data_11140 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution structure of the 4th KH type I domain from human Vigilin ; _BMRB_accession_number 11140 _BMRB_flat_file_name bmr11140.str _Entry_type original _Submission_date 2010-03-31 _Accession_date 2010-03-31 _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 Tomizawa T. . . 2 Kigawa T. . . 3 Koshiba S. . . 4 Inoue M. . . 5 Yokoyama S. . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 571 "13C chemical shifts" 425 "15N chemical shifts" 98 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2011-04-01 original author . stop_ _Original_release_date 2011-04-01 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title 'Solution structure of the 4th KH type I domain from human Vigilin' _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 Tomizawa T. . . 2 Kigawa T. . . 3 Koshiba S. . . 4 Inoue M. . . 5 Yokoyama S. . . stop_ _Journal_abbreviation . _Journal_volume . _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first . _Page_last . _Year . _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name final001 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'KH domain' $entity_1 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_entity_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'KH domain' _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 102 _Mol_residue_sequence ; GSSGSSGEPEKLGQALTEVY AKANSFTVSSVAAPSWLHRF IIGKKGQNLAKITQQMPKVH IEFTEGEDKITLEGPTEDVS VAQEQIEGMVKDLINRSGPS SG ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 SER 3 SER 4 GLY 5 SER 6 SER 7 GLY 8 GLU 9 PRO 10 GLU 11 LYS 12 LEU 13 GLY 14 GLN 15 ALA 16 LEU 17 THR 18 GLU 19 VAL 20 TYR 21 ALA 22 LYS 23 ALA 24 ASN 25 SER 26 PHE 27 THR 28 VAL 29 SER 30 SER 31 VAL 32 ALA 33 ALA 34 PRO 35 SER 36 TRP 37 LEU 38 HIS 39 ARG 40 PHE 41 ILE 42 ILE 43 GLY 44 LYS 45 LYS 46 GLY 47 GLN 48 ASN 49 LEU 50 ALA 51 LYS 52 ILE 53 THR 54 GLN 55 GLN 56 MET 57 PRO 58 LYS 59 VAL 60 HIS 61 ILE 62 GLU 63 PHE 64 THR 65 GLU 66 GLY 67 GLU 68 ASP 69 LYS 70 ILE 71 THR 72 LEU 73 GLU 74 GLY 75 PRO 76 THR 77 GLU 78 ASP 79 VAL 80 SER 81 VAL 82 ALA 83 GLN 84 GLU 85 GLN 86 ILE 87 GLU 88 GLY 89 MET 90 VAL 91 LYS 92 ASP 93 LEU 94 ILE 95 ASN 96 ARG 97 SER 98 GLY 99 PRO 100 SER 101 SER 102 GLY stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-31 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 2CTF "Solution Structure Of The 4th Kh Type I Domain From Human Vigilin" 100.00 102 100.00 100.00 2.48e-66 DBJ BAC33456 "unnamed protein product [Mus musculus]" 51.96 422 98.11 100.00 2.52e-26 EMBL CAI46262 "hypothetical protein [Homo sapiens]" 51.96 248 100.00 100.00 9.83e-28 GB EDL39954 "high density lipoprotein (HDL) binding protein, isoform CRA_e [Mus musculus]" 88.24 314 97.78 100.00 1.06e-54 GB EDL91932 "high density lipoprotein binding protein, isoform CRA_d [Rattus norvegicus]" 88.24 329 97.78 100.00 1.10e-54 GB EDL91937 "high density lipoprotein binding protein, isoform CRA_d [Rattus norvegicus]" 88.24 329 97.78 100.00 1.10e-54 GB EDL91944 "high density lipoprotein binding protein, isoform CRA_d [Rattus norvegicus]" 88.24 329 97.78 100.00 1.10e-54 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $entity_1 human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $entity_1 'cell free synthesis' . Escherichia coli . P050131-13 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details ; 1.16mM KH domain U-15N, {13C;} 20mM {d-Tris-HCl;} 100mM {NaCl;} 1mM {d-DTT;} 0.02% {NaN3;} 10% D2O ; loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 1.16 mM '[U-13C; U-15N]' d-Tris-HCl 20 mM 'natural abundance' NaCl 100 mM 'natural abundance' d-DTT 1 mM 'natural abundance' NaN3 0.02 % 'natural abundance' H2O 90 % . D2O 10 % . stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Saveframe_category software _Name xwinnmr _Version 2.6 loop_ _Vendor _Address _Electronic_address Bruker . . stop_ loop_ _Task collection stop_ _Details . save_ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version 20030801 loop_ _Vendor _Address _Electronic_address 'Delaglio, F.' . . stop_ loop_ _Task processing stop_ _Details . save_ save_NMRview _Saveframe_category software _Name NMRView _Version 5.0.4 loop_ _Vendor _Address _Electronic_address 'Johnson, B.A.' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ save_Kujira _Saveframe_category software _Name Kujira _Version 0.9295 loop_ _Vendor _Address _Electronic_address 'Kobayashi, N.' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ save_CYANA _Saveframe_category software _Name CYANA _Version 2.0.17 loop_ _Vendor _Address _Electronic_address 'Guntert, P.' . . stop_ loop_ _Task 'structure solution' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model AVANCE _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_15N-separated_NOESY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 15N-separated NOESY' _Sample_label $sample_1 save_ save_3D_13C-separated_NOESY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 13C-separated NOESY' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_condition_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 120 0.1 mM pH 7.0 0.05 pH pressure 1 0.001 atm temperature 296 0.1 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Saveframe_category chemical_shift_reference _Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; 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 0.0 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.0 . indirect . . . 