data_6593 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Chromo 3 domain of cpSRP43 ; _BMRB_accession_number 6593 _BMRB_flat_file_name bmr6593.str _Entry_type original _Submission_date 2005-04-12 _Accession_date 2005-04-13 _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 Philominathan Leena 'Sagaya Theresa' . 2 Thallapuranam 'Suresh Kumar' Krishnaswamy . 3 Henry Ralph . . 4 Yu Chin . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 222 "15N chemical shifts" 46 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2007-02-05 original author . stop_ _Original_release_date 2007-02-05 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Three-dimensional solution structures of the chromodomains of cpSRP43' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 16183644 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Sivaraja Vaithiyalingam . . 2 'Suresh Kumar' Thallapuranam Krishnaswamy . 3 Leena Philominathan Sagaya-Theresa . 4 Chang Anne . . 5 Vidya Chitturi . . 6 Goforth Robyn L. . 7 Rajalingam Dakshinamurthy . . 8 Arvind Kannan . . 9 Ye Jian-Liang . . 10 Chou Jonathan . . 11 Henry Ralph . . 12 Yu Chin . . stop_ _Journal_abbreviation 'J. Biol. Chem.' _Journal_volume 280 _Journal_issue 50 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 41465 _Page_last 41471 _Year 2005 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Chromo 3 domain of cpSRP43' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'Chromo 3 domain of cpSRP43' $CD3 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state 'not present' loop_ _Biological_function 'Protein targetting' stop_ _Database_query_date . _Details 'Chromo3 domain of cpSRP43' save_ ######################## # Monomeric polymers # ######################## save_CD3 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'Chromo 3 domain of cpSRP43' _Molecular_mass . _Mol_thiol_state 'not present' loop_ _Biological_function 'Protein targeting' stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 54 _Mol_residue_sequence ; AVAESVIGKRVGDDGKTIEY LVKWTDMSDATWEPQDNVDS TLVLLYQQQQPMNE ; loop_ _Residue_seq_code _Residue_label 1 ALA 2 VAL 3 ALA 4 GLU 5 SER 6 VAL 7 ILE 8 GLY 9 LYS 10 ARG 11 VAL 12 GLY 13 ASP 14 ASP 15 GLY 16 LYS 17 THR 18 ILE 19 GLU 20 TYR 21 LEU 22 VAL 23 LYS 24 TRP 25 THR 26 ASP 27 MET 28 SER 29 ASP 30 ALA 31 THR 32 TRP 33 GLU 34 PRO 35 GLN 36 ASP 37 ASN 38 VAL 39 ASP 40 SER 41 THR 42 LEU 43 VAL 44 LEU 45 LEU 46 TYR 47 GLN 48 GLN 49 GLN 50 GLN 51 PRO 52 MET 53 ASN 54 GLU stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-28 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 15540 C-Terminal_chromo_domain 100.00 111 100.00 100.00 1.38e-29 PDB 1X3P "3d Solution Structure Of The Chromo-3 Domain Of Cpsrp43" 100.00 54 100.00 100.00 3.34e-30 GB AAC62865 "expressed protein [Arabidopsis thaliana]" 100.00 373 100.00 100.00 2.74e-28 GB AAD01509 "CAO [Arabidopsis thaliana]" 