data_nef_c34228_6ffr 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 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 6FFR 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 G start . . 2 A 2 DG middle . . 3 A 3 DG middle . . 4 A 4 DA middle . . 5 A 5 DT middle . . 6 A 6 DG middle . . 7 A 7 DG middle . . 8 A 8 DG middle . . 9 A 9 DA middle . . 10 A 10 DC middle . . 11 A 11 DA middle . . 12 A 12 DC middle . . 13 A 13 DA middle . . 14 A 14 DG middle . . 15 A 15 DG middle . . 16 A 16 DG middle . . 17 A 17 DG middle . . 18 A 18 DA middle . . 19 A 19 DC middle . . 20 A 20 G middle . . 21 A 21 DG middle . . 22 A 22 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 G H1 H 1 11.622 0.002 A 1 G H1' H 1 5.858 0.001 A 1 G H2' H 1 4.900 0.001 A 1 G H3' H 1 4.711 0.002 A 1 G H4' H 1 4.479 0.002 A 1 G H8 H 1 8.005 0.001 A 1 G C8 C 13 137.831 . A 2 DG H1 H 1 11.341 0.002 A 2 DG H1' H 1 6.242 0.003 A 2 DG H2' H 1 2.709 0.001 A 2 DG H2'' H 1 2.613 0.005 A 2 DG H3' H 1 4.972 0.002 A 2 DG H4' H 1 4.546 0.001 A 2 DG H8 H 1 7.745 0.001 A 2 DG C8 C 13 137.978 . A 3 DG H1 H 1 11.212 0.001 A 3 DG H1' H 1 6.173 0.004 A 3 DG H2' H 1 2.696 0.005 A 3 DG H2'' H 1 2.594 0.002 A 3 DG H3' H 1 5.008 0.002 A 3 DG H4' H 1 4.164 0.001 A 3 DG H8 H 1 7.658 0.001 A 3 DG C8 C 13 137.490 . A 4 DA H1' H 1 6.604 0.001 A 4 DA H2 H 1 8.316 0.003 A 4 DA H2' H 1 2.921 0.005 A 4 DA H2'' H 1 2.919 0.002 A 4 DA H3' H 1 4.879 0.001 A 4 DA H4' H 1 4.631 0.002 A 4 DA H8 H 1 8.586 0.001 A 4 DA C8 C 13 142.641 . A 5 DT H1' H 1 6.575 0.002 A 5 DT H2' H 1 2.633 0.001 A 5 DT H2'' H 1 2.633 0.001 A 5 DT H3' H 1 5.048 0.002 A 5 DT H4' H 1 4.515 0.002 A 5 DT H6 H 1 7.874 0.001 A 5 DT H7% H 1 2.056 0.001 A 5 DT C6 C 13 140.198 . A 6 DG H1 H 1 11.557 0.001 A 6 DG H1' H 1 6.118 0.002 A 6 DG H2' H 1 2.521 0.001 A 6 DG H2'' H 1 2.982 0.001 A 6 DG H3' H 1 4.987 0.001 A 6 DG H4' H 1 4.441 0.003 A 6 DG H8 H 1 7.964 0.001 A 6 DG C8 C 13 138.326 . A 7 DG H1 H 1 11.408 0.002 A 7 DG H1' H 1 5.952 0.002 A 7 DG H2' H 1 2.702 0.002 A 7 DG H2'' H 1 2.753 0.002 A 7 DG H3' H 1 5.095 0.001 A 7 DG H4' H 1 4.442 0.003 A 7 DG H8 H 1 7.770 0.001 A 7 DG C8 C 13 137.490 . A 8 DG H1 H 1 11.152 0.003 A 8 DG H1' H 1 5.880 0.003 A 8 DG H2' H 1 2.112 0.002 A 8 DG H2'' H 1 2.386 0.001 A 8 DG H3' H 1 4.943 0.002 A 8 DG H4' H 1 4.419 0.004 A 8 DG H8 H 1 7.489 0.001 A 8 DG C8 C 13 136.725 . A 9 DA H1' H 1 6.084 0.002 A 9 DA H2 H 1 7.583 0.002 A 9 DA H2' H 1 2.697 0.005 A 9 DA H2'' H 1 2.565 0.004 A 9 DA H3' H 1 4.966 0.003 A 9 DA H4' H 1 4.425 0.001 A 9 