data_17350 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; SOLUTION STRUCTURE OF THE R2 DOMAIN OF TALIN ; _BMRB_accession_number 17350 _BMRB_flat_file_name bmr17350.str _Entry_type original _Submission_date 2010-12-07 _Accession_date 2010-12-07 _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 Goult Benjamin T. . 2 Gingras Alexandre R. . 3 Bate Neil . . 4 Roberts Gordon C.K. . 5 Barsukov Igor L. . 6 Critchley David R. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 131 "13C chemical shifts" 396 "15N chemical shifts" 131 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2013-02-04 original author . stop_ _Original_release_date 2013-02-04 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'RIAM and vinculin binding to talin are mutually exclusive and regulate adhesion assembly and turnover' _Citation_status accepted _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 Goult Benjamin T. . 2 Zacharchenko Tom . . 3 Bate Neil . . 4 Tsang Ricky . . 5 Hey Fiona . . 6 Gingras Alexandre R. . 7 Elliott Paul R. . 8 Roberts Gordon CK . 9 Ballestrem Christoph . . 10 Critchley David R. . 11 Barsukov Igor L. . stop_ _Journal_abbreviation 'J. Biol. Chem.' _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 bundle 'focal adhesion' riam talin vinculin stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name vbs2a _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label vbs2a $vbs2a stop_ _System_molecular_weight 14027 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_vbs2a _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common vbs2a _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 138 _Mol_residue_sequence ; GIDPFTIGESDTDPHFQDVL MQLANAVASAAAALVLKAKS VAQRTEDSGLQTQVIAAATQ CALSTSQLVACTKVVAPTIS SPVCQEQLVEAGRLVAKAVE GCVSASQAATEDGQLLRGVG AAATAVTQALNELLQHVK ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 ILE 3 ASP 4 PRO 5 PHE 6 THR 7 ILE 8 GLY 9 GLU 10 SER 11 ASP 12 THR 13 ASP 14 PRO 15 HIS 16 PHE 17 GLN 18 ASP 19 VAL 20 LEU 21 MET 22 GLN 23 LEU 24 ALA 25 ASN 26 ALA 27 VAL 28 ALA 29 SER 30 ALA 31 ALA 32 ALA 33 ALA 34 LEU 35 VAL 36 LEU 37 LYS 38 ALA 39 LYS 40 SER 41 VAL 42 ALA 43 GLN 44 ARG 45 THR 46 GLU 47 ASP 48 SER 49 GLY 50 LEU 51 GLN 52 THR 53 GLN 54 VAL 55 ILE 56 ALA 57 ALA 58 ALA 59 THR 60 GLN 61 CYS 62 ALA 63 LEU 64 SER 65 THR 66 SER 67 GLN 68 LEU 69 VAL 70 ALA 71 CYS 72 THR 73 LYS 74 VAL 75 VAL 76 ALA 77 PRO 78 THR 79 ILE 80 SER 81 SER 82 PRO 83 VAL 84 CYS 85 GLN 86 GLU 87 GLN 88 LEU 89 VAL 90 GLU 91 ALA 92 GLY 93 ARG 94 LEU 95 VAL 96 ALA 97 LYS 98 ALA 99 VAL 100 GLU 101 GLY 102 CYS 103 VAL 104 SER 105 ALA 106 SER 107 GLN 108 ALA 109 ALA 110 THR 111 GLU 112 ASP 113 GLY 114 GLN 115 LEU 116 LEU 117 ARG 118 GLY 119 VAL 120 GLY 121 ALA 122 ALA 123 ALA 124 THR 125 ALA 126 VAL 127 THR 128 GLN 129 ALA 130 LEU 131 ASN 132 GLU 133 LEU 134 LEU 135 GLN 136 HIS 137 VAL 138 LYS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-07-08 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 1SJ8 "Crystal Structure Of Talin Residues 482-789" 95.65 308 100.00 100.00 8.58e-82 DBJ BAA82979 "KIAA1027 protein [Homo sapiens]" 95.65 2550 98.48 98.48 1.19e-73 DBJ BAC65702 "mKIAA1027 protein [Mus musculus]" 95.65 2564 99.24 99.24 3.19e-74 DBJ BAE27781 "unnamed protein product [Mus musculus]" 95.65 2541 99.24 99.24 2.90e-74 DBJ BAG09941 "talin-1 [synthetic construct]" 95.65 2541 98.48 98.48 1.39e-73 EMBL CAA39588 "talin [Mus musculus]" 95.65 2541 100.00 100.00 4.15e-75 GB AAD13152 "talin [Homo sapiens]" 95.65 2541 