data_nef_c30254_5uzf save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 30253 BMRB 30255 PDB 5UZF stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 DC start . . 2 A 2 DG middle . . 3 A 3 DA middle . . 4 A 4 DT middle . . 5 A 5 DT middle . . 6 A 6 DT middle . . 7 A 7 DT middle . . 8 A 8 DT middle . . 9 A 9 DT middle . . 10 A 10 DG middle . . 11 A 11 DG middle . . 12 A 12 DC end . . 13 B 13 DG start . . 14 B 14 DC middle . . 15 B 15 DC middle . . 16 B 16 DA middle . . 17 B 17 DA middle . . 18 B 18 DA middle . . 19 B 19 DA middle . . 20 B 20 DA middle . . 21 B 21 DA middle . . 22 B 22 DT middle . . 23 B 23 DC middle . . 24 B 24 DG end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 DC H1' H 1 5.67 0.04 A 1 DC H2' H 1 2.32 0.04 A 1 DC H2'' H 1 1.8 0.04 A 1 DC H4' H 1 4.01 0.04 A 1 DC H5 H 1 5.85 0.04 A 1 DC H6 H 1 7.56 0.04 A 1 DC C1' C 13 87.9 0.2 A 1 DC C2' C 13 40 0.2 A 1 DC C4' C 13 88.3 0.2 A 1 DC C5 C 13 99.8 0.2 A 1 DC C6 C 13 143.1 0.2 A 2 DG H1 H 1 12.82 0.04 A 2 DG H1' H 1 5.49 0.04 A 2 DG H2' H 1 2.78 0.04 A 2 DG H2'' H 1 2.69 0.04 A 2 DG H4' H 1 4.3 0.04 A 2 DG H8 H 1 7.91 0.04 A 2 DG C1' C 13 84 0.2 A 2 DG C2' C 13 39.9 0.2 A 2 DG C4' C 13 87.4 0.2 A 2 DG C8 C 13 138.2 0.2 A 2 DG N1 N 15 147.3 0.2 A 2 DG P P 31 -0.39 0.04 A 3 DA H1' H 1 6.3 0.04 A 3 DA H2 H 1 7.83 0.04 A 3 DA H2' H 1 2.97 0.04 A 3 DA H2'' H 1 2.68 0.04 A 3 DA H4' H 1 4.49 0.04 A 3 DA H8 H 1 8.24 0.04 A 3 DA C1' C 13 85 0.2 A 3 DA C2 C 13 155 0.2 A 3 DA C2' C 13 41.3 0.2 A 3 DA C4' C 13 87.8 0.2 A 3 DA C8 C 13 141.5 0.2 A 3 DA P P 31 -0.45 0.04 A 4 DT H1' H 1 5.94 0.04 A 4 DT H2' H 1 2.6 0.04 A 4 DT H2'' H 1 2.02 0.04 A 4 DT H3 H 1 13.77 0.04 A 4 DT H4' H 1 4.21 0.04 A 4 DT H6 H 1 7.14 0.04 A 4 DT H7% H 1 1.34 0.04 A 4 DT C1' C 13 84.8 0.2 A 4 DT C2' C 13 39.1 0.2 A 4 DT C4' C 13 85.4 0.2 A 4 DT C6 C 13 138.4 0.2 A 4 DT C7 C 13 14 0.2 A 4 DT N3 N 15 159.3 0.2 A 4 DT P P 31 -0.85 0.04 A 5 DT H1' H 1 6.17 0.04 A 5 DT H2' H 1 2.65 0.04 A 5 DT H2'' H 1 2.23 0.04 A 5 DT H3 H 1 14.06 0.04 A 5 DT H4' H 1 4.24 0.04 A 5 DT H6 H 1 7.42 0.04 A 5 DT H7% H 1 1.51 0.04 A 5 DT C1' C 13 85.3 0.2 A 5 DT C2' C 13 39 0.2 A 5 DT C4' C 13 85.9 0.2 A 5 DT C6 C 13 140.2 0.2 A 5 DT C7 C 13 14.4 0.2 A 5 DT N3 N 15 159.9 0.2 A 5 DT P P 31 -0.78 0.04 A 6 DT H1' H 1 6.17 0.04 A 6 DT H2' H 1 2.64 0.04 A 6 DT H2'' H 1 2.22 0.04 A 6 DT H3 H 1 13.99 0.04 A 6 DT H4' H 1 4.21 0.04 A 6 DT H6 H 1 7.44 0.04 A 6 DT H7% H 1 1.59 0.04 A 6 DT C1' C 13 85.2 0.2 A 6 DT C2' C 13 39 0.2 A 6 DT C4' C 13 86 0.2 A 6 DT C6 C 13 140.3 0.2 A 6 DT C7 C 13 14.4 0.2 A 6 DT N3 N 15 159.9 0.2 A 6 DT P P 31 -0.84 0.04 A 7 DT H1' H 1 6.13 0.04 A 7 DT H2' H 1 2.67 0.04 A 7 DT H2'' H 1 2.2 0.04 A 7 DT H3 H 1 13.82 0.04 A 7 DT H4' H 1 4.23 0.04 A 7 DT H6 H 1 7.43 0.04 A 7 DT H7% H 1 1.57 0.04 A 7 DT C1' C 13 85.2 0.2 A 7 DT C2' C 13 39 