data_17482 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Structural Characterization of small heat shock protein (Hsp12) ; _BMRB_accession_number 17482 _BMRB_flat_file_name bmr17482.str _Entry_type original _Submission_date 2011-02-22 _Accession_date 2011-02-22 _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 Singarapu Kiran K. . 2 Tonelli Marco . . 3 Westler William M. . 4 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" 536 "13C chemical shifts" 391 "15N chemical shifts" 102 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2012-03-09 update BMRB 'update entry citation' 2011-10-26 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 17483 'Hsp12 in aqueous solution' stop_ save_ ############################# # Citation for this entry # ############################# save_citations _Saveframe_category entry_citation _Citation_full . _Citation_title 'Structural characterization of Hsp12, the heat shock protein from Saccharomyces cerevisiae, in aqueous solution where it is intrinsically disordered and in detergent micelles where it is locally -helical.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 21998307 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Singarapu Kiran K. . 2 Tonelli Marco . . 3 Chow Darius C. . 4 Frederick Ronnie O. . 5 Westler William M. . 6 Markley John L. . stop_ _Journal_abbreviation 'J. Biol. Chem.' _Journal_name_full 'The Journal of biological chemistry' _Journal_volume 286 _Journal_issue 50 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 43447 _Page_last 43453 _Year 2011 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name Hsp12 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label Hsp12 $Hsp12 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_Hsp12 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common entity _Molecular_mass 11712.830 _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 109 _Mol_residue_sequence ; MSDAGRKGFGEKASEALKPD SQKSYAEQGKEYITDKADKV AGKVQPEDNKGVFQGVHDSA EKGKDNAEGQGESLADQARD YMGAAKSKLNDAVEYVSGRV HGEEDPTKK ; loop_ _Residue_seq_code _Residue_label 1 MET 2 SER 3 ASP 4 ALA 5 GLY 6 ARG 7 LYS 8 GLY 9 PHE 10 GLY 11 GLU 12 LYS 13 ALA 14 SER 15 GLU 16 ALA 17 LEU 18 LYS 19 PRO 20 ASP 21 SER 22 GLN 23 LYS 24 SER 25 TYR 26 ALA 27 GLU 28 GLN 29 GLY 30 LYS 31 GLU 32 TYR 33 ILE 34 THR 35 ASP 36 LYS 37 ALA 38 ASP 39 LYS 40 VAL 41 ALA 42 GLY 43 LYS 44 VAL 45 GLN 46 PRO 47 GLU 48 ASP 49 ASN 50 LYS 51 GLY 52 VAL 53 PHE 54 GLN 55 GLY 56 VAL 57 HIS 58 ASP 59 SER 60 ALA 61 GLU 62 LYS 63 GLY 64 LYS 65 ASP 66 ASN 67 ALA 68 GLU 69 GLY 70 GLN 71 GLY 72 GLU 73 SER 74 LEU 75 ALA 76 ASP 77 GLN 78 ALA 79 ARG 80 ASP 81 TYR 82 MET 83 GLY 84 ALA 85 ALA 86 LYS 87 SER 88 LYS 89 LEU 90 ASN 91 ASP 92 ALA 93 VAL 94 GLU 95 TYR 96 VAL 97 SER 98 GLY 99 ARG 100 VAL 101 HIS 102 GLY 103 GLU 104 GLU 105 ASP 106 PRO 107 THR 108 LYS 109 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 BMRB 17483 hsp12 100.00 109 100.00 100.00 8.02e-70 BMRB 17948 Hsp12 100.00 109 100.00 100.00 8.02e-70 BMRB 18523 HSP12_SDS 100.00 109 100.00 100.00 8.02e-70 PDB 2L9Q "Structural Characterization Of Small Heat Shock Protein (Hsp12)" 100.00 109 100.00 100.00 8.02e-70 PDB 2LJL "Nmr Structure Of Hsp12 In The Presence Of Dpc" 100.00 109 100.00 100.00 8.02e-70 PDB 4AXP "Nmr Structure Of Hsp12, A Protein Induced By And Required For Dietary Restriction-Induced Lifespan Extension In Yeast" 99.08 109 100.00 100.00 9.65e-69 DBJ BAA09224 "12KD heat shock protein [Saccharomyces cerevisiae]" 100.00 109 100.00 100.00 8.02e-70 DBJ BAA14033 "Sc-Hsp12p [Saccharomyces pastorianus]" 100.00 109 100.00 100.00 8.02e-70 DBJ GAA23069 "K7_Hsp12p [Saccharomyces cerevisiae Kyokai no. 7]" 100.00 109 100.00 100.00 8.02e-70 EMBL CAA39306 "hsp12 [Saccharomyces cerevisiae]" 100.00 109 100.00 100.00 8.02e-70 EMBL CAA86349 "hsp12, glp1 [Saccharomyces cerevisiae]" 100.00 109 100.00 100.00 8.02e-70 EMBL CAY79436 "Hsp12p [Saccharomyces cerevisiae EC1118]" 100.00 109 99.08 99.08 1.20e-68 GB AAA34647 "15 kD glucose and lipid regulated protein [Saccharomyces cerevisiae]" 100.00 109 100.00 100.00 8.02e-70 GB AAL06077 "12 kDa heat shock protein [Saccharomyces cerevisiae]" 100.00 109 99.08 99.08 1.20e-68 GB AAS56790 "YFL014W [Saccharomyces cerevisiae]" 100.00 109 100.00 100.00 8.02e-70 GB AHY75775 "Hsp12p [Saccharomyces cerevisiae YJM993]" 100.00 109 98.17 98.17 1.59e-67 GB AJP38487 "Hsp12p [Saccharomyces cerevisiae YJM1078]" 100.00 109 99.08 99.08 1.20e-68 REF NP_116640 "lipid-binding protein HSP12 [Saccharomyces cerevisiae S288c]" 100.00 109 100.00 100.00 8.02e-70 SP P22943 "RecName: Full=12 kDa heat shock protein; AltName: Full=Glucose and lipid-regulated protein" 100.00 109 100.00 100.00 8.02e-70 TPG DAA12425 "TPA: lipid-binding protein HSP12 [Saccharomyces cerevisiae S288c]" 100.00 109 100.00 100.00 8.02e-70 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $Hsp12 'baker's yeast' 4932 Eukaryota Fungi Saccharomyces cerevisiae 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 $Hsp12 'recombinant technology' . Escherichia coli . pvp68k stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details '10mM MOPS, 100mM NaCl, 100mM SDS, 5mM DTT, 3mM NaN3' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Hsp12 0.2 mM '[U-100% 15N]' $Hsp12 1.0 mM '[U-100% 13C; U-100% 15N]' MOPS 10 mM 'natural abundance' NaCl 100 mM 'natural abundance' SDS 100 mM 