data_19397 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H and 15N Chemical Shift Assignments for the first domain of FAT10 ; _BMRB_accession_number 19397 _BMRB_flat_file_name bmr19397.str _Entry_type original _Submission_date 2013-07-30 _Accession_date 2013-07-30 _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 Wang Wei . . 2 Lim Liangzhong . . 3 Qin Haina . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 238 "15N chemical shifts" 52 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2014-08-25 original author . stop_ _Original_release_date 2014-08-25 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title 'Structure of FAT10 first domain' _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 Wang Wei . . 2 Lim Liangzhong . . 3 Qin Haina . . 4 Song Jianxing . . stop_ _Journal_abbreviation 'Not known' _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 'FAT10 first domain' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label FAT10 $FAT10 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_FAT10 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common FAT10 _Molecular_mass 8676.306 _Mol_thiol_state . _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 75 _Mol_residue_sequence ; LCVHVRSEEWDLMTFDANPY DSVLKIKEHVRSKTKVPVQD QVLLLGSKILKPRRSLSSYG IDKEKTIHLTLKVVK ; loop_ _Residue_seq_code _Residue_label 1 LEU 2 CYS 3 VAL 4 HIS 5 VAL 6 ARG 7 SER 8 GLU 9 GLU 10 TRP 11 ASP 12 LEU 13 MET 14 THR 15 PHE 16 ASP 17 ALA 18 ASN 19 PRO 20 TYR 21 ASP 22 SER 23 VAL 24 LEU 25 LYS 26 ILE 27 LYS 28 GLU 29 HIS 30 VAL 31 ARG 32 SER 33 LYS 34 THR 35 LYS 36 VAL 37 PRO 38 VAL 39 GLN 40 ASP 41 GLN 42 VAL 43 LEU 44 LEU 45 LEU 46 GLY 47 SER 48 LYS 49 ILE 50 LEU 51 LYS 52 PRO 53 ARG 54 ARG 55 SER 56 LEU 57 SER 58 SER 59 TYR 60 GLY 61 ILE 62 ASP 63 LYS 64 GLU 65 LYS 66 THR 67 ILE 68 HIS 69 LEU 70 THR 71 LEU 72 LYS 73 VAL 74 VAL 75 LYS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-11-04 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 2MBE "Backbone 1h And 15n Chemical Shift Assignments For The First Domain Of Fat10" 100.00 75 100.00 100.00 4.18e-45 DBJ BAG34855 "unnamed protein product [Homo sapiens]" 100.00 165 97.33 97.33 1.26e-42 EMBL CAA21458 "ubiquitin D [Homo sapiens]" 100.00 165 98.67 98.67 8.99e-44 EMBL CAA73200 "diubiquitin [Homo sapiens]" 100.00 165 98.67 98.67 8.99e-44 GB AAD52982 "ubiquitin-like protein FAT10 [Homo sapiens]" 100.00 165 98.67 98.67 8.99e-44 GB AAH12472 "Ubiquitin D [Homo sapiens]" 100.00 165 98.67 98.67 1.12e-43 GB ABM85550 "ubiquitin D [synthetic construct]" 100.00 165 98.67 98.67 1.12e-43 GB AIC55799 "UBD, partial [synthetic construct]" 100.00 165 98.67 98.67 1.12e-43 GB EAX03201 "ubiquitin D [Homo