data_15397 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; NH, NN, C, CA and CB chemical shift assignment of the transcriptional activation domain 1 of the nuclear hormone receptor coactivator ACTR in the free state ; _BMRB_accession_number 15397 _BMRB_flat_file_name bmr15397.str _Entry_type original _Submission_date 2007-07-20 _Accession_date 2007-07-20 _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 Ebert Marc-Olivier . . 2 Bae Sung-Hun . . 3 Dyson H. Jane . 4 Wright Peter E. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 62 "13C chemical shifts" 182 "15N chemical shifts" 62 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2008-04-04 original author . stop_ loop_ _Related_BMRB_accession_number _Relationship 15398 'CBP in the free state' 5228 'ACTR in complex with the CREB binding protein, CBP' stop_ _Original_release_date 2008-04-04 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; NMR Relaxation Study of the Complex Formed Between CBP and the Activation Domain of the Nuclear Hormone Receptor Coactivator ACTR ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 18177052 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Ebert Marc-Olivier . . 2 Bae Sung-Hun . . 3 Dyson H. Jane . 4 Wright Peter E. . stop_ _Journal_abbreviation Biochemistry _Journal_volume 47 _Journal_issue 5 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 1299 _Page_last 1308 _Year 2008 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name ACTR _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label ACTR $ACTR stop_ _System_molecular_weight . _System_physical_state unfolded _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_ACTR _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common ACTR _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 71 _Mol_residue_sequence ; GTQNRPLLRNSLDDLVGPPS NLEGQSDERALLDQLHTLLS NTDATGLEEIDRALGIPELV NQGQALEPKQD ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 1018 GLY 2 1019 THR 3 1020 GLN 4 1021 ASN 5 1022 ARG 6 1023 PRO 7 1024 LEU 8 1025 LEU 9 1026 ARG 10 1027 ASN 11 1028 SER 12 1029 LEU 13 1030 ASP 14 1031 ASP 15 1032 LEU 16 1033 VAL 17 1034 GLY 18 1035 PRO 19 1036 PRO 20 1037 SER 21 1038 ASN 22 1039 LEU 23 1040 GLU 24 1041 GLY 25 1042 GLN 26 1043 SER 27 1044 ASP 28 1045 GLU 29 1046 ARG 30 1047 ALA 31 1048 LEU 32 1049 LEU 33 1050 ASP 34 1051 GLN 35 1052 LEU 36 1053 HIS 37 1054 THR 38 1055 LEU 39 1056 LEU 40 1057 SER 41 1058 ASN 42 1059 THR 43 1060 ASP 44 1061 ALA 45 1062 THR 46 1063 GLY 47 1064 LEU 48 1065 GLU 49 1066 GLU 50 1067 ILE 51 1068 ASP 52 1069 ARG 53 1070 ALA 54 1071 LEU 55 1072 GLY 56 1073 ILE 57 1074 PRO 58 1075 GLU 59 1076 LEU 60 1077 VAL 61 1078 ASN 62 1079 GLN 63 1080 GLY 64 1081 GLN 65 1082 ALA 66 1083 LEU 67 1084 GLU 68 1085 PRO 69 1086 LYS 70 1087 GLN 71 1088 ASP 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 1KBH "Mutual Synergistic Folding In The Interaction Between Nuclear Receptor Coactivators Cbp And Actr" 66.20 47 100.00 100.00 1.54e-22 DBJ BAD93100 "nuclear receptor coactivator 3 isoform a variant [Homo sapiens]" 100.00 1427 100.00 100.00 7.65e-37 DBJ BAF82372 "unnamed protein product [Homo