data_25838 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for the C-terminal intrinsically disordered domain of Alb3 ; _BMRB_accession_number 25838 _BMRB_flat_file_name bmr25838.str _Entry_type original _Submission_date 2015-10-06 _Accession_date 2015-10-06 _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 Sattler Michael . . 2 Hennig Janosch . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 119 "13C chemical shifts" 153 "15N chemical shifts" 79 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2016-01-06 original BMRB . stop_ _Original_release_date 2016-01-06 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Structural basis for cpSRP43 chromodomain selectivity and dynamics in Alb3 insertase interaction ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 26568381 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Horn Annemarie . . 2 Hennig Janosch . . 3 Ahmed Yasar L. . 4 Stier Gunter . . 5 Wild Klemens . . 6 Sattler Michael . . 7 Hennig Janosch . . stop_ _Journal_abbreviation 'Nat. Commun.' _Journal_volume 6 _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 8875 _Page_last 8875 _Year 2015 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'A3CT monomer' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'A3CT monomer' $Alb3-A3CT stop_ _System_molecular_weight 11300 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_Alb3-A3CT _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Alb3-A3CT _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 101 _Mol_residue_sequence ; MDENASKIISAGRAKRSIAQ PDDAGERFRQLKEQEKRSKK NKAVAKDTVELVEESQSESE EGSDDEEEEAREGALASSTT SKPLPEVGQRRSKRSKRKRT V ; loop_ _Residue_seq_code _Residue_label 1 MET 2 ASP 3 GLU 4 ASN 5 ALA 6 SER 7 LYS 8 ILE 9 ILE 10 SER 11 ALA 12 GLY 13 ARG 14 ALA 15 LYS 16 ARG 17 SER 18 ILE 19 ALA 20 GLN 21 PRO 22 ASP 23 ASP 24 ALA 25 GLY 26 GLU 27 ARG 28 PHE 29 ARG 30 GLN 31 LEU 32 LYS 33 GLU 34 GLN 35 GLU 36 LYS 37 ARG 38 SER 39 LYS 40 LYS 41 ASN 42 LYS 43 ALA 44 VAL 45 ALA 46 LYS 47 ASP 48 THR 49 VAL 50 GLU 51 LEU 52 VAL 53 GLU 54 GLU 55 SER 56 GLN 57 SER 58 GLU 59 SER 60 GLU 61 GLU 62 GLY 63 SER 64 ASP 65 ASP 66 GLU 67 GLU 68 GLU 69 GLU 70 ALA 71 ARG 72 GLU 73 GLY 74 ALA 75 LEU 76 ALA 77 SER 78 SER 79 THR 80 THR 81 SER 82 LYS 83 PRO 84 LEU 85 PRO 86 GLU 87 VAL 88 GLY 89 GLN 90 ARG 91 ARG 92 SER 93 LYS 94 ARG 95 SER 96 LYS 97 ARG 98 LYS 99 ARG 100 THR 101 VAL stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $Alb3-A3CT 'Thale cress' 3702 Eukaryota Viridiplantae Arabidopsis thaliana 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 $Alb3-A3CT 'recombinant technology' . Escherichia coli . pET21d 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 _Concentration_min_value _Concentration_max_value _Isotopic_labeling $Alb3-A3CT 0.45 mM 0.2 0.7 '[U-100% 13C; U-100% 15N]' 'sodium phosphate' 20 mM . . 