0.2 A 7 DT C4' C 13 86 0.2 A 7 DT C6 C 13 140.2 0.2 A 7 DT C7 C 13 14.4 0.2 A 7 DT N3 N 15 159.6 0.2 A 7 DT P P 31 -0.73 0.04 A 8 DT H1' H 1 6.06 0.04 A 8 DT H2' H 1 2.59 0.04 A 8 DT H2'' H 1 2.11 0.04 A 8 DT H3 H 1 13.77 0.04 A 8 DT H4' H 1 4.18 0.04 A 8 DT H6 H 1 7.42 0.04 A 8 DT H7% H 1 1.61 0.04 A 8 DT C1' C 13 85.2 0.2 A 8 DT C2' C 13 38.8 0.2 A 8 DT C4' C 13 85.8 0.2 A 8 DT C6 C 13 140.2 0.2 A 8 DT C7 C 13 14.5 0.2 A 8 DT N3 N 15 159.4 0.2 A 8 DT P P 31 -0.7 0.04 A 9 DT H1' H 1 5.74 0.04 A 9 DT H2' H 1 2.36 0.04 A 9 DT H2'' H 1 1.97 0.04 A 9 DT H3 H 1 13.74 0.04 A 9 DT H4' H 1 4.08 0.04 A 9 DT H6 H 1 7.23 0.04 A 9 DT H7% H 1 1.64 0.04 A 9 DT C1' C 13 85 0.2 A 9 DT C2' C 13 39.1 0.2 A 9 DT C4' C 13 85.3 0.2 A 9 DT C6 C 13 139.6 0.2 A 9 DT C7 C 13 14.6 0.2 A 9 DT N3 N 15 159.1 0.2 A 9 DT P P 31 -0.7 0.04 A 10 DG H1 H 1 12.84 0.04 A 10 DG H1' H 1 5.57 0.04 A 10 DG H2' H 1 2.68 0.04 A 10 DG H4' H 1 4.31 0.04 A 10 DG H8 H 1 7.84 0.04 A 10 DG C1' C 13 84.1 0.2 A 10 DG C2' C 13 40.2 0.2 A 10 DG C4' C 13 87.7 0.2 A 10 DG C8 C 13 138.5 0.2 A 10 DG N1 N 15 147.2 0.2 A 10 DG P P 31 -0.48 0.04 A 11 DG H1 H 1 13.06 0.04 A 11 DG H1' H 1 5.94 0.04 A 11 DG H2' H 1 2.69 0.04 A 11 DG H2'' H 1 2.51 0.04 A 11 DG H4' H 1 4.34 0.04 A 11 DG H8 H 1 7.73 0.04 A 11 DG C1' C 13 84.9 0.2 A 11 DG C2' C 13 41.1 0.2 A 11 DG C4' C 13 86.9 0.2 A 11 DG C8 C 13 137.5 0.2 A 11 DG N1 N 15 147.4 0.2 A 11 DG P P 31 -0.22 0.04 A 12 DC H1' H 1 6.15 0.04 A 12 DC H2' H 1 2.14 0.04 A 12 DC H4' H 1 3.99 0.04 A 12 DC H5 H 1 5.41 0.04 A 12 DC H6 H 1 7.41 0.04 A 12 DC C1' C 13 86.5 0.2 A 12 DC C2' C 13 41.6 0.2 A 12 DC C4' C 13 86.6 0.2 A 12 DC C5 C 13 98.5 0.2 A 12 DC C6 C 13 143.2 0.2 A 12 DC P P 31 -0.41 0.04 B 13 DG H1' H 1 5.97 0.04 B 13 DG H2' H 1 2.75 0.04 B 13 DG H2'' H 1 2.62 0.04 B 13 DG H4' H 1 4.22 0.04 B 13 DG H8 H 1 7.95 0.04 B 13 DG C1' C 13 85.3 0.2 B 13 DG C2' C 13 40.3 0.2 B 13 DG C4' C 13 89.1 0.2 B 13 DG C8 C 13 138.8 0.2 B 14 DC H1' H 1 6.02 0.04 B 14 DC H2' H 1 2.43 0.04 B 14 DC H2'' H 1 2.08 0.04 B 14 DC H4' H 1 4.2 0.04 B 14 DC H5 H 1 5.37 0.04 B 14 DC H6 H 1 7.44 0.04 B 14 DC C1' C 13 86.7 0.2 B 14 DC C2' C 13 39.7 0.2 B 14 DC C4' C 13 86.1 0.2 B 14 DC C5 C 13 98.9 0.2 B 14 DC C6 C 13 142.8 0.2 B 14 DC P P 31 -0.61 0.04 B 15 DC H1' H 1 5.24 0.04 B 15 DC H2' H 1 2.18 0.04 B 15 DC H2'' H 1 1.9 0.04 B 15 DC H4' H 1 4.01 0.04 B 15 DC H5 H 1 5.61 0.04 B 15 DC H6 H 1 7.41 0.04 B 15 DC C1' C 13 86.3 0.2 B 15 DC C2' C 13 39.3 0.2 B 15 DC C4' C 13 85.7 0.2 B 15 DC C5 C 13 99 0.2 B 15 DC C6 C 13 143.2 0.2 B 15 DC P P 31 -0.54 0.04 B 16 DA H1' H 1 5.68 0.04 B 16 DA H2 H 1 7.18 0.04 B 16 DA H2' H 1 2.75 0.04 B 16 DA H2'' H 1 2.67 0.04 B 16 DA H4' H 1 4.33 0.04 B 16 DA H8 H 1 8.15 0.04 B 16 DA C1' C 13 84.5 0.2 B 16 DA C2 C 13 154.2 0.2 B 16 DA C2' C 13 40.1 0.2 B 16 DA C4' C 13 87.1 0.2 B 16 DA