1.0 DSS N 15 'methyl protons' ppm 0.0 . 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_chemical_shift_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $XWINNMR $NMRPipe $NMRview $Kujira $CYANA stop_ loop_ _Experiment_label '3D 15N-separated NOESY' '3D 13C-separated NOESY' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $condition_1 _Chem_shift_reference_set_label $reference_1 _Mol_system_component_name 'KH domain' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 1 1 GLY HA2 H 3.758 0.030 1 2 1 1 GLY HA3 H 3.758 0.030 1 3 1 1 GLY CA C 41.373 0.300 1 4 6 6 SER HA H 4.372 0.030 1 5 6 6 SER HB2 H 3.801 0.030 1 6 6 6 SER HB3 H 3.801 0.030 1 7 6 6 SER C C 172.584 0.300 1 8 6 6 SER CA C 56.296 0.300 1 9 6 6 SER CB C 61.445 0.300 1 10 7 7 GLY H H 8.290 0.030 1 11 7 7 GLY HA2 H 3.862 0.030 1 12 7 7 GLY HA3 H 3.862 0.030 1 13 7 7 GLY C C 171.416 0.300 1 14 7 7 GLY CA C 42.734 0.300 1 15 7 7 GLY N N 110.305 0.300 1 16 8 8 GLU H H 8.129 0.030 1 17 8 8 GLU HA H 4.476 0.030 1 18 8 8 GLU HB2 H 1.773 0.030 2 19 8 8 GLU HB3 H 1.929 0.030 2 20 8 8 GLU HG2 H 2.145 0.030 1 21 8 8 GLU HG3 H 2.145 0.030 1 22 8 8 GLU C C 172.375 0.300 1 23 8 8 GLU CA C 52.167 0.300 1 24 8 8 GLU CB C 27.324 0.300 1 25 8 8 GLU CG C 33.833 0.300 1 26 8 8 GLU N N 121.275 0.300 1 27 9 9 PRO HA H 4.281 0.030 1 28 9 9 PRO HB2 H 2.192 0.030 2 29 9 9 PRO HB3 H 1.788 0.030 2 30 9 9 PRO HD2 H 3.701 0.030 2 31 9 9 PRO HD3 H 3.586 0.030 2 32 9 9 PRO HG2 H 1.907 0.030 1 33 9 9 PRO HG3 H 1.907 0.030 1 34 9 9 PRO C C 174.745 0.300 1 35 9 9 PRO CA C 61.020 0.300 1 36 9 9 PRO CB C 29.708 0.300 1 37 9 9 PRO CD C 48.267 0.300 1 38 9 9 PRO CG C 25.144 0.300 1 39 10 10 GLU H H 8.484 0.030 1 40 10 10 GLU HA H 4.084 0.030 1 41 10 10 GLU HB2 H 1.843 0.030 2 42 10 10 GLU HB3 H 1.899 0.030 2 43 10 10 GLU HG2 H 2.141 0.030 2 44 10 10 GLU HG3 H 2.172 0.030 2 45 10 10 GLU C C 174.329 0.300 1 46 10 10 GLU CA C 54.607 0.300 1 47 10 10 GLU CB C 27.830 0.300 1 48 10 10 GLU CG C 34.097 0.300 1 49 10 10 GLU N N 120.732 0.300 1 50 11 11 LYS H H 8.229 0.030 1 51 11 11 LYS HA H 4.206 0.030 1 52 11 11 LYS HB2 H 1.711 0.030 2 53 11 11 LYS HB3 H 1.640 0.030 2 54 11 11 LYS HD2 H 1.568 0.030 1 55 11 11 LYS HD3 H 1.568 0.030 1 56 11 11 LYS HE2 H 2.878 0.030 1 57 11 11 LYS HE3 H 2.878 0.030 1 58 11 11 LYS HG2 H 1.329 0.030 1 59 11 11 LYS HG3 H 1.329 0.030 1 60 11 11 LYS C C 174.174 0.300 1 61 11 11 LYS CA C 53.793 0.300 1 62 11 11 LYS CB C 30.549 0.300 1 63 11 11 LYS CD C 26.759 0.300 1 64 11 11 LYS CE C 39.859 0.300 1 65 11 11 LYS CG C 22.457 0.300 1 66 11 11 LYS N N 122.191 0.300 1 67 12 12 LEU H H 8.161 0.030 1 68 12 12 LEU HA H 4.236 0.030 1 69 12 12 LEU HB2 H 1.484 0.030 2 70 12 12 LEU HB3 H 1.568 0.030 2 71 12 12 LEU HD1 H 0.816 0.030 1 72 12 12 LEU HD2 H 0.764 0.030 1 73 12 12 LEU HG H 1.524 0.030 1 74 12 12 LEU C C 175.698 0.300 1 75 12 12 LEU CA C 53.017 0.300 1 76 12 12 LEU CB C 40.065 0.300 1 77 12 12 LEU CD1 C 22.571 0.300 2 78 12 12 LEU CD2 C 21.074 0.300 2 79 12 12 LEU CG C 24.699 0.300 1 80 12 12 LEU N N 123.074 0.300 1 81 13 13 GLY H H 8.364 0.030 1 82 13 13 GLY HA2 H 3.823 0.030 1 83 13 13 GLY HA3 H 3.823 0.030 1 84 13 13 GLY C C 171.915 0.300 1 85 13 13 GLY CA C 43.110 0.300 1 86 13 13 GLY N N 109.298 0.300 1 87 14 14 GLN H H 8.079 0.030 1 88 14 14 GLN HA H 4.197 0.030 1 89 14 14 GLN HB2 H 1.866 0.030 2 90 14 14 GLN HB3 H 1.981 0.030 2 91 14 14 GLN HE21 H 6.771 0.030 2 92 14 14 GLN HE22 H 7.472 0.030 2 93 14 14 GLN HG2 H 2.232 0.030 1 94 14 14 GLN HG3 H 2.232 0.030 1 95 14 14 GLN C C 173.448 0.300 1 96 14 14 GLN CA C 53.633 0.300 1 97 14 14 GLN CB C 27.269 0.300 1 98 14 14 GLN CG C 31.457 0.300 1 99 14 14 GLN N N 119.623 0.300 1 100 14 14 GLN NE2 N 112.170 0.300 1 101 15 15 ALA H H 8.275 0.030 1 102 15 15 ALA HA H 4.177 0.030 1 103 15 15 ALA HB H 1.285 0.030 1 104 15 15 ALA C C 175.533 0.300 1 105 15 15 ALA CA C 50.414 0.300 1 106 15 15 ALA CB C 16.831 0.300 1 107 15 15 ALA N N 124.693 0.300 1 108 16 16 LEU H H 8.184 0.030 1 109 16 16 LEU HA H 4.240 0.030 1 110 16 16 LEU HB2 H 1.569 0.030 2 111 16 16 LEU HB3 H 1.485 0.030 2 112 16 16 LEU HD1 H 0.817 0.030 1 113 16 16 LEU HD2 H 0.765 0.030 1 114 16 16 LEU HG H 1.527 0.030 1 115 16 16 LEU C C 175.394 0.300 1 116 16 16 LEU CA C 53.056 0.300 1 117 16 16 LEU CB C 39.859 0.300 1 118 16 16 LEU CD1 C 22.577 0.300 2 119 16 16 LEU CD2 C 21.074 0.300 2 120 16 16 LEU CG C 24.699 0.300 1 121 16 16 LEU N N 121.017 0.300 1 122 17 17 THR H H 7.905 0.030 1 123 17 17 THR HA H 4.169 0.030 1 124 17 17 THR HB H 4.112 0.030 1 125 17 17 THR HG2 H 1.092 0.030 1 126 17 17 THR C C 172.350 0.300 1 127 17 17 THR CA C 59.874 0.300 1 128 17 17 THR CB C 67.372 0.300 1 129 17 17 THR CG2 C 19.351 0.300 1 130 17 17 THR N N 113.629 0.300 1 131 18 18 GLU H H 8.192 0.030 1 132 18 18 GLU HA H 4.164 0.030 1 133 18 18 GLU HB2 H 1.816 0.030 2 134 18 18 GLU HB3 H 1.872 0.030 2 135 18 18 GLU HG2 H 2.077 0.030 2 136 18 18 GLU HG3 H 2.128 0.030 2 137 18 18 GLU C C 174.024 0.300 1 138 18 18 GLU CA C 54.480 0.300 1 139 18 18 GLU CB C 27.823 0.300 1 140 18 18 GLU CG C 33.927 0.300 1 141 18 18 GLU N N 122.679 0.300 1 142 19 19 VAL H H 7.911 0.030 1 143 19 19 VAL HA H 3.844 0.030 1 144 19 19 VAL HB H 1.854 0.030 1 145 19 19 VAL HG1 H 0.697 0.030 1 146 19 19 VAL HG2 H 0.768 0.030 1 147 19 19 VAL C C 173.873 0.300 1 148 19 19 VAL CA C 