DA H8 H 1 8.078 0.001 A 9 DA C8 C 13 141.729 . A 10 DC H1' H 1 5.844 0.003 A 10 DC H2' H 1 2.156 0.005 A 10 DC H2'' H 1 1.773 0.003 A 10 DC H3' H 1 4.590 0.003 A 10 DC H4' H 1 3.951 0.001 A 10 DC H5 H 1 5.917 . A 10 DC H6 H 1 7.573 0.001 A 10 DC C6 C 13 143.441 . A 11 DA H1' H 1 5.778 0.002 A 11 DA H2 H 1 7.728 0.002 A 11 DA H2' H 1 2.363 0.005 A 11 DA H2'' H 1 2.123 0.004 A 11 DA H3' H 1 4.511 . A 11 DA H4' H 1 3.944 0.007 A 11 DA H8 H 1 7.862 0.001 A 11 DA C8 C 13 141.646 . A 12 DC H1' H 1 5.517 0.003 A 12 DC H2' H 1 1.768 0.01 A 12 DC H2'' H 1 2.021 0.006 A 12 DC H3' H 1 4.374 0.001 A 12 DC H5 H 1 5.263 0.002 A 12 DC H6 H 1 7.089 0.001 A 12 DC C6 C 13 143.928 . A 13 DA H1' H 1 5.756 0.003 A 13 DA H2 H 1 7.786 0.002 A 13 DA H2' H 1 2.275 0.002 A 13 DA H2'' H 1 2.625 0.002 A 13 DA H8 H 1 7.879 0.002 A 13 DA C8 C 13 141.367 . A 14 DG H1 H 1 11.401 0.004 A 14 DG H1' H 1 6.052 0.002 A 14 DG H2' H 1 3.701 0.007 A 14 DG H2'' H 1 3.114 0.001 A 14 DG H3' H 1 4.441 0.001 A 14 DG H8 H 1 7.234 0.001 A 14 DG C8 C 13 141.318 . A 15 DG H1 H 1 11.458 0.002 A 15 DG H1' H 1 5.812 0.005 A 15 DG H2' H 1 2.922 0.004 A 15 DG H2'' H 1 2.802 0.001 A 15 DG H3' H 1 5.037 0.001 A 15 DG H8 H 1 7.339 0.001 A 15 DG C8 C 13 140.692 . A 16 DG H1 H 1 11.036 0.004 A 16 DG H1' H 1 5.867 0.003 A 16 DG H2' H 1 2.672 0.004 A 16 DG H2'' H 1 2.361 0.003 A 16 DG H3' H 1 5.009 0.001 A 16 DG H4' H 1 4.304 0.002 A 16 DG H8 H 1 7.547 0.002 A 16 DG C8 C 13 141.388 . A 17 DG H1' H 1 5.629 0.002 A 17 DG H2' H 1 2.299 0.001 A 17 DG H2'' H 1 2.354 0.003 A 17 DG H8 H 1 7.766 0.001 A 18 DA H1' H 1 6.044 0.002 A 18 DA H2 H 1 7.805 0.002 A 18 DA H2' H 1 2.349 0.002 A 18 DA H2'' H 1 2.349 0.002 A 18 DA H3' H 1 4.681 0.002 A 18 DA H8 H 1 7.875 0.001 A 18 DA C8 C 13 141.367 . A 19 DC H1' H 1 5.691 0.006 A 19 DC H2' H 1 2.114 0.011 A 19 DC H2'' H 1 2.365 0.004 A 19 DC H3' H 1 4.584 0.006 A 19 DC H5 H 1 5.786 0.004 A 19 DC H6 H 1 7.300 0.001 A 19 DC C6 C 13 142.870 . A 20 G H1 H 1 11.604 0.001 A 20 G H1' H 1 5.611 0.004 A 20 G H2' H 1 4.922 0.0 A 20 G H8 H 1 8.173 0.001 A 20 G C8 C 13 138.882 . A 21 DG H1 H 1 11.523 0.002 A 21 DG H1' H 1 6.038 0.001 A 21 DG H2' H 1 2.521 0.004 A 21 DG H2'' H 1 2.675 0.002 A 21 DG H3' H 1 4.986 0.001 A 21 DG H4' H 1 4.450 0.001 A 21 DG H8 H 1 7.938 0.001 A 21 DG C8 C 13 138.326 . A 22 DG H1 H 1 11.519 0.005 A 22 DG H1' H 1 6.334 0.002 A 22 DG H2' H 1 2.603 0.003 A 22 DG H2'' H 1 2.454 0.0 A 22 DG H3' H 1 4.687 0.001 A 22 DG H4' H 1 4.353 0.002 A 22 DG H8 H 1 7.906 0.001 A 22 DG C8 C 13 137.873 . stop_ save_ save_CNS/XPLOR_distance_constraints_6 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_6 _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 G H8 A 1 G H1' 1.0 2.5 5.5 2 2 A 1 G H8 A 1 G H2' 1.0 2.5 5.5 3 3 A 1 G H8 A 1 G H3' 1.0 1.8 4.0 4 4 A 1 G H8 A 1 G H4' 1.0 4.0 7.0 5 5 A 2 DG H8 A 2 DG H1' 1.0 2.5 5.5 6 6 A 2 DG H8 A 2 DG H2' 1.0 1.8 4.0 7 7 A 2 DG H8 A 2 DG H2'' 1.0 1.8 4.0 8 8 A 2 DG H8 A 2 DG H3' 1.0 2.5 5.5 9 9 A 2 DG H8 A 2 DG H4' 1.0 2.5 5.5 10 10 A 3 DG H8 A 3 DG H1' 1.0 2.5 5.5 11 11 A 3 DG H8 A 3 DG H2' 1.0 1.8 4.0 12 12 A 3 DG H8 A 3 DG H2'' 1.0 1.8 4.0 13 13 A 3 DG H8 A 3 DG H3' 1.0 2.5 5.5 14 14 A 3 DG H8 A 3 DG H4' 1.0 4.0 7.0 15 15 A 4 DA H8 A 4 DA H1' 1.0 1.8 4.0 16 16 A 4 DA H8 A 4 DA H2' 1.0 1.8 4.0 17 17 A 4 DA H8 A 4 DA H2'' 1.0 3.0 7.0 18 18 A 4 DA H8 A 4 DA H3' 1.0 2.5 5.5 19 19 A 4 DA H8 A 4 DA H4' 1.0 4.0 7.0 20 20 A 5 DT H6 A 5 DT H1' 1.0 1.8 4.0 21 21 A 5 DT H6 A 5 DT H2' 1.0 1.8 4.0 22 22 A 5 DT H6 A 5 DT H2'' 1.0 3.0 7.0 23 23 A 5 DT H6 A 5 DT H3' 1.0 2.5 5.5 24 24 A 5 DT H6 A 5 DT H4' 1.0 2.5 5.5 25 25 A 6 DG H8 A 6 DG H1' 1.0 2.5 5.5 26 26 A 6 DG H8 A 6 DG H2' 1.0 1.8 4.0 27 27 A 6 DG H8 A 6 DG H2'' 1.0 1.8 4.0 28 28 A 6 DG H8 A 6 DG H3' 1.0 2.5 5.5 29 29 A 6 DG H8 A 6 DG H4' 1.0 2.5 5.5 30 30 A 7 DG H8 A 7 DG H1' 1.0 2.5 5.5 31 31 A 7 DG H8 A 7 DG H2' 1.0 1.8 4.0 32 32 A 7 DG H8 A 7 DG H2'' 1.0 1.8 4.0 33 33 A 7 DG H8 A 7 DG H3' 1.0 4.0 7.0 34 34 A 7 DG H8 A 7 DG H4' 1.0 3.0 7.0 35 35 A 8 DG H8 A 8 DG H1' 1.0 2.5 5.5 36 36 A 8 DG H8 A 8 DG H2' 1.0 1.8 4.0 37 37 A 8 DG H8 A 8 DG H2'' 1.0 1.8 4.0 38 38 A 8 DG H8 A 8 DG H3' 1.0 2.5 5.5 39 39 A 8 DG H8 A 8 DG H4' 1.0 4.5 7.5 40 40 A 9 DA H8 A 9 DA H1' 1.0 1.8 4.0 41 41 A 9 DA H8 A 9 DA H2' 1.0 1.8 4.0 42 42 A 9 DA H8 A 9 DA H2'' 1.0 1.8 4.0 43 43 A 9 DA H8 A 9 DA H3' 1.0 2.5 5.5 44 44 A 9 DA H8 A 9 DA H4' 1.0 3.0 7.0 45 45 A 10 DC H6 A 10 DC H1' 1.0 2.5 5.5 46 46 A 10 DC H6 A 10 DC H2' 1.0 1.8 4.0 47 47 A 10 DC H6 A 10 DC H2'' 1.0 2.5 5.5 48 48 A 10 DC H6 A 10 DC H3' 1.0 4.0 7.0 49 49 A 10 DC H6 A 10 DC H4' 1.0 2.5 5.5 50 50 A 11 DA H8 A 11 DA H1' 1.0 2.5 5.5 51 51 A 11 DA H8 A 11 DA H2' 1.0 1.8 4.0 52 52 A 11 DA H8 A 11 DA H2'' 1.0 2.5 5.5 53 53 A 11 DA H8 A 11 DA H3' 1.0 2.5 5.5 54 54 A 11 DA H8 A 11 DA H4' 1.0 2.5 5.5 55 55 A 12 DC H6 A 12 DC H1' 1.0 1.8 4.0 56 56 A 12 DC H6 A 12 DC H2' 1.0 4.0 7.0 57 57 A 12 DC H6 A 12 DC H2'' 1.0 2.5 5.5 58 58 A 12 DC H6 A 12 DC H3' 1.0 4.0 7.0 59 59 A 13 DA H8 A 13 DA H1' 1.0 2.5 5.5 60 60 A 13 DA H8 A 13 DA H2' 1.0 2.5 5.5 61 61 A 13 DA