C8 C 13 141.5 0.2 B 16 DA P P 31 -0.24 0.04 B 17 DA H1' H 1 5.66 0.04 B 17 DA H2 H 1 6.95 0.04 B 17 DA H2' H 1 2.72 0.04 B 17 DA H2'' H 1 2.51 0.04 B 17 DA H4' H 1 4.34 0.04 B 17 DA H8 H 1 8.02 0.04 B 17 DA C1' C 13 84 0.2 B 17 DA C2 C 13 153.7 0.2 B 17 DA C2' C 13 40.8 0.2 B 17 DA C4' C 13 87.1 0.2 B 17 DA C8 C 13 140.9 0.2 B 17 DA P P 31 -0.62 0.04 B 18 DA H1' H 1 5.71 0.04 B 18 DA H2 H 1 6.87 0.04 B 18 DA H2' H 1 2.77 0.04 B 18 DA H2'' H 1 2.46 0.04 B 18 DA H4' H 1 4.35 0.04 B 18 DA H8 H 1 7.93 0.04 B 18 DA C1' C 13 84.2 0.2 B 18 DA C2 C 13 153.5 0.2 B 18 DA C2' C 13 41.3 0.2 B 18 DA C4' C 13 87.1 0.2 B 18 DA C8 C 13 140.9 0.2 B 18 DA P P 31 -0.64 0.04 B 19 DA H1' H 1 5.8 0.04 B 19 DA H2 H 1 6.88 0.04 B 19 DA H2' H 1 2.86 0.04 B 19 DA H2'' H 1 2.44 0.04 B 19 DA H4' H 1 4.36 0.04 B 19 DA H8 H 1 7.88 0.04 B 19 DA C1' C 13 84.2 0.2 B 19 DA C2 C 13 153.4 0.2 B 19 DA C2' C 13 41.7 0.2 B 19 DA C4' C 13 87 0.2 B 19 DA C8 C 13 140.8 0.2 B 19 DA P P 31 -0.74 0.04 B 20 DA H1' H 1 5.87 0.04 B 20 DA H2 H 1 6.97 0.04 B 20 DA H2' H 1 2.88 0.04 B 20 DA H2'' H 1 2.46 0.04 B 20 DA H4' H 1 4.41 0.04 B 20 DA H8 H 1 7.86 0.04 B 20 DA C1' C 13 84 0.2 B 20 DA C2 C 13 153.3 0.2 B 20 DA C2' C 13 41.9 0.2 B 20 DA C4' C 13 86.8 0.2 B 20 DA C8 C 13 140.7 0.2 B 20 DA P P 31 -0.78 0.04 B 21 DA H1' H 1 6.05 0.04 B 21 DA H2 H 1 7.61 0.04 B 21 DA H2' H 1 2.86 0.04 B 21 DA H2'' H 1 2.43 0.04 B 21 DA H4' H 1 4.43 0.04 B 21 DA H8 H 1 7.93 0.04 B 21 DA C1' C 13 84.6 0.2 B 21 DA C2 C 13 154.5 0.2 B 21 DA C2' C 13 41.9 0.2 B 21 DA C4' C 13 86.8 0.2 B 21 DA C8 C 13 141 0.2 B 21 DA P P 31 -0.7 0.04 B 22 DT H1' H 1 5.89 0.04 B 22 DT H2' H 1 2.42 0.04 B 22 DT H2'' H 1 1.91 0.04 B 22 DT H3 H 1 13.61 0.04 B 22 DT H4' H 1 4.18 0.04 B 22 DT H6 H 1 7.02 0.04 B 22 DT H7% H 1 1.16 0.04 B 22 DT C1' C 13 84.9 0.2 B 22 DT C2' C 13 39.5 0.2 B 22 DT C4' C 13 85.1 0.2 B 22 DT C6 C 13 138.5 0.2 B 22 DT C7 C 13 13.9 0.2 B 22 DT N3 N 15 159.3 0.2 B 22 DT P P 31 -0.76 0.04 B 23 DC H1' H 1 5.71 0.04 B 23 DC H2' H 1 2.35 0.04 B 23 DC H2'' H 1 1.97 0.04 B 23 DC H4' H 1 4.1 0.04 B 23 DC H5 H 1 5.57 0.04 B 23 DC H6 H 1 7.41 0.04 B 23 DC C1' C 13 86.4 0.2 B 23 DC C2' C 13 39.5 0.2 B 23 DC C4' C 13 85.5 0.2 B 23 DC C5 C 13 98.7 0.2 B 23 DC C6 C 13 143.8 0.2 B 23 DC P P 31 -0.58 0.04 B 24 DG H1' H 1 6.14 0.04 B 24 DG H2' H 1 2.59 0.04 B 24 DG H2'' H 1 2.34 0.04 B 24 DG H4' H 1 4.17 0.04 B 24 DG H8 H 1 7.91 0.04 B 24 DG C1' C 13 84.7 0.2 B 24 DG C2' C 13 41.9 0.2 B 24 DG C4' C 13 88.1 0.2 B 24 DG C8 C 13 139.3 0.2 B 24 DG P P 31 -0.21 0.04 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 1 DC H1' A 1 DC H6 1.0 2.90 3.92 2 2 A 1 DC H1' A 2 DG H8 1.0 3.75 5.07 3 3 A 1 DC H1' A 1 DC H2'' 1.0 2.46 4.12 4 4 A 1 DC H6 A 1 DC H2'' 1.0 3.03 4.09 5 5 A 2 DG H8 A 1 DC H2'' 1.0 2.43 3.29 6 6 A 1 DC H1' A 1 DC H2' 1.0 2.89 3.91 7 7 A 1 DC