data_nef_c19659_2mhx 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 19661 PDB 2mhx stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 5 DC O3' 1 6 RBD P 1 6 RBD O3' 1 7 DA P stop_ 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 DG middle . . 4 A 4 DA middle . . 5 A 5 DC middle . . 6 A 6 RBD middle . . 7 A 7 DA middle . . 8 A 8 DG middle . . 9 A 9 DA middle . . 10 A 10 DA middle . . 11 A 11 DG end . . 12 B 12 DC start . . 13 B 13 DT middle . . 14 B 14 DT middle . . 15 B 15 DC middle . . 16 B 16 DT middle . . 17 B 17 DT middle . . 18 B 18 DG middle . . 19 B 19 DT middle . . 20 B 20 DC middle . . 21 B 21 DC middle . . 22 B 22 DG end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_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 5.758 . A 1 DC H2' H 1 1.865 . A 1 DC H2'' H 1 2.364 . A 1 DC H3' H 1 4.707 . A 1 DC H4' H 1 4.080 . A 1 DC H5 H 1 5.929 . A 1 DC H5' H 1 3.715 . A 1 DC H5'' H 1 4.303 . A 1 DC H6 H 1 7.615 . A 2 DG H1' H 1 5.456 . A 2 DG H2' H 1 2.475 . A 2 DG H2'' H 1 2.722 . A 2 DG H3' H 1 4.995 . A 2 DG H4' H 1 4.309 . A 2 DG H5' H 1 3.971 . A 2 DG H5'' H 1 4.086 . A 2 DG H8 H 1 7.927 . A 3 DG H1' H 1 5.677 . A 3 DG H2' H 1 2.685 . A 3 DG H2'' H 1 2.791 . A 3 DG H3' H 1 5.061 . A 3 DG H4' H 1 4.425 . A 3 DG H5' H 1 4.139 . A 3 DG H5'' H 1 4.207 . A 3 DG H8 H 1 7.824 . A 4 DA H1' H 1 6.174 . A 4 DA H2 H 1 7.846 . A 4 DA H2' H 1 2.622 . A 4 DA H2'' H 1 2.880 . A 4 DA H3' H 1 5.044 . A 4 DA H4' H 1 4.473 . A 4 DA H5' H 1 4.243 . A 4 DA H5'' H 1 4.152 . A 4 DA H8 H 1 8.140 . A 5 DC H1' H 1 5.663 . A 5 DC H2' H 1 1.852 . A 5 DC H2'' H 1 2.388 . A 5 DC H3' H 1 4.784 . A 5 DC H4' H 1 4.258 . A 5 DC H5 H 1 5.102 . A 5 DC H5' H 1 4.148 . A 5 DC H5'' H 1 4.181 . A 5 DC H6 H 1 7.140 . A 6 RBD H1' H 1 5.814 . A 6 RBD H2 H 1 7.272 . A 6 RBD H2'x H 1 2.368 . A 6 RBD H2'y H 1 2.623 . A 6 RBD H3' H 1 4.981 . A 6 RBD H5'y H 1 4.133 . A 6 RBD H8 H 1 8.040 . A 6 RBD HAx H 1 3.880 . A 6 RBD HAy H 1 3.949 . A 6 RBD HB H 1 4.319 . A 6 RBD HDy H 1 3.723 . A 6 RBD HDx H 1 3.637 . A 6 RBD HG H 1 4.292 . A 7 DA H1' H 1 5.793 . A 7 DA H2 H 1 7.526 . A 7 DA H2' H 1 2.551 . A 7 DA H2'' H 1 2.676 . A 7 DA H3' H 1 4.981 . A 7 DA