data_17143 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for the first dsRBD of protein HYL1 ; _BMRB_accession_number 17143 _BMRB_flat_file_name bmr17143.str _Entry_type original _Submission_date 2010-08-23 _Accession_date 2010-08-23 _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 Rasia Rodolfo M. . 2 Mateos Julieta L. . 3 Bologna Nicolas G. . 4 Burdisso Paula . . 5 Imbert Lionel . . 6 Palatnik Javier F. . 7 Boisbouvier Jerome . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 residual_dipolar_couplings 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 156 "13C chemical shifts" 264 "15N chemical shifts" 80 "residual dipolar couplings" 292 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2010-09-24 original author . stop_ _Original_release_date 2010-09-24 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Structure and RNA Interactions of the Plant MicroRNA Processing-Associated Protein HYL1.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 20735118 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Rasia Rodolfo M. . 2 Mateos Julieta . . 3 Bologna Nicolas G. . 4 Burdisso Paula . . 5 Imbert Lionel . . 6 Palatnik Javier F. . 7 Boisbouvier Jerome . . stop_ _Journal_abbreviation Biochemistry _Journal_name_full Biochemistry _Journal_volume 49 _Journal_issue 38 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 8237 _Page_last 8239 _Year 2010 _Details . loop_ _Keyword dsRBD miRNA stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name HYL1_dsRBD_1 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label HYL1_dsRBD_1-1 $HYL1_dsRBD_1 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_HYL1_dsRBD_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common HYL1_dsRBD_1 _Molecular_mass 8031.225 _Mol_thiol_state 'all free' loop_ _Biological_function 'miRNA processing' 'RNA binding' stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 103 _Mol_residue_sequence ; GHMMTSTDVSSGVSNCYVFK SRLQEYAQKYKLPTPVYEIV KEGPSHKSLFQSTVILDGVR YNSLPGFFNRKAAEQSAAEV ALRELAKSSELSQCVSQPVH ETG ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 -2 GLY 2 -1 HIS 3 0 MET 4 1 MET 5 2 THR 6 3 SER 7 4 THR 8 5 ASP 9 6 VAL 10 7 SER 11 8 SER 12 9 GLY 13 10 VAL 14 11 SER 15 12 ASN 16 13 CYS 17 14 TYR 18 15 VAL 19 16 PHE 20 17 LYS 21 18 SER 22 19 ARG 23 20 LEU 24 21 GLN 25 22 GLU 26 23 TYR 27 24 ALA 28 25 GLN 29 26 LYS 30 27 TYR 31 28 LYS 32 29 LEU 33 30 PRO 34 31 THR 35 32 PRO 36 33 VAL 37 34 TYR 38 35 GLU 39 36 ILE 40 37 VAL 41 38 LYS 42 39 GLU 43 40 GLY 44 41 PRO 45 42 SER 46 43 HIS 47 44 LYS 48 45 SER 49 46 LEU 50 47 PHE 51 48 GLN 52 49 SER 53 50 THR 54 51 VAL 55 52 ILE 56 53 LEU 57 54 ASP 58 55 GLY 59 56 VAL 60 57 ARG 61 58 TYR 62 59 ASN 63 60 SER 64 61 LEU 65 62 PRO 66 63 GLY 67 64 PHE 68 65 PHE 69 66 ASN 70 67 ARG 71 68 LYS 72 69 ALA 73 70 ALA 74 71 GLU 75 72 GLN 76 73 SER 77 74 ALA 78 75 ALA 79 76 GLU 80 77 VAL 81 78 ALA 82 79 LEU 83 80 ARG 84 81 GLU 85 82 LEU 86 83 ALA 87 84 LYS 88 85 SER 89 86 SER 90 87 GLU 91 88 LEU 92 89 SER 93 90 GLN 94 91 CYS 95 92 VAL 96 93 SER 97 94 GLN 98 95 PRO 99 96 VAL 100 97 HIS 101 98 GLU 102 99 THR 103 100 GLY stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-30 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 2L2N "Backbone 1h, 13c, And 15n Chemical Shift Assignments For The First Dsrbd Of Protein Hyl1" 100.00 103 100.00 100.00 5.14e-69 PDB 3ADG "Structure Of Arabidopsis Hyl1 And Its Molecular Implications For Mirna Processing" 69.90 73 97.22 98.61 2.85e-42 PDB 3ADI "Structure Of Arabidopsis Hyl1 And Its Molecular Implications For Mirna Processing" 69.90 73 97.22 98.61 2.85e-42 GB AAB60726 "F21M12.9 gene product [Arabidopsis thaliana]" 97.09 419 100.00 100.00 4.63e-63 GB AAG49890 "hyponastic leave 1 [Arabidopsis thaliana]" 97.09 419 100.00 100.00 4.63e-63 GB AAK96822 "Unknown protein [Arabidopsis thaliana]" 97.09 419 100.00 100.00 4.63e-63 GB AAM10087 "unknown protein [Arabidopsis thaliana]" 97.09 419 100.00 100.00 4.63e-63 GB AEE28481 "dsRNA-binding hyponastic leave 1 protein [Arabidopsis thaliana]" 97.09 419 100.00 100.00 4.63e-63 REF NP_563850 "double-stranded RNA-binding protein 1 [Arabidopsis thaliana]" 97.09 419 100.00 100.00 4.63e-63 SP O04492 "RecName: Full=Double-stranded RNA-binding protein 1; AltName: Full=Protein HYPONASTIC LEAVES 1; AltName: Full=dsRNA-binding pro" 97.09 419 100.00 100.00 4.63e-63 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $HYL1_dsRBD_1 '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 $HYL1_dsRBD_1 'recombinant technology' . Escherichia coli . pET-TEV stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_Isotropic_sample _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $HYL1_dsRBD_1 0.5 mM '[U-100% 13C; U-100% 15N]' 'sodium phosphate' 100 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' DTT 10 mM 'natural abundance' 'sodium azide' 0.05 % 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ save_Aligned_sample _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $HYL1_dsRBD_1 