data_6750 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Structural basis for cooperative transcription factor binding to the CBP coactivator ; _BMRB_accession_number 6750 _BMRB_flat_file_name bmr6750.str _Entry_type original _Submission_date 2005-07-26 _Accession_date 2005-07-27 _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 'De Guzman' Roberto N. . 2 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" 137 "13C chemical shifts" 90 "15N chemical shifts" 23 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2006-04-27 original author . stop_ _Original_release_date 2006-04-27 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Structural basis for cooperative transcription factor binding to the CBP coactivator ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 16253272 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 'De Guzman' Roberto N. . 2 Goto Natalie K. . 3 Dyson H.J. . . 4 Wright Peter E. . stop_ _Journal_abbreviation 'J. Mol. Biol.' _Journal_volume 355 _Journal_issue 5 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 1005 _Page_last 1013 _Year 2006 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'MYB-KIX-MLL COMPLEX' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label MYB $MYB KIX $KIX MLL $MLL stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state 'not present' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_MYB _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common MYB _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 25 _Mol_residue_sequence ; KEKRIKELELLLMSTENELK GQQAL ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 291 LYS 2 292 GLU 3 293 LYS 4 294 ARG 5 295 ILE 6 296 LYS 7 297 GLU 8 298 LEU 9 299 GLU 10 300 LEU 11 301 LEU 12 302 LEU 13 303 MET 14 304 SER 15 305 THR 16 306 GLU 17 307 ASN 18 308 GLU 19 309 LEU 20 310 LYS 21 311 GLY 22 312 GLN 23 313 GLN 24 314 ALA 25 315 LEU stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2014-05-12 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 1SB0 "Solution Structure Of The Kix Domain Of Cbp Bound To The Transactivation Domain Of C-Myb" 100.00 25 100.00 100.00 1.37e-03 PDB 2AGH "Structural Basis For Cooperative Transcription Factor Binding To The Cbp Coactivator" 100.00 25 100.00 100.00 1.37e-03 DBJ BAA05135 "cellular oncogene [Bos taurus]" 100.00 640 100.00 100.00 9.44e-04 DBJ BAA05136 "protooncogene c-myb [Bos taurus]" 100.00 555 100.00 100.00 2.70e-04 DBJ BAA05137 "protooncogene c-myb [Bos taurus]" 100.00 430 100.00 100.00 1.53e-04 DBJ BAC40133 "unnamed protein product [Mus musculus]" 100.00 755 100.00 100.00 5.17e-04 DBJ BAC40443 "unnamed protein product [Mus musculus]" 100.00 439 100.00 100.00 6.43e-04 EMBL CAA24979 "p153 protein [Avian leukemia virus]" 100.00 669 100.00 100.00 3.24e-05 EMBL CAA26551 "unnamed protein product [Mus musculus]" 100.00 648 100.00 100.00 4.20e-04 EMBL CAA26552 "unnamed protein product [Mus musculus]" 100.00 636 100.00 100.00 5.17e-04 EMBL CAA27197 "unnamed protein product [Gallus gallus]" 100.00 699 100.00 100.00 4.20e-04 EMBL CAA27724 "myb proto-oncogene [Mus musculus]" 100.00 330 100.00 100.00 6.82e-04 GB AAA39781 "myb protein [Mus musculus]" 100.00 715 100.00 100.00 2.96e-04 GB AAA39785 "tumor-specific myb protein [Mus musculus]" 100.00 593 100.00 100.00 3.24e-04 GB AAA42551 "transforming protein [Avian myeloblastosis virus]" 100.00 265 100.00 100.00 3.24e-05 GB AAA42553 "c-myb ORF startng at the first atg in the ORF [Avian myeloblastosis virus]" 100.00 265 100.00 100.00 3.24e-05 GB AAA48696 "c-myb oncogene product [Gallus gallus]" 100.00 379 100.00 100.00 2.30e-04 PRF 0912261A "protein p135" 100.00 669 100.00 100.00 3.24e-05 PRF 1203379A "gene c-myb" 100.00 699 100.00 100.00 4.20e-04 REF NP_001123644 "transcriptional activator Myb isoform 3 [Homo sapiens]" 92.00 637 100.00 100.00 7.23e-03 REF NP_001155128 "transcriptional activator Myb isoform 4 [Homo sapiens]" 92.00 758 100.00 100.00 4.42e-03 REF NP_001185843 "transcriptional activator Myb isoform 1 [Mus musculus]" 100.00 755 100.00 100.00 5.22e-04 REF NP_034978 "transcriptional activator Myb [Mus musculus]" 100.00 636 100.00 100.00 6.43e-04 REF NP_778220 "transcriptional activator Myb [Bos taurus]" 100.00 555 100.00 100.00 2.70e-04 SP P01103 "RecName: Full=Transcriptional activator Myb; AltName: Full=Proto-oncogene c-Myb" 100.00 641 100.00 100.00 7.41e-04 SP P01104 "RecName: Full=Transforming protein Myb" 100.00 382 100.00 100.00 1.11e-04 SP P01105 "RecName: Full=p135Gag-Myb-Ets-transforming protein; Contains: RecName: Full=Transforming protein v-Myb; Contains: RecName: Full" 100.00 669 100.00 100.00 3.24e-05 SP P06876 "RecName: Full=Transcriptional activator Myb; AltName: Full=Proto-oncogene c-Myb" 100.00 636 100.00 100.00 6.27e-04 SP P46200 "RecName: Full=Transcriptional activator Myb; AltName: Full=Proto-oncogene c-Myb" 100.00 640 100.00 100.00 9.44e-04 stop_ save_ save_KIX _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common KIX _Molecular_mass . _Mol_thiol_state 'not reported' _Details . _Residue_count 1 _Mol_residue_sequence . _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ save_MLL _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common MLL _Molecular_mass . _Mol_thiol_state 'not reported' _Details . _Residue_count 1 _Mol_residue_sequence . _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 $MYB Mouse 10090 Eukaryota Metazoa Mus musculus $KIX Mouse 10090 Eukaryota Metazoa Mus musculus $MLL Mouse 10090 Eukaryota Metazoa Mus musculus 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 $MYB 'recombinant technology' 'E. coli' . . . . $KIX 'recombinant technology' 'E. coli' . . . . $MLL 'recombinant technology' 'E. coli' . . . . 