'natural abundance' 'sodium chloride' 150 mM . . 'natural abundance' D2O 10 % . . [U-2H] stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version . loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . 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_CARA _Saveframe_category software _Name CARA _Version . loop_ _Vendor _Address _Electronic_address 'Keller and Wuthrich' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model 'Avance III' _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_HNCACB_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HNCA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _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' 0.15 . M pH 6.5 . pH pressure 1 . atm temperature 298 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.00 na indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 na indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D HNCACB' '3D HNCA' 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 'A3CT monomer' _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 3 3 GLU H H 8.690 0.020 1 2 3 3 GLU CA C 57.254 0.3 1 3 3 3 GLU CB C 29.548 0.3 1 4 3 3 GLU N N 122.011 0.3 1 5 4 4 ASN H H 8.453 0.020 1 6 4 4 ASN HA H 4.655 0.020 1 7 4 4 ASN CA C 53.611 0.3 1 8 4 4 ASN CB C 38.624 0.3 1 9 4 4 ASN N N 118.738 0.3 1 10 5 5 ALA H H 8.112 0.020 1 11 5 5 ALA CA C 53.074 0.3 1 12 5 5 ALA CB C 18.860 0.3 1 13 5 5 ALA N N 123.902 0.3 1 14 6 6 SER H H 8.214 0.020 1 15 6 6 SER HA H 4.336 0.020 1 16 6 6 SER CA C 58.687 0.3 1 17 6 6 SER CB C 63.344 0.3 1 18 6 6 SER N N 113.998 0.3 1 19 7 7 LYS H H 8.120 0.020 1 20 7 7 LYS CA C 56.537 0.3 1 21 7 7 LYS CB C 32.653 0.3 1 22 7 7 LYS N N 122.798 0.3 1 23 8 8 ILE H H 7.995 0.020 1 24 8 8 ILE CA C 61.254 0.3 1 25 8 8 ILE CB C 38.146 0.3 1 26 8 8 ILE N N 121.484 0.3 1 27 9 9 ILE H H 8.208 0.020 1 28 9 9 ILE CA C 61.135 0.3 1 29 9 9 ILE CB C 38.206 0.3 1 30 9 9 ILE N N 125.121 0.3 1 31 11 11 ALA H H 8.338 0.020 1 32 11 11 ALA CA C 52.775 0.3 1 33 11 11 ALA CB C 18.920 0.3 1 34 11 11 ALA N N 126.224 0.3 1 35 12 12 GLY H H 8.320 0.020 1 36 12 12 GLY HA2 H 3.905 0.020 1 37 12 12 GLY HA3 H 3.905 0.020 1 38 12 12 GLY CA C 45.311 0.3 1 39 