98.48 98.48 1.10e-73 GB AAF23322 "talin [Homo sapiens]" 95.65 2541 98.48 98.48 1.38e-73 GB AAF27330 "talin [Homo sapiens]" 95.65 2540 98.48 98.48 1.39e-73 GB AAH42923 "Talin 1 [Homo sapiens]" 95.65 2541 98.48 98.48 1.35e-73 GB AAI50811 "Talin 1 [Mus musculus]" 95.65 2541 99.24 99.24 3.19e-74 PRF 1617167A talin 95.65 2541 100.00 100.00 4.15e-75 REF NP_001034114 "talin-1 [Rattus norvegicus]" 95.65 2541 98.48 99.24 4.27e-74 REF NP_001192357 "talin-1 [Bos taurus]" 95.65 2541 97.73 98.48 6.28e-73 REF NP_006280 "talin-1 [Homo sapiens]" 95.65 2541 98.48 98.48 1.39e-73 REF NP_035732 "talin-1 [Mus musculus]" 95.65 2541 99.24 99.24 3.19e-74 REF XP_001084941 "PREDICTED: talin-1 [Macaca mulatta]" 95.65 2428 99.24 99.24 3.09e-74 SP P26039 "RecName: Full=Talin-1" 95.65 2541 99.24 99.24 3.19e-74 SP Q9Y490 "RecName: Full=Talin-1" 95.65 2541 98.48 98.48 1.39e-73 TPG DAA26829 "TPA: talin 1 [Bos taurus]" 95.65 2541 97.73 98.48 6.34e-73 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $vbs2a Mouse 10090 Eukaryota Metazoa Mus musculus stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Variant _Vector_name $vbs2a 'recombinant technology' . Escherichia coli BL21(DE3) * pet151TOPO 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 $vbs2a 1 mM '[U-100% 13C; U-100% 15N]' DTT 2 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' 'sodium phosphate' 20 mM 'natural abundance' D2O 10 % 'natural abundance' H2O 90 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version 2.1 loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection processing stop_ _Details . save_ save_CCPNAnalysis _Saveframe_category software _Name CCPNAnalysis _Version 1.15 loop_ _Vendor _Address _Electronic_address CCPN . . stop_ loop_ _Task 'chemical shift assignment' 'data analysis' 'peak picking' stop_ _Details . save_ save_TALOS _Saveframe_category software _Name TALOS _Version . loop_ _Vendor _Address _Electronic_address 'Cornilescu, Delaglio and Bax' . . stop_ loop_ _Task 'Dihedral angle prediction' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 600 _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_3D_HNCO_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HNCACB_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HN(CO)CA_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_1 save_ save_NMR_spectrometer_expt _Saveframe_category NMR_applied_experiment _Experiment_name . _BMRB_pulse_sequence_accession_number . _Details . 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' 50 0.1 mM pH 6.5 0.1 pH pressure 1 . atm temperature 298 0.1 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 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 . 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 '2D 1H-15N HSQC' '3D HNCO' '3D CBCA(CO)NH' '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 vbs2a _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 ILE C C 175.696 0.20 1 2 2 2 ILE CA C 61.064 0.20 1 3 2 2 ILE CB C 38.986 0.20 1 4 3 3 ASP H H 8.369 0.02 1 5 3 3 ASP CA C 52.163 0.20 1 6 3 3 ASP CB C 41.214 0.20 1 7 3 3 ASP N N 126.084 0.2 1 8 4 4 PRO C C 176.771 0.20 1 9 4 4 PRO CA C 63.619 0.20 1 10 4 4 PRO CB C 31.908 0.20 1 11 5 5 PHE H H 8.150 0.02 1 12 5 5 PHE C C 175.936 0.20 1 13 5 5 PHE CA C 57.960 0.20 1 14 5 5 PHE CB C 38.953 0.20 1 15 5 5 PHE N N 118.409 0.2 1 16 6 6 THR H H 7.827 0.02 1 17 6 6 THR C C 174.101 0.20 1 18 6 6 THR CA C 62.009 0.20 1 19 6 6 THR CB C 70.062 0.20 1 20 6 6 THR N N 115.387 0.2 1 21 7 7 ILE H H 8.037 0.02 1 