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 $MYB . mM . $KIX . mM . $MLL . mM . stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH . . pH temperature 298 0.1 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _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 _Indirect_shift_ratio_citation_label _Correction_value_citation_label DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 $entry_citation $entry_citation DSS H 1 'methyl protons' ppm 0.0 internal direct . . . 1.0 $entry_citation $entry_citation DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 $entry_citation $entry_citation 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_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $conditions_1 _Chem_shift_reference_set_label $chemical_shift_referencing _Mol_system_component_name MYB _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 1 291 1 LYS HA H 3.969 . 1 2 291 1 LYS HB2 H 1.866 . 2 3 291 1 LYS HG2 H 1.399 . 2 4 291 1 LYS HG3 H 1.456 . 2 5 291 1 LYS HE2 H 2.943 . 2 6 291 1 LYS CA C 55.628 . 1 7 291 1 LYS CB C 32.921 . 1 8 291 1 LYS CG C 23.990 . 1 9 291 1 LYS CE C 41.480 . 1 10 292 2 GLU HA H 4.275 . 1 11 292 2 GLU HB2 H 2.035 . 2 12 292 2 GLU HB3 H 1.900 . 2 13 292 2 GLU HG2 H 2.306 . 2 14 292 2 GLU CA C 56.766 . 1 15 292 2 GLU CB C 29.723 . 1 16 292 2 GLU CG C 35.941 . 1 17 293 3 LYS H H 8.751 . 1 18 293 3 LYS HA H 4.126 . 1 19 293 3 LYS HB2 H 1.858 . 2 20 293 3 LYS HG2 H 1.472 . 2 21 293 3 LYS HE2 H 3.017 . 2 22 293 3 LYS CA C 58.328 . 1 23 293 3 LYS CB C 32.503 . 1 24 293 3 LYS CG C 24.617 . 1 25 293 3 LYS CE C 41.793 . 1 26 293 3 LYS N N 124.770 . 1 27 294 4 ARG H H 8.562 . 1 28 294 4 ARG HA H 4.222 . 1 29 294 4 ARG HB2 H 1.936 . 2 30 294 4 ARG HB3 H 1.906 . 2 31 294 4 ARG HG2 H 1.962 . 2 32 294 4 ARG HG3 H 1.755 . 2 33 294 4 ARG HD2 H 3.534 . 2 34 294 4 ARG HD3 H 3.257 . 2 35 294 4 ARG CA C 57.293 . 1 36 294 4 ARG CB C 29.979 . 1 37 294 4 ARG CG C 27.135 . 1 38 294 4 ARG CD C 42.865 . 1 39 294 4 ARG N N 119.038 . 1 40 295 5 ILE H H 7.522 . 1 41 295 5 ILE HA H 3.585 . 1 42 295 5 ILE HB H 1.798 . 1 43 295 5 ILE HG12 H 1.143 . 9 44 295 5 ILE HG13 H 0.705 . 9 45 295 5 ILE HG2 H 0.802 . 4 46 295 5 ILE HD1 H 0.623 . 1 47 295 5 ILE CA C 64.634 . 1 48 295 5 ILE CB C 36.712 . 1 49 295 5 ILE CG1 C 29.336 . 2 50 295 5 ILE CG2 C 83.567 . 2 51 295 5 ILE CD1 C 12.499 . 1 52 295 5 ILE N N 118.392 . 1 53 296 6 LYS H H 7.649 . 1 54 296 6 LYS HA H 4.127 . 1 55 296 6 LYS HB2 H 1.854 . 2 56 296 6 LYS HB3 H 1.960 . 2 57 296 6 LYS HG2 H 1.478 . 2 58 296 6 LYS HE2 H 2.936 . 1 59 296 6 LYS HE3 H 2.936 . 1 60 296 6 LYS CA C 58.594 . 1 61 296 6 LYS CB C 31.438 . 1 62 296 6 LYS CG C 24.530 . 1 63 296 6 LYS CE C 41.580 . 1 64 296 6 LYS N N 119.942 . 1 65 297 7 GLU H H 7.952 . 