H8 A 13 DA H2'' 1.0 3.0 7.0 62 62 A 14 DG H8 A 14 DG H1' 1.0 1.8 4.0 63 63 A 14 DG H8 A 14 DG H2' 1.0 4.0 7.0 64 64 A 14 DG H8 A 14 DG H2'' 1.0 2.5 5.5 65 65 A 14 DG H8 A 14 DG H3' 1.0 4.5 7.5 66 66 A 15 DG H8 A 15 DG H1' 1.0 1.8 4.0 67 67 A 15 DG H8 A 15 DG H2' 1.0 2.5 5.5 68 68 A 15 DG H8 A 15 DG H2'' 1.0 2.5 5.5 69 69 A 15 DG H8 A 15 DG H3' 1.0 4.5 7.5 70 70 A 15 DG H8 A 15 DG H4' 1.0 2.5 5.5 71 71 A 16 DG H8 A 16 DG H1' 1.0 1.8 4.0 72 72 A 16 DG H8 A 16 DG H2' 1.0 4.0 7.0 73 73 A 16 DG H8 A 16 DG H2'' 1.0 2.5 5.5 74 74 A 16 DG H8 A 16 DG H3' 1.0 4.0 7.0 75 75 A 16 DG H8 A 16 DG H4' 1.0 2.5 5.5 76 76 A 17 DG H8 A 17 DG H1' 1.0 2.5 5.5 77 77 A 17 DG H8 A 17 DG H2' 1.0 3.0 7.0 78 78 A 17 DG H8 A 17 DG H2'' 1.0 3.0 7.0 79 79 A 18 DA H8 A 18 DA H1' 1.0 2.5 5.5 80 80 A 18 DA H8 A 18 DA H2' 1.0 1.8 4.0 81 81 A 18 DA H8 A 18 DA H2'' 1.0 3.0 7.0 82 82 A 18 DA H8 A 18 DA H3' 1.0 4.0 7.0 83 83 A 18 DA H8 A 18 DA H4' 1.0 2.5 5.5 84 84 A 19 DC H6 A 19 DC H1' 1.0 2.5 5.5 85 85 A 19 DC H6 A 19 DC H2' 1.0 1.8 4.0 86 86 A 19 DC H6 A 19 DC H2'' 1.0 2.5 5.5 87 87 A 19 DC H6 A 19 DC H3' 1.0 2.5 5.5 88 88 A 20 G H8 A 20 G H1' 1.0 2.5 5.5 89 89 A 20 G H8 A 20 G H2' 1.0 1.8 4.0 90 90 A 21 DG H8 A 21 DG H1' 1.0 2.5 5.5 91 91 A 21 DG H8 A 21 DG H2' 1.0 1.8 4.0 92 92 A 21 DG H8 A 21 DG H2'' 1.0 2.5 5.5 93 93 A 21 DG H8 A 21 DG H3' 1.0 2.5 5.5 94 94 A 21 DG H8 A 21 DG H4' 1.0 2.5 5.5 95 95 A 22 DG H8 A 22 DG H1' 1.0 2.5 5.5 96 96 A 22 DG H8 A 22 DG H2' 1.0 1.8 4.0 97 97 A 22 DG H8 A 22 DG H2'' 1.0 1.8 4.0 98 98 A 22 DG H8 A 22 DG H3' 1.0 2.5 5.5 99 99 A 22 DG H8 A 22 DG H4' 1.0 4.0 7.0 100 100 A 1 G H1' A 1 G H2' 1.0 1.8 4.0 101 101 A 2 DG H1' A 2 DG H2' 1.0 1.8 4.0 102 102 A 2 DG H1' A 2 DG H2'' 1.0 1.8 4.0 103 103 A 3 DG H1' A 3 DG H2' 1.0 2.5 5.5 104 104 A 3 DG H1' A 3 DG H2'' 1.0 1.8 4.0 105 105 A 4 DA H1' A 4 DA H2' 1.0 2.5 5.5 106 106 A 4 DA H1' A 4 DA H2'' 1.0 1.8 4.0 107 107 A 5 DT H1' A 5 DT H2' 1.0 2.5 5.5 108 108 A 5 DT H1' A 5 DT H2'' 1.0 1.8 4.0 109 109 A 6 DG H1' A 6 DG H2' 1.0 1.8 4.0 110 110 A 6 DG H1' A 6 DG H2'' 1.0 1.8 4.0 111 111 A 7 DG H1' A 7 DG H2' 1.0 1.8 4.0 112 112 A 7 DG H1' A 7 DG H2'' 1.0 1.8 4.0 113 113 A 8 DG H1' A 8 DG H2' 1.0 1.8 4.0 114 114 A 8 DG H1' A 8 DG H2'' 1.0 1.8 4.0 115 115 A 9 DA H1' A 9 DA H2' 1.0 1.8 4.0 116 116 A 9 DA H1' A 9 DA H2'' 1.0 1.8 4.0 117 117 A 10 DC H1' A 10 DC H2' 1.0 1.8 4.0 118 118 A 10 DC H1' A 10 DC H2'' 1.0 1.8 4.0 119 119 A 11 DA H1' A 11 DA H2' 1.0 2.5 5.5 120 120 A 11 DA H1' A 11 DA H2'' 1.0 1.8 4.0 121 121 A 12 DC H1' A 12 DC H2' 1.0 