1528 . 1 1 142 142 LYS HA H 1 5.053 0.02 . 1 . . . . 141 LYS HA . 16317 1 1529 . 1 1 142 142 LYS HB2 H 1 1.725 0.02 . 2 . . . . 141 LYS HB2 . 16317 1 1530 . 1 1 142 142 LYS HB3 H 1 1.969 0.02 . 2 . . . . 141 LYS HB3 . 16317 1 1531 . 1 1 142 142 LYS HD2 H 1 1.731 0.02 . 2 . . . . 141 LYS HD2 . 16317 1 1532 . 1 1 142 142 LYS HE2 H 1 3.036 0.02 . 2 . . . . 141 LYS HE2 . 16317 1 1533 . 1 1 142 142 LYS HG2 H 1 1.403 0.02 . 2 . . . . 141 LYS HG2 . 16317 1 1534 . 1 1 142 142 LYS CA C 13 55.586 0.2 . 1 . . . . 141 LYS CA . 16317 1 1535 . 1 1 142 142 LYS CB C 13 32.709 0.2 . 1 . . . . 141 LYS CB . 16317 1 1536 . 1 1 142 142 LYS CD C 13 28.981 0.2 . 1 . . . . 141 LYS CD . 16317 1 1537 . 1 1 142 142 LYS CE C 13 41.733 0.2 . 1 . . . . 141 LYS CE . 16317 1 1538 . 1 1 142 142 LYS CG C 13 24.730 0.2 . 1 . . . . 141 LYS CG . 16317 1 1539 . 1 1 142 142 LYS N N 15 128.856 0.1 . 1 . . . . 141 LYS N . 16317 1 1540 . 1 1 143 143 VAL H H 1 8.757 0.02 . 1 . . . . 142 VAL HN . 16317 1 1541 . 1 1 143 143 VAL HA H 1 4.223 0.02 . 1 . . . . 142 VAL HA . 16317 1 1542 . 1 1 143 143 VAL HB H 1 2.116 0.02 . 1 . . . . 142 VAL HB . 16317 1 1543 . 1 1 143 143 VAL HG11 H 1 0.793 0.02 . 1 . . . . 142 VAL QG1 . 16317 1 1544 . 1 1 143 143 VAL HG12 H 1 0.793 0.02 . 1 . . . . 142 VAL QG1 . 16317 1 1545 . 1 1 143 143 VAL HG13 H 1 0.793 0.02 . 1 . . . . 142 VAL QG1 . 16317 1 1546 . 1 1 143 143 VAL HG21 H 1 0.859 0.02 . 1 . . . . 142 VAL QG2 . 16317 1 1547 . 1 1 143 143 VAL HG22 H 1 0.859 0.02 . 1 . . . . 142 VAL QG2 . 16317 1 1548 . 1 1 143 143 VAL HG23 H 1 0.859 0.02 . 1 . . . . 142 VAL QG2 . 16317 1 1549 . 1 1 143 143 VAL CA C 13 62.032 0.2 . 1 . . . . 142 VAL CA . 16317 1 1550 . 1 1 143 143 VAL CB C 13 33.008 0.2 . 1 . . . . 142 VAL CB . 16317 1 1551 . 1 1 143 143 VAL CG1 C 13 21.270 0.2 . 2 . . . . 142 VAL CG1 . 16317 1 1552 . 1 1 143 143 VAL CG2 C 13 21.252 0.2 . 2 . . . . 142 VAL CG2 . 16317 1 1553 . 1 1 143 143 VAL N N 15 127.220 0.1 . 1 . . . . 142 VAL N . 16317 1 1554 . 1 1 144 144 ASP H H 1 8.595 0.02 . 1 . . . . 143 ASP HN . 16317 1 1555 . 1 1 144 144 ASP HA H 1 4.698 0.02 . 1 . . . . 143 ASP HA . 16317 1 1556 . 1 1 144 144 ASP HB2 H 1 2.737 0.02 . 2 . . . . 143 ASP HB2 . 16317 1 1557 . 1 1 144 144 ASP CB C 13 41.517 0.2 . 1 . . . . 143 ASP CB . 16317 1 1558 . 1 1 144 144 ASP N N 15 125.250 0.1 . 1 . . . . 143 ASP N . 16317 1 1559 . 