60.606 0.300 1 149 19 19 VAL CB C 30.178 0.300 1 150 19 19 VAL CG1 C 18.646 0.300 2 151 19 19 VAL CG2 C 18.443 0.300 2 152 19 19 VAL N N 120.455 0.300 1 153 20 20 TYR H H 8.041 0.030 1 154 20 20 TYR HA H 4.442 0.030 1 155 20 20 TYR HB2 H 2.813 0.030 2 156 20 20 TYR HB3 H 2.967 0.030 2 157 20 20 TYR HD1 H 7.002 0.030 1 158 20 20 TYR HD2 H 7.002 0.030 1 159 20 20 TYR HE1 H 6.695 0.030 1 160 20 20 TYR HE2 H 6.695 0.030 1 161 20 20 TYR C C 173.370 0.300 1 162 20 20 TYR CA C 55.590 0.300 1 163 20 20 TYR CB C 36.275 0.300 1 164 20 20 TYR CD1 C 130.814 0.300 1 165 20 20 TYR CD2 C 130.814 0.300 1 166 20 20 TYR CE1 C 115.917 0.300 1 167 20 20 TYR CE2 C 115.917 0.300 1 168 20 20 TYR N N 122.870 0.300 1 169 21 21 ALA H H 8.041 0.030 1 170 21 21 ALA HA H 4.146 0.030 1 171 21 21 ALA HB H 1.255 0.030 1 172 21 21 ALA C C 175.272 0.300 1 173 21 21 ALA CA C 50.267 0.300 1 174 21 21 ALA CB C 16.831 0.300 1 175 21 21 ALA N N 124.964 0.300 1 176 22 22 LYS H H 8.022 0.030 1 177 22 22 LYS HA H 4.120 0.030 1 178 22 22 LYS HB2 H 1.641 0.030 2 179 22 22 LYS HB3 H 1.727 0.030 2 180 22 22 LYS HD2 H 1.571 0.030 1 181 22 22 LYS HD3 H 1.571 0.030 1 182 22 22 LYS HE2 H 2.882 0.030 1 183 22 22 LYS HE3 H 2.882 0.030 1 184 22 22 LYS HG2 H 1.359 0.030 1 185 22 22 LYS HG3 H 1.359 0.030 1 186 22 22 LYS C C 174.355 0.300 1 187 22 22 LYS CA C 54.158 0.300 1 188 22 22 LYS CB C 30.554 0.300 1 189 22 22 LYS CD C 26.759 0.300 1 190 22 22 LYS CE C 39.777 0.300 1 191 22 22 LYS CG C 22.521 0.300 1 192 22 22 LYS N N 120.111 0.300 1 193 23 23 ALA H H 8.158 0.030 1 194 23 23 ALA HA H 4.179 0.030 1 195 23 23 ALA HB H 1.288 0.030 1 196 23 23 ALA C C 175.245 0.300 1 197 23 23 ALA CA C 50.321 0.300 1 198 23 23 ALA CB C 16.831 0.300 1 199 23 23 ALA N N 124.336 0.300 1 200 24 24 ASN H H 8.291 0.030 1 201 24 24 ASN HA H 4.648 0.030 1 202 24 24 ASN HB2 H 2.622 0.030 2 203 24 24 ASN HB3 H 2.738 0.030 2 204 24 24 ASN HD21 H 7.449 0.030 2 205 24 24 ASN HD22 H 6.790 0.030 2 206 24 24 ASN C C 172.836 0.300 1 207 24 24 ASN CA C 50.944 0.300 1 208 24 24 ASN CB C 36.563 0.300 1 209 24 24 ASN N N 117.132 0.300 1 210 24 24 ASN ND2 N 112.589 0.300 1 211 25 25 SER H H 8.048 0.030 1 212 25 25 SER HA H 4.409 0.030 1 213 25 25 SER HB2 H 3.801 0.030 1 214 25 25 SER HB3 H 3.801 0.030 1 215 25 25 SER CA C 56.090 0.300 1 216 25 25 SER CB C 61.722 0.300 1 217 25 25 SER N N 115.246 0.300 1 218 26 26 PHE H H 8.342 0.030 1 219 26 26 PHE HA H 4.735 0.030 1 220 26 26 PHE HB2 H 2.877 0.030 1 221 26 26 PHE HB3 H 2.877 0.030 1 222 26 26 PHE HD1 H 7.004 0.030 1 223 26 26 PHE HD2 H 7.004 0.030 1 224 26 26 PHE HE1 H 7.212 0.030 1 225 26 26 PHE HE2 H 7.212 0.030 1 226 26 26 PHE HZ H 7.179 0.030 1 227 26 26 PHE C C 172.508 0.300 1 228 26 26 PHE CA C 54.956 0.300 1 229 26 26 PHE CB C 39.035 0.300 1 230 26 26 PHE CD1 C 128.901 0.300 1 231 26 26 PHE CD2 C 128.901 0.300 1 232 26 26 PHE CE1 C 128.999 0.300 1 233 26 26 PHE CE2 C 128.999 0.300 1 234 26 26 PHE CZ C 127.542 0.300 1 235 26 26 PHE N N 124.613 0.300 1 236 27 27 THR H H 8.613 0.030 1 237 27 27 THR HA H 4.489 0.030 1 238 27 27 THR HB H 3.689 0.030 1 239 27 27 THR HG2 H 0.986 0.030 1 240 27 27 THR C C 168.693 0.300 1 241 27 27 THR CA C 58.922 0.300 1 242 27 27 THR CB C 69.422 0.300 1 243 27 27 THR CG2 C 18.482 0.300 1 244 27 27 THR N N 119.371 0.300 1 245 28 28 VAL H H 7.743 0.030 1 246 28 28 VAL HA H 4.976 0.030 1 247 28 28 VAL HB H 1.830 0.030 1 248 28 28 VAL HG1 H 0.811 0.030 1 249 28 28 VAL HG2 H 0.867 0.030 1 250 28 28 VAL C C 173.632 0.300 1 251 28 28 VAL CA C 58.234 0.300 1 252 28 28 VAL CB C 31.768 0.300 1 253 28 28 VAL CG1 C 18.550 0.300 2 254 28 28 VAL CG2 C 18.706 0.300 2 255 28 28 VAL N N 121.672 0.300 1 256 29 29 SER H H 9.270 0.030 1 257 29 29 SER HA H 4.709 0.030 1 258 29 29 SER HB2 H 3.376 0.030 2 259 29 29 SER HB3 H 3.442 0.030 2 260 29 29 SER C C 170.636 0.300 1 261 29 29 SER CA C 53.635 0.300 1 262 29 29 SER CB C 63.258 0.300 1 263 29 29 SER N N 121.600 0.300 1 264 30 30 SER H H 8.241 0.030 1 265 30 30 SER HA H 5.345 0.030 1 266 30 30 SER HB2 H 3.477 0.030 2 267 30 30 SER HB3 H 3.620 0.030 2 268 30 30 SER C C 170.584 0.300 1 269 30 30 SER CA C 54.850 0.300 1 270 30 30 SER CB C 63.559 0.300 1 271 30 30 SER N N 115.567 0.300 1 272 31 31 VAL H H 8.940 0.030 1 273 31 31 VAL HA H 4.088 0.030 1 274 31 31 VAL HB H 1.607 0.030 1 275 31 31 VAL HG1 H 0.758 0.030 1 276 31 31 VAL HG2 H 0.713 0.030 1 277 31 31 VAL C C 172.298 0.300 1 278 31 31 VAL CA C 58.164 0.300 1 279 31 31 VAL CB C 33.214 0.300 1 280 31 31 VAL CG1 C 18.817 0.300 2 281 31 31 VAL CG2 C 19.418 0.300 2 282 31 31 VAL N N 121.803 0.300 1 283 32 32 ALA H H 8.485 0.030 1 284 32 32 ALA HA H 4.280 0.030 1 285 32 32 ALA HB H 1.278 0.030 1 286 32 32 ALA C C 174.178 0.300 1 287 32 32 ALA CA C 50.394 0.300 1 288 32 32 ALA CB C 16.192 0.300 1 289 32 32 ALA N N 129.848 0.300 1 290 33 33 ALA H H 7.720 0.030 1 291 33 33 ALA HA H 4.474 0.030 1 292 33 33 ALA HB H 0.854 0.030 1 293 33 33 ALA C C 169.801 0.300 1 294 33 33 ALA CA C 46.778 0.300 1 295 33 33 ALA CB C 18.124 0.300 1 296 33 33 ALA N N 123.474 0.300 1 297 34 34 PRO HA H 4.080 0.030 1 298 34 34 PRO HB2 H 2.190 0.030 2 299 34 34 PRO HB3 H 1.110 0.030 2 300 34 34 PRO HD2 H 3.589 0.030 2 301 34 34 PRO HD3 H 3.074 0.030 2 302 34 34 PRO HG2 H 1.902 0.030 2 303 34 34 PRO HG3 H 1.633 0.030 2 304 34 34 PRO CA C 60.354 0.300 1 305 34 34 PRO CB C 30.101 0.300 1 306 34 34 PRO CD C 47.929 0.300 1 307 34 