22 7 7 ILE C C 176.468 0.20 1 23 7 7 ILE CA C 61.498 0.20 1 24 7 7 ILE CB C 38.667 0.20 1 25 7 7 ILE N N 123.494 0.2 1 26 8 8 GLY H H 8.401 0.02 1 27 8 8 GLY C C 174.027 0.20 1 28 8 8 GLY CA C 45.142 0.20 1 29 8 8 GLY N N 112.872 0.2 1 30 9 9 GLU H H 8.218 0.02 1 31 9 9 GLU C C 176.656 0.20 1 32 9 9 GLU CA C 56.650 0.20 1 33 9 9 GLU CB C 30.372 0.20 1 34 9 9 GLU N N 120.607 0.2 1 35 10 10 SER H H 8.317 0.02 1 36 10 10 SER C C 174.299 0.20 1 37 10 10 SER CA C 58.435 0.20 1 38 10 10 SER CB C 63.952 0.20 1 39 10 10 SER N N 116.124 0.2 1 40 11 11 ASP H H 8.289 0.02 1 41 11 11 ASP C C 176.364 0.20 1 42 11 11 ASP CA C 54.617 0.20 1 43 11 11 ASP CB C 41.065 0.20 1 44 11 11 ASP N N 122.207 0.2 1 45 12 12 THR H H 8.005 0.02 1 46 12 12 THR C C 174.208 0.20 1 47 12 12 THR CA C 61.913 0.20 1 48 12 12 THR CB C 70.054 0.20 1 49 12 12 THR N N 113.649 0.2 1 50 13 13 ASP H H 8.395 0.02 1 51 13 13 ASP CA C 52.445 0.20 1 52 13 13 ASP CB C 41.835 0.20 1 53 13 13 ASP N N 125.440 0.2 1 54 14 14 PRO C C 177.944 0.20 1 55 14 14 PRO CA C 64.532 0.20 1 56 14 14 PRO CB C 32.140 0.20 1 57 15 15 HIS H H 8.591 0.02 1 58 15 15 HIS C C 176.276 0.20 1 59 15 15 HIS CA C 57.478 0.20 1 60 15 15 HIS CB C 28.538 0.20 1 61 15 15 HIS N N 117.326 0.2 1 62 16 16 PHE H H 8.089 0.02 1 63 16 16 PHE C C 177.385 0.20 1 64 16 16 PHE CA C 60.777 0.20 1 65 16 16 PHE CB C 38.981 0.20 1 66 16 16 PHE N N 121.235 0.2 1 67 17 17 GLN H H 8.217 0.02 1 68 17 17 GLN C C 176.967 0.20 1 69 17 17 GLN CA C 59.102 0.20 1 70 17 17 GLN CB C 28.226 0.20 1 71 17 17 GLN N N 117.749 0.2 1 72 18 18 ASP H H 7.677 0.02 1 73 18 18 ASP C C 178.502 0.20 1 74 18 18 ASP CA C 56.902 0.20 1 75 18 18 ASP CB C 40.800 0.20 1 76 18 18 ASP N N 119.530 0.2 1 77 19 19 VAL H H 7.776 0.02 1 78 19 19 VAL C C 177.723 0.20 1 79 19 19 VAL CA C 66.316 0.20 1 80 19 19 VAL CB C 31.235 0.20 1 81 19 19 VAL N N 121.903 0.2 1 82 20 20 LEU H H 7.770 0.02 1 83 20 20 LEU C C 178.700 0.20 1 84 20 20 LEU CA C 58.283 0.20 1 85 20 20 LEU CB C 41.340 0.20 1 86 20 20 LEU N N 118.862 0.2 1 87 21 21 MET H H 7.727 0.02 1 88 21 21 MET C C 179.181 0.20 1 89 21 21 MET CA C 57.253 0.20 1 90 21 21 MET CB C 30.926 0.20 1 91 21 21 MET N N 115.697 0.2 1 92 22 22 GLN H H 8.162 0.02 1 93 22 22 GLN C C 180.069 0.20 1 94 22 22 GLN CA C 59.309 0.20 1 95 22 22 GLN CB C 27.771 0.20 1 96 22 22 GLN N N 120.857 0.2 1 97 23 23 LEU H H 8.448 0.02 1 98 23 23 LEU C C 181.002 0.20 1 99 23 23 LEU CA C 57.624 0.20 1 100 23 23 LEU CB C 42.097 0.20 1 101 23 23 LEU N N 121.100 0.2 1 102 24 24 ALA H H 8.691 0.02 1 103 24 24 ALA C C 179.435 0.20 1 104 24 24 ALA CA C 56.007 0.20 1 105 24 24 ALA CB C 17.837 0.20 1 106 24 24 ALA N N 124.716 0.2 1 107 25 25 ASN H H 8.547 0.02 1 108 25 25 ASN C C 178.047 0.20 1 109 25 25 ASN CA C 55.977 0.20 1 110 25 25 ASN CB C 37.687 0.20 1 111 25 25 ASN N N 117.755 0.2 1 112 26 26 ALA H H 8.006 0.02 1 113 26 26 ALA C C 181.403 0.20 1 114 26 26 ALA CA C 55.011 0.20 1 115 26 26 ALA CB C 17.506 0.20 1 116 26 26 ALA N N 123.646 0.2 1 117 27 27 VAL H H 7.602 0.02 1 118 27 27 VAL C C 177.430 0.20 1 119 27 27 VAL CA C 66.601 0.20 1 120 27 27 VAL CB C 30.840 0.20 1 121 27 27 VAL N N 119.862 0.2 1 122 28 28 ALA H H 7.795 0.02 1 123 28 28 ALA C C 180.687 0.20 1 124 28 28 ALA CA C 55.556 0.20 1 125 28 28 ALA CB C 17.561 0.20 1 126 28 28 ALA N N 121.434 0.2 1 127 29 29 SER H H 8.695 0.02 1 128 29 29 SER C C 177.378 0.20 1 129 29 29 SER CA C 61.648 0.20 1 130 29 29 SER CB C 62.458 0.20 1 131 29 29 SER N N 115.757 0.2 1 132 30 30 ALA H H 7.818 