'natural abundance' DTT 5 mM 'natural abundance' NaN3 3 mM 'natural abundance' H2O 95 mM 'natural abundance' D2O 5 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Saveframe_category software _Name CYANA _Version . loop_ _Vendor _Address _Electronic_address 'Guntert, Mumenthaler and Wuthrich' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_Molmol _Saveframe_category software _Name Molmol _Version . loop_ _Vendor _Address _Electronic_address 'Koradi, Billeter and Wuthrich' . . stop_ loop_ _Task 'structure solution' stop_ _Details . save_ save_VNMRJ _Saveframe_category software _Name VNMRJ _Version . loop_ _Vendor _Address _Electronic_address Varian . . stop_ loop_ _Task collection stop_ _Details . save_ 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_PINE _Saveframe_category software _Name PINE _Version . loop_ _Vendor _Address _Electronic_address 'Bahrami, Markley, Assadi, and Eghbalnia' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_TALOS _Saveframe_category software _Name TALOS _Version . loop_ _Vendor _Address _Electronic_address 'Cornilescu, Delaglio and Bax' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 900 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _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_CBCA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_2D_1H-13C_HSQC_aliphatic_4 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC aliphatic' _Sample_label $sample_1 save_ save_2D_1H-13C_HSQC_aromatic_5 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC aromatic' _Sample_label $sample_1 save_ save_3D_C(CO)NH_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C(CO)NH' _Sample_label $sample_1 save_ save_3D_HBHA(CO)NH_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CO)NH' _Sample_label $sample_1 save_ save_3D_HCCH-COSY_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-COSY' _Sample_label $sample_1 save_ save_3D_1H-13C_NOESY_aliphatic_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aliphatic' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_10 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _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' 100 . mM pH 7.0 . pH pressure 1 . atm temperature 313 . 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 _Correction_value_citation_label DSS C 13 'methyl protons' ppm 0.00 . indirect . . . 0.251449530 $citations DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 $citations DSS N 15 'methyl protons' ppm 0.00 . indirect . . . 0.101329118 $citations 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 CBCA(CO)NH' '3D HNCACB' '3D C(CO)NH' '3D HBHA(CO)NH' '3D HCCH-COSY' '3D 1H-13C NOESY aliphatic' '3D 1H-15N NOESY' 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 Hsp12 _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 SER HA H 4.546 0.000 1 2 2 2 SER HB2 H 3.852 0.000 2 3 2 2 SER HB3 H 3.945 0.000 2 4 2 2 SER CA C 58.499 0.000 1 5 2 2 SER CB C 64.011 0.000 1 6 3 3 ASP HA H 4.602 0.000 1 7 3 3 ASP HB2 H 2.638 0.000 2 8 3 3 ASP HB3 H 2.695 0.000 2 9 3 3 ASP C C 176.010 0.000 1 10 3 3 ASP CA C 54.736 0.000 1 11 3 3 ASP CB C 41.269 0.000 1 12 4 4 ALA H H 8.095 0.000 1 13 4 4 ALA HA H 4.326 0.000 1 14 4 4 ALA HB H 1.409 0.000 1 15 4 4 ALA C C 178.097 0.000 1 16 4 4 ALA CA C 52.847 0.000 1 17 4 4 ALA CB C 19.323 0.000 1 18 4 4 ALA N N 123.253 0.000 1 19 5 5 GLY H H 8.167 0.000 1 20 5 5 GLY HA2 H 3.945 0.000 2 21 5 5 GLY HA3 H 3.973 0.000 2 22 5 5 GLY C C 174.828 0.000 1 23 5 5 GLY CA C 45.448 0.000 1 24 5 5 GLY N N 107.651 0.000 1 25 6 6 ARG H H 8.060 0.000 1 26 6 6 ARG HA H 4.349 0.000 1 27 6 6 ARG HB2 H 1.810 0.000 2 28 6 6 ARG HB3 H 1.924 0.000 2 29 6 6 ARG HG2 H 1.677 0.000 2 30 6 6 ARG HG3 H 1.655 0.000 2 31 6 6 ARG HD2 H 3.206 0.000 2 32 6 6 ARG HD3 H 3.189 0.000 2 33 6 6 ARG C C 176.562 0.000 1 34 6 6 ARG CA C 56.399 0.000 1 35 6 6 ARG CB C 30.831 0.000 1 36 6 6 ARG CG C 27.408 0.000 1 37 6 6 ARG CD C 43.544 0.000 1 38 6 6 ARG N N 120.230 0.000 1 39 7 7 LYS H H 8.181 0.000 1 40 7 7 LYS HA H 4.257 0.000 1 41 7 7 LYS HB2 H 1.772 0.000 2 42 7 7 LYS HB3 H 1.790 0.000 2 43 7 7 LYS HG2 H 1.469 0.000 2 44 7 7 LYS HG3 H 1.457 0.000 2 45 7 7 LYS HD2 H 1.660 0.000 2 46 7 7 LYS HD3 H 1.664 0.000 2 47 7 7 LYS C C 177.010 0.000 1 48 7 7 LYS CA C 56.920 0.000 1 49 7 7 LYS CB C 32.831 0.000 1 50 7 7 LYS CG C 24.882 0.000 1 51 7 7 LYS CD C 28.911 0.000 1 52 7 7 LYS N N 121.076 0.000 1 53 8 8 GLY H H 8.141 0.000 1 54 8 8 GLY HA2 H 3.947 0.000 2 55 8 8 GLY HA3 H 3.971 0.000 2 56 8 8 GLY C C 174.828 0.000 1 57 8 8 GLY CA C 45.829 0.000 1 58 8 8 GLY N N 108.196 0.000 1 59 9 9 PHE H H 8.072 0.000 1 60 9 9 PHE HA H 4.392 0.000 1 61 9 9 PHE HB2 H 3.111 0.000 2 62 9 9 PHE HB3 H 3.152 0.000 2 63 9 9 PHE C C 176.898 0.000 1 64 9 9 PHE CA C 59.980 0.000 1 65 9 9 PHE CB C 39.553 0.000 1 66 9 9 PHE N N 120.374 0.000 1 67 10 10 GLY H H 8.431 0.000 1 68 10 10 GLY HA2 H 3.708 0.000 2 69 10 10 GLY HA3 H 3.996 0.000 2 70 10 10 GLY C C 175.441 0.000 1 71 10 10 GLY CA C 46.822 0.000 1 72 10 10 GLY N N 107.944 0.000 1 73 11 11 GLU H H 8.003 0.000 1 74 11 11 GLU HA H 4.100 0.000 1 75 11 11 GLU HB2 H 2.062 0.000 2 76 11 11 GLU HB3 H 2.060 0.000 2 77 11 11 GLU HG2 H 2.322 0.000 2 78 11 11 GLU HG3 H 2.235 0.000 2 79 11 11 GLU C C 175.234 0.000 1 80 11 11 GLU CA C 58.971 0.000 1 81 11 11 GLU CB C 29.898 0.000 1 82 11 11 GLU CG C 36.455 0.000 1 83 11 11 GLU N N 