34 PRO CG C 25.143 0.300 1 308 35 35 SER H H 8.788 0.030 1 309 35 35 SER HA H 2.671 0.030 1 310 35 35 SER HB2 H 3.671 0.030 2 311 35 35 SER HB3 H 3.791 0.030 2 312 35 35 SER C C 174.722 0.300 1 313 35 35 SER CA C 59.105 0.300 1 314 35 35 SER CB C 60.426 0.300 1 315 35 35 SER N N 118.493 0.300 1 316 36 36 TRP H H 7.617 0.030 1 317 36 36 TRP HA H 4.397 0.030 1 318 36 36 TRP HB2 H 3.563 0.030 2 319 36 36 TRP HB3 H 3.138 0.030 2 320 36 36 TRP HD1 H 7.402 0.030 1 321 36 36 TRP HE1 H 10.413 0.030 1 322 36 36 TRP HE3 H 7.437 0.030 1 323 36 36 TRP HH2 H 7.004 0.030 1 324 36 36 TRP HZ2 H 7.344 0.030 1 325 36 36 TRP HZ3 H 6.807 0.030 1 326 36 36 TRP C C 174.461 0.300 1 327 36 36 TRP CA C 55.803 0.300 1 328 36 36 TRP CB C 25.171 0.300 1 329 36 36 TRP CD1 C 125.663 0.300 1 330 36 36 TRP CE3 C 118.670 0.300 1 331 36 36 TRP CH2 C 122.532 0.300 1 332 36 36 TRP CZ2 C 112.230 0.300 1 333 36 36 TRP CZ3 C 119.846 0.300 1 334 36 36 TRP N N 118.948 0.300 1 335 36 36 TRP NE1 N 130.267 0.300 1 336 37 37 LEU H H 7.264 0.030 1 337 37 37 LEU HA H 4.291 0.030 1 338 37 37 LEU HB2 H 1.120 0.030 2 339 37 37 LEU HB3 H 0.835 0.030 2 340 37 37 LEU HD1 H 0.487 0.030 1 341 37 37 LEU HD2 H 0.362 0.030 1 342 37 37 LEU HG H 0.811 0.030 1 343 37 37 LEU C C 176.558 0.300 1 344 37 37 LEU CA C 52.257 0.300 1 345 37 37 LEU CB C 39.719 0.300 1 346 37 37 LEU CD1 C 23.309 0.300 2 347 37 37 LEU CD2 C 23.930 0.300 2 348 37 37 LEU CG C 23.882 0.300 1 349 37 37 LEU N N 116.894 0.300 1 350 38 38 HIS H H 7.728 0.030 1 351 38 38 HIS HA H 3.814 0.030 1 352 38 38 HIS HB2 H 3.020 0.030 2 353 38 38 HIS HB3 H 2.800 0.030 2 354 38 38 HIS HD2 H 6.070 0.030 1 355 38 38 HIS HE1 H 7.759 0.030 1 356 38 38 HIS C C 175.183 0.300 1 357 38 38 HIS CA C 58.305 0.300 1 358 38 38 HIS CB C 28.542 0.300 1 359 38 38 HIS CD2 C 113.779 0.300 1 360 38 38 HIS CE1 C 136.406 0.300 1 361 38 38 HIS N N 121.154 0.300 1 362 39 39 ARG H H 8.496 0.030 1 363 39 39 ARG HA H 3.866 0.030 1 364 39 39 ARG HB2 H 1.566 0.030 2 365 39 39 ARG HB3 H 1.486 0.030 2 366 39 39 ARG HD2 H 2.876 0.030 1 367 39 39 ARG HD3 H 2.876 0.030 1 368 39 39 ARG HG2 H 1.186 0.030 2 369 39 39 ARG HG3 H 0.638 0.030 2 370 39 39 ARG C C 175.654 0.300 1 371 39 39 ARG CA C 56.007 0.300 1 372 39 39 ARG CB C 26.388 0.300 1 373 39 39 ARG CD C 41.012 0.300 1 374 39 39 ARG CG C 23.471 0.300 1 375 39 39 ARG N N 114.339 0.300 1 376 40 40 PHE H H 7.294 0.030 1 377 40 40 PHE HA H 4.372 0.030 1 378 40 40 PHE HB2 H 3.196 0.030 2 379 40 40 PHE HB3 H 2.935 0.030 2 380 40 40 PHE HD1 H 7.259 0.030 1 381 40 40 PHE HD2 H 7.259 0.030 1 382 40 40 PHE HE1 H 7.457 0.030 1 383 40 40 PHE HE2 H 7.457 0.030 1 384 40 40 PHE HZ H 7.373 0.030 1 385 40 40 PHE C C 174.721 0.300 1 386 40 40 PHE CA C 57.117 0.300 1 387 40 40 PHE CB C 37.335 0.300 1 388 40 40 PHE CD1 C 129.149 0.300 1 389 40 40 PHE CD2 C 129.149 0.300 1 390 40 40 PHE CE1 C 129.433 0.300 1 391 40 40 PHE CE2 C 129.433 0.300 1 392 40 40 PHE CZ C 128.063 0.300 1 393 40 40 PHE N N 118.848 0.300 1 394 41 41 ILE H H 7.627 0.030 1 395 41 41 ILE HA H 3.705 0.030 1 396 41 41 ILE HB H 1.866 0.030 1 397 41 41 ILE HD1 H 0.567 0.030 1 398 41 41 ILE HG12 H 1.039 0.030 2 399 41 41 ILE HG13 H 1.458 0.030 2 400 41 41 ILE HG2 H 0.770 0.030 1 401 41 41 ILE C C 173.890 0.300 1 402 41 41 ILE CA C 61.267 0.300 1 403 41 41 ILE CB C 35.648 0.300 1 404 41 41 ILE CD1 C 11.135 0.300 1 405 41 41 ILE CG1 C 25.906 0.300 1 406 41 41 ILE CG2 C 14.907 0.300 1 407 41 41 ILE N N 118.706 0.300 1 408 42 42 ILE H H 7.651 0.030 1 409 42 42 ILE HA H 3.648 0.030 1 410 42 42 ILE HB H 1.419 0.030 1 411 42 42 ILE HD1 H 0.248 0.030 1 412 42 42 ILE HG12 H 1.055 0.030 2 413 42 42 ILE HG13 H 0.587 0.030 2 414 42 42 ILE HG2 H 0.750 0.030 1 415 42 42 ILE C C 175.718 0.300 1 416 42 42 ILE CA C 61.549 0.300 1 417 42 42 ILE CB C 36.536 0.300 1 418 42 42 ILE CD1 C 10.383 0.300 1 419 42 42 ILE CG1 C 26.388 0.300 1 420 42 42 ILE CG2 C 15.321 0.300 1 421 42 42 ILE N N 116.765 0.300 1 422 43 43 GLY H H 7.386 0.030 1 423 43 43 GLY HA2 H 3.826 0.030 2 424 43 43 GLY HA3 H 3.914 0.030 2 425 43 43 GLY C C 172.059 0.300 1 426 43 43 GLY CA C 42.194 0.300 1 427 43 43 GLY N N 105.629 0.300 1 428 44 44 LYS HA H 4.083 0.030 1 429 44 44 LYS HB2 H 1.725 0.030 1 430 44 44 LYS HB3 H 1.725 0.030 1 431 44 44 LYS HD2 H 1.598 0.030 1 432 44 44 LYS HD3 H 1.598 0.030 1 433 44 44 LYS HE2 H 2.895 0.030 1 434 44 44 LYS HE3 H 2.895 0.030 1 435 44 44 LYS HG2 H 1.417 0.030 2 436 44 44 LYS HG3 H 1.316 0.030 2 437 44 44 LYS CA C 55.561 0.300 1 438 44 44 LYS CB C 29.964 0.300 1 439 44 44 LYS CD C 27.000 0.300 1 440 44 44 LYS CE C 39.667 0.300 1 441 44 44 LYS CG C 22.500 0.300 1 442 45 45 LYS HA H 4.118 0.030 1 443 45 45 LYS HB2 H 1.727 0.030 2 444 45 45 LYS HB3 H 1.948 0.030 2 445 45 45 LYS HD2 H 1.555 0.030 2 446 45 45 LYS HD3 H 1.587 0.030 2 447 45 45 LYS HE2 H 2.878 0.030 2 448 45 45 LYS HG2 H 1.321 0.030 1 449 45 45 LYS HG3 H 1.321 0.030 1 450 45 45 LYS C C 174.545 0.300 1 451 45 45 LYS CA C 53.898 0.300 1 452 45 45 LYS CB C 29.011 0.300 1 453 45 45 LYS CD C 26.594 0.300 1 454 45 45 LYS CE C 39.777 0.300 1 455 45 45 LYS CG C 22.722 0.300 1 456 46 46 GLY H H 7.826 0.030 1 457 46 46 GLY HA2 H 3.923 0.030 2 458 46 46 GLY HA3 H 3.636 0.030 2 459 46 46 GLY C C 174.414 0.300 1 460 46 46 GLY CA C 43.909 0.300 1 461 46 46 GLY N N 106.630 0.300 1 462 47 47 GLN HA H 4.087 0.030 1 463 47 47 GLN HB2 H 2.022 0.030 2 464 47 47 GLN HB3 H 1.606 0.030 2 