data_18031 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for the ribosoaml assembly factor Fap7 from Pyrococcus horikoshii in its AP5A bound form ; _BMRB_accession_number 18031 _BMRB_flat_file_name bmr18031.str _Entry_type original _Submission_date 2011-10-31 _Accession_date 2011-10-31 _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 Hellmich Ute A. . 2 Duchardt-Ferner Elke . . 3 Woehnert Jens . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 155 "13C chemical shifts" 319 "15N chemical shifts" 155 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2012-11-09 original author . stop_ loop_ _Related_BMRB_accession_number _Relationship 18030 'Fap7 monomer' stop_ _Original_release_date 2012-11-09 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title '1H, 15N, 13C Assigned Backbone Chemical Shifts for Fap7 in the AP5A-bound form' _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 Hellmich Ute A. . 2 Duchardt-Ferner Elke . . 3 Woehnert Jens . . stop_ _Journal_abbreviation 'Biomol. NMR Assignments' _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 . loop_ _Keyword AP5A Fap7 'ribosomal assembly factor' 'triple resonance' stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name Fap7 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label Fap7 $Fap7 AP5A $AP5 stop_ _System_molecular_weight 21094.5 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . loop_ _Biological_function 'presumed ribosomal assembly factor' 'putative involvement in oxidative stress' stop_ _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_Fap7 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Fap7 _Molecular_mass 20178.1 _Mol_thiol_state 'all free' loop_ _Biological_function 'presumed ribosomal assembly factor' 'putative involvement in oxidative stress' stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 180 _Mol_residue_sequence ; MLIAITGTPGVGKTTVAKLL AKKLNYEYVSLKDFALEKGC GRRVNDEVEVEIDELAYFIE RELKGKNAVLDGHLSHLMPV DLVVVLRAHPKLIGERLRER GYDREKIGENVEAELVDAVL IEAIEEHENVIEVDTTNKSP EDVVEEIVSLINSGIKKRVG IVDWSEVYDEIIPYLRLGGE ; loop_ _Residue_seq_code _Residue_label 1 MET 2 LEU 3 ILE 4 ALA 5 ILE 6 THR 7 GLY 8 THR 9 PRO 10 GLY 11 VAL 12 GLY 13 LYS 14 THR 15 THR 16 VAL 17 ALA 18 LYS 19 LEU 20 LEU 21 ALA 22 LYS 23 LYS 24 LEU 25 ASN 26 TYR 27 GLU 28 TYR 29 VAL 30 SER 31 LEU 32 LYS 33 ASP 34 PHE 35 ALA 36 LEU 37 GLU 38 LYS 39 GLY 40 CYS 41 GLY 42 ARG 43 ARG 44 VAL 45 ASN 46 ASP 47 GLU 48 VAL 49 GLU 50 VAL 51 GLU 52 ILE 53 ASP 54 GLU 55 LEU 56 ALA 57 TYR 58 PHE 59 ILE 60 GLU 61 ARG 62 GLU 63 LEU 64 LYS 65 GLY 66 LYS 67 ASN 68 ALA 69 VAL 70 LEU 71 ASP 72 GLY 73 HIS 74 LEU 75 SER 76 HIS 77 LEU 78 MET 79 PRO 80 VAL 81 ASP 82 LEU 83 VAL 84 VAL 85 VAL 86 LEU 87 ARG 88 ALA 89 HIS 90 PRO 91 LYS 92 LEU 93 ILE 94 GLY 95 GLU 96 ARG 97 LEU 98 ARG 99 GLU 100 ARG 101 GLY 102 TYR 103 ASP 104 ARG 105 GLU 106 LYS 107 ILE 108 GLY 109 GLU 110 ASN 111 VAL 112 GLU 113 ALA 114 GLU 115 LEU 116 VAL 117 ASP 118 ALA 119 VAL 120 LEU 121 ILE 122 GLU 123 ALA 124 ILE 125 GLU 126 GLU 127 HIS 128 GLU 129 ASN 130 VAL 131 ILE 132 GLU 133 VAL 134 ASP 135 THR 136 THR 137 ASN 138 LYS 139 SER 140 PRO 141 GLU 142 ASP 143 VAL 144 VAL 145 GLU 146 GLU 147 ILE 148 VAL 149 SER 150 LEU 151 ILE 152 ASN 153 SER 154 GLY 155 ILE 156 LYS 157 LYS 158 ARG 159 VAL 160 GLY 161 ILE 162 VAL 163 ASP 164 TRP 165 SER 166 GLU 167 VAL 168 TYR 169 ASP 170 GLU 171 ILE 172 ILE 173 PRO 174 TYR 175 LEU 176 ARG 177 LEU 178 GLY 179 GLY 180 GLU stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-10-14 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 DBJ BAA30356 "180aa long hypothetical protein [Pyrococcus horikoshii OT3]" 100.00 180 100.00 100.00 3.63e-121 REF WP_010885344 "kinase [Pyrococcus horikoshii]" 100.00 180 100.00 100.00 3.63e-121 SP O58998 "RecName: Full=Putative adenylate kinase; Short=AK; AltName: Full=ATP-AMP transphosphorylase" 100.00 180 100.00 100.00 3.63e-121 stop_ save_ ############# # Ligands # ############# save_AP5 _Saveframe_category ligand _Mol_type non-polymer _Name_common "AP5 (BIS(ADENOSINE)-5'-PENTAPHOSPHATE)" _BMRB_code . _PDB_code AP5 _Molecular_mass 916.367 _Mol_charge 0 _Mol_paramagnetic . _Mol_aromatic yes _Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Mon Nov 7 13:51:45 2011 ; loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons PA PA P . 