1 66 297 7 GLU HA H 3.972 . 1 67 297 7 GLU HB2 H 2.243 . 2 68 297 7 GLU HB3 H 2.088 . 2 69 297 7 GLU HG2 H 2.448 . 2 70 297 7 GLU HG3 H 2.251 . 2 71 297 7 GLU CA C 59.367 . 1 72 297 7 GLU CB C 29.676 . 1 73 297 7 GLU CG C 36.408 . 1 74 297 7 GLU N N 117.993 . 1 75 298 8 LEU H H 8.083 . 1 76 298 8 LEU HA H 4.144 . 1 77 298 8 LEU HB2 H 1.239 . 2 78 298 8 LEU HB3 H 2.243 . 2 79 298 8 LEU HG H 1.808 . 1 80 298 8 LEU HD1 H 0.943 . 2 81 298 8 LEU HD2 H 1.031 . 2 82 298 8 LEU CA C 57.790 . 1 83 298 8 LEU CB C 43.252 . 1 84 298 8 LEU CG C 27.494 . 1 85 298 8 LEU CD1 C 23.128 . 2 86 298 8 LEU CD2 C 25.816 . 2 87 298 8 LEU N N 121.341 . 1 88 299 9 GLU H H 8.640 . 1 89 299 9 GLU HA H 3.701 . 1 90 299 9 GLU HB2 H 2.003 . 2 91 299 9 GLU HB3 H 2.379 . 2 92 299 9 GLU HG2 H 2.097 . 2 93 299 9 GLU HG3 H 2.512 . 2 94 299 9 GLU CA C 60.624 . 1 95 299 9 GLU CB C 29.639 . 1 96 299 9 GLU CG C 37.152 . 1 97 299 9 GLU N N 120.733 . 1 98 300 10 LEU H H 7.854 . 1 99 300 10 LEU HA H 4.001 . 1 100 300 10 LEU HB2 H 1.843 . 2 101 300 10 LEU HB3 H 1.582 . 2 102 300 10 LEU HG H 1.782 . 1 103 300 10 LEU HD1 H 0.872 . 2 104 300 10 LEU HD2 H 0.902 . 2 105 300 10 LEU CA C 57.849 . 1 106 300 10 LEU CB C 41.373 . 1 107 300 10 LEU CG C 27.018 . 1 108 300 10 LEU CD1 C 23.301 . 2 109 300 10 LEU CD2 C 24.823 . 2 110 300 10 LEU N N 118.237 . 1 111 301 11 LEU H H 7.964 . 1 112 301 11 LEU HA H 4.118 . 1 113 301 11 LEU HB2 H 1.838 . 2 114 301 11 LEU HB3 H 1.982 . 2 115 301 11 LEU HG H 1.613 . 1 116 301 11 LEU HD1 H 0.913 . 2 117 301 11 LEU HD2 H 0.945 . 2 118 301 11 LEU CA C 57.985 . 1 119 301 11 LEU CB C 41.834 . 1 120 301 11 LEU CG C 27.108 . 1 121 301 11 LEU CD1 C 24.543 . 2 122 301 11 LEU CD2 C 24.424 . 2 123 301 11 LEU N N 122.420 . 1 124 302 12 LEU H H 8.375 . 1 125 302 12 LEU HA H 3.958 . 1 126 302 12 LEU HB2 H 2.107 . 2 127 302 12 LEU HB3 H 1.515 . 2 128 302 12 LEU HG H 2.089 . 1 129 302 12 LEU HD1 H 0.932 . 2 130 302 12 LEU HD2 H 0.773 . 2 131 302 12 LEU CA C 57.893 . 1 132 302 12 LEU CB C 41.692 . 1 133 302 12 LEU CG C 26.614 . 1 134 302 12 LEU CD1 C 27.017 . 2 135 302 12 LEU CD2 C 21.788 . 2 136 302 12 LEU N N 119.292 . 1 137 303 13 MET H H 8.595 . 1 138 303 13 MET HA H 3.559 . 1 139 303 13 MET HB2 H 1.762 . 2 140 303 13 MET HG2 H 2.167 . 2 141 303 13 MET HG3 H 1.612 . 2 142 303 13 MET HE H 1.984 . 1 143 303 13 MET CA C 59.023 . 1 144 303 13 MET CB C 32.641 . 1 145 303 13 MET CG C 31.826 . 1 146 303 13 MET CE C 17.037 . 1 147 303 13 MET N N 120.334 . 1 148 304 14 SER H H 7.945 . 1 149 304 14 SER HA H 4.304 . 1 150 304 14 SER HB2 H 4.069 . 2 151 304 14 SER CA C 61.028 . 1 152 304 14 SER CB C 62.732 . 1 153 304 14 SER N N 115.486 . 1 154 305 15 THR H H 7.796 . 1 155 305 15 THR HA H 4.064 . 1 156 305 15 THR HB H 4.191 . 1 157 305 15 THR HG2 H 1.338 . 1 158 305 15 THR CA C 65.157 . 1 159 305 15 THR CB C 68.561 . 