H4' H 1 4.373 . A 7 DA H5' H 1 4.140 . A 7 DA H5'' H 1 4.207 . A 7 DA H8 H 1 7.975 . A 8 DG H1' H 1 5.457 . A 8 DG H2' H 1 2.544 . A 8 DG H2'' H 1 2.683 . A 8 DG H3' H 1 4.992 . A 8 DG H4' H 1 4.364 . A 8 DG H5' H 1 4.163 . A 8 DG H5'' H 1 4.207 . A 8 DG H8 H 1 7.695 . A 9 DA H1' H 1 5.960 . A 9 DA H2 H 1 7.383 . A 9 DA H2' H 1 2.648 . A 9 DA H2'' H 1 2.891 . A 9 DA H3' H 1 5.065 . A 9 DA H4' H 1 4.447 . A 9 DA H5' H 1 4.191 . A 9 DA H5'' H 1 4.226 . A 9 DA H8 H 1 8.109 . A 10 DA H1' H 1 6.050 . A 10 DA H2 H 1 7.383 . A 10 DA H2' H 1 2.599 . A 10 DA H2'' H 1 2.871 . A 10 DA H3' H 1 5.047 . A 10 DA H4' H 1 4.458 . A 10 DA H5' H 1 4.245 . A 10 DA H5'' H 1 4.152 . A 10 DA H8 H 1 8.061 . A 11 DG H1' H 1 6.024 . A 11 DG H2' H 1 2.277 . A 11 DG H2'' H 1 2.382 . A 11 DG H3' H 1 4.628 . A 11 DG H5' H 1 4.304 . A 11 DG H5'' H 1 4.178 . A 11 DG H8 H 1 7.616 . B 12 DC H1' H 1 5.930 . B 12 DC H2' H 1 2.651 . B 12 DC H2'' H 1 2.348 . B 12 DC H3' H 1 4.698 . B 12 DC H4' H 1 4.147 . B 12 DC H5 H 1 5.993 . B 12 DC H5' H 1 3.835 . B 12 DC H5'' H 1 3.900 . B 12 DC H6 H 1 7.946 . B 13 DT H1' H 1 6.235 . B 13 DT H2' H 1 2.692 . B 13 DT H2'' H 1 2.314 . B 13 DT H3' H 1 4.950 . B 13 DT H4' H 1 4.313 . B 13 DT H5' H 1 4.142 . B 13 DT H5'' H 1 4.215 . B 13 DT H6 H 1 7.703 . B 13 DT H7% H 1 1.713 . B 14 DT H1' H 1 6.174 . B 14 DT H2' H 1 2.652 . B 14 DT H2'' H 1 2.326 . B 14 DT H3' H 1 4.965 . B 14 DT H4' H 1 4.295 . B 14 DT H5' H 1 4.206 . B 14 DT H6 H 1 7.542 . B 14 DT H7% H 1 1.693 . B 15 DC H1' H 1 6.062 . B 15 DC H2' H 1 2.581 . B 15 DC H2'' H 1 2.173 . B 15 DC H3' H 1 4.842 . B 15 DC H5 H 1 5.649 . B 15 DC H5' H 1 4.297 . B 15 DC H5'' H 1 4.198 . B 15 DC H6 H 1 7.633 . B 16 DT H1' H 1 6.108 . B 16 DT H2' H 1 2.599 . B 16 DT H2'' H 1 2.240 . B 16 DT H3' H 1 4.906 . B 16 DT H4' H 1 4.261 . B 16 DT H5' H 1 4.114 . B 16 DT H5'' H 1 4.194 . B 16 DT H6 H 1 7.508 . B 16 DT H7% H 1 1.683 . B 17 DT H1' H 1 5.857 . B 17 DT H2' H 1 2.377 . B 17 DT H2'' H 1 2.079 . B 17 DT H3' H 1 4.914 . B 17 DT H4' H 1 4.106 . B 17 DT H5' H 1 4.254 . B 17 DT H5'' H 1 4.074 . B 17 DT H6 H 1 7.365 . B 17 DT H7% H 1 1.780 . B 18 DG H1' H 1 6.030 . B 18 DG H2' H 1 2.821 . B 18 DG H2'' H 1 