sapiens]" 100.00 1424 100.00 100.00 8.33e-37 DBJ BAG10971 "nuclear receptor coactivator 3 [synthetic construct]" 100.00 1423 100.00 100.00 8.66e-37 DBJ BAG63847 "unnamed protein product [Homo sapiens]" 100.00 1218 100.00 100.00 5.38e-37 GB AAB92368 "nuclear receptor coactivator [Homo sapiens]" 100.00 1412 100.00 100.00 7.02e-37 GB AAC51663 "receptor-associated coactivator 3 [Homo sapiens]" 100.00 1417 100.00 100.00 7.18e-37 GB AAC51677 "Amplified in Breast Cancer [Homo sapiens]" 100.00 1420 100.00 100.00 8.64e-37 GB AAC51849 "thyroid hormone receptor activator molecule [Homo sapiens]" 100.00 1424 100.00 100.00 8.17e-37 GB AAH92516 "Nuclear receptor coactivator 3 [Homo sapiens]" 100.00 1422 100.00 100.00 8.65e-37 REF NP_001107748 "nuclear receptor coactivator 3 [Sus scrofa]" 100.00 1390 98.59 100.00 3.02e-36 REF NP_001167558 "nuclear receptor coactivator 3 isoform c [Homo sapiens]" 100.00 1423 100.00 100.00 8.66e-37 REF NP_001167559 "nuclear receptor coactivator 3 isoform d [Homo sapiens]" 100.00 1415 100.00 100.00 7.45e-37 REF NP_006525 "nuclear receptor coactivator 3 isoform b [Homo sapiens]" 100.00 1420 100.00 100.00 8.64e-37 REF NP_858045 "nuclear receptor coactivator 3 isoform a [Homo sapiens]" 100.00 1424 100.00 100.00 8.17e-37 SP Q9Y6Q9 "RecName: Full=Nuclear receptor coactivator 3; Short=NCoA-3; AltName: Full=ACTR; AltName: Full=Amplified in breast cancer 1 prot" 100.00 1424 100.00 100.00 8.17e-37 TPG DAA23082 "TPA: nuclear receptor coactivator 3-like [Bos taurus]" 100.00 1411 97.18 100.00 5.36e-36 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $ACTR 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 $ACTR 'recombinant technology' . Escherichia coli . pET22b 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 $ACTR 1 mM '[U-98% 13C; U-98% 15N]' 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 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 750 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 600 _Details . save_ save_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 500 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_HNCACB_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_(HCA)CO(CA)NH_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D (HCA)CO(CA)NH' _Sample_label $sample_1 save_ save_3D_HNCO_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_2D_1H-15N_HSQC_5 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _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' 50 . mM pH 6.7 . pH pressure 1 . atm temperature 304.15 . 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 C 13 protons ppm 4.715615 internal indirect . . . 0.251449530 water H 1 protons ppm 4.715615 internal direct . . . 1 water N 15 protons ppm 4.715615 internal 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_NH_NN_C_CA_and_CB_shifts _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '3D HNCACB' '3D CBCA(CO)NH' '3D (HCA)CO(CA)NH' '3D HNCO' '2D 1H-15N HSQC' 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 ACTR _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 1021 4 ASN C C 174.546 . . 2 1021 4 ASN CA C 53.353 . . 3 1021 4 ASN CB C 39.17 . . 