12 12 GLY N N 107.631 0.3 1 40 13 13 ARG H H 8.091 0.020 1 41 13 13 ARG CA C 55.880 0.3 1 42 13 13 ARG CB C 30.563 0.3 1 43 13 13 ARG N N 120.520 0.3 1 44 15 15 LYS H H 8.586 0.020 1 45 15 15 LYS HA H 4.446 0.020 1 46 15 15 LYS CA C 55.522 0.3 1 47 15 15 LYS CB C 32.414 0.3 1 48 15 15 LYS N N 119.664 0.3 1 49 18 18 ILE H H 8.135 0.020 1 50 18 18 ILE CA C 61.075 0.3 1 51 18 18 ILE CB C 38.684 0.3 1 52 18 18 ILE N N 122.270 0.3 1 53 19 19 ALA H H 8.317 0.020 1 54 19 19 ALA CA C 52.238 0.3 1 55 19 19 ALA CB C 19.158 0.3 1 56 19 19 ALA N N 127.736 0.3 1 57 20 20 GLN H H 8.339 0.020 1 58 20 20 GLN CA C 53.253 0.3 1 59 20 20 GLN CB C 28.831 0.3 1 60 20 20 GLN N N 120.840 0.3 1 61 22 22 ASP H H 8.464 0.020 1 62 22 22 ASP HA H 4.516 0.020 1 63 22 22 ASP CA C 54.149 0.3 1 64 22 22 ASP CB C 40.833 0.3 1 65 22 22 ASP N N 120.366 0.3 1 66 23 23 ASP H H 8.188 0.020 1 67 23 23 ASP CA C 54.208 0.3 1 68 23 23 ASP CB C 41.012 0.3 1 69 23 23 ASP N N 121.032 0.3 1 70 24 24 ALA H H 8.382 0.020 1 71 24 24 ALA CA C 53.731 0.3 1 72 24 24 ALA CB C 18.740 0.3 1 73 24 24 ALA N N 124.545 0.3 1 74 25 25 GLY H H 8.438 0.020 1 75 25 25 GLY HA2 H 3.947 0.020 1 76 25 25 GLY HA3 H 3.947 0.020 1 77 25 25 GLY CA C 45.909 0.3 1 78 25 25 GLY N N 107.288 0.3 1 79 26 26 GLU H H 8.245 0.020 1 80 26 26 GLU CA C 57.910 0.3 1 81 26 26 GLU CB C 29.548 0.3 1 82 26 26 GLU N N 122.069 0.3 1 83 27 27 ARG H H 8.279 0.020 1 84 27 27 ARG HA H 4.058 0.020 1 85 27 27 ARG CA C 58.089 0.3 1 86 27 27 ARG CB C 29.727 0.3 1 87 27 27 ARG N N 120.196 0.3 1 88 28 28 PHE H H 8.094 0.020 1 89 28 28 PHE HA H 4.405 0.020 1 90 28 28 PHE CA C 59.343 0.3 1 91 28 28 PHE CB C 38.684 0.3 1 92 28 28 PHE N N 119.267 0.3 1 93 29 29 ARG H H 8.033 0.020 1 94 29 29 ARG HA H 4.044 0.020 1 95 29 29 ARG CA C 58.089 0.3 1 96 29 29 ARG CB C 30.265 0.3 1 97 29 29 ARG N N 120.713 0.3 1 98 30 30 GLN H H 8.268 0.020 1 99 30 30 GLN HA H 4.114 0.020 1 100 30 30 GLN CA C 57.313 0.3 1 101 30 30 GLN CB C 28.533 0.3 1 102 30 30 GLN N N 119.549 0.3 1 103 31 31 LEU H H 8.103 0.020 1 104 31 31 LEU CA C 56.776 0.3 1 105 31 31 LEU CB C 41.789 0.3 1 106 31 31 LEU N N 122.241 0.3 1 107 32 32 LYS H H 8.131 0.020 1 108 32 32 LYS CA C 57.134 0.3 1 109 32 32 LYS CB C 31.936 0.3 1 110 32 32 LYS N N 120.485 0.3 1 111 34 34 GLN H H 8.206 0.020 1 112 34 34 GLN HA H 4.114 0.020 1 113 34 34 GLN CA C 57.254 0.3 1 114 34 34 GLN CB C 28.772 0.3 1 115 34 34 GLN N N 119.614 0.3 1 116 35 35 GLU H H 8.194 0.020 1 117 35 35 GLU CA C 57.612 0.3 1 118 35 35 GLU CB C 29.847 0.3 1 