2.688 . B 18 DG H3' H 1 4.949 . B 18 DG H4' H 1 4.417 . B 18 DG H5' H 1 4.132 . B 18 DG H5'' H 1 4.237 . B 18 DG H8 H 1 7.948 . B 19 DT H1' H 1 6.117 . B 19 DT H2' H 1 2.575 . B 19 DT H2'' H 1 2.216 . B 19 DT H3' H 1 4.916 . B 19 DT H5' H 1 4.291 . B 19 DT H5'' H 1 4.190 . B 19 DT H6 H 1 7.347 . B 19 DT H7% H 1 1.344 . B 20 DC H1' H 1 5.982 . B 20 DC H2' H 1 2.451 . B 20 DC H2'' H 1 2.158 . B 20 DC H3' H 1 4.857 . B 20 DC H4' H 1 4.290 . B 20 DC H5 H 1 5.671 . B 20 DC H5' H 1 4.183 . B 20 DC H5'' H 1 4.126 . B 20 DC H6 H 1 7.589 . B 21 DC H1' H 1 5.650 . B 21 DC H2' H 1 2.392 . B 21 DC H2'' H 1 2.094 . B 21 DC H3' H 1 4.853 . B 21 DC H5 H 1 5.740 . B 21 DC H5' H 1 4.210 . B 21 DC H5'' H 1 4.131 . B 21 DC H6 H 1 7.527 . B 22 DG H1' H 1 6.216 . B 22 DG H2' H 1 2.679 . B 22 DG H2'' H 1 2.407 . B 22 DG H3' H 1 4.723 . B 22 DG H4' H 1 4.218 . B 22 DG H5' H 1 4.101 . B 22 DG H8 H 1 8.005 . stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-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 B 12 DC H6 B 12 DC H1' 1.0 . 3.10 2 2 B 12 DC H1' B 12 DC H3' 1.0 . 3.69 3 3 B 12 DC H1' B 13 DT H6 1.0 . 3.86 4 4 B 12 DC H6 B 13 DT H6 1.0 . 3.28 5 5 B 12 DC H3' B 13 DT H6 1.0 . 3.23 6 6 B 13 DT H6 B 13 DT H1' 1.0 . 3.09 7 7 B 14 DT H1' B 14 DT H3' 1.0 . 3.29 8 8 B 14 DT H1' B 14 DT H2' 1.0 . 2.38 9 9 B 14 DT H1' B 15 DC H6 1.0 . 3.17 10 10 B 14 DT H3' B 15 DC H6 1.0 . 4.07 11 11 B 15 DC H6 B 15 DC H1' 1.0 . 3.11 12 12 B 14 DT H1' B 15 DC H5 1.0 . 3.27 13 13 B 14 DT H3' B 15 DC H5 1.0 . 5.30 14 14 B 15 DC H1' B 15 DC H3' 1.0 . 3.84 15 15 B 15 DC H6 B 15 DC H3' 1.0 . 3.21 16 16 B 15 DC H1' B 15 DC H2' 1.0 . 2.25 17 17 B 15 DC H6 B 15 DC H2' 1.0 . 1.90 18 18 B 15 DC H3' B 15 DC H2'' 1.0 . 2.17 19 19 B 15 DC H1' B 16 DT H6 1.0 . 3.34 20 20 B 16 DT H6 B 16 DT H1' 1.0 . 3.16 21 21 B 17 DT H6 B 17 DT H1' 1.0 . 3.03 22 22 B 17 DT H1' B 17 DT H2'' 1.0 . 2.67 23 23 B 17 DT H6 B 17 DT H2'' 1.0 . 2.13 24 24 B 17 DT H2'' B 17 DT H3' 1.0 . 2.29 25 25 B 17 DT H1' B 17 DT H2' 1.0 . 1.83 26 26 B 17 DT H6 B 17 DT H2' 1.0 . 3.41 27 27 B 17 DT H1' B 18 DG H8 1.0 . 3.71 28 28 B 17 DT H2'' B 18 DG H8 1.0 . 2.56 29 29 B 18 DG H3' B 18 DG H1' 1.0 . 