0.5 mM '[U-100% 13C; U-100% 15N]' 'sodium phosphate' 100 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' DTT 10 mM 'natural abundance' 'sodium azide' 0.05 % 'natural abundance' C12E5 5 % 'natural abundance' Hexanol 0.2 % 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ 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_NMRView _Saveframe_category software _Name NMRView _Version . loop_ _Vendor _Address _Electronic_address 'Johnson, One Moon Scientific' . . stop_ loop_ _Task 'chemical shift assignment' 'data analysis' 'peak picking' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model DirectDrive _Field_strength 600 _Details 'Equipped with cryoprobe' save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $Isotropic_sample save_ save_3D_HNCO_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $Isotropic_sample save_ save_3D_HNCA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $Isotropic_sample save_ save_3D_HNCACB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $Isotropic_sample save_ save_3D_HN(CO)CA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $Isotropic_sample save_ save_3D_HN(COCA)CB_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(COCA)CB' _Sample_label $Isotropic_sample save_ save_3D_HN(CA)CO_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CA)CO' _Sample_label $Isotropic_sample save_ save_3D_HBHA(CO)NH_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CO)NH' _Sample_label $Isotropic_sample save_ save_3D_HNCO_JNH_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO JNH' _Sample_label $Isotropic_sample save_ save_3D_HNCOCA_JCAHA_10 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCOCA JCAHA' _Sample_label $Isotropic_sample save_ save_3D_HNCO_JCACO_11 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO JCACO' _Sample_label $Isotropic_sample save_ save_3D_HNCO_JCH_12 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO JCH' _Sample_label $Isotropic_sample save_ save_3D_HNCO_JNH_13 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO JNH' _Sample_label $Aligned_sample save_ save_3D_HNCOCA_JCAHA_14 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCOCA JCAHA' _Sample_label $Aligned_sample save_ save_3D_HNCO_JCACO_15 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO JCACO' _Sample_label $Aligned_sample save_ save_3D_HNCO_JCH_16 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO JCH' _Sample_label $Aligned_sample save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 7.0 . 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 water C 13 protons ppm 4.77 internal indirect . . . 0.251449530 water H 1 protons ppm 4.77 internal direct . . . 1.000000000 water N 15 protons ppm 4.77 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_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $NMRPipe $NMRView stop_ loop_ _Experiment_label '2D 1H-15N HSQC' '3D HNCO' '3D HNCA' '3D HNCACB' '3D HN(CO)CA' '3D HN(COCA)CB' '3D HN(CA)CO' '3D HBHA(CO)NH' stop_ loop_ _Sample_label $Isotropic_sample stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name HYL1_dsRBD_1-1 _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 3 6 SER HA H 4.410 0.030 1 2 3 6 SER C C 175.020 0.300 1 3 3 6 SER CA C 58.590 0.300 1 4 3 6 SER CB C 64.026 0.300 1 5 4 7 THR H H 8.160 0.030 1 6 4 7 THR HA H 4.210 0.030 1 7 4 7 THR C C 174.390 0.300 1 8 4 7 THR CA C 62.151 0.300 1 9 4 7 THR CB C 69.719 0.300 1 10 4 7 THR N N 115.160 0.300 1 11 5 8 ASP H H 8.234 0.030 1 12 5 8 ASP HA H 4.540 0.030 1 13 5 8 ASP C C 176.580 0.300 1 14 5 8 ASP CA C 54.542 0.300 1 15 5 8 ASP CB C 41.236 0.300 1 16 5 8 ASP N N 122.750 0.300 1 17 6 9 VAL H H 8.072 0.030 1 18 6 9 VAL HA H 4.060 0.030 1 19 6 9 VAL C C 176.650 0.300 1 20 6 9 VAL CA C 62.527 0.300 1 21 6 9 VAL CB C 32.394 0.300 1 22 6 9 VAL N N 119.830 0.300 1 23 7 10 SER H H 8.371 0.030 1 24 7 10 SER HA H 4.330 0.030 1 25 7 10 SER C C 175.090 0.300 1 26 7 10 SER CA C 58.898 0.300 1 27 7 10 SER CB C 63.849 0.300 1 28 7 10 SER N N 118.640 0.300 1 29 8 11 SER H H 8.324 0.030 1 30 8 11 SER C C 175.110 0.300 1 31 8 11 SER N N 110.590 0.300 1 32 9 12 GLY C C 174.310 0.300 1 33 9 12 GLY CA C 45.465 0.300 1 34 10 13 VAL H H 7.886 0.030 1 35 10 13 VAL HA H 4.050 0.030 1 36 10 13 VAL C C 176.460 0.300 1 37 10 13 VAL CA C 62.483 0.300 1 38 10 13 VAL CB C 32.506 0.300 1 39 10 13 VAL N N 118.690 0.300 1 40 11 14 SER H H 8.312 0.030 1 41 11 14 SER C C 174.510 0.300 1 42 11 14 SER CA C 58.418 0.300 1 43 11 14 SER CB C 63.790 0.300 1 44 11 14 SER N N 118.460 0.300 1 45 13 16 CYS HA H 4.280 0.030 1 46 13 16 CYS C C 174.450 0.300 1 47 13 16 CYS CA C 58.764 0.300 1 48 13 16 CYS CB C 27.622 0.300 1 49 14 17 TYR H H 8.131 0.030 1 50 14 17 TYR HA H 4.520 0.030 1 51 14 17 TYR C C 176.780 0.300 1 52 14 17 TYR CA C 56.692 0.300 1 53 14 17 TYR CB C 37.716 0.300 1 54 14 17 TYR N N 121.160 0.300 1 55 15 18 VAL H H 7.387 0.030 1 56 15 18 VAL HA H 4.270 0.030 1 57 15 18 VAL C C 176.420 0.300 1 58 15 18 VAL CA C 61.599 0.300 