data_nef_c17088_2kye 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 PDB 2kye 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 G O3' 1 6 PSU P 1 6 PSU O3' 1 7 PSU P 1 7 PSU O3' 1 8 G P 1 11 C O3' 1 12 PSU P 1 12 PSU O3' 1 13 C P 1 13 C O3' 1 14 PSU P 1 14 PSU O3' 1 15 C 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 G start . . 2 A 2 A middle . . 3 A 3 G middle . . 4 A 4 A middle . . 5 A 5 G middle . . 6 A 6 PSU middle . . 7 A 7 PSU middle . . 8 A 8 G middle . . 9 A 9 G middle . . 10 A 10 G middle . . 11 A 11 C middle . . 12 A 12 PSU middle . . 13 A 13 C middle . . 14 A 14 PSU middle . . 15 A 15 C 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 G H1 H 1 12.64 0.0160 A 1 G H1' H 1 5.821 0.0042 A 1 G H2' H 1 4.985 0.0035 A 1 G H3' H 1 4.82 0.0048 A 1 G H4' H 1 4.592 0.0055 A 1 G H5' H 1 4.317 0.0205 A 1 G H5'' H 1 4.391 0.0037 A 1 G H8 H 1 8.171 0.0041 A 1 G C1' C 13 89.88 0.0349 A 1 G C2' C 13 74.77 0.0012 A 1 G C3' C 13 75.61 0.0010 A 1 G C4' C 13 84.04 0.0100 A 1 G C5' C 13 67.39 0.0010 A 1 G C8 C 13 139.1 0.0010 A 1 G N1 N 15 146.6 0.0000 A 2 A H1' H 1 6.167 0.0052 A 2 A H2 H 1 7.633 0.0043 A 2 A H2' H 1 4.842 0.0072 A 2 A H3' H 1 4.721 0.0045 A 2 A H4' H 1 4.652 0.0050 A 2 A H5' H 1 4.54 0.0258 A 2 A H5'' H 1 4.482 0.0240 A 2 A H61 H 1 7.317 0.0000 A 2 A H62 H 1 6.815 0.0000 A 2 A H8 H 1 8.163 0.0041 A 2 A C1' C 13 92.78 0.0013 A 2 A C2 C 13 153.1 0.0000 A 2 A C2' C 13 75.77 0.0510 A 2 A C3' C 13 73.54 0.0232 A 2 A C4' C 13 82.94 0.0201 A 2 A C5' C 13 67.59 0.0010 A 2 A C8 C 13 140.5 0.0010 A 2 A N6 N 15 81.39 0.0074 A 3 G H1 H 1 12.54 0.0048 A 3 G H1' H 1 5.666 0.0046 A 3 G H2' H 1 4.62 0.0050 A 3 G H21 H 1 7.996 0.0108 A 3 G H22 H 1 6.035 0.0154 A 3 G H3' H 1 4.535 0.0042 A 3 G H4' H 1 4.541 0.0025 A 3 G H5' H 1 4.508 0.0021 A 3 G H5'' H 1 4.156 0.0065 A 3 G H8 H 1 7.178 0.0050 A 3 G C1' C 13 92.82 0.0350 A 3 G C2' C 13 75.51 0.0010 A 3 G C3' C 13 74.33 0.0146 A 3 G C4' C 13 82.24 0.0533 A 3 G C5' C 13 66.82 0.0075 A 3 G C8 C 13 136 0.0010 A 3 G N1 N 15 146.3 0.0000 A 3 G N2 N 15 74.61 0.0080 A 4 A H1' H 1 5.999 