0.02 1 133 30 30 ALA C C 180.986 0.20 1 134 30 30 ALA CA C 54.751 0.20 1 135 30 30 ALA CB C 16.974 0.20 1 136 30 30 ALA N N 125.126 0.2 1 137 31 31 ALA H H 9.188 0.02 1 138 31 31 ALA C C 178.688 0.20 1 139 31 31 ALA CA C 55.397 0.20 1 140 31 31 ALA CB C 18.854 0.20 1 141 31 31 ALA N N 123.918 0.2 1 142 32 32 ALA H H 8.059 0.02 1 143 32 32 ALA C C 178.416 0.20 1 144 32 32 ALA CA C 55.258 0.20 1 145 32 32 ALA CB C 17.399 0.20 1 146 32 32 ALA N N 120.876 0.2 1 147 33 33 ALA H H 7.197 0.02 1 148 33 33 ALA C C 180.242 0.20 1 149 33 33 ALA CA C 54.824 0.20 1 150 33 33 ALA CB C 17.760 0.20 1 151 33 33 ALA N N 120.008 0.2 1 152 34 34 LEU H H 7.567 0.02 1 153 34 34 LEU C C 177.421 0.20 1 154 34 34 LEU CA C 58.213 0.20 1 155 34 34 LEU CB C 40.922 0.20 1 156 34 34 LEU N N 120.007 0.2 1 157 35 35 VAL H H 8.642 0.02 1 158 35 35 VAL C C 177.785 0.20 1 159 35 35 VAL CA C 67.744 0.20 1 160 35 35 VAL CB C 31.506 0.20 1 161 35 35 VAL N N 120.103 0.2 1 162 36 36 LEU H H 7.606 0.02 1 163 36 36 LEU C C 180.515 0.20 1 164 36 36 LEU CA C 58.601 0.20 1 165 36 36 LEU CB C 41.776 0.20 1 166 36 36 LEU N N 118.499 0.2 1 167 37 37 LYS H H 7.895 0.02 1 168 37 37 LYS C C 179.601 0.20 1 169 37 37 LYS CA C 57.894 0.20 1 170 37 37 LYS CB C 31.473 0.20 1 171 37 37 LYS N N 119.253 0.2 1 172 38 38 ALA H H 8.913 0.02 1 173 38 38 ALA C C 179.449 0.20 1 174 38 38 ALA CA C 55.184 0.20 1 175 38 38 ALA CB C 17.461 0.20 1 176 38 38 ALA N N 123.267 0.2 1 177 39 39 LYS H H 8.618 0.02 1 178 39 39 LYS C C 179.243 0.20 1 179 39 39 LYS CA C 60.833 0.20 1 180 39 39 LYS CB C 31.651 0.20 1 181 39 39 LYS N N 118.135 0.2 1 182 40 40 SER H H 7.742 0.02 1 183 40 40 SER C C 176.664 0.20 1 184 40 40 SER CA C 62.292 0.20 1 185 40 40 SER CB C 62.701 0.20 1 186 40 40 SER N N 116.117 0.2 1 187 41 41 VAL H H 7.465 0.02 1 188 41 41 VAL C C 179.247 0.20 1 189 41 41 VAL CA C 66.542 0.20 1 190 41 41 VAL CB C 30.909 0.20 1 191 41 41 VAL N N 121.660 0.2 1 192 42 42 ALA H H 8.269 0.02 1 193 42 42 ALA C C 178.991 0.20 1 194 42 42 ALA CA C 55.596 0.20 1 195 42 42 ALA CB C 18.134 0.20 1 196 42 42 ALA N N 122.699 0.2 1 197 43 43 GLN H H 7.809 0.02 1 198 43 43 GLN C C 176.771 0.20 1 199 43 43 GLN CA C 57.803 0.20 1 200 43 43 GLN CB C 28.771 0.20 1 201 43 43 GLN N N 114.258 0.2 1 202 44 44 ARG H H 7.280 0.02 1 203 44 44 ARG C C 175.609 0.20 1 204 44 44 ARG CA C 54.989 0.20 1 205 44 44 ARG CB C 30.398 0.20 1 206 44 44 ARG N N 116.491 0.2 1 207 45 45 THR H H 7.352 0.02 1 208 45 45 THR C C 173.533 0.20 1 209 45 45 THR CA C 62.521 0.20 1 210 45 45 THR CB C 69.456 0.20 1 211 45 45 THR N N 117.025 0.2 1 212 46 46 GLU H H 8.604 0.02 1 213 46 46 GLU C C 176.410 0.20 1 214 46 46 GLU CA C 57.456 0.20 1 215 46 46 GLU CB C 30.046 0.20 1 216 46 46 GLU N N 126.420 0.2 1 217 47 47 ASP H H 7.933 0.02 1 218 47 47 ASP C C 180.492 0.20 1 219 47 47 ASP CA C 54.212 0.20 1 220 47 47 ASP CB C 43.012 0.20 1 221 47 47 ASP N N 120.992 0.2 1 222 48 48 SER H H 8.895 0.02 1 223 48 48 SER C C 176.862 0.20 1 224 48 48 SER CA C 61.721 0.20 1 225 48 48 SER CB C 62.870 0.20 1 226 48 48 SER N N 123.471 0.2 1 227 49 49 GLY H H 8.387 0.02 1 228 49 49 GLY C C 176.873 0.20 1 229 49 49 GLY CA C 47.215 0.20 1 230 49 49 GLY N N 112.636 0.2 1 231 50 50 LEU H H 8.373 0.02 1 232 50 50 LEU C C 180.170 0.20 1 233 50 50 LEU CA C 57.452 0.20 1 234 50 50 LEU CB C 41.973 0.20 1 235 50 50 LEU N N 123.595 0.2 1 236 51 51 GLN H H 8.666 0.02 1 237 51 51 GLN C C 177.875 0.20 1 238 51 51 GLN CA C 60.545 0.20 1 239 51 51 GLN CB C 29.928 0.20 1 240 51 51 GLN