sapiens]" 100.00 165 98.67 98.67 8.99e-44 REF NP_006389 "ubiquitin D [Homo sapiens]" 100.00 165 98.67 98.67 1.12e-43 REF XP_004043579 "PREDICTED: ubiquitin D [Gorilla gorilla gorilla]" 100.00 165 97.33 97.33 4.78e-42 SP O15205 "RecName: Full=Ubiquitin D; AltName: Full=Diubiquitin; AltName: Full=Ubiquitin-like protein FAT10" 100.00 165 98.67 98.67 1.12e-43 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $FAT10 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 $FAT10 'recombinant technology' . Escherichia coli BL21 pET32a stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling 'sodium phosphate' 0.01 mM 'natural abundance' DTT 0.01 mM 'natural abundance' $FAT10 0.4 mM '[U-100% 15N]' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Saveframe_category software _Name NMRView _Version . loop_ _Vendor _Address _Electronic_address 'Johnson, One Moon Scientific' . . stop_ loop_ _Task 'data analysis' 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_TALOS _Saveframe_category software _Name TALOS _Version . loop_ _Vendor _Address _Electronic_address 'Cornilescu, Delaglio and Bax' . . stop_ loop_ _Task 'geometry optimization' stop_ _Details . save_ save_CYANA _Saveframe_category software _Name CYANA _Version . loop_ _Vendor _Address _Electronic_address 'Guntert, Mumenthaler and Wuthrich' . . stop_ loop_ _Task refinement 'structure solution' stop_ _Details . save_ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version . loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection stop_ _Details . save_ save_AMBER _Saveframe_category software _Name AMBER _Version . loop_ _Vendor _Address _Electronic_address 'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . stop_ loop_ _Task refinement 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_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_1H-15N_TOCSY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N TOCSY' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_3 _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' 0 . M pH 7.4 . pH pressure 1 . atm temperature 298.15 . 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 water H 1 protons ppm . external indirect . . . 1.00000000 water N 15 protons ppm . external indirect . . . 0.10000000 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '3D 1H-15N TOCSY' 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 FAT10 _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 LEU HA H 4.640 . . 2 1 1 LEU HB2 H 1.275 . . 3 1 1 LEU HG H 1.189 . . 4 1 1 LEU HD1 H 0.591 . . 5 1 1 LEU HD2 H 0.480 . . 6 1 1 LEU H H 8.669 . . 7 1 1 LEU N N 123.014 . . 8 2 2 CYS H H 8.271 . . 9 2 2 CYS HA H 4.643 . . 10 2 2 CYS HB2 H 2.714 . . 