4 1022 5 ARG H H 8.109 . . 5 1022 5 ARG N N 122.096 . . 6 1023 6 PRO C C 176.423 . . 7 1023 6 PRO CA C 63.144 . . 8 1023 6 PRO CB C 32.198 . . 9 1024 7 LEU H H 8.168 . . 10 1024 7 LEU C C 176.97 . . 11 1024 7 LEU CA C 55.203 . . 12 1024 7 LEU CB C 42.454 . . 13 1024 7 LEU N N 122.096 . . 14 1025 8 LEU H H 8.052 . . 15 1025 8 LEU C C 176.858 . . 16 1025 8 LEU CA C 54.818 . . 17 1025 8 LEU CB C 42.526 . . 18 1025 8 LEU N N 123.208 . . 19 1026 9 ARG H H 8.2 . . 20 1026 9 ARG C C 175.731 . . 21 1026 9 ARG CA C 55.911 . . 22 1026 9 ARG CB C 30.91 . . 23 1026 9 ARG N N 121.54 . . 24 1027 10 ASN H H 8.411 . . 25 1027 10 ASN C C 175.163 . . 26 1027 10 ASN CA C 53.336 . . 27 1027 10 ASN CB C 39.187 . . 28 1027 10 ASN N N 119.871 . . 29 1028 11 SER H H 8.194 . . 30 1028 11 SER C C 174.671 . . 31 1028 11 SER CA C 58.62 . . 32 1028 11 SER CB C 63.775 . . 33 1028 11 SER N N 115.979 . . 34 1029 12 LEU H H 8.194 . . 35 1029 12 LEU C C 177.346 . . 36 1029 12 LEU CA C 55.74 . . 37 1029 12 LEU CB C 41.952 . . 38 1029 12 LEU N N 123.208 . . 39 1030 13 ASP H H 7.971 . . 40 1030 13 ASP C C 176.023 . . 41 1030 13 ASP CA C 54.895 . . 42 1030 13 ASP CB C 41.238 . . 43 1030 13 ASP N N 119.315 . . 44 1031 14 ASP H H 7.931 . . 45 1031 14 ASP C C 176.078 . . 46 1031 14 ASP CA C 54.625 . . 47 1031 14 ASP CB C 41.202 . . 48 1031 14 ASP N N 119.593 . . 49 1032 15 LEU H H 7.918 . . 50 1032 15 LEU C C 177.802 . . 51 1032 15 LEU CA C 55.552 . . 52 1032 15 LEU CB C 42.3 . . 53 1032 15 LEU N N 121.54 . . 54 1033 16 VAL H H 7.869 . . 55 1033 16 VAL C C 176.15 . . 56 1033 16 VAL CA C 62.39 . . 57 1033 16 VAL CB C 32.816 . . 58 1033 16 VAL N N 119.871 . . 59 1034 17 GLY H H 8.064 . . 60 1034 17 GLY N N 112.086 . . 61 1036 19 PRO C C 176.959 . . 62 1036 19 PRO CA C 63.109 . . 63 1036 19 PRO CB C 32.028 . . 64 1037 20 SER H H 8.277 . . 65 1037 20 SER C C 174.319 . . 66 1037 20 SER CA C 58.45 . . 67 1037 20 SER CB C 63.82 . . 68 1037 20 SER N N 115.701 . . 69 1038 21 ASN H H 8.312 . . 70 1038 21 ASN C C 175.072 . . 71 1038 21 ASN CA C 53.276 . . 72 1038 21 ASN CB C 38.869 . . 73 1038 21 ASN N N 120.149 . . 74 1039 22 LEU H H 8.089 . . 75 1039 22 LEU C C 177.413 . . 76 1039 22 LEU CA C 55.449 . . 77 1039 22 LEU CB C 42.308 . . 78 1039 22 LEU N N 122.096 . . 79 1040 23 GLU H H 8.229 . . 80 1040 23 GLU C C 177.043 . . 81 1040 23 GLU CA C 56.924 . . 82 1040 23 GLU CB C 30.239 . . 83 1040 23 GLU N N 120.983 . . 84 1041 24 GLY H H 8.276 . . 85 1041 24 GLY C C 174.149 . . 86 1041 24 GLY CA C 45.507 . . 87 1041 24 GLY N N 109.584 . . 88 1042 25 GLN H H 8.055 . . 89 1042 25 GLN C C 176.009 . . 90 1042 25 GLN CA C 55.767 . . 91 1042 25 GLN CB C 29.604 . . 92 1042 25 GLN N N 119.593 . . 93 1043 26 SER H H 8.277 . . 94 1043 26 SER C C 174.233 . . 95 1043 26 SER CA C 58.476 . . 96 1043 26 SER CB C 63.799 . . 97 1043 26 SER N N 116.813 . . 98 1044 27 ASP H H 8.285 . . 99 1044 27 ASP C C 176.563 . . 100 1044 27 ASP CA C 54.375 . . 101 1044 27 ASP CB C 41.233 . . 102 1044 27 ASP N N 122.652 . . 103 1045 28 GLU H H 8.372 . . 104 1045 28 GLU C C 177.19 . . 105 1045 28 GLU CA C 57.818 . . 106 1045 28 GLU CB C 29.945 . . 107 1045 28 GLU N N 121.818 . . 