119 35 35 GLU N N 120.971 0.3 1 120 36 36 LYS H H 8.050 0.020 1 121 36 36 LYS HA H 4.128 0.020 1 122 36 36 LYS CA C 57.492 0.3 1 123 36 36 LYS CB C 32.414 0.3 1 124 36 36 LYS N N 120.743 0.3 1 125 37 37 ARG H H 8.090 0.020 1 126 37 37 ARG HA H 4.225 0.020 1 127 37 37 ARG CA C 56.955 0.3 1 128 37 37 ARG CB C 30.553 0.3 1 129 37 37 ARG N N 120.104 0.3 1 130 38 38 SER H H 8.171 0.020 1 131 38 38 SER HA H 4.322 0.020 1 132 38 38 SER CA C 58.746 0.3 1 133 38 38 SER CB C 63.583 0.3 1 134 38 38 SER N N 115.970 0.3 1 135 42 42 LYS H H 8.239 0.020 1 136 42 42 LYS CA C 56.238 0.3 1 137 42 42 LYS CB C 32.772 0.3 1 138 42 42 LYS N N 121.905 0.3 1 139 43 43 ALA H H 8.274 0.020 1 140 43 43 ALA CA C 52.357 0.3 1 141 43 43 ALA CB C 19.039 0.3 1 142 43 43 ALA N N 125.236 0.3 1 143 44 44 VAL H H 8.044 0.020 1 144 44 44 VAL HA H 4.058 0.020 1 145 44 44 VAL CA C 61.911 0.3 1 146 44 44 VAL CB C 32.713 0.3 1 147 44 44 VAL N N 119.256 0.3 1 148 45 45 ALA H H 8.344 0.020 1 149 45 45 ALA CA C 52.238 0.3 1 150 45 45 ALA CB C 19.218 0.3 1 151 45 45 ALA N N 127.982 0.3 1 152 46 46 LYS H H 8.314 0.020 1 153 46 46 LYS CA C 56.298 0.3 1 154 46 46 LYS CB C 32.892 0.3 1 155 46 46 LYS N N 120.847 0.3 1 156 47 47 ASP H H 8.391 0.020 1 157 47 47 ASP HA H 4.586 0.020 1 158 47 47 ASP CA C 54.268 0.3 1 159 47 47 ASP CB C 40.833 0.3 1 160 47 47 ASP N N 120.786 0.3 1 161 48 48 THR H H 8.003 0.020 1 162 48 48 THR HA H 4.280 0.020 1 163 48 48 THR CA C 61.732 0.3 1 164 48 48 THR CB C 69.614 0.3 1 165 48 48 THR N N 114.017 0.3 1 166 49 49 VAL H H 7.783 0.020 1 167 49 49 VAL CA C 63.583 0.3 1 168 49 49 VAL CB C 33.011 0.3 1 169 49 49 VAL N N 126.205 0.3 1 170 51 51 LEU H H 8.296 0.020 1 171 51 51 LEU CA C 54.925 0.3 1 172 51 51 LEU CB C 42.147 0.3 1 173 51 51 LEU N N 124.132 0.3 1 174 52 52 VAL H H 8.190 0.020 1 175 52 52 VAL CA C 62.150 0.3 1 176 52 52 VAL CB C 32.713 0.3 1 177 52 52 VAL N N 122.126 0.3 1 178 53 53 GLU H H 8.523 0.020 1 179 53 53 GLU CA C 56.298 0.3 1 180 53 53 GLU CB C 30.265 0.3 1 181 53 53 GLU N N 125.034 0.3 1 182 54 54 GLU H H 8.510 0.020 1 183 54 54 GLU CA C 56.477 0.3 1 184 54 54 GLU CB C 30.205 0.3 1 185 54 54 GLU N N 122.645 0.3 1 186 55 55 SER H H 8.419 0.020 1 187 55 55 SER HA H 4.391 0.020 1 188 55 55 SER CA C 58.328 0.3 1 189 55 55 SER CB C 63.583 0.3 1 190 55 55 SER N N 117.024 0.3 1 191 56 56 GLN H H 8.486 0.020 1 192 56 56 GLN CA C 55.820 0.3 1 193 56 56 GLN CB C 29.369 0.3 1 194 56 56 GLN N N 122.462 0.3 1 195 57 57 SER H H 8.383 0.020 1 196 57 57 SER HA H 4.391 0.020 1 