0.0047 A 4 A H2 H 1 7.517 0.0197 A 4 A H2' H 1 4.662 0.0051 A 4 A H3' H 1 4.679 0.0033 A 4 A H4' H 1 4.551 0.0036 A 4 A H5' H 1 4.162 0.0034 A 4 A H5'' H 1 4.601 0.0010 A 4 A H61 H 1 7.314 0.0000 A 4 A H62 H 1 6.86 0.0000 A 4 A H8 H 1 7.779 0.0071 A 4 A C1' C 13 92.93 0.0091 A 4 A C2 C 13 153.3 0.0010 A 4 A C2' C 13 75.7 0.0010 A 4 A C3' C 13 72.69 0.0420 A 4 A C4' C 13 82.07 0.0012 A 4 A C5' C 13 65.75 0.0020 A 4 A C8 C 13 139.4 0.0010 A 4 A N6 N 15 82.35 0.0065 A 5 G H1 H 1 13.38 0.0087 A 5 G H1' H 1 5.737 0.0095 A 5 G H2' H 1 4.701 0.0111 A 5 G H21 H 1 8.511 0.0082 A 5 G H22 H 1 6.461 0.0124 A 5 G H3' H 1 4.469 0.0067 A 5 G H4' H 1 4.457 0.0030 A 5 G H5' H 1 4.104 0.0050 A 5 G H5'' H 1 4.565 0.0025 A 5 G H8 H 1 7.276 0.0086 A 5 G C1' C 13 92.69 0.0457 A 5 G C2' C 13 75.51 0.0383 A 5 G C3' C 13 72.4 0.0404 A 5 G C4' C 13 81.91 0.0148 A 5 G C5' C 13 64.97 0.0400 A 5 G C8 C 13 135.9 0.0010 A 5 G N1 N 15 147.5 0.0000 A 5 G N2 N 15 75.12 0.0000 A 6 PSU H1' H 1 4.653 0.0097 A 6 PSU H2' H 1 4.38 0.0115 A 6 PSU H3' H 1 4.405 0.0080 A 6 PSU H4' H 1 4.162 0.0049 A 6 PSU H5' H 1 4.344 0.0051 A 6 PSU H5'' H 1 4.019 0.0061 A 6 PSU H6 H 1 7.161 0.0052 A 6 PSU HN1 H 1 10.65 0.0473 A 6 PSU C1' C 13 81.8 0.0005 A 6 PSU C2' C 13 75.76 0.0010 A 6 PSU C3' C 13 74 0.0010 A 6 PSU C4' C 13 80.07 0.0009 A 6 PSU C6 C 13 140.8 0.0010 A 7 PSU H1' H 1 4.472 0.0094 A 7 PSU H2' H 1 4.126 0.0050 A 7 PSU H3' H 1 4.257 0.0035 A 7 PSU H4' H 1 4.073 0.0035 A 7 PSU H5' H 1 4.154 0.0045 A 7 PSU H5'' H 1 3.91 0.0030 A 7 PSU H6 H 1 7.393 0.0054 A 7 PSU HN1 H 1 10.81 0.0005 A 7 PSU C1' C 13 82.02 0.0025 A 7 PSU C2' C 13 75.53 0.0010 A 7 PSU C3' C 13 75.99 0.0010 A 7 PSU C4' C 13 81.67 0.0005 A 7 PSU C6 C 13 141.6 0.0010 A 8 G H1 H 1 10.52 0.0035 A 8 G H1' H 1 5.584 0.0041 A 8 G H2' H 1 4.519 0.0050 A 8 G H3' H 1 4.597 0.0033 A 8 G H4' H 1 4.021 0.0005 A 8 G H5' H 1 3.928 0.0040 A 8 G H5'' H 1 3.969 0.0045 A 8 G H8 H 1 7.82 0.0047 A 8 G C1' C 13 89.7 0.0760 A 8 G C2' C 13 76.01 0.0119 A 8 G C3' C 13 78.08 0.0319 A 8 G C4' C 13 85.29 0.0075 A 8 G C5' C 13 68.17 0.0010 A 8 G