N N 120.627 0.2 1 241 52 52 THR H H 8.245 0.02 1 242 52 52 THR C C 176.488 0.20 1 243 52 52 THR CA C 66.709 0.20 1 244 52 52 THR CB C 68.869 0.20 1 245 52 52 THR N N 114.603 0.2 1 246 53 53 GLN H H 7.723 0.02 1 247 53 53 GLN C C 179.090 0.20 1 248 53 53 GLN CA C 59.135 0.20 1 249 53 53 GLN CB C 28.564 0.20 1 250 53 53 GLN N N 120.511 0.2 1 251 54 54 VAL H H 7.867 0.02 1 252 54 54 VAL C C 177.498 0.20 1 253 54 54 VAL CA C 66.963 0.20 1 254 54 54 VAL CB C 31.553 0.20 1 255 54 54 VAL N N 120.408 0.2 1 256 55 55 ILE H H 8.004 0.02 1 257 55 55 ILE C C 179.119 0.20 1 258 55 55 ILE CA C 64.194 0.20 1 259 55 55 ILE CB C 36.688 0.20 1 260 55 55 ILE N N 119.953 0.2 1 261 56 56 ALA H H 8.826 0.02 1 262 56 56 ALA C C 180.634 0.20 1 263 56 56 ALA CA C 55.409 0.20 1 264 56 56 ALA CB C 17.707 0.20 1 265 56 56 ALA N N 124.422 0.2 1 266 57 57 ALA H H 7.867 0.02 1 267 57 57 ALA C C 181.053 0.20 1 268 57 57 ALA CA C 54.791 0.20 1 269 57 57 ALA CB C 17.488 0.20 1 270 57 57 ALA N N 121.540 0.2 1 271 58 58 ALA H H 8.644 0.02 1 272 58 58 ALA C C 179.357 0.20 1 273 58 58 ALA CA C 55.667 0.20 1 274 58 58 ALA CB C 17.583 0.20 1 275 58 58 ALA N N 123.809 0.2 1 276 59 59 THR H H 8.762 0.02 1 277 59 59 THR C C 176.292 0.20 1 278 59 59 THR CA C 66.836 0.20 1 279 59 59 THR CB C 68.785 0.20 1 280 59 59 THR N N 116.960 0.2 1 281 60 60 GLN H H 8.081 0.02 1 282 60 60 GLN C C 178.971 0.20 1 283 60 60 GLN CA C 58.301 0.20 1 284 60 60 GLN CB C 27.749 0.20 1 285 60 60 GLN N N 120.781 0.2 1 286 61 61 CYS H H 8.092 0.02 1 287 61 61 CYS C C 176.328 0.20 1 288 61 61 CYS CA C 63.371 0.20 1 289 61 61 CYS CB C 26.041 0.20 1 290 61 61 CYS N N 120.683 0.2 1 291 62 62 ALA H H 8.043 0.02 1 292 62 62 ALA C C 180.038 0.20 1 293 62 62 ALA CA C 55.806 0.20 1 294 62 62 ALA CB C 17.958 0.20 1 295 62 62 ALA N N 124.852 0.2 1 296 63 63 LEU H H 8.551 0.02 1 297 63 63 LEU C C 179.973 0.20 1 298 63 63 LEU CA C 58.222 0.20 1 299 63 63 LEU CB C 42.089 0.20 1 300 63 63 LEU N N 120.094 0.2 1 301 64 64 SER H H 8.592 0.02 1 302 64 64 SER C C 178.154 0.20 1 303 64 64 SER CA C 62.166 0.20 1 304 64 64 SER N N 115.274 0.2 1 305 65 65 THR H H 8.101 0.02 1 306 65 65 THR C C 176.185 0.20 1 307 65 65 THR CA C 67.728 0.20 1 308 65 65 THR CB C 67.728 0.20 1 309 65 65 THR N N 120.790 0.2 1 310 66 66 SER H H 8.138 0.02 1 311 66 66 SER CA C 62.313 0.20 1 312 66 66 SER N N 119.701 0.2 1 313 67 67 GLN C C 178.342 0.20 1 314 67 67 GLN CA C 58.821 0.20 1 315 67 67 GLN CB C 27.881 0.20 1 316 68 68 LEU H H 7.893 0.02 1 317 68 68 LEU C C 179.286 0.20 1 318 68 68 LEU CA C 58.821 0.20 1 319 68 68 LEU CB C 41.289 0.20 1 320 68 68 LEU N N 122.944 0.2 1 321 69 69 VAL H H 8.295 0.02 1 322 69 69 VAL C C 177.224 0.20 1 323 69 69 VAL CA C 67.844 0.20 1 324 69 69 VAL CB C 31.682 0.20 1 325 69 69 VAL N N 123.293 0.2 1 326 70 70 ALA H H 7.829 0.02 1 327 70 70 ALA C C 179.935 0.20 1 328 70 70 ALA CA C 55.336 0.20 1 329 70 70 ALA CB C 17.993 0.20 1 330 70 70 ALA N N 121.185 0.2 1 331 71 71 CYS H H 8.390 0.02 1 332 71 71 CYS C C 176.347 0.20 1 333 71 71 CYS CA C 61.789 0.20 1 334 71 71 CYS CB C 26.459 0.20 1 335 71 71 CYS N N 117.773 0.2 1 336 72 72 THR H H 8.200 0.02 1 337 72 72 THR C C 174.904 0.20 1 338 72 72 THR CA C 68.355 0.20 1 339 72 72 THR CB C 67.960 0.20 1 340 72 72 THR N N 115.460 0.2 1 341 73 73 LYS H H 7.559 0.02 1 342 73 73 LYS C C 178.519 0.20 1 343 73 73 LYS CA C 59.704 0.20 1 344 73 73 LYS CB C 32.542 0.20 1 345 73 73 LYS N N 118.522 0.2 1 346 74 74 VAL H H 7.363 0.02 1 347 74 74 VAL C C 178.457 0.20 1 348 