H2' A 1 DC H5 1.0 3.87 5.23 8 8 A 1 DC H6 A 1 DC H2' 1.0 2.15 2.91 9 9 A 2 DG H8 A 1 DC H2' 1.0 2.58 3.48 10 10 A 1 DC H1' A 1 DC H4' 1.0 2.96 4.00 11 11 A 1 DC H6 A 1 DC H5 1.0 2.12 2.88 12 12 A 1 DC H6 A 2 DG H8 1.0 3.61 4.89 13 13 A 2 DG H8 A 2 DG H1' 1.0 3.14 4.24 14 14 A 2 DG H1' A 3 DA H8 1.0 2.58 3.50 15 15 A 2 DG H1' A 2 DG H2'' 1.0 2.29 3.11 16 16 A 2 DG H8 A 2 DG H2'' 1.0 1.99 3.67 17 17 A 3 DA H8 A 2 DG H2'' 1.0 2.24 3.02 18 18 A 2 DG H1' A 2 DG H2' 1.0 3.10 4.20 19 19 A 2 DG H8 A 2 DG H2' 1.0 1.92 2.60 20 20 A 3 DA H8 A 2 DG H2' 1.0 1.61 2.97 21 21 A 2 DG H1' A 2 DG H4' 1.0 3.19 4.31 22 22 A 2 DG H8 A 3 DA H8 1.0 3.83 5.17 23 23 A 3 DA H8 A 3 DA H1' 1.0 3.01 4.07 24 24 A 3 DA H1' A 4 DT H6 1.0 2.69 3.63 25 25 A 3 DA H1' A 3 DA H2'' 1.0 2.24 3.02 26 26 A 3 DA H8 A 3 DA H2'' 1.0 2.09 3.89 27 27 A 4 DT H6 A 3 DA H2'' 1.0 2.13 2.87 28 28 A 3 DA H1' A 3 DA H2' 1.0 2.68 3.62 29 29 A 3 DA H8 A 3 DA H2' 1.0 1.96 2.66 30 30 A 4 DT H6 A 3 DA H2' 1.0 2.69 3.63 31 31 A 3 DA H1' A 3 DA H4' 1.0 2.85 3.85 32 32 A 4 DT H6 A 4 DT H1' 1.0 3.06 4.14 33 33 A 4 DT H1' A 5 DT H6 1.0 2.45 4.61 34 34 A 4 DT H1' A 4 DT H2'' 1.0 2.25 3.05 35 35 A 4 DT H6 A 4 DT H2'' 1.0 2.13 3.97 36 36 A 5 DT H6 A 4 DT H2'' 1.0 1.98 2.68 37 37 A 4 DT H1' A 4 DT H2' 1.0 2.58 3.50 38 38 A 4 DT H6 A 4 DT H2' 1.0 1.96 2.66 39 39 A 5 DT H6 A 4 DT H2' 1.0 2.52 3.42 40 40 A 4 DT H1' A 4 DT H4' 1.0 2.43 3.29 41 41 A 3 DA H1' A 4 DT H7% 1.0 4.31 5.83 42 42 A 3 DA H2'' A 4 DT H7% 1.0 3.54 4.78 43 43 A 3 DA H8 A 4 DT H7% 1.0 2.92 3.94 44 44 A 4 DT H6 A 4 DT H7% 1.0 2.46 3.68 45 45 A 3 DA H8 A 4 DT H6 1.0 3.59 4.85 46 46 A 4 DT H6 A 5 DT H6 1.0 4.34 5.88 47 47 A 5 DT H6 A 5 DT H1' 1.0 2.77 3.75 48 48 A 5 DT H1' A 5 DT H2'' 1.0 2.06 2.78 49 49 A 5 DT H6 A 5 DT H2'' 1.0 1.83 3.39 50 50 A 5 DT H1' A 5 DT H2' 1.0 2.37 3.21 51 51 A 5 DT H6 A 5 DT H2' 1.0 1.87 2.53 52 52 A 5 DT H1' A 5 DT H4' 1.0 2.72 3.68 53 53 A 4 DT H1' A 5 DT H7% 1.0 4.43 5.99 54 54 A 4 DT H2'' A 5 DT H7% 1.0 3.37 4.57 55 55 A 4 DT H2' A 5 DT H7% 1.0 2.65 4.50 56 56 A 4 DT H6 A 5 DT H7% 1.0 2.98 4.04 57 57 A 5 DT H6 A 5 DT H7% 1.0 2.44 3.66 58 58 A 6 DT H1' A 6 DT H6 1.0 1.98 3.66 59 59 A 6 DT H1' A 6 DT H4' 1.0 2.72 3.68 60 60 A 5 DT H2'' A 6 DT H7% 1.0 3.09 4.17 61 61 A 5 DT H2' A 6 DT H7% 1.0 3.03 4.09 62 62 A 6 DT H6 A 6 DT H7% 1.0 2.49 3.75 63 63 A 7 DT H1' A 7 DT H6 1.0 2.87 3.89 64 64 A 7 DT H1' A 8 DT H6 1.0 2.75 3.71 65 65 A 7 DT H1' A 7 DT H2'' 1.0 2.22 3.00 66 66 A 7 DT H1' A 7 DT H2' 1.0 2.58 3.48 67 67 A 7 DT H1' A 7 DT H4' 1.0 2.76 3.74 68 68 A 6 DT H1' A 7 DT H7% 1.0 3.85 5.21 69 69 A 6 DT H1' A 7 DT H7% 1.0 3.88 5.26 70 70 A 7 DT H7% A 6 DT H2'' 1.0 3.05 4.38 71 71 A 7 DT H7% A 6 DT H2' 1.0 2.97 4.03 72 72 A 7 DT H6 A 7 DT H7% 1.0 2.47 3.71 73 73 A 8 DT H6 A 8 DT H1' 1.0 3.01 4.07 74 74 A 8 DT H1' A 9 DT H6 1.0 2.84 4.27 75 75 