data_6863 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for Mengovirus Leader polypeptide ; _BMRB_accession_number 6863 _BMRB_flat_file_name bmr6863.str _Entry_type original _Submission_date 2005-10-13 _Accession_date 2005-10-13 _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 Cornilescu Claudia C. . 2 Porter Frederick W. IV 3 Qin Zhao . . 4 Lee Min S. . 5 Palmenberg Ann C. . 6 Markley John L. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 129 "13C chemical shifts" 101 "15N chemical shifts" 29 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2005-12-16 original author . stop_ _Original_release_date 2005-12-16 save_ ############################# # Citation for this entry # ############################# save_Mengovirus_Leader_polypeptide_fragment _Saveframe_category entry_citation _Citation_full . _Citation_title ; Leader Protein of Encephalomyocarditis Virus Binds Zinc, Is Phosphorylated during Viral Infection, and Affects the Efficiency of Genome Translation ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 11883190 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Dvorak Cheryl M.T. . 2 Hall David J. . 3 Hill Marchel . . 4 Riddle Michael . . 5 Pranter Andrew . . stop_ _Journal_abbreviation Virology _Journal_volume 290 _Journal_issue 2 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 261 _Page_last 271 _Year 2001 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Zinc finger domain of Mengovirus Leader polypeptide' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'Zinc finger domain of Mengovirus Leader polypeptide' $Mengovirus_Leader_polypeptide 'ZINC (II) ION, 1' $ZN stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state 'all other bound' loop_ _Magnetic_equivalence_ID _Magnetically_equivalent_system_component diamagnetic 'ZINC (II) ION, 1' stop_ _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_Mengovirus_Leader_polypeptide _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'zinc finger domain' _Molecular_mass . _Mol_thiol_state 'all other bound' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 35 _Mol_residue_sequence ; GSTMATTMEQEICAHSMTFE ECPKCSALQYRNGFY ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 -3 GLY 2 -2 SER 3 -1 THR 4 1 MET 5 2 ALA 6 3 THR 7 4 THR 8 5 MET 9 6 GLU 10 7 GLN 11 8 GLU 12 9 ILE 13 10 CYS 14 11 ALA 15 12 HIS 16 13 SER 17 14 MET 18 15 THR 19 16 PHE 20 17 GLU 21 18 GLU 22 19 CYS 23 20 PRO 24 21 LYS 25 22 CYS 26 23 SER 27 24 ALA 28 25 LEU 29 26 GLN 30 27 TYR 31 28 ARG 32 29 ASN 33 30 GLY 34 31 PHE 35 32 TYR stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-28 