C8 C 13 140.2 0.0010 A 8 G N1 N 15 145.3 0.0000 A 8 G N2 N 15 73.88 0.0000 A 9 G H1 H 1 10.92 0.0010 A 9 G H1' H 1 5.91 0.0076 A 9 G H2' H 1 4.908 0.0043 A 9 G H2y H 1 6.397 0.0037 A 9 G H3' H 1 5.155 0.0212 A 9 G H4' H 1 4.501 0.0037 A 9 G H5' H 1 4.25 0.0059 A 9 G H5'' H 1 4.19 0.0052 A 9 G H8 H 1 7.935 0.0041 A 9 G C1' C 13 91.01 0.0218 A 9 G C2' C 13 75.67 0.0010 A 9 G C3' C 13 77.1 0.0255 A 9 G C4' C 13 85.02 0.0064 A 9 G C5' C 13 68.51 0.0010 A 9 G C8 C 13 141.2 0.0010 A 9 G N1 N 15 146.7 0.0000 A 9 G N2 N 15 72.7 0.0590 A 10 G H1 H 1 11.74 0.0110 A 10 G H1' H 1 5.638 0.0093 A 10 G H2' H 1 4.663 0.0158 A 10 G H2y H 1 6.46 0.0070 A 10 G H3' H 1 4.815 0.0081 A 10 G H4' H 1 4.601 0.0004 A 10 G H5' H 1 4.391 0.0040 A 10 G H5'' H 1 4.315 0.0010 A 10 G H8 H 1 8.109 0.0038 A 10 G C1' C 13 90.78 0.0400 A 10 G C2' C 13 75.66 0.0245 A 10 G C3' C 13 75.39 0.0125 A 10 G C4' C 13 84.05 0.0304 A 10 G C5' C 13 68.88 0.0133 A 10 G C8 C 13 139.1 0.0010 A 10 G N1 N 15 145.6 0.0000 A 10 G N2 N 15 73.72 0.0637 A 11 C H1' H 1 5.434 0.0007 A 11 C H2' H 1 4.609 0.0055 A 11 C H3' H 1 4.479 0.0065 A 11 C H4' H 1 4.506 0.0047 A 11 C H41 H 1 8.801 0.0066 A 11 C H42 H 1 7.054 0.0008 A 11 C H5 H 1 5.627 0.0121 A 11 C H5' H 1 4.241 0.0036 A 11 C H5'' H 1 4.473 0.0010 A 11 C H6 H 1 7.709 0.0142 A 11 C C1' C 13 94.38 0.0206 A 11 C C2' C 13 75.36 0.0049 A 11 C C3' C 13 73.05 0.0010 A 11 C C4' C 13 82.45 0.0459 A 11 C C5 C 13 97.89 0.0009 A 11 C C5' C 13 66.16 0.0015 A 11 C C6 C 13 141.8 0.0010 A 11 C N4 N 15 97.81 0.0579 A 12 PSU H1' H 1 4.885 0.0034 A 12 PSU H2' H 1 4.566 0.0048 A 12 PSU H3' H 1 4.611 0.0046 A 12 PSU H4' H 1 4.307 0.0067 A 12 PSU H5' H 1 4.513 0.0043 A 12 PSU H5'' H 1 4.095 0.0084 A 12 PSU H6 H 1 7.554 0.0010 A 12 PSU HN1 H 1 10.92 0.0111 A 12 PSU HN3 H 1 14.26 0.0048 A 12 PSU C1' C 13 83.08 0.0010 A 12 PSU C2' C 13 74.85 0.0010 A 12 PSU C3' C 13 73.5 0.0010 A 12 PSU C4' C 13 79.69 0.0005 A 12 PSU C6 C 13 140.8 0.0010 A 13 C H1' H 1 5.578 0.0057 A 13 C H2' H 1 4.462 0.0054 A 13 C H3' H 1 4.61 0.0074 A 13 C H4' H 1 4.488 0.0063 A 13 C H41 H 1 8.532 