1 1 145 145 SER H H 1 8.296 0.02 . 1 . . . . 144 SER HN . 16317 1 1560 . 1 1 145 145 SER HA H 1 4.455 0.02 . 1 . . . . 144 SER HA . 16317 1 1561 . 1 1 145 145 SER HB2 H 1 3.905 0.02 . 2 . . . . 144 SER HB2 . 16317 1 1562 . 1 1 145 145 SER HB3 H 1 4.024 0.02 . 2 . . . . 144 SER HB3 . 16317 1 1563 . 1 1 145 145 SER CA C 13 58.814 0.2 . 1 . . . . 144 SER CA . 16317 1 1564 . 1 1 145 145 SER CB C 13 63.202 0.2 . 1 . . . . 144 SER CB . 16317 1 1565 . 1 1 145 145 SER N N 15 116.695 0.1 . 1 . . . . 144 SER N . 16317 1 1566 . 1 1 146 146 SER H H 1 8.512 0.02 . 1 . . . . 145 SER HN . 16317 1 1567 . 1 1 146 146 SER HA H 1 4.393 0.02 . 1 . . . . 145 SER HA . 16317 1 1568 . 1 1 146 146 SER HB2 H 1 3.896 0.02 . 2 . . . . 145 SER HB2 . 16317 1 1569 . 1 1 146 146 SER HB3 H 1 3.982 0.02 . 2 . . . . 145 SER HB3 . 16317 1 1570 . 1 1 146 146 SER CA C 13 59.286 0.2 . 1 . . . . 145 SER CA . 16317 1 1571 . 1 1 146 146 SER CB C 13 63.396 0.2 . 1 . . . . 145 SER CB . 16317 1 1572 . 1 1 146 146 SER N N 15 117.509 0.1 . 1 . . . . 145 SER N . 16317 1 1573 . 1 1 147 147 GLU H H 1 8.145 0.02 . 1 . . . . 146 GLU HN . 16317 1 1574 . 1 1 147 147 GLU HA H 1 4.351 0.02 . 1 . . . . 146 GLU HA . 16317 1 1575 . 1 1 147 147 GLU HB2 H 1 1.946 0.02 . 2 . . . . 146 GLU HB2 . 16317 1 1576 . 1 1 147 147 GLU HB3 H 1 2.095 0.02 . 2 . . . . 146 GLU HB3 . 16317 1 1577 . 1 1 147 147 GLU HG2 H 1 2.258 0.02 . 2 . . . . 146 GLU HG2 . 16317 1 1578 . 1 1 147 147 GLU CA C 13 56.389 0.2 . 1 . . . . 146 GLU CA . 16317 1 1579 . 1 1 147 147 GLU N N 15 121.023 0.1 . 1 . . . . 146 GLU N . 16317 1 1580 . 1 1 148 148 ASN H H 1 8.145 0.02 . 1 . . . . 147 ASN HN . 16317 1 1581 . 1 1 148 148 ASN HA H 1 4.584 0.02 . 1 . . . . 147 ASN HA . 16317 1 1582 . 1 1 148 148 ASN HB2 H 1 2.735 0.02 . 2 . . . . 147 ASN HB2 . 16317 1 1583 . 1 1 148 148 ASN HB3 H 1 2.846 0.02 . 2 . . . . 147 ASN HB3 . 16317 1 1584 . 1 1 148 148 ASN CA C 13 53.643 0.2 . 1 . . . . 147 ASN CA . 16317 1 1585 . 1 1 148 148 ASN CB C 13 38.423 0.2 . 1 . . . . 147 ASN CB . 16317 1 1586 . 1 1 148 148 ASN N N 15 118.043 0.1 . 1 . . . . 147 ASN N . 16317 1 1587 . 1 1 149 149 LEU H H 1 7.953 0.02 . 1 . . . . 148 LEU HN . 16317 1 1588 . 1 1 149 149 LEU HA H 1 4.294 0.02 . 1 . . . . 148 LEU HA . 16317 1 1589 . 1 1 149 149 LEU HB2 H 1 1.581 0.02 . 2 . . . . 148 LEU HB2 . 16317 1 1590 . 1 1 149 149 LEU HB3 H 1 1.631 0.02 . 