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 BMRB 19084 full_length_mengoL 102.86 71 97.22 97.22 3.28e-15 BMRB 19855 entity_1 102.86 71 97.22 97.22 3.28e-15 BMRB 19857 entity_1 102.86 71 97.22 97.22 3.14e-15 BMRB 19858 entity_1 102.86 71 97.22 97.22 3.25e-15 PDB 2BAI "The Zinc Finger Domain Of Mengovirus Leader Polypeptide" 88.57 32 100.00 100.00 1.52e-13 PDB 2M7Y "The Mengovirus Leader Protein" 102.86 71 97.22 97.22 3.28e-15 PDB 2MMH "Unphosphorylated Mengovirus Leader Protein: Nmr Studies Of The Phosphorylation Of The Mengovirus Leader Protein Reveal Stabiliz" 102.86 71 97.22 97.22 3.28e-15 PDB 2MMI "Mengovirus Leader: Structural Characterization Of The Mengovirus Leader Protein Bound To Ran Gtpase By Nuclear Magnetic Resonan" 102.86 71 97.22 97.22 3.28e-15 PDB 2MMK "Y41 And T47 Phosphorylation Of The Mengovirus Leader Protein: Nmr Studies Of The Phosphorylation Of The Mengovirus Leader Prote" 102.86 71 97.22 97.22 3.14e-15 PDB 2MML "T47 Phosphorylation Of The Mengovirus Leader Protein: Nmr Studies Of The Phosphorylation Of The Mengovirus Leader Protein Revea" 102.86 71 97.22 97.22 3.25e-15 EMBL CAE84564 "polyprotein [Encephalomyocarditis virus]" 91.43 901 100.00 100.00 5.16e-14 EMBL CAE84565 "polyprotein [Encephalomyocarditis virus]" 91.43 901 100.00 100.00 5.74e-14 EMBL CAE84566 "polyprotein [Encephalomyocarditis virus]" 91.43 901 100.00 100.00 5.74e-14 EMBL CAE84567 "polyprotein [Encephalomyocarditis virus]" 91.43 901 100.00 100.00 6.02e-14 GB AAA46547 "polyprotein [Mengo virus]" 91.43 2293 100.00 100.00 2.97e-14 GB AAB59755 "hemagglutin structural protein, partial [Mengo virus]" 91.43 901 100.00 100.00 5.26e-14 GB ABB97066 "polyprotein [Mengo virus]" 91.43 2293 100.00 100.00 2.88e-14 GB ABI15777 "polyprotein, partial [Encephalomyocarditis virus]" 91.43 2274 100.00 100.00 3.70e-14 SP P12296 "RecName: Full=Genome polyprotein; Contains: RecName: Full=Leader protein; Contains: RecName: Full=Protein VP0; AltName: Full=VP" 91.43 2293 100.00 100.00 2.88e-14 SP P32540 "RecName: Full=Genome polyprotein; Contains: RecName: Full=Protein VP0; AltName: Full=VP4-VP2; Contains: RecName: Full=Protein V" 91.43 901 100.00 100.00 5.26e-14 stop_ save_ ############# # Ligands # ############# save_ZN _Saveframe_category ligand _Mol_type non-polymer _Name_common "ZN (ZINC ION)" _BMRB_code . _PDB_code ZN _Molecular_mass 65.409 _Mol_charge 2 _Mol_paramagnetic . _Mol_aromatic no _Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Tue Sep 6 11:47:31 2011 ; 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 $Mengovirus_Leader_polypeptide Mengovirus 12107 Viruses . Cardiovirus