121.098 0.000 1 84 12 12 LYS H H 7.930 0.000 1 85 12 12 LYS HA H 4.144 0.000 1 86 12 12 LYS HB2 H 1.840 0.000 2 87 12 12 LYS HB3 H 1.877 0.000 2 88 12 12 LYS HG2 H 1.460 0.000 2 89 12 12 LYS HG3 H 1.531 0.000 2 90 12 12 LYS HD2 H 1.683 0.000 2 91 12 12 LYS HD3 H 1.653 0.000 2 92 12 12 LYS C C 178.520 0.000 1 93 12 12 LYS CA C 58.337 0.000 1 94 12 12 LYS CB C 32.394 0.000 1 95 12 12 LYS CG C 25.211 0.000 1 96 12 12 LYS CD C 28.911 0.000 1 97 12 12 LYS N N 119.103 0.000 1 98 13 13 ALA H H 8.216 0.000 1 99 13 13 ALA HA H 4.011 0.000 1 100 13 13 ALA HB H 1.323 0.000 1 101 13 13 ALA C C 178.364 0.000 1 102 13 13 ALA CA C 54.728 0.000 1 103 13 13 ALA CB C 18.460 0.000 1 104 13 13 ALA N N 121.534 0.000 1 105 14 14 SER H H 8.000 0.000 1 106 14 14 SER HA H 4.114 0.000 1 107 14 14 SER HB2 H 3.944 0.000 2 108 14 14 SER HB3 H 4.000 0.000 2 109 14 14 SER C C 176.148 0.000 1 110 14 14 SER CA C 61.159 0.000 1 111 14 14 SER CB C 63.250 0.000 1 112 14 14 SER N N 111.263 0.000 1 113 15 15 GLU H H 7.724 0.000 1 114 15 15 GLU HA H 4.166 0.000 1 115 15 15 GLU HB2 H 2.093 0.000 2 116 15 15 GLU HB3 H 2.114 0.000 2 117 15 15 GLU HG2 H 2.396 0.000 2 118 15 15 GLU HG3 H 2.302 0.000 2 119 15 15 GLU C C 177.493 0.000 1 120 15 15 GLU CA C 58.013 0.000 1 121 15 15 GLU CB C 29.941 0.000 1 122 15 15 GLU CG C 36.379 0.000 1 123 15 15 GLU N N 119.902 0.000 1 124 16 16 ALA H H 7.726 0.000 1 125 16 16 ALA HA H 4.261 0.000 1 126 16 16 ALA HB H 1.440 0.000 1 127 16 16 ALA C C 177.933 0.000 1 128 16 16 ALA CA C 53.775 0.000 1 129 16 16 ALA CB C 19.544 0.000 1 130 16 16 ALA N N 120.687 0.000 1 131 17 17 LEU H H 7.634 0.000 1 132 17 17 LEU HA H 4.359 0.000 1 133 17 17 LEU HB2 H 1.602 0.000 2 134 17 17 LEU HB3 H 1.723 0.000 2 135 17 17 LEU HG H 1.724 0.000 1 136 17 17 LEU HD1 H 0.867 0.000 2 137 17 17 LEU HD2 H 0.838 0.000 2 138 17 17 LEU C C 176.277 0.000 1 139 17 17 LEU CA C 54.934 0.000 1 140 17 17 LEU CB C 42.564 0.000 1 141 17 17 LEU CG C 27.179 0.000 1 142 17 17 LEU CD1 C 25.538 0.000 1 143 17 17 LEU CD2 C 23.528 0.000 1 144 17 17 LEU N N 116.559 0.000 1 145 18 18 LYS H H 7.761 0.000 1 146 18 18 LYS HA H 4.567 0.000 1 147 18 18 LYS HB2 H 1.822 0.000 2 148 18 18 LYS HB3 H 1.859 0.000 2 149 18 18 LYS HG2 H 1.485 0.000 2 150 18 18 LYS HG3 H 1.457 0.000 2 151 18 18 LYS HD2 H 1.691 0.000 2 152 18 18 LYS HD3 H 1.684 0.000 2 153 18 18 LYS HE2 H 3.003 0.000 1 154 18 18 LYS HE3 H 3.002 0.000 1 155 18 18 LYS CA C 54.489 0.000 1 156 18 18 LYS CB C 32.520 0.000 1 157 18 18 LYS CG C 24.737 0.000 1 158 18 18 LYS CD C 29.095 0.000 1 159 18 18 LYS CE C 42.308 0.000 1 160 18 18 LYS N N 120.269 0.000 1 161 19 19 PRO HA H 4.443 0.000 1 162 19 19 PRO HB2 H 1.984 0.000 2 163 19 19 PRO HB3 H 2.292 0.000 2 164 19 19 PRO HG2 H 1.989 0.000 2 165 19 19 PRO HG3 H 2.053 0.000 2 166 19 19 PRO HD2 H 3.813 0.000 2 167 19 19 PRO HD3 H 3.700 0.000 2 168 19 19 PRO C C 176.984 0.000 1 169 19 19 PRO CA C 63.833 0.000 1 170 19 19 PRO CB C 32.247 0.000 1 171 19 19 PRO CG C 27.472 0.000 1 172 19 19 PRO CD C 50.728 0.000 1 173 20 20 ASP H H 8.383 0.000 1 174 20 20 ASP HA H 4.602 0.000 1 175 20 20 ASP HB2 H 2.683 0.000 2 176 20 20 ASP HB3 H 2.732 0.000 2 177 20 20 ASP C C 176.639 0.000 1 178 20 20 ASP CA C 54.497 0.000 1 179 20 20 ASP CB C 41.231 0.000 1 180 20 20 ASP N N 119.103 0.000 1 181 21 21 SER H H 8.054 0.000 1 182 21 21 SER HA H 4.376 0.000 1 183 21 21 SER HB2 H 3.887 0.000 2 184 21 21 SER HB3 H 3.971 0.000 2 185 21 21 SER C C 174.889 0.000 1 186 21 21 SER CA C 59.093 0.000 1 187 21 21 SER CB C 63.860 0.000 1 188 21 21 SER N N 115.970 0.000 1 189 22 22 GLN H H 8.452 0.000 1 190 22 22 GLN HA H 4.278 0.000 1 191 22 22 GLN HB2 H 2.024 0.000 2 192 22 22 GLN HB3 H 2.175 0.000 2 193 22 22 GLN HG2 H 2.358 0.000 2 194 22 22 GLN HG3 H 2.347 0.000 2 195 22 22 GLN C C 175.984 0.000 1 196 22 22 GLN CA C 56.739 0.000 1 197 22 22 GLN CB C 29.191 0.000 1 198 22 22 GLN CG C 33.922 0.000 1 199 22 22 GLN N N 120.766 0.000 1 200 23 23 LYS H H 7.935 0.000 1 201 23 23 LYS HA H 4.337 0.000 1 202 23 23 LYS HB2 H 1.648 0.000 2 203 23 23 LYS HB3 H 1.640 0.000 2 204 23 23 LYS HG2 H 1.371 0.000 2 205 23 23 LYS HG3 H 1.342 0.000 2 206 23 23 LYS HD2 H 1.605 0.000 2 207 23 23 LYS HD3 H 1.614 0.000 2 208 23 23 LYS HE2 H 2.941 0.000 2 209 23 23 LYS HE3 H 2.955 0.000 2 210 23 23 LYS C C 176.191 0.000 1 211 23 23 LYS CA C 56.208 0.000 1 212 23 23 LYS CB C 33.736 0.000 1 213 23 23 LYS CG C 24.971 0.000 1 214 23 23 LYS CD C 29.286 0.000 1 215 23 23 LYS CE C 42.319 0.000 1 216 23 23 LYS N N 120.410 0.000 1 217 24 24 SER H H 8.365 0.000 1 218 24 24 SER HA H 4.492 0.000 1 219 24 24 SER HB2 H 3.929 0.000 2 220 24 24 SER HB3 H 4.126 0.000 2 221 24 24 SER C C 175.717 0.000 1 222 24 24 SER CA C 58.145 0.000 1 223 24 24 SER CB C 63.815 0.000 1 224 24 24 SER N N 117.302 0.000 1 225 25 25 TYR H H 8.205 0.000 1 226 25 25 TYR HA H 4.382 0.000 1 227 25 25 TYR HB2 H 3.012 0.000 2 228 25 25 TYR HB3 H 3.038 0.000 2 229 25 25 TYR C C 177.752 0.000 1 230 25 25 TYR CA C 60.945 0.000 1 231 25 25 TYR CB C 37.821 0.000 1 232 25 25 TYR N N 121.904 0.000 1 233 26 26 ALA H H 8.233 0.000 1 234 26 26 ALA HA H 4.057 0.000 1 235 26 26 ALA HB H 1.487 0.000 1 236 26 26 ALA C C 179.037 0.000 1 237 26 26 ALA CA C 55.537 0.000 1 238 26 26 ALA CB C 18.474 0.000 1 239 26 26 ALA N N 121.123 0.000 1 240 27 27 GLU H H 7.922 0.000 1 241 27 27 GLU HA H 4.017 0.000 1 242 27 27 GLU HB2 H 2.076 