data_19716 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Zn-binding domain of eukaryotic translation initiation factor 3, subunit G ; _BMRB_accession_number 19716 _BMRB_flat_file_name bmr19716.str _Entry_type original _Submission_date 2014-01-03 _Accession_date 2014-01-03 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Al-Abdul-Wahid 'Mohamed Sameer' . . 2 Menade Marie . . 3 Xie Jingwei . . 4 Kozlov Guennadi . . 5 Gehring Kalle . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 130 "13C chemical shifts" 78 "15N chemical shifts" 24 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2015-01-05 original author . stop_ _Original_release_date 2015-01-05 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Solution NMR structure of the Zn-binding domain of eukaryotic translation initiation factor 3, subunit G' _Citation_status 'in preparation' _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Al-Abdul-Wahid 'Mohamed Sameer' . . 2 Menade Marie . . 3 Xie Jingwei . . 4 Kozlov Guennadi . . 5 Gehring Kalle . . stop_ _Journal_abbreviation 'Proteins: Struct. Funct. Genet.' _Journal_volume . _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first . _Page_last . _Year . _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Zn-binding domain of eukaryotic translation initiation factor 3, subunit G' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label entity_1 $entity_1 'ZINC ION' $entity_ZN stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_entity_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common eif3G_Zn _Molecular_mass 2787.301 _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 24 _Mol_residue_sequence ; KIVSCRICKGDHWTTRCPYK DTLG ; loop_ _Residue_seq_code _Residue_label 1 LYS 2 ILE 3 VAL 4 SER 5 CYS 6 ARG 7 ILE 8 CYS 9 LYS 10 GLY 11 ASP 12 HIS 13 TRP 14 THR 15 THR 16 ARG 17 CYS 18 PRO 19 TYR 20 LYS 21 ASP 22 THR 23 LEU 24 GLY stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-29 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value PDB 2MJC "Zn-binding Domain Of Eukaryotic Translation Initiation Factor 3, Subunit G" 100.00 24 100.00 100.00 4.14e-08 DBJ BAC29952 "unnamed protein product [Mus musculus]" 100.00 320 100.00 100.00 1.18e-09 DBJ BAE40297 "unnamed protein product [Mus musculus]" 100.00 320 100.00 100.00 9.91e-10 DBJ BAE87500 "unnamed protein product [Macaca fascicularis]" 100.00 195 100.00 100.00 2.07e-09 DBJ BAF84009 "unnamed protein product [Homo sapiens]" 100.00 320 100.00 100.00 1.18e-09 DBJ BAH11496 "unnamed protein product [Homo sapiens]" 100.00 144 100.00 100.00 5.51e-08 EMBL CAG12187 "unnamed protein product [Tetraodon nigroviridis]" 100.00 296 100.00 100.00 7.37e-10 EMBL CAG33415 "EIF3S4 [Homo sapiens]" 100.00 320 100.00 100.00 1.18e-09 EMBL CAJ83120 "eukaryotic translation initiation factor 3, subunit 4 delta, 44kDa [Xenopus (Silurana) tropicalis]" 100.00 310 100.00 100.00 4.77e-10 EMBL CDQ73632 "unnamed protein product [Oncorhynchus mykiss]" 100.00 294 100.00 100.00 6.57e-10 EMBL CDQ81098 "unnamed protein product [Oncorhynchus mykiss]" 100.00 294 100.00 100.00 6.57e-10 GB AAB71866 "eukaryotic translation initiation factor 3 subunit [Homo sapiens]" 