A 8 DT H1' A 8 DT H2'' 1.0 2.17 2.93 76 76 A 9 DT H6 A 8 DT H2'' 1.0 2.17 2.93 77 77 A 8 DT H1' A 8 DT H2' 1.0 2.78 3.76 78 78 A 8 DT H6 A 8 DT H2' 1.0 1.83 2.47 79 79 A 9 DT H6 A 8 DT H2' 1.0 2.67 3.61 80 80 A 8 DT H1' A 8 DT H4' 1.0 2.70 3.66 81 81 A 7 DT H1' A 8 DT H7% 1.0 4.24 5.74 82 82 A 7 DT H2'' A 8 DT H7% 1.0 3.14 4.26 83 83 A 7 DT H2' A 8 DT H7% 1.0 3.12 4.22 84 84 A 8 DT H6 A 8 DT H7% 1.0 2.58 3.99 85 85 A 9 DT H6 A 9 DT H1' 1.0 3.15 4.27 86 86 A 9 DT H1' A 10 DG H8 1.0 3.31 4.47 87 87 A 9 DT H1' A 9 DT H2'' 1.0 2.26 3.06 88 88 A 9 DT H6 A 9 DT H2'' 1.0 2.14 3.98 89 89 A 10 DG H8 A 9 DT H2'' 1.0 2.42 3.28 90 90 A 9 DT H1' A 9 DT H2' 1.0 2.98 4.02 91 91 A 9 DT H6 A 9 DT H2' 1.0 1.93 2.61 92 92 A 10 DG H8 A 9 DT H2' 1.0 2.59 3.51 93 93 A 9 DT H1' A 9 DT H4' 1.0 2.58 3.50 94 94 A 8 DT H1' A 9 DT H7% 1.0 4.56 6.16 95 95 A 8 DT H2'' A 9 DT H7% 1.0 3.59 4.85 96 96 A 8 DT H2' A 9 DT H7% 1.0 3.38 4.58 97 97 A 8 DT H6 A 9 DT H7% 1.0 2.94 3.98 98 98 A 9 DT H6 A 9 DT H7% 1.0 2.46 3.68 99 99 A 8 DT H6 A 9 DT H6 1.0 4.39 5.93 100 100 A 9 DT H6 A 10 DG H8 1.0 3.44 4.66 101 101 A 10 DG H8 A 10 DG H1' 1.0 3.06 4.14 102 102 A 10 DG H1' A 11 DG H8 1.0 1.96 4.06 103 103 A 10 DG H1' A 10 DG H2' 1.0 2.31 3.13 104 104 A 10 DG H8 A 10 DG H2' 1.0 1.66 2.76 105 105 A 11 DG H8 A 10 DG H2' 1.0 1.87 3.47 106 106 A 10 DG H1' A 10 DG H4' 1.0 3.00 4.31 107 107 A 11 DG H8 A 11 DG H1' 1.0 3.01 4.07 108 108 A 11 DG H1' A 12 DC H6 1.0 2.39 4.01 109 109 A 11 DG H1' A 11 DG H2'' 1.0 2.18 2.96 110 110 A 11 DG H8 A 11 DG H2'' 1.0 1.77 4.20 111 111 A 11 DG H2'' A 12 DC H5 1.0 3.34 4.52 112 112 A 12 DC H6 A 11 DG H2'' 1.0 2.33 3.15 113 113 A 11 DG H1' A 11 DG H2' 1.0 2.50 3.38 114 114 A 11 DG H8 A 11 DG H2' 1.0 1.58 2.94 115 115 A 12 DC H5 A 11 DG H2' 1.0 3.18 4.78 116 116 A 12 DC H6 A 11 DG H2' 1.0 2.40 4.00 117 117 A 11 DG H1' A 11 DG H4' 1.0 2.92 3.94 118 118 A 10 DG H8 A 11 DG H8 1.0 3.78 5.12 119 119 A 12 DC H6 A 12 DC H1' 1.0 2.70 3.64 120 120 A 12 DC H1' A 12 DC H2' 1.0 2.13 2.89 121 121 A 12 DC H5 A 12 DC H2' 1.0 3.77 5.11 122 122 A 12 DC H1' A 12 DC H4' 1.0 2.58 3.48 123 123 A 11 DG H8 A 12 DC H5 1.0 2.86 3.88 124 124 A 12 DC H6 A 12 DC H5 1.0 2.00 2.70 125 125 A 11 DG H8 A 12 DC H6 1.0 3.65 4.93 126 126 B 13 DG H1' B 13 DG H8 1.0 2.99 4.05 127 127 B 13 DG H1' B 14 DC H6 1.0 2.85 3.85 128 128 B 13 DG H1' B 13 DG H2'' 1.0 2.10 2.84 129 129 B 13 DG H8 B 13 DG H2'' 1.0 2.42 4.50 130 130 B 13 DG H2'' B 14 DC H5 1.0 3.07 4.15 131 131 B 14 DC H6 B 13 DG H2'' 1.0 2.38 3.22 132 132 B 13 DG H1' B 13 DG H2' 1.0 2.78 3.76 133 133 B 13 DG H8 B 13 DG H2' 1.0 1.64 3.04 134 134 B 14 DC H5 B 13 DG H2' 1.0 3.48 4.70 135 135 B 14 DC H6 B 13 DG H2' 1.0 2.14 3.22 136 136 B 13 DG H1' B 13 DG H4' 1.0 3.23 4.37 137 137 B 14 DC H6 B 14 DC H1' 1.0 3.10 4.20 138 138 B 14 DC H1' B 15 DC H6 1.0 3.21 4.35 139 139 B 14 