Mengovirus 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 $Mengovirus_Leader_polypeptide 'recombinant technology' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_NC_labeled_fragment _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Mengovirus_Leader_polypeptide 0.5 mM '[U-13C; U-15N]' NaPi 100 mM . stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer unknown _Model unknown _Field_strength 0 _Details 'spectrometer information not available' save_ ############################# # NMR applied experiments # ############################# save_unknown_1 _Saveframe_category NMR_applied_experiment _Experiment_name unknown _Sample_label $NC_labeled_fragment save_ save_NMR_spec_expt _Saveframe_category NMR_applied_experiment _Experiment_name unknown _BMRB_pulse_sequence_accession_number . _Details 'experiment information not available' save_ ####################### # Sample conditions # ####################### save_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 100 5 mM pH 7.0 0.1 pH temperature 298 1 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _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 _Indirect_shift_ratio_citation_label _Correction_value_citation_label DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 $Mengovirus_Leader_polypeptide_fragment $Mengovirus_Leader_polypeptide_fragment DSS H 1 'methyl protons' ppm 0.0 internal direct . . . 1.000000000 $Mengovirus_Leader_polypeptide_fragment $Mengovirus_Leader_polypeptide_fragment DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 $Mengovirus_Leader_polypeptide_fragment $Mengovirus_Leader_polypeptide_fragment 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_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label unknown stop_ loop_ _Sample_label $NC_labeled_fragment stop_ _Sample_conditions_label $conditions_1 _Chem_shift_reference_set_label $chemical_shift_referencing _Mol_system_component_name 'Zinc finger domain of Mengovirus Leader polypeptide' _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 4 MET HA H 4.4580 0.02 . 2 1 4 MET HG2 H 2.5790 0.02 . 3 1 4 MET HG3 H 2.5790 0.02 . 4 1 4 MET C C 175.7310 0.1 . 5 1 4 MET CA C 55.3140 0.1 . 6 1 4 MET CG C 31.9630 0.1 . 7 2 5 ALA H H 8.3230 0.02 . 8 2 5 ALA HB H 1.4120 0.02 . 9 2 5 ALA C C 176.9140 0.1 . 10 2 5 ALA CA C 52.7588 0.1 . 11 2 5 ALA CB C 19.4490 0.1 . 12 2 5 ALA N N 126.2109 0.1 . 13 3 6 THR H H 7.7622 0.02 . 14 3 6 THR CA C 63.0996 0.1 . 15 3 6 THR N N 118.9108 0.1 . 16 4 7 THR HA H 4.2430 0.02 . 17 4 7 THR C C 174.5390 0.1 . 18 4 7 THR CA C 62.1991 0.1 . 19 4 7 THR CB C 69.8060 0.1 . 