0.0051 A 13 C H42 H 1 7.052 0.0066 A 13 C H5 H 1 5.733 0.0065 A 13 C H5' H 1 4.111 0.0068 A 13 C H5'' H 1 4.614 0.0015 A 13 C H6 H 1 7.956 0.0060 A 13 C C1' C 13 94.09 0.0094 A 13 C C2' C 13 75.44 0.0075 A 13 C C3' C 13 72.13 0.0035 A 13 C C4' C 13 81.86 0.0035 A 13 C C5 C 13 97.51 0.0160 A 13 C C5' C 13 64.89 0.0125 A 13 C C6 C 13 142.2 0.0010 A 13 C N4 N 15 96.89 0.0595 A 14 PSU H1' H 1 4.819 0.0047 A 14 PSU H2' H 1 4.264 0.0102 A 14 PSU H3' H 1 4.593 0.0060 A 14 PSU H4' H 1 4.46 0.0068 A 14 PSU H5' H 1 4.564 0.0092 A 14 PSU H5'' H 1 4.061 0.0053 A 14 PSU H6 H 1 7.518 0.0049 A 14 PSU HN1 H 1 10.78 0.0108 A 14 PSU HN3 H 1 13.98 0.0504 A 14 PSU C1' C 13 83.22 0.0080 A 14 PSU C2' C 13 74.93 0.0010 A 14 PSU C3' C 13 73.2 0.0775 A 14 PSU C4' C 13 82 0.0000 A 14 PSU C6 C 13 140.7 0.0000 A 15 C H1' H 1 5.832 0.0052 A 15 C H2' H 1 4.014 0.0054 A 15 C H3' H 1 4.221 0.0048 A 15 C H4' H 1 4.216 0.0031 A 15 C H41 H 1 8.283 0.0105 A 15 C H42 H 1 7.17 0.0146 A 15 C H5 H 1 5.717 0.0085 A 15 C H5' H 1 4.517 0.0037 A 15 C H5'' H 1 4.052 0.0050 A 15 C H6 H 1 7.808 0.0072 A 15 C C1' C 13 92.82 0.0055 A 15 C C2' C 13 77.63 0.0201 A 15 C C3' C 13 69.83 5.9118 A 15 C C4' C 13 83.42 0.0775 A 15 C C5 C 13 97.85 0.0010 A 15 C C5' C 13 65.65 0.0010 A 15 C C6 C 13 142.4 0.0010 A 15 C N4 N 15 96.17 0.0573 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _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 H1' A 1 G H5' 1.0 1.8 5.5 2 2 A 1 G H1' A 1 G H8 1.0 1.8 4.5 3 3 A 1 G H1' A 1 G H2' 1.0 1.8 4.5 4 4 A 1 G H2' A 1 G H4' 1.0 1.8 4.5 5 5 A 1 G H2' A 1 G H5'' 1.0 1.8 5.5 6 6 A 1 G H1' A 1 G H4' 1.0 1.8 3.5 7 7 A 1 G H8 A 1 G H4' 1.0 2.8 4.5 8 8 A 1 G H8 A 1 G H5'' 1.0 1.8 4.5 9 9 A 1 G H5' A 1 G H8 1.0 1.8 4.5 10 10 A 1 G H1' A 2 A H1' 1.0 1.8 5.5 11 11 A 1 G H2' A 2 A H5'' 1.0 1.8 4.5 12 12 A 1 G H2' A 2 A H5' 1.0 1.8 5.5 13 13 A 2 A H1' A 2 A H2 1.0 1.8 5.5 14 14 A 2 A H1' A 2 A H2' 1.0 1.8 3.5 15 15 A 2 A H1' A 2 A H3' 1.0 1.8 5.5 16 16 A 2 A H1' A 2 A H4' 1.0 1.8 3.5 17 17 A 2 A H4' A 2 A H8 1.0 1.8 6.5 18 18 A 2 A H1' A 2 A H8 1.0 1.8 4.5 19 19 A 2 A H3' A 