0 . ? O1A O1A O . 0 . ? O2A O2A O . 0 . ? O3A O3A O . 0 . ? PB PB P . 0 . ? O1B O1B O . 0 . ? O2B O2B O . 0 . ? O3B O3B O . 0 . ? PG PG P . 0 . ? O1G O1G O . 0 . ? O2G O2G O . 0 . ? O3G O3G O . 0 . ? PD PD P . 0 . ? O1D O1D O . 0 . ? O2D O2D O . 0 . ? O3D O3D O . 0 . ? PE PE P . 0 . ? O1E O1E O . 0 . ? O2E O2E O . 0 . ? O5F O5F O . 0 . ? C5F C5F C . 0 . ? C4F C4F C . 0 . ? O4F O4F O . 0 . ? C3F C3F C . 0 . ? O3F O3F O . 0 . ? C2F C2F C . 0 . ? O2F O2F O . 0 . ? C1F C1F C . 0 . ? N9A N9A N . 0 . ? C8A C8A C . 0 . ? N7A N7A N . 0 . ? C5A C5A C . 0 . ? C6A C6A C . 0 . ? N6A N6A N . 0 . ? N1A N1A N . 0 . ? C2A C2A C . 0 . ? N3A N3A N . 0 . ? C4A C4A C . 0 . ? O5J O5J O . 0 . ? C5J C5J C . 0 . ? C4J C4J C . 0 . ? O4J O4J O . 0 . ? C3J C3J C . 0 . ? O3J O3J O . 0 . ? C2J C2J C . 0 . ? O2J O2J O . 0 . ? C1J C1J C . 0 . ? N9B N9B N . 0 . ? C8B C8B C . 0 . ? N7B N7B N . 0 . ? C5B C5B C . 0 . ? C6B C6B C . 0 . ? N6B N6B N . 0 . ? N1B N1B N . 0 . ? C2B C2B C . 0 . ? N3B N3B N . 0 . ? C4B C4B C . 0 . ? HOA2 HOA2 H . 0 . ? HOB2 HOB2 H . 0 . ? HOG2 HOG2 H . 0 . ? HOD2 HOD2 H . 0 . ? HOE2 HOE2 H . 0 . ? H51A H51A H . 0 . ? H52A H52A H . 0 . ? H4F H4F H . 0 . ? H3F H3F H . 0 . ? HO3A HO3A H . 0 . ? H2F H2F H . 0 . ? HO2A HO2A H . 0 . ? H1F H1F H . 0 . ? H8A H8A H . 0 . ? H61A H61A H . 0 . ? H62A H62A H . 0 . ? H2A H2A H . 0 . ? H51B H51B H . 0 . ? H52B H52B H . 0 . ? H4J H4J H . 0 . ? H3J H3J H . 0 . ? HO3B HO3B H . 0 . ? H2J H2J H . 0 . ? HO2B HO2B H . 0 . ? H1J H1J H . 0 . ? H8B H8B H . 0 . ? H61B H61B H . 0 . ? H62B H62B H . 0 . ? H2B H2B H . 0 . ? stop_ loop_ _Bond_order _Bond_atom_one_atom_name _Bond_atom_two_atom_name _PDB_bond_atom_one_atom_name _PDB_bond_atom_two_atom_name DOUB PA O1A ? ? SING PA O2A ? ? SING PA O3A ? ? SING PA O5F ? ? SING O2A HOA2 ? ? SING O3A PB ? ? DOUB PB O1B ? ? SING PB O2B ? ? SING PB O3B ? ? SING O2B HOB2 ? ? SING O3B PG ? ? DOUB PG O1G ? ? SING PG O2G ? ? SING PG O3G ? ? SING O2G HOG2 ? ? SING O3G PD ? ? DOUB PD O1D ? ? SING PD O2D ? ? SING PD O3D ? ? SING O2D HOD2 ? ? SING O3D PE ? ? DOUB PE O1E ? ? SING PE O2E ? ? SING PE O5J ? ? SING O2E HOE2 ? ? SING O5F C5F ? ? SING C5F C4F ? ? SING C5F H51A ? ? SING C5F H52A ? ? SING C4F O4F ? ? SING C4F C3F ? ? SING C4F H4F ? ? SING O4F C1F ? ? SING C3F O3F ? ? SING C3F C2F ? ? SING C3F H3F ? ? SING O3F HO3A ? ? SING C2F O2F ? ? SING C2F C1F ? ? SING C2F H2F ? ? SING O2F HO2A ? ? SING C1F N9A ? ? SING C1F H1F ? ? SING N9A C8A ? ? SING N9A C4A ? ? DOUB C8A N7A ? ? SING C8A H8A ? ? SING N7A C5A ? ? SING C5A C6A ? ? DOUB C5A C4A ? ? SING C6A N6A ? ? DOUB C6A N1A ? ? SING N6A H61A ? ? SING N6A H62A ? ? SING N1A C2A ? ? DOUB C2A N3A ? ? SING C2A H2A ? ? SING N3A C4A ? ? SING O5J C5J ? ? SING C5J C4J ? ? SING C5J H51B ? ? SING C5J H52B ? ? SING C4J O4J ? ? SING C4J C3J ? ? SING C4J H4J ? ? SING O4J C1J ? ? SING C3J O3J ? ? SING C3J C2J ? ? SING C3J H3J ? ? SING O3J HO3B ? ? SING C2J O2J ? ? SING C2J C1J ? ? SING C2J H2J ? ? SING O2J HO2B ? ? SING C1J N9B ? ? SING C1J H1J ? ? SING N9B C8B ? ? SING N9B C4B ? ? DOUB C8B N7B ? ? SING C8B H8B ? ? SING N7B C5B ? ? SING C5B C6B ? ? DOUB C5B C4B ? ? SING C6B N6B ? ? DOUB C6B N1B ? ? SING N6B H61B ? ? SING N6B H62B ? ? SING N1B C2B ? ? DOUB C2B N3B ? ? SING C2B H2B ? ? SING N3B C4B ? ? 