197 57 57 SER CA C 58.328 0.3 1 198 57 57 SER CB C 63.643 0.3 1 199 57 57 SER N N 117.161 0.3 1 200 58 58 GLU H H 8.500 0.020 1 201 58 58 GLU CA C 56.452 0.3 1 202 58 58 GLU CB C 30.176 0.3 1 203 58 58 GLU N N 122.961 0.3 1 204 59 59 SER H H 8.336 0.020 1 205 59 59 SER HA H 4.405 0.020 1 206 59 59 SER CA C 58.209 0.3 1 207 59 59 SER CB C 63.822 0.3 1 208 59 59 SER N N 116.460 0.3 1 209 60 60 GLU H H 8.534 0.020 1 210 60 60 GLU CA C 56.537 0.3 1 211 60 60 GLU CB C 30.145 0.3 1 212 60 60 GLU N N 122.904 0.3 1 213 61 61 GLU H H 8.413 0.020 1 214 61 61 GLU CA C 56.716 0.3 1 215 61 61 GLU CB C 30.145 0.3 1 216 61 61 GLU N N 121.714 0.3 1 217 62 62 GLY H H 8.479 0.020 1 218 62 62 GLY HA2 H 3.961 0.020 1 219 62 62 GLY HA3 H 3.961 0.020 1 220 62 62 GLY CA C 45.073 0.3 1 221 62 62 GLY N N 110.305 0.3 1 222 63 63 SER H H 8.256 0.020 1 223 63 63 SER HA H 4.461 0.020 1 224 63 63 SER CA C 58.089 0.3 1 225 63 63 SER CB C 63.941 0.3 1 226 63 63 SER N N 115.453 0.3 1 227 64 64 ASP H H 8.531 0.020 1 228 64 64 ASP CA C 54.268 0.3 1 229 64 64 ASP CB C 41.012 0.3 1 230 64 64 ASP N N 122.510 0.3 1 231 65 65 ASP H H 8.294 0.020 1 232 65 65 ASP HA H 4.558 0.020 1 233 65 65 ASP CA C 54.447 0.3 1 234 65 65 ASP CB C 41.072 0.3 1 235 65 65 ASP N N 120.531 0.3 1 236 66 66 GLU H H 8.353 0.020 1 237 66 66 GLU CA C 56.776 0.3 1 238 66 66 GLU CB C 30.205 0.3 1 239 66 66 GLU N N 121.002 0.3 1 240 67 67 GLU H H 8.417 0.020 1 241 67 67 GLU CA C 56.776 0.3 1 242 67 67 GLU CB C 30.145 0.3 1 243 67 67 GLU N N 122.155 0.3 1 244 68 68 GLU H H 8.461 0.020 1 245 68 68 GLU CA C 56.776 0.3 1 246 68 68 GLU CB C 30.085 0.3 1 247 68 68 GLU N N 121.848 0.3 1 248 69 69 GLU H H 8.460 0.020 1 249 69 69 GLU CA C 56.776 0.3 1 250 69 69 GLU CB C 30.085 0.3 1 251 69 69 GLU N N 122.069 0.3 1 252 70 70 ALA H H 8.294 0.020 1 253 70 70 ALA CA C 52.536 0.3 1 254 70 70 ALA CB C 18.800 0.3 1 255 70 70 ALA N N 124.890 0.3 1 256 71 71 ARG H H 8.232 0.020 1 257 71 71 ARG HA H 4.225 0.020 1 258 71 71 ARG CA C 56.298 0.3 1 259 71 71 ARG CB C 30.682 0.3 1 260 71 71 ARG N N 120.516 0.3 1 261 73 73 GLY H H 8.442 0.020 1 262 73 73 GLY HA2 H 3.905 0.020 1 263 73 73 GLY HA3 H 3.905 0.020 1 264 73 73 GLY CA C 45.252 0.3 1 265 73 73 GLY N N 110.060 0.3 1 266 74 74 ALA H H 8.099 0.020 1 267 74 74 ALA CA C 52.596 0.3 1 268 74 74 ALA CB C 19.099 0.3 1 269 74 74 ALA N N 123.595 0.3 1 270 75 75 LEU H H 8.175 0.020 1 271 75 75 LEU HA H 4.058 0.020 1 272 75 75 LEU CA C 55.044 0.3 1 273 75 75 LEU CB C 42.027 0.3 1 274 75 75 LEU N N 120.639 0.3 