11 2 2 CYS N N 123.896 . . 12 3 3 VAL H H 8.930 . . 13 3 3 VAL HA H 4.225 . . 14 3 3 VAL HB H 1.708 . . 15 3 3 VAL HG1 H 0.588 . . 16 3 3 VAL HG2 H 0.648 . . 17 3 3 VAL N N 128.209 . . 18 4 4 HIS H H 8.723 . . 19 4 4 HIS HA H 5.364 . . 20 4 4 HIS HB2 H 2.973 . . 21 4 4 HIS HB3 H 2.734 . . 22 4 4 HIS N N 126.227 . . 23 5 5 VAL H H 9.400 . . 24 5 5 VAL HA H 4.636 . . 25 5 5 VAL HB H 2.100 . . 26 5 5 VAL HG1 H 0.652 . . 27 5 5 VAL HG2 H 0.817 . . 28 5 5 VAL N N 122.706 . . 29 6 6 ARG H H 8.874 . . 30 6 6 ARG HA H 4.992 . . 31 6 6 ARG HB2 H 1.898 . . 32 6 6 ARG HG2 H 1.714 . . 33 6 6 ARG HD2 H 3.175 . . 34 6 6 ARG N N 130.121 . . 35 7 7 SER H H 8.936 . . 36 7 7 SER HA H 5.085 . . 37 7 7 SER HB2 H 4.023 . . 38 7 7 SER N N 117.297 . . 39 10 10 TRP H H 7.235 . . 40 10 10 TRP HA H 4.745 . . 41 10 10 TRP HB2 H 3.770 . . 42 10 10 TRP HE1 H 9.910 . . 43 10 10 TRP NE1 N 128.279 . . 44 11 11 ASP H H 7.665 . . 45 11 11 ASP HA H 4.791 . . 46 11 11 ASP HB2 H 3.340 . . 47 11 11 ASP HB3 H 2.948 . . 48 11 11 ASP N N 117.787 . . 49 13 13 MET H H 8.827 . . 50 13 13 MET HA H 4.858 . . 51 13 13 MET HB2 H 2.363 . . 52 13 13 MET HG2 H 2.948 . . 53 13 13 MET N N 122.940 . . 54 14 14 THR H H 8.273 . . 55 14 14 THR HA H 5.262 . . 56 14 14 THR HB H 4.706 . . 57 14 14 THR HG2 H 2.492 . . 58 14 14 THR N N 121.214 . . 59 16 16 ASP H H 8.719 . . 60 16 16 ASP HA H 4.621 . . 61 16 16 ASP HB2 H 1.278 . . 62 16 16 ASP HB3 H 1.177 . . 63 16 16 ASP N N 122.962 . . 64 17 17 ALA H H 8.670 . . 65 17 17 ALA HA H 5.131 . . 66 17 17 ALA HB H 2.164 . . 67 17 17 ALA N N 118.368 . . 68 18 18 ASN N N 123.103 . . 69 20 20 TYR H H 7.004 . . 70 20 20 TYR HA H 4.588 . . 71 20 20 TYR HB2 H 3.157 . . 72 20 20 TYR HB3 H 3.110 . . 73 20 20 TYR N N 128.229 . . 74 21 21 ASP H H 7.590 . . 75 21 21 ASP HA H 4.671 . . 76 21 21 ASP HB2 H 2.885 . . 77 21 21 ASP HB3 H 2.632 . . 78 23 23 VAL H H 8.753 . . 79 23 23 VAL HA H 3.415 . . 80 23 23 VAL HB H 2.487 . . 81 23 23 VAL HG1 H 0.647 . . 82 23 23 VAL HG2 H 0.971 . . 83 23 23 VAL N N 123.649 . . 84 25 25 LYS H H 7.760 . . 85 25 25 LYS HA H 3.871 . . 86 25 25 LYS HB2 H 1.923 . . 87 25 25 LYS HB3 H 1.358 . . 88 25 25 LYS HG2 H 1.759 . . 89 25 25 LYS N N 119.120 . . 90 26 26 ILE H H 7.324 . . 91 26 26 ILE HA H 3.508 . . 92 26 26 ILE HB H 2.214 . . 93 26 26 ILE HG12 H 0.739 . . 94 26 26 ILE N N 117.483 . . 95 27 27 LYS H H 7.665 . . 96 27 27 LYS HA H 4.400 . . 97 27 27 LYS HB2 H 2.202 . . 98 27 27 LYS HB3 H 1.911 . . 99 27 27 LYS N N 119.349 . . 100 28 28 GLU H H 8.379 . . 101 28 28 GLU HA H 3.770 . . 102 28 28 GLU HB2 H 2.054 . . 103 28 28 GLU HG2 H 2.363 . . 104 28 28 GLU N N 121.785 . . 105 29 29 HIS H H 7.590 . . 106 29 29 HIS HA H 4.203 . . 107 29 29 HIS HB2 H 2.492 . . 