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 _Details $Fap7 'Pyrococcus horikoshii' 53953 Archaea . Pyrococcus horikoshii 'synthetic gene based on P. horikoshii sequence' 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 $Fap7 'recombinant technology' . Escherichia coli BL21DE3 pET21a stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details 'Fap7 in 50mM BisTris pH6.5, 50mM NaCl' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Fap7 250 uM '[U-100% 13C; U-100% 15N; U-80% 2H]' BisTris 50 mM 'natural abundance' NaCl 50 mM 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' $AP5 2.5 mM 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details 'Fap7 in 50mM BisTris pH6.5, 50mM NaCl' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Fap7 250 uM '[U-100% 13C-Pro; U-100% 15N-Lys]' BisTris 50 mM 'natural abundance' NaCl 50 mM 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' $AP5 2.5 mM 'natural abundance' stop_ save_ save_sample_3 _Saveframe_category sample _Sample_type solution _Details 'Fap7 in 50mM BisTris pH6.5, 50mM NaCl' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Fap7 250 uM '[U-100% 13C-Pro; U-100% 15N-Tyr]' BisTris 50 mM 'natural abundance' NaCl 50 mM 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' $AP5 2.5 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version 2.1 loop_ _Vendor _Address _Electronic_address BRUKER . . stop_ loop_ _Task collection processing stop_ _Details . save_ save_CARA _Saveframe_category software _Name CARA _Version . loop_ _Vendor _Address _Electronic_address 'Keller and Wuthrich' . www.nmr.ch stop_ loop_ _Task 'chemical shift assignment' 'peak picking' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 950 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 900 _Details . save_ save_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_2D_1H-15N_HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_2 save_ save_2D_1H-15N_HSQC_3 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_3 save_ save_3D_HNCO_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HNCACB_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HN(CO)CA_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details ; same conditions used for all samples; Fap7 in 50mM BisTris pH6.5, 50mM NaCl, 2.5mM AP5A ; loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0.05 . M pH 6.5 . pH pressure 1 . atm temperature 305 . 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 DSS C 13 'methyl protons' ppm 0.00 na indirect . 'separate tube (no insert) similar to the experimental sample tube' . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . 'separate tube (no insert) similar to the experimental sample tube' . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 na indirect . 'separate tube (no insert) similar to the experimental sample tube' . 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 HNCO' '3D HNCA' '3D HNCACB' '3D HN(CO)CA' 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 Fap7 _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 2 2 LEU H H 10.028 0.020 1 2 2 2 LEU C C 173.684 0.3 1 3 2 2 LEU CA C 50.601 0.3 1 4 2 2 LEU N N 126.512 0.3 1 5 3 3 ILE H H 8.866 0.020 1 6 3 3 ILE C C 172.224 0.3 1 7 3 3 ILE CA C 56.734 0.3 1 8 3 3 ILE N N 125.572 0.3 1 9 4 4 ALA H H 8.948 0.020 1 10 4 4 ALA C C 172.847 0.3 1 11 4 4 ALA CA C 47.595 0.3 1 12 4 4 ALA N N 128.686 0.3 1 13 5 5 ILE H H 8.508 0.020 1 14 5 5 ILE C C 172.164 0.3 1 15 5 5 ILE CA C 55.554 0.3 1 16 5 5 ILE N N 122.591 0.3 1 17 7 7 GLY H H 7.888 0.020 1 18 7 7 GLY C C 169.753 0.3 1 19 7 7 GLY CA C 40.976 0.3 1 20 7 7 GLY N N 108.725 0.3 1 21 8 8 THR H H 9.177 0.020 1 22 8 8 THR C C 169.123 0.3 1 23 8 8 THR CA C 59.619 0.3 1 24 8 8 THR N N 123.065 0.3 1 25 16 16 VAL C C 173.856 0.3 1 26 16 16 VAL CA C 64.128 0.3 1 27 17 17 ALA H H 8.890 0.020 1 28 17 17 ALA C C 176.523 0.3 1 29 17 17 ALA CA C 52.890 0.3 1 30 17 17 ALA N N 121.219 0.3 1 31 18 18 LYS H H 8.438 0.020 1 32 18 18 LYS C C 177.587 0.3 1 33 18 18 LYS CA C 57.216 0.3 1 34 18 18 LYS N N 116.197 0.3 1 35 19 19 LEU H H 7.712 0.020 1 36 19 19 LEU C C 176.771 0.3 1 37 19 19 LEU CA C 54.496 0.3 1 38 19 19 