100.00 376 100.00 100.00 2.48e-28 GB AAK91457 "At2g47450/T30B22.25 [Arabidopsis thaliana]" 100.00 373 100.00 100.00 2.74e-28 GB AAK96775 "Unknown protein [Arabidopsis thaliana]" 100.00 373 100.00 100.00 2.74e-28 GB AAL09772 "At2g47450/T30B22.25 [Arabidopsis thaliana]" 100.00 373 100.00 100.00 2.74e-28 REF NP_566101 "chloroplast signal recognition particle component CAO [Arabidopsis thaliana]" 100.00 373 100.00 100.00 2.74e-28 SP O22265 "RecName: Full=Signal recognition particle 43 kDa protein, chloroplastic; AltName: Full=Chromo protein SRP43; Short=CpSRP43; Fla" 100.00 373 100.00 100.00 2.74e-28 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $CD3 'Thale cress' 3702 Eubacteria Viridiplantae Arabdopsis 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 $CD3 'recombinant technology' 'Escherichia coli' . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_Chromo_3_domain _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Concentration_min_value _Concentration_max_value _Isotopic_labeling $CD3 0.75 mM 0.5 0.8 '[U-15N; U-13C]' stop_ save_ ############################ # Computer software used # ############################ save_Chromo_3 _Saveframe_category software _Name 'XWIN NMR' _Version 3.5 loop_ _Vendor _Address _Electronic_address Bruker . . stop_ _Details 'For data processing' save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_700_MHz_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model 'Avance DMX' _Field_strength 700 _Details '700 MHz equipped with a cryoprobe' save_ ############################# # NMR applied experiments # ############################# save_2D_1H_TOCSY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H TOCSY' _Sample_label $Chromo_3_domain save_ save_2D_1H_NOESY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H NOESY' _Sample_label $Chromo_3_domain save_ save_15N_NOESY_HSQC_3 _Saveframe_category NMR_applied_experiment _Experiment_name '15N NOESY HSQC' _Sample_label $Chromo_3_domain save_ save_15N_HSQC_DIPSY_4 _Saveframe_category NMR_applied_experiment _Experiment_name '15N HSQC DIPSY' _Sample_label $Chromo_3_domain save_ save_HNCA_5 _Saveframe_category NMR_applied_experiment _Experiment_name HNCA _Sample_label $Chromo_3_domain save_ save_HNCOCA_6 _Saveframe_category NMR_applied_experiment _Experiment_name HNCOCA _Sample_label $Chromo_3_domain save_ save_CBCACONH_7 _Saveframe_category NMR_applied_experiment _Experiment_name CBCACONH _Sample_label $Chromo_3_domain save_ save_HNCACB_8 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _Sample_label $Chromo_3_domain save_ save_1H-15N_HSQC_9 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-15N HSQC' _Sample_label $Chromo_3_domain save_ save_2D_1H-15N_HSQC _Saveframe_category NMR_applied_experiment _Experiment_name . _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_Chromo_3_conditions _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.4 