108 29 29 HIS HB3 H 1.835 . . 109 29 29 HIS N N 122.422 . . 110 30 30 VAL H H 8.412 . . 111 30 30 VAL HA H 3.477 . . 112 30 30 VAL HB H 2.543 . . 113 30 30 VAL HG1 H 0.557 . . 114 30 30 VAL HG2 H 1.025 . . 115 30 30 VAL N N 121.437 . . 116 32 32 SER N N 121.037 . . 117 33 33 LYS H H 8.918 . . 118 33 33 LYS HA H 3.757 . . 119 33 33 LYS HB2 H 2.037 . . 120 33 33 LYS HB3 H 1.557 . . 121 33 33 LYS N N 125.831 . . 122 34 34 THR H H 7.961 . . 123 34 34 THR HA H 4.111 . . 124 34 34 THR HB H 4.004 . . 125 34 34 THR HG2 H 0.971 . . 126 34 34 THR N N 116.691 . . 127 35 35 LYS H H 7.064 . . 128 35 35 LYS HA H 4.352 . . 129 35 35 LYS HB2 H 1.938 . . 130 35 35 LYS HB3 H 1.877 . . 131 35 35 LYS HG2 H 1.479 . . 132 35 35 LYS HD2 H 1.673 . . 133 35 35 LYS HE2 H 2.935 . . 134 35 35 LYS N N 117.623 . . 135 36 36 VAL H H 7.918 . . 136 36 36 VAL HA H 3.770 . . 137 36 36 VAL HB H 2.935 . . 138 36 36 VAL HG1 H 0.028 . . 139 36 36 VAL HG2 H 0.570 . . 140 36 36 VAL N N 125.248 . . 141 38 38 VAL H H 8.409 . . 142 38 38 VAL HA H 4.078 . . 143 38 38 VAL HB H 1.923 . . 144 38 38 VAL HG1 H 0.809 . . 145 38 38 VAL HG2 H 0.867 . . 146 39 39 GLN H H 8.793 . . 147 39 39 GLN HA H 4.162 . . 148 39 39 GLN HB2 H 2.031 . . 149 39 39 GLN HB3 H 1.937 . . 150 39 39 GLN HG2 H 2.378 . . 151 39 39 GLN N N 115.805 . . 152 40 40 ASP H H 7.590 . . 153 40 40 ASP HA H 4.769 . . 154 40 40 ASP HB2 H 3.074 . . 155 40 40 ASP HB3 H 2.467 . . 156 40 40 ASP N N 120.069 . . 157 41 41 GLN H H 7.046 . . 158 41 41 GLN HA H 4.453 . . 159 41 41 GLN HB2 H 1.835 . . 160 41 41 GLN HB3 H 1.569 . . 161 41 41 GLN HG2 H 2.556 . . 162 41 41 GLN HG3 H 2.463 . . 163 41 41 GLN N N 117.974 . . 164 42 42 VAL H H 8.842 . . 165 42 42 VAL HA H 4.175 . . 166 42 42 VAL HB H 1.873 . . 167 42 42 VAL HG1 H 0.779 . . 168 42 42 VAL HG2 H 0.851 . . 169 42 42 VAL N N 123.686 . . 170 43 43 LEU H H 9.208 . . 171 43 43 LEU HA H 5.450 . . 172 43 43 LEU HB2 H 1.519 . . 173 43 43 LEU HG H 1.114 . . 174 43 43 LEU N N 126.600 . . 175 44 44 LEU H H 9.107 . . 176 44 44 LEU HA H 5.178 . . 177 44 44 LEU HB2 H 1.455 . . 178 44 44 LEU HG H 1.319 . . 179 44 44 LEU HD1 H 0.722 . . 180 44 44 LEU N N 120.515 . . 181 45 45 LEU H H 8.551 . . 182 45 45 LEU HA H 4.706 . . 183 45 45 LEU HB2 H 1.759 . . 184 45 45 LEU HG H 1.485 . . 185 45 45 LEU HD1 H 0.954 . . 186 45 45 LEU N N 124.199 . . 187 48 48 LYS H H 7.982 . . 188 48 48 LYS HA H 4.339 . . 189 48 48 LYS HB2 H 1.916 . . 190 48 48 LYS HB3 H 1.832 . . 191 48 48 LYS HG2 H 1.475 . . 192 48 48 LYS HG3 H 1.412 . . 193 48 48 LYS HD2 H 1.747 . . 194 48 48 LYS HE2 H 3.112 . . 195 48 48 LYS N N 124.618 . . 196 49 49 ILE H H 8.399 . . 197 49 49 ILE HA H 4.018 . . 198 49 49 ILE HB H 1.607 . . 199 49 49 ILE HD1 H 0.844 . . 