LEU N N 120.494 0.3 1 39 20 20 LEU H H 9.110 0.020 1 40 20 20 LEU C C 175.075 0.3 1 41 20 20 LEU CA C 54.666 0.3 1 42 20 20 LEU N N 122.437 0.3 1 43 21 21 ALA H H 8.219 0.020 1 44 21 21 ALA C C 176.790 0.3 1 45 21 21 ALA CA C 53.129 0.3 1 46 21 21 ALA N N 119.910 0.3 1 47 22 22 LYS H H 7.432 0.020 1 48 22 22 LYS C C 176.960 0.3 1 49 22 22 LYS CA C 56.101 0.3 1 50 22 22 LYS N N 116.566 0.3 1 51 23 23 LYS H H 8.222 0.020 1 52 23 23 LYS C C 175.807 0.3 1 53 23 23 LYS CA C 55.134 0.3 1 54 23 23 LYS N N 120.365 0.3 1 55 24 24 LEU H H 7.842 0.020 1 56 24 24 LEU C C 174.239 0.3 1 57 24 24 LEU CA C 51.506 0.3 1 58 24 24 LEU N N 115.088 0.3 1 59 25 25 ASN H H 7.935 0.020 1 60 25 25 ASN C C 172.495 0.3 1 61 25 25 ASN CA C 51.729 0.3 1 62 25 25 ASN N N 116.930 0.3 1 63 26 26 TYR H H 8.977 0.020 1 64 26 26 TYR C C 172.855 0.3 1 65 26 26 TYR CA C 51.501 0.3 1 66 26 26 TYR N N 120.887 0.3 1 67 27 27 GLU H H 8.131 0.020 1 68 27 27 GLU C C 173.119 0.3 1 69 27 27 GLU CA C 53.661 0.3 1 70 27 27 GLU N N 119.798 0.3 1 71 28 28 TYR H H 8.722 0.020 1 72 28 28 TYR C C 171.481 0.3 1 73 28 28 TYR CA C 55.065 0.3 1 74 28 28 TYR N N 125.685 0.3 1 75 29 29 VAL H H 8.324 0.020 1 76 29 29 VAL C C 171.107 0.3 1 77 29 29 VAL CA C 57.843 0.3 1 78 29 29 VAL N N 129.949 0.3 1 79 30 30 SER H H 8.507 0.020 1 80 30 30 SER C C 173.342 0.3 1 81 30 30 SER CA C 52.685 0.3 1 82 30 30 SER N N 122.608 0.3 1 83 31 31 LEU H H 8.537 0.020 1 84 31 31 LEU C C 175.495 0.3 1 85 31 31 LEU CA C 55.712 0.3 1 86 31 31 LEU N N 131.443 0.3 1 87 32 32 LYS H H 8.629 0.020 1 88 32 32 LYS C C 174.512 0.3 1 89 32 32 LYS CA C 56.990 0.3 1 90 32 32 LYS N N 118.176 0.3 1 91 33 33 ASP H H 7.215 0.020 1 92 33 33 ASP C C 176.057 0.3 1 93 33 33 ASP CA C 54.492 0.3 1 94 33 33 ASP N N 119.204 0.3 1 95 34 34 PHE H H 8.688 0.020 1 96 34 34 PHE C C 174.264 0.3 1 97 34 34 PHE CA C 58.310 0.3 1 98 34 34 PHE N N 123.308 0.3 1 99 35 35 ALA H H 8.539 0.020 1 100 35 35 ALA C C 177.643 0.3 1 101 35 35 ALA CA C 51.761 0.3 1 102 35 35 ALA N N 119.507 0.3 1 103 36 36 LEU H H 7.654 0.020 1 104 36 36 LEU C C 177.680 0.3 1 105 36 36 LEU CA C 54.769 0.3 1 106 36 36 LEU N N 117.337 0.3 1 107 37 37 GLU H H 8.155 0.020 1 108 37 37 GLU C C 176.014 0.3 1 109 37 37 GLU CA C 56.031 0.3 1 110 37 37 GLU N N 121.074 0.3 1 111 38 38 LYS H H 7.779 0.020 1 112 38 38 LYS C C 174.372 0.3 1 113 38 38 LYS CA C 51.222 0.3 1 114 38 38 LYS N N 114.623 0.3 1 115 39 39 GLY H H 7.528 0.020 1 116 39 39 GLY C C 171.574 0.3 1 117 39 39 GLY CA C 42.927 0.3 1 118 39 39 GLY N N 106.134 0.3 1 119 40 40 CYS H H 8.078 0.020 1 120 40 40 CYS C C 170.081 0.3 1 121 40 40 CYS CA C 53.330 0.3 1 122 40 40 CYS N N 114.886 0.3 1 123 41 41 GLY H H 7.377 0.020 1 124 41 41 GLY C C 168.525 0.3 1 125 41 41 GLY CA C 41.792 0.3 1 126 41 41 GLY N N 107.708 0.3 1 127 42 42 ARG H H 8.679 0.020 1 128 42 42 ARG C C 171.594 0.3 1 129 42 42 ARG CA C 51.622 0.3 1 130 42 42 ARG N N 119.587 0.3 1 131 43 43 ARG H H 8.775 0.020 1 132 43 43 ARG C C 173.300 0.3 1 133 43 43 ARG CA C 53.082 0.3 1 134 43 43 ARG N N 124.024 0.3 1 135 44 44 VAL H H 8.692 0.020 1 136 44 44 VAL C C 173.093 0.3 1 137 44 44 VAL CA C 58.793 0.3 1 138 44 44 VAL N N 127.464 0.3 1 139 45 45 ASN H H 9.084 0.020 1 140 45 45 ASN C C 171.780 0.3 1 141 45 45 ASN CA C 52.436 0.3 1 142 45 45 ASN N N 124.995 0.3 1 143 46 46 ASP H H 8.578 0.020 1 144 46 46 ASP C C 172.591 0.3 1 145 46 46 ASP CA C 52.347 0.3 1 146 46 46 ASP N N 119.803 0.3 1 147 47 47 GLU H H 8.100 0.020 1 148 47 47 GLU C C 172.881 0.3 1 149 47 47 GLU CA C 51.831 0.3 1 150 47 47 GLU N N 120.747 0.3 1 151 48 48 VAL H H 8.518 0.020 1 152 48 48 VAL C C 172.847 0.3 1 153 48 48 VAL CA C 58.629 0.3 1 154 48 48 VAL N N 121.454 0.3 1 155 49 49 GLU H H 8.916 0.020 1 156 49 49 GLU C C 173.309 0.3 1 157 49 49 GLU CA C 52.158 0.3 1 158 49 49 GLU N N 128.883 0.3 1 159 50 50 VAL H H 8.473 0.020 1 160 50 50 VAL C C 171.942 0.3 1 161 50 50 VAL CA C 57.085 0.3 1 