100.00 320 100.00 100.00 1.18e-09 GB AAC78728 "translation initiation factor eIF3 p44 subunit [Homo sapiens]" 100.00 320 100.00 100.00 1.27e-09 GB AAD00176 "eIF3-p44 [Mus musculus]" 100.00 320 100.00 100.00 1.27e-09 GB AAF14221 "eukaryotic translation initiation factor 3 p42 subunit [Mus musculus]" 100.00 320 100.00 100.00 1.18e-09 GB AAG15396 "eukaryotic translation initiation factor 3 subunit p42/p44 [Homo sapiens]" 100.00 320 100.00 100.00 1.18e-09 REF NP_001013113 "eukaryotic translation initiation factor 3 subunit G [Rattus norvegicus]" 100.00 320 100.00 100.00 1.11e-09 REF NP_001016749 "eukaryotic translation initiation factor 3 subunit G [Xenopus (Silurana) tropicalis]" 100.00 310 100.00 100.00 4.77e-10 REF NP_001073091 "eukaryotic translation initiation factor 3 subunit G [Bos taurus]" 100.00 320 100.00 100.00 1.11e-09 REF NP_001086477 "eukaryotic translation initiation factor 3 subunit G-A [Xenopus laevis]" 100.00 308 100.00 100.00 5.03e-10 REF NP_001087888 "eukaryotic translation initiation factor 3 subunit G-B [Xenopus laevis]" 100.00 308 100.00 100.00 5.03e-10 SP O75821 "RecName: Full=Eukaryotic translation initiation factor 3 subunit G; Short=eIF3g; AltName: Full=Eukaryotic translation initiatio" 100.00 320 100.00 100.00 1.18e-09 SP Q28CY2 "RecName: Full=Eukaryotic translation initiation factor 3 subunit G; Short=eIF3g; AltName: Full=Eukaryotic translation initiatio" 100.00 310 100.00 100.00 4.77e-10 SP Q3ZC12 "RecName: Full=Eukaryotic translation initiation factor 3 subunit G; Short=eIF3g; AltName: Full=Eukaryotic translation initiatio" 100.00 320 100.00 100.00 1.11e-09 SP Q5RK09 "RecName: Full=Eukaryotic translation initiation factor 3 subunit G; Short=eIF3g; AltName: Full=Eukaryotic translation initiatio" 100.00 320 100.00 100.00 1.11e-09 SP Q641B2 "RecName: Full=Eukaryotic translation initiation factor 3 subunit G-B; Short=eIF3g-B; AltName: Full=Eukaryotic translation initi" 100.00 308 100.00 100.00 5.03e-10 TPG DAA27948 "TPA: eukaryotic translation initiation factor 3 subunit G [Bos taurus]" 100.00 320 100.00 100.00 1.18e-09 stop_ save_ ############# # Ligands # ############# save_ZN _Saveframe_category ligand _Mol_type "non-polymer (NON-POLYMER)" _Name_common 'ZINC ION' _BMRB_code ZN _PDB_code ZN _Molecular_mass 65.409 _Mol_charge 2 _Mol_paramagnetic . _Mol_aromatic no _Details . loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons ZN ZN ZN . 2 . ? stop_ _Mol_thiol_state . _Sequence_homology_query_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $entity_1 Human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $entity_1 'recombinant technology' . . . . pGEX-6p1 $entity_ZN 'obtained from a vendor' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 10 mM 'natural abundance' HEPES 10 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' 'zinc chloride' 1 mM 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ save_NMRView _Saveframe_category software _Name NMRView _Version . loop_ _Vendor _Address _Electronic_address 'Johnson, One Moon Scientific' . . stop_ loop_ _Task 'chemical shift assignment' 'peak picking' stop_ _Details . save_ save_XPLOR-NIH _Saveframe_category