1 59 15 18 VAL CB C 32.453 0.300 1 60 15 18 VAL N N 113.530 0.300 1 61 16 19 PHE H H 7.272 0.030 1 62 16 19 PHE HA H 3.950 0.030 1 63 16 19 PHE C C 177.950 0.300 1 64 16 19 PHE CA C 62.281 0.300 1 65 16 19 PHE CB C 38.656 0.300 1 66 16 19 PHE N N 121.120 0.300 1 67 17 20 LYS H H 8.575 0.030 1 68 17 20 LYS C C 180.800 0.300 1 69 17 20 LYS CA C 60.913 0.300 1 70 17 20 LYS CB C 31.689 0.300 1 71 17 20 LYS N N 119.160 0.300 1 72 18 21 SER H H 8.228 0.030 1 73 18 21 SER CA C 61.564 0.300 1 74 18 21 SER N N 116.440 0.300 1 75 19 22 ARG HA H 4.120 0.030 1 76 19 22 ARG C C 179.830 0.300 1 77 19 22 ARG CA C 59.280 0.300 1 78 19 22 ARG CB C 30.686 0.300 1 79 20 23 LEU H H 8.703 0.030 1 80 20 23 LEU HA H 4.210 0.030 1 81 20 23 LEU C C 177.930 0.300 1 82 20 23 LEU CA C 57.755 0.300 1 83 20 23 LEU CB C 41.442 0.300 1 84 20 23 LEU N N 122.780 0.300 1 85 21 24 GLN H H 8.000 0.030 1 86 21 24 GLN HA H 3.910 0.030 1 87 21 24 GLN C C 178.590 0.300 1 88 21 24 GLN CA C 59.451 0.300 1 89 21 24 GLN CB C 27.965 0.300 1 90 21 24 GLN N N 120.270 0.300 1 91 22 25 GLU H H 8.172 0.030 1 92 22 25 GLU HA H 3.970 0.030 1 93 22 25 GLU C C 178.860 0.300 1 94 22 25 GLU CA C 59.546 0.300 1 95 22 25 GLU CB C 29.386 0.300 1 96 22 25 GLU N N 119.610 0.300 1 97 23 26 TYR H H 8.099 0.030 1 98 23 26 TYR HA H 4.050 0.030 1 99 23 26 TYR C C 176.790 0.300 1 100 23 26 TYR CA C 62.218 0.300 1 101 23 26 TYR CB C 38.382 0.300 1 102 23 26 TYR N N 122.630 0.300 1 103 24 27 ALA H H 8.431 0.030 1 104 24 27 ALA HA H 3.920 0.030 1 105 24 27 ALA C C 179.250 0.300 1 106 24 27 ALA CA C 55.582 0.300 1 107 24 27 ALA CB C 17.599 0.300 1 108 24 27 ALA N N 120.250 0.300 1 109 25 28 GLN H H 8.073 0.030 1 110 25 28 GLN C C 179.760 0.300 1 111 25 28 GLN CA C 58.782 0.300 1 112 25 28 GLN CB C 28.655 0.300 1 113 25 28 GLN N N 115.210 0.300 1 114 26 29 LYS HA H 3.710 0.030 1 115 26 29 LYS C C 177.970 0.300 1 116 26 29 LYS CA C 59.316 0.300 1 117 26 29 LYS CB C 31.968 0.300 1 118 27 30 TYR H H 7.542 0.030 1 119 27 30 TYR HA H 4.180 0.030 1 120 27 30 TYR C C 173.330 0.300 1 121 27 30 TYR CA C 58.900 0.300 1 122 27 30 TYR CB C 37.075 0.300 1 123 27 30 TYR N N 114.480 0.300 1 124 28 31 LYS H H 7.596 0.030 1 125 28 31 LYS HA H 3.810 0.030 1 126 28 31 LYS C C 175.750 0.300 1 127 28 31 LYS CA C 57.154 0.300 1 128 28 31 LYS CB C 28.355 0.300 1 129 28 31 LYS N N 116.640 0.300 1 130 29 32 LEU H H 8.794 0.030 1 131 29 32 LEU C C 174.430 0.300 1 132 29 32 LEU CA C 52.172 0.300 1 133 29 32 LEU CB C 42.165 0.300 1 134 29 32 LEU N N 119.670 0.300 1 135 32 35 PRO HA H 4.340 0.030 1 136 32 35 PRO C C 175.300 0.300 1 137 32 35 PRO CA C 63.464 0.300 1 138 32 35 PRO CB C 32.689 0.300 1 139 33 36 VAL H H 7.511 0.030 1 140 33 36 VAL HA H 4.220 0.030 1 141 33 36 VAL C C 173.790 0.300 1 142 33 36 VAL CA C 61.224 0.300 1 143 33 36 VAL CB C 35.224 0.300 1 144 33 36 VAL N N 122.150 0.300 1 145 34 37 TYR H H 8.762 0.030 1 146 34 37 TYR HA H 5.020 0.030 1 147 34 37 TYR C C 176.470 0.300 1 148 34 37 TYR CA C 57.611 0.300 1 149 34 37 TYR CB C 40.297 0.300 1 150 34 37 TYR N N 123.800 0.300 1 151 35 38 GLU H H 9.362 0.030 1 152 35 38 GLU HA H 4.610 0.030 1 153 35 38 GLU C C 176.250 0.300 1 154 35 38 GLU CA C 54.704 0.300 1 155 35 38 GLU CB C 32.997 0.300 1 156 35 38 GLU N N 123.010 0.300 1 157 36 39 ILE H H 8.873 0.030 1 158 36 39 ILE HA H 5.000 0.030 1 159 36 39 ILE C C 174.980 0.300 1 160 36 39 ILE CA C 58.454 0.300 1 161 36 39 ILE CB C 40.867 0.300 1 162 36 39 ILE N N 123.360 0.300 1 163 37 40 VAL H H 8.820 0.030 1 164 37 40 VAL HA H 4.170 0.030 1 165 37 40 VAL C C 174.200 0.300 1 166 37 40 VAL CA C 61.924 0.300 1 167 37 40 VAL CB C 34.438 0.300 1 168 37 40 VAL N N 127.130 0.300 1 169 38 41 LYS H H 8.447 0.030 1 170 38 41 LYS HA H 4.730 0.030 1 171 38 41 LYS C C 175.550 0.300 1 172 38 41 LYS CA C 54.566 0.300 1 173 38 41 LYS CB C 34.666 0.300 1 174 38 41 LYS N N 127.300 0.300 1 175 39 42 GLU H H 8.658 0.030 1 176 39 42 GLU HA H 4.490 0.030 1 177 39 42 GLU C C 175.170 0.300 1 178 39 42 GLU CA C 55.056 0.300 1 179 39 42 GLU CB C 33.337 0.300 1 180 39 42 GLU N N 123.990 0.300 1 181 40 43 GLY H H 8.306 0.030 1 182 40 43 GLY C C 175.150 0.300 1 183 40 43 GLY CA C 44.114 0.300 1 184 40 43 GLY N N 108.470 0.300 1 185 43 46 HIS HA H 4.550 0.030 1 186 43 46 HIS C C 175.290 0.300 1 187 43 46 HIS CA C 56.642 0.300 1 188 43 46 HIS CB C 30.074 0.300 1 189 44 47 LYS H H 7.477 0.030 1 190 44 47 LYS HA H 4.270 0.030 1 191 44 47 LYS C C 173.780 0.300 1 192 44 47 LYS CA C 55.644 0.300 1 193 44 47 LYS CB C 32.260 0.300 1 194 44 47 LYS N N 123.940 0.300 1 195 45 48 SER H H 8.013 0.030 1 196 45 48 SER HA H 4.260 0.030 1 197 45 48 SER C C 172.790 0.300 1 198 45 48 SER CA C 59.171 0.300 1 199 45 48 SER CB C 64.368 0.300 1 200 45 48 SER N N 117.640 0.300 1 201 46 49 LEU H H 8.301 0.030 1 202 46 49 LEU HA H 4.890 0.030 1 203 46 49 LEU C C 176.900 0.300 1 204 46 49 LEU CA C 53.100 0.300 1 205 46 49 LEU CB C 44.854 0.300 1 206 46 49 LEU N N 121.190 0.300 1 207 47 50 PHE H H 9.342 0.030 1 208 47 50 