2 . . . . 148 LEU HB3 . 16317 1 1591 . 1 1 149 149 LEU HD11 H 1 0.827 0.02 . 2 . . . . 148 LEU QD1 . 16317 1 1592 . 1 1 149 149 LEU HD12 H 1 0.827 0.02 . 2 . . . . 148 LEU QD1 . 16317 1 1593 . 1 1 149 149 LEU HD13 H 1 0.827 0.02 . 2 . . . . 148 LEU QD1 . 16317 1 1594 . 1 1 149 149 LEU HD21 H 1 0.894 0.02 . 2 . . . . 148 LEU QD2 . 16317 1 1595 . 1 1 149 149 LEU HD22 H 1 0.894 0.02 . 2 . . . . 148 LEU QD2 . 16317 1 1596 . 1 1 149 149 LEU HD23 H 1 0.894 0.02 . 2 . . . . 148 LEU QD2 . 16317 1 1597 . 1 1 149 149 LEU HG H 1 1.565 0.02 . 1 . . . . 148 LEU HG . 16317 1 1598 . 1 1 149 149 LEU CA C 13 55.249 0.2 . 1 . . . . 148 LEU CA . 16317 1 1599 . 1 1 149 149 LEU CB C 13 42.000 0.2 . 1 . . . . 148 LEU CB . 16317 1 1600 . 1 1 149 149 LEU CD1 C 13 23.496 0.2 . 2 . . . . 148 LEU CD1 . 16317 1 1601 . 1 1 149 149 LEU CD2 C 13 24.496 0.2 . 2 . . . . 148 LEU CD2 . 16317 1 1602 . 1 1 149 149 LEU CG C 13 26.746 0.2 . 1 . . . . 148 LEU CG . 16317 1 1603 . 1 1 149 149 LEU N N 15 120.366 0.1 . 1 . . . . 148 LEU N . 16317 1 1604 . 1 1 150 150 CYS H H 1 8.141 0.02 . 1 . . . . 149 CYS HN . 16317 1 1605 . 1 1 150 150 CYS HA H 1 4.517 0.02 . 1 . . . . 149 CYS HA . 16317 1 1606 . 1 1 150 150 CYS HB2 H 1 2.864 0.02 . 2 . . . . 149 CYS HB2 . 16317 1 1607 . 1 1 150 150 CYS HB3 H 1 2.903 0.02 . 2 . . . . 149 CYS HB3 . 16317 1 1608 . 1 1 150 150 CYS CA C 13 57.817 0.2 . 1 . . . . 149 CYS CA . 16317 1 1609 . 1 1 150 150 CYS CB C 13 27.529 0.2 . 1 . . . . 149 CYS CB . 16317 1 1610 . 1 1 150 150 CYS N N 15 118.879 0.1 . 1 . . . . 149 CYS N . 16317 1 1611 . 1 1 151 151 THR H H 1 7.892 0.02 . 1 . . . . 150 THR HN . 16317 1 1612 . 1 1 151 151 THR HA H 1 4.191 0.02 . 1 . . . . 150 THR HA . 16317 1 1613 . 1 1 151 151 THR HB H 1 4.149 0.02 . 1 . . . . 150 THR HB . 16317 1 1614 . 1 1 151 151 THR HG21 H 1 1.149 0.02 . 1 . . . . 150 THR QG2 . 16317 1 1615 . 1 1 151 151 THR HG22 H 1 1.149 0.02 . 1 . . . . 150 THR QG2 . 16317 1 1616 . 1 1 151 151 THR HG23 H 1 1.149 0.02 . 1 . . . . 150 THR QG2 . 16317 1 1617 . 1 1 151 151 THR CA C 13 61.680 0.2 . 1 . . . . 150 THR CA . 16317 1 1618 . 1 1 151 151 THR CB C 13 68.930 0.2 . 1 . . . . 150 THR CB . 16317 1 1619 . 1 1 151 151 THR CG2 C 13 21.372 0.2 . 1 . . . . 150 THR CG2 . 16317 1 1620 . 1 1 151 151 THR N N 15 117.354 0.1 . 1 . . . . 150 THR N . 16317 1 1621 . 1 1 152 152 GLU H H 1 8.547 0.02 . 1 . . . . 