2.5 5.5 122 122 A 12 DC H1' A 12 DC H2'' 1.0 1.8 4.0 123 123 A 13 DA H1' A 13 DA H2' 1.0 1.8 4.0 124 124 A 13 DA H1' A 13 DA H2'' 1.0 1.8 4.0 125 125 A 14 DG H1' A 14 DG H2' 1.0 2.5 5.5 126 126 A 14 DG H1' A 14 DG H2'' 1.0 1.8 4.0 127 127 A 15 DG H1' A 15 DG H2' 1.0 2.5 5.5 128 128 A 15 DG H1' A 15 DG H2'' 1.0 1.8 4.0 129 129 A 16 DG H1' A 16 DG H2' 1.0 1.8 4.0 130 130 A 16 DG H1' A 16 DG H2'' 1.0 1.8 4.0 131 131 A 17 DG H1' A 17 DG H2' 1.0 2.5 5.5 132 132 A 17 DG H1' A 17 DG H2'' 1.0 1.8 4.0 133 133 A 18 DA H1' A 18 DA H2' 1.0 1.8 4.0 134 134 A 18 DA H1' A 18 DA H2'' 1.0 1.8 4.0 135 135 A 19 DC H1' A 19 DC H2' 1.0 2.5 5.5 136 136 A 19 DC H1' A 19 DC H2'' 1.0 1.8 4.0 137 137 A 20 G H1' A 20 G H2' 1.0 2.5 5.5 138 138 A 21 DG H1' A 21 DG H2' 1.0 1.8 4.0 139 139 A 21 DG H1' A 21 DG H2'' 1.0 1.8 4.0 140 140 A 22 DG H1' A 22 DG H2' 1.0 1.8 4.0 141 141 A 22 DG H1' A 22 DG H2'' 1.0 1.8 4.0 142 142 A 9 DA H2' A 9 DA H2 1.0 4.5 7.5 143 143 A 9 DA H2'' A 9 DA H2 1.0 4.5 7.5 144 144 A 11 DA H2'' A 11 DA H2 1.0 4.5 7.5 145 145 A 1 G H1' A 2 DG H8 1.0 2.5 5.5 146 146 A 1 G H2' A 2 DG H8 1.0 1.8 4.0 147 147 A 1 G H3' A 2 DG H8 1.0 1.8 4.0 148 148 A 1 G H4' A 2 DG H8 1.0 4.0 7.0 149 149 A 1 G H8 A 2 DG H8 1.0 2.5 5.5 150 150 A 2 DG H1' A 3 DG H8 1.0 2.5 5.5 151 151 A 2 DG H2' A 3 DG H8 1.0 3.0 7.0 152 152 A 2 DG H2'' A 3 DG H8 1.0 1.8 4.0 153 153 A 2 DG H3' A 3 DG H8 1.0 3.0 7.0 154 154 A 3 DG H1' A 4 DA H8 1.0 4.5 7.5 155 155 A 3 DG H3' A 4 DA H8 1.0 2.5 5.5 156 156 A 3 DG H4' A 4 DA H8 1.0 3.0 7.0 157 157 A 4 DA H2' A 5 DT H6 1.0 3.0 7.0 158 158 A 4 DA H2'' A 5 DT H6 1.0 3.0 7.0 159 159 A 4 DA H3' A 5 DT H6 1.0 2.5 5.5 160 160 A 4 DA H4' A 5 DT H6 1.0 2.5 5.5 161 161 A 5 DT H1' A 6 DG H8 1.0 2.5 5.5 162 162 A 5 DT H2' A 6 DG H8 1.0 3.0 7.0 163 163 A 5 DT H2'' A 6 DG H8 1.0 3.0 7.0 164 164 A 5 DT H4' A 6 DG H8 1.0 4.5 7.5 165 165 A 6 DG H1' A 7 DG H8 1.0 1.8 4.0 166 166 A 6 DG H2' A 7 DG H8 1.0 1.8 4.0 167 167 A 6 DG H2'' A 7 DG H8 1.0 1.8 4.0 168 168 A 6 DG H3' A 7 DG H8 1.0 2.5 5.5 169 169 A 6 DG H4' A 7 DG H8 1.0 3.0 7.0 170 170 A 6 DG H8 A 7 DG H8 1.0 2.5 5.5 171 171 A 7 DG H1' A 8 DG H8 1.0 1.8 4.0 172 172 A 7 DG H2' A 8 DG H8 1.0 2.5 5.5 173 173 A 7 DG H2'' A 8 DG H8 1.0 1.8 4.0 174 174 A 7 DG H3' A 8 DG H8 1.0 2.5 5.5 175 175 A 7 DG H4' A 8 DG H8 1.0 4.5 7.5 176 176 A 7 DG H8 A 8 DG H8 1.0 2.5 5.5 177 177 A 8 DG H1' A 9 DA H8 1.0 4.0 7.0 178 178 A 8 DG H2' A 9 DA H8 1.0 2.5 5.5 179 179 A 8 DG H2'' A 9 DA H8 1.0 1.8 4.0 180 180 A 8 DG H3' A 9 DA H8 1.0 3.0 7.0 181 181 A 8 DG H4' A 9 DA