PHE HA H 5.130 0.030 1 209 47 50 PHE C C 174.390 0.300 1 210 47 50 PHE CA C 57.950 0.300 1 211 47 50 PHE CB C 43.642 0.300 1 212 47 50 PHE N N 118.030 0.300 1 213 48 51 GLN H H 8.547 0.030 1 214 48 51 GLN HA H 4.510 0.030 1 215 48 51 GLN C C 173.660 0.300 1 216 48 51 GLN CA C 55.049 0.300 1 217 48 51 GLN CB C 32.317 0.300 1 218 48 51 GLN N N 118.130 0.300 1 219 49 52 SER H H 9.097 0.030 1 220 49 52 SER HA H 5.640 0.030 1 221 49 52 SER C C 172.990 0.300 1 222 49 52 SER CA C 55.574 0.300 1 223 49 52 SER CB C 66.214 0.300 1 224 49 52 SER N N 117.520 0.300 1 225 50 53 THR H H 8.477 0.030 1 226 50 53 THR HA H 5.210 0.030 1 227 50 53 THR C C 172.790 0.300 1 228 50 53 THR CA C 61.510 0.300 1 229 50 53 THR CB C 72.716 0.300 1 230 50 53 THR N N 124.240 0.300 1 231 51 54 VAL H H 9.260 0.030 1 232 51 54 VAL HA H 4.980 0.030 1 233 51 54 VAL C C 172.310 0.300 1 234 51 54 VAL CA C 57.702 0.300 1 235 51 54 VAL CB C 34.626 0.300 1 236 51 54 VAL N N 125.340 0.300 1 237 52 55 ILE H H 8.908 0.030 1 238 52 55 ILE HA H 4.810 0.030 1 239 52 55 ILE C C 176.620 0.300 1 240 52 55 ILE CA C 60.379 0.300 1 241 52 55 ILE CB C 39.154 0.300 1 242 52 55 ILE N N 127.680 0.300 1 243 53 56 LEU H H 8.955 0.030 1 244 53 56 LEU HA H 4.820 0.030 1 245 53 56 LEU C C 176.590 0.300 1 246 53 56 LEU CA C 53.133 0.300 1 247 53 56 LEU CB C 45.131 0.300 1 248 53 56 LEU N N 129.100 0.300 1 249 54 57 ASP H H 9.930 0.030 1 250 54 57 ASP HA H 4.210 0.030 1 251 54 57 ASP C C 175.280 0.300 1 252 54 57 ASP CA C 54.660 0.300 1 253 54 57 ASP CB C 41.334 0.300 1 254 54 57 ASP N N 131.490 0.300 1 255 55 58 GLY H H 8.120 0.030 1 256 55 58 GLY C C 174.350 0.300 1 257 55 58 GLY CA C 45.368 0.300 1 258 55 58 GLY N N 101.610 0.300 1 259 56 59 VAL H H 7.628 0.030 1 260 56 59 VAL HA H 3.760 0.030 1 261 56 59 VAL C C 173.420 0.300 1 262 56 59 VAL CA C 61.934 0.300 1 263 56 59 VAL CB C 32.797 0.300 1 264 56 59 VAL N N 123.920 0.300 1 265 57 60 ARG H H 7.789 0.030 1 266 57 60 ARG HA H 4.420 0.030 1 267 57 60 ARG C C 175.650 0.300 1 268 57 60 ARG CA C 55.274 0.300 1 269 57 60 ARG CB C 32.035 0.300 1 270 57 60 ARG N N 123.800 0.300 1 271 58 61 TYR H H 9.091 0.030 1 272 58 61 TYR HA H 4.580 0.030 1 273 58 61 TYR C C 174.480 0.300 1 274 58 61 TYR CA C 56.721 0.300 1 275 58 61 TYR CB C 39.282 0.300 1 276 58 61 TYR N N 122.690 0.300 1 277 59 62 ASN H H 8.902 0.030 1 278 59 62 ASN HA H 5.240 0.030 1 279 59 62 ASN C C 175.380 0.300 1 280 59 62 ASN CA C 52.689 0.300 1 281 59 62 ASN CB C 40.881 0.300 1 282 59 62 ASN N N 121.250 0.300 1 283 60 63 SER H H 9.404 0.030 1 284 60 63 SER C C 175.310 0.300 1 285 60 63 SER CA C 58.565 0.300 1 286 60 63 SER CB C 67.135 0.300 1 287 60 63 SER N N 114.980 0.300 1 288 62 65 PRO HA H 4.630 0.030 1 289 62 65 PRO C C 178.490 0.300 1 290 62 65 PRO CA C 62.380 0.300 1 291 62 65 PRO CB C 32.051 0.300 1 292 63 66 GLY H H 8.691 0.030 1 293 63 66 GLY C C 174.800 0.300 1 294 63 66 GLY CA C 47.183 0.300 1 295 63 66 GLY N N 104.740 0.300 1 296 64 67 PHE H H 8.383 0.030 1 297 64 67 PHE HA H 4.190 0.030 1 298 64 67 PHE C C 176.860 0.300 1 299 64 67 PHE CA C 59.966 0.300 1 300 64 67 PHE CB C 40.718 0.300 1 301 64 67 PHE N N 117.500 0.300 1 302 65 68 PHE H H 9.202 0.030 1 303 65 68 PHE HA H 5.060 0.030 1 304 65 68 PHE C C 175.760 0.300 1 305 65 68 PHE CA C 57.773 0.300 1 306 65 68 PHE CB C 39.239 0.300 1 307 65 68 PHE N N 117.050 0.300 1 308 66 69 ASN H H 7.517 0.030 1 309 66 69 ASN HA H 4.210 0.030 1 310 66 69 ASN C C 173.410 0.300 1 311 66 69 ASN CA C 52.160 0.300 1 312 66 69 ASN CB C 41.307 0.300 1 313 66 69 ASN N N 113.210 0.300 1 314 67 70 ARG H H 8.056 0.030 1 315 67 70 ARG HA H 3.100 0.030 1 316 67 70 ARG C C 176.900 0.300 1 317 67 70 ARG CA C 59.300 0.300 1 318 67 70 ARG CB C 30.046 0.300 1 319 67 70 ARG N N 120.880 0.300 1 320 68 71 LYS H H 7.906 0.030 1 321 68 71 LYS HA H 3.660 0.030 1 322 68 71 LYS C C 178.790 0.300 1 323 68 71 LYS CA C 59.633 0.300 1 324 68 71 LYS CB C 31.818 0.300 1 325 68 71 LYS N N 118.800 0.300 1 326 69 72 ALA H H 7.934 0.030 1 327 69 72 ALA HA H 3.670 0.030 1 328 69 72 ALA C C 179.490 0.300 1 329 69 72 ALA CA C 54.490 0.300 1 330 69 72 ALA CB C 18.723 0.300 1 331 69 72 ALA N N 119.940 0.300 1 332 70 73 ALA H H 6.740 0.030 1 333 70 73 ALA HA H 3.130 0.030 1 334 70 73 ALA C C 179.120 0.300 1 335 70 73 ALA CA C 54.895 0.300 1 336 70 73 ALA CB C 17.724 0.300 1 337 70 73 ALA N N 119.600 0.300 1 338 71 74 GLU H H 7.995 0.030 1 339 71 74 GLU HA H 3.910 0.030 1 340 71 74 GLU C C 178.950 0.300 1 341 71 74 GLU CA C 59.486 0.300 1 342 71 74 GLU CB C 30.319 0.300 1 343 71 74 GLU N N 118.060 0.300 1 344 72 75 GLN H H 7.800 0.030 1 345 72 75 GLN HA H 3.910 0.030 1 346 72 75 GLN C C 177.830 0.300 1 347 72 75 GLN CA C 59.136 0.300 1 348 72 75 GLN CB C 27.078 0.300 1 349 72 75 GLN N N 114.750 0.300 1 350 73 76 SER H H 7.167 0.030 1 351 73 76 SER HA H 4.210 0.030 1 352 73 76 SER C C 176.230 0.300 1 353 73 76 SER CA C 60.151 0.300 1 354 73 76 SER CB C 64.234 0.300 1 355 73 76 SER N N 111.760 0.300 1 356 74 77 ALA H