0.1 pH temperature 298 0.5 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_CD3_chemical_shifts _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_Chemical_Shift_list _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $Chromo_3_domain stop_ _Sample_conditions_label $Chromo_3_conditions _Chem_shift_reference_set_label $CD3_chemical_shifts _Mol_system_component_name 'Chromo 3 domain of cpSRP43' _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 ALA N N 119.024 0.0 1 2 2 2 VAL H H 8.559 0.0 1 3 2 2 VAL HA H 4.392 0.0 1 4 2 2 VAL HB H 2.047 0.0 1 5 2 2 VAL N N 113.743 0.0 1 6 3 3 ALA H H 8.952 0.0 1 7 3 3 ALA HA H 3.724 0.0 1 8 3 3 ALA HB H 0.752 0.0 1 9 3 3 ALA N N 124.539 0.0 1 10 4 4 GLU H H 9.357 0.0 1 11 4 4 GLU HA H 4.172 0.0 1 12 4 4 GLU HB2 H 1.765 0.0 2 13 4 4 GLU HB3 H 1.667 0.0 2 14 4 4 GLU HG2 H 2.056 0.0 2 15 4 4 GLU HG3 H 1.93 0.0 2 16 4 4 GLU N N 116.4 0.0 1 17 5 5 SER H H 7.562 0.0 1 18 5 5 SER HA H 4.344 0.0 1 19 5 5 SER HB3 H 3.491 0.0 2 20 5 5 SER N N 101.8 0.0 1 21 6 6 VAL H H 8.531 0.0 1 22 6 6 VAL HA H 4.356 0.0 1 23 6 6 VAL HB H 1.5 0.0 1 24 6 6 VAL HG1 H 0.392 0.0 1 25 6 6 VAL HG2 H 0.485 0.0 1 26 6 6 VAL N N 114.472 0.0 1 27 7 7 ILE H H 8.783 0.0 1 28 7 7 ILE HA H 4.585 0.0 1 29 7 7 ILE HG12 H 0.373 0.0 1 30 7 7 ILE HG13 H 0.373 0.0 1 31 7 7 ILE HG2 H 0.482 0.0 1 32 7 7 ILE N N 109.228 0.0 1 33 8 8 GLY H H 6.913 0.0 1 34 8 8 GLY HA2 H 4.252 0.0 2 35 8 8 GLY HA3 H 3.684 0.0 2 36 8 8 GLY N N 103.102 0.0 1 37 9 9 LYS H H 8.646 0.0 1 38 9 9 LYS HA H 5.336 0.0 1 39 9 9 LYS HB2 H 1.751 0.0 2 40 9 9 LYS HB3 H 1.562 0.0 2 41 9 9 LYS HG2 H 0.487 0.0 1 42 9 9 LYS HG3 H 0.487 0.0 1 43 9 9 LYS HD2 H 1.567 0.0 2 44 9 9 LYS HD3 H 0.993 0.0 2 45 9 9 LYS HE2 H 1.935 0.0 1 46 9 9 LYS HE3 H 1.935 0.0 1 47 9 9 LYS N N 114.2 0.0 1 48 10 10 ARG H H 9.276 0.0 1 49 10 10 ARG HA H 4.636 0.0 1 50 10 10 ARG HB2 H 1.459 0.0 2 51 10 10 ARG HB3 H 1.181 0.0 2 52 10 10 ARG HD2 H 2.844 0.0 1 53 10 10 ARG HD3 H 2.844 0.0 1 54 10 10 ARG N N 117.2 0.0 1 55 11 11 VAL H H 8.037 0.0 1 56 11 11 VAL HA H 4.261 0.0 1 57 11 11 VAL HB H 1.695 0.0 1 58 11 11 VAL HG1 H 0.488 0.0 1 59 11 11 VAL HG2 H 0.758 0.0 1 60 11 11 VAL N N 112.999 0.0 1 61 12 12 GLY H H 8.983 0.0 1 62 12 12 GLY HA2 H 3.841 0.0 2 63 12 12 GLY HA3 H 3.95 0.0 2 64 12 12 GLY N N 106.435 0.0 1 65 13 13 ASP H H 8.632 0.0 1 66 13 13 ASP HA H 4.143 0.0 1 67 13 13 ASP HB3 H 2.536 0.0 2 68 13 13 ASP N N 113.297 0.0 1 69 14 14 ASP H H 8.055 0.0 1 70 14 14 ASP HA H 4.295 0.0 1 71 14 14 ASP HB2 H 2.889 0.0 2 72 14 14 ASP HB3 H 2.615 0.0 2 73 14 14 ASP N N 109.993 0.0 2 74 15 15 GLY H H 8.213 0.0 1 75 15 15 GLY HA2 H 4.04 0.0 2 76 15 15 GLY HA3 H 3.551 0.0 2 77 15 15 GLY N N 101.39 0.0 1 78 16 16 LYS H H 8.424 0.0 1 79 16 16 LYS HA H 4.369 0.0 1 80 16 16 LYS HB2 H 1.653 0.0 2 81 16 16 LYS HB3 H 1.519 0.0 2 82 16 16 LYS HG2 H 1.158 0.0 1 83 16 16 LYS HG3 H 1.158 0.0 1 84 16 