3.43 30 30 B 18 DG H1' B 18 DG H2' 1.0 . 2.23 31 31 B 18 DG H8 B 18 DG H2'' 1.0 . 2.27 32 32 B 18 DG H3' B 18 DG H2'' 1.0 . 2.27 33 33 B 18 DG H1' B 19 DT H6 1.0 . 3.08 34 34 B 18 DG H2' B 19 DT H6 1.0 . 2.28 35 35 B 18 DG H2'' B 19 DT H6 1.0 . 2.58 36 36 B 20 DC H6 B 19 DT H1' 1.0 . 3.91 37 37 B 19 DT H6 B 20 DC H6 1.0 . 3.44 38 38 B 20 DC H6 B 20 DC H1' 1.0 . 3.10 39 39 B 19 DT H1' B 20 DC H5 1.0 . 4.08 40 40 B 19 DT H6 B 20 DC H5 1.0 . 3.76 41 41 B 20 DC H1' B 20 DC H3' 1.0 . 3.70 42 42 B 20 DC H6 B 20 DC H3' 1.0 . 3.18 43 43 B 20 DC H1' B 20 DC H2' 1.0 . 2.33 44 44 B 20 DC H1' B 20 DC H2'' 1.0 . 2.01 45 45 B 20 DC H6 B 20 DC H2'' 1.0 . 2.15 46 46 B 20 DC H3' B 20 DC H2'' 1.0 . 2.14 47 47 B 20 DC H1' B 21 DC H6 1.0 . 3.30 48 48 B 20 DC H2'' B 21 DC H6 1.0 . 2.05 49 49 B 20 DC H1' B 21 DC H5 1.0 . 3.43 50 50 B 20 DC H3' B 21 DC H5 1.0 . 4.02 51 51 B 20 DC H2' B 21 DC H5 1.0 . 3.52 52 52 B 20 DC H2'' B 21 DC H5 1.0 . 2.44 53 53 B 21 DC H3' B 21 DC H1' 1.0 . 3.70 54 54 B 21 DC H1' B 21 DC H2' 1.0 . 2.34 55 55 B 21 DC H6 B 21 DC H2' 1.0 . 1.77 56 56 B 21 DC H5 B 21 DC H2' 1.0 . 3.38 57 57 B 21 DC H1' B 22 DG H8 1.0 . 3.72 58 58 B 21 DC H2' B 22 DG H8 1.0 . 2.53 59 59 B 22 DG H8 B 22 DG H1' 1.0 . 3.30 60 60 B 22 DG H1' B 22 DG H3' 1.0 . 3.37 61 61 B 22 DG H8 B 22 DG H3' 1.0 . 3.02 62 62 B 22 DG H1' B 22 DG H2' 1.0 . 1.83 63 63 B 22 DG H3' B 22 DG H2'' 1.0 . 2.21 64 64 A 1 DC H6 A 1 DC H1' 1.0 . 2.83 65 65 A 1 DC H1' A 1 DC H3' 1.0 . 3.61 66 66 A 1 DC H6 A 1 DC H3' 1.0 . 3.46 67 67 A 1 DC H1' A 1 DC H2' 1.0 . 2.32 68 68 A 1 DC H6 A 1 DC H2' 1.0 . 2.16 69 69 A 1 DC H2' A 1 DC H5 1.0 . 3.43 70 70 A 1 DC H3' A 1 DC H2' 1.0 . 2.14 71 71 A 1 DC H1' A 1 DC H2'' 1.0 . 1.85 72 72 A 1 DC H1' A 2 DG H8 1.0 . 2.59 73 73 A 1 DC H6 A 2 DG H8 1.0 . 4.10 74 74 A 1 DC H2' A 2 DG H8 1.0 . 3.02 75 75 A 2 DG H8 A 2 DG H1' 1.0 . 3.34 76 76 A 2 DG H8 A 2 DG H3' 1.0 . 3.17 77 77 A 2 DG H1' A 3 DG H1' 1.0 . 3.10 78 78 A 2 DG H1' A 3 DG H8 1.0 . 3.38 79 79 A 3 DG H1' A 3 DG H8 1.0 . 3.87 80 80 A 3 DG H1' A 3 DG H3' 1.0 . 3.43 81 81 A 3 DG H8 A 3 DG H3' 1.0 . 3.33 82 82 A 3 DG H1' A 3 DG H2'' 1.0 . 2.15 83 83 A 3 DG H1' A 4 DA H8 1.0 . 3.39 84 84 A 3 DG H8 A 4 DA H8 1.0 . 