data_25290 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solid-state NMR 13C and 15N resonance assignments of a seven-transmembrane helical protein Anabaena Sensory Rhodopsin in the E. coli Inner Membrane ; _BMRB_accession_number 25290 _BMRB_flat_file_name bmr25290.str _Entry_type original _Submission_date 2014-10-17 _Accession_date 2014-10-17 _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 Ward Meaghan E. . 2 Wang Shenlin . . 3 Munro Rachel . . 4 Ritz Emily . . 5 Hung Ivan . . 6 Gor'kov Peter L. . 7 Jiang Yunjiang . . 8 Liang Hongjun . . 9 Brown Leonid S. . 10 Ladizhansky Vladimir . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "13C chemical shifts" 167 "15N chemical shifts" 82 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2015-04-08 update BMRB 'update entry citation' 2015-03-23 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 17064 . 18595 . stop_ _Original_release_date 2015-04-08 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; In Situ Structural Studies of Anabaena Sensory Rhodopsin in the E. coli Membrane ; _Citation_status published _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 Ward Meaghan E. . 2 Wang Shenlin . . 3 Munro Rachel . . 4 Ritz Emily . . 5 Hung Ivan . . 6 Gor'kov Peter L. . 7 Jiang Yunjiang . . 8 Liang Hongjun . . 9 Brown Leonid S. . 10 Ladizhansky Vladimir . . stop_ _Journal_abbreviation 'Biophys. J.' _Journal_name_full 'Biophysical Journal' _Journal_volume 108 _Journal_issue 7 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 1683 _Page_last 1696 _Year 2015 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'ASR trimer' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'ASR, chain 1' $Anabaena_sensory_rhodopsin 'ASR, chain 2' $Anabaena_sensory_rhodopsin 'ASR, chain 3' $Anabaena_sensory_rhodopsin 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_Anabaena_sensory_rhodopsin _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Anabaena_sensory_rhodopsin _Molecular_mass . _Mol_thiol_state 'not reported' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 235 _Mol_residue_sequence ; MNLESLLHWIYVAGMTIGAL HFWSLSRNPRGVPQYEYLVA MFIPIWSGLAYMAMAIDQGK VEAAGQIAHYARYIDWMVTT PLLLLSLSWTAMQFIKKDWT LIGFLMSTQIVVITSGLIAD LSERDWVRYLWYICGVCAFL IILWGIWNPLRAKTRTQSSE LANLYDKLVTYFTVLWIGYP IVWIIGPSGFGWINQTIDTF LFCLLPFFSKVGFSFLDLHG LRNLNDSRQHHHHHH ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 1 MET 2 2 ASN 3 3 LEU 4 4 GLU 5 5 SER 6 6 LEU 7 7 LEU 8 8 HIS 9 9 TRP 10 10 ILE 11 11 TYR 12 12 VAL 13 13 ALA 14 14 GLY 15 15 MET 16 16 THR 17 17 ILE 18 18 GLY 19 19 ALA 20 20 LEU 21 21 HIS 22 22 PHE 23 23 TRP 24 24 SER 25 25 LEU 26 26 SER 27 27 