0.000 2 243 27 27 GLU HB3 H 2.151 0.000 2 244 27 27 GLU HG2 H 2.285 0.000 2 245 27 27 GLU HG3 H 2.293 0.000 2 246 27 27 GLU C C 179.166 0.000 1 247 27 27 GLU CA C 59.478 0.000 1 248 27 27 GLU CB C 29.866 0.000 1 249 27 27 GLU CG C 36.551 0.000 1 250 27 27 GLU N N 117.313 0.000 1 251 28 28 GLN H H 8.179 0.000 1 252 28 28 GLN HA H 4.188 0.000 1 253 28 28 GLN HB2 H 2.189 0.000 2 254 28 28 GLN HB3 H 2.201 0.000 2 255 28 28 GLN HG2 H 2.373 0.000 2 256 28 28 GLN HG3 H 2.489 0.000 2 257 28 28 GLN C C 179.132 0.000 1 258 28 28 GLN CA C 58.845 0.000 1 259 28 28 GLN CB C 29.382 0.000 1 260 28 28 GLN CG C 34.721 0.000 1 261 28 28 GLN N N 118.602 0.000 1 262 29 29 GLY H H 8.804 0.000 1 263 29 29 GLY HA2 H 3.691 0.000 2 264 29 29 GLY HA3 H 3.882 0.000 2 265 29 29 GLY C C 174.518 0.000 1 266 29 29 GLY CA C 47.586 0.000 1 267 29 29 GLY N N 107.984 0.000 1 268 30 30 LYS H H 8.406 0.000 1 269 30 30 LYS HA H 3.961 0.000 1 270 30 30 LYS HB2 H 1.951 0.000 2 271 30 30 LYS HB3 H 2.022 0.000 2 272 30 30 LYS HG2 H 1.584 0.000 2 273 30 30 LYS HG3 H 1.428 0.000 2 274 30 30 LYS HD2 H 1.748 0.000 2 275 30 30 LYS HD3 H 1.761 0.000 2 276 30 30 LYS HE2 H 2.967 0.000 2 277 30 30 LYS HE3 H 2.950 0.000 2 278 30 30 LYS C C 178.925 0.000 1 279 30 30 LYS CA C 60.400 0.000 1 280 30 30 LYS CB C 32.427 0.000 1 281 30 30 LYS CG C 25.662 0.000 1 282 30 30 LYS CD C 29.547 0.000 1 283 30 30 LYS CE C 42.293 0.000 1 284 30 30 LYS N N 121.339 0.000 1 285 31 31 GLU H H 8.090 0.000 1 286 31 31 GLU HA H 4.040 0.000 1 287 31 31 GLU HB2 H 2.156 0.000 2 288 31 31 GLU HB3 H 2.154 0.000 2 289 31 31 GLU HG2 H 2.302 0.000 1 290 31 31 GLU HG3 H 2.302 0.000 1 291 31 31 GLU C C 177.761 0.000 1 292 31 31 GLU CA C 59.531 0.000 1 293 31 31 GLU CB C 29.531 0.000 1 294 31 31 GLU CG C 36.492 0.000 1 295 31 31 GLU N N 119.880 0.000 1 296 32 32 TYR H H 8.052 0.000 1 297 32 32 TYR HA H 4.271 0.000 1 298 32 32 TYR HB2 H 3.220 0.000 2 299 32 32 TYR HB3 H 3.241 0.000 2 300 32 32 TYR C C 178.054 0.000 1 301 32 32 TYR CA C 61.720 0.000 1 302 32 32 TYR CB C 38.931 0.000 1 303 32 32 TYR N N 119.786 0.000 1 304 33 33 ILE H H 8.249 0.000 1 305 33 33 ILE HA H 3.792 0.000 1 306 33 33 ILE HB H 2.070 0.000 1 307 33 33 ILE HG12 H 1.423 0.000 2 308 33 33 ILE HG13 H 1.819 0.000 2 309 33 33 ILE HG2 H 0.999 0.000 1 310 33 33 ILE HD1 H 0.918 0.000 1 311 33 33 ILE C C 177.519 0.000 1 312 33 33 ILE CA C 64.019 0.000 1 313 33 33 ILE CB C 38.111 0.000 1 314 33 33 ILE CG1 C 28.999 0.000 1 315 33 33 ILE CG2 C 18.082 0.000 1 316 33 33 ILE CD1 C 13.171 0.000 1 317 33 33 ILE N N 116.856 0.000 1 318 34 34 THR H H 8.254 0.000 1 319 34 34 THR HA H 3.934 0.000 1 320 34 34 THR HB H 4.299 0.000 1 321 34 34 THR HG2 H 1.329 0.000 1 322 34 34 THR C C 176.579 0.000 1 323 34 34 THR CA C 66.459 0.000 1 324 34 34 THR CB C 68.845 0.000 1 325 34 34 THR CG2 C 21.891 0.000 1 326 34 34 THR N N 114.203 0.000 1 327 35 35 ASP H H 7.880 0.000 1 328 35 35 ASP HA H 4.496 0.000 1 329 35 35 ASP HB2 H 2.645 0.000 2 330 35 35 ASP HB3 H 2.841 0.000 2 331 35 35 ASP C C 177.933 0.000 1 332 35 35 ASP CA C 57.062 0.000 1 333 35 35 ASP CB C 41.828 0.000 1 334 35 35 ASP N N 121.116 0.000 1 335 36 36 LYS H H 7.677 0.000 1 336 36 36 LYS HA H 4.157 0.000 1 337 36 36 LYS HB2 H 1.807 0.000 2 338 36 36 LYS HB3 H 1.833 0.000 2 339 36 36 LYS HG2 H 1.236 0.000 2 340 36 36 LYS HG3 H 1.444 0.000 2 341 36 36 LYS HD2 H 1.479 0.000 2 342 36 36 LYS HD3 H 1.494 0.000 2 343 36 36 LYS HE2 H 2.963 0.000 2 344 36 36 LYS HE3 H 2.713 0.000 2 345 36 36 LYS C C 177.968 0.000 1 346 36 36 LYS CA C 56.871 0.000 1 347 36 36 LYS CB C 31.913 0.000 1 348 36 36 LYS CG C 24.295 0.000 1 349 36 36 LYS CD C 27.733 0.000 1 350 36 36 LYS CE C 42.515 0.000 1 351 36 36 LYS N N 116.457 0.000 1 352 37 37 ALA H H 8.296 0.000 1 353 37 37 ALA HA H 4.005 0.000 1 354 37 37 ALA HB H 1.503 0.000 1 355 37 37 ALA C C 178.795 0.000 1 356 37 37 ALA CA C 55.331 0.000 1 357 37 37 ALA CB C 18.474 0.000 1 358 37 37 ALA N N 121.588 0.000 1 359 38 38 ASP H H 8.046 0.000 1 360 38 38 ASP HA H 4.409 0.000 1 361 38 38 ASP HB2 H 2.701 0.000 2 362 38 38 ASP HB3 H 2.811 0.000 2 363 38 38 ASP C C 178.347 0.000 1 364 38 38 ASP CA C 56.729 0.000 1 365 38 38 ASP CB C 41.048 0.000 1 366 38 38 ASP N N 116.490 0.000 1 367 39 39 LYS H H 7.757 0.000 1 368 39 39 LYS HA H 4.148 0.000 1 369 39 39 LYS HB2 H 1.949 0.000 2 370 39 39 LYS HB3 H 1.972 0.000 2 371 39 39 LYS HG2 H 1.512 0.000 2 372 39 39 LYS HG3 H 1.602 0.000 2 373 39 39 LYS HD2 H 1.826 0.000 2 374 39 39 LYS HD3 H 1.689 0.000 2 375 39 39 LYS HE2 H 2.700 0.000 2 376 39 39 LYS HE3 H 2.955 0.000 2 377 39 39 LYS C C 178.588 0.000 1 378 39 39 LYS CA C 58.226 0.000 1 379 39 39 LYS CB C 32.657 0.000 1 380 39 39 LYS CG C 24.227 0.000 1 381 39 39 LYS CD C 27.705 0.000 1 382 39 39 LYS CE C 42.547 0.000 1 383 39 39 LYS N N 118.627 0.000 1 384 40 40 VAL H H 7.792 0.000 1 385 40 40 VAL HA H 3.909 0.000 1 386 40 40 VAL HB H 2.203 0.000 1 387 40 40 VAL HG1 H 0.952 0.000 2 388 40 40 VAL HG2 H 1.022 0.000 2 389 40 40 VAL C C 176.683 0.000 1 390 40 40 VAL CA C 64.408 0.000 1 391 40 40 VAL CB C 32.334 0.000 1 392 40 40 VAL CG1 C 21.872 0.000 1 393 40 40 VAL CG2 C 21.978 0.000 1 394 40 40 VAL N N 116.146 0.000 1 395 41 41 ALA H H 8.094 0.000 1 396 41 41 ALA HA H 4.123 0.000 1 397 41 41 ALA HB H 1.479 0.000 1 398 41 41 ALA C C 179.106 0.000 1 399 41 41 ALA CA C 54.529 0.000 1 400 41 41 ALA CB C 18.601 0.000 1 401 41 41 ALA