20 4 7 THR CG2 C 22.0240 0.1 . 21 5 8 MET H H 8.5587 0.02 . 22 5 8 MET HA H 4.4410 0.02 . 23 5 8 MET HB2 H 2.0380 0.02 . 24 5 8 MET HB3 H 2.0380 0.02 . 25 5 8 MET HG2 H 2.5310 0.02 . 26 5 8 MET HG3 H 2.5310 0.02 . 27 5 8 MET C C 176.2010 0.1 . 28 5 8 MET CA C 56.0939 0.1 . 29 5 8 MET CB C 34.0130 0.1 . 30 5 8 MET CG C 31.9140 0.1 . 31 5 8 MET N N 122.9616 0.1 . 32 6 9 GLU H H 8.7050 0.02 . 33 6 9 GLU HA H 4.2020 0.02 . 34 6 9 GLU HB2 H 1.9260 0.02 . 35 6 9 GLU HB3 H 1.9260 0.02 . 36 6 9 GLU HG2 H 2.2790 0.02 . 37 6 9 GLU HG3 H 2.2790 0.02 . 38 6 9 GLU C C 176.4350 0.1 . 39 6 9 GLU CA C 57.5922 0.1 . 40 6 9 GLU CB C 29.5590 0.1 . 41 6 9 GLU CG C 36.4580 0.1 . 42 6 9 GLU N N 121.6054 0.1 . 43 7 10 GLN H H 8.2315 0.02 . 44 7 10 GLN HA H 4.3820 0.02 . 45 7 10 GLN HB2 H 1.9890 0.02 . 46 7 10 GLN HB3 H 1.9890 0.02 . 47 7 10 GLN HG2 H 2.3590 0.02 . 48 7 10 GLN HG3 H 2.3590 0.02 . 49 7 10 GLN HE21 H 7.6200 0.02 . 50 7 10 GLN HE22 H 6.8900 0.02 . 51 7 10 GLN C C 175.7120 0.1 . 52 7 10 GLN CA C 55.8254 0.1 . 53 7 10 GLN CB C 29.4620 0.1 . 54 7 10 GLN CG C 34.1390 0.1 . 55 7 10 GLN N N 119.1992 0.1 . 56 7 10 GLN NE2 N 112.3170 0.1 . 57 8 11 GLU H H 8.3746 0.02 . 58 8 11 GLU HA H 4.3830 0.02 . 59 8 11 GLU HB2 H 1.9510 0.02 . 60 8 11 GLU HB3 H 1.9510 0.02 . 61 8 11 GLU HG2 H 2.2960 0.02 . 62 8 11 GLU HG3 H 2.2960 0.02 . 63 8 11 GLU C C 175.3900 0.1 . 64 8 11 GLU CA C 56.8195 0.1 . 65 8 11 GLU CB C 30.3010 0.1 . 66 8 11 GLU CG C 36.5320 0.1 . 67 8 11 GLU N N 122.1443 0.1 . 68 9 12 ILE H H 8.0195 0.02 . 69 9 12 ILE HA H 4.6150 0.02 . 70 9 12 ILE HB H 1.7960 0.02 . 71 9 12 ILE HG12 H 1.3260 0.02 . 72 9 12 ILE HG2 H 0.8830 0.02 . 73 9 12 ILE C C 176.1080 0.1 . 74 9 12 ILE CA C 58.7019 0.1 . 75 9 12 ILE CB C 38.9240 0.1 . 76 9 12 ILE CG1 C 26.3540 0.1 . 77 9 12 ILE CG2 C 17.2800 0.1 . 78 9 12 ILE CD1 C 11.5550 0.1 . 79 9 12 ILE N N 121.0135 0.1 . 80 10 13 CYS H H 9.1246 0.02 . 81 10 13 CYS HA H 4.5750 0.02 . 82 10 13 CYS HB2 H 3.5080 0.02 . 83 10 13 CYS HB3 H 1.8750 0.02 . 84 10 13 CYS C C 177.2190 0.1 . 85 10 13 CYS CA C 58.0730 0.1 . 86 10 13 CYS CB C 32.9990 0.1 . 87 10 13 CYS N N 126.6502 0.1 . 88 11 14 ALA H H 8.3039 0.02 . 89 11 14 ALA HA H 4.0120 0.02 . 90 11 14 ALA HB H 0.9890 0.02 . 91 11 14 ALA C C 177.9280 0.1 . 92 11 14 ALA CA C 53.8434 0.1 . 93 11 14 ALA CB C 18.6780 0.1 . 94 11 14 ALA N N 121.8515 0.1 . 95 12 15 HIS H H 10.4021 0.02 . 96 12 15 HIS HA H 4.6130 0.02 . 97 12 15 HIS HB2 H 3.4990 0.02 . 98 12 15 HIS HB3 H 2.8650 0.02 . 99 12 15 HIS C C 174.6860 0.1 . 100 12 15 HIS CA C 56.5032 0.1 . 101 12 15 HIS CB C 29.6910 0.1 . 102 12 15 HIS N N 122.0227 0.1 . 103 13 16 SER H H 8.1952 0.02 . 