16 LYS HD2 H 1.247 0.0 1 85 16 16 LYS HD3 H 1.247 0.0 1 86 16 16 LYS N N 112.353 0.0 1 87 17 17 THR H H 9.831 0.0 1 88 17 17 THR HA H 4.091 0.0 1 89 17 17 THR HB H 3.969 0.0 1 90 17 17 THR HG2 H 1.189 0.0 1 91 17 17 THR N N 115.4 0.0 1 92 18 18 ILE H H 8.336 0.0 1 93 18 18 ILE HA H 4.288 0.0 1 94 18 18 ILE HB H 1.648 0.0 1 95 18 18 ILE HG12 H 1.457 0.0 1 96 18 18 ILE HG13 H 1.457 0.0 1 97 18 18 ILE HG2 H 0.707 0.0 1 98 18 18 ILE HD1 H 0.381 0.0 1 99 18 18 ILE N N 121.598 0.0 1 100 19 19 GLU H H 8.655 0.0 1 101 19 19 GLU HA H 4.976 0.0 1 102 19 19 GLU HB2 H 1.764 0.0 2 103 19 19 GLU HB3 H 1.57 0.0 2 104 19 19 GLU HG2 H 1.935 0.0 1 105 19 19 GLU HG3 H 1.935 0.0 1 106 19 19 GLU N N 118.043 0.0 1 107 20 20 TYR H H 9.236 0.0 1 108 20 20 TYR HA H 5.164 0.0 1 109 20 20 TYR HB2 H 2.268 0.0 2 110 20 20 TYR HB3 H 2.838 0.0 2 111 20 20 TYR N N 111.023 0.0 1 112 21 21 LEU H H 7.391 0.0 1 113 21 21 LEU HA H 3.545 0.0 1 114 21 21 LEU HG H 0.566 0.0 1 115 21 21 LEU HD1 H 0.176 0.0 1 116 21 21 LEU HD2 H 0.364 0.0 1 117 21 21 LEU N N 120.85 0.0 1 118 22 22 VAL H H 9.008 0.0 1 119 22 22 VAL HA H 3.913 0.0 1 120 22 22 VAL HB H 1.5 0.0 1 121 22 22 VAL HG1 H 0.48 0.0 1 122 22 22 VAL HG2 H 0.897 0.0 1 123 22 22 VAL N N 122.836 0.0 1 124 23 23 LYS H H 8.136 0.0 1 125 23 23 LYS HA H 4.229 0.0 1 126 23 23 LYS HB2 H 1.254 0.0 2 127 23 23 LYS HB3 H 1.787 0.0 2 128 23 23 LYS N N 117.639 0.0 1 129 24 24 TRP H H 9.02 0.0 1 130 24 24 TRP HA H 4.825 0.0 1 131 24 24 TRP HB2 H 3.238 0.0 2 132 24 24 TRP HB3 H 2.936 0.0 2 133 24 24 TRP N N 121.782 0.0 1 134 25 25 THR H H 8.974 0.0 1 135 25 25 THR HA H 4.063 0.0 1 136 25 25 THR HB H 3.727 0.0 1 137 25 25 THR HG2 H 1.201 0.0 1 138 25 25 THR N N 109.325 0.0 1 139 27 27 MET H H 8.423 0.0 1 140 27 27 MET HA H 4.336 0.0 1 141 27 27 MET HB2 H 2.558 0.0 2 142 27 27 MET N N 113.529 0.0 1 143 29 29 ASP H H 8.083 0.0 1 144 29 29 ASP HA H 4.636 0.0 1 145 29 29 ASP HB2 H 2.551 0.0 2 146 29 29 ASP HB3 H 2.48 0.0 2 147 30 30 ALA H H 8.419 0.0 1 148 30 30 ALA HA H 4.934 0.0 1 149 30 30 ALA HB H 0.897 0.0 1 150 30 30 ALA N N 120.642 0.0 1 151 31 31 THR H H 8.513 0.0 1 152 31 31 THR HA H 4.097 0.0 1 153 31 31 THR HG2 H 1.176 0.0 1 154 31 31 THR N N 104.588 0.0 1 155 32 32 TRP H H 8.501 0.0 1 156 32 32 TRP HA H 4.848 0.0 1 157 32 32 TRP HB2 H 2.872 0.0 2 158 32 32 TRP HB3 H 2.702 0.0 2 159 32 32 TRP N N 116.306 0.0 1 160 33 33 GLU H H 9.745 0.0 1 161 33 33 GLU HA H 5.098 0.0 1 162 33 33 GLU HB2 H 1.769 0.0 2 163 33 33 GLU HB3 H 1.573 0.0 2 164 33 33 GLU HG2 H 2.083 0.0 2 165 33 33 GLU HG3 H 2.264 0.0 2 166 33 33 GLU N N 116.3 0.0 1 167 35 35 GLN H H 8.475 0.0 1 168 35 35 GLN HA H 4.647 0.0 1 169 35 35 GLN HB2 H 2.381 0.0 2 170 35 35 GLN HB3 H 2.124 0.0 2 171 35 35 GLN N N 112.043 0.0 1 172 36 36 ASP H H 8.601 0.0 1 173 36 36 ASP HA H 4.485 0.0 1 174 36 36 ASP HB2 H 2.716 0.0 2 175 36 36 ASP HB3 H 2.553 0.0 2 176 36 36 ASP N N 109.123 0.0 1 