151 GLU HN . 16317 1 1622 . 1 1 152 152 GLU HA H 1 3.600 0.02 . 1 . . . . 151 GLU HA . 16317 1 1623 . 1 1 152 152 GLU HB2 H 1 1.684 0.02 . 2 . . . . 151 GLU HB2 . 16317 1 1624 . 1 1 152 152 GLU HB3 H 1 1.731 0.02 . 2 . . . . 151 GLU HB3 . 16317 1 1625 . 1 1 152 152 GLU HG2 H 1 1.894 0.02 . 2 . . . . 151 GLU HG2 . 16317 1 1626 . 1 1 152 152 GLU HG3 H 1 2.003 0.02 . 2 . . . . 151 GLU HG3 . 16317 1 1627 . 1 1 152 152 GLU CA C 13 59.126 0.2 . 1 . . . . 151 GLU CA . 16317 1 1628 . 1 1 152 152 GLU CB C 13 28.575 0.2 . 1 . . . . 151 GLU CB . 16317 1 1629 . 1 1 152 152 GLU CG C 13 36.549 0.2 . 1 . . . . 151 GLU CG . 16317 1 1630 . 1 1 152 152 GLU N N 15 122.526 0.1 . 1 . . . . 151 GLU N . 16317 1 1631 . 1 1 153 153 ASN H H 1 8.140 0.02 . 1 . . . . 152 ASN HN . 16317 1 1632 . 1 1 153 153 ASN HA H 1 4.525 0.02 . 1 . . . . 152 ASN HA . 16317 1 1633 . 1 1 153 153 ASN HB2 H 1 3.001 0.02 . 2 . . . . 152 ASN HB2 . 16317 1 1634 . 1 1 153 153 ASN HB3 H 1 3.084 0.02 . 2 . . . . 152 ASN HB3 . 16317 1 1635 . 1 1 153 153 ASN CA C 13 54.838 0.2 . 1 . . . . 152 ASN CA . 16317 1 1636 . 1 1 153 153 ASN CB C 13 37.230 0.2 . 1 . . . . 152 ASN CB . 16317 1 1637 . 1 1 153 153 ASN N N 15 113.916 0.1 . 1 . . . . 152 ASN N . 16317 1 1638 . 1 1 154 154 ILE H H 1 6.885 0.02 . 1 . . . . 153 ILE HN . 16317 1 1639 . 1 1 154 154 ILE HA H 1 5.150 0.02 . 1 . . . . 153 ILE HA . 16317 1 1640 . 1 1 154 154 ILE HB H 1 2.441 0.02 . 1 . . . . 153 ILE HB . 16317 1 1641 . 1 1 154 154 ILE HD11 H 1 0.161 0.02 . 1 . . . . 153 ILE QD1 . 16317 1 1642 . 1 1 154 154 ILE HD12 H 1 0.161 0.02 . 1 . . . . 153 ILE QD1 . 16317 1 1643 . 1 1 154 154 ILE HD13 H 1 0.161 0.02 . 1 . . . . 153 ILE QD1 . 16317 1 1644 . 1 1 154 154 ILE HG12 H 1 1.010 0.02 . 2 . . . . 153 ILE HG12 . 16317 1 1645 . 1 1 154 154 ILE HG13 H 1 1.064 0.02 . 2 . . . . 153 ILE HG13 . 16317 1 1646 . 1 1 154 154 ILE HG21 H 1 0.742 0.02 . 1 . . . . 153 ILE QG2 . 16317 1 1647 . 1 1 154 154 ILE HG22 H 1 0.742 0.02 . 1 . . . . 153 ILE QG2 . 16317 1 1648 . 1 1 154 154 ILE HG23 H 1 0.742 0.02 . 1 . . . . 153 ILE QG2 . 16317 1 1649 . 1 1 154 154 ILE CA C 13 60.523 0.2 . 1 . . . . 153 ILE CA . 16317 1 1650 . 1 1 154 154 ILE CB C 13 38.399 0.2 . 1 . . . . 153 ILE CB . 16317 1 1651 . 1 1 154 154 ILE CD1 C 13 13.666 0.2 . 1 . . . . 153 ILE CD1 . 16317 1 1652 . 1 1 154 154 ILE CG1 C 13 25.400 0.2 . 1 . . . . 