H 8.041 0.030 1 357 74 77 ALA C C 178.310 0.300 1 358 74 77 ALA CA C 60.147 0.300 1 359 74 77 ALA CB C 17.546 0.300 1 360 74 77 ALA N N 121.780 0.300 1 361 76 79 GLU HA H 3.160 0.030 1 362 76 79 GLU C C 179.100 0.300 1 363 76 79 GLU CA C 60.001 0.300 1 364 76 79 GLU CB C 28.808 0.300 1 365 77 80 VAL H H 8.219 0.030 1 366 77 80 VAL HA H 3.230 0.030 1 367 77 80 VAL C C 178.220 0.300 1 368 77 80 VAL CA C 67.113 0.300 1 369 77 80 VAL CB C 31.537 0.300 1 370 77 80 VAL N N 120.900 0.300 1 371 78 81 ALA H H 7.939 0.030 1 372 78 81 ALA HA H 2.750 0.030 1 373 78 81 ALA C C 178.970 0.300 1 374 78 81 ALA CA C 55.178 0.300 1 375 78 81 ALA CB C 18.280 0.300 1 376 78 81 ALA N N 121.780 0.300 1 377 79 82 LEU H H 8.209 0.030 1 378 79 82 LEU HA H 3.410 0.030 1 379 79 82 LEU C C 179.810 0.300 1 380 79 82 LEU CA C 58.056 0.300 1 381 79 82 LEU CB C 41.977 0.300 1 382 79 82 LEU N N 115.590 0.300 1 383 80 83 ARG H H 7.907 0.030 1 384 80 83 ARG HA H 3.890 0.030 1 385 80 83 ARG C C 179.360 0.300 1 386 80 83 ARG CA C 59.392 0.300 1 387 80 83 ARG CB C 30.047 0.300 1 388 80 83 ARG N N 120.280 0.300 1 389 81 84 GLU H H 8.119 0.030 1 390 81 84 GLU HA H 3.980 0.030 1 391 81 84 GLU C C 180.320 0.300 1 392 81 84 GLU CA C 58.715 0.300 1 393 81 84 GLU CB C 29.468 0.300 1 394 81 84 GLU N N 119.350 0.300 1 395 82 85 LEU H H 8.621 0.030 1 396 82 85 LEU HA H 3.890 0.030 1 397 82 85 LEU C C 179.470 0.300 1 398 82 85 LEU CA C 57.338 0.300 1 399 82 85 LEU CB C 41.733 0.300 1 400 82 85 LEU N N 121.600 0.300 1 401 83 86 ALA H H 7.595 0.030 1 402 83 86 ALA HA H 4.120 0.030 1 403 83 86 ALA C C 179.080 0.300 1 404 83 86 ALA CA C 53.799 0.300 1 405 83 86 ALA CB C 18.238 0.300 1 406 83 86 ALA N N 120.870 0.300 1 407 84 87 LYS H H 7.552 0.030 1 408 84 87 LYS HA H 4.100 0.030 1 409 84 87 LYS C C 177.880 0.300 1 410 84 87 LYS CA C 58.007 0.300 1 411 84 87 LYS CB C 32.527 0.300 1 412 84 87 LYS N N 117.850 0.300 1 413 85 88 SER H H 7.958 0.030 1 414 85 88 SER HA H 4.360 0.030 1 415 85 88 SER C C 175.420 0.300 1 416 85 88 SER CA C 59.350 0.300 1 417 85 88 SER CB C 63.693 0.300 1 418 85 88 SER N N 114.140 0.300 1 419 86 89 SER H H 8.095 0.030 1 420 86 89 SER C C 178.900 0.300 1 421 86 89 SER CA C 59.274 0.300 1 422 86 89 SER CB C 63.719 0.300 1 423 86 89 SER N N 117.360 0.300 1 424 87 90 GLU HA H 4.160 0.030 1 425 87 90 GLU C C 177.180 0.300 1 426 87 90 GLU CA C 57.316 0.300 1 427 87 90 GLU CB C 29.793 0.300 1 428 88 91 LEU H H 8.058 0.030 1 429 88 91 LEU HA H 4.250 0.030 1 430 88 91 LEU C C 177.910 0.300 1 431 88 91 LEU CA C 55.725 0.300 1 432 88 91 LEU CB C 42.155 0.300 1 433 88 91 LEU N N 121.560 0.300 1 434 89 92 SER H H 8.122 0.030 1 435 89 92 SER HA H 4.320 0.030 1 436 89 92 SER C C 174.800 0.300 1 437 89 92 SER CA C 58.910 0.300 1 438 89 92 SER CB C 63.709 0.300 1 439 89 92 SER N N 115.480 0.300 1 440 90 93 GLN H H 8.242 0.030 1 441 90 93 GLN HA H 4.260 0.030 1 442 90 93 GLN C C 175.960 0.300 1 443 90 93 GLN CA C 55.963 0.300 1 444 90 93 GLN CB C 29.286 0.300 1 445 90 93 GLN N N 121.210 0.300 1 446 91 94 CYS H H 8.256 0.030 1 447 91 94 CYS HA H 4.390 0.030 1 448 91 94 CYS C C 174.720 0.300 1 449 91 94 CYS CA C 58.741 0.300 1 450 91 94 CYS CB C 27.983 0.300 1 451 91 94 CYS N N 120.040 0.300 1 452 92 95 VAL H H 8.185 0.030 1 453 92 95 VAL HA H 4.100 0.030 1 454 92 95 VAL C C 176.110 0.300 1 455 92 95 VAL CA C 62.370 0.300 1 456 92 95 VAL CB C 32.747 0.300 1 457 92 95 VAL N N 122.030 0.300 1 458 93 96 SER H H 8.317 0.030 1 459 93 96 SER HA H 4.340 0.030 1 460 93 96 SER C C 174.020 0.300 1 461 93 96 SER CA C 58.260 0.300 1 462 93 96 SER CB C 63.856 0.300 1 463 93 96 SER N N 119.350 0.300 1 464 94 97 GLN H H 8.297 0.030 1 465 94 97 GLN C C 173.820 0.300 1 466 94 97 GLN CA C 53.664 0.300 1 467 94 97 GLN CB C 29.116 0.300 1 468 94 97 GLN N N 123.040 0.300 1 469 95 98 PRO HA H 3.870 0.030 1 470 95 98 PRO C C 176.790 0.300 1 471 95 98 PRO CA C 63.138 0.300 1 472 95 98 PRO CB C 32.007 0.300 1 473 96 99 VAL H H 8.202 0.030 1 474 96 99 VAL HA H 3.940 0.030 1 475 96 99 VAL C C 175.990 0.300 1 476 96 99 VAL CA C 62.415 0.300 1 477 96 99 VAL CB C 32.640 0.300 1 478 96 99 VAL N N 120.270 0.300 1 479 97 100 HIS H H 8.352 0.030 1 480 97 100 HIS HA H 4.590 0.030 1 481 97 100 HIS C C 175.090 0.300 1 482 97 100 HIS CA C 55.761 0.300 1 483 97 100 HIS CB C 30.585 0.300 1 484 97 100 HIS N N 122.910 0.300 1 485 98 101 GLU H H 8.446 0.030 1 486 98 101 GLU HA H 4.270 0.030 1 487 98 101 GLU C C 176.570 0.300 1 488 98 101 GLU CA C 56.706 0.300 1 489 98 101 GLU CB C 30.386 0.300 1 490 98 101 GLU N N 122.980 0.300 1 491 99 102 THR H H 8.194 0.030 1 492 99 102 THR HA H 4.230 0.030 1 493 99 102 THR C C 174.360 0.300 1 494 99 102 THR CA C 61.843 0.300 1 495 99 102 THR CB C 70.065 0.300 1 496 99 102 THR N N 114.420 0.300 1 497 100 103 GLY H H 8.031 0.030 1 498 100 103 GLY C C 179.050 0.300 1 499 100 103 GLY CA C 46.279 0.300 1 500 100 103 GLY N N 117.310 0.300 1 stop_ save_ save_RDC_list_1 _Saveframe_category residual_dipolar_couplings loop_ _Sample_label $Isotropic_sample $Isotropic_sample $Isotropic_sample $Isotropic_sample $Aligned_sample $Aligned_sample $Aligned_sample $Aligned_sample stop_ loop_ _Residual_dipolar_coupling_ID _Atom_one_residue_seq_code _Atom_one_residue_label _Atom_one_atom_name _Atom_two_residue_seq_code _Atom_two_residue_label _Atom_two_atom_name _Residual_dipolar_coupling_value _Software_label _Atom_one_mol_system_component_name _Atom_two_mol_system_component_name _Residual_dipolar_coupling_min_value _Residual_dipolar_coupling_max_value DCAHA 20 LYS CA 20 LYS HA -65.92 $NMRPipe ? ? . . DCAHA 21 SER CA 21 SER HA 47.75 $NMRView ? ? . . DCAHA 22 ARG CA 22 ARG HA 1.88 $NMRView ? ? . . DCAHA 22 ARG CA 22 ARG HA 49.33 $NMRView ? ? . . DCAHA 23 LEU CA 23 LEU HA -71.97 $NMRView ? ? . . DCAHA 26 TYR CA 26 TYR HA 20.27 $NMRView ? ? . . DCAHA 27 ALA CA 27 ALA HA -89.61 $NMRView ? ? . . DCAHA 28 GLN CA 28 GLN HA -3.89 $NMRView ? ? . . DCAHA 32 LEU CA 32 LEU HA 18.35 $NMRView ? ? . . DCAHA 33 PRO CA 33 PRO HA 20.97 $NMRView ? ? . . DCAHA 34 THR CA 34 THR HA 9.93 $NMRView ? ? . . DCAHA 35 PRO CA 35 PRO HA 21.89 $NMRView ? ? . . DCAHA 36 VAL CA 36 VAL HA 13.16 $NMRView ? ? . . DCAHA 37 TYR CA 37 TYR HA 27.87 $NMRView ? ? . . DCAHA 38 GLU CA 38 GLU HA 33.25 $NMRView ? ? . . DCAHA 39 ILE CA 39 ILE HA 21.68 $NMRView ? ? . . DCAHA 43 GLY CA 43 GLY HA 20.17 $NMRView ? ? . . DCAHA 44 PRO CA 44 PRO HA 27.29 $NMRView ? ? . . DCAHA 47 LYS CA 47 LYS HA 39.43 $NMRView ? ? . . DCAHA 49 LEU CA 49 LEU HA 9.47 $NMRView ? ? . . DCAHA 51 GLN CA 51 GLN HA 19.68 $NMRView ? ? . . DCAHA 53 THR CA 53 THR HA 46.63 $NMRView ? ? . . DCAHA 54 VAL CA 54 VAL HA 47.14 $NMRView ? ? . . DCAHA 56 LEU CA 56 LEU HA 44.19 $NMRView ? ? . . DCAHA 57 ASP CA 57 ASP HA 33.73 $NMRView ? ? . . DCAHA 58 GLY CA 58 GLY HA 32.14 $NMRView ? ? . . DCAHA 59 VAL CA 59 VAL HA 18.77 $NMRView ? ? . . DCAHA 64 LEU CA 64 LEU HA 35.62 $NMRView ? ? . . DCAHA 65 PRO CA 65 PRO HA 11.05 $NMRView ? ? . . DCAHA 73 ALA CA 73 ALA HA -10.29 $NMRView ? ? . . DCAHA 77 ALA CA 77 ALA HA 36.77 $NMRView ? ? . . DCAHA 80 VAL CA 80 VAL HA -12.45 $NMRView ? ? . . DCAHA 82 LEU CA 82 LEU HA 13.61 $NMRView ? ? . . DCAHA 83 ARG CA 83 ARG HA -16.34 $NMRView ? ? . . DCAHA 84 GLU CA 84 GLU HA 22.06 $NMRView ? ? . . DCAHA 85 LEU CA 85 LEU HA 22.34 $NMRView ? ? . . DCCA 16 CYS C 16 CYS CA 3.73 $NMRView ? ? . . DCCA 19 PHE C 19 PHE CA 2.02 $NMRView ? ? . . DCCA 20 LYS C 20 LYS CA 5.41 $NMRView ? ? . . DCCA 21 SER C 21 SER CA -6.49 $NMRView ? ? . . DCCA 22 ARG C 22 ARG CA -2.63 $NMRView ? ? . . DCCA 23 LEU C 23 LEU CA 5.01 $NMRView ? ? . . DCCA 24 GLN C 24 GLN CA 1.55 $NMRView ? ? . . DCCA 26 TYR C 26 TYR CA 1.33 $NMRView ? ? . . DCCA 27 ALA C 27 ALA CA 4.18 $NMRView ? ? . . DCCA 28 GLN C 28 GLN CA 1.16 $NMRView ? ? . . DCCA 32 LEU C 32 LEU CA -7.87 $NMRView ? ? . . DCCA 33 PRO C 33 PRO CA 1.51 $NMRView ? ? . . DCCA 34 THR C 34 THR CA -3.41 $NMRView ? ? . . DCCA 35 PRO C 35 PRO CA -1.30 $NMRView ? ? . . DCCA 36 VAL C 36 VAL CA -0.17 $NMRView ? ? . . DCCA 37 TYR C 37 TYR CA -2.85 $NMRView ? ? . . DCCA 38 GLU C 38 GLU CA -0.01 $NMRView ? ? . . DCCA 39 ILE C 39 ILE CA -3.04 $NMRView ? ? . . DCCA 43 GLY C 43 GLY CA -0.14 $NMRView ? ? . . DCCA 44 PRO C 44 PRO CA -3.80 $NMRView ? ? . . DCCA 45 SER C 45 SER CA -4.95 $NMRView ? ? . . DCCA 46 HIS C 46 HIS CA -1.42 $NMRView ? ? . . DCCA 47 LYS C 47 LYS CA -6.94 $NMRView ? ? . . DCCA 48 SER C 48 SER CA 2.19 $NMRView ? ? . . DCCA 49 LEU C 49 LEU CA -4.65 $NMRView ? ? . . DCCA 50 PHE C 50 PHE CA 0.21 $NMRView ? ? . . DCCA 51 GLN C 51 GLN CA -2.03 $NMRView ? ? . . DCCA 52 SER C 52 SER CA -4.53 $NMRView ? ? . . DCCA 53 THR C 53 THR CA -1.60 $NMRView ? ? . . DCCA 54 VAL C 54 VAL CA 2.01 $NMRView ? ? . . DCCA 55 ILE C 55 ILE CA 3.52 $NMRView ? ? . . DCCA 56 LEU C 56 LEU CA -5.91 $NMRView ? ? . . DCCA 57 ASP C 57 ASP CA 5.48 $NMRView ? ? . . DCCA 58 GLY C 58 GLY CA -8.14 $NMRView ? ? . . DCCA 59 VAL C 59 VAL CA 5.10 $NMRView ? ? . . DCCA 62 ASN C 62 ASN CA -0.15 $NMRView ? ? . . DCCA 63 SER C 63 SER CA 4.92 $NMRView ? ? . . DCCA 64 LEU C 64 LEU CA -5.26 $NMRView ? ? . . DCCA 65 PRO C 65 PRO CA 4.56 $NMRView ? ? . . DCCA 66 GLY C 66 GLY CA -4.54 $NMRView ? ? . . DCCA 67 PHE C 67 PHE CA -6.26 $NMRView ? ? . . DCCA 68 PHE C 68 PHE CA 2.58 $NMRView ? ? . . DCCA 69 ASN C 69 ASN CA 5.39 $NMRView ? ? . . DCCA 70 ARG C 70 ARG CA -3.88 $NMRView ? ? . . DCCA 71 LYS C 71 LYS CA -3.06 $NMRView ? ? . . DCCA 72 ALA C 72 ALA CA 4.17 $NMRView ? ? . . DCCA 73 ALA C 73 ALA CA -0.91 $NMRView ? ? . . DCCA 76 SER C 76 SER CA 3.02 $NMRView ? ? . . DCCA 77 ALA C 77 ALA CA -1.40 $NMRView ? ? . . DCCA 78 ALA C 78 ALA CA -3.80 $NMRView ? ? . . DCCA 79 GLU C 79 GLU CA 4.77 $NMRView ? ? . . DCCA 80 VAL C 80 VAL CA -0.01 $NMRView ? ? . . DCCA 81 ALA C 81 ALA CA -2.91 $NMRView ? ? . . DCCA 82 LEU C 82 LEU CA -1.84 $NMRView ? ? . . DCCA 83 ARG C 83 ARG CA -0.54 $NMRView ? ? . . DCCA 84 GLU C 84 GLU CA -2.66 $NMRView ? ? . . DCH(i+1) 16 CYS C 17 TYR H -13.26 $NMRView ? ? . . DCH(i+1) 19 PHE C 20 LYS