ARG 28 28 ASN 29 29 PRO 30 30 ARG 31 31 GLY 32 32 VAL 33 33 PRO 34 34 GLN 35 35 TYR 36 36 GLU 37 37 TYR 38 38 LEU 39 39 VAL 40 40 ALA 41 41 MET 42 42 PHE 43 43 ILE 44 44 PRO 45 45 ILE 46 46 TRP 47 47 SER 48 48 GLY 49 49 LEU 50 50 ALA 51 51 TYR 52 52 MET 53 53 ALA 54 54 MET 55 55 ALA 56 56 ILE 57 57 ASP 58 58 GLN 59 59 GLY 60 60 LYS 61 61 VAL 62 62 GLU 63 63 ALA 64 64 ALA 65 65 GLY 66 66 GLN 67 67 ILE 68 68 ALA 69 69 HIS 70 70 TYR 71 71 ALA 72 72 ARG 73 73 TYR 74 74 ILE 75 75 ASP 76 76 TRP 77 77 MET 78 78 VAL 79 79 THR 80 80 THR 81 81 PRO 82 82 LEU 83 83 LEU 84 84 LEU 85 85 LEU 86 86 SER 87 87 LEU 88 88 SER 89 89 TRP 90 90 THR 91 91 ALA 92 92 MET 93 93 GLN 94 94 PHE 95 95 ILE 96 96 LYS 97 97 LYS 98 98 ASP 99 99 TRP 100 100 THR 101 101 LEU 102 102 ILE 103 103 GLY 104 104 PHE 105 105 LEU 106 106 MET 107 107 SER 108 108 THR 109 109 GLN 110 110 ILE 111 111 VAL 112 112 VAL 113 113 ILE 114 114 THR 115 115 SER 116 116 GLY 117 117 LEU 118 118 ILE 119 119 ALA 120 120 ASP 121 121 LEU 122 122 SER 123 123 GLU 124 124 ARG 125 125 ASP 126 126 TRP 127 127 VAL 128 128 ARG 129 129 TYR 130 130 LEU 131 131 TRP 132 132 TYR 133 133 ILE 134 134 CYS 135 135 GLY 136 136 VAL 137 137 CYS 138 138 ALA 139 139 PHE 140 140 LEU 141 141 ILE 142 142 ILE 143 143 LEU 144 144 TRP 145 145 GLY 146 146 ILE 147 147 TRP 148 148 ASN 149 149 PRO 150 150 LEU 151 151 ARG 152 152 ALA 153 153 LYS 154 154 THR 155 155 ARG 156 156 THR 157 157 GLN 158 158 SER 159 159 SER 160 160 GLU 161 161 LEU 162 162 ALA 163 163 ASN 164 164 LEU 165 165 TYR 166 166 ASP 167 167 LYS 168 168 LEU 169 169 VAL 170 170 THR 171 171 TYR 172 172 PHE 173 173 THR 174 174 VAL 175 175 LEU 176 176 TRP 177 177 ILE 178 178 GLY 179 179 TYR 180 180 PRO 181 181 ILE 182 182 VAL 183 183 TRP 184 184 ILE 185 185 ILE 186 186 GLY 187 187 PRO 188 188 SER 189 189 GLY 190 190 PHE 191 191 GLY 192 192 TRP 193 193 ILE 194 194 ASN 195 195 GLN 196 196 THR 197 197 ILE 198 198 ASP 199 199 THR 200 200 PHE 201 201 LEU 202 202 PHE 203 203 CYS 204 204 LEU 205 205 LEU 206 206 PRO 207 207 PHE 208 208 PHE 209 209 SER 210 210 LYS 211 211 VAL 212 212 GLY 213 213 PHE 214 214 SER 215 215 PHE 216 216 LEU 217 217 ASP 218 218 LEU 219 219 HIS 220 220 GLY 221 221 LEU 222 222 ARG 223 223 ASN 224 224 LEU 225 225 ASN 226 226 ASP 227 227 SER 228 228 ARG 229 229 GLN 230 230 HIS 231 231 HIS 232 232 HIS 233 233 HIS 234 234 HIS 235 235 HIS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-04-15 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 17064 opsin 100.00 235 100.00 100.00 2.38e-170 BMRB 18595 ASR 100.00 235 100.00 100.00 2.38e-170 PDB 1XIO "Anabaena Sensory Rhodopsin" 97.45 261 100.00 100.00 4.07e-165 PDB 