104 13 16 SER HA H 4.1430 0.02 . 105 13 16 SER HB2 H 3.8130 0.02 . 106 13 16 SER HB3 H 3.8130 0.02 . 107 13 16 SER C C 173.0810 0.1 . 108 13 16 SER CA C 59.6133 0.1 . 109 13 16 SER N N 112.0382 0.1 . 110 14 17 MET H H 7.5764 0.02 . 111 14 17 MET HA H 4.8050 0.02 . 112 14 17 MET HB2 H 2.0930 0.02 . 113 14 17 MET HG2 H 2.4650 0.02 . 114 14 17 MET C C 174.2290 0.1 . 115 14 17 MET CA C 53.8394 0.1 . 116 14 17 MET CB C 34.5320 0.1 . 117 14 17 MET CG C 32.4970 0.1 . 118 14 17 MET N N 119.1478 0.1 . 119 15 18 THR H H 8.4788 0.02 . 120 15 18 THR HA H 4.7790 0.02 . 121 15 18 THR HB H 4.5210 0.02 . 122 15 18 THR HG2 H 1.3190 0.02 . 123 15 18 THR C C 176.3700 0.1 . 124 15 18 THR CA C 62.5555 0.1 . 125 15 18 THR CB C 69.6490 0.1 . 126 15 18 THR CG2 C 22.6920 0.1 . 127 15 18 THR N N 112.1471 0.1 . 128 16 19 PHE H H 8.4929 0.02 . 129 16 19 PHE HA H 3.8350 0.02 . 130 16 19 PHE HB2 H 2.9970 0.02 . 131 16 19 PHE HB3 H 2.9970 0.02 . 132 16 19 PHE C C 177.3860 0.1 . 133 16 19 PHE CA C 63.0474 0.1 . 134 16 19 PHE CB C 39.3080 0.1 . 135 16 19 PHE N N 122.7605 0.1 . 136 17 20 GLU H H 8.4305 0.02 . 137 17 20 GLU HA H 4.0410 0.02 . 138 17 20 GLU HB2 H 1.9800 0.02 . 139 17 20 GLU HB3 H 1.9800 0.02 . 140 17 20 GLU HG2 H 2.3190 0.02 . 141 17 20 GLU HG3 H 2.3190 0.02 . 142 17 20 GLU C C 177.4210 0.1 . 143 17 20 GLU CA C 58.7637 0.1 . 144 17 20 GLU CB C 29.3360 0.1 . 145 17 20 GLU CG C 36.6350 0.1 . 146 17 20 GLU N N 112.9497 0.1 . 147 18 21 GLU H H 7.5236 0.02 . 148 18 21 GLU HA H 4.2310 0.02 . 149 18 21 GLU HB2 H 1.9070 0.02 . 150 18 21 GLU HB3 H 1.9070 0.02 . 151 18 21 GLU HG2 H 2.2380 0.02 . 152 18 21 GLU HG3 H 2.2380 0.02 . 153 18 21 GLU C C 176.0450 0.1 . 154 18 21 GLU CA C 56.2104 0.1 . 155 18 21 GLU CB C 30.8950 0.1 . 156 18 21 GLU CG C 36.8960 0.1 . 157 18 21 GLU N N 116.7564 0.1 . 158 19 22 CYS H H 7.7923 0.02 . 159 19 22 CYS CA C 57.2819 0.1 . 160 19 22 CYS N N 124.7482 0.1 . 161 20 23 PRO HA H 4.3870 0.02 . 162 20 23 PRO HB2 H 1.9600 0.02 . 163 20 23 PRO HB3 H 1.9600 0.02 . 164 20 23 PRO HG2 H 2.3210 0.02 . 165 20 23 PRO HG3 H 2.3210 0.02 . 166 20 23 PRO HD2 H 4.0280 0.02 . 167 20 23 PRO HD3 H 4.0280 0.02 . 168 20 23 PRO C C 177.7330 0.1 . 169 20 23 PRO CA C 64.3919 0.1 . 170 20 23 PRO CB C 32.2250 0.1 . 171 20 23 PRO CG C 27.3020 0.1 . 172 20 23 PRO CD C 51.1640 0.1 . 173 21 24 LYS H H 8.4054 0.02 . 174 21 24 LYS HA H 4.2620 0.02 . 175 21 24 LYS HB2 H 1.2040 0.02 . 176 21 24 LYS HB3 H 1.2040 0.02 . 177 21 24 LYS HG2 H 1.7090 0.02 . 178 21 24 LYS HG3 H 1.7090 0.02 . 179 21 24 LYS HD2 H 1.3720 0.02 . 180 21 24 LYS HD3 H 1.3720 0.02 . 181 21 24 LYS HE2 H 2.8290 0.02 . 