1 160 305 15 THR CG2 C 22.695 . 1 161 305 15 THR N N 118.271 . 1 162 306 16 GLU H H 7.882 . 1 163 306 16 GLU HA H 3.970 . 1 164 306 16 GLU HB2 H 2.071 . 2 165 306 16 GLU HB3 H 2.229 . 2 166 306 16 GLU HG2 H 2.741 . 2 167 306 16 GLU HG3 H 2.448 . 2 168 306 16 GLU CA C 59.096 . 1 169 306 16 GLU CB C 29.482 . 1 170 306 16 GLU CG C 36.558 . 1 171 306 16 GLU N N 118.194 . 1 172 307 17 ASN H H 7.775 . 1 173 307 17 ASN HA H 4.661 . 1 174 307 17 ASN HB2 H 2.936 . 2 175 307 17 ASN HB3 H 2.895 . 2 176 307 17 ASN CA C 54.437 . 1 177 307 17 ASN CB C 38.266 . 1 178 307 17 ASN N N 116.222 . 1 179 308 18 GLU H H 7.853 . 1 180 308 18 GLU HA H 4.227 . 1 181 308 18 GLU HB2 H 2.142 . 2 182 308 18 GLU HG2 H 2.390 . 2 183 308 18 GLU HG3 H 2.318 . 2 184 308 18 GLU CA C 56.882 . 1 185 308 18 GLU CB C 29.492 . 1 186 308 18 GLU CG C 35.937 . 1 187 308 18 GLU N N 119.881 . 1 188 309 19 LEU H H 7.542 . 1 189 309 19 LEU HA H 4.199 . 1 190 309 19 LEU HB2 H 1.675 . 2 191 309 19 LEU HG H 1.671 . 1 192 309 19 LEU HD1 H 0.438 . 2 193 309 19 LEU HD2 H 0.733 . 2 194 309 19 LEU CA C 55.211 . 1 195 309 19 LEU CB C 41.392 . 1 196 309 19 LEU CG C 26.660 . 1 197 309 19 LEU CD1 C 22.262 . 2 198 309 19 LEU CD2 C 25.117 . 2 199 309 19 LEU N N 118.962 . 1 200 310 20 LYS H H 7.826 . 1 201 310 20 LYS HA H 4.310 . 1 202 310 20 LYS HB2 H 1.923 . 2 203 310 20 LYS HB3 H 1.866 . 2 204 310 20 LYS HG2 H 1.543 . 2 205 310 20 LYS HG3 H 1.468 . 2 206 310 20 LYS HE2 H 3.017 . 2 207 310 20 LYS CA C 56.674 . 1 208 310 20 LYS CB C 32.732 . 1 209 310 20 LYS CG C 24.792 . 1 210 310 20 LYS CE C 41.963 . 1 211 310 20 LYS N N 119.976 . 1 212 311 21 GLY H H 8.204 . 1 213 311 21 GLY HA2 H 3.985 . 2 214 311 21 GLY CA C 45.231 . 1 215 311 21 GLY N N 108.707 . 1 216 312 22 GLN H H 8.139 . 1 217 312 22 GLN HA H 4.344 . 1 218 312 22 GLN HB2 H 2.075 . 2 219 312 22 GLN HG2 H 2.382 . 2 220 312 22 GLN CA C 55.598 . 1 221 312 22 GLN CB C 29.358 . 1 222 312 22 GLN CG C 33.693 . 1 223 312 22 GLN N N 119.596 . 1 224 313 23 GLN H H 8.351 . 1 225 313 23 GLN HA H 4.346 . 1 226 313 23 GLN HB2 H 2.135 . 2 227 313 23 GLN HB3 H 2.015 . 2 228 313 23 GLN HG2 H 2.382 . 2 229 313 23 GLN CA C 55.657 . 1 230 313 23 GLN CB C 29.431 . 1 231 313 23 GLN CG C 33.651 . 1 232 313 23 GLN N N 121.235 . 1 233 314 24 ALA H H 8.281 . 1 234 314 24 ALA HA H 4.366 . 1 235 314 24 ALA HB H 1.395 . 1 236 314 24 ALA CA C 52.112 . 1 237 314 24 ALA CB C 85.334 . 1 238 314 24 ALA N N 126.017 . 1 239 315 25 LEU H H 7.822 . 1 240 315 25 LEU HA H 4.188 . 1 241 315 25 LEU HB2 H 1.593 . 2 242 315 25 LEU HG H 1.612 . 1 243 315 25 LEU HD1 H 0.874 . 2 244 315 25 LEU HD2 H 0.910 . 2 245 315 25 LEU CA C 56.435 . 1 246 315 25 LEU CB C 43.290 . 1 247 315 25 LEU CG C 27.142 . 1 248 315 25 LEU CD1 C 23.452 . 2 249 315 25 LEU CD2 C 25.167 . 2 250 315 25 LEU N N 127.578 . 1 stop_ save_