N N 122.561 0.000 1 402 42 42 GLY H H 8.044 0.000 1 403 42 42 GLY HA2 H 3.940 0.000 2 404 42 42 GLY HA3 H 3.972 0.000 2 405 42 42 GLY C C 174.941 0.000 1 406 42 42 GLY CA C 46.027 0.000 1 407 42 42 GLY N N 105.072 0.000 1 408 43 43 LYS H H 7.834 0.000 1 409 43 43 LYS HA H 4.341 0.000 1 410 43 43 LYS HB2 H 1.920 0.000 2 411 43 43 LYS HB3 H 1.936 0.000 2 412 43 43 LYS HG2 H 1.504 0.000 2 413 43 43 LYS HG3 H 1.488 0.000 2 414 43 43 LYS HD2 H 1.698 0.000 2 415 43 43 LYS HD3 H 1.710 0.000 2 416 43 43 LYS C C 176.631 0.000 1 417 43 43 LYS CA C 56.797 0.000 1 418 43 43 LYS CB C 33.396 0.000 1 419 43 43 LYS CG C 24.946 0.000 1 420 43 43 LYS CD C 28.866 0.000 1 421 43 43 LYS N N 119.123 0.000 1 422 44 44 VAL H H 7.650 0.000 1 423 44 44 VAL HA H 4.146 0.000 1 424 44 44 VAL HB H 2.160 0.000 1 425 44 44 VAL HG1 H 0.956 0.000 2 426 44 44 VAL HG2 H 0.928 0.000 2 427 44 44 VAL C C 175.018 0.000 1 428 44 44 VAL CA C 62.331 0.000 1 429 44 44 VAL CB C 32.641 0.000 1 430 44 44 VAL CG1 C 20.871 0.000 1 431 44 44 VAL CG2 C 21.658 0.000 1 432 44 44 VAL N N 116.413 0.000 1 433 45 45 GLN H H 8.154 0.000 1 434 45 45 GLN HA H 4.659 0.000 1 435 45 45 GLN HB2 H 2.111 0.000 2 436 45 45 GLN HB3 H 1.977 0.000 2 437 45 45 GLN HG2 H 2.356 0.000 2 438 45 45 GLN HG3 H 2.349 0.000 2 439 45 45 GLN CA C 53.664 0.000 1 440 45 45 GLN CB C 29.329 0.000 1 441 45 45 GLN CG C 33.883 0.000 1 442 45 45 GLN N N 122.078 0.000 1 443 46 46 PRO HA H 4.433 0.000 1 444 46 46 PRO HB2 H 1.987 0.000 2 445 46 46 PRO HB3 H 2.292 0.000 2 446 46 46 PRO HG2 H 1.958 0.000 2 447 46 46 PRO HG3 H 2.047 0.000 2 448 46 46 PRO HD2 H 3.725 0.000 1 449 46 46 PRO HD3 H 3.725 0.000 1 450 46 46 PRO C C 177.329 0.000 1 451 46 46 PRO CA C 63.754 0.000 1 452 46 46 PRO CB C 32.231 0.000 1 453 46 46 PRO CG C 27.520 0.000 1 454 46 46 PRO CD C 50.688 0.000 1 455 47 47 GLU H H 8.491 0.000 1 456 47 47 GLU HA H 4.211 0.000 1 457 47 47 GLU HB2 H 1.970 0.000 2 458 47 47 GLU HB3 H 2.051 0.000 2 459 47 47 GLU HG2 H 2.265 0.000 2 460 47 47 GLU HG3 H 2.289 0.000 2 461 47 47 GLU C C 176.484 0.000 1 462 47 47 GLU CA C 57.468 0.000 1 463 47 47 GLU CB C 30.329 0.000 1 464 47 47 GLU CG C 36.414 0.000 1 465 47 47 GLU N N 119.456 0.000 1 466 48 48 ASP H H 8.137 0.000 1 467 48 48 ASP HA H 4.585 0.000 1 468 48 48 ASP HB2 H 2.618 0.000 2 469 48 48 ASP HB3 H 2.721 0.000 2 470 48 48 ASP C C 175.863 0.000 1 471 48 48 ASP CA C 54.579 0.000 1 472 48 48 ASP CB C 41.131 0.000 1 473 48 48 ASP N N 119.108 0.000 1 474 49 49 ASN H H 8.173 0.000 1 475 49 49 ASN HA H 4.665 0.000 1 476 49 49 ASN HB2 H 2.776 0.000 2 477 49 49 ASN HB3 H 2.860 0.000 2 478 49 49 ASN C C 174.975 0.000 1 479 49 49 ASN CA C 53.728 0.000 1 480 49 49 ASN CB C 39.131 0.000 1 481 49 49 ASN N N 117.714 0.000 1 482 50 50 LYS H H 8.098 0.000 1 483 50 50 LYS HA H 4.308 0.000 1 484 50 50 LYS HB2 H 1.813 0.000 2 485 50 50 LYS HB3 H 1.880 0.000 2 486 50 50 LYS C C 176.950 0.000 1 487 50 50 LYS CA C 56.828 0.000 1 488 50 50 LYS CB C 33.031 0.000 1 489 50 50 LYS N N 120.215 0.000 1 490 51 51 GLY H H 8.295 0.000 1 491 51 51 GLY HA2 H 4.025 0.000 2 492 51 51 GLY HA3 H 4.053 0.000 2 493 51 51 GLY C C 175.251 0.000 1 494 51 51 GLY CA C 45.913 0.000 1 495 51 51 GLY N N 109.286 0.000 1 496 52 52 VAL H H 7.940 0.000 1 497 52 52 VAL HA H 3.864 0.000 1 498 52 52 VAL HB H 1.916 0.000 1 499 52 52 VAL HG1 H 0.805 0.000 2 500 52 52 VAL HG2 H 0.646 0.000 2 501 52 52 VAL C C 176.372 0.000 1 502 52 52 VAL CA C 64.346 0.000 1 503 52 52 VAL CB C 32.230 0.000 1 504 52 52 VAL CG1 C 21.194 0.000 1 505 52 52 VAL CG2 C 21.000 0.000 1 506 52 52 VAL N N 119.528 0.000 1 507 53 53 PHE H H 8.046 0.000 1 508 53 53 PHE HA H 4.593 0.000 1 509 53 53 PHE HB2 H 3.065 0.000 2 510 53 53 PHE HB3 H 3.283 0.000 2 511 53 53 PHE C C 176.441 0.000 1 512 53 53 PHE CA C 58.676 0.000 1 513 53 53 PHE CB C 38.635 0.000 1 514 53 53 PHE N N 118.265 0.000 1 515 54 54 GLN H H 7.978 0.000 1 516 54 54 GLN HA H 4.171 0.000 1 517 54 54 GLN HB2 H 2.113 0.000 2 518 54 54 GLN HB3 H 2.141 0.000 2 519 54 54 GLN HG2 H 2.327 0.000 2 520 54 54 GLN HG3 H 2.445 0.000 2 521 54 54 GLN C C 177.166 0.000 1 522 54 54 GLN CA C 57.549 0.000 1 523 54 54 GLN CB C 29.499 0.000 1 524 54 54 GLN CG C 34.600 0.000 1 525 54 54 GLN N N 119.441 0.000 1 526 55 55 GLY H H 8.120 0.000 1 527 55 55 GLY HA2 H 3.954 0.000 2 528 55 55 GLY HA3 H 3.974 0.000 2 529 55 55 GLY C C 175.294 0.000 1 530 55 55 GLY CA C 46.188 0.000 1 531 55 55 GLY N N 107.822 0.000 1 532 56 56 VAL H H 7.774 0.000 1 533 56 56 VAL HA H 3.972 0.000 1 534 56 56 VAL HB H 2.124 0.000 1 535 56 56 VAL HG1 H 0.967 0.000 2 536 56 56 VAL HG2 H 0.898 0.000 2 537 56 56 VAL C C 176.527 0.000 1 538 56 56 VAL CA C 64.004 0.000 1 539 56 56 VAL CB C 32.192 0.000 1 540 56 56 VAL CG1 C 21.424 0.000 1 541 56 56 VAL CG2 C 21.375 0.000 1 542 56 56 VAL N N 119.174 0.000 1 543 57 57 HIS H H 8.201 0.000 1 544 57 57 HIS HA H 4.542 0.000 1 545 57 57 HIS HB2 H 3.112 0.000 2 546 57 57 HIS HB3 H 3.290 0.000 2 547 57 57 HIS CA C 56.973 0.000 1 548 57 57 HIS CB C 29.608 0.000 1 549 57 57 HIS N N 119.221 0.000 1 550 58 58 ASP HA H 4.580 0.000 1 551 58 58 ASP HB2 H 2.690 0.000 2 552 58 58 ASP HB3 H 2.711 0.000 2 553 58 58 ASP C C 177.097 0.000 1 554 58 58 ASP CA C 55.021 0.000 1 555 58 58 ASP CB C 41.236 0.000 1 556 59 59 SER H H 8.134 0.000 1 557 59 59 SER HA H 4.372 0.000 1 558 59 59 SER HB2 H 3.887 0.000 2 559 59 59 SER HB3 H 3.974 0.000 2 560 