2M3G "Structure Of Anabaena Sensory Rhodopsin Determined By Solid State Nmr Spectroscopy" 100.00 235 99.57 99.57 2.29e-169 PDB 4TL3 "Mechanistic Insights From The Crystal Structure Of An Inward Proton- Transporting Anabaena Sensory Rhodopsin Mutant" 96.17 226 99.56 100.00 1.48e-161 DBJ BAB74864 "bacteriorhodopsin [Nostoc sp. PCC 7120]" 97.45 261 100.00 100.00 4.07e-165 REF WP_010997316 "lactococcin [Nostoc sp. PCC 7120]" 97.45 261 100.00 100.00 4.07e-165 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $Anabaena_sensory_rhodopsin 'Anabaena (Nostoc)' 103690 Bacteria . Anabaena PCC7120 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 $Anabaena_sensory_rhodopsin 'recombinant technology' . Escherichia coli . pKJ606 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_IM-ASR _Saveframe_category sample _Sample_type solid _Details 'Anabaena Sensory Rhodopsin in the E. coli inner membrane' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Anabaena_sensory_rhodopsin 0.053 mg/ul '[U-100% 13C; U-100% 15N]' 'E. coli inner membrane' 0.93 mg/ul 'natural abundance' H2O 100 % 'natural abundance' 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 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 900 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_NCA_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D NCA' _Sample_label $IM-ASR save_ save_3D_CANCO_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CANCO' _Sample_label $IM-ASR save_ save_3D_NCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D NCACB' _Sample_label $IM-ASR save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 9 . pH pressure 1 . atm temperature 273 . 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 adamantane C 13 'methyl carbon' ppm 40.48 external direct . 'separate tube (no insert) similar to the experimental sample tube' . 1 adamantane N 15 'methyl carbon' ppm 40.48 external indirect . 'separate tube (no insert) similar to the experimental sample tube' . 0.402979946 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_IM_ASR _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D NCA' '3D CANCO' '3D NCACB' stop_ loop_ _Sample_label $IM-ASR stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'ASR, chain 1' _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 6 6 LEU C C 176.944 0.25 1 2 6 6 LEU CA C 57.172 0.25 1 3 6 6 LEU CB C 42.526 0.25 1 4 6 6 LEU N N 116.277 0.3 1 5 7 7 LEU CA C 58.846 0.25 1 6 7 7 LEU N N 117.462 0.3 1 7 12 12 VAL CA C 67.836 0.25 1 8 12 12 VAL CB C 31.773 0.25 1 9 12 12 VAL N N 121.199 0.3 1 10 14 14 GLY C C 175.56 0.25 1 11 15 15 MET CA C 56.777 0.25 1 12 15 15 MET CB C 