H8 1.0 3.0 7.0 182 182 A 8 DG H8 A 9 DA H8 1.0 4.0 7.0 183 183 A 9 DA H1' A 10 DC H6 1.0 4.0 7.0 184 184 A 9 DA H2' A 10 DC H6 1.0 4.0 7.0 185 185 A 9 DA H2'' A 10 DC H6 1.0 2.5 5.5 186 186 A 9 DA H3' A 10 DC H6 1.0 2.5 5.5 187 187 A 10 DC H2' A 11 DA H8 1.0 4.0 7.0 188 188 A 10 DC H2'' A 11 DA H8 1.0 4.0 7.0 189 189 A 10 DC H3' A 11 DA H8 1.0 4.0 7.0 190 190 A 11 DA H2' A 12 DC H6 1.0 4.5 7.5 191 191 A 11 DA H2'' A 12 DC H6 1.0 4.0 7.0 192 192 A 11 DA H3' A 12 DC H6 1.0 4.0 7.0 193 193 A 11 DA H4' A 12 DC H6 1.0 4.5 7.5 194 194 A 12 DC H1' A 13 DA H8 1.0 2.5 5.5 195 195 A 12 DC H2' A 13 DA H8 1.0 2.5 5.5 196 196 A 12 DC H2'' A 13 DA H8 1.0 2.5 5.5 197 197 A 12 DC H3' A 13 DA H8 1.0 4.5 7.5 198 198 A 13 DA H1' A 14 DG H8 1.0 4.0 7.0 199 199 A 14 DG H8 A 15 DG H1' 1.0 4.0 7.0 200 200 A 14 DG H1' A 15 DG H8 1.0 4.0 7.0 201 201 A 15 DG H8 A 16 DG H8 1.0 2.5 5.5 202 202 A 16 DG H1' A 17 DG H8 1.0 4.5 7.5 203 203 A 16 DG H2' A 17 DG H8 1.0 3.0 7.0 204 204 A 16 DG H2'' A 17 DG H8 1.0 3.0 7.0 205 205 A 17 DG H1' A 18 DA H8 1.0 2.5 5.5 206 206 A 17 DG H2' A 18 DA H8 1.0 3.0 7.0 207 207 A 17 DG H2'' A 18 DA H8 1.0 3.0 7.0 208 208 A 18 DA H2' A 19 DC H6 1.0 3.0 7.0 209 209 A 18 DA H2'' A 19 DC H6 1.0 3.0 7.0 210 210 A 19 DC H1' A 20 G H8 1.0 4.0 7.0 211 211 A 19 DC H2' A 20 G H8 1.0 1.8 4.0 212 212 A 19 DC H2'' A 20 G H8 1.0 1.8 4.0 213 213 A 19 DC H3' A 20 G H8 1.0 4.5 7.5 214 214 A 19 DC H6 A 20 G H8 1.0 2.5 5.5 215 215 A 20 G H1' A 21 DG H8 1.0 1.8 4.0 216 216 A 20 G H2' A 21 DG H8 1.0 2.5 5.5 217 217 A 20 G H8 A 21 DG H8 1.0 2.5 5.5 218 218 A 21 DG H1' A 22 DG H8 1.0 1.8 4.0 219 219 A 21 DG H2' A 22 DG H8 1.0 1.8 4.0 220 220 A 21 DG H2'' A 22 DG H8 1.0 1.8 4.0 221 221 A 21 DG H3' A 22 DG H8 1.0 2.5 5.5 222 222 A 21 DG H4' A 22 DG H8 1.0 4.5 7.5 223 223 A 1 G H1 A 2 DG H1 1.0 2.8 5.2 224 224 A 2 DG H1 A 3 DG H1 1.0 2.8 5.2 225 225 A 6 DG H1 A 7 DG H1 1.0 2.8 5.2 226 226 A 7 DG H1 A 8 DG H1 1.0 2.8 5.2 227 227 A 14 DG H1 A 15 DG H1 1.0 2.8 5.2 228 228 A 15 DG H1 A 16 DG H1 1.0 2.8 5.2 229 229 A 20 G H1 A 21 DG H1 1.0 2.8 5.2 230 230 A 1 G H8 A 16 DG H1 1.0 4.8 7.2 231 231 A 2 DG H8 A 15 DG H1 1.0 3.8 6.2 232 232 A 3 DG H8 A 14 DG H1 1.0 3.8 6.2 233 233 A 6 DG H8 A 1 G H1 1.0 3.8 6.2 234 234 A 7 DG H8 A 2 DG H1 1.0 3.8 6.2 235 235 A 8 DG H8 A 3 DG H1 1.0 3.8 6.2 236 236 A 14 DG H8 A 22 DG H1 1.0 3.8 6.2 237 237 A 15 DG H8 A 21 DG H1 1.0 3.8 6.2 238 238 A 16 DG H8 A 20 G H1 1.0 3.8 6.2 239 239 A 20 G H8 A 6 DG H1 1.0 3.8 6.2 240 240 A 21 DG H8 A 7 DG H1 1.0 3.8 6.2 241 241 A 22 DG H8 A 