59 59 SER C C 175.087 0.000 1 561 59 59 SER CA C 59.207 0.000 1 562 59 59 SER CB C 63.780 0.000 1 563 59 59 SER N N 116.347 0.000 1 564 60 60 ALA H H 8.203 0.000 1 565 60 60 ALA HA H 4.253 0.000 1 566 60 60 ALA HB H 1.429 0.000 1 567 60 60 ALA C C 178.192 0.000 1 568 60 60 ALA CA C 53.561 0.000 1 569 60 60 ALA CB C 19.078 0.000 1 570 60 60 ALA N N 125.097 0.000 1 571 61 61 GLU H H 8.095 0.000 1 572 61 61 GLU HA H 4.200 0.000 1 573 61 61 GLU HB2 H 2.077 0.000 2 574 61 61 GLU HB3 H 1.966 0.000 2 575 61 61 GLU HG2 H 2.302 0.000 2 576 61 61 GLU HG3 H 2.267 0.000 2 577 61 61 GLU C C 177.036 0.000 1 578 61 61 GLU CA C 57.224 0.000 1 579 61 61 GLU CB C 30.228 0.000 1 580 61 61 GLU CG C 36.357 0.000 1 581 61 61 GLU N N 118.432 0.000 1 582 62 62 LYS H H 7.969 0.000 1 583 62 62 LYS HA H 4.297 0.000 1 584 62 62 LYS HB2 H 1.820 0.000 2 585 62 62 LYS HB3 H 1.882 0.000 2 586 62 62 LYS HG2 H 1.379 0.000 2 587 62 62 LYS HG3 H 1.362 0.000 2 588 62 62 LYS C C 177.450 0.000 1 589 62 62 LYS CA C 56.826 0.000 1 590 62 62 LYS CB C 32.943 0.000 1 591 62 62 LYS CG C 24.875 0.000 1 592 62 62 LYS N N 120.770 0.000 1 593 63 63 GLY H H 8.287 0.000 1 594 63 63 GLY HA2 H 3.924 0.000 2 595 63 63 GLY HA3 H 3.962 0.000 2 596 63 63 GLY C C 174.432 0.000 1 597 63 63 GLY CA C 45.751 0.000 1 598 63 63 GLY N N 108.912 0.000 1 599 64 64 LYS H H 8.019 0.000 1 600 64 64 LYS HA H 4.298 0.000 1 601 64 64 LYS HB2 H 1.771 0.000 2 602 64 64 LYS HB3 H 1.866 0.000 2 603 64 64 LYS HG2 H 1.409 0.000 2 604 64 64 LYS HG3 H 1.362 0.000 2 605 64 64 LYS C C 176.622 0.000 1 606 64 64 LYS CA C 56.731 0.000 1 607 64 64 LYS CB C 33.117 0.000 1 608 64 64 LYS CG C 24.882 0.000 1 609 64 64 LYS N N 120.529 0.000 1 610 65 65 ASP H H 8.296 0.000 1 611 65 65 ASP HA H 4.580 0.000 1 612 65 65 ASP HB2 H 2.628 0.000 2 613 65 65 ASP HB3 H 2.703 0.000 2 614 65 65 ASP C C 176.226 0.000 1 615 65 65 ASP CA C 54.783 0.000 1 616 65 65 ASP CB C 41.172 0.000 1 617 65 65 ASP N N 120.673 0.000 1 618 66 66 ASN H H 8.212 0.000 1 619 66 66 ASN HA H 4.690 0.000 1 620 66 66 ASN HB2 H 2.768 0.000 2 621 66 66 ASN HB3 H 2.842 0.000 2 622 66 66 ASN C C 175.217 0.000 1 623 66 66 ASN CA C 53.475 0.000 1 624 66 66 ASN CB C 39.117 0.000 1 625 66 66 ASN N N 118.902 0.000 1 626 67 67 ALA H H 8.212 0.000 1 627 67 67 ALA HA H 4.300 0.000 1 628 67 67 ALA HB H 1.400 0.000 1 629 67 67 ALA C C 177.890 0.000 1 630 67 67 ALA CA C 53.053 0.000 1 631 67 67 ALA CB C 19.427 0.000 1 632 67 67 ALA N N 124.149 0.000 1 633 68 68 GLU H H 8.286 0.000 1 634 68 68 GLU HA H 4.271 0.000 1 635 68 68 GLU HB2 H 1.980 0.000 2 636 68 68 GLU HB3 H 2.079 0.000 2 637 68 68 GLU HG2 H 2.298 0.000 2 638 68 68 GLU HG3 H 2.277 0.000 2 639 68 68 GLU C C 177.243 0.000 1 640 68 68 GLU CA C 56.797 0.000 1 641 68 68 GLU CB C 30.159 0.000 1 642 68 68 GLU CG C 36.362 0.000 1 643 68 68 GLU N N 119.216 0.000 1 644 69 69 GLY H H 8.293 0.000 1 645 69 69 GLY HA2 H 3.976 0.000 2 646 69 69 GLY HA3 H 3.996 0.000 2 647 69 69 GLY C C 174.371 0.000 1 648 69 69 GLY CA C 45.634 0.000 1 649 69 69 GLY N N 109.637 0.000 1 650 70 70 GLN H H 8.201 0.000 1 651 70 70 GLN HA H 4.393 0.000 1 652 70 70 GLN HB2 H 2.008 0.000 2 653 70 70 GLN HB3 H 2.174 0.000 2 654 70 70 GLN HG2 H 2.358 0.000 2 655 70 70 GLN HG3 H 2.367 0.000 2 656 70 70 GLN C C 176.502 0.000 1 657 70 70 GLN CA C 56.046 0.000 1 658 70 70 GLN CB C 29.627 0.000 1 659 70 70 GLN CG C 33.911 0.000 1 660 70 70 GLN N N 119.629 0.000 1 661 71 71 GLY H H 8.424 0.000 1 662 71 71 GLY HA2 H 3.948 0.000 2 663 71 71 GLY HA3 H 3.972 0.000 2 664 71 71 GLY C C 173.992 0.000 1 665 71 71 GLY CA C 45.634 0.000 1 666 71 71 GLY N N 109.977 0.000 1 667 72 72 GLU H H 8.244 0.000 1 668 72 72 GLU HA H 4.411 0.000 1 669 72 72 GLU HB2 H 1.945 0.000 2 670 72 72 GLU HB3 H 2.094 0.000 2 671 72 72 GLU HG2 H 2.278 0.000 2 672 72 72 GLU HG3 H 2.262 0.000 2 673 72 72 GLU C C 176.639 0.000 1 674 72 72 GLU CA C 56.618 0.000 1 675 72 72 GLU CB C 30.731 0.000 1 676 72 72 GLU CG C 36.325 0.000 1 677 72 72 GLU N N 120.532 0.000 1 678 73 73 SER H H 8.689 0.000 1 679 73 73 SER HA H 4.589 0.000 1 680 73 73 SER HB2 H 3.991 0.000 2 681 73 73 SER HB3 H 4.221 0.000 2 682 73 73 SER C C 175.475 0.000 1 683 73 73 SER CA C 58.064 0.000 1 684 73 73 SER CB C 64.761 0.000 1 685 73 73 SER N N 117.827 0.000 1 686 74 74 LEU H H 8.514 0.000 1 687 74 74 LEU HA H 4.201 0.000 1 688 74 74 LEU HB2 H 1.608 0.000 2 689 74 74 LEU HB3 H 1.825 0.000 2 690 74 74 LEU HG H 1.746 0.000 1 691 74 74 LEU HD1 H 0.981 0.000 2 692 74 74 LEU HD2 H 0.923 0.000 2 693 74 74 LEU C C 178.735 0.000 1 694 74 74 LEU CA C 57.895 0.000 1 695 74 74 LEU CB C 41.934 0.000 1 696 74 74 LEU CG C 27.403 0.000 1 697 74 74 LEU CD1 C 24.955 0.000 1 698 74 74 LEU CD2 C 24.339 0.000 1 699 74 74 LEU N N 124.414 0.000 1 700 75 75 ALA H H 8.160 0.000 1 701 75 75 ALA HA H 3.990 0.000 1 702 75 75 ALA HB H 1.429 0.000 1 703 75 75 ALA C C 179.046 0.000 1 704 75 75 ALA CA C 55.267 0.000 1 705 75 75 ALA CB C 18.594 0.000 1 706 75 75 ALA N N 120.291 0.000 1 707 76 76 ASP H H 7.773 0.000 1 708 76 76 ASP HA H 4.406 0.000 1 709 76 76 ASP HB2 H 2.740 0.000 2 710 76 76 ASP HB3 H 2.809 0.000 2 711 76 76 ASP C C 178.476 0.000 1 712 76 76 ASP CA C 57.133 0.000 1 713 76 76 ASP CB C 40.652 0.000 1 714 76 76 ASP N N 117.288 0.000 1 715 77 77 GLN H H 7.994 0.000 1 716 77 77 GLN HA H 4.162 0.000 1 717 77 77 GLN HB2 H 2.162 0.000 2 718 77 77 GLN HB3 H 2.169 0.000 2 719 