H -10.96 $NMRView ? ? . . DCH(i+1) 20 LYS C 21 SER H -5.81 $NMRView ? ? . . DCH(i+1) 21 SER C 22 ARG H 8.20 $NMRView ? ? . . DCH(i+1) 22 ARG C 23 LEU H 4.24 $NMRView ? ? . . DCH(i+1) 23 LEU C 24 GLN H -12.95 $NMRView ? ? . . DCH(i+1) 24 GLN C 25 GLU H 3.64 $NMRView ? ? . . DCH(i+1) 26 TYR C 27 ALA H -5.83 $NMRView ? ? . . DCH(i+1) 27 ALA C 28 GLN H 3.27 $NMRView ? ? . . DCH(i+1) 28 GLN C 29 LYS H 1.47 $NMRView ? ? . . DCH(i+1) 32 LEU C 33 PRO H 5.51 $NMRView ? ? . . DCH(i+1) 33 PRO C 34 THR H -5.48 $NMRView ? ? . . DCH(i+1) 34 THR C 35 PRO H 8.64 $NMRView ? ? . . DCH(i+1) 35 PRO C 36 VAL H -6.55 $NMRView ? ? . . DCH(i+1) 36 VAL C 37 TYR H 8.48 $NMRView ? ? . . DCH(i+1) 37 TYR C 38 GLU H -2.68 $NMRView ? ? . . DCH(i+1) 38 GLU C 39 ILE H 7.68 $NMRView ? ? . . DCH(i+1) 39 ILE C 40 VAL H 2.29 $NMRView ? ? . . DCH(i+1) 43 GLY C 44 PRO H 3.33 $NMRView ? ? . . DCH(i+1) 44 PRO C 45 SER H 6.76 $NMRView ? ? . . DCH(i+1) 45 SER C 46 HIS H 4.64 $NMRView ? ? . . DCH(i+1) 46 HIS C 47 LYS H 0.61 $NMRView ? ? . . DCH(i+1) 47 LYS C 48 SER H 9.03 $NMRView ? ? . . DCH(i+1) 48 SER C 49 LEU H -7.96 $NMRView ? ? . . DCH(i+1) 49 LEU C 50 PHE H 9.24 $NMRView ? ? . . DCH(i+1) 50 PHE C 51 GLN H -6.74 $NMRView ? ? . . DCH(i+1) 51 GLN C 52 SER H 7.65 $NMRView ? ? . . DCH(i+1) 52 SER C 53 THR H -0.23 $NMRView ? ? . . DCH(i+1) 53 THR C 54 VAL H 9.67 $NMRView ? ? . . DCH(i+1) 54 VAL C 55 ILE H -10.12 $NMRView ? ? . . DCH(i+1) 55 ILE C 56 LEU H 5.96 $NMRView ? ? . . DCH(i+1) 56 LEU C 57 ASP H 5.46 $NMRView ? ? . . DCH(i+1) 57 ASP C 58 GLY H 4.23 $NMRView ? ? . . DCH(i+1) 58 GLY C 59 VAL H 7.25 $NMRView ? ? . . DCH(i+1) 59 VAL C 60 ARG H -5.01 $NMRView ? ? . . DCH(i+1) 63 SER C 64 LEU H 4.74 $NMRView ? ? . . DCH(i+1) 64 LEU C 65 PRO H 5.70 $NMRView ? ? . . DCH(i+1) 65 PRO C 66 GLY H -15.70 $NMRView ? ? . . DCH(i+1) 66 GLY C 67 PHE H 6.30 $NMRView ? ? . . DCH(i+1) 67 PHE C 68 PHE H 2.21 $NMRView ? ? . . DCH(i+1) 68 PHE C 69 ASN H -8.39 $NMRView ? ? . . DCH(i+1) 69 ASN C 70 ARG H -5.44 $NMRView ? ? . . DCH(i+1) 70 ARG C 71 LYS H 4.19 $NMRView ? ? . . DCH(i+1) 71 LYS C 72 ALA H -5.12 $NMRView ? ? . . DCH(i+1) 72 ALA C 73 ALA H -8.36 $NMRView ? ? . . DCH(i+1) 73 ALA C 74 GLU H -0.56 $NMRView ? ? . . DCH(i+1) 76 SER C 77 ALA H -5.79 $NMRView ? ? . . DCH(i+1) 77 ALA C 78 ALA H 3.07 $NMRView ? ? . . DCH(i+1) 78 ALA C 79 GLU H 1.12 $NMRView ? ? . . DCH(i+1) 79 GLU C 80 VAL H -10.99 $NMRView ? ? . . DCH(i+1) 80 VAL C 81 ALA H -1.57 $NMRView ? ? . . DCH(i+1) 81 ALA C 82 LEU H 4.71 $NMRView ? ? . . DCH(i+1) 83 ARG C 84 GLU H -3.95 $NMRView ? ? . . DCH(i+1) 84 GLU C 85 LEU H 3.72 $NMRView ? ? . . DCH(i+1) 85 LEU C 86 ALA H 0.42 $NMRView ? ? . . DHCA(i-1) 17 TYR H 16 CYS CA -0.07 $NMRView ? ? . . DHCA(i-1) 20 LYS H 19 PHE CA 6.36 $NMRView ? ? . . DHCA(i-1) 21 SER H 20 LYS CA -4.48 $NMRView ? ? . . DHCA(i-1) 22 ARG H 21 SER CA -0.89 $NMRView ? ? . . DHCA(i-1) 23 LEU H 22 ARG CA -2.87 $NMRView ? ? . . DHCA(i-1) 24 GLN H 23 LEU CA -1.56 $NMRView ? ? . . DHCA(i-1) 25 GLU H 24 GLN CA -2.59 $NMRView ? ? . . DHCA(i-1) 27 ALA H 26 TYR CA -4.74 $NMRView ? ? . . DHCA(i-1) 28 GLN H 27 ALA CA -1.21 $NMRView ? ? . . DHCA(i-1) 29 LYS H 28 GLN CA 2.98 $NMRView ? ? . . DHCA(i-1) 33 PRO H 32 LEU CA 0.31 $NMRView ? ? . . DHCA(i-1) 34 THR H 33 PRO CA 4.72 $NMRView ? ? . . DHCA(i-1) 35 PRO H 34 THR CA -1.32 $NMRView ? ? . . DHCA(i-1) 36 VAL H 35 PRO CA 5.56 $NMRView ? ? . . DHCA(i-1) 37 TYR H 36 VAL CA -2.03 $NMRView ? ? . . DHCA(i-1) 38 GLU H 37 TYR CA 4.85 $NMRView ? ? . . DHCA(i-1) 39 ILE H 38 GLU CA -2.58 $NMRView ? ? . . DHCA(i-1) 40 VAL H 39 ILE CA 2.56 $NMRView ? ? . . DHCA(i-1) 44 PRO H 43 GLY CA 0.98 $NMRView ? ? . . DHCA(i-1) 45 SER H 44 PRO CA 0.72 $NMRView ? ? . . DHCA(i-1) 46 HIS H 45 SER CA 0.77 $NMRView ? ? . . DHCA(i-1) 47 LYS H 46 HIS CA 6.54 $NMRView ? ? . . DHCA(i-1) 48 SER H 47 LYS CA -3.14 $NMRView ? ? . . DHCA(i-1) 49 LEU H 48 SER CA 7.47 $NMRView ? ? . . DHCA(i-1) 50 PHE H 49 LEU CA -2.18 $NMRView ? ? . . DHCA(i-1) 51 GLN H 50 PHE CA 7.35 $NMRView ? ? . . DHCA(i-1) 52 SER H 51 GLN CA -2.78 $NMRView ? ? . . DHCA(i-1) 53 THR H 52 SER CA 7.66 $NMRView ? ? . . DHCA(i-1) 54 VAL H 53 THR CA -2.04 $NMRView ? ? . . DHCA(i-1) 55 ILE H 54 VAL CA 6.20 $NMRView ? ? . . DHCA(i-1) 56 LEU H 55 ILE CA -2.42 $NMRView ? ? . . DHCA(i-1) 57 ASP H 56 LEU CA 2.56 $NMRView ? ? . . DHCA(i-1) 58 GLY H 57 ASP CA -0.11 $NMRView ? ? . . DHCA(i-1) 59 VAL H 58 GLY CA -1.29 $NMRView ? ? . . DHCA(i-1) 60 ARG H 59 VAL CA 1.64 $NMRView ? ? . . DHCA(i-1) 63 SER H 62 ASN CA 9.91 $NMRView ? ? . . DHCA(i-1) 64 LEU H 63 SER CA -5.72 $NMRView ? ? . . DHCA(i-1) 65 PRO H 64 LEU CA -0.29 $NMRView ? ? . . DHCA(i-1) 66 GLY H 65 PRO CA 2.98 $NMRView ? ? . . DHCA(i-1) 67 PHE H 66 GLY CA -3.32 $NMRView ? ? . . DHCA(i-1) 68 PHE H 67 PHE CA -2.48 $NMRView ? ? . . DHCA(i-1) 69 ASN H 68 PHE CA -4.49 $NMRView ? ? . . DHCA(i-1) 70 ARG H 69 ASN CA 0.92 $NMRView ? ? . . DHCA(i-1) 71 LYS H 70 ARG CA -3.07 $NMRView ? ? . . DHCA(i-1) 72 ALA H 71 LYS CA -7.45 $NMRView ? ? . . DHCA(i-1) 73 ALA H 72 ALA CA -0.65 $NMRView ? ? . . DHCA(i-1) 74 GLU H 73 ALA CA -1.28 $NMRView ? ? . . DHCA(i-1) 77 ALA H 76 SER CA -0.45 $NMRView ? ? . . DHCA(i-1) 78 ALA H 77 ALA CA -5.58 $NMRView ? ? . . DHCA(i-1) 79 GLU H 78 ALA CA -1.67 $NMRView ? ? . . DHCA(i-1) 80 VAL H 79 GLU CA -1.31 $NMRView ? ? . . DHCA(i-1) 81 ALA H 80 VAL CA -1.67 $NMRView ? ? . . DHCA(i-1) 82 LEU H 81 ALA CA -5.30 $NMRView ? ? . . DHCA(i-1) 83 ARG H 82 LEU CA -3.49 $NMRView ? ? . . DHCA(i-1) 84 GLU H 83 ARG CA -1.12 $NMRView ? ? . . DHCA(i-1) 85 LEU H 84 GLU CA -3.11 $NMRView ? ? . . DHHA(i-1) 21 SER H 20 LYS HA -9.33 $NMRView ? ? . . DHHA(i-1) 22 ARG H 21 SER HA -12.18 $NMRView ? ? . . DHHA(i-1) 23 LEU H 22 ARG HA 46.36 $NMRView ? ? . . DHHA(i-1) 23 LEU H 22 ARG HA 7.83 $NMRView ? ? . . DHHA(i-1) 24 GLN H 23 LEU HA 2.53 $NMRView ? ? . . DHHA(i-1) 27 ALA H 26 TYR HA -1.87 $NMRView ? ? . . DHHA(i-1) 28 GLN H 27 ALA HA -2.67 $NMRView ? ? . . DHHA(i-1) 29 LYS H 28 GLN HA 0.25 $NMRView ? ? . . DHHA(i-1) 33 PRO H 32 LEU HA 24.11 $NMRView ? ? . . DHHA(i-1) 34 THR H 33 PRO HA 12.00 $NMRView ? ? . . DHHA(i-1) 35 PRO H 34 THR HA 11.73 $NMRView ? ? . . DHHA(i-1) 36 VAL H 35 PRO HA 18.59 $NMRView ? ? . . DHHA(i-1) 37 TYR H 36 VAL HA -2.12 $NMRView ? ? . . DHHA(i-1) 38 GLU H 37 TYR HA 31.99 $NMRView ? ? . . DHHA(i-1) 39 ILE H 38 GLU HA -0.20 $NMRView ? ? . . DHHA(i-1) 40 VAL H 39 ILE HA 14.07 $NMRView ? ? . . DHHA(i-1) 44 PRO H 43 GLY HA 1.26 $NMRView ? ? . . DHHA(i-1) 45 SER H 44 PRO HA -3.40 $NMRView ? ? . . DHHA(i-1) 48 SER H 47 LYS HA 14.07 $NMRView ? ? . . DHHA(i-1) 50 PHE H 49 LEU HA 19.61 $NMRView ? ? . . DHHA(i-1) 52 SER H 51 GLN HA 2.06 $NMRView ? ? . . DHHA(i-1) 54 VAL H 53 THR HA 3.44 $NMRView ? ? . . DHHA(i-1) 55 ILE H 54 VAL HA 9.09 $NMRView ? ? . . DHHA(i-1) 57 ASP H 56 LEU HA 22.51 $NMRView ? ? . . DHHA(i-1) 58 GLY H 57 ASP HA 0.15 $NMRView ? ? . . DHHA(i-1) 59 VAL H 58 GLY HA 27.28 $NMRView ? ? . . DHHA(i-1) 60 ARG H 59 VAL HA 1.47 $NMRView ? ? . . DHHA(i-1) 65 PRO H 64 LEU HA 23.53 $NMRView ? ? . . DHHA(i-1) 66 GLY H 65 PRO HA 16.21 $NMRView ? ? . . DHHA(i-1) 74 GLU H 73 ALA HA -2.32 $NMRView ? ? . . DHHA(i-1) 78 ALA H 77 ALA HA 0.77 $NMRView ? ? . . DHHA(i-1) 81 ALA H 80 VAL HA -7.36 $NMRView ? ? . . DHHA(i-1) 83 ARG H 82 LEU HA -0.36 $NMRView ? ? . . DHHA(i-1) 84 GLU H 83 ARG HA -3.53 $NMRView ? ? . . DHHA(i-1) 85 LEU H 84 GLU HA -1.19 $NMRView ? ? . . DHHA(i-1) 86 ALA H 85 LEU HA 2.79 $NMRView ? ? . . DHN 16 CYS H 16 CYS N -24.44 $NMRView ? ? . . DHN 17 TYR H 17 TYR N -22.31 $NMRView ? ? . . DHN 20 LYS H 20 LYS N -33.31 $NMRView ? ? . . DHN 21 SER H 21 SER N -12.33 $NMRView ? ? . . DHN 22 ARG H 22 ARG N -0.54 $NMRView ? ? . . DHN 23 LEU H 23 LEU N -23.98 $NMRView ? ? . . DHN 24 GLN H 24 GLN N -31.82 $NMRView ? ? . . DHN 25 GLU H 25 GLU N -6.34 $NMRView ? ? . . DHN 27 ALA H 27 ALA N -32.36 $NMRView ? ? . . DHN 28 GLN H 28 GLN N 14.11 $NMRView ? ? . . DHN 29 LYS H 29 LYS N 20.80 $NMRView ? ? . . DHN 33 PRO H 33 PRO N 3.58 $NMRView ? ? . . DHN 34 THR H 34 THR N 17.02 $NMRView ? ? . . DHN 35 PRO H 35 PRO N 1.84 $NMRView ? ? . . DHN 36 VAL H 36 VAL N 19.27 $NMRView ? ? . . DHN 37 TYR H 37 TYR N 14.45 $NMRView ? ? . . DHN 38 GLU H 38 GLU N 21.97 $NMRView ? ? . . DHN 39 ILE H 39 ILE N 17.29 $NMRView ? ? . . DHN 40 VAL H 40 VAL N 19.84 $NMRView ? ? . . DHN 44 PRO H 44 PRO N 18.86 $NMRView ? ? . . DHN 45 SER H 45 SER N 14.87 $NMRView ? ? . . DHN 46 HIS H 46 HIS N 17.32 $NMRView ? ? . . DHN 47 LYS H 47 LYS N 23.40 $NMRView ? ? . . DHN 48 SER H 48 SER N 16.31 $NMRView ? ? . . DHN 49 LEU H 49 LEU N 14.02 $NMRView ? ? . . DHN 50 PHE H 50 PHE N 6.85 $NMRView ? ? . . DHN 51 GLN H 51 GLN N 14.60 $NMRView ? ? . . DHN 52 SER H 52 SER N 6.40 $NMRView ? ? . . DHN 53 THR H 53 THR N 22.00 $NMRView ? ? . . DHN 54 VAL H 54 VAL N 14.75 $NMRView ? ? . . DHN 55 ILE H 55 ILE N -1.75 $NMRView ? ? . . DHN 56 LEU H 56 LEU N 12.41 $NMRView ? ? . . DHN 57 ASP H 57 ASP N 16.86 $NMRView ? ? . . DHN 58 GLY H 58 GLY N 19.63 $NMRView ? ? . . DHN 59 VAL H 59 VAL N 1.00 $NMRView ? ? . . DHN 60 ARG H 60 ARG N 6.96 $NMRView ? ? . . DHN 63 SER H 63 SER N 17.52 $NMRView ? ? . . DHN 64 LEU H 64 LEU N 12.54 $NMRView ? ? . . DHN 65 PRO H 65 PRO N 8.43 $NMRView ? ? . . DHN 66 GLY H 66 GLY N -18.76 $NMRView ? ? . . DHN 67 PHE H 67 PHE N -26.28 $NMRView ? ? . . DHN 68 PHE H 68 PHE N -29.46 $NMRView ? ? . . DHN 71 LYS H 71 LYS N -23.88 $NMRView ? ? . . DHN 72 ALA H 72 ALA N -38.27 $NMRView ? ? . . DHN 73 ALA H 73 ALA N -43.39 $NMRView ? ? . . DHN 77 ALA H 77 ALA N -36.51 $NMRView ? ? . . DHN 78 ALA H 78 ALA N -28.02 $NMRView ? ? . . DHN 79 GLU H 79 GLU N -35.59 $NMRView ? ? . . DHN 81 ALA H 81 ALA N -29.45 $NMRView ? ? . . DHN 82 LEU H 82 LEU N -28.75 $NMRView ? ? . . DHN 83 ARG H 83 ARG N -35.08 $NMRView ? ? . . DHN 84 GLU H 84 GLU N -28.16 $NMRView ? ? . . DHN 85 LEU H 85 LEU N -12.73 $NMRView ? ? . . stop_ _Details . _Sample_conditions_label $sample_conditions_1 _Spectrometer_frequency_1H 600 _Text_data_format . _Text_data . save_