200 49 49 ILE N N 126.507 . . 201 50 50 LEU H H 8.652 . . 202 50 50 LEU HA H 4.126 . . 203 50 50 LEU HB2 H 1.544 . . 204 50 50 LEU HG H 1.358 . . 205 50 50 LEU HD1 H 1.018 . . 206 50 50 LEU N N 128.139 . . 207 51 51 LYS H H 8.132 . . 208 51 51 LYS HA H 4.714 . . 209 51 51 LYS HB2 H 2.075 . . 210 51 51 LYS HB3 H 1.683 . . 211 51 51 LYS HG2 H 1.493 . . 212 51 51 LYS N N 123.009 . . 213 56 56 LEU H H 8.627 . . 214 56 56 LEU HA H 4.188 . . 215 56 56 LEU HB2 H 2.050 . . 216 56 56 LEU HG H 1.714 . . 217 56 56 LEU N N 123.359 . . 218 57 57 SER H H 8.719 . . 219 57 57 SER HA H 4.265 . . 220 57 57 SER N N 113.706 . . 221 59 59 TYR H H 7.737 . . 222 59 59 TYR HA H 4.536 . . 223 59 59 TYR HB2 H 3.338 . . 224 59 59 TYR HB3 H 2.753 . . 225 59 59 TYR N N 120.883 . . 226 61 61 ILE H H 6.997 . . 227 61 61 ILE HA H 4.099 . . 228 61 61 ILE HB H 1.784 . . 229 61 61 ILE HG12 H 1.278 . . 230 61 61 ILE HG13 H 1.141 . . 231 61 61 ILE HD1 H 0.770 . . 232 61 61 ILE N N 117.591 . . 233 64 64 GLU H H 8.132 . . 234 64 64 GLU HA H 4.559 . . 235 64 64 GLU HB2 H 1.911 . . 236 64 64 GLU HB3 H 1.759 . . 237 64 64 GLU HG2 H 2.657 . . 238 64 64 GLU HG3 H 2.533 . . 239 64 64 GLU N N 126.670 . . 240 67 67 ILE H H 8.488 . . 241 67 67 ILE HA H 4.497 . . 242 67 67 ILE HB H 1.721 . . 243 67 67 ILE HG12 H 1.025 . . 244 67 67 ILE HG13 H 0.494 . . 245 67 67 ILE HG2 H 0.785 . . 246 67 67 ILE N N 121.803 . . 247 68 68 HIS H H 8.425 . . 248 68 68 HIS HA H 5.131 . . 249 68 68 HIS HB2 H 3.013 . . 250 68 68 HIS HB3 H 2.929 . . 251 68 68 HIS N N 124.455 . . 252 69 69 LEU H H 9.322 . . 253 69 69 LEU HA H 5.317 . . 254 69 69 LEU HB2 H 1.797 . . 255 69 69 LEU HG H 1.373 . . 256 69 69 LEU N N 122.823 . . 257 70 70 THR H H 9.107 . . 258 70 70 THR HA H 5.009 . . 259 70 70 THR HB H 4.010 . . 260 70 70 THR HG2 H 1.177 . . 261 70 70 THR N N 118.743 . . 262 71 71 LEU H H 8.829 . . 263 71 71 LEU HA H 5.363 . . 264 71 71 LEU HB2 H 1.683 . . 265 71 71 LEU HG H 1.373 . . 266 71 71 LEU HD1 H 1.139 . . 267 71 71 LEU N N 126.880 . . 268 72 72 LYS H H 9.570 . . 269 72 72 LYS HA H 4.683 . . 270 72 72 LYS HB2 H 1.771 . . 271 72 72 LYS HG2 H 1.450 . . 272 72 72 LYS HD2 H 1.510 . . 273 72 72 LYS HE2 H 2.910 . . 274 72 72 LYS N N 128.792 . . 275 73 73 VAL H H 8.488 . . 276 73 73 VAL HA H 4.807 . . 277 73 73 VAL HB H 2.075 . . 278 73 73 VAL HG2 H 1.051 . . 279 73 73 VAL N N 120.771 . . 280 74 74 VAL H H 8.715 . . 281 74 74 VAL HA H 3.956 . . 282 74 74 VAL HB H 1.974 . . 283 74 74 VAL HG2 H 0.848 . . 284 74 74 VAL N N 127.859 . . 285 75 75 LYS H H 7.729 . . 286 75 75 LYS HA H 4.203 . . 287 75 75 LYS HB2 H 1.772 . . 288 75 75 LYS HB3 H 1.652 . . 289 75 75 LYS HG2 H 1.342 . . 290 75 75 LYS N N 130.074 . . stop_ save_