software _Name XPLOR-NIH _Version . loop_ _Vendor _Address _Electronic_address 'Schwieters, Kuszewski, Tjandra and Clore' . . stop_ loop_ _Task 'structure solution' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 500 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_CBCA(CO)NH_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCACB_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_1H-13C_NOESY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $sample_1 save_ save_3D_HCCH-TOCSY_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $sample_1 save_ save_3D_HNHB_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNHB' _Sample_label $sample_1 save_ save_3D_HNHA_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNHA' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_3D_1H-15N_TOCSY_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N TOCSY' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0 . mM pH 6.3 1 pH pressure 1 . atm temperature 298 .2 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio water C 13 protons ppm 4.768 internal indirect . . . 0.251449530 water H 1 protons ppm 4.768 internal direct . . . 1.0 water N 15 protons ppm 4.768 internal indirect . . . 0.101329118 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 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '3D CBCA(CO)NH' '3D HCCH-TOCSY' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name entity_1 _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 1 1 LYS H H 8.4442 0.0000 1 2 1 1 LYS HA H 4.3287 0.0000 1 3 1 1 LYS HB2 H 1.7139 0.0000 2 4 1 1 LYS HB3 H 1.3657 0.0000 2 5 1 1 LYS HG2 H 1.4075 0.0000 2 6 1 1 LYS HG3 H 1.4099 0.0000 2 7 1 1 LYS HD2 H 1.7170 0.0000 2 8 1 1 LYS HE2 H 2.9744 0.0000 2 9 1 1 LYS CA C 28.3826 0.0000 1 10 1 1 LYS CB C 33.6298 0.0000 1 11 1 1 LYS CG C 24.7879 0.0000 1 12 1 1 LYS N N 123.3586 0.0000 1 13 2 2 ILE H H 8.2268 0.0000 1 14 2 2 ILE HA H 4.0656 0.0000 1 15 2 2 ILE HB H 1.7357 0.0000 1 16 2 2 ILE HG12 H 1.4111 0.0000 2 17 2 2 ILE HG13 H 1.1247 0.0000 2 18 2 2 ILE HG2 H 0.7862 0.0000 1 19 2 2 ILE HD1 H 0.7895 0.0000 1 20 2 2 ILE CA C 33.2123 0.0000 1 21 2 2 ILE CB C 38.8006 0.0000 1 22 2 2 ILE CG1 C 27.3936 0.0000 1 23 2 2 ILE CG2 C 45.2705 0.0000 1 24 2 2 ILE CD1 C 40.6225 0.0000 1 25 2 2 ILE N N 123.6061 0.0000 1 26 3 3 VAL H H 8.0721 0.0000 1 27 3 3 VAL HA H 3.8382 0.0000 1 28 3 3 VAL HB H 1.7207 0.0000 1 29 3 3 VAL HG1 H 0.6047 0.0000 2 30 3 3 VAL HG2 H 0.3995 0.0000 2 31 3 3 VAL CA C 33.8377 0.0000 1 32 3 3 VAL CB C 32.7389 0.0000 1 33 3 3 VAL CG1 C 48.2281 0.0000 2 34 3 3 VAL CG2 C 48.4400 0.0000 2 35 3 3 VAL N N 125.8212 0.0000 1 36 4 4 SER H H 7.8217 0.0000 1 37 4 4 SER HA H 4.5187 0.0000 1 38 4 4 SER HB2 H 3.4886 0.0000 2 39 4 4 SER HB3 H 3.5311 0.0000 2 40 4 4 SER CA C 29.1086 0.0000 1 41 4 4 SER CB C 36.5225 0.0000 1 42 4 4 SER N N 119.0844 0.0000 1 43 5 5 CYS H H 8.5850 0.0000 1 44 5 5 CYS HA H 4.3146 0.0000 1 45 5 5 CYS HB2 H 2.6554 0.0000 2 46 5 5 CYS HB3 H 2.5078 0.0000 2 47 5 5 CYS CA C 31.8584 0.0000 1 48 5 5 CYS CB C 30.0267 0.0000 1 49 5 5 CYS N N 129.0813 0.0000 1 50 6 6 ARG H H 9.1196 0.0000 1 51 6 6 ARG HA H 4.1363 0.0000 1 52 6 6 ARG HB2 H 1.9838 0.0000 