108 1046 29 ARG H H 8.111 . . 109 1046 29 ARG C C 176.775 . . 110 1046 29 ARG CA C 57.181 . . 111 1046 29 ARG CB C 30.382 . . 112 1046 29 ARG N N 120.705 . . 113 1047 30 ALA H H 7.967 . . 114 1047 30 ALA C C 178.464 . . 115 1047 30 ALA CA C 53.433 . . 116 1047 30 ALA CB C 19.157 . . 117 1047 30 ALA N N 122.93 . . 118 1048 31 LEU H H 7.821 . . 119 1048 31 LEU C C 177.988 . . 120 1048 31 LEU CA C 56.099 . . 121 1048 31 LEU CB C 42.042 . . 122 1048 31 LEU N N 119.593 . . 123 1049 32 LEU H H 7.853 . . 124 1049 32 LEU C C 177.815 . . 125 1049 32 LEU CA C 56.125 . . 126 1049 32 LEU CB C 42.131 . . 127 1049 32 LEU N N 120.983 . . 128 1050 33 ASP H H 8.055 . . 129 1050 33 ASP C C 177.027 . . 130 1050 33 ASP CA C 55.261 . . 131 1050 33 ASP CB C 41.046 . . 132 1050 33 ASP N N 119.871 . . 133 1051 34 GLN H H 7.995 . . 134 1051 34 GLN C C 176.666 . . 135 1051 34 GLN CA C 56.695 . . 136 1051 34 GLN CB C 29.187 . . 137 1051 34 GLN N N 119.593 . . 138 1052 35 LEU H H 7.981 . . 139 1052 35 LEU C C 177.606 . . 140 1052 35 LEU CA C 56.154 . . 141 1052 35 LEU CB C 42.101 . . 142 1052 35 LEU N N 120.983 . . 143 1053 36 HIS H H 8.113 . . 144 1053 36 HIS C C 175.461 . . 145 1053 36 HIS CA C 56.497 . . 146 1053 36 HIS CB C 29.555 . . 147 1053 36 HIS N N 117.925 . . 148 1054 37 THR H H 7.879 . . 149 1054 37 THR C C 174.521 . . 150 1054 37 THR CA C 62.824 . . 151 1054 37 THR CB C 69.711 . . 152 1054 37 THR N N 114.867 . . 153 1055 38 LEU H H 8.026 . . 154 1055 38 LEU C C 177.379 . . 155 1055 38 LEU CA C 55.698 . . 156 1055 38 LEU CB C 42.313 . . 157 1055 38 LEU N N 124.042 . . 158 1056 39 LEU H H 8.022 . . 159 1056 39 LEU C C 177.317 . . 160 1056 39 LEU CA C 55.26 . . 161 1056 39 LEU CB C 42.365 . . 162 1056 39 LEU N N 121.818 . . 163 1057 40 SER H H 8.027 . . 164 1057 40 SER C C 174.207 . . 165 1057 40 SER CA C 58.407 . . 166 1057 40 SER CB C 63.756 . . 167 1057 40 SER N N 115.701 . . 168 1058 41 ASN H H 8.264 . . 169 1058 41 ASN C C 175.395 . . 170 1058 41 ASN CA C 53.442 . . 171 1058 41 ASN CB C 39.04 . . 172 1058 41 ASN N N 120.427 . . 173 1059 42 THR H H 8.009 . . 174 1059 42 THR C C 174.242 . . 175 1059 42 THR CA C 61.97 . . 176 1059 42 THR CB C 69.733 . . 177 1059 42 THR N N 113.754 . . 178 1060 43 ASP H H 8.177 . . 179 1060 43 ASP C C 175.947 . . 180 1060 43 ASP CA C 54.37 . . 181 1060 43 ASP CB C 41.262 . . 182 1060 43 ASP N N 122.374 . . 183 1061 44 ALA H H 8.118 . . 184 1061 44 ALA C C 177.978 . . 185 1061 44 ALA CA C 52.763 . . 186 1061 44 ALA CB C 19.157 . . 187 1061 44 ALA N N 124.32 . . 188 1062 45 THR H H 8.158 . . 189 1062 45 THR C C 175.46 . . 190 1062 45 THR CA C 62.698 . . 191 1062 45 THR CB C 69.918 . . 192 1062 45 THR N N 112.642 . . 193 1063 46 GLY H H 8.337 . . 194 1063 46 GLY C C 174.235 . . 195 1063 46 GLY CA C 45.576 . . 196 1063 46 GLY N N 110.974 . . 197 1064 47 LEU H H 7.935 . . 198 1064 47 LEU C C 177.44 . . 199 1064 47 LEU CA C 55.314 . . 200 1064 47 LEU CB C 42.482 . . 201 1064 47 LEU N N 121.262 . . 202 1065 48 GLU H H 8.385 . . 203 1065 48 GLU C C 176.614 . . 204 1065 48 GLU CA C 57.099 . . 205 1065 48 GLU CB C 30.311 . . 206 1065 48 GLU N N 120.983 . . 