DC H1' B 14 DC H2'' 1.0 2.26 3.06 140 140 B 14 DC H6 B 14 DC H2'' 1.0 2.19 4.07 141 141 B 14 DC H2'' B 15 DC H5 1.0 3.15 4.27 142 142 B 15 DC H6 B 14 DC H2'' 1.0 2.30 3.10 143 143 B 14 DC H1' B 14 DC H2' 1.0 2.68 3.62 144 144 B 14 DC H5 B 14 DC H2' 1.0 3.80 5.14 145 145 B 14 DC H6 B 14 DC H2' 1.0 1.94 2.62 146 146 B 15 DC H5 B 14 DC H2' 1.0 3.09 4.17 147 147 B 15 DC H6 B 14 DC H2' 1.0 2.62 3.54 148 148 B 14 DC H1' B 14 DC H4' 1.0 2.84 3.84 149 149 B 13 DG H8 B 14 DC H5 1.0 3.14 4.24 150 150 B 14 DC H6 B 14 DC H5 1.0 2.07 2.81 151 151 B 13 DG H8 B 14 DC H6 1.0 3.99 5.39 152 152 B 15 DC H6 B 15 DC H1' 1.0 3.11 4.21 153 153 B 15 DC H1' B 16 DA H8 1.0 3.31 4.49 154 154 B 15 DC H1' B 15 DC H2'' 1.0 2.49 4.15 155 155 B 15 DC H6 B 15 DC H2'' 1.0 2.12 3.92 156 156 B 16 DA H8 B 15 DC H2'' 1.0 2.72 3.68 157 157 B 15 DC H5 B 15 DC H2' 1.0 3.47 4.69 158 158 B 15 DC H6 B 15 DC H2' 1.0 1.95 2.63 159 159 B 16 DA H8 B 15 DC H2' 1.0 2.92 3.96 160 160 B 15 DC H1' B 15 DC H4' 1.0 2.77 3.75 161 161 B 14 DC H6 B 15 DC H5 1.0 3.24 4.38 162 162 B 15 DC H6 B 15 DC H5 1.0 2.38 3.22 163 163 B 15 DC H6 B 16 DA H8 1.0 4.13 5.59 164 164 B 16 DA H8 B 16 DA H1' 1.0 3.31 4.49 165 165 B 16 DA H1' B 17 DA H8 1.0 2.72 3.68 166 166 B 16 DA H1' B 16 DA H2'' 1.0 2.32 3.14 167 167 B 16 DA H8 B 16 DA H2'' 1.0 2.07 3.87 168 168 B 17 DA H8 B 16 DA H2'' 1.0 2.33 3.15 169 169 B 16 DA H1' B 16 DA H2' 1.0 2.69 3.63 170 170 B 16 DA H8 B 16 DA H2' 1.0 1.98 2.68 171 171 B 17 DA H8 B 16 DA H2' 1.0 2.80 3.78 172 172 B 17 DA H8 B 17 DA H1' 1.0 2.78 3.76 173 173 B 17 DA H1' B 18 DA H8 1.0 2.78 3.76 174 174 B 17 DA H2 B 16 DA H2 1.0 2.75 3.71 175 175 B 17 DA H1' B 17 DA H2'' 1.0 2.31 3.13 176 176 B 17 DA H8 B 17 DA H2'' 1.0 2.27 4.19 177 177 B 17 DA H1' B 17 DA H2' 1.0 2.81 3.81 178 178 B 17 DA H8 B 17 DA H2' 1.0 1.97 2.67 179 179 B 18 DA H8 B 17 DA H2' 1.0 2.69 3.63 180 180 B 17 DA H1' B 17 DA H4' 1.0 3.01 4.07 181 181 B 16 DA H8 B 17 DA H8 1.0 3.27 4.43 182 182 B 18 DA H8 B 18 DA H1' 1.0 3.17 4.29 183 183 B 18 DA H1' B 19 DA H8 1.0 2.84 3.84 184 184 B 18 DA H1' B 18 DA H2'' 1.0 2.25 3.05 185 185 B 19 DA H8 B 18 DA H2'' 1.0 2.18 2.94 186 186 B 18 DA H1' B 18 DA H2' 1.0 3.11 4.21 187 187 B 18 DA H8 B 18 DA H2' 1.0 1.94 2.62 188 188 B 18 DA H1' B 18 DA H4' 1.0 3.10 4.20 189 189 B 19 DA H8 B 19 DA H1' 1.0 3.07 4.15 190 190 B 19 DA H1' B 20 DA H8 1.0 2.76 3.74 191 191 B 19 DA H1' B 19 DA H2'' 1.0 2.24 3.04 192 192 B 19 DA H8 B 19 DA H2'' 1.0 2.11 3.91 193 193 B 20 DA H8 B 19 DA H2'' 1.0 2.08 2.82 194 194 B 19 DA H1' B 19 DA H2' 1.0 2.68 3.62 195 195 B 19 DA H8 B 19 DA H2' 1.0 1.99 2.69 196 196 B 20 DA H8 B 19 DA H2' 1.0 2.34 3.16 197 197 B 19 DA H1' B 19 DA H4' 1.0 2.93 3.97 198 198 B 20 DA H8 B 20 DA H1' 1.0 3.18 4.30 199 199 B 20 DA H1' B 21 DA H8 1.0 2.69 3.63 200 200 B 20 DA H2 B 21 DA H2 1.0 2.80 3.80 201 201 B 20 DA