465 47 47 GLN HE21 H 7.410 0.030 2 466 47 47 GLN HE22 H 6.820 0.030 2 467 47 47 GLN HG2 H 2.331 0.030 1 468 47 47 GLN HG3 H 2.331 0.030 1 469 47 47 GLN C C 174.860 0.300 1 470 47 47 GLN CA C 55.596 0.300 1 471 47 47 GLN CB C 26.429 0.300 1 472 47 47 GLN CG C 31.417 0.300 1 473 47 47 GLN NE2 N 111.464 0.300 1 474 48 48 ASN H H 7.969 0.030 1 475 48 48 ASN HA H 4.532 0.030 1 476 48 48 ASN HB2 H 2.724 0.030 1 477 48 48 ASN HB3 H 2.724 0.030 1 478 48 48 ASN HD21 H 6.859 0.030 2 479 48 48 ASN HD22 H 7.465 0.030 2 480 48 48 ASN C C 174.678 0.300 1 481 48 48 ASN CA C 52.894 0.300 1 482 48 48 ASN CB C 35.590 0.300 1 483 48 48 ASN N N 118.389 0.300 1 484 48 48 ASN ND2 N 112.276 0.300 1 485 49 49 LEU H H 7.898 0.030 1 486 49 49 LEU HA H 4.026 0.030 1 487 49 49 LEU HB2 H 1.665 0.030 2 488 49 49 LEU HB3 H 1.540 0.030 2 489 49 49 LEU HD1 H 0.766 0.030 1 490 49 49 LEU HD2 H 0.801 0.030 1 491 49 49 LEU HG H 1.633 0.030 1 492 49 49 LEU C C 175.995 0.300 1 493 49 49 LEU CA C 54.662 0.300 1 494 49 49 LEU CB C 39.615 0.300 1 495 49 49 LEU CD1 C 22.241 0.300 2 496 49 49 LEU CD2 C 22.119 0.300 2 497 49 49 LEU CG C 24.620 0.300 1 498 49 49 LEU N N 119.757 0.300 1 499 50 50 ALA H H 7.863 0.030 1 500 50 50 ALA HA H 4.066 0.030 1 501 50 50 ALA HB H 1.346 0.030 1 502 50 50 ALA C C 177.173 0.300 1 503 50 50 ALA CA C 52.401 0.300 1 504 50 50 ALA CB C 15.658 0.300 1 505 50 50 ALA N N 120.704 0.300 1 506 51 51 LYS H H 7.506 0.030 1 507 51 51 LYS HA H 3.963 0.030 1 508 51 51 LYS HB2 H 1.827 0.030 1 509 51 51 LYS HB3 H 1.827 0.030 1 510 51 51 LYS HD2 H 1.603 0.030 1 511 51 51 LYS HD3 H 1.603 0.030 1 512 51 51 LYS HE2 H 2.878 0.030 1 513 51 51 LYS HE3 H 2.878 0.030 1 514 51 51 LYS HG2 H 1.349 0.030 2 515 51 51 LYS HG3 H 1.496 0.030 2 516 51 51 LYS C C 176.717 0.300 1 517 51 51 LYS CA C 56.807 0.300 1 518 51 51 LYS CB C 29.849 0.300 1 519 51 51 LYS CD C 26.759 0.300 1 520 51 51 LYS CE C 39.694 0.300 1 521 51 51 LYS CG C 22.792 0.300 1 522 51 51 LYS N N 116.689 0.300 1 523 52 52 ILE H H 7.541 0.030 1 524 52 52 ILE HA H 3.717 0.030 1 525 52 52 ILE HB H 1.873 0.030 1 526 52 52 ILE HD1 H 0.672 0.030 1 527 52 52 ILE HG12 H 1.599 0.030 2 528 52 52 ILE HG13 H 1.010 0.030 2 529 52 52 ILE HG2 H 0.725 0.030 1 530 52 52 ILE C C 175.499 0.300 1 531 52 52 ILE CA C 62.430 0.300 1 532 52 52 ILE CB C 35.699 0.300 1 533 52 52 ILE CD1 C 11.219 0.300 1 534 52 52 ILE CG1 C 26.186 0.300 1 535 52 52 ILE CG2 C 14.592 0.300 1 536 52 52 ILE N N 118.819 0.300 1 537 53 53 THR H H 7.965 0.030 1 538 53 53 THR HA H 3.907 0.030 1 539 53 53 THR HB H 4.228 0.030 1 540 53 53 THR HG2 H 1.165 0.030 1 541 53 53 THR C C 174.492 0.300 1 542 53 53 THR CA C 62.520 0.300 1 543 53 53 THR CB C 66.511 0.300 1 544 53 53 THR CG2 C 19.594 0.300 1 545 53 53 THR N N 111.604 0.300 1 546 54 54 GLN H H 7.717 0.030 1 547 54 54 GLN HA H 3.969 0.030 1 548 54 54 GLN HB2 H 2.087 0.030 2 549 54 54 GLN HB3 H 2.021 0.030 2 550 54 54 GLN HE21 H 6.715 0.030 2 551 54 54 GLN HE22 H 7.368 0.030 2 552 54 54 GLN HG2 H 2.313 0.030 2 553 54 54 GLN HG3 H 2.412 0.030 2 554 54 54 GLN C C 175.296 0.300 1 555 54 54 GLN CA C 55.943 0.300 1 556 54 54 GLN CB C 26.306 0.300 1 557 54 54 GLN CG C 31.785 0.300 1 558 54 54 GLN N N 119.090 0.300 1 559 54 54 GLN NE2 N 111.131 0.300 1 560 55 55 GLN H H 7.483 0.030 1 561 55 55 GLN HA H 4.117 0.030 1 562 55 55 GLN HB2 H 2.100 0.030 1 563 55 55 GLN HB3 H 2.100 0.030 1 564 55 55 GLN HE21 H 6.765 0.030 2 565 55 55 GLN HE22 H 7.380 0.030 2 566 55 55 GLN HG2 H 2.455 0.030 2 567 55 55 GLN HG3 H 2.329 0.030 2 568 55 55 GLN C C 173.880 0.300 1 569 55 55 GLN CA C 54.727 0.300 1 570 55 55 GLN CB C 27.216 0.300 1 571 55 55 GLN CG C 31.867 0.300 1 572 55 55 GLN N N 115.825 0.300 1 573 55 55 GLN NE2 N 110.879 0.300 1 574 56 56 MET H H 7.766 0.030 1 575 56 56 MET HA H 4.860 0.030 1 576 56 56 MET HB2 H 1.919 0.030 2 577 56 56 MET HB3 H 1.786 0.030 2 578 56 56 MET HE H 1.917 0.030 1 579 56 56 MET HG2 H 2.299 0.030 2 580 56 56 MET HG3 H 2.387 0.030 2 581 56 56 MET C C 170.991 0.300 1 582 56 56 MET CA C 50.833 0.300 1 583 56 56 MET CB C 30.384 0.300 1 584 56 56 MET CE C 15.066 0.300 1 585 56 56 MET CG C 29.687 0.300 1 586 56 56 MET N N 116.980 0.300 1 587 57 57 PRO HA H 4.522 0.030 1 588 57 57 PRO HB2 H 2.291 0.030 2 589 57 57 PRO HB3 H 1.875 0.030 2 590 57 57 PRO HD2 H 3.523 0.030 2 591 57 57 PRO HD3 H 3.237 0.030 2 592 57 57 PRO HG2 H 1.926 0.030 2 593 57 57 PRO HG3 H 1.763 0.030 2 594 57 57 PRO C C 176.042 0.300 1 595 57 57 PRO CA C 62.198 0.300 1 596 57 57 PRO CB C 29.972 0.300 1 597 57 57 PRO CD C 48.016 0.300 1 598 57 57 PRO CG C 24.946 0.300 1 599 58 58 LYS H H 8.436 0.030 1 600 58 58 LYS HA H 4.246 0.030 1 601 58 58 LYS HB2 H 1.886 0.030 2 602 58 58 LYS HB3 H 1.630 0.030 2 603 58 58 LYS HD2 H 1.619 0.030 1 604 58 58 LYS HD3 H 1.619 0.030 1 605 58 58 LYS HE2 H 2.916 0.030 1 606 58 58 LYS HE3 H 2.916 0.030 1 607 58 58 LYS HG2 H 1.292 0.030 2 608 58 58 LYS HG3 H 1.397 0.030 2 609 58 58 LYS C C 173.387 0.300 1 610 58 58 LYS CA C 54.004 0.300 1 611 58 58 LYS CB C 29.939 0.300 1 612 58 58 LYS CD C 26.759 0.300 1 613 58 58 LYS CE C 39.947 0.300 1 614 58 58 LYS CG C 23.436 0.300 1 615 58 58 LYS N N 116.193 0.300 1 616 59 59 VAL H H 7.530 0.030 1 617 59 59 VAL HA H 4.394 0.030 1 618 59 59 VAL HB H 1.948 0.030 1 619 59 59 VAL HG1 H 0.557 0.030 1 620 59 59 VAL HG2 H 0.638 0.030 1 621 59 59 VAL C C 171.996 0.300 1 622 59 59 VAL CA C 59.063 0.300 1 623 59 59 VAL