33.616 0.25 1 13 15 15 MET N N 120.9455 0.3 1 14 16 16 THR C C 176.12 0.25 1 15 17 17 ILE CA C 65.406 0.25 1 16 17 17 ILE CB C 37.914 0.25 1 17 17 17 ILE N N 119.287 0.3 1 18 19 19 ALA CA C 56.586 0.25 1 19 19 19 ALA CB C 18.131 0.25 1 20 19 19 ALA N N 122.137 0.3 1 21 28 28 ASN C C 173.475 0.25 1 22 28 28 ASN CA C 50.895 0.25 1 23 28 28 ASN N N 115.407 0.3 1 24 29 29 PRO CA C 65.123 0.25 1 25 29 29 PRO N N 130.223 0.3 1 26 32 32 VAL CA C 59.633 0.25 1 27 32 32 VAL CB C 32.203 0.25 1 28 32 32 VAL N N 125.535 0.3 1 29 36 36 GLU C C 179.25 0.25 1 30 37 37 TYR CA C 63.404 0.25 1 31 37 37 TYR N N 115.321 0.3 1 32 38 38 LEU CA C 58.93 0.25 1 33 38 38 LEU CB C 41.605 0.25 1 34 38 38 LEU N N 121.551 0.3 1 35 40 40 ALA C C 177.87 0.25 1 36 41 41 MET CA C 59.178 0.25 1 37 41 41 MET N N 111.903 0.3 1 38 43 43 ILE C C 174.396 0.25 1 39 43 43 ILE CA C 67.728 0.25 1 40 43 43 ILE N N 114.919 0.3 1 41 44 44 PRO CA C 65.338 0.25 1 42 44 44 PRO N N 132.001 0.3 1 43 46 46 TRP C C 176.81 0.25 1 44 47 47 SER CA C 60.00766667 0.25 1 45 47 47 SER CB C 65.57 0.25 1 46 47 47 SER N N 106.1343333 0.3 1 47 48 48 GLY C C 174.92 0.25 1 48 49 49 LEU CA C 58.25 0.25 1 49 49 49 LEU N N 121.39 0.3 1 50 52 52 MET C C 177.514 0.25 1 51 52 52 MET CA C 59.02 0.25 1 52 52 52 MET CB C 33.125 0.25 1 53 52 52 MET N N 126.1545 0.3 1 54 53 53 ALA C C 179.186 0.25 1 55 53 53 ALA CA C 54.7065 0.25 1 56 53 53 ALA CB C 17.762 0.25 1 57 53 53 ALA N N 118.4485 0.3 1 58 54 54 MET CA C 58.548 0.25 1 59 54 54 MET CB C 31.22 0.25 1 60 54 54 MET N N 113.205 0.3 1 61 55 55 ALA C C 179.185 0.25 1 62 55 55 ALA CA C 55.531 0.25 1 63 55 55 ALA CB C 15.612 0.25 1 64 55 55 ALA N N 126.941 0.3 1 65 56 56 ILE CA C 60.4845 0.25 1 66 56 56 ILE N N 111.0945 0.3 1 67 57 57 ASP C C 174.764 0.25 1 68 57 57 ASP CA C 56.351 0.25 1 69 57 57 ASP CB C 38.717 0.25 1 70 57 57 ASP N N 114.754 0.3 1 71 58 58 GLN CA C 54.5355 0.25 1 72 58 58 GLN CB C 32.08 0.25 1 73 58 58 GLN N N 117.6645 0.3 1 74 59 59 GLY CA C 45.829 0.25 1 75 59 59 GLY N N 101.778 0.3 1 76 60 60 LYS CA C 53.773 0.25 1 77 60 60 LYS CB C 36.443 0.25 1 78 60 60 LYS N N 114.051 0.3 1 79 61 61 VAL CA C 59.984 0.25 1 80 61 61 VAL CB C 35.706 0.25 1 81 61 61 VAL N N 120.145 0.3 1 82 63 63 ALA CA C 52.25 0.25 1 83 63 63 ALA CB C 21.388 0.25 1 84 63 63 ALA N N 128.934 0.3 1 85 66 66 GLN C C 172.43 0.25 1 86 67 67 ILE CA C 58.9565 0.25 1 87 67 67 ILE CB C 35.951 0.25 1 88 67 67 ILE N N 119.1605 0.3 1 89 68 68 ALA CA C 50.804 0.25 1 90 68 68 ALA N N 134.284 0.3 1 91 71 71 ALA CA C 55.18 0.25 1 92 71 71 ALA CB C 17.332 0.25 1 93 71 71 ALA N N 124.832 0.3 1 94 73 73 TYR C C 177.334 0.25 1 95 73 73 TYR CA C 59.867 