153 ILE CG1 . 16317 1 1653 . 1 1 154 154 ILE CG2 C 13 17.406 0.2 . 1 . . . . 153 ILE CG2 . 16317 1 1654 . 1 1 154 154 ILE N N 15 108.606 0.1 . 1 . . . . 153 ILE N . 16317 1 1655 . 1 1 155 155 LEU H H 1 7.162 0.02 . 1 . . . . 154 LEU HN . 16317 1 1656 . 1 1 155 155 LEU HA H 1 4.654 0.02 . 1 . . . . 154 LEU HA . 16317 1 1657 . 1 1 155 155 LEU HB2 H 1 1.190 0.02 . 2 . . . . 154 LEU HB2 . 16317 1 1658 . 1 1 155 155 LEU HB3 H 1 1.950 0.02 . 2 . . . . 154 LEU HB3 . 16317 1 1659 . 1 1 155 155 LEU HD11 H 1 0.472 0.02 . 1 . . . . 154 LEU QD1 . 16317 1 1660 . 1 1 155 155 LEU HD12 H 1 0.472 0.02 . 1 . . . . 154 LEU QD1 . 16317 1 1661 . 1 1 155 155 LEU HD13 H 1 0.472 0.02 . 1 . . . . 154 LEU QD1 . 16317 1 1662 . 1 1 155 155 LEU HD21 H 1 0.527 0.02 . 1 . . . . 154 LEU QD2 . 16317 1 1663 . 1 1 155 155 LEU HD22 H 1 0.527 0.02 . 1 . . . . 154 LEU QD2 . 16317 1 1664 . 1 1 155 155 LEU HD23 H 1 0.527 0.02 . 1 . . . . 154 LEU QD2 . 16317 1 1665 . 1 1 155 155 LEU HG H 1 1.552 0.02 . 1 . . . . 154 LEU HG . 16317 1 1666 . 1 1 155 155 LEU CA C 13 54.179 0.2 . 1 . . . . 154 LEU CA . 16317 1 1667 . 1 1 155 155 LEU CB C 13 43.178 0.2 . 1 . . . . 154 LEU CB . 16317 1 1668 . 1 1 155 155 LEU CD1 C 13 25.927 0.2 . 2 . . . . 154 LEU CD1 . 16317 1 1669 . 1 1 155 155 LEU CD2 C 13 23.177 0.2 . 2 . . . . 154 LEU CD2 . 16317 1 1670 . 1 1 155 155 LEU CG C 13 25.926 0.2 . 1 . . . . 154 LEU CG . 16317 1 1671 . 1 1 155 155 LEU N N 15 123.152 0.1 . 1 . . . . 154 LEU N . 16317 1 1672 . 1 1 156 156 PHE H H 1 9.292 0.02 . 1 . . . . 155 PHE HN . 16317 1 1673 . 1 1 156 156 PHE HA H 1 5.175 0.02 . 1 . . . . 155 PHE HA . 16317 1 1674 . 1 1 156 156 PHE HB2 H 1 2.739 0.02 . 2 . . . . 155 PHE HB2 . 16317 1 1675 . 1 1 156 156 PHE HB3 H 1 3.255 0.02 . 2 . . . . 155 PHE HB3 . 16317 1 1676 . 1 1 156 156 PHE HD1 H 1 7.307 0.02 . 3 . . . . 155 PHE QD . 16317 1 1677 . 1 1 156 156 PHE HD2 H 1 7.307 0.02 . 3 . . . . 155 PHE QD . 16317 1 1678 . 1 1 156 156 PHE HE1 H 1 7.248 0.02 . 3 . . . . 155 PHE QE . 16317 1 1679 . 1 1 156 156 PHE HE2 H 1 7.248 0.02 . 3 . . . . 155 PHE QE . 16317 1 1680 . 1 1 156 156 PHE HZ H 1 6.882 0.02 . 1 . . . . 155 PHE HZ . 16317 1 1681 . 1 1 156 156 PHE CA C 13 56.409 0.2 . 1 . . . . 155 PHE CA . 16317 1 1682 . 1 1 156 156 PHE CB C 13 43.001 0.2 . 1 . . . . 155 PHE CB . 16317 1 1683 . 1 1 156 156 PHE CD1 C 13 132.151 0.2 . 3 . . . . 155 PHE CD . 