CB C 30.243 0.300 1 624 59 59 VAL CG1 C 19.344 0.300 2 625 59 59 VAL CG2 C 21.391 0.300 2 626 59 59 VAL N N 118.127 0.300 1 627 60 60 HIS H H 9.135 0.030 1 628 60 60 HIS HA H 4.788 0.030 1 629 60 60 HIS HB2 H 3.023 0.030 2 630 60 60 HIS HB3 H 3.082 0.030 2 631 60 60 HIS HD2 H 7.019 0.030 1 632 60 60 HIS HE1 H 8.176 0.030 1 633 60 60 HIS C C 171.740 0.300 1 634 60 60 HIS CA C 52.546 0.300 1 635 60 60 HIS CB C 28.489 0.300 1 636 60 60 HIS CD2 C 117.368 0.300 1 637 60 60 HIS CE1 C 134.841 0.300 1 638 60 60 HIS N N 126.730 0.300 1 639 61 61 ILE H H 8.246 0.030 1 640 61 61 ILE HA H 4.617 0.030 1 641 61 61 ILE HB H 1.410 0.030 1 642 61 61 ILE HD1 H 0.566 0.030 1 643 61 61 ILE HG12 H 1.341 0.030 2 644 61 61 ILE HG13 H 0.531 0.030 2 645 61 61 ILE HG2 H 0.329 0.030 1 646 61 61 ILE C C 171.834 0.300 1 647 61 61 ILE CA C 57.915 0.300 1 648 61 61 ILE CB C 37.238 0.300 1 649 61 61 ILE CD1 C 11.549 0.300 1 650 61 61 ILE CG1 C 25.328 0.300 1 651 61 61 ILE CG2 C 15.231 0.300 1 652 61 61 ILE N N 127.476 0.300 1 653 62 62 GLU H H 8.584 0.030 1 654 62 62 GLU HA H 4.528 0.030 1 655 62 62 GLU HB2 H 1.843 0.030 2 656 62 62 GLU HB3 H 1.645 0.030 2 657 62 62 GLU HG2 H 2.021 0.030 1 658 62 62 GLU HG3 H 2.021 0.030 1 659 62 62 GLU C C 171.733 0.300 1 660 62 62 GLU CA C 52.410 0.300 1 661 62 62 GLU CB C 30.960 0.300 1 662 62 62 GLU CG C 33.574 0.300 1 663 62 62 GLU N N 126.080 0.300 1 664 63 63 PHE H H 8.812 0.030 1 665 63 63 PHE HA H 4.605 0.030 1 666 63 63 PHE HB2 H 2.970 0.030 2 667 63 63 PHE HB3 H 2.771 0.030 2 668 63 63 PHE HD1 H 6.771 0.030 1 669 63 63 PHE HD2 H 6.771 0.030 1 670 63 63 PHE HE1 H 6.788 0.030 1 671 63 63 PHE HE2 H 6.788 0.030 1 672 63 63 PHE HZ H 6.700 0.030 1 673 63 63 PHE C C 172.657 0.300 1 674 63 63 PHE CA C 53.916 0.300 1 675 63 63 PHE CB C 37.308 0.300 1 676 63 63 PHE CD1 C 129.298 0.300 1 677 63 63 PHE CD2 C 129.298 0.300 1 678 63 63 PHE CE1 C 128.225 0.300 1 679 63 63 PHE CE2 C 128.225 0.300 1 680 63 63 PHE CZ C 126.123 0.300 1 681 63 63 PHE N N 124.776 0.300 1 682 64 64 THR H H 8.800 0.030 1 683 64 64 THR HA H 4.267 0.030 1 684 64 64 THR HB H 3.836 0.030 1 685 64 64 THR HG2 H 1.115 0.030 1 686 64 64 THR C C 172.051 0.300 1 687 64 64 THR CA C 59.714 0.300 1 688 64 64 THR CB C 67.089 0.300 1 689 64 64 THR CG2 C 19.954 0.300 1 690 64 64 THR N N 121.781 0.300 1 691 65 65 GLU H H 8.772 0.030 1 692 65 65 GLU HA H 3.712 0.030 1 693 65 65 GLU HB2 H 1.823 0.030 1 694 65 65 GLU HB3 H 1.823 0.030 1 695 65 65 GLU HG2 H 2.067 0.030 1 696 65 65 GLU HG3 H 2.067 0.030 1 697 65 65 GLU C C 175.485 0.300 1 698 65 65 GLU CA C 56.446 0.300 1 699 65 65 GLU CB C 27.088 0.300 1 700 65 65 GLU CG C 33.680 0.300 1 701 65 65 GLU N N 128.428 0.300 1 702 66 66 GLY H H 8.888 0.030 1 703 66 66 GLY HA2 H 4.059 0.030 2 704 66 66 GLY HA3 H 3.680 0.030 2 705 66 66 GLY C C 171.812 0.300 1 706 66 66 GLY CA C 43.229 0.300 1 707 66 66 GLY N N 111.186 0.300 1 708 67 67 GLU H H 7.479 0.030 1 709 67 67 GLU HA H 4.514 0.030 1 710 67 67 GLU HB2 H 2.146 0.030 2 711 67 67 GLU HB3 H 1.793 0.030 2 712 67 67 GLU HG2 H 2.069 0.030 2 713 67 67 GLU HG3 H 2.126 0.030 2 714 67 67 GLU C C 173.185 0.300 1 715 67 67 GLU CA C 52.911 0.300 1 716 67 67 GLU CB C 29.478 0.300 1 717 67 67 GLU CG C 34.256 0.300 1 718 67 67 GLU N N 117.404 0.300 1 719 68 68 ASP H H 8.184 0.030 1 720 68 68 ASP HA H 4.813 0.030 1 721 68 68 ASP HB2 H 2.648 0.030 1 722 68 68 ASP HB3 H 2.648 0.030 1 723 68 68 ASP C C 174.465 0.300 1 724 68 68 ASP CA C 52.048 0.300 1 725 68 68 ASP CB C 37.703 0.300 1 726 68 68 ASP N N 119.070 0.300 1 727 69 69 LYS H H 7.464 0.030 1 728 69 69 LYS HA H 5.011 0.030 1 729 69 69 LYS HB2 H 1.588 0.030 2 730 69 69 LYS HB3 H 1.416 0.030 2 731 69 69 LYS HD2 H 1.468 0.030 2 732 69 69 LYS HD3 H 1.403 0.030 2 733 69 69 LYS HE2 H 2.745 0.030 1 734 69 69 LYS HE3 H 2.745 0.030 1 735 69 69 LYS HG2 H 1.123 0.030 1 736 69 69 LYS HG3 H 1.123 0.030 1 737 69 69 LYS C C 171.195 0.300 1 738 69 69 LYS CA C 53.123 0.300 1 739 69 69 LYS CB C 34.050 0.300 1 740 69 69 LYS CD C 27.137 0.300 1 741 69 69 LYS CE C 39.643 0.300 1 742 69 69 LYS CG C 21.815 0.300 1 743 69 69 LYS N N 115.401 0.300 1 744 70 70 ILE H H 8.623 0.030 1 745 70 70 ILE HA H 4.198 0.030 1 746 70 70 ILE HB H 1.125 0.030 1 747 70 70 ILE HD1 H 0.161 0.030 1 748 70 70 ILE HG12 H -0.007 0.030 2 749 70 70 ILE HG13 H 0.912 0.030 2 750 70 70 ILE HG2 H 0.149 0.030 1 751 70 70 ILE C C 173.065 0.300 1 752 70 70 ILE CA C 57.713 0.300 1 753 70 70 ILE CB C 38.584 0.300 1 754 70 70 ILE CD1 C 12.455 0.300 1 755 70 70 ILE CG1 C 24.573 0.300 1 756 70 70 ILE CG2 C 14.712 0.300 1 757 70 70 ILE N N 123.018 0.300 1 758 71 71 THR H H 8.814 0.030 1 759 71 71 THR HA H 4.735 0.030 1 760 71 71 THR HB H 3.861 0.030 1 761 71 71 THR HG2 H 0.997 0.030 1 762 71 71 THR C C 170.512 0.300 1 763 71 71 THR CA C 59.556 0.300 1 764 71 71 THR CB C 67.993 0.300 1 765 71 71 THR CG2 C 19.538 0.300 1 766 71 71 THR N N 121.110 0.300 1 767 72 72 LEU H H 8.713 0.030 1 768 72 72 LEU HA H 5.095 0.030 1 769 72 72 LEU HB2 H 1.422 0.030 2 770 72 72 LEU HB3 H 1.045 0.030 2 771 72 72 LEU HD1 H 0.551 0.030 1 772 72 72 LEU HD2 H 0.522 0.030 1 773 72 72 LEU HG H 1.333 0.030 1 774 72 72 LEU C C 172.287 0.300 1 775 72 72 LEU CA C 51.678 0.300 1 776 72 72 LEU CB C 43.741 0.300 1 777 72 72 LEU CD1 C 23.626 0.300 2 778 72 72 LEU CD2 C 24.650 0.300 2 779 72 72 LEU CG C 25.681 0.300 1 780 72 72 LEU N N 124.155 0.300 1 781 73 73 GLU H H 8.398 