2 53 6 6 ARG HB3 H 1.8029 0.0000 2 54 6 6 ARG HG2 H 1.8622 0.0000 2 55 6 6 ARG HG3 H 1.7915 0.0000 2 56 6 6 ARG HD2 H 3.3071 0.0000 2 57 6 6 ARG CA C 30.6710 0.0000 1 58 6 6 ARG CB C 30.8072 0.0000 1 59 6 6 ARG CG C 27.7988 0.0000 1 60 6 6 ARG CD C 43.2067 0.0000 1 61 6 6 ARG N N 130.2553 0.0000 1 62 7 7 ILE H H 9.6730 0.0000 1 63 7 7 ILE HA H 3.9613 0.0000 1 64 7 7 ILE HB H 2.5400 0.0000 1 65 7 7 ILE HG12 H 1.6548 0.0000 2 66 7 7 ILE HG13 H 1.0607 0.0000 2 67 7 7 ILE HG2 H 0.9509 0.0000 1 68 7 7 ILE HD1 H 0.8283 0.0000 1 69 7 7 ILE CA C 36.4094 0.0000 1 70 7 7 ILE CB C 38.2941 0.0000 1 71 7 7 ILE CG1 C 28.5500 0.0000 1 72 7 7 ILE CG2 C 41.5301 0.0000 1 73 7 7 ILE CD1 C 46.0053 0.0000 1 74 7 7 ILE N N 123.3842 0.0000 1 75 8 8 CYS H H 8.7845 0.0000 1 76 8 8 CYS HA H 4.9843 0.0000 1 77 8 8 CYS HB2 H 3.2810 0.0000 2 78 8 8 CYS HB3 H 2.5335 0.0000 2 79 8 8 CYS CA C 30.6688 0.0000 1 80 8 8 CYS CB C 33.1698 0.0000 1 81 8 8 CYS N N 118.6018 0.0000 1 82 9 9 LYS H H 7.7784 0.0000 1 83 9 9 LYS HA H 4.3125 0.0000 1 84 9 9 LYS HB2 H 2.2010 0.0000 2 85 9 9 LYS HB3 H 2.0314 0.0000 2 86 9 9 LYS HG2 H 1.3331 0.0000 2 87 9 9 LYS HD2 H 1.6564 0.0000 2 88 9 9 LYS HE2 H 2.9324 0.0000 2 89 9 9 LYS CA C 30.6809 0.0000 1 90 9 9 LYS CB C 29.3794 0.0000 1 91 9 9 LYS CG C 25.4130 0.0000 1 92 9 9 LYS CE C 42.1216 0.0000 1 93 9 9 LYS N N 117.4516 0.0000 1 94 10 10 GLY H H 9.1402 0.0000 1 95 10 10 GLY HA2 H 4.1969 0.0000 2 96 10 10 GLY HA3 H 3.4808 0.0000 2 97 10 10 GLY CA C 43.3535 0.0000 1 98 10 10 GLY N N 112.3053 0.0000 1 99 11 11 ASP H H 8.3725 0.0000 1 100 11 11 ASP HA H 4.7223 0.0000 1 101 11 11 ASP HB2 H 2.6150 0.0000 2 102 11 11 ASP HB3 H 2.5392 0.0000 2 103 11 11 ASP CA C 24.8368 0.0000 1 104 11 11 ASP CB C 39.0106 0.0000 1 105 11 11 ASP N N 119.7177 0.0000 1 106 12 12 HIS H H 7.2605 0.0000 1 107 12 12 HIS HA H 4.5615 0.0000 1 108 12 12 HIS HB2 H 3.3357 0.0000 2 109 12 12 HIS HB3 H 3.0419 0.0000 2 110 12 12 HIS HD2 H 6.8239 0.0000 1 111 12 12 HIS HE1 H 7.8345 0.0000 1 112 12 12 HIS CA C 25.9907 0.0000 1 113 12 12 HIS CB C 30.4906 0.0000 1 114 12 12 HIS CD2 C 44.3704 0.0000 1 115 12 12 HIS CE1 C 25.6125 0.0000 1 116 12 12 HIS N N 115.2904 0.0000 1 117 13 13 TRP H H 8.3573 0.0000 1 118 13 13 TRP HA H 4.7520 0.0000 1 119 13 13 TRP HB2 H 3.5339 0.0000 2 120 13 13 TRP HB3 H 2.9385 0.0000 2 121 13 13 TRP HD1 H 7.3275 0.0000 1 122 13 13 TRP HE1 H 10.2300 0.0000 1 123 13 13 TRP HE3 H 7.7223 0.0000 1 124 13 13 TRP HZ2 H 7.5097 0.0000 1 125 13 13 TRP HZ3 H 7.1990 0.0000 1 126 13 13 TRP HH2 H 7.2583 0.0000 1 127 13 13 TRP CA C 28.7436 0.0000 1 128 13 13 TRP CB C 30.1384 0.0000 1 129 13 13 TRP CD1 C 42.0288 0.0000 1 130 13 13 TRP CE3 C 36.8314 0.0000 1 131 13 13 TRP CZ2 C 30.7281 0.0000 1 132 13 13 TRP CZ3 C 38.0334 0.0000 1 133 13 13 TRP CH2 C 40.9008 0.0000 1 134 13 13 TRP N N 117.6668 0.0000 1 135 13 13 TRP NE1 N 128.8700 0.0000 1 136 14 14 THR H H 8.6933 0.0000 1 137 14 14 THR HA H 5.3294 0.0000 1 138 14 14 THR HB H 4.3159 0.0000 1 139 14 14 THR HG2 H 1.4834 0.0000 1 140 14 14 THR CA C 37.9867 0.0000 1 141 14 14 THR CB C 42.0043 0.0000 1 142 14 14 THR CG2 C 50.8598 0.0000 1 143 14 14 THR N N 120.6353 0.0000 1 144 15 15 THR H H 7.7374 