2 A H8 1.0 1.8 4.5 20 20 A 2 A H5' A 2 A H8 1.0 2.8 4.5 21 21 A 2 A H5'' A 2 A H8 1.0 1.8 4.5 22 22 A 1 G H2' A 2 A H1' 1.0 1.8 5.5 23 23 A 2 A H2 A 15 C H1' 1.0 1.8 5.5 24 24 A 2 A H2 A 3 G H8 1.0 3.5 5.5 25 25 A 1 G H1' A 2 A H8 1.0 1.8 4.5 26 26 A 1 G H2' A 2 A H8 1.0 1.8 4.5 27 27 A 1 G H4' A 2 A H8 1.0 1.8 5.5 28 28 A 2 A H8 A 3 G H8 1.0 3.5 5.5 29 29 A 3 G H1' A 3 G H4' 1.0 1.8 4.5 30 30 A 3 G H1' A 3 G H2' 1.0 1.8 3.5 31 31 A 3 G H1' A 3 G H3' 1.0 1.8 4.5 32 32 A 3 G H8 A 3 G H1' 1.0 1.8 5.5 33 33 A 3 G H8 A 3 G H2' 1.0 1.8 4.5 34 34 A 3 G H8 A 3 G H3' 1.0 1.8 3.5 35 35 A 3 G H8 A 3 G H5'' 1.0 1.8 4.5 36 36 A 2 A H2 A 3 G H1' 1.0 1.8 4.5 37 37 A 3 G H1' A 4 A H8 1.0 1.8 5.5 38 38 A 3 G H2' A 4 A H8 1.0 1.8 3.5 39 39 A 3 G H3' A 4 A H8 1.0 1.8 4.5 40 40 A 2 A H1' A 3 G H8 1.0 1.8 4.5 41 41 A 4 A H1' A 4 A H2 1.0 1.8 5.5 42 42 A 4 A H8 A 4 A H1' 1.0 1.8 4.5 43 43 A 4 A H1' A 4 A H2' 1.0 1.8 3.5 44 44 A 4 A H8 A 4 A H2' 1.0 1.8 4.5 45 45 A 4 A H1' A 4 A H4' 1.0 1.8 4.5 46 46 A 4 A H8 A 4 A H5' 1.0 1.8 4.5 47 47 A 3 G H2' A 4 A H1' 1.0 1.8 4.5 48 48 A 4 A H2 A 3 G H1 1.0 1.8 5.5 49 49 A 4 A H2 A 5 G H1 1.0 1.8 5.5 50 50 A 4 A H2 A 5 G H8 1.0 1.8 4.5 51 51 A 3 G H4' A 4 A H8 1.0 1.8 5.5 52 52 A 3 G H8 A 4 A H8 1.0 1.8 5.5 53 53 A 4 A H8 A 5 G H8 1.0 1.8 5.5 54 54 A 5 G H1' A 5 G H5'' 1.0 1.8 4.5 55 55 A 5 G H1' A 5 G H5' 1.0 1.8 5.5 56 56 A 5 G H1' A 5 G H2' 1.0 1.8 3.5 57 57 A 5 G H8 A 5 G H2' 1.0 1.8 4.5 58 58 A 5 G H1' A 5 G H3' 1.0 1.8 4.5 59 59 A 5 G H8 A 5 G H3' 1.0 1.8 3.5 60 60 A 5 G H8 A 5 G H5' 1.0 1.8 4.5 61 61 A 5 G H8 A 5 G H1' 1.0 1.8 4.5 62 62 A 5 G H8 A 5 G H4' 1.0 1.8 4.5 63 63 A 5 G H1 A 10 G H1 1.0 4.5 6.5 64 64 A 5 G H1 A 11 C H41 1.0 1.8 4.5 65 65 A 4 A H2' A 5 G H1' 1.0 1.8 4.5 66 66 A 4 A H2 A 5 G H1' 1.0 1.8 5.5 67 67 A 5 G H1 A 6 PSU H1' 1.0 4.5 6.5 68 68 A 5 G H2' A 6 PSU HN1 1.0 4.5 6.5 69 69 A 5 G H2' A 6 PSU H5'' 1.0 3.5 5.5 70 70 A 5 G H3' A 6 PSU HN1 1.0 4.5 6.5 71 71 A 4 A H1' A 5 G H8 1.0 1.8 5.5 72 72 A 4 A H2' A 5 G H8 1.0 1.8 4.5 73 73 A 4 A H4' A 5 G H8 1.0 1.8 5.5 74 74 A 5 G H8 A 6 PSU H1' 1.0 4.5 