0.030 1 782 73 73 GLU HA H 5.383 0.030 1 783 73 73 GLU HB2 H 1.946 0.030 2 784 73 73 GLU HB3 H 1.998 0.030 2 785 73 73 GLU HG2 H 2.177 0.030 1 786 73 73 GLU HG3 H 2.177 0.030 1 787 73 73 GLU C C 172.831 0.300 1 788 73 73 GLU CA C 51.727 0.300 1 789 73 73 GLU CB C 31.512 0.300 1 790 73 73 GLU CG C 34.092 0.300 1 791 73 73 GLU N N 118.689 0.300 1 792 74 74 GLY H H 7.979 0.030 1 793 74 74 GLY HA2 H 3.761 0.030 2 794 74 74 GLY HA3 H 4.195 0.030 2 795 74 74 GLY C C 166.281 0.300 1 796 74 74 GLY CA C 43.076 0.300 1 797 74 74 GLY N N 110.796 0.300 1 798 75 75 PRO HA H 4.475 0.030 1 799 75 75 PRO HB2 H 2.357 0.030 2 800 75 75 PRO HB3 H 1.848 0.030 2 801 75 75 PRO HD2 H 3.107 0.030 2 802 75 75 PRO HD3 H 3.506 0.030 2 803 75 75 PRO HG2 H 1.878 0.030 2 804 75 75 PRO HG3 H 2.083 0.030 2 805 75 75 PRO C C 175.974 0.300 1 806 75 75 PRO CA C 60.377 0.300 1 807 75 75 PRO CB C 29.797 0.300 1 808 75 75 PRO CD C 47.879 0.300 1 809 75 75 PRO CG C 25.935 0.300 1 810 76 76 THR H H 8.349 0.030 1 811 76 76 THR HA H 3.446 0.030 1 812 76 76 THR HB H 3.844 0.030 1 813 76 76 THR HG2 H 1.062 0.030 1 814 76 76 THR C C 173.389 0.300 1 815 76 76 THR CA C 65.067 0.300 1 816 76 76 THR CB C 67.003 0.300 1 817 76 76 THR CG2 C 19.203 0.300 1 818 76 76 THR N N 121.692 0.300 1 819 77 77 GLU H H 9.392 0.030 1 820 77 77 GLU HA H 3.965 0.030 1 821 77 77 GLU HB2 H 1.874 0.030 1 822 77 77 GLU HB3 H 1.874 0.030 1 823 77 77 GLU HG2 H 2.194 0.030 1 824 77 77 GLU HG3 H 2.194 0.030 1 825 77 77 GLU C C 175.678 0.300 1 826 77 77 GLU CA C 57.195 0.300 1 827 77 77 GLU CB C 26.270 0.300 1 828 77 77 GLU CG C 33.762 0.300 1 829 77 77 GLU N N 119.685 0.300 1 830 78 78 ASP H H 7.038 0.030 1 831 78 78 ASP HA H 4.358 0.030 1 832 78 78 ASP HB2 H 2.486 0.030 2 833 78 78 ASP HB3 H 2.248 0.030 2 834 78 78 ASP C C 175.654 0.300 1 835 78 78 ASP CA C 54.177 0.300 1 836 78 78 ASP CB C 39.087 0.300 1 837 78 78 ASP N N 118.858 0.300 1 838 79 79 VAL H H 8.393 0.030 1 839 79 79 VAL HA H 3.076 0.030 1 840 79 79 VAL HB H 1.694 0.030 1 841 79 79 VAL HG1 H 0.594 0.030 1 842 79 79 VAL HG2 H 0.497 0.030 1 843 79 79 VAL C C 174.680 0.300 1 844 79 79 VAL CA C 65.010 0.300 1 845 79 79 VAL CB C 28.972 0.300 1 846 79 79 VAL CG1 C 19.426 0.300 2 847 79 79 VAL CG2 C 22.119 0.300 2 848 79 79 VAL N N 119.864 0.300 1 849 80 80 SER H H 7.816 0.030 1 850 80 80 SER HA H 4.002 0.030 1 851 80 80 SER HB2 H 3.828 0.030 1 852 80 80 SER HB3 H 3.828 0.030 1 853 80 80 SER C C 174.611 0.300 1 854 80 80 SER CA C 59.669 0.300 1 855 80 80 SER CB C 60.281 0.300 1 856 80 80 SER N N 112.969 0.300 1 857 81 81 VAL H H 6.977 0.030 1 858 81 81 VAL HA H 3.702 0.030 1 859 81 81 VAL HB H 2.036 0.030 1 860 81 81 VAL HG1 H 0.850 0.030 1 861 81 81 VAL HG2 H 1.004 0.030 1 862 81 81 VAL C C 176.242 0.300 1 863 81 81 VAL CA C 63.516 0.300 1 864 81 81 VAL CB C 29.968 0.300 1 865 81 81 VAL CG1 C 18.998 0.300 2 866 81 81 VAL CG2 C 19.940 0.300 2 867 81 81 VAL N N 121.568 0.300 1 868 82 82 ALA H H 8.221 0.030 1 869 82 82 ALA HA H 3.821 0.030 1 870 82 82 ALA HB H 1.239 0.030 1 871 82 82 ALA C C 176.453 0.300 1 872 82 82 ALA CA C 52.923 0.300 1 873 82 82 ALA CB C 16.419 0.300 1 874 82 82 ALA N N 122.174 0.300 1 875 83 83 GLN H H 9.168 0.030 1 876 83 83 GLN HA H 3.359 0.030 1 877 83 83 GLN HB2 H 2.025 0.030 2 878 83 83 GLN HB3 H 1.911 0.030 2 879 83 83 GLN HE21 H 6.668 0.030 2 880 83 83 GLN HE22 H 7.506 0.030 2 881 83 83 GLN HG2 H 1.854 0.030 2 882 83 83 GLN HG3 H 2.125 0.030 2 883 83 83 GLN C C 175.008 0.300 1 884 83 83 GLN CA C 57.822 0.300 1 885 83 83 GLN CB C 25.235 0.300 1 886 83 83 GLN CG C 30.631 0.300 1 887 83 83 GLN N N 117.542 0.300 1 888 83 83 GLN NE2 N 111.386 0.300 1 889 84 84 GLU H H 7.331 0.030 1 890 84 84 GLU HA H 4.001 0.030 1 891 84 84 GLU HB2 H 2.062 0.030 1 892 84 84 GLU HB3 H 2.062 0.030 1 893 84 84 GLU HG2 H 2.317 0.030 2 894 84 84 GLU HG3 H 2.146 0.030 2 895 84 84 GLU C C 177.650 0.300 1 896 84 84 GLU CA C 57.195 0.300 1 897 84 84 GLU CB C 27.131 0.300 1 898 84 84 GLU CG C 33.802 0.300 1 899 84 84 GLU N N 118.176 0.300 1 900 85 85 GLN H H 7.691 0.030 1 901 85 85 GLN HA H 3.976 0.030 1 902 85 85 GLN HB2 H 2.096 0.030 2 903 85 85 GLN HB3 H 1.951 0.030 2 904 85 85 GLN HE21 H 7.010 0.030 2 905 85 85 GLN HE22 H 6.613 0.030 2 906 85 85 GLN HG2 H 2.255 0.030 2 907 85 85 GLN HG3 H 2.467 0.030 2 908 85 85 GLN C C 177.409 0.300 1 909 85 85 GLN CA C 56.684 0.300 1 910 85 85 GLN CB C 26.183 0.300 1 911 85 85 GLN CG C 31.867 0.300 1 912 85 85 GLN N N 118.208 0.300 1 913 85 85 GLN NE2 N 109.278 0.300 1 914 86 86 ILE H H 8.571 0.030 1 915 86 86 ILE HA H 3.662 0.030 1 916 86 86 ILE HB H 1.747 0.030 1 917 86 86 ILE HD1 H 0.558 0.030 1 918 86 86 ILE HG12 H 1.597 0.030 2 919 86 86 ILE HG13 H 0.932 0.030 2 920 86 86 ILE HG2 H 0.628 0.030 1 921 86 86 ILE C C 175.380 0.300 1 922 86 86 ILE CA C 62.465 0.300 1 923 86 86 ILE CB C 34.998 0.300 1 924 86 86 ILE CD1 C 10.391 0.300 1 925 86 86 ILE CG1 C 26.966 0.300 1 926 86 86 ILE CG2 C 15.521 0.300 1 927 86 86 ILE N N 121.029 0.300 1 928 87 87 GLU H H 8.963 0.030 1 929 87 87 GLU HA H 3.718 0.030 1 930 87 87 GLU HB2 H 2.134 0.030 2 931 87 87 GLU HB3 H 1.882 0.030 2 932 87 87 GLU HG2 H 2.164 0.030 2 933 87 87 GLU HG3 H 2.428 0.030 2 934 87 87 GLU C C 177.708 0.300 1 935 87 87 GLU CA C 58.147 0.300 1 936 87 87 GLU CB C 27.147 0.300 1 937 87 87 GLU CG C 35.712 0.300 1 938 87 87 GLU N N 119.850 0.300 1 939 88 88 GLY H H 7.840 0.030 1 940 88 88 GLY HA2 H 