182 21 24 LYS HE3 H 2.8290 0.02 . 183 21 24 LYS C C 178.7070 0.1 . 184 21 24 LYS CA C 58.2638 0.1 . 185 21 24 LYS CB C 33.8440 0.1 . 186 21 24 LYS CG C 28.7900 0.1 . 187 21 24 LYS CD C 25.2680 0.1 . 188 21 24 LYS CE C 42.0960 0.1 . 189 21 24 LYS N N 119.8126 0.1 . 190 22 25 CYS H H 9.1101 0.02 . 191 22 25 CYS HA H 4.2440 0.02 . 192 22 25 CYS HB2 H 3.1010 0.02 . 193 22 25 CYS HB3 H 2.5290 0.02 . 194 22 25 CYS C C 176.7620 0.1 . 195 22 25 CYS CA C 63.1041 0.1 . 196 22 25 CYS CB C 29.4380 0.1 . 197 22 25 CYS N N 122.5700 0.1 . 198 23 26 SER H H 8.0107 0.02 . 199 23 26 SER HA H 4.3390 0.02 . 200 23 26 SER HB2 H 3.9370 0.02 . 201 23 26 SER HB3 H 3.9370 0.02 . 202 23 26 SER C C 174.9140 0.1 . 203 23 26 SER CA C 59.7750 0.1 . 204 23 26 SER CB C 63.7150 0.1 . 205 23 26 SER N N 113.7010 0.1 . 206 24 27 ALA H H 7.4780 0.02 . 207 24 27 ALA HB H 1.3740 0.02 . 208 24 27 ALA C C 177.5730 0.1 . 209 24 27 ALA CA C 52.6567 0.1 . 210 24 27 ALA CB C 19.1720 0.1 . 211 24 27 ALA N N 123.8456 0.1 . 212 25 28 LEU H H 7.7929 0.02 . 213 25 28 LEU HA H 4.2490 0.02 . 214 25 28 LEU HB2 H 1.7230 0.02 . 215 25 28 LEU HB3 H 1.4710 0.02 . 216 25 28 LEU HD1 H 0.9700 0.02 . 217 25 28 LEU HD2 H 0.8690 0.02 . 218 25 28 LEU C C 176.9310 0.1 . 219 25 28 LEU CA C 55.3152 0.1 . 220 25 28 LEU CB C 42.0820 0.1 . 221 25 28 LEU CG C 26.8720 0.1 . 222 25 28 LEU CD1 C 25.1690 0.1 . 223 25 28 LEU CD2 C 23.2240 0.1 . 224 25 28 LEU N N 119.9935 0.1 . 225 26 29 GLN H H 8.0080 0.02 . 226 26 29 GLN HA H 4.2820 0.02 . 227 26 29 GLN HB2 H 1.8830 0.02 . 228 26 29 GLN HB3 H 1.8830 0.02 . 229 26 29 GLN HG2 H 2.2480 0.02 . 230 26 29 GLN HG3 H 2.2480 0.02 . 231 26 29 GLN HE21 H 7.4900 0.02 . 232 26 29 GLN HE22 H 6.7900 0.02 . 233 26 29 GLN C C 174.5590 0.1 . 234 26 29 GLN CA C 55.4965 0.1 . 235 26 29 GLN CB C 29.3900 0.1 . 236 26 29 GLN CG C 33.8130 0.1 . 237 26 29 GLN N N 120.0996 0.1 . 238 26 29 GLN NE2 N 112.2700 0.1 . 239 27 30 TYR H H 7.6793 0.02 . 240 27 30 TYR N N 126.3568 0.1 . 241 29 32 ASN HB2 H 2.7560 0.02 . 242 29 32 ASN C C 175.4120 0.1 . 243 29 32 ASN CA C 53.6287 0.1 . 244 30 33 GLY H H 8.1438 0.02 . 245 30 33 GLY HA2 H 3.8350 0.02 . 246 30 33 GLY HA3 H 3.8350 0.02 . 247 30 33 GLY C C 173.5370 0.1 . 248 30 33 GLY CA C 45.4198 0.1 . 249 30 33 GLY N N 108.7560 0.1 . 250 31 34 PHE H H 7.9605 0.02 . 251 31 34 PHE HA H 4.5660 0.02 . 252 31 34 PHE HB2 H 3.0270 0.02 . 253 31 34 PHE HB3 H 3.0270 0.02 . 254 31 34 PHE C C 174.4410 0.1 . 255 31 34 PHE CA C 57.8795 0.1 . 256 31 34 PHE N N 119.8992 0.1 . 257 32 35 TYR H H 7.6091 0.02 . 258 32 35 TYR CA C 59.2278 0.1 . 259 32 35 TYR N N 125.7152 0.1 . stop_ save_