74 74 VAL CA C 65.465 0.20 1 349 74 74 VAL CB C 32.207 0.20 1 350 74 74 VAL N N 115.886 0.2 1 351 75 75 VAL H H 8.388 0.02 1 352 75 75 VAL C C 176.946 0.20 1 353 75 75 VAL CA C 62.745 0.20 1 354 75 75 VAL CB C 32.991 0.20 1 355 75 75 VAL N N 111.366 0.2 1 356 76 76 ALA H H 8.118 0.02 1 357 76 76 ALA CA C 57.049 0.20 1 358 76 76 ALA CB C 16.230 0.20 1 359 76 76 ALA N N 123.643 0.2 1 360 77 77 PRO C C 177.349 0.20 1 361 77 77 PRO CA C 65.244 0.20 1 362 77 77 PRO CB C 31.929 0.20 1 363 78 78 THR H H 7.777 0.02 1 364 78 78 THR C C 176.193 0.20 1 365 78 78 THR CA C 59.388 0.20 1 366 78 78 THR CB C 68.447 0.20 1 367 78 78 THR N N 106.842 0.2 1 368 79 79 ILE H H 6.972 0.02 1 369 79 79 ILE C C 173.719 0.20 1 370 79 79 ILE CA C 59.873 0.20 1 371 79 79 ILE CB C 39.240 0.20 1 372 79 79 ILE N N 122.420 0.2 1 373 80 80 SER H H 7.990 0.02 1 374 80 80 SER C C 175.474 0.20 1 375 80 80 SER CA C 59.317 0.20 1 376 80 80 SER CB C 63.142 0.20 1 377 80 80 SER N N 113.885 0.2 1 378 81 81 SER H H 8.053 0.02 1 379 81 81 SER CA C 55.246 0.20 1 380 81 81 SER CB C 63.669 0.20 1 381 81 81 SER N N 118.508 0.2 1 382 82 82 PRO C C 178.691 0.20 1 383 82 82 PRO CA C 65.517 0.20 1 384 82 82 PRO CB C 32.246 0.20 1 385 83 83 VAL H H 7.631 0.02 1 386 83 83 VAL C C 180.452 0.20 1 387 83 83 VAL CA C 65.385 0.20 1 388 83 83 VAL CB C 31.841 0.20 1 389 83 83 VAL N N 116.313 0.2 1 390 84 84 CYS H H 7.201 0.02 1 391 84 84 CYS C C 176.523 0.20 1 392 84 84 CYS CA C 62.366 0.20 1 393 84 84 CYS CB C 27.976 0.20 1 394 84 84 CYS N N 120.135 0.2 1 395 85 85 GLN H H 7.926 0.02 1 396 85 85 GLN C C 177.759 0.20 1 397 85 85 GLN CA C 59.998 0.20 1 398 85 85 GLN CB C 27.799 0.20 1 399 85 85 GLN N N 118.881 0.2 1 400 86 86 GLU H H 7.964 0.02 1 401 86 86 GLU C C 179.043 0.20 1 402 86 86 GLU CA C 59.249 0.20 1 403 86 86 GLU CB C 29.147 0.20 1 404 86 86 GLU N N 117.160 0.2 1 405 87 87 GLN H H 7.624 0.02 1 406 87 87 GLN C C 178.968 0.20 1 407 87 87 GLN CA C 59.169 0.20 1 408 87 87 GLN CB C 28.745 0.20 1 409 87 87 GLN N N 118.245 0.2 1 410 88 88 LEU H H 7.646 0.02 1 411 88 88 LEU C C 178.451 0.20 1 412 88 88 LEU CA C 58.026 0.20 1 413 88 88 LEU CB C 42.022 0.20 1 414 88 88 LEU N N 121.985 0.2 1 415 89 89 VAL H H 8.378 0.02 1 416 89 89 VAL C C 179.307 0.20 1 417 89 89 VAL CA C 67.225 0.20 1 418 89 89 VAL CB C 31.557 0.20 1 419 89 89 VAL N N 120.012 0.2 1 420 90 90 GLU H H 8.259 0.02 1 421 90 90 GLU C C 178.552 0.20 1 422 90 90 GLU CA C 59.175 0.20 1 423 90 90 GLU CB C 28.742 0.20 1 424 90 90 GLU N N 120.830 0.2 1 425 91 91 ALA H H 8.002 0.02 1 426 91 91 ALA C C 181.818 0.20 1 427 91 91 ALA CA C 55.242 0.20 1 428 91 91 ALA CB C 17.692 0.20 1 429 91 91 ALA N N 122.032 0.2 1 430 92 92 GLY H H 8.916 0.02 1 431 92 92 GLY C C 174.981 0.20 1 432 92 92 GLY CA C 47.504 0.20 1 433 92 92 GLY N N 107.308 0.2 1 434 93 93 ARG H H 8.569 0.02 1 435 93 93 ARG C C 179.425 0.20 1 436 93 93 ARG CA C 59.692 0.20 1 437 93 93 ARG CB C 29.889 0.20 1 438 93 93 ARG N N 124.792 0.2 1 439 94 94 LEU H H 7.717 0.02 1 440 94 94 LEU C C 180.728 0.20 1 441 94 94 LEU CA C 58.063 0.20 1 442 94 94 LEU CB C 41.236 0.20 1 443 94 94 LEU N N 118.966 0.2 1 444 95 95 VAL H H 7.478 0.02 1 445 95 95 VAL C C 177.363 0.20 1 446 95 95 VAL CA C 66.181 0.20 1 447 95 95 VAL CB C 30.972 0.20 1 448 95 95 VAL N N 120.760 0.2 1 449 96 96 ALA H H 8.163 0.02 1 450 96 96 ALA C C 180.905 0.20 1 451 96 96 ALA CA C 55.797 0.20 1 452 96 96 ALA CB C 17.700 0.20 1 453 96 96 ALA N N 122.361 0.2 1 454 97 97 LYS H H 8.128 0.02 1 455 97 97 LYS C C 179.217 