3.742 0.030 2 941 88 88 GLY HA3 H 3.864 0.030 2 942 88 88 GLY C C 173.512 0.300 1 943 88 88 GLY CA C 44.947 0.300 1 944 88 88 GLY N N 105.539 0.300 1 945 89 89 MET H H 7.651 0.030 1 946 89 89 MET HA H 4.109 0.030 1 947 89 89 MET HB2 H 2.203 0.030 2 948 89 89 MET HB3 H 1.963 0.030 2 949 89 89 MET HE H 1.918 0.030 1 950 89 89 MET HG2 H 2.424 0.030 2 951 89 89 MET HG3 H 2.678 0.030 2 952 89 89 MET C C 176.166 0.300 1 953 89 89 MET CA C 56.790 0.300 1 954 89 89 MET CB C 31.208 0.300 1 955 89 89 MET CE C 15.388 0.300 1 956 89 89 MET CG C 29.663 0.300 1 957 89 89 MET N N 121.779 0.300 1 958 90 90 VAL H H 8.258 0.030 1 959 90 90 VAL HA H 3.267 0.030 1 960 90 90 VAL HB H 2.075 0.030 1 961 90 90 VAL HG1 H 0.873 0.030 1 962 90 90 VAL HG2 H 0.812 0.030 1 963 90 90 VAL C C 174.681 0.300 1 964 90 90 VAL CA C 64.974 0.300 1 965 90 90 VAL CB C 29.650 0.300 1 966 90 90 VAL CG1 C 18.849 0.300 2 967 90 90 VAL CG2 C 20.870 0.300 2 968 90 90 VAL N N 118.934 0.300 1 969 91 91 LYS H H 7.874 0.030 1 970 91 91 LYS HA H 3.802 0.030 1 971 91 91 LYS HB2 H 1.807 0.030 2 972 91 91 LYS HB3 H 2.074 0.030 2 973 91 91 LYS HD2 H 1.599 0.030 1 974 91 91 LYS HD3 H 1.599 0.030 1 975 91 91 LYS HE2 H 2.878 0.030 1 976 91 91 LYS HE3 H 2.878 0.030 1 977 91 91 LYS HG2 H 1.352 0.030 2 978 91 91 LYS HG3 H 1.488 0.030 2 979 91 91 LYS C C 176.411 0.300 1 980 91 91 LYS CA C 57.481 0.300 1 981 91 91 LYS CB C 29.668 0.300 1 982 91 91 LYS CD C 27.006 0.300 1 983 91 91 LYS CE C 39.694 0.300 1 984 91 91 LYS CG C 22.901 0.300 1 985 91 91 LYS N N 117.722 0.300 1 986 92 92 ASP H H 7.693 0.030 1 987 92 92 ASP HA H 4.341 0.030 1 988 92 92 ASP HB2 H 2.601 0.030 2 989 92 92 ASP HB3 H 2.687 0.030 2 990 92 92 ASP C C 175.894 0.300 1 991 92 92 ASP CA C 54.780 0.300 1 992 92 92 ASP CB C 39.049 0.300 1 993 92 92 ASP N N 117.489 0.300 1 994 93 93 LEU H H 7.820 0.030 1 995 93 93 LEU HA H 3.945 0.030 1 996 93 93 LEU HB2 H 1.825 0.030 2 997 93 93 LEU HB3 H 1.188 0.030 2 998 93 93 LEU HD1 H 0.699 0.030 1 999 93 93 LEU HD2 H 0.640 0.030 1 1000 93 93 LEU HG H 1.726 0.030 1 1001 93 93 LEU C C 177.582 0.300 1 1002 93 93 LEU CA C 55.255 0.300 1 1003 93 93 LEU CB C 40.808 0.300 1 1004 93 93 LEU CD1 C 24.301 0.300 2 1005 93 93 LEU CD2 C 20.846 0.300 2 1006 93 93 LEU CG C 25.068 0.300 1 1007 93 93 LEU N N 118.532 0.300 1 1008 94 94 ILE H H 8.291 0.030 1 1009 94 94 ILE HA H 3.852 0.030 1 1010 94 94 ILE HB H 1.866 0.030 1 1011 94 94 ILE HD1 H 0.735 0.030 1 1012 94 94 ILE HG12 H 1.140 0.030 2 1013 94 94 ILE HG13 H 1.611 0.030 2 1014 94 94 ILE HG2 H 0.895 0.030 1 1015 94 94 ILE C C 175.663 0.300 1 1016 94 94 ILE CA C 62.458 0.300 1 1017 94 94 ILE CB C 35.837 0.300 1 1018 94 94 ILE CD1 C 11.424 0.300 1 1019 94 94 ILE CG1 C 26.806 0.300 1 1020 94 94 ILE CG2 C 14.809 0.300 1 1021 94 94 ILE N N 119.002 0.300 1 1022 95 95 ASN H H 7.959 0.030 1 1023 95 95 ASN HA H 4.575 0.030 1 1024 95 95 ASN HB2 H 2.823 0.030 1 1025 95 95 ASN HB3 H 2.823 0.030 1 1026 95 95 ASN HD21 H 6.826 0.030 2 1027 95 95 ASN HD22 H 7.647 0.030 2 1028 95 95 ASN C C 174.016 0.300 1 1029 95 95 ASN CA C 52.444 0.300 1 1030 95 95 ASN CB C 36.522 0.300 1 1031 95 95 ASN N N 117.793 0.300 1 1032 95 95 ASN ND2 N 112.443 0.300 1 1033 96 96 ARG H H 7.791 0.030 1 1034 96 96 ARG HA H 4.281 0.030 1 1035 96 96 ARG HB2 H 1.834 0.030 2 1036 96 96 ARG HB3 H 1.750 0.030 2 1037 96 96 ARG HD2 H 3.060 0.030 2 1038 96 96 ARG HD3 H 3.023 0.030 2 1039 96 96 ARG HG2 H 1.589 0.030 2 1040 96 96 ARG HG3 H 1.644 0.030 2 1041 96 96 ARG C C 174.249 0.300 1 1042 96 96 ARG CA C 54.604 0.300 1 1043 96 96 ARG CB C 28.407 0.300 1 1044 96 96 ARG CD C 41.230 0.300 1 1045 96 96 ARG CG C 25.046 0.300 1 1046 96 96 ARG N N 118.048 0.300 1 1047 97 97 SER H H 7.950 0.030 1 1048 97 97 SER HA H 4.387 0.030 1 1049 97 97 SER HB2 H 3.757 0.030 1 1050 97 97 SER HB3 H 3.757 0.030 1 1051 97 97 SER C C 171.892 0.300 1 1052 97 97 SER CA C 56.419 0.300 1 1053 97 97 SER CB C 61.775 0.300 1 1054 97 97 SER N N 115.020 0.300 1 1055 98 98 GLY H H 7.957 0.030 1 1056 98 98 GLY HA2 H 3.906 0.030 1 1057 98 98 GLY HA3 H 3.906 0.030 1 1058 98 98 GLY C C 169.316 0.300 1 1059 98 98 GLY CA C 42.410 0.300 1 1060 98 98 GLY N N 109.476 0.300 1 1061 99 99 PRO HA H 4.264 0.030 1 1062 99 99 PRO HB2 H 2.065 0.030 2 1063 99 99 PRO HB3 H 1.817 0.030 2 1064 99 99 PRO HD2 H 3.258 0.030 2 1065 99 99 PRO HD3 H 3.415 0.030 2 1066 99 99 PRO HG2 H 1.833 0.030 2 1067 99 99 PRO HG3 H 1.785 0.030 2 1068 99 99 PRO C C 175.011 0.300 1 1069 99 99 PRO CA C 60.914 0.300 1 1070 99 99 PRO CB C 29.643 0.300 1 1071 99 99 PRO CD C 47.321 0.300 1 1072 99 99 PRO CG C 24.704 0.300 1 1073 100 100 SER H H 8.320 0.030 1 1074 100 100 SER HA H 4.345 0.030 1 1075 100 100 SER HB2 H 3.799 0.030 2 1076 100 100 SER HB3 H 3.838 0.030 2 1077 100 100 SER C C 172.264 0.300 1 1078 100 100 SER CA C 55.996 0.300 1 1079 100 100 SER CB C 61.404 0.300 1 1080 100 100 SER N N 115.642 0.300 1 1081 101 101 SER H H 8.143 0.030 1 1082 101 101 SER HA H 4.333 0.030 1 1083 101 101 SER HB2 H 3.749 0.030 1 1084 101 101 SER HB3 H 3.749 0.030 1 1085 101 101 SER C C 171.537 0.300 1 1086 101 101 SER CA C 56.049 0.300 1 1087 101 101 SER CB C 61.775 0.300 1 1088 101 101 SER N N 117.360 0.300 1 1089 102 102 GLY H H 7.902 0.030 1 1090 102 102 GLY HA2 H 3.672 0.030 2 1091 102 102 GLY HA3 H 3.637 0.030 2 1092 102 102 GLY C C 176.648 0.300 1 1093 102 102 GLY CA C 43.851 0.300 1 1094 102 102 GLY N N 116.359 0.300 1 stop_ save_