6.5 75 75 A 5 G H8 A 6 PSU H6 1.0 3.5 5.5 76 76 A 6 PSU H1' A 6 PSU H6 1.0 1.8 4.5 77 77 A 6 PSU H1' A 6 PSU H3' 1.0 3.5 5.5 78 78 A 6 PSU H5'' A 6 PSU H3' 1.0 1.8 4.5 79 79 A 6 PSU H1' A 6 PSU H4' 1.0 1.8 4.5 80 80 A 6 PSU H6 A 6 PSU H5' 1.0 2.5 4.5 81 81 A 6 PSU H6 A 6 PSU H2' 1.0 1.8 3.5 82 82 A 6 PSU H6 A 6 PSU H3' 1.0 1.8 3.5 83 83 A 6 PSU H6 A 6 PSU H4' 1.0 3.5 5.5 84 84 A 6 PSU H5'' A 6 PSU H6 1.0 3.5 5.5 85 85 A 6 PSU H2' A 7 PSU H5'' 1.0 2.5 4.5 86 86 A 5 G H2' A 6 PSU H4' 1.0 3.5 5.5 87 87 A 5 G H2' A 6 PSU H5' 1.0 2.5 4.5 88 88 A 5 G H1' A 6 PSU H6 1.0 4.5 6.5 89 89 A 5 G H2' A 6 PSU H6 1.0 2.5 4.5 90 90 A 5 G H3' A 6 PSU H6 1.0 2.5 4.5 91 91 A 7 PSU H1' A 7 PSU H2' 1.0 2.5 4.5 92 92 A 7 PSU H1' A 7 PSU H3' 1.0 2.5 4.5 93 93 A 7 PSU H3' A 7 PSU H5' 1.0 1.8 4.5 94 94 A 7 PSU H1' A 7 PSU H4' 1.0 1.8 4.5 95 95 A 7 PSU H4' A 7 PSU H6 1.0 3.5 5.5 96 96 A 7 PSU H5'' A 7 PSU H3' 1.0 1.8 4.5 97 97 A 7 PSU H5'' A 7 PSU H4' 1.0 1.8 4.5 98 98 A 7 PSU H1' A 7 PSU H6 1.0 1.8 4.5 99 99 A 7 PSU H2' A 7 PSU H6 1.0 2.5 4.5 100 100 A 7 PSU H3' A 7 PSU H6 1.0 2.5 4.5 101 101 A 7 PSU H4' A 7 PSU H6 1.0 3.5 5.5 102 102 A 7 PSU H5'' A 7 PSU H6 1.0 2.5 4.5 103 103 A 7 PSU H5' A 7 PSU H6 1.0 2.5 4.5 104 104 A 6 PSU H2' A 7 PSU H1' 1.0 2.5 4.5 105 105 A 7 PSU H1' A 8 G H4' 1.0 3.5 5.5 106 106 A 7 PSU H1' A 8 G H5'' 1.0 3.5 5.5 107 107 A 7 PSU H1' A 8 G H5' 1.0 4.5 6.5 108 108 A 6 PSU H2' A 7 PSU H2' 1.0 4.5 6.5 109 109 A 7 PSU H2' A 8 G H4' 1.0 1.8 4.5 110 110 A 7 PSU H2' A 8 G H5'' 1.0 1.8 4.5 111 111 A 7 PSU H2' A 8 G H5' 1.0 1.8 5.5 112 112 A 6 PSU H2' A 7 PSU H4' 1.0 3.5 5.5 113 113 A 6 PSU H2' A 7 PSU H5' 1.0 3.5 5.5 114 114 A 6 PSU H3' A 7 PSU H5'' 1.0 4.5 6.5 115 115 A 6 PSU H1' A 7 PSU H6 1.0 4.5 6.5 116 116 A 6 PSU H2' A 7 PSU H6 1.0 1.8 3.5 117 117 A 6 PSU H3' A 7 PSU H6 1.0 2.5 4.5 118 118 A 6 PSU H5'' A 7 PSU H6 1.0 4.5 6.5 119 119 A 6 PSU H6 A 7 PSU H6 1.0 4.5 6.5 120 120 A 8 G H2' A 8 G H1' 1.0 1.8 3.5 121 121 A 8 G H5' A 8 G H2' 1.0 1.8 5.5 122 122 A 8 G H4' A 8 G H1' 1.0 1.8 4.5 123 123 A 8 G H5' A 8 G H1' 1.0 1.8 5.5 124 124 A 8 G H5'' A 