162 50 50 VAL N N 120.599 0.3 1 163 51 51 GLU H H 8.225 0.020 1 164 51 51 GLU C C 174.036 0.3 1 165 51 51 GLU CA C 51.911 0.3 1 166 51 51 GLU N N 126.009 0.3 1 167 52 52 ILE H H 8.374 0.020 1 168 52 52 ILE C C 174.071 0.3 1 169 52 52 ILE CA C 61.869 0.3 1 170 52 52 ILE N N 126.580 0.3 1 171 53 53 ASP H H 8.624 0.020 1 172 53 53 ASP C C 176.645 0.3 1 173 53 53 ASP CA C 54.188 0.3 1 174 53 53 ASP N N 119.041 0.3 1 175 54 54 GLU H H 7.566 0.020 1 176 54 54 GLU C C 175.563 0.3 1 177 54 54 GLU CA C 55.792 0.3 1 178 54 54 GLU N N 121.062 0.3 1 179 55 55 LEU H H 8.249 0.020 1 180 55 55 LEU C C 175.755 0.3 1 181 55 55 LEU CA C 55.759 0.3 1 182 55 55 LEU N N 120.480 0.3 1 183 56 56 ALA H H 8.410 0.020 1 184 56 56 ALA C C 176.879 0.3 1 185 56 56 ALA CA C 52.958 0.3 1 186 56 56 ALA N N 120.109 0.3 1 187 57 57 TYR H H 7.561 0.020 1 188 57 57 TYR C C 175.422 0.3 1 189 57 57 TYR CA C 57.926 0.3 1 190 57 57 TYR N N 118.744 0.3 1 191 58 58 PHE H H 8.229 0.020 1 192 58 58 PHE C C 176.356 0.3 1 193 58 58 PHE CA C 59.927 0.3 1 194 58 58 PHE N N 118.565 0.3 1 195 59 59 ILE H H 8.803 0.020 1 196 59 59 ILE C C 175.081 0.3 1 197 59 59 ILE CA C 60.307 0.3 1 198 59 59 ILE N N 121.595 0.3 1 199 60 60 GLU H H 8.148 0.020 1 200 60 60 GLU C C 175.397 0.3 1 201 60 60 GLU CA C 56.545 0.3 1 202 60 60 GLU N N 119.929 0.3 1 203 61 61 ARG H H 7.826 0.020 1 204 61 61 ARG C C 176.033 0.3 1 205 61 61 ARG CA C 55.452 0.3 1 206 61 61 ARG N N 115.408 0.3 1 207 62 62 GLU H H 8.461 0.020 1 208 62 62 GLU C C 175.697 0.3 1 209 62 62 GLU CA C 54.803 0.3 1 210 62 62 GLU N N 114.500 0.3 1 211 63 63 LEU H H 8.142 0.020 1 212 63 63 LEU C C 173.600 0.3 1 213 63 63 LEU CA C 51.387 0.3 1 214 63 63 LEU N N 116.689 0.3 1 215 64 64 LYS H H 7.008 0.020 1 216 64 64 LYS C C 175.206 0.3 1 217 64 64 LYS CA C 55.759 0.3 1 218 64 64 LYS N N 120.128 0.3 1 219 65 65 GLY H H 8.670 0.020 1 220 65 65 GLY C C 171.651 0.3 1 221 65 65 GLY CA C 42.335 0.3 1 222 65 65 GLY N N 113.316 0.3 1 223 66 66 LYS H H 7.904 0.020 1 224 66 66 LYS C C 172.213 0.3 1 225 66 66 LYS CA C 51.865 0.3 1 226 66 66 LYS N N 120.419 0.3 1 227 67 67 ASN H H 7.966 0.020 1 228 67 67 ASN C C 171.554 0.3 1 229 67 67 ASN CA C 48.210 0.3 1 230 67 67 ASN N N 118.688 0.3 1 231 68 68 ALA H H 8.208 0.020 1 232 68 68 ALA C C 171.692 0.3 1 233 68 68 ALA CA C 48.000 0.3 1 234 68 68 ALA N N 125.624 0.3 1 235 69 69 VAL H H 8.994 0.020 1 236 69 69 VAL C C 170.664 0.3 1 237 69 69 VAL CA C 57.877 0.3 1 238 69 69 VAL N N 122.094 0.3 1 239 70 70 LEU H H 9.514 0.020 1 240 70 70 LEU C C 170.668 0.3 1 241 70 70 LEU CA C 50.473 0.3 1 242 70 70 LEU N N 126.767 0.3 1 243 71 71 ASP H H 8.426 0.020 1 244 71 71 ASP C C 174.819 0.3 1 245 71 71 ASP CA C 49.214 0.3 1 246 71 71 ASP N N 122.300 0.3 1 247 79 79 PRO C C 172.208 0.3 1 248 79 79 PRO CA C 59.952 0.3 1 249 80 80 VAL H H 7.799 0.020 1 250 80 80 VAL C C 171.759 0.3 1 251 80 80 VAL CA C 56.801 0.3 1 252 80 80 VAL N N 114.158 0.3 1 253 81 81 ASP H H 8.399 0.020 1 254 81 81 ASP C C 173.271 0.3 1 255 81 81 ASP CA C 53.676 0.3 1 256 81 81 ASP N N 117.871 0.3 1 257 82 82 LEU H H 7.593 0.020 1 258 82 82 LEU C C 171.029 0.3 1 259 82 82 LEU CA C 51.694 0.3 1 260 82 82 LEU N N 120.128 0.3 1 261 83 83 VAL H H 8.591 0.020 1 262 83 83 VAL C C 170.830 0.3 1 263 83 83 VAL CA C 57.669 0.3 1 264 83 83 VAL N N 125.334 0.3 1 265 84 84 VAL H H 9.393 0.020 1 266 84 84 VAL C C 171.932 0.3 1 267 84 84 VAL CA C 57.222 0.3 1 268 84 84 VAL N N 128.758 0.3 1 269 85 85 VAL H H 9.055 0.020 1 270 85 85 VAL C C 172.372 0.3 1 271 85 85 VAL CA C 57.399 0.3 1 272 85 85 VAL N N 127.470 0.3 1 273 86 86 LEU H H 8.556 0.020 1 274 86 86 LEU C C 173.177 0.3 1 275 86 86 LEU CA C 50.772 0.3 1 276 86 86 LEU N N 126.679 0.3 1 277 87 87 ARG H H 9.037 0.020 1 278 87 87 ARG C C 174.632 0.3 1 279 87 87 ARG CA C 48.426 0.3 1 280 87 87 ARG N N 118.648 0.3 1 281 88 88 ALA H H 8.517 0.020 1 282 88 88 ALA C C 170.601 0.3 1 283 88 88 ALA CA C 49.294 