3.96 85 85 A 3 DG H2'' A 4 DA H8 1.0 . 2.73 86 86 A 4 DA H8 A 4 DA H1' 1.0 . 3.40 87 87 A 4 DA H1' A 4 DA H3' 1.0 . 3.42 88 88 A 4 DA H1' A 4 DA H2'' 1.0 . 2.44 89 89 A 4 DA H8 A 4 DA H2'' 1.0 . 2.43 90 90 A 5 DC H1' A 4 DA H2 1.0 . 3.51 91 91 A 4 DA H1' A 5 DC H6 1.0 . 3.70 92 92 A 4 DA H8 A 5 DC H6 1.0 . 4.07 93 93 A 4 DA H3' A 5 DC H6 1.0 . 4.06 94 94 A 5 DC H6 A 4 DA H2' 1.0 . 2.34 95 95 A 4 DA H2'' A 5 DC H6 1.0 . 2.53 96 96 A 5 DC H1' A 5 DC H6 1.0 . 3.70 97 97 A 4 DA H1' A 5 DC H5 1.0 . 4.96 98 98 A 5 DC H1' A 5 DC H3' 1.0 . 3.36 99 99 A 5 DC H6 A 5 DC H3' 1.0 . 3.22 100 100 A 5 DC H1' A 5 DC H2'' 1.0 . 2.74 101 101 A 5 DC H6 A 5 DC H2'' 1.0 . 2.18 102 102 A 5 DC H5 A 5 DC H2'' 1.0 . 3.41 103 103 A 5 DC H3' A 5 DC H2'' 1.0 . 2.23 104 104 A 5 DC H6 A 5 DC H2' 1.0 . 2.80 105 105 A 5 DC H3' A 5 DC H2' 1.0 . 2.76 106 106 A 8 DG H8 A 7 DA H1' 1.0 . 3.43 107 107 A 8 DG H8 A 7 DA H8 1.0 . 3.74 108 108 A 8 DG H8 A 8 DG H1' 1.0 . 3.66 109 109 A 8 DG H1' A 8 DG H2' 1.0 . 2.37 110 110 A 8 DG H1' A 9 DA H8 1.0 . 3.28 111 111 A 8 DG H8 A 9 DA H8 1.0 . 4.35 112 112 A 9 DA H8 A 8 DG H3' 1.0 . 4.08 113 113 A 9 DA H8 A 9 DA H1' 1.0 . 3.38 114 114 A 9 DA H8 A 9 DA H3' 1.0 . 2.93 115 115 A 9 DA H1' A 9 DA H2'' 1.0 . 2.22 116 116 A 9 DA H8 A 9 DA H2'' 1.0 . 2.24 117 117 A 9 DA H1' A 10 DA H8 1.0 . 3.53 118 118 A 10 DA H8 A 10 DA H1' 1.0 . 3.28 119 119 A 10 DA H1' A 10 DA H3' 1.0 . 3.39 120 120 A 10 DA H8 A 11 DG H8 1.0 . 3.74 121 121 A 10 DA H3' A 11 DG H8 1.0 . 4.62 122 122 A 11 DG H8 A 10 DA H2'' 1.0 . 3.16 123 123 A 11 DG H3' A 11 DG H1' 1.0 . 3.34 124 124 A 11 DG H8 A 11 DG H3' 1.0 . 3.54 125 125 A 11 DG H1' A 11 DG H2' 1.0 . 1.87 126 126 A 11 DG H3' A 11 DG H2' 1.0 . 2.32 127 127 A 11 DG H1' A 11 DG H2'' 1.0 . 2.25 128 128 A 11 DG H3' A 11 DG H2'' 1.0 . 1.95 129 129 B 13 DT H1' B 14 DT H6 1.0 . 4.17 130 130 B 14 DT H1' B 14 DT H6 1.0 . 3.64 131 131 A 7 DA H1' A 7 DA H3' 1.0 . 3.28 132 132 A 7 DA H1' A 7 DA H2' 1.0 . 2.28 133 133 A 7 DA H8 A 7 DA H2' 1.0 . 2.33 134 134 A 7 DA H1' A 7 DA H2'' 1.0 . 2.01 135 135 A 7 DA H8 A 7 DA H2'' 1.0 . 2.19 136 136 A 8 DG H1' A 7 DA H2 1.0 . 5.13 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type upper-bound-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 B 12 DC H4y A 11 DG O6 1.0 . 