77 77 GLN HG2 H 2.311 0.000 2 720 77 77 GLN HG3 H 2.306 0.000 2 721 77 77 GLN C C 178.037 0.000 1 722 77 77 GLN CA C 58.381 0.000 1 723 77 77 GLN CB C 29.480 0.000 1 724 77 77 GLN CG C 34.640 0.000 1 725 77 77 GLN N N 119.454 0.000 1 726 78 78 ALA H H 8.498 0.000 1 727 78 78 ALA HA H 4.149 0.000 1 728 78 78 ALA HB H 1.500 0.000 1 729 78 78 ALA C C 178.977 0.000 1 730 78 78 ALA CA C 55.131 0.000 1 731 78 78 ALA CB C 18.655 0.000 1 732 78 78 ALA N N 121.577 0.000 1 733 79 79 ARG H H 8.101 0.000 1 734 79 79 ARG HA H 4.012 0.000 1 735 79 79 ARG HB2 H 1.922 0.000 2 736 79 79 ARG HB3 H 1.972 0.000 2 737 79 79 ARG HG2 H 1.643 0.000 2 738 79 79 ARG HG3 H 1.875 0.000 2 739 79 79 ARG HD2 H 3.281 0.000 2 740 79 79 ARG HD3 H 3.233 0.000 2 741 79 79 ARG C C 175.449 0.000 1 742 79 79 ARG CA C 59.503 0.000 1 743 79 79 ARG CB C 30.146 0.000 1 744 79 79 ARG CG C 28.414 0.000 1 745 79 79 ARG CD C 43.481 0.000 1 746 79 79 ARG N N 117.138 0.000 1 747 80 80 ASP H H 8.000 0.000 1 748 80 80 ASP HA H 4.513 0.000 1 749 80 80 ASP HB2 H 2.612 0.000 2 750 80 80 ASP HB3 H 2.708 0.000 2 751 80 80 ASP C C 178.882 0.000 1 752 80 80 ASP CA C 56.876 0.000 1 753 80 80 ASP CB C 40.328 0.000 1 754 80 80 ASP N N 120.784 0.000 1 755 81 81 TYR H H 8.127 0.000 1 756 81 81 TYR HA H 4.431 0.000 1 757 81 81 TYR HB2 H 3.092 0.000 2 758 81 81 TYR HB3 H 3.104 0.000 2 759 81 81 TYR C C 177.855 0.000 1 760 81 81 TYR CA C 60.834 0.000 1 761 81 81 TYR CB C 38.478 0.000 1 762 81 81 TYR N N 120.298 0.000 1 763 82 82 MET H H 8.382 0.000 1 764 82 82 MET HA H 4.239 0.000 1 765 82 82 MET HB2 H 2.186 0.000 2 766 82 82 MET HB3 H 2.262 0.000 2 767 82 82 MET HG2 H 2.612 0.000 2 768 82 82 MET HG3 H 2.743 0.000 2 769 82 82 MET C C 178.175 0.000 1 770 82 82 MET CA C 58.757 0.000 1 771 82 82 MET CB C 32.631 0.000 1 772 82 82 MET CG C 32.969 0.000 1 773 82 82 MET N N 118.452 0.000 1 774 83 83 GLY H H 8.308 0.000 1 775 83 83 GLY HA2 H 3.863 0.000 2 776 83 83 GLY HA3 H 4.014 0.000 2 777 83 83 GLY C C 176.717 0.000 1 778 83 83 GLY CA C 47.331 0.000 1 779 83 83 GLY N N 106.740 0.000 1 780 84 84 ALA H H 7.905 0.000 1 781 84 84 ALA HA H 4.287 0.000 1 782 84 84 ALA HB H 1.576 0.000 1 783 84 84 ALA C C 180.149 0.000 1 784 84 84 ALA CA C 54.648 0.000 1 785 84 84 ALA CB C 18.541 0.000 1 786 84 84 ALA N N 125.357 0.000 1 787 85 85 ALA H H 8.341 0.000 1 788 85 85 ALA HA H 4.025 0.000 1 789 85 85 ALA HB H 1.525 0.000 1 790 85 85 ALA C C 178.847 0.000 1 791 85 85 ALA CA C 55.283 0.000 1 792 85 85 ALA CB C 18.487 0.000 1 793 85 85 ALA N N 121.332 0.000 1 794 86 86 LYS H H 8.360 0.000 1 795 86 86 LYS HA H 3.872 0.000 1 796 86 86 LYS HB2 H 1.956 0.000 2 797 86 86 LYS HB3 H 2.028 0.000 2 798 86 86 LYS HG2 H 1.607 0.000 2 799 86 86 LYS HG3 H 1.515 0.000 2 800 86 86 LYS HD2 H 1.800 0.000 2 801 86 86 LYS HD3 H 1.743 0.000 2 802 86 86 LYS C C 178.485 0.000 1 803 86 86 LYS CA C 60.193 0.000 1 804 86 86 LYS CB C 32.331 0.000 1 805 86 86 LYS CG C 25.376 0.000 1 806 86 86 LYS CD C 29.568 0.000 1 807 86 86 LYS N N 116.980 0.000 1 808 87 87 SER H H 7.863 0.000 1 809 87 87 SER HA H 4.299 0.000 1 810 87 87 SER HB2 H 4.056 0.000 2 811 87 87 SER HB3 H 4.042 0.000 2 812 87 87 SER C C 176.467 0.000 1 813 87 87 SER CA C 61.614 0.000 1 814 87 87 SER CB C 63.064 0.000 1 815 87 87 SER N N 113.632 0.000 1 816 88 88 LYS H H 7.843 0.000 1 817 88 88 LYS HA H 4.345 0.000 1 818 88 88 LYS HB2 H 1.929 0.000 2 819 88 88 LYS HB3 H 2.012 0.000 2 820 88 88 LYS HG2 H 1.615 0.000 2 821 88 88 LYS HG3 H 1.569 0.000 2 822 88 88 LYS HD2 H 1.710 0.000 2 823 88 88 LYS HD3 H 1.808 0.000 2 824 88 88 LYS HE2 H 2.990 0.000 2 825 88 88 LYS HE3 H 2.998 0.000 2 826 88 88 LYS C C 178.502 0.000 1 827 88 88 LYS CA C 57.696 0.000 1 828 88 88 LYS CB C 32.011 0.000 1 829 88 88 LYS CG C 24.875 0.000 1 830 88 88 LYS CD C 28.366 0.000 1 831 88 88 LYS CE C 42.349 0.000 1 832 88 88 LYS N N 120.925 0.000 1 833 89 89 LEU H H 8.174 0.000 1 834 89 89 LEU HA H 4.105 0.000 1 835 89 89 LEU HB2 H 1.822 0.000 2 836 89 89 LEU HB3 H 1.812 0.000 2 837 89 89 LEU HG H 1.808 0.000 1 838 89 89 LEU HD1 H 0.932 0.000 2 839 89 89 LEU HD2 H 0.920 0.000 2 840 89 89 LEU C C 178.209 0.000 1 841 89 89 LEU CA C 58.197 0.000 1 842 89 89 LEU CB C 41.631 0.000 1 843 89 89 LEU CG C 27.169 0.000 1 844 89 89 LEU CD1 C 24.760 0.000 1 845 89 89 LEU CD2 C 24.711 0.000 1 846 89 89 LEU N N 119.955 0.000 1 847 90 90 ASN H H 8.223 0.000 1 848 90 90 ASN HA H 4.393 0.000 1 849 90 90 ASN HB2 H 2.947 0.000 2 850 90 90 ASN HB3 H 2.927 0.000 2 851 90 90 ASN C C 174.164 0.000 1 852 90 90 ASN CA C 57.166 0.000 1 853 90 90 ASN CB C 38.952 0.000 1 854 90 90 ASN N N 117.013 0.000 1 855 91 91 ASP H H 8.043 0.000 1 856 91 91 ASP HA H 4.457 0.000 1 857 91 91 ASP HB2 H 2.945 0.000 2 858 91 91 ASP HB3 H 2.737 0.000 2 859 91 91 ASP C C 178.804 0.000 1 860 91 91 ASP CA C 57.438 0.000 1 861 91 91 ASP CB C 40.179 0.000 1 862 91 91 ASP N N 119.959 0.000 1 863 92 92 ALA H H 8.256 0.000 1 864 92 92 ALA HA H 4.203 0.000 1 865 92 92 ALA HB H 1.594 0.000 1 866 92 92 ALA C C 178.951 0.000 1 867 92 92 ALA CA C 55.537 0.000 1 868 92 92 ALA CB C 18.504 0.000 1 869 92 92 ALA N N 123.900 0.000 1 870 93 93 VAL H H 8.449 0.000 1 871 93 93 VAL HA H 3.594 0.000 1 872 93 93 VAL HB H 2.311 0.000 1 873 93 93 VAL HG1 H 1.141 0.000 2 874 93 93 VAL HG2 H 1.006 0.000 2 875 93 93 VAL C C 178.761 0.000 1 876 93 93 VAL CA C 67.157 0.000 1 877 93 93 VAL CB C 31.795 0.000 1 