0.3 1 284 88 88 ALA N N 123.782 0.3 1 285 89 89 HIS H H 7.714 0.020 1 286 89 89 HIS C C 173.468 0.3 1 287 89 89 HIS CA C 51.281 0.3 1 288 89 89 HIS N N 122.472 0.3 1 289 90 90 PRO C C 174.593 0.3 1 290 90 90 PRO CA C 62.389 0.3 1 291 91 91 LYS H H 10.545 0.020 1 292 91 91 LYS C C 175.237 0.3 1 293 91 91 LYS CA C 56.282 0.3 1 294 91 91 LYS N N 119.822 0.3 1 295 92 92 LEU H H 7.680 0.020 1 296 92 92 LEU C C 177.039 0.3 1 297 92 92 LEU CA C 54.120 0.3 1 298 92 92 LEU N N 120.030 0.3 1 299 93 93 ILE H H 6.789 0.020 1 300 93 93 ILE C C 174.941 0.3 1 301 93 93 ILE CA C 60.952 0.3 1 302 93 93 ILE N N 118.078 0.3 1 303 94 94 GLY H H 7.811 0.020 1 304 94 94 GLY C C 172.518 0.3 1 305 94 94 GLY CA C 44.521 0.3 1 306 94 94 GLY N N 105.124 0.3 1 307 95 95 GLU H H 7.951 0.020 1 308 95 95 GLU C C 177.097 0.3 1 309 95 95 GLU CA C 56.076 0.3 1 310 95 95 GLU N N 119.985 0.3 1 311 96 96 ARG H H 8.342 0.020 1 312 96 96 ARG C C 177.420 0.3 1 313 96 96 ARG CA C 56.383 0.3 1 314 96 96 ARG N N 120.280 0.3 1 315 97 97 LEU H H 8.404 0.020 1 316 97 97 LEU C C 176.898 0.3 1 317 97 97 LEU CA C 54.299 0.3 1 318 97 97 LEU N N 117.821 0.3 1 319 98 98 ARG H H 8.222 0.020 1 320 98 98 ARG C C 178.575 0.3 1 321 98 98 ARG CA C 57.028 0.3 1 322 98 98 ARG N N 122.068 0.3 1 323 99 99 GLU H H 7.974 0.020 1 324 99 99 GLU C C 175.374 0.3 1 325 99 99 GLU CA C 56.022 0.3 1 326 99 99 GLU N N 121.244 0.3 1 327 100 100 ARG H H 7.357 0.020 1 328 100 100 ARG C C 173.918 0.3 1 329 100 100 ARG CA C 53.554 0.3 1 330 100 100 ARG N N 116.465 0.3 1 331 101 101 GLY H H 7.828 0.020 1 332 101 101 GLY C C 172.624 0.3 1 333 101 101 GLY CA C 42.466 0.3 1 334 101 101 GLY N N 106.293 0.3 1 335 102 102 TYR H H 7.591 0.020 1 336 102 102 TYR C C 172.710 0.3 1 337 102 102 TYR CA C 54.254 0.3 1 338 102 102 TYR N N 120.639 0.3 1 339 103 103 ASP H H 8.362 0.020 1 340 103 103 ASP C C 173.990 0.3 1 341 103 103 ASP CA C 50.533 0.3 1 342 103 103 ASP N N 119.065 0.3 1 343 104 104 ARG H H 8.635 0.020 1 344 104 104 ARG C C 176.454 0.3 1 345 104 104 ARG CA C 56.934 0.3 1 346 104 104 ARG N N 119.942 0.3 1 347 105 105 GLU H H 8.807 0.020 1 348 105 105 GLU C C 176.176 0.3 1 349 105 105 GLU CA C 56.836 0.3 1 350 105 105 GLU N N 120.974 0.3 1 351 106 106 LYS H H 7.914 0.020 1 352 106 106 LYS C C 177.570 0.3 1 353 106 106 LYS CA C 55.185 0.3 1 354 106 106 LYS N N 121.262 0.3 1 355 107 107 ILE H H 8.461 0.020 1 356 107 107 ILE C C 175.618 0.3 1 357 107 107 ILE CA C 64.016 0.3 1 358 107 107 ILE N N 120.202 0.3 1 359 108 108 GLY H H 8.184 0.020 1 360 108 108 GLY C C 173.441 0.3 1 361 108 108 GLY CA C 44.944 0.3 1 362 108 108 GLY N N 106.177 0.3 1 363 109 109 GLU H H 8.130 0.020 1 364 109 109 GLU C C 176.677 0.3 1 365 109 109 GLU CA C 56.293 0.3 1 366 109 109 GLU N N 120.801 0.3 1 367 110 110 ASN H H 7.534 0.020 1 368 110 110 ASN C C 173.607 0.3 1 369 110 110 ASN CA C 53.967 0.3 1 370 110 110 ASN N N 118.849 0.3 1 371 111 111 VAL H H 8.687 0.020 1 372 111 111 VAL C C 175.369 0.3 1 373 111 111 VAL CA C 64.743 0.3 1 374 111 111 VAL N N 122.262 0.3 1 375 112 112 GLU H H 8.217 0.020 1 376 112 112 GLU C C 174.681 0.3 1 377 112 112 GLU CA C 56.750 0.3 1 378 112 112 GLU N N 118.724 0.3 1 379 113 113 ALA H H 7.926 0.020 1 380 113 113 ALA C C 179.724 0.3 1 381 113 113 ALA CA C 52.036 0.3 1 382 113 113 ALA N N 119.624 0.3 1 383 114 114 GLU H H 8.213 0.020 1 384 114 114 GLU C C 176.239 0.3 1 385 114 114 GLU CA C 56.084 0.3 1 386 114 114 GLU N N 121.106 0.3 1 387 115 115 LEU H H 8.085 0.020 1 388 115 115 LEU C C 175.470 0.3 1 389 115 115 LEU CA C 56.135 0.3 1 390 115 115 LEU N N 121.482 0.3 1 391 116 116 VAL H H 7.947 0.020 1 392 116 116 VAL C C 173.086 0.3 1 393 116 116 VAL CA C 57.502 0.3 1 394 116 116 VAL N N 108.485 0.3 1 395 117 117 ASP H H 7.732 0.020 1 396 117 117 ASP C C 173.484 0.3 1 397 117 117 ASP CA C 51.884 0.3 1 398 117 117 ASP N N 116.015 0.3 1 399 118 118 ALA H H 7.989 0.020 1 400 118 118 ALA C C 177.964 0.3 1 