8 DG H1 1.0 3.8 6.2 242 242 A 6 DG H8 A 2 DG H1 1.0 3.8 6.2 243 243 A 16 DG H8 A 21 DG H1 1.0 3.8 6.2 244 244 A 20 G H8 A 7 DG H1 1.0 3.8 6.2 245 245 A 21 DG H8 A 8 DG H1 1.0 4.8 7.2 246 246 A 11 DA H2 A 3 DG H1 1.0 4.8 7.2 247 247 A 11 DA H2 A 8 DG H1 1.0 2.8 5.2 248 248 A 11 DA H2 A 22 DG H1 1.0 4.8 7.2 249 249 A 3 DG H1 A 13 DA H2 1.0 3.8 6.2 250 250 A 14 DG H1 A 13 DA H2 1.0 3.8 6.2 251 251 A 13 DA H8 A 14 DG H1 1.0 3.8 6.2 252 252 A 6 DG H1 A 19 DC H5 1.0 2.8 5.2 253 253 A 8 DG H1 A 12 DC H5 1.0 4.8 7.2 254 254 A 13 DA H1' A 14 DG H1 1.0 3.8 6.2 255 255 A 18 DA H1' A 20 G H1 1.0 4.8 7.2 256 256 A 20 G H1 A 19 DC H5 1.0 4.8 7.2 257 257 A 12 DC H1' A 22 DG H1 1.0 4.8 7.2 258 258 A 10 DC H1' A 9 DA H2 1.0 4.5 7.5 259 259 A 11 DA H2 A 12 DC H5 1.0 2.5 5.5 260 260 A 9 DA H3' A 11 DA H2 1.0 4.0 7.0 261 261 A 8 DG H8 A 11 DA H2 1.0 4.0 7.0 262 262 A 3 DG H1' A 13 DA H2 1.0 4.5 7.5 263 263 A 3 DG H8 A 13 DA H2 1.0 2.5 5.5 264 264 A 3 DG H2' A 13 DA H2 1.0 2.5 5.5 265 265 A 3 DG H2'' A 13 DA H2 1.0 2.5 5.5 266 266 A 3 DG H3' A 13 DA H2 1.0 4.0 7.0 267 267 A 12 DC H1' A 13 DA H2 1.0 4.0 7.0 268 268 A 1 G H2' A 18 DA H2 1.0 4.0 7.0 269 269 A 19 DC H5 A 18 DA H2 1.0 4.0 7.0 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 hbond _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 G H2x A 6 DG N7 1.0 1.89 2.09 2 2 A 6 DG N7 A 1 G N2 1.0 2.80 3.00 3 3 A 1 G H1 A 6 DG O6 1.0 1.85 2.05 4 4 A 6 DG O6 A 1 G N1 1.0 2.85 3.05 5 5 A 6 DG H2x A 20 G N7 1.0 1.89 2.09 6 6 A 20 G N7 A 6 DG N2 1.0 2.80 3.00 7 7 A 6 DG H1 A 20 G O6 1.0 1.85 2.05 8 8 A 20 G O6 A 6 DG N1 1.0 2.85 3.05 9 9 A 20 G H2x A 16 DG N7 1.0 1.89 2.09 10 10 A 16 DG N7 A 20 G N2 1.0 2.80 3.00 11 11 A 20 G H1 A 16 DG O6 1.0 1.85 2.05 12 12 A 16 DG O6 A 20 G N1 1.0 2.85 3.05 13 13 A 16 DG H2x A 1 G N7 1.0 1.89 2.09 14 14 A 1 G N7 A 16 DG N2 1.0 2.80 3.00 15 15 A 16 DG H1 A 1 G O6 1.0 1.85 2.05 16 16 A 1 G O6 A 16 DG N1 1.0 2.85 3.05 17 17 A 2 DG H2x A 7 DG N7 1.0 1.89 2.09 18 18 A 7 DG N7 A 2 DG N2 1.0 2.80 3.00 19 19 A 2 DG H1 A 7 DG O6 1.0 1.85 2.05 20 20 A 7 DG O6 A 2 DG N1 1.0 2.85 3.05 21 21 A 7 DG H2x A 21 DG N7 1.0 1.89 2.09 22 22 A 21 DG N7 A 7 DG N2 1.0 2.80 3.00 23 23 A 7 DG H1 A 21 DG O6 1.0 1.85 2.05 24 24 A 21 DG O6 A 7 DG N1 1.0 2.85 3.05 25 25 A 21 DG H2x A 15 DG N7 1.0 1.89 2.09 26 26 A 15 DG N7 A 21 DG N2 1.0 2.80 3.00 27 27 A 21 DG H1 A 15 DG O6 1.0 1.85 2.05 28 28 A 15 DG O6 A 21 DG N1 1.0 2.85 3.05 29 29 A 15 DG H2x A 2 DG N7 1.0 1.89 2.09 30 30 A 2 DG N7 A 15 DG N2 1.0 2.80 3.00 31 31 A 15 DG H1 A 2 DG