8 G H1' 1.0 4.5 6.5 125 125 A 8 G H1' A 8 G H8 1.0 1.8 4.5 126 126 A 8 G H2' A 8 G H8 1.0 1.8 4.5 127 127 A 8 G H5' A 8 G H8 1.0 1.8 5.5 128 128 A 7 PSU H3' A 8 G H1' 1.0 1.8 6.5 129 129 A 8 G H1' A 9 G H5'' 1.0 5.5 7.5 130 130 A 8 G H2' A 9 G H8 1.0 3.5 5.5 131 131 A 9 G H8 A 8 G H3' 1.0 3.5 5.5 132 132 A 7 PSU H1' A 8 G H8 1.0 1.8 6.5 133 133 A 7 PSU H2' A 8 G H8 1.0 3.5 5.5 134 134 A 7 PSU H4' A 8 G H8 1.0 1.8 5.5 135 135 A 8 G H5' A 9 G H2y 1.0 1.8 4.5 136 136 A 9 G H1' A 9 G H5' 1.0 1.8 5.5 137 137 A 9 G H5'' A 9 G H1' 1.0 1.8 5.5 138 138 A 9 G H1' A 9 G H2' 1.0 1.8 4.5 139 139 A 9 G H2' A 9 G H4' 1.0 1.8 4.5 140 140 A 9 G H5' A 9 G H2' 1.0 3.5 5.5 141 141 A 9 G H8 A 9 G H2' 1.0 3.5 4.5 142 142 A 9 G H1' A 9 G H3' 1.0 3.5 5.5 143 143 A 9 G H2' A 9 G H3' 1.0 1.8 3.5 144 144 A 9 G H4' A 9 G H3' 1.0 1.8 3.5 145 145 A 9 G H8 A 9 G H3' 1.0 1.8 5.5 146 146 A 9 G H8 A 9 G H4' 1.0 1.8 5.5 147 147 A 9 G H1' A 9 G H4' 1.0 2.5 4.5 148 148 A 9 G H5'' A 9 G H3' 1.0 1.8 4.5 149 149 A 9 G H5' A 9 G H3' 1.0 1.8 4.5 150 150 A 9 G H8 A 9 G H5' 1.0 1.8 6.5 151 151 A 9 G H5'' A 9 G H8 1.0 1.8 6.5 152 152 A 9 G H8 A 9 G H1' 1.0 1.8 3.5 153 153 A 9 G H2y A 9 G H5' 1.0 1.8 4.5 154 154 A 9 G H1' A 10 G H8 1.0 1.8 6.5 155 155 A 9 G H2' A 10 G H4' 1.0 1.8 5.5 156 156 A 9 G H2' A 10 G H5' 1.0 1.8 6.5 157 157 A 8 G H3' A 9 G H2' 1.0 1.8 5.5 158 158 A 9 G H3' A 10 G H1' 1.0 1.8 6.5 159 159 A 9 G H3' A 10 G H4' 1.0 1.8 5.5 160 160 A 9 G H3' A 10 G H8 1.0 1.8 4.5 161 161 A 8 G H3' A 9 G H3' 1.0 1.8 5.5 162 162 A 8 G H4' A 9 G H3' 1.0 1.8 5.5 163 163 A 9 G H5' A 10 G H1' 1.0 1.8 6.5 164 164 A 9 G H8 A 10 G H4' 1.0 1.8 5.5 165 165 A 9 G H3' A 10 G H1' 1.0 1.8 5.5 166 166 A 10 G H1' A 10 G H2' 1.0 1.8 4.5 167 167 A 10 G H8 A 10 G H2' 1.0 3.5 5.5 168 168 A 10 G H8 A 10 G H3' 1.0 3.5 5.5 169 169 A 10 G H4' A 10 G H1' 1.0 1.8 4.5 170 170 A 10 G H8 A 10 G H4' 1.0 3.5 5.5 171 171 A 10 G H5' A 10 G H1' 1.0 1.8 5.5 172 172 A 10 G H8 A 10 G H1' 1.0 3.5 5.5 173 173 A 10 G H8 A 10 G H5' 1.0 1.8 4.5 174 174 A 10 G H1 A 11 C H41 1.0 1.8 6.5 175 175 A 10 G H1 A 11 C H42 1.0 1.8 