207 1066 49 GLU H H 8.243 . . 208 1066 49 GLU C C 176.676 . . 209 1066 49 GLU CA C 56.712 . . 210 1066 49 GLU CB C 30.283 . . 211 1066 49 GLU N N 121.262 . . 212 1067 50 ILE H H 7.863 . . 213 1067 50 ILE C C 175.941 . . 214 1067 50 ILE CA C 61.442 . . 215 1067 50 ILE CB C 38.932 . . 216 1067 50 ILE N N 120.983 . . 217 1068 51 ASP H H 8.19 . . 218 1068 51 ASP C C 176.666 . . 219 1068 51 ASP CA C 54.726 . . 220 1068 51 ASP CB C 41.086 . . 221 1068 51 ASP N N 123.208 . . 222 1069 52 ARG H H 8.058 . . 223 1069 52 ARG C C 176.401 . . 224 1069 52 ARG CA C 56.596 . . 225 1069 52 ARG CB C 30.638 . . 226 1069 52 ARG N N 121.818 . . 227 1070 53 ALA H H 8.14 . . 228 1070 53 ALA C C 177.239 . . 229 1070 53 ALA CA C 52.897 . . 230 1070 53 ALA CB C 19.157 . . 231 1070 53 ALA N N 123.764 . . 232 1071 54 LEU H H 7.865 . . 233 1071 54 LEU C C 177.803 . . 234 1071 54 LEU CA C 55.314 . . 235 1071 54 LEU CB C 42.551 . . 236 1071 54 LEU N N 119.871 . . 237 1072 55 GLY H H 8.063 . . 238 1072 55 GLY C C 173.589 . . 239 1072 55 GLY CA C 45.347 . . 240 1072 55 GLY N N 108.471 . . 241 1073 56 ILE H H 7.8 . . 242 1073 56 ILE N N 121.262 . . 243 1074 57 PRO C C 176.849 . . 244 1074 57 PRO CA C 63.558 . . 245 1074 57 PRO CB C 32.214 . . 246 1075 58 GLU H H 8.331 . . 247 1075 58 GLU C C 176.455 . . 248 1075 58 GLU CA C 56.853 . . 249 1075 58 GLU CB C 30.359 . . 250 1075 58 GLU N N 120.149 . . 251 1076 59 LEU H H 8.05 . . 252 1076 59 LEU C C 177.28 . . 253 1076 59 LEU CA C 55.26 . . 254 1076 59 LEU CB C 42.436 . . 255 1076 59 LEU N N 122.652 . . 256 1077 60 VAL H H 7.912 . . 257 1077 60 VAL C C 175.918 . . 258 1077 60 VAL CA C 62.628 . . 259 1077 60 VAL CB C 32.778 . . 260 1077 60 VAL N N 120.427 . . 261 1078 61 ASN H H 8.361 . . 262 1078 61 ASN C C 175.174 . . 263 1078 61 ASN CA C 53.396 . . 264 1078 61 ASN CB C 38.883 . . 265 1078 61 ASN N N 121.818 . . 266 1079 62 GLN H H 8.271 . . 267 1079 62 GLN C C 176.399 . . 268 1079 62 GLN CA C 56.278 . . 269 1079 62 GLN CB C 29.421 . . 270 1079 62 GLN N N 120.705 . . 271 1080 63 GLY H H 8.3 . . 272 1080 63 GLY C C 174.041 . . 273 1080 63 GLY CA C 45.494 . . 274 1080 63 GLY N N 109.306 . . 275 1081 64 GLN H H 8.025 . . 276 1081 64 GLN C C 175.528 . . 277 1081 64 GLN CA C 55.737 . . 278 1081 64 GLN CB C 29.672 . . 279 1081 64 GLN N N 119.871 . . 280 1082 65 ALA H H 8.206 . . 281 1082 65 ALA C C 177.265 . . 282 1082 65 ALA CA C 52.41 . . 283 1082 65 ALA CB C 19.157 . . 284 1082 65 ALA N N 125.154 . . 285 1083 66 LEU H H 8.057 . . 286 1083 66 LEU C C 176.971 . . 287 1083 66 LEU CA C 54.833 . . 288 1083 66 LEU CB C 42.598 . . 289 1083 66 LEU N N 121.54 . . 290 1084 67 GLU H H 8.135 . . 291 1084 67 GLU N N 122.93 . . 292 1085 68 PRO C C 176.559 . . 293 1085 68 PRO CA C 63.015 . . 294 1085 68 PRO CB C 32.169 . . 295 1086 69 LYS H H 8.259 . . 296 1086 69 LYS C C 176.307 . . 297 1086 69 LYS CA C 56.146 . . 298 1086 69 LYS CB C 33.298 . . 299 1086 69 LYS N N 122.096 . . 300 1087 70 GLN H H 8.402 . . 301 1087 70 GLN C C 174.505 . . 302 1087 70 GLN CA C 55.654 . . 303 1087 70 GLN CB C 29.991 . . 304 1087 70 GLN N N 123.208 . . 305 1088 71 ASP H H 7.92 . . 306 1088 71 ASP N N 127.77 . . stop_ save_