H1' B 20 DA H2'' 1.0 2.25 3.05 202 202 B 20 DA H8 B 20 DA H2'' 1.0 2.00 3.74 203 203 B 21 DA H8 B 20 DA H2'' 1.0 2.07 2.79 204 204 B 20 DA H1' B 20 DA H2' 1.0 2.74 3.70 205 205 B 20 DA H8 B 20 DA H2' 1.0 2.02 2.74 206 206 B 20 DA H1' B 20 DA H4' 1.0 2.81 3.79 207 207 B 21 DA H8 B 21 DA H1' 1.0 3.05 4.13 208 208 B 21 DA H1' B 22 DT H6 1.0 2.85 3.85 209 209 B 21 DA H2 A 3 DA H2 1.0 2.58 4.94 210 210 B 21 DA H1' B 21 DA H2'' 1.0 2.25 3.05 211 211 B 21 DA H8 B 21 DA H2'' 1.0 2.03 3.75 212 212 B 22 DT H6 B 21 DA H2'' 1.0 2.11 2.85 213 213 B 21 DA H1' B 21 DA H2' 1.0 2.80 3.78 214 214 B 21 DA H8 B 21 DA H2' 1.0 2.01 2.73 215 215 B 22 DT H6 B 21 DA H2' 1.0 2.39 3.23 216 216 B 21 DA H1' B 21 DA H4' 1.0 2.69 3.63 217 217 B 22 DT H6 B 22 DT H1' 1.0 3.09 4.19 218 218 B 22 DT H1' B 23 DC H6 1.0 3.59 4.85 219 219 B 22 DT H1' B 22 DT H2'' 1.0 2.19 2.97 220 220 B 22 DT H6 B 22 DT H2'' 1.0 2.21 4.09 221 221 B 22 DT H2'' B 23 DC H5 1.0 3.07 4.15 222 222 B 23 DC H6 B 22 DT H2'' 1.0 2.22 3.00 223 223 B 22 DT H1' B 22 DT H2' 1.0 2.81 3.81 224 224 B 22 DT H6 B 22 DT H2' 1.0 1.94 2.72 225 225 B 23 DC H5 B 22 DT H2' 1.0 2.91 4.11 226 226 B 22 DT H1' B 22 DT H4' 1.0 2.67 3.61 227 227 B 21 DA H1' B 22 DT H7% 1.0 4.51 6.11 228 228 B 21 DA H2'' B 22 DT H7% 1.0 3.55 4.89 229 229 B 21 DA H2' B 22 DT H7% 1.0 3.03 4.85 230 230 B 21 DA H8 B 22 DT H7% 1.0 2.97 4.01 231 231 B 22 DT H6 B 22 DT H7% 1.0 2.47 3.71 232 232 B 23 DC H5 B 22 DT H7% 1.0 4.21 5.69 233 233 B 21 DA H8 B 22 DT H6 1.0 3.57 4.83 234 234 B 22 DT H6 B 23 DC H6 1.0 4.39 5.95 235 235 B 23 DC H6 B 23 DC H1' 1.0 3.26 4.42 236 236 B 23 DC H1' B 24 DG H8 1.0 3.20 4.32 237 237 B 23 DC H1' B 23 DC H2'' 1.0 2.11 2.85 238 238 B 23 DC H5 B 23 DC H2'' 1.0 3.66 5.50 239 239 B 23 DC H6 B 23 DC H2'' 1.0 2.69 3.63 240 240 B 24 DG H8 B 23 DC H2'' 1.0 2.24 3.04 241 241 B 23 DC H1' B 23 DC H2' 1.0 3.10 4.20 242 242 B 23 DC H5 B 23 DC H2' 1.0 3.40 4.60 243 243 B 23 DC H6 B 23 DC H2' 1.0 1.96 2.64 244 244 B 24 DG H8 B 23 DC H2' 1.0 2.65 3.59 245 245 B 23 DC H1' B 23 DC H4' 1.0 2.81 3.81 246 246 B 22 DT H6 B 23 DC H5 1.0 3.09 4.19 247 247 B 23 DC H6 B 23 DC H5 1.0 2.01 2.73 248 248 B 23 DC H6 B 24 DG H8 1.0 4.01 5.43 249 249 B 24 DG H8 B 24 DG H1' 1.0 2.85 3.85 250 250 B 24 DG H1' B 24 DG H2'' 1.0 2.39 3.23 251 251 B 24 DG H1' B 24 DG H2' 1.0 2.24 3.04 stop_ save_ save_CNS/XPLOR_dipolar_coupling_2 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_2 _nef_rdc_restraint_list.potential_type square-well-parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 2 DG C1' A 2 DG H1' 1.0 23.1 29.1 . 2 2 A 3 DA C1' A 3 DA H1' 1.0 21.5 27.5 . 3 3 A 4 DT C1' A 4 DT H1' 1.0 17.3 23.3 . 4 4 A 5 DT C1' A 5 DT H1' 1.0 31.1 37.1 . 5 5 A 6 DT C1' A 6 DT H1' 1.0 27.3 33.3 . 6 6 A 7 DT C1' A 7 DT H1' 1.0 23.8 29.8 . 7 7 A 8 DT C1' A 8 DT H1' 1.0 25.4 31.4 . 