0.20 1 456 97 97 LYS CA C 58.685 0.20 1 457 97 97 LYS CB C 32.102 0.20 1 458 97 97 LYS N N 118.055 0.2 1 459 98 98 ALA H H 7.987 0.02 1 460 98 98 ALA C C 181.538 0.20 1 461 98 98 ALA CA C 54.400 0.20 1 462 98 98 ALA CB C 17.574 0.20 1 463 98 98 ALA N N 123.908 0.2 1 464 99 99 VAL H H 8.878 0.02 1 465 99 99 VAL C C 177.741 0.20 1 466 99 99 VAL CA C 67.550 0.20 1 467 99 99 VAL CB C 31.332 0.20 1 468 99 99 VAL N N 122.739 0.2 1 469 100 100 GLU H H 7.745 0.02 1 470 100 100 GLU C C 179.793 0.20 1 471 100 100 GLU CA C 59.613 0.20 1 472 100 100 GLU CB C 29.226 0.20 1 473 100 100 GLU N N 119.334 0.2 1 474 101 101 GLY H H 8.205 0.02 1 475 101 101 GLY C C 176.294 0.20 1 476 101 101 GLY CA C 47.068 0.20 1 477 101 101 GLY N N 106.063 0.2 1 478 102 102 CYS H H 8.046 0.02 1 479 102 102 CYS C C 177.225 0.20 1 480 102 102 CYS CA C 63.665 0.20 1 481 102 102 CYS CB C 27.328 0.20 1 482 102 102 CYS N N 121.315 0.2 1 483 103 103 VAL H H 8.158 0.02 1 484 103 103 VAL C C 177.983 0.20 1 485 103 103 VAL CA C 67.780 0.20 1 486 103 103 VAL CB C 31.627 0.20 1 487 103 103 VAL N N 123.154 0.2 1 488 104 104 SER H H 8.654 0.02 1 489 104 104 SER C C 177.859 0.20 1 490 104 104 SER CA C 61.876 0.20 1 491 104 104 SER CB C 62.456 0.20 1 492 104 104 SER N N 115.393 0.2 1 493 105 105 ALA H H 8.254 0.02 1 494 105 105 ALA C C 180.179 0.20 1 495 105 105 ALA CA C 54.962 0.20 1 496 105 105 ALA CB C 18.055 0.20 1 497 105 105 ALA N N 122.985 0.2 1 498 106 106 SER H H 7.770 0.02 1 499 106 106 SER C C 174.813 0.20 1 500 106 106 SER CA C 63.951 0.20 1 501 106 106 SER CB C 62.924 0.20 1 502 106 106 SER N N 114.384 0.2 1 503 107 107 GLN H H 8.067 0.02 1 504 107 107 GLN C C 177.109 0.20 1 505 107 107 GLN CA C 58.086 0.20 1 506 107 107 GLN CB C 27.969 0.20 1 507 107 107 GLN N N 118.827 0.2 1 508 108 108 ALA H H 7.283 0.02 1 509 108 108 ALA C C 178.185 0.20 1 510 108 108 ALA CA C 53.232 0.20 1 511 108 108 ALA CB C 18.400 0.20 1 512 108 108 ALA N N 117.635 0.2 1 513 109 109 ALA H H 7.271 0.02 1 514 109 109 ALA C C 176.480 0.20 1 515 109 109 ALA CA C 53.232 0.20 1 516 109 109 ALA CB C 20.907 0.20 1 517 109 109 ALA N N 117.873 0.2 1 518 110 110 THR H H 7.594 0.02 1 519 110 110 THR C C 170.366 0.20 1 520 110 110 THR CA C 60.315 0.20 1 521 110 110 THR CB C 69.675 0.20 1 522 110 110 THR N N 111.850 0.2 1 523 111 111 GLU H H 8.128 0.02 1 524 111 111 GLU C C 176.680 0.20 1 525 111 111 GLU CA C 55.048 0.20 1 526 111 111 GLU CB C 30.640 0.20 1 527 111 111 GLU N N 121.502 0.2 1 528 112 112 ASP H H 8.683 0.02 1 529 112 112 ASP C C 176.676 0.20 1 530 112 112 ASP CA C 55.019 0.20 1 531 112 112 ASP CB C 42.068 0.20 1 532 112 112 ASP N N 124.625 0.2 1 533 113 113 GLY H H 8.801 0.02 1 534 113 113 GLY C C 176.271 0.20 1 535 113 113 GLY CA C 47.462 0.20 1 536 113 113 GLY N N 115.572 0.2 1 537 114 114 GLN H H 8.236 0.02 1 538 114 114 GLN C C 179.872 0.20 1 539 114 114 GLN CA C 59.076 0.20 1 540 114 114 GLN CB C 28.073 0.20 1 541 114 114 GLN N N 120.940 0.2 1 542 115 115 LEU H H 8.166 0.02 1 543 115 115 LEU C C 180.381 0.20 1 544 115 115 LEU CA C 57.455 0.20 1 545 115 115 LEU CB C 41.801 0.20 1 546 115 115 LEU N N 122.020 0.2 1 547 116 116 LEU H H 8.294 0.02 1 548 116 116 LEU C C 180.561 0.20 1 549 116 116 LEU CA C 57.919 0.20 1 550 116 116 LEU CB C 41.341 0.20 1 551 116 116 LEU N N 118.546 0.2 1 552 117 117 ARG H H 8.372 0.02 1 553 117 117 ARG C C 179.553 0.20 1 554 117 117 ARG CA C 59.434 0.20 1 555 117 117 ARG CB C 29.717 0.20 1 556 117 117 ARG N N 121.611 0.2 1 557 118 118 GLY H H 7.792 0.02 