401 118 118 ALA CA C 54.325 0.3 1 402 118 118 ALA N N 117.889 0.3 1 403 119 119 VAL H H 8.691 0.020 1 404 119 119 VAL C C 174.391 0.3 1 405 119 119 VAL CA C 63.480 0.3 1 406 119 119 VAL N N 117.505 0.3 1 407 120 120 LEU H H 7.856 0.020 1 408 120 120 LEU C C 175.223 0.3 1 409 120 120 LEU CA C 55.691 0.3 1 410 120 120 LEU N N 120.843 0.3 1 411 121 121 ILE H H 8.381 0.020 1 412 121 121 ILE C C 175.987 0.3 1 413 121 121 ILE CA C 62.089 0.3 1 414 121 121 ILE N N 116.858 0.3 1 415 122 122 GLU H H 7.628 0.020 1 416 122 122 GLU C C 176.593 0.3 1 417 122 122 GLU CA C 56.340 0.3 1 418 122 122 GLU N N 119.558 0.3 1 419 123 123 ALA H H 8.753 0.020 1 420 123 123 ALA C C 176.260 0.3 1 421 123 123 ALA CA C 53.129 0.3 1 422 123 123 ALA N N 120.806 0.3 1 423 124 124 ILE H H 8.478 0.020 1 424 124 124 ILE C C 175.337 0.3 1 425 124 124 ILE CA C 60.610 0.3 1 426 124 124 ILE N N 115.172 0.3 1 427 125 125 GLU H H 7.744 0.020 1 428 125 125 GLU C C 175.390 0.3 1 429 125 125 GLU CA C 55.338 0.3 1 430 125 125 GLU N N 119.407 0.3 1 431 126 126 GLU H H 7.419 0.020 1 432 126 126 GLU C C 173.789 0.3 1 433 126 126 GLU CA C 53.639 0.3 1 434 126 126 GLU N N 116.256 0.3 1 435 127 127 HIS H H 8.320 0.020 1 436 127 127 HIS C C 170.366 0.3 1 437 127 127 HIS CA C 51.826 0.3 1 438 127 127 HIS N N 116.340 0.3 1 439 128 128 GLU H H 8.368 0.020 1 440 128 128 GLU C C 174.796 0.3 1 441 128 128 GLU CA C 55.022 0.3 1 442 128 128 GLU N N 119.150 0.3 1 443 129 129 ASN H H 8.101 0.020 1 444 129 129 ASN C C 170.716 0.3 1 445 129 129 ASN CA C 49.782 0.3 1 446 129 129 ASN N N 117.952 0.3 1 447 130 130 VAL H H 6.989 0.020 1 448 130 130 VAL C C 171.297 0.3 1 449 130 130 VAL CA C 57.194 0.3 1 450 130 130 VAL N N 124.159 0.3 1 451 131 131 ILE H H 9.296 0.020 1 452 131 131 ILE C C 170.259 0.3 1 453 131 131 ILE CA C 57.002 0.3 1 454 131 131 ILE N N 125.231 0.3 1 455 132 132 GLU H H 9.006 0.020 1 456 132 132 GLU C C 173.136 0.3 1 457 132 132 GLU CA C 51.250 0.3 1 458 132 132 GLU N N 130.003 0.3 1 459 133 133 VAL H H 8.622 0.020 1 460 133 133 VAL C C 171.045 0.3 1 461 133 133 VAL CA C 58.287 0.3 1 462 133 133 VAL N N 124.692 0.3 1 463 134 134 ASP H H 9.558 0.020 1 464 134 134 ASP C C 173.827 0.3 1 465 134 134 ASP CA C 50.606 0.3 1 466 134 134 ASP N N 127.412 0.3 1 467 135 135 THR H H 8.837 0.020 1 468 135 135 THR C C 171.947 0.3 1 469 135 135 THR CA C 59.775 0.3 1 470 135 135 THR N N 118.021 0.3 1 471 140 140 PRO C C 175.523 0.3 1 472 140 140 PRO CA C 62.956 0.3 1 473 141 141 GLU H H 8.800 0.020 1 474 141 141 GLU C C 176.396 0.3 1 475 141 141 GLU CA C 57.777 0.3 1 476 141 141 GLU N N 115.958 0.3 1 477 142 142 ASP H H 7.896 0.020 1 478 142 142 ASP C C 177.154 0.3 1 479 142 142 ASP CA C 54.393 0.3 1 480 142 142 ASP N N 121.602 0.3 1 481 143 143 VAL H H 8.120 0.020 1 482 143 143 VAL C C 174.988 0.3 1 483 143 143 VAL CA C 63.676 0.3 1 484 143 143 VAL N N 122.582 0.3 1 485 144 144 VAL H H 8.324 0.020 1 486 144 144 VAL C C 174.568 0.3 1 487 144 144 VAL CA C 64.755 0.3 1 488 144 144 VAL N N 119.444 0.3 1 489 145 145 GLU H H 8.080 0.020 1 490 145 145 GLU C C 176.548 0.3 1 491 145 145 GLU CA C 56.169 0.3 1 492 145 145 GLU N N 118.757 0.3 1 493 146 146 GLU H H 7.878 0.020 1 494 146 146 GLU C C 176.060 0.3 1 495 146 146 GLU CA C 56.750 0.3 1 496 146 146 GLU N N 122.241 0.3 1 497 147 147 ILE H H 8.193 0.020 1 498 147 147 ILE C C 174.930 0.3 1 499 147 147 ILE CA C 63.480 0.3 1 500 147 147 ILE N N 118.695 0.3 1 501 148 148 VAL H H 8.443 0.020 1 502 148 148 VAL CA C 64.129 0.3 1 503 148 148 VAL N N 118.048 0.3 1 504 149 149 SER H H 8.204 0.020 1 505 149 149 SER C C 174.990 0.3 1 506 149 149 SER CA C 58.834 0.3 1 507 149 149 SER N N 115.545 0.3 1 508 150 150 LEU H H 7.810 0.020 1 509 150 150 LEU C C 176.805 0.3 1 510 150 150 LEU CA C 55.486 0.3 1 511 150 150 LEU N N 123.398 0.3 1 512 151 151 ILE H H 8.376 0.020 1 513 151 151 ILE C C 178.517 0.3 1 514 151 151 ILE CA C 62.694 0.3 1 515 151 151 ILE N N 