16317 1 1684 . 1 1 156 156 PHE CD2 C 13 132.151 0.2 . 3 . . . . 155 PHE CD . 16317 1 1685 . 1 1 156 156 PHE CE1 C 13 129.978 0.2 . 3 . . . . 155 PHE CE . 16317 1 1686 . 1 1 156 156 PHE CE2 C 13 129.978 0.2 . 3 . . . . 155 PHE CE . 16317 1 1687 . 1 1 156 156 PHE CZ C 13 128.530 0.2 . 1 . . . . 155 PHE CZ . 16317 1 1688 . 1 1 156 156 PHE N N 15 119.900 0.1 . 1 . . . . 155 PHE N . 16317 1 1689 . 1 1 157 157 LYS H H 1 9.195 0.02 . 1 . . . . 156 LYS HN . 16317 1 1690 . 1 1 157 157 LYS HA H 1 4.966 0.02 . 1 . . . . 156 LYS HA . 16317 1 1691 . 1 1 157 157 LYS HB2 H 1 1.686 0.02 . 2 . . . . 156 LYS HB2 . 16317 1 1692 . 1 1 157 157 LYS HB3 H 1 1.824 0.02 . 2 . . . . 156 LYS HB3 . 16317 1 1693 . 1 1 157 157 LYS HD2 H 1 1.660 0.02 . 2 . . . . 156 LYS HD2 . 16317 1 1694 . 1 1 157 157 LYS HD3 H 1 1.704 0.02 . 2 . . . . 156 LYS HD3 . 16317 1 1695 . 1 1 157 157 LYS HE2 H 1 2.900 0.02 . 2 . . . . 156 LYS HE2 . 16317 1 1696 . 1 1 157 157 LYS HG2 H 1 1.255 0.02 . 2 . . . . 156 LYS HG2 . 16317 1 1697 . 1 1 157 157 LYS HG3 H 1 1.540 0.02 . 2 . . . . 156 LYS HG3 . 16317 1 1698 . 1 1 157 157 LYS CA C 13 55.200 0.2 . 1 . . . . 156 LYS CA . 16317 1 1699 . 1 1 157 157 LYS CB C 13 35.002 0.2 . 1 . . . . 156 LYS CB . 16317 1 1700 . 1 1 157 157 LYS CD C 13 29.447 0.2 . 1 . . . . 156 LYS CD . 16317 1 1701 . 1 1 157 157 LYS CE C 13 41.948 0.2 . 1 . . . . 156 LYS CE . 16317 1 1702 . 1 1 157 157 LYS CG C 13 25.946 0.2 . 1 . . . . 156 LYS CG . 16317 1 1703 . 1 1 157 157 LYS N N 15 118.435 0.1 . 1 . . . . 156 LYS N . 16317 1 1704 . 1 1 158 158 LEU H H 1 8.769 0.02 . 1 . . . . 157 LEU HN . 16317 1 1705 . 1 1 158 158 LEU HA H 1 5.356 0.02 . 1 . . . . 157 LEU HA . 16317 1 1706 . 1 1 158 158 LEU HB2 H 1 1.478 0.02 . 2 . . . . 157 LEU HB2 . 16317 1 1707 . 1 1 158 158 LEU HB3 H 1 1.906 0.02 . 2 . . . . 157 LEU HB3 . 16317 1 1708 . 1 1 158 158 LEU HD11 H 1 1.070 0.02 . 1 . . . . 157 LEU QD1 . 16317 1 1709 . 1 1 158 158 LEU HD12 H 1 1.070 0.02 . 1 . . . . 157 LEU QD1 . 16317 1 1710 . 1 1 158 158 LEU HD13 H 1 1.070 0.02 . 1 . . . . 157 LEU QD1 . 16317 1 1711 . 1 1 158 158 LEU HD21 H 1 0.992 0.02 . 1 . . . . 157 LEU QD2 . 16317 1 1712 . 1 1 158 158 LEU HD22 H 1 0.992 0.02 . 1 . . . . 157 LEU QD2 . 16317 1 1713 . 1 1 158 158 LEU HD23 H 1 0.992 0.02 . 1 . . . . 157 LEU QD2 . 16317 1 1714 . 1 1 158 158 LEU HG H 1 1.755 0.02 . 1 . . . . 157 LEU HG . 