1.80 2 2 B 12 DC N3 A 11 DG H1 1.0 . 1.84 3 3 B 12 DC N3 A 11 DG N1 1.0 . 2.85 4 4 A 11 DG O6 B 12 DC N4 1.0 . 2.81 5 5 B 12 DC O2 A 11 DG H2y 1.0 . 1.75 6 6 B 13 DT H3 A 10 DA N1 1.0 . 1.71 7 7 A 10 DA N1 B 13 DT N3 1.0 . 2.72 8 8 B 13 DT O4 A 10 DA H6x 1.0 . 1.84 9 9 B 14 DT H3 A 9 DA N1 1.0 . 1.71 10 10 A 9 DA N1 B 14 DT N3 1.0 . 2.72 11 11 B 14 DT O4 A 9 DA H6x 1.0 . 1.84 12 12 B 15 DC H4y A 8 DG O6 1.0 . 1.80 13 13 B 15 DC N3 A 8 DG H1 1.0 . 1.84 14 14 B 15 DC N3 A 8 DG N1 1.0 . 2.85 15 15 A 8 DG O6 B 15 DC N4 1.0 . 2.81 16 16 B 15 DC O2 A 8 DG H2y 1.0 . 1.75 17 17 B 16 DT H3 A 7 DA N1 1.0 . 1.71 18 18 A 7 DA N1 B 16 DT N3 1.0 . 2.72 19 19 B 16 DT O4 A 7 DA H6x 1.0 . 1.84 20 20 B 18 DG H1 A 5 DC N3 1.0 . 1.84 21 21 B 18 DG H2y A 5 DC O2 1.0 . 1.75 22 22 A 5 DC N3 B 18 DG N1 1.0 . 2.85 23 23 B 18 DG O6 A 5 DC H4y 1.0 . 1.80 24 24 B 18 DG O6 A 5 DC N4 1.0 . 2.81 25 25 B 19 DT H3 A 4 DA N1 1.0 . 1.71 26 26 A 4 DA N1 B 19 DT N3 1.0 . 2.72 27 27 B 19 DT O4 A 4 DA H6x 1.0 . 1.84 28 28 B 20 DC H4y A 3 DG O6 1.0 . 1.80 29 29 B 20 DC N3 A 3 DG H1 1.0 . 1.84 30 30 B 20 DC N3 A 3 DG N1 1.0 . 2.85 31 31 A 3 DG O6 B 20 DC N4 1.0 . 2.81 32 32 B 20 DC O2 A 3 DG H2y 1.0 . 1.75 33 33 B 21 DC H4y A 2 DG O6 1.0 . 1.80 34 34 B 21 DC N3 A 2 DG H1 1.0 . 1.84 35 35 B 21 DC N3 A 2 DG N1 1.0 . 2.85 36 36 A 2 DG O6 B 21 DC N4 1.0 . 2.81 37 37 B 21 DC O2 A 2 DG H2y 1.0 . 1.75 38 38 B 22 DG H1 A 1 DC N3 1.0 . 1.84 39 39 B 22 DG H2y A 1 DC O2 1.0 . 1.75 40 40 A 1 DC N3 B 22 DG N1 1.0 . 2.85 41 41 B 22 DG O6 A 1 DC H4y 1.0 . 1.80 42 42 B 22 DG O6 A 1 DC N4 1.0 . 2.81 stop_ save_ save_DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_4 _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 B 12 DC O3' B 13 DT P B 13 DT O5' B 13 DT C5' 1.0 -90.0 -30.0 ALPHA 2 2 B 13 DT O3' B 14 DT P B 14 DT O5' B 14 DT C5' 1.0 -90.0 -30.0 ALPHA 3 3 B 14 DT O3' B 15 DC P B 15 DC O5' B 15 DC C5' 1.0 -90.0 -30.0 ALPHA 4 4 B 15 DC O3' B 16 DT P B 16 DT O5' B 16 DT C5' 1.0 -90.0 -30.0 ALPHA 5 5 B 16 DT O3' B 17 DT P B 17 DT O5' B 17 DT C5' 1.0 -90.0 -30.0 ALPHA 6 6 B 17 DT O3' B 18 DG P B 18 DG O5' B 18 