8 8 A 9 DT C1' A 9 DT H1' 1.0 23.4 29.4 . 9 9 A 10 DG C1' A 10 DG H1' 1.0 16.5 22.5 . 10 10 A 11 DG C1' A 11 DG H1' 1.0 17.5 23.5 . 11 11 B 14 DC C1' B 14 DC H1' 1.0 10.0 16.0 . 12 12 B 15 DC C1' B 15 DC H1' 1.0 9.4 15.4 . 13 13 B 16 DA C1' B 16 DA H1' 1.0 24.9 30.9 . 14 14 B 17 DA C1' B 17 DA H1' 1.0 21.4 27.4 . 15 15 B 18 DA C1' B 18 DA H1' 1.0 24.2 30.2 . 16 16 B 19 DA C1' B 19 DA H1' 1.0 24.6 30.6 . 17 17 B 20 DA C1' B 20 DA H1' 1.0 22.7 28.7 . 18 18 B 21 DA C1' B 21 DA H1' 1.0 21.9 27.9 . 19 19 B 22 DT C1' B 22 DT H1' 1.0 26.3 32.3 . 20 20 B 23 DC C1' B 23 DC H1' 1.0 15.7 21.7 . 21 21 A 2 DG C4' A 2 DG H4' 1.0 -2.5 3.5 . 22 22 A 3 DA C4' A 3 DA H4' 1.0 -10.4 -4.4 . 23 23 A 4 DT C4' A 4 DT H4' 1.0 -10.4 -4.4 . 24 24 A 5 DT C4' A 5 DT H4' 1.0 6.0 12.0 . 25 25 A 6 DT C4' A 6 DT H4' 1.0 6.4 12.4 . 26 26 A 7 DT C4' A 7 DT H4' 1.0 7.8 13.8 . 27 27 A 8 DT C4' A 8 DT H4' 1.0 20.5 26.5 . 28 28 A 9 DT C4' A 9 DT H4' 1.0 19.6 25.6 . 29 29 A 10 DG C4' A 10 DG H4' 1.0 16.1 22.1 . 30 30 B 15 DC C4' B 15 DC H4' 1.0 -0.5 5.5 . 31 31 B 16 DA C4' B 16 DA H4' 1.0 -12.6 -6.6 . 32 32 B 17 DA C4' B 17 DA H4' 1.0 -8.0 -2.0 . 33 33 B 18 DA C4' B 18 DA H4' 1.0 -7.0 -1.0 . 34 34 B 19 DA C4' B 19 DA H4' 1.0 -1.8 4.2 . 35 35 B 20 DA C4' B 20 DA H4' 1.0 9.1 15.1 . 36 36 B 21 DA C4' B 21 DA H4' 1.0 13.1 19.1 . 37 37 B 22 DT C4' B 22 DT H4' 1.0 20.9 26.9 . 38 38 B 23 DC C4' B 23 DC H4' 1.0 25.4 31.4 . 39 39 A 2 DG C8 A 2 DG H8 1.0 21.5 27.5 . 40 40 A 3 DA C8 A 3 DA H8 1.0 28.8 34.8 . 41 41 A 4 DT C6 A 4 DT H6 1.0 33.7 39.7 . 42 42 A 6 DT C6 A 6 DT H6 1.0 28.9 34.9 . 43 43 A 7 DT C6 A 7 DT H6 1.0 28.1 34.1 . 44 44 A 8 DT C6 A 8 DT H6 1.0 26.5 32.5 . 45 45 A 9 DT C6 A 9 DT H6 1.0 30.0 36.0 . 46 46 A 10 DG C8 A 10 DG H8 1.0 27.5 33.5 . 47 47 A 11 DG C8 A 11 DG H8 1.0 21.6 27.6 . 48 48 B 14 DC C6 B 14 DC H6 1.0 18.7 24.7 . 49 49 B 15 DC C6 B 15 DC H6 1.0 19.6 25.6 . 50 50 B 16 DA C8 B 16 DA H8 1.0 29.2 35.2 . 51 51 B 17 DA C8 B 17 DA H8 1.0 30.1 36.1 . 52 52 B 18 DA C8 B 18 DA H8 1.0 31.8 37.8 . 53 53 B 19 DA C8 B 19 DA H8 1.0 29.7 35.7 . 54 54 B 20 DA C8 B 20 DA H8 1.0 27.4 33.4 . 55 55 B 21 DA C8 B 21 DA H8 1.0 33.5 39.5 . 56 56 B 22 DT C6 B 22 DT H6 1.0 28.6 34.6 . 57 57 B 23 DC C6 B 23 DC H6 1.0 25.6 31.6 . 58 58 B 14 DC C5 B 14 DC H5 1.0 22.6 28.6 . 59 59 B 15 DC C5 B 15 DC H5 1.0 12.2 18.2 . 60 60 B 23 DC C5 B 23 DC H5 1.0 28.4 34.4 . 61 61 A 3 DA C2 A 3 DA H2 1.0 21.7 27.7 . 62 62 B 16 DA C2 B 16 DA H2 1.0 21.0 27.0 . 63 63 B 17 DA C2 B 17 DA H2 1.0 26.2 32.2 . 64 64 B 18 DA C2 B 18 DA H2 1.0 31.2 37.2 . 65 65 B 19 DA C2 B 19 DA H2 1.0 29.5 35.5 . 66 66 B 20 DA C2 B 20 DA H2 1.0 29.1 35.1 . 67 67 B 21 DA C2 B 21 DA H2 1.0 28.7 34.7 . stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.num_dimensions 2 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.folding 1 ppm 1H 22 . 2 ppm 1H 22 . stop_ save_