120.224 0.3 1 516 152 152 ASN H H 8.942 0.020 1 517 152 152 ASN C C 174.457 0.3 1 518 152 152 ASN CA C 52.241 0.3 1 519 152 152 ASN N N 119.783 0.3 1 520 153 153 SER H H 7.722 0.020 1 521 153 153 SER C C 171.771 0.3 1 522 153 153 SER CA C 56.301 0.3 1 523 153 153 SER N N 114.619 0.3 1 524 154 154 GLY H H 7.848 0.020 1 525 154 154 GLY C C 171.555 0.3 1 526 154 154 GLY CA C 42.642 0.3 1 527 154 154 GLY N N 109.356 0.3 1 528 155 155 ILE H H 7.696 0.020 1 529 155 155 ILE C C 172.120 0.3 1 530 155 155 ILE CA C 57.911 0.3 1 531 155 155 ILE N N 122.260 0.3 1 532 156 156 LYS H H 8.222 0.020 1 533 156 156 LYS C C 170.774 0.3 1 534 156 156 LYS CA C 52.689 0.3 1 535 156 156 LYS N N 124.161 0.3 1 536 157 157 LYS H H 6.998 0.020 1 537 157 157 LYS C C 172.995 0.3 1 538 157 157 LYS CA C 51.592 0.3 1 539 157 157 LYS N N 114.990 0.3 1 540 158 158 ARG H H 9.015 0.020 1 541 158 158 ARG C C 171.421 0.3 1 542 158 158 ARG CA C 54.256 0.3 1 543 158 158 ARG N N 129.347 0.3 1 544 159 159 VAL H H 8.798 0.020 1 545 159 159 VAL C C 173.113 0.3 1 546 159 159 VAL CA C 56.887 0.3 1 547 159 159 VAL N N 120.794 0.3 1 548 160 160 GLY H H 9.244 0.020 1 549 160 160 GLY C C 174.393 0.3 1 550 160 160 GLY CA C 42.999 0.3 1 551 160 160 GLY N N 112.364 0.3 1 552 161 161 ILE H H 8.225 0.020 1 553 161 161 ILE C C 173.090 0.3 1 554 161 161 ILE CA C 58.287 0.3 1 555 161 161 ILE N N 114.118 0.3 1 556 162 162 VAL H H 7.253 0.020 1 557 162 162 VAL C C 171.140 0.3 1 558 162 162 VAL CA C 57.228 0.3 1 559 162 162 VAL N N 117.626 0.3 1 560 163 163 ASP H H 7.724 0.020 1 561 163 163 ASP C C 174.026 0.3 1 562 163 163 ASP CA C 49.918 0.3 1 563 163 163 ASP N N 123.260 0.3 1 564 164 164 TRP H H 9.743 0.020 1 565 164 164 TRP C C 174.602 0.3 1 566 164 164 TRP CA C 52.617 0.3 1 567 164 164 TRP N N 125.486 0.3 1 568 165 165 SER H H 8.726 0.020 1 569 165 165 SER C C 174.625 0.3 1 570 165 165 SER CA C 59.845 0.3 1 571 165 165 SER N N 116.749 0.3 1 572 166 166 GLU H H 7.709 0.020 1 573 166 166 GLU C C 175.179 0.3 1 574 166 166 GLU CA C 54.905 0.3 1 575 166 166 GLU N N 119.073 0.3 1 576 167 167 VAL H H 7.838 0.020 1 577 167 167 VAL C C 173.396 0.3 1 578 167 167 VAL CA C 57.149 0.3 1 579 167 167 VAL N N 112.673 0.3 1 580 168 168 TYR H H 7.347 0.020 1 581 168 168 TYR C C 173.981 0.3 1 582 168 168 TYR CA C 59.278 0.3 1 583 168 168 TYR N N 122.683 0.3 1 584 169 169 ASP H H 8.717 0.020 1 585 169 169 ASP C C 175.620 0.3 1 586 169 169 ASP CA C 54.256 0.3 1 587 169 169 ASP N N 115.605 0.3 1 588 170 170 GLU H H 7.980 0.020 1 589 170 170 GLU C C 174.988 0.3 1 590 170 170 GLU CA C 54.632 0.3 1 591 170 170 GLU N N 115.731 0.3 1 592 171 171 ILE H H 7.793 0.020 1 593 171 171 ILE C C 173.279 0.3 1 594 171 171 ILE CA C 57.383 0.3 1 595 171 171 ILE N N 111.860 0.3 1 596 172 172 ILE H H 7.162 0.020 1 597 172 172 ILE C C 172.030 0.3 1 598 172 172 ILE CA C 63.142 0.3 1 599 172 172 ILE N N 122.432 0.3 1 600 173 173 PRO C C 174.755 0.3 1 601 173 173 PRO CA C 62.529 0.3 1 602 174 174 TYR H H 7.788 0.020 1 603 174 174 TYR C C 173.392 0.3 1 604 174 174 TYR CA C 55.774 0.3 1 605 174 174 TYR N N 113.133 0.3 1 606 175 175 LEU H H 7.568 0.020 1 607 175 175 LEU C C 174.708 0.3 1 608 175 175 LEU CA C 51.840 0.3 1 609 175 175 LEU N N 118.257 0.3 1 610 176 176 ARG H H 8.104 0.020 1 611 176 176 ARG C C 173.532 0.3 1 612 176 176 ARG CA C 53.027 0.3 1 613 176 176 ARG N N 119.775 0.3 1 614 177 177 LEU H H 8.180 0.020 1 615 177 177 LEU C C 175.297 0.3 1 616 177 177 LEU CA C 52.196 0.3 1 617 177 177 LEU N N 123.346 0.3 1 618 178 178 GLY H H 8.344 0.020 1 619 178 178 GLY C C 171.824 0.3 1 620 178 178 GLY CA C 42.318 0.3 1 621 178 178 GLY N N 109.467 0.3 1 622 179 179 GLY H H 8.138 0.020 1 623 179 179 GLY C C 170.635 0.3 1 624 179 179 GLY CA C 42.197 0.3 1 625 179 179 GLY N N 109.239 0.3 1 626 180 180 GLU H H 7.902 0.020 1 627 180 180 GLU C C 178.611 0.3 1 628 180 180 GLU CA C 55.059 0.3 1 629 180 180 GLU N N 125.912 0.3 1 stop_ save_