0.0000 1 145 15 15 THR HA H 4.0971 0.0000 1 146 15 15 THR HB H 4.3190 0.0000 1 147 15 15 THR HG2 H 1.3322 0.0000 1 148 15 15 THR CA C 35.6174 0.0000 1 149 15 15 THR CB C 40.8783 0.0000 1 150 15 15 THR CG2 C 50.7432 0.0000 1 151 15 15 THR N N 108.0645 0.0000 1 152 16 16 ARG H H 7.9764 0.0000 1 153 16 16 ARG HA H 4.5362 0.0000 1 154 16 16 ARG HB2 H 2.1192 0.0000 2 155 16 16 ARG HB3 H 1.7100 0.0000 2 156 16 16 ARG HG2 H 1.7287 0.0000 2 157 16 16 ARG HG3 H 1.6117 0.0000 2 158 16 16 ARG HD2 H 3.1764 0.0000 2 159 16 16 ARG CA C 26.0313 0.0000 1 160 16 16 ARG CB C 30.3245 0.0000 1 161 16 16 ARG CG C 27.0679 0.0000 1 162 16 16 ARG CD C 43.0218 0.0000 1 163 16 16 ARG N N 119.9565 0.0000 1 164 17 17 CYS H H 7.5451 0.0000 1 165 17 17 CYS HA H 4.0156 0.0000 1 166 17 17 CYS HB2 H 3.6892 0.0000 2 167 17 17 CYS HB3 H 2.8408 0.0000 2 168 17 17 CYS CA C 30.8889 0.0000 1 169 17 17 CYS CB C 31.9158 0.0000 1 170 17 17 CYS N N 125.7286 0.0000 1 171 18 18 PRO HA H 4.3165 0.0000 1 172 18 18 PRO HB2 H 1.9967 0.0000 2 173 18 18 PRO HB3 H 1.1741 0.0000 2 174 18 18 PRO HG2 H 1.6054 0.0000 2 175 18 18 PRO HG3 H 1.2315 0.0000 2 176 18 18 PRO HD2 H 3.6570 0.0000 2 177 18 18 PRO HD3 H 3.0029 0.0000 2 178 18 18 PRO CA C 35.8773 0.0000 1 179 18 18 PRO CB C 31.8078 0.0000 1 180 18 18 PRO CG C 26.1890 0.0000 1 181 18 18 PRO CD C 50.9125 0.0000 1 182 19 19 TYR H H 9.2793 0.0000 1 183 19 19 TYR HA H 4.7522 0.0000 1 184 19 19 TYR HB2 H 3.3328 0.0000 2 185 19 19 TYR HB3 H 2.9276 0.0000 2 186 19 19 TYR HD2 H 7.1880 0.0000 3 187 19 19 TYR HE2 H 6.9019 0.0000 3 188 19 19 TYR CA C 28.8963 0.0000 1 189 19 19 TYR CB C 37.7830 0.0000 1 190 19 19 TYR CD2 C 49.2004 0.0000 2 191 19 19 TYR CE2 C 34.1221 0.0000 2 192 19 19 TYR N N 120.9965 0.0000 1 193 20 20 LYS H H 7.4792 0.0000 1 194 20 20 LYS HA H 4.0972 0.0000 1 195 20 20 LYS HB2 H 1.8674 0.0000 2 196 20 20 LYS HG2 H 1.4384 0.0000 2 197 20 20 LYS HD2 H 1.6899 0.0000 2 198 20 20 LYS HE2 H 3.0115 0.0000 2 199 20 20 LYS CA C 30.6971 0.0000 1 200 20 20 LYS CG C 52.0289 0.0000 1 201 20 20 LYS N N 120.5321 0.0000 1 202 21 21 ASP H H 8.5411 0.0000 1 203 21 21 ASP HA H 4.7042 0.0000 1 204 21 21 ASP HB2 H 2.7842 0.0000 2 205 21 21 ASP HB3 H 2.6347 0.0000 2 206 21 21 ASP CA C 26.9945 0.0000 1 207 21 21 ASP CB C 40.9318 0.0000 1 208 21 21 ASP N N 118.9432 0.0000 1 209 22 22 THR H H 7.8413 0.0000 1 210 22 22 THR HA H 4.3805 0.0000 1 211 22 22 THR HB H 4.2843 0.0000 1 212 22 22 THR HG2 H 1.2365 0.0000 1 213 22 22 THR CA C 34.4430 0.0000 1 214 22 22 THR CB C 41.9199 0.0000 1 215 22 22 THR CG2 C 49.7785 0.0000 1 216 22 22 THR N N 112.3965 0.0000 1 217 23 23 LEU H H 8.1699 0.0000 1 218 23 23 LEU HA H 4.4252 0.0000 1 219 23 23 LEU HB2 H 1.6543 0.0000 2 220 23 23 LEU HG H 1.6551 0.0000 1 221 23 23 LEU HD1 H 0.8576 0.0000 2 222 23 23 LEU HD2 H 0.8561 0.0000 2 223 23 23 LEU CA C 27.0941 0.0000 1 224 23 23 LEU CB C 42.5382 0.0000 1 225 23 23 LEU CG C 27.0551 0.0000 1 226 23 23 LEU CD1 C 25.0616 0.0000 2 227 23 23 LEU CD2 C 51.1998 0.0000 2 228 23 23 LEU N N 123.0899 0.0000 1 229 24 24 GLY H H 8.0586 0.0000 1 230 24 24 GLY HA2 H 4.0522 0.0000 2 231 24 24 GLY CA C 44.6383 0.0000 1 232 24 24 GLY N N 108.9635 0.0000 1 stop_ save_