0.25 1 96 73 73 TYR CB C 38.041 0.25 1 97 73 73 TYR N N 112.762 0.3 1 98 74 74 ILE CA C 65.664 0.25 1 99 74 74 ILE N N 119.971 0.3 1 100 75 75 ASP CA C 56 0.25 1 101 75 75 ASP CB C 40.867 0.25 1 102 75 75 ASP N N 116.043 0.3 1 103 76 76 TRP CA C 56.586 0.25 1 104 76 76 TRP CB C 29.929 0.25 1 105 76 76 TRP N N 114.871 0.3 1 106 77 77 MET C C 172.92 0.25 1 107 78 78 VAL C C 178.746 0.25 1 108 78 78 VAL CA C 63.25166667 0.25 1 109 78 78 VAL CB C 34.354 0.25 1 110 78 78 VAL N N 109.8813333 0.3 1 111 79 79 THR CA C 66.0325 0.25 1 112 79 79 THR N N 107.369 0.3 1 113 80 80 THR CA C 67.061 0.25 1 114 80 80 THR N N 113.048 0.3 1 115 82 82 LEU CA C 57.523 0.25 1 116 82 82 LEU CB C 41.297 0.25 1 117 82 82 LEU N N 113.699 0.3 1 118 91 91 ALA CA C 53.891 0.25 1 119 91 91 ALA CB C 18.807 0.25 1 120 91 91 ALA N N 119.91 0.3 1 121 92 92 MET CA C 53.533 0.25 1 122 92 92 MET N N 109.427 0.3 1 123 96 96 LYS CA C 56.586 0.25 1 124 96 96 LYS CB C 32.879 0.25 1 125 96 96 LYS N N 119.324 0.3 1 126 101 100 THR C C 178.51 0.25 1 127 102 102 ILE CA C 66.533 0.25 1 128 102 102 ILE CB C 38.163 0.25 1 129 102 102 ILE N N 117.1565 0.3 1 130 106 106 MET CA C 61.156 0.25 1 131 106 106 MET CB C 35.091 0.25 1 132 106 106 MET N N 113.699 0.3 1 133 109 109 GLN CA C 57.172 0.25 1 134 109 109 GLN CB C 26.673 0.25 1 135 109 109 GLN N N 121.434 0.3 1 136 111 111 VAL CA C 67.719 0.25 1 137 111 111 VAL CB C 30.851 0.25 1 138 111 111 VAL N N 123.074 0.3 1 139 112 112 VAL CA C 67.133 0.25 1 140 112 112 VAL CB C 31.711 0.25 1 141 112 112 VAL N N 121.082 0.3 1 142 113 113 ILE CA C 61.508 0.25 1 143 113 113 ILE CB C 34.599 0.25 1 144 113 113 ILE N N 112.996 0.3 1 145 115 115 SER CA C 63.617 0.25 1 146 115 115 SER CB C 62.436 0.25 1 147 115 115 SER N N 115.574 0.3 1 148 117 117 LEU CA C 57.172 0.25 1 149 117 117 LEU CB C 40.867 0.25 1 150 117 117 LEU N N 123.191 0.3 1 151 119 119 ALA CA C 56.117 0.25 1 152 119 119 ALA CB C 19.36 0.25 1 153 119 119 ALA N N 122.488 0.3 1 154 120 120 ASP CA C 54.125 0.25 1 155 120 120 ASP CB C 40.314 0.25 1 156 120 120 ASP N N 112.996 0.3 1 157 122 122 SER CA C 61.625 0.25 1 158 122 122 SER CB C 63.849 0.25 1 159 122 122 SER N N 115.574 0.3 1 160 127 127 VAL CA C 65.844 0.25 1 161 127 127 VAL CB C 31.65 0.25 1 162 127 127 VAL N N 122.254 0.3 1 163 131 131 TRP CA C 61.106 0.25 1 164 131 131 TRP CB C 29.253 0.25 1 165 131 131 TRP N N 119.559 0.3 1 166 134 134 CYS CA C 65.4 0.25 1 167 134 134 CYS CB C 25.812 0.25 1 168 134 134 CYS N N 121.316 0.3 1 169 135 135 GLY C C 175.99 0.25 1 170 136 136 VAL CA C 67.4265 0.25 1 171 136 136 VAL CB C 31.281 0.25 1 172 136 136 VAL N N 123.348 0.3 1 173 137 137 CYS CA C 65.492 