177 37 37 ASN H H 8.296 0.0 1 178 37 37 ASN HA H 4.96 0.0 1 179 37 37 ASN HB2 H 3.093 0.0 2 180 37 37 ASN HB3 H 2.747 0.0 2 181 37 37 ASN N N 109.59 0.0 1 182 38 38 VAL H H 7.304 0.0 1 183 38 38 VAL HA H 3.978 0.0 1 184 38 38 VAL HB H 1.659 0.0 1 185 38 38 VAL HG1 H 0.493 0.0 1 186 38 38 VAL HG2 H 0.745 0.0 1 187 38 38 VAL N N 112.316 0.0 1 188 39 39 ASP H H 8.473 0.0 1 189 39 39 ASP HA H 4.303 0.0 1 190 39 39 ASP HB2 H 2.605 0.0 2 191 39 39 ASP HB3 H 2.456 0.0 2 192 39 39 ASP N N 121.316 0.0 1 193 40 40 SER H H 8.837 0.0 1 194 40 40 SER HA H 3.901 0.0 1 195 40 40 SER HB3 H 3.834 0.0 2 196 40 40 SER N N 116.0 0.0 1 197 41 41 THR H H 8.513 0.0 1 198 41 41 THR HA H 3.88 0.0 1 199 41 41 THR N N 111.403 0.0 1 200 42 42 LEU H H 7.345 0.0 1 201 42 42 LEU HA H 3.981 0.0 1 202 42 42 LEU HB2 H 1.672 0.0 2 203 42 42 LEU HB3 H 1.551 0.0 2 204 42 42 LEU HG H 1.172 0.0 1 205 42 42 LEU HD1 H 0.389 0.0 1 206 42 42 LEU HD2 H 0.511 0.0 1 207 42 42 LEU N N 113.212 0.0 1 208 43 43 VAL H H 7.087 0.0 1 209 43 43 VAL HA H 3.025 0.0 1 210 43 43 VAL HB H 1.851 0.0 1 211 43 43 VAL HG1 H 0.173 0.0 1 212 43 43 VAL HG2 H 0.661 0.0 1 213 43 43 VAL N N 113.583 0.0 1 214 44 44 LEU H H 7.836 0.0 1 215 44 44 LEU HA H 3.993 0.0 1 216 44 44 LEU HB2 H 1.677 0.0 2 217 44 44 LEU HB3 H 1.582 0.0 2 218 44 44 LEU HG H 1.174 0.0 1 219 44 44 LEU HD1 H 0.812 0.0 1 220 44 44 LEU HD2 H 0.812 0.0 1 221 44 44 LEU N N 113.645 0.0 1 222 45 45 LEU H H 7.538 0.0 1 223 45 45 LEU HA H 3.986 0.0 1 224 45 45 LEU HB2 H 1.708 0.0 2 225 45 45 LEU HB3 H 1.5 0.0 2 226 45 45 LEU HG H 0.813 0.0 1 227 45 45 LEU N N 111.097 0.0 1 228 46 46 TYR H H 7.417 0.0 1 229 46 46 TYR HA H 4.234 0.0 1 230 46 46 TYR HB2 H 3.16 0.0 2 231 46 46 TYR HB3 H 2.97 0.0 2 232 46 46 TYR N N 113.194 0.0 1 233 47 47 GLN H H 8.445 0.0 1 234 47 47 GLN HA H 3.702 0.0 1 235 47 47 GLN HB2 H 2.2 0.0 2 236 47 47 GLN HB3 H 2.05 0.0 2 237 47 47 GLN HG2 H 2.566 0.0 2 238 47 47 GLN HG3 H 2.398 0.0 2 239 47 47 GLN N N 112.353 0.0 1 240 48 48 GLN H H 7.982 0.0 1 241 48 48 GLN HA H 4.056 0.0 1 242 48 48 GLN HB2 H 2.202 0.0 2 243 48 48 GLN HB3 H 2.072 0.0 2 244 48 48 GLN HG2 H 2.508 0.0 2 245 48 48 GLN HG3 H 2.376 0.0 2 246 48 48 GLN N N 109.973 0.0 1 247 49 49 GLN H H 7.451 0.0 1 248 49 49 GLN HA H 4.195 0.0 1 249 49 49 GLN HB2 H 2.073 0.0 2 250 49 49 GLN HB3 H 1.934 0.0 2 251 49 49 GLN HG2 H 2.416 0.0 2 252 49 49 GLN HG3 H 2.234 0.0 2 253 49 49 GLN N N 110.265 0.0 1 254 50 50 GLN H H 7.623 0.0 1 255 50 50 GLN HA H 4.383 0.0 1 256 50 50 GLN HB2 H 2.075 0.0 2 257 50 50 GLN HB3 H 2.189 0.0 2 258 50 50 GLN HG2 H 1.949 0.0 2 259 50 50 GLN HG3 H 1.769 0.0 2 260 50 50 GLN N N 113.495 0.0 1 261 52 52 MET H H 7.612 0.0 1 262 52 52 MET HA H 4.626 0.0 1 263 52 52 MET HB2 H 2.725 0.0 2 264 52 52 MET HB3 H 2.457 0.0 2 265 52 52 MET HG3 H 2.84 0.0 2 266 54 54 GLU H H 7.884 0.0 1 267 54 54 GLU HA H 4.059 0.0 1 268 54 54 GLU HB3 H 1.812 0.0 2 stop_ save_