878 93 93 VAL CG1 C 23.139 0.000 1 879 93 93 VAL CG2 C 21.432 0.000 1 880 93 93 VAL N N 118.228 0.000 1 881 94 94 GLU H H 8.175 0.000 1 882 94 94 GLU HA H 4.045 0.000 1 883 94 94 GLU HB2 H 2.162 0.000 2 884 94 94 GLU HB3 H 2.154 0.000 2 885 94 94 GLU HG2 H 2.280 0.000 2 886 94 94 GLU HG3 H 2.443 0.000 2 887 94 94 GLU C C 179.347 0.000 1 888 94 94 GLU CA C 59.631 0.000 1 889 94 94 GLU CB C 29.531 0.000 1 890 94 94 GLU CG C 36.502 0.000 1 891 94 94 GLU N N 120.485 0.000 1 892 95 95 TYR H H 8.197 0.000 1 893 95 95 TYR HA H 4.228 0.000 1 894 95 95 TYR HB2 H 3.260 0.000 2 895 95 95 TYR HB3 H 3.272 0.000 2 896 95 95 TYR C C 178.407 0.000 1 897 95 95 TYR CA C 61.561 0.000 1 898 95 95 TYR CB C 38.631 0.000 1 899 95 95 TYR N N 120.806 0.000 1 900 96 96 VAL H H 8.525 0.000 1 901 96 96 VAL HA H 3.483 0.000 1 902 96 96 VAL HB H 2.222 0.000 1 903 96 96 VAL HG1 H 1.229 0.000 2 904 96 96 VAL HG2 H 0.999 0.000 2 905 96 96 VAL C C 177.752 0.000 1 906 96 96 VAL CA C 66.680 0.000 1 907 96 96 VAL CB C 32.022 0.000 1 908 96 96 VAL CG1 C 23.253 0.000 1 909 96 96 VAL CG2 C 22.260 0.000 1 910 96 96 VAL N N 118.584 0.000 1 911 97 97 SER H H 8.642 0.000 1 912 97 97 SER HA H 4.080 0.000 1 913 97 97 SER HB2 H 3.989 0.000 2 914 97 97 SER HB3 H 3.975 0.000 2 915 97 97 SER C C 176.803 0.000 1 916 97 97 SER CA C 61.800 0.000 1 917 97 97 SER CB C 63.258 0.000 1 918 97 97 SER N N 114.566 0.000 1 919 98 98 GLY H H 7.926 0.000 1 920 98 98 GLY HA2 H 3.898 0.000 2 921 98 98 GLY HA3 H 3.971 0.000 2 922 98 98 GLY C C 175.553 0.000 1 923 98 98 GLY CA C 46.556 0.000 1 924 98 98 GLY N N 107.586 0.000 1 925 99 99 ARG H H 7.611 0.000 1 926 99 99 ARG HA H 4.203 0.000 1 927 99 99 ARG HB2 H 1.772 0.000 2 928 99 99 ARG HB3 H 1.860 0.000 2 929 99 99 ARG HG2 H 1.496 0.000 2 930 99 99 ARG HG3 H 1.499 0.000 2 931 99 99 ARG HD2 H 2.967 0.000 2 932 99 99 ARG HD3 H 3.095 0.000 2 933 99 99 ARG C C 177.830 0.000 1 934 99 99 ARG CA C 57.129 0.000 1 935 99 99 ARG CB C 30.212 0.000 1 936 99 99 ARG CG C 27.128 0.000 1 937 99 99 ARG CD C 42.747 0.000 1 938 99 99 ARG N N 119.948 0.000 1 939 100 100 VAL H H 7.906 0.000 1 940 100 100 VAL HA H 3.940 0.000 1 941 100 100 VAL HB H 2.018 0.000 1 942 100 100 VAL HG1 H 0.894 0.000 2 943 100 100 VAL HG2 H 0.762 0.000 2 944 100 100 VAL C C 176.381 0.000 1 945 100 100 VAL CA C 63.931 0.000 1 946 100 100 VAL CB C 32.331 0.000 1 947 100 100 VAL CG1 C 21.296 0.000 1 948 100 100 VAL CG2 C 21.179 0.000 1 949 100 100 VAL N N 116.709 0.000 1 950 101 101 HIS H H 8.061 0.000 1 951 101 101 HIS HA H 4.775 0.000 1 952 101 101 HIS HB2 H 3.193 0.000 2 953 101 101 HIS HB3 H 3.340 0.000 2 954 101 101 HIS C C 175.484 0.000 1 955 101 101 HIS CA C 55.862 0.000 1 956 101 101 HIS CB C 29.517 0.000 1 957 101 101 HIS N N 117.584 0.000 1 958 102 102 GLY H H 7.990 0.000 1 959 102 102 GLY HA2 H 3.968 0.000 2 960 102 102 GLY HA3 H 4.053 0.000 2 961 102 102 GLY C C 174.121 0.000 1 962 102 102 GLY CA C 45.719 0.000 1 963 102 102 GLY N N 109.164 0.000 1 964 103 103 GLU H H 8.320 0.000 1 965 103 103 GLU HA H 4.315 0.000 1 966 103 103 GLU HB2 H 1.904 0.000 2 967 103 103 GLU HB3 H 2.050 0.000 2 968 103 103 GLU HG2 H 2.292 0.000 2 969 103 103 GLU HG3 H 2.286 0.000 2 970 103 103 GLU C C 176.467 0.000 1 971 103 103 GLU CA C 56.451 0.000 1 972 103 103 GLU CB C 30.731 0.000 1 973 103 103 GLU CG C 36.353 0.000 1 974 103 103 GLU N N 120.493 0.000 1 975 104 104 GLU H H 8.358 0.000 1 976 104 104 GLU HA H 4.263 0.000 1 977 104 104 GLU HB2 H 1.912 0.000 2 978 104 104 GLU HB3 H 2.001 0.000 2 979 104 104 GLU C C 175.820 0.000 1 980 104 104 GLU CA C 56.480 0.000 1 981 104 104 GLU CB C 30.654 0.000 1 982 104 104 GLU N N 122.018 0.000 1 983 105 105 ASP H H 8.350 0.000 1 984 105 105 ASP HA H 4.898 0.000 1 985 105 105 ASP HB2 H 2.796 0.000 2 986 105 105 ASP HB3 H 2.585 0.000 2 987 105 105 ASP CA C 51.728 0.000 1 988 105 105 ASP CB C 41.614 0.000 1 989 105 105 ASP N N 122.625 0.000 1 990 106 106 PRO HA H 4.466 0.000 1 991 106 106 PRO HB2 H 2.027 0.000 2 992 106 106 PRO HB3 H 2.316 0.000 2 993 106 106 PRO HG2 H 1.996 0.000 2 994 106 106 PRO HG3 H 2.052 0.000 2 995 106 106 PRO HD2 H 3.906 0.000 2 996 106 106 PRO HD3 H 3.896 0.000 2 997 106 106 PRO C C 177.605 0.000 1 998 106 106 PRO CA C 63.921 0.000 1 999 106 106 PRO CB C 32.296 0.000 1 1000 106 106 PRO CG C 27.068 0.000 1 1001 106 106 PRO CD C 51.021 0.000 1 1002 107 107 THR H H 8.355 0.000 1 1003 107 107 THR HA H 4.281 0.000 1 1004 107 107 THR HB H 4.262 0.000 1 1005 107 107 THR HG2 H 1.236 0.000 1 1006 107 107 THR C C 174.889 0.000 1 1007 107 107 THR CA C 62.896 0.000 1 1008 107 107 THR CB C 69.593 0.000 1 1009 107 107 THR CG2 C 21.843 0.000 1 1010 107 107 THR N N 111.954 0.000 1 1011 108 108 LYS H H 7.739 0.000 1 1012 108 108 LYS HA H 4.355 0.000 1 1013 108 108 LYS HB2 H 1.751 0.000 2 1014 108 108 LYS HB3 H 1.912 0.000 2 1015 108 108 LYS HG2 H 1.371 0.000 2 1016 108 108 LYS HG3 H 1.407 0.000 2 1017 108 108 LYS C C 175.406 0.000 1 1018 108 108 LYS CA C 56.252 0.000 1 1019 108 108 LYS CB C 32.964 0.000 1 1020 108 108 LYS CG C 24.857 0.000 1 1021 108 108 LYS N N 123.177 0.000 1 1022 109 109 LYS H H 7.653 0.000 1 1023 109 109 LYS HB2 H 1.820 0.000 2 1024 109 109 LYS HB3 H 1.695 0.000 2 1025 109 109 LYS HG2 H 1.379 0.000 2 1026 109 109 LYS HG3 H 1.362 0.000 2 1027 109 109 LYS CB C 33.856 0.000 1 1028 109 109 LYS CG C 24.839 0.000 1 1029 109 109 LYS N N 127.535 0.000 1 stop_ save_