0.25 1 174 137 137 CYS CB C 26.857 0.25 1 175 137 137 CYS N N 118.621 0.3 1 176 145 145 GLY C C 175.55 0.25 1 177 146 146 ILE C C 178.203 0.25 1 178 146 146 ILE CA C 64.2605 0.25 1 179 146 146 ILE CB C 35.621 0.25 1 180 146 146 ILE N N 114.6445 0.3 1 181 147 147 TRP CA C 60.029 0.25 1 182 147 147 TRP CB C 30.052 0.25 1 183 147 147 TRP N N 120.887 0.3 1 184 154 154 THR CA C 63.785 0.25 1 185 154 154 THR N N 107.149 0.3 1 186 156 156 THR CA C 61.51 0.25 1 187 156 156 THR N N 104.504 0.3 1 188 158 158 SER CA C 57.875 0.25 1 189 158 158 SER CB C 65.201 0.25 1 190 158 158 SER N N 112.996 0.3 1 191 159 159 SER CA C 61.508 0.25 1 192 159 159 SER CB C 62.743 0.25 1 193 159 159 SER N N 118.504 0.3 1 194 162 162 ALA CA C 56 0.25 1 195 162 162 ALA CB C 17.824 0.25 1 196 162 162 ALA N N 122.957 0.3 1 197 164 164 LEU C C 178.2 0.25 1 198 165 165 TYR CA C 63.941 0.25 1 199 165 165 TYR N N 119.286 0.3 1 200 166 166 ASP CA C 56.937 0.25 1 201 166 166 ASP CB C 39.331 0.25 1 202 166 166 ASP N N 119.207 0.3 1 203 169 169 VAL CA C 64.672 0.25 1 204 169 169 VAL CB C 29.929 0.25 1 205 169 169 VAL N N 120.379 0.3 1 206 171 171 TYR C C 175.32 0.25 1 207 172 172 PHE CA C 60.718 0.25 1 208 172 172 PHE N N 118.329 0.3 1 209 173 173 THR CA C 68.941 0.25 1 210 173 173 THR N N 113.129 0.3 1 211 175 175 LEU C C 179.745 0.25 1 212 176 176 TRP CA C 62.647 0.25 1 213 176 176 TRP N N 117.705 0.3 1 214 178 178 GLY CA C 47.588 0.25 1 215 178 178 GLY N N 102.389 0.3 1 216 181 181 ILE C C 175.69 0.25 1 217 182 182 VAL CA C 66.9825 0.25 1 218 182 182 VAL CB C 30.728 0.25 1 219 182 182 VAL N N 118.7385 0.3 1 220 183 183 TRP CA C 62.68 0.25 1 221 183 183 TRP CB C 32.387 0.25 1 222 183 183 TRP N N 116.395 0.3 1 223 184 184 ILE CA C 61.039 0.25 1 224 184 184 ILE CB C 39.577 0.25 1 225 184 184 ILE N N 113.348 0.3 1 226 186 186 GLY C C 174.02 0.25 1 227 187 187 PRO CA C 64.846 0.25 1 228 187 187 PRO N N 133.531 0.3 1 229 193 193 ILE C C 175.278 0.25 1 230 193 193 ILE CA C 58.559 0.25 1 231 193 193 ILE N N 107.111 0.3 1 232 194 194 ASN CA C 51.353 0.25 1 233 194 194 ASN N N 118.319 0.3 1 234 195 195 GLN CA C 57.758 0.25 1 235 195 195 GLN CB C 29.253 0.25 1 236 195 195 GLN N N 115.809 0.3 1 237 200 200 PHE CA C 61.976 0.25 1 238 200 200 PHE CB C 38.962 0.25 1 239 200 200 PHE N N 120.379 0.3 1 240 201 201 LEU C C 178.39 0.25 1 241 202 202 PHE CA C 60.7565 0.25 1 242 202 202 PHE CB C 35.828 0.25 1 243 202 202 PHE N N 115.477 0.3 1 244 203 203 CYS CA C 62.328 0.25 1 245 203 203 CYS CB C 28.639 0.25 1 246 203 203 CYS N N 117.918 0.3 1 247 212 212 GLY C C 173.54 0.25 1 248 213 213 PHE CA C 62.437 0.25 1 249 213 213 PHE N N 119.833 0.3 1 stop_ save_