1 558 118 118 GLY C C 176.874 0.20 1 559 118 118 GLY CA C 47.116 0.20 1 560 118 118 GLY N N 107.488 0.2 1 561 119 119 VAL H H 7.961 0.02 1 562 119 119 VAL C C 177.220 0.20 1 563 119 119 VAL CA C 67.211 0.20 1 564 119 119 VAL CB C 31.854 0.20 1 565 119 119 VAL N N 123.084 0.2 1 566 120 120 GLY H H 8.468 0.02 1 567 120 120 GLY C C 176.455 0.20 1 568 120 120 GLY CA C 47.482 0.20 1 569 120 120 GLY N N 106.973 0.2 1 570 121 121 ALA H H 8.427 0.02 1 571 121 121 ALA C C 180.855 0.20 1 572 121 121 ALA CA C 54.944 0.20 1 573 121 121 ALA CB C 17.975 0.20 1 574 121 121 ALA N N 124.247 0.2 1 575 122 122 ALA H H 7.732 0.02 1 576 122 122 ALA C C 180.492 0.20 1 577 122 122 ALA CA C 54.450 0.20 1 578 122 122 ALA CB C 17.811 0.20 1 579 122 122 ALA N N 121.377 0.2 1 580 123 123 ALA H H 8.891 0.02 1 581 123 123 ALA C C 179.437 0.20 1 582 123 123 ALA CA C 55.978 0.20 1 583 123 123 ALA CB C 18.358 0.20 1 584 123 123 ALA N N 123.398 0.2 1 585 124 124 THR H H 8.312 0.02 1 586 124 124 THR C C 175.768 0.20 1 587 124 124 THR CA C 66.614 0.20 1 588 124 124 THR CB C 68.817 0.20 1 589 124 124 THR N N 116.200 0.2 1 590 125 125 ALA H H 7.525 0.02 1 591 125 125 ALA C C 181.278 0.20 1 592 125 125 ALA CA C 55.252 0.20 1 593 125 125 ALA CB C 17.612 0.20 1 594 125 125 ALA N N 122.554 0.2 1 595 126 126 VAL H H 7.848 0.02 1 596 126 126 VAL C C 177.294 0.20 1 597 126 126 VAL CA C 66.753 0.20 1 598 126 126 VAL CB C 30.788 0.20 1 599 126 126 VAL N N 118.844 0.2 1 600 127 127 THR H H 8.380 0.02 1 601 127 127 THR C C 176.531 0.20 1 602 127 127 THR CA C 67.191 0.20 1 603 127 127 THR CB C 68.221 0.20 1 604 127 127 THR N N 116.616 0.2 1 605 128 128 GLN H H 8.616 0.02 1 606 128 128 GLN C C 178.430 0.20 1 607 128 128 GLN CA C 59.249 0.20 1 608 128 128 GLN CB C 28.099 0.20 1 609 128 128 GLN N N 120.951 0.2 1 610 129 129 ALA H H 7.630 0.02 1 611 129 129 ALA C C 180.923 0.20 1 612 129 129 ALA CA C 54.953 0.20 1 613 129 129 ALA CB C 17.172 0.20 1 614 129 129 ALA N N 122.100 0.2 1 615 130 130 LEU H H 9.123 0.02 1 616 130 130 LEU C C 177.790 0.20 1 617 130 130 LEU CA C 57.958 0.20 1 618 130 130 LEU CB C 42.428 0.20 1 619 130 130 LEU N N 123.025 0.2 1 620 131 131 ASN H H 8.417 0.02 1 621 131 131 ASN C C 177.959 0.20 1 622 131 131 ASN CA C 56.197 0.20 1 623 131 131 ASN CB C 37.631 0.20 1 624 131 131 ASN N N 117.839 0.2 1 625 132 132 GLU H H 7.857 0.02 1 626 132 132 GLU C C 178.880 0.20 1 627 132 132 GLU CA C 59.690 0.20 1 628 132 132 GLU CB C 29.215 0.20 1 629 132 132 GLU N N 119.953 0.2 1 630 133 133 LEU H H 7.549 0.02 1 631 133 133 LEU C C 177.656 0.20 1 632 133 133 LEU CA C 58.746 0.20 1 633 133 133 LEU CB C 41.535 0.20 1 634 133 133 LEU N N 119.724 0.2 1 635 134 134 LEU H H 8.394 0.02 1 636 134 134 LEU C C 179.739 0.20 1 637 134 134 LEU CA C 57.472 0.20 1 638 134 134 LEU CB C 40.568 0.20 1 639 134 134 LEU N N 115.850 0.2 1 640 135 135 GLN H H 8.083 0.02 1 641 135 135 GLN C C 177.172 0.20 1 642 135 135 GLN CA C 57.761 0.20 1 643 135 135 GLN CB C 28.075 0.20 1 644 135 135 GLN N N 117.706 0.2 1 645 136 136 HIS H H 7.653 0.02 1 646 136 136 HIS C C 174.837 0.20 1 647 136 136 HIS CA C 57.968 0.20 1 648 136 136 HIS CB C 30.166 0.20 1 649 136 136 HIS N N 115.471 0.2 1 650 137 137 VAL H H 7.285 0.02 1 651 137 137 VAL C C 173.624 0.20 1 652 137 137 VAL CA C 62.347 0.20 1 653 137 137 VAL CB C 31.936 0.20 1 654 137 137 VAL N N 114.215 0.2 1 655 138 138 LYS H H 7.245 0.02 1 656 138 138 LYS CA C 57.631 0.20 1 657 138 138 LYS CB C 33.504 0.20 1 658 138 138 LYS N N 125.422 0.2 1 stop_ save_