16317 1 1715 . 1 1 158 158 LEU CA C 13 53.173 0.2 . 1 . . . . 157 LEU CA . 16317 1 1716 . 1 1 158 158 LEU CB C 13 44.220 0.2 . 1 . . . . 157 LEU CB . 16317 1 1717 . 1 1 158 158 LEU CD1 C 13 25.438 0.2 . 2 . . . . 157 LEU CD1 . 16317 1 1718 . 1 1 158 158 LEU CD2 C 13 24.288 0.2 . 2 . . . . 157 LEU CD2 . 16317 1 1719 . 1 1 158 158 LEU CG C 13 26.937 0.2 . 1 . . . . 157 LEU CG . 16317 1 1720 . 1 1 158 158 LEU N N 15 122.607 0.1 . 1 . . . . 157 LEU N . 16317 1 1721 . 1 1 159 159 SER H H 1 8.462 0.02 . 1 . . . . 158 SER HN . 16317 1 1722 . 1 1 159 159 SER HA H 1 4.854 0.02 . 1 . . . . 158 SER HA . 16317 1 1723 . 1 1 159 159 SER HB2 H 1 3.923 0.02 . 2 . . . . 158 SER HB2 . 16317 1 1724 . 1 1 159 159 SER CA C 13 57.305 0.2 . 1 . . . . 158 SER CA . 16317 1 1725 . 1 1 159 159 SER CB C 13 64.330 0.2 . 1 . . . . 158 SER CB . 16317 1 1726 . 1 1 159 159 SER N N 15 116.051 0.1 . 1 . . . . 158 SER N . 16317 1 1727 . 1 1 160 160 GLU H H 1 9.008 0.02 . 1 . . . . 159 GLU HN . 16317 1 1728 . 1 1 160 160 GLU HA H 1 4.606 0.02 . 1 . . . . 159 GLU HA . 16317 1 1729 . 1 1 160 160 GLU HB2 H 1 2.055 0.02 . 2 . . . . 159 GLU HB2 . 16317 1 1730 . 1 1 160 160 GLU HB3 H 1 2.240 0.02 . 2 . . . . 159 GLU HB3 . 16317 1 1731 . 1 1 160 160 GLU HG2 H 1 2.364 0.02 . 2 . . . . 159 GLU HG2 . 16317 1 1732 . 1 1 160 160 GLU CA C 13 56.956 0.2 . 1 . . . . 159 GLU CA . 16317 1 1733 . 1 1 160 160 GLU CB C 13 30.452 0.2 . 1 . . . . 159 GLU CB . 16317 1 1734 . 1 1 160 160 GLU CG C 13 36.664 0.2 . 1 . . . . 159 GLU CG . 16317 1 1735 . 1 1 160 160 GLU N N 15 124.532 0.1 . 1 . . . . 159 GLU N . 16317 1 1736 . 1 1 161 161 THR H H 1 7.805 0.02 . 1 . . . . 160 THR HN . 16317 1 1737 . 1 1 161 161 THR HA H 1 4.227 0.02 . 1 . . . . 160 THR HA . 16317 1 1738 . 1 1 161 161 THR HB H 1 4.234 0.02 . 1 . . . . 160 THR HB . 16317 1 1739 . 1 1 161 161 THR HG21 H 1 1.187 0.02 . 1 . . . . 160 THR QG2 . 16317 1 1740 . 1 1 161 161 THR HG22 H 1 1.187 0.02 . 1 . . . . 160 THR QG2 . 16317 1 1741 . 1 1 161 161 THR HG23 H 1 1.187 0.02 . 1 . . . . 160 THR QG2 . 16317 1 1742 . 1 1 161 161 THR CA C 13 62.841 0.2 . 1 . . . . 160 THR CA . 16317 1 1743 . 1 1 161 161 THR CB C 13 70.755 0.2 . 1 . . . . 160 THR CB . 16317 1 1744 . 1 1 161 161 THR CG2 C 13 21.915 0.2 . 1 . . . . 160 THR CG2 . 16317 1 1745 . 1 1 161 161 THR N N 15 118.334 0.1 . 1 . . . . 160 THR N . 16317 1 stop_ save_