1 275 76 76 ALA H H 8.218 0.020 1 276 76 76 ALA CA C 52.536 0.3 1 277 76 76 ALA CB C 18.979 0.3 1 278 76 76 ALA N N 124.478 0.3 1 279 77 77 SER H H 8.215 0.020 1 280 77 77 SER HA H 4.391 0.020 1 281 77 77 SER CA C 58.328 0.3 1 282 77 77 SER CB C 63.523 0.3 1 283 77 77 SER N N 114.354 0.3 1 284 78 78 SER H H 8.341 0.020 1 285 78 78 SER HA H 4.266 0.020 1 286 78 78 SER CA C 58.328 0.3 1 287 78 78 SER CB C 63.463 0.3 1 288 78 78 SER N N 119.687 0.3 1 289 80 80 THR H H 8.095 0.020 1 290 80 80 THR HA H 4.350 0.020 1 291 80 80 THR CA C 61.792 0.3 1 292 80 80 THR CB C 69.434 0.3 1 293 80 80 THR N N 115.421 0.3 1 294 81 81 SER H H 8.260 0.020 1 295 81 81 SER CA C 58.209 0.3 1 296 81 81 SER CB C 63.583 0.3 1 297 81 81 SER N N 118.282 0.3 1 298 82 82 LYS H H 8.233 0.020 1 299 82 82 LYS CA C 54.029 0.3 1 300 82 82 LYS CB C 32.474 0.3 1 301 82 82 LYS N N 124.171 0.3 1 302 84 84 LEU H H 7.924 0.020 1 303 84 84 LEU HA H 4.391 0.020 1 304 84 84 LEU CA C 52.357 0.3 1 305 84 84 LEU CB C 43.222 0.3 1 306 84 84 LEU N N 121.117 0.3 1 307 86 86 GLU H H 8.480 0.020 1 308 86 86 GLU HA H 4.225 0.020 1 309 86 86 GLU CA C 56.537 0.3 1 310 86 86 GLU CB C 30.085 0.3 1 311 86 86 GLU N N 120.662 0.3 1 312 87 87 VAL H H 8.166 0.020 1 313 87 87 VAL HA H 4.044 0.020 1 314 87 87 VAL CA C 62.627 0.3 1 315 87 87 VAL CB C 32.414 0.3 1 316 87 87 VAL N N 120.724 0.3 1 317 88 88 GLY H H 8.506 0.020 1 318 88 88 GLY HA2 H 3.905 0.020 1 319 88 88 GLY HA3 H 3.905 0.020 1 320 88 88 GLY CA C 45.192 0.3 1 321 88 88 GLY N N 111.859 0.3 1 322 89 89 GLN H H 8.209 0.020 1 323 89 89 GLN HA H 4.266 0.020 1 324 89 89 GLN CA C 55.641 0.3 1 325 89 89 GLN CB C 28.891 0.3 1 326 89 89 GLN N N 119.645 0.3 1 327 91 91 ARG H H 8.456 0.020 1 328 91 91 ARG CA C 56.836 0.3 1 329 91 91 ARG CB C 30.145 0.3 1 330 91 91 ARG N N 121.483 0.3 1 331 97 97 ARG H H 8.502 0.020 1 332 97 97 ARG CA C 56.119 0.3 1 333 97 97 ARG CB C 30.921 0.3 1 334 97 97 ARG N N 123.336 0.3 1 335 98 98 LYS H H 8.431 0.020 1 336 98 98 LYS CA C 56.059 0.3 1 337 98 98 LYS CB C 32.892 0.3 1 338 98 98 LYS N N 123.518 0.3 1 339 99 99 ARG H H 8.348 0.020 1 340 99 99 ARG CA C 56.000 0.3 1 341 99 99 ARG CB C 30.742 0.3 1 342 99 99 ARG N N 122.318 0.3 1 343 100 100 THR H H 8.328 0.020 1 344 100 100 THR HA H 4.308 0.020 1 345 100 100 THR CA C 61.732 0.3 1 346 100 100 THR CB C 69.614 0.3 1 347 100 100 THR N N 116.792 0.3 1 348 101 101 VAL H H 8.261 0.020 1 349 101 101 VAL CA C 62.030 0.3 1 350 101 101 VAL CB C 32.713 0.3 1 351 101 101 VAL N N 123.211 0.3 1 stop_ save_