DG C5' 1.0 -90.0 -30.0 ALPHA 7 7 B 18 DG O3' B 19 DT P B 19 DT O5' B 19 DT C5' 1.0 -90.0 -30.0 ALPHA 8 8 B 19 DT O3' B 20 DC P B 20 DC O5' B 20 DC C5' 1.0 -90.0 -30.0 ALPHA 9 9 B 20 DC O3' B 21 DC P B 21 DC O5' B 21 DC C5' 1.0 -90.0 -30.0 ALPHA 10 10 A 1 DC O3' A 2 DG P A 2 DG O5' A 2 DG C5' 1.0 -90.0 -30.0 ALPHA 11 11 A 2 DG O3' A 3 DG P A 3 DG O5' A 3 DG C5' 1.0 -90.0 -30.0 ALPHA 12 12 A 3 DG O3' A 4 DA P A 4 DA O5' A 4 DA C5' 1.0 -90.0 -30.0 ALPHA 13 13 A 4 DA O3' A 5 DC P A 5 DC O5' A 5 DC C5' 1.0 -90.0 -30.0 ALPHA 14 14 A 7 DA O3' A 8 DG P A 8 DG O5' A 8 DG C5' 1.0 -90.0 -30.0 ALPHA 15 15 A 8 DG O3' A 9 DA P A 9 DA O5' A 9 DA C5' 1.0 -90.0 -30.0 ALPHA 16 16 A 9 DA O3' A 10 DA P A 10 DA O5' A 10 DA C5' 1.0 -90.0 -30.0 ALPHA 17 17 B 13 DT P B 13 DT O5' B 13 DT C5' B 13 DT C4' 1.0 150.0 210.0 BETA 18 18 B 14 DT P B 14 DT O5' B 14 DT C5' B 14 DT C4' 1.0 150.0 210.0 BETA 19 19 B 15 DC P B 15 DC O5' B 15 DC C5' B 15 DC C4' 1.0 150.0 210.0 BETA 20 20 B 16 DT P B 16 DT O5' B 16 DT C5' B 16 DT C4' 1.0 150.0 210.0 BETA 21 21 B 17 DT P B 17 DT O5' B 17 DT C5' B 17 DT C4' 1.0 150.0 210.0 BETA 22 22 B 18 DG P B 18 DG O5' B 18 DG C5' B 18 DG C4' 1.0 150.0 210.0 BETA 23 23 B 19 DT P B 19 DT O5' B 19 DT C5' B 19 DT C4' 1.0 150.0 210.0 BETA 24 24 B 20 DC P B 20 DC O5' B 20 DC C5' B 20 DC C4' 1.0 150.0 210.0 BETA 25 25 B 21 DC P B 21 DC O5' B 21 DC C5' B 21 DC C4' 1.0 150.0 210.0 BETA 26 26 A 2 DG P A 2 DG O5' A 2 DG C5' A 2 DG C4' 1.0 150.0 210.0 BETA 27 27 A 3 DG P A 3 DG O5' A 3 DG C5' A 3 DG C4' 1.0 150.0 210.0 BETA 28 28 A 4 DA P A 4 DA O5' A 4 DA C5' A 4 DA C4' 1.0 150.0 210.0 BETA 29 29 A 5 DC P A 5 DC O5' A 5 DC C5' A 5 DC C4' 1.0 150.0 210.0 BETA 30 30 A 7 DA P A 7 DA O5' A 7 DA C5' A 7 DA C4' 1.0 150.0 210.0 BETA 31 31 A 8 DG P A 8 DG O5' A 8 DG C5' A 8 DG C4' 1.0 150.0 210.0 BETA 32 32 A 9 DA P A 9 DA O5' A 9 DA C5' A 9 DA C4' 1.0 150.0 210.0 BETA 33 33 A 10 DA P A 10 DA O5' A 10 DA C5' A 10 DA C4' 1.0 150.0 210.0 BETA 34 34 B 13 DT O5' B 13 DT C5' B 13 DT C4' B 13 DT C3' 1.0 30.0 90.0 GAMMA 35 35 B 14 DT O5' B 14 DT C5' B 14 DT C4' B 14 DT C3' 1.0 30.0 90.0 GAMMA 36 36 B 15 DC O5' B 15 DC C5' B 15 DC C4' B 15 DC C3' 1.0 30.0 90.0 GAMMA 37 