O6 1.0 1.85 2.05 32 32 A 2 DG O6 A 15 DG N1 1.0 2.85 3.05 33 33 A 3 DG H2x A 8 DG N7 1.0 1.89 2.09 34 34 A 8 DG N7 A 3 DG N2 1.0 2.80 3.00 35 35 A 3 DG H1 A 8 DG O6 1.0 1.85 2.05 36 36 A 8 DG O6 A 3 DG N1 1.0 2.85 3.05 37 37 A 8 DG H2x A 22 DG N7 1.0 1.89 2.09 38 38 A 22 DG N7 A 8 DG N2 1.0 2.80 3.00 39 39 A 8 DG H1 A 22 DG O6 1.0 1.85 2.05 40 40 A 22 DG O6 A 8 DG N1 1.0 2.85 3.05 41 41 A 22 DG H2x A 14 DG N7 1.0 1.89 2.09 42 42 A 14 DG N7 A 22 DG N2 1.0 2.80 3.00 43 43 A 22 DG H1 A 14 DG O6 1.0 1.85 2.05 44 44 A 14 DG O6 A 22 DG N1 1.0 2.85 3.05 45 45 A 14 DG H2x A 3 DG N7 1.0 1.89 2.09 46 46 A 3 DG N7 A 14 DG N2 1.0 2.80 3.00 47 47 A 14 DG H1 A 3 DG O6 1.0 1.85 2.05 48 48 A 3 DG O6 A 14 DG N1 1.0 2.85 3.05 stop_ save_ save_CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 1 G O4' A 1 G C1' A 1 G N9 A 1 G C4 1.0 90.0 270.0 CHI 2 2 A 2 DG O4' A 2 DG C1' A 2 DG N9 A 2 DG C4 1.0 170.0 310.0 CHI 3 3 A 3 DG O4' A 3 DG C1' A 3 DG N9 A 3 DG C4 1.0 170.0 310.0 CHI 4 4 A 4 DA O4' A 4 DA C1' A 4 DA N9 A 4 DA C4 1.0 170.0 310.0 CHI 5 5 A 5 DT O4' A 5 DT C1' A 5 DT N1 A 5 DT C2 1.0 170.0 310.0 CHI 6 6 A 6 DG O4' A 6 DG C1' A 6 DG N9 A 6 DG C4 1.0 170.0 310.0 CHI 7 7 A 7 DG O4' A 7 DG C1' A 7 DG N9 A 7 DG C4 1.0 170.0 310.0 CHI 8 8 A 8 DG O4' A 8 DG C1' A 8 DG N9 A 8 DG C4 1.0 170.0 310.0 CHI 9 9 A 9 DA O4' A 9 DA C1' A 9 DA N9 A 9 DA C4 1.0 170.0 310.0 CHI 10 10 A 10 DC O4' A 10 DC C1' A 10 DC N1 A 10 DC C2 1.0 170.0 310.0 CHI 11 11 A 11 DA O4' A 11 DA C1' A 11 DA N9 A 11 DA C4 1.0 170.0 310.0 CHI 12 12 A 12 DC O4' A 12 DC C1' A 12 DC N1 A 12 DC C2 1.0 170.0 310.0 CHI 13 13 A 13 DA O4' A 13 DA C1' A 13 DA N9 A 13 DA C4 1.0 170.0 310.0 CHI 14 14 A 14 DG O4' A 14 DG C1' A 14 DG N9 A 14 DG C4 1.0 0.0 110.0 CHI 15 15 A 15 DG O4' A 15 DG C1' A 15 DG N9 A 15 DG C4 1.0 0.0 110.0 CHI 16 16 A 16 DG O4' A 16 DG C1' A 16 DG N9 A 16 DG C4 1.0 0.0 110.0 CHI 17 17 A 17 DG O4' A 17 DG C1' A 17 DG N9 A 17 DG C4 1.0 170.0 310.0 CHI 18 18 A 18 DA O4' A 18 DA C1' A 18 DA N9 A 18 DA C4 1.0 170.0 310.0 CHI 19 19 A 19 DC O4' A 19 DC C1' A 19 DC N1 A 19 DC C2 1.0 80.0 220.0 CHI 20 20 A 20 G O4' A 20 G C1' A 20 G N9 A 20 G C4 1.0 170.0 310.0 CHI 21 21 A 21 DG O4' A 21 DG C1' A 21 DG N9 A 21 DG C4 1.0 170.0 310.0 CHI 22 22 A 22 DG O4' A 22 DG C1' A 22 DG N9 A 22 DG C4 1.0 170.0 310.0 CHI 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.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 2 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 Hz . . 9615.385 . . . . 2 Hz . . 9615.388 . . . . stop_ save_