37 B 16 DT O5' B 16 DT C5' B 16 DT C4' B 16 DT C3' 1.0 30.0 90.0 GAMMA 38 38 B 17 DT O5' B 17 DT C5' B 17 DT C4' B 17 DT C3' 1.0 30.0 90.0 GAMMA 39 39 B 18 DG O5' B 18 DG C5' B 18 DG C4' B 18 DG C3' 1.0 30.0 90.0 GAMMA 40 40 B 19 DT O5' B 19 DT C5' B 19 DT C4' B 19 DT C3' 1.0 30.0 90.0 GAMMA 41 41 B 20 DC O5' B 20 DC C5' B 20 DC C4' B 20 DC C3' 1.0 30.0 90.0 GAMMA 42 42 B 21 DC O5' B 21 DC C5' B 21 DC C4' B 21 DC C3' 1.0 30.0 90.0 GAMMA 43 43 A 2 DG O5' A 2 DG C5' A 2 DG C4' A 2 DG C3' 1.0 30.0 90.0 GAMMA 44 44 A 3 DG O5' A 3 DG C5' A 3 DG C4' A 3 DG C3' 1.0 30.0 90.0 GAMMA 45 45 A 4 DA O5' A 4 DA C5' A 4 DA C4' A 4 DA C3' 1.0 30.0 90.0 GAMMA 46 46 A 5 DC O5' A 5 DC C5' A 5 DC C4' A 5 DC C3' 1.0 30.0 90.0 GAMMA 47 47 A 7 DA O5' A 7 DA C5' A 7 DA C4' A 7 DA C3' 1.0 30.0 90.0 GAMMA 48 48 A 8 DG O5' A 8 DG C5' A 8 DG C4' A 8 DG C3' 1.0 30.0 90.0 GAMMA 49 49 A 9 DA O5' A 9 DA C5' A 9 DA C4' A 9 DA C3' 1.0 30.0 90.0 GAMMA 50 50 A 10 DA O5' A 10 DA C5' A 10 DA C4' A 10 DA C3' 1.0 30.0 90.0 GAMMA 51 51 B 12 DC C3' B 12 DC O3' B 13 DT P B 13 DT O5' 1.0 -135.0 -75.0 ZETA 52 52 B 13 DT C3' B 13 DT O3' B 14 DT P B 14 DT O5' 1.0 -135.0 -75.0 ZETA 53 53 B 14 DT C3' B 14 DT O3' B 15 DC P B 15 DC O5' 1.0 -135.0 -75.0 ZETA 54 54 B 15 DC C3' B 15 DC O3' B 16 DT P B 16 DT O5' 1.0 -135.0 -75.0 ZETA 55 55 B 16 DT C3' B 16 DT O3' B 17 DT P B 17 DT O5' 1.0 -135.0 -75.0 ZETA 56 56 B 17 DT C3' B 17 DT O3' B 18 DG P B 18 DG O5' 1.0 -135.0 -75.0 ZETA 57 57 B 18 DG C3' B 18 DG O3' B 19 DT P B 19 DT O5' 1.0 -135.0 -75.0 ZETA 58 58 B 19 DT C3' B 19 DT O3' B 20 DC P B 20 DC O5' 1.0 -135.0 -75.0 ZETA 59 59 B 20 DC C3' B 20 DC O3' B 21 DC P B 21 DC O5' 1.0 -135.0 -75.0 ZETA 60 60 A 1 DC C3' A 1 DC O3' A 2 DG P A 2 DG O5' 1.0 -135.0 -75.0 ZETA 61 61 A 2 DG C3' A 2 DG O3' A 3 DG P A 3 DG O5' 1.0 -135.0 -75.0 ZETA 62 62 A 3 DG C3' A 3 DG O3' A 4 DA P A 4 DA O5' 1.0 -135.0 -75.0 ZETA 63 63 A 4 DA C3' A 4 DA O3' A 5 DC P A 5 DC O5' 1.0 -135.0 -75.0 ZETA 64 64 A 7 DA C3' A 7 DA O3' A 8 DG P A 8 DG O5' 1.0 -135.0 -75.0 ZETA 65 65 A 8 DG C3' A 8 DG O3' A 9 DA P A 9 DA O5' 1.0 -135.0 -75.0 ZETA 66 66 A 9 DA C3' A 9 DA O3' A 10 DA P A 10 DA O5' 1.0 -135.0 -75.0 ZETA stop_ save_