6.5 176 176 A 9 G H2' A 10 G H1' 1.0 4.5 6.5 177 177 A 9 G H4' A 10 G H1' 1.0 3.5 7.5 178 178 A 10 G H3' A 11 C H6 1.0 3.5 5.5 179 179 A 9 G H3' A 10 G H5' 1.0 1.8 5.5 180 180 A 10 G H8 A 11 C H6 1.0 4.5 6.5 181 181 A 9 G H4' A 10 G H8 1.0 4.5 6.5 182 182 A 9 G H5'' A 10 G H8 1.0 4.5 6.5 183 183 A 9 G H5' A 10 G H8 1.0 4.5 6.5 184 184 A 9 G H2y A 10 G H5' 1.0 1.8 6.5 185 185 A 11 C H1' A 11 C H4' 1.0 1.8 4.5 186 186 A 11 C H1' A 11 C H5' 1.0 1.8 5.5 187 187 A 11 C H6 A 11 C H1' 1.0 1.8 4.5 188 188 A 11 C H1' A 11 C H2' 1.0 1.8 3.5 189 189 A 11 C H1' A 11 C H5 1.0 1.8 5.5 190 190 A 11 C H5 A 11 C H3' 1.0 1.8 4.5 191 191 A 11 C H6 A 11 C H5' 1.0 1.8 4.5 192 192 A 11 C H6 A 11 C H2' 1.0 1.8 4.5 193 193 A 11 C H6 A 11 C H3' 1.0 1.8 3.5 194 194 A 11 C H1' A 12 PSU H6 1.0 1.8 4.5 195 195 A 11 C H2' A 12 PSU HN1 1.0 1.8 3.5 196 196 A 11 C H3' A 12 PSU HN1 1.0 1.8 3.5 197 197 A 11 C H41 A 12 PSU HN3 1.0 1.8 5.5 198 198 A 5 G H1 A 11 C H42 1.0 1.8 4.5 199 199 A 10 G H1' A 11 C H6 1.0 1.8 4.5 200 200 A 10 G H2' A 11 C H6 1.0 1.8 3.5 201 201 A 11 C H6 A 12 PSU H6 1.0 1.8 5.5 202 202 A 12 PSU H2' A 12 PSU H1' 1.0 1.8 3.5 203 203 A 12 PSU H6 A 12 PSU H2' 1.0 1.8 4.5 204 204 A 12 PSU H1' A 12 PSU H3' 1.0 1.8 4.5 205 205 A 12 PSU H6 A 12 PSU H3' 1.0 1.8 3.5 206 206 A 12 PSU H1' A 12 PSU H4' 1.0 1.8 4.5 207 207 A 12 PSU H6 A 12 PSU H4' 1.0 1.8 4.5 208 208 A 12 PSU H6 A 12 PSU H5' 1.0 1.8 4.5 209 209 A 12 PSU H6 A 12 PSU H1' 1.0 1.8 4.5 210 210 A 12 PSU H6 A 12 PSU H5'' 1.0 1.8 4.5 211 211 A 12 PSU H2' A 13 C H6 1.0 1.8 3.5 212 212 A 11 C H42 A 12 PSU HN3 1.0 1.8 6.5 213 213 A 12 PSU HN3 A 13 C H41 1.0 1.8 4.5 214 214 A 12 PSU H3' A 13 C H6 1.0 1.8 3.5 215 215 A 3 G H1 A 12 PSU HN3 1.0 1.8 4.5 216 216 A 4 A H2 A 12 PSU HN3 1.0 1.8 3.5 217 217 A 5 G H1 A 12 PSU HN3 1.0 1.8 4.5 218 218 A 11 C H2' A 12 PSU H6 1.0 1.8 3.5 219 219 A 11 C H3' A 12 PSU H6 1.0 1.8 3.5 220 220 A 13 C H2' A 13 C H1' 1.0 1.8 3.5 221 221 A 13 C H1' A 13 C H3' 1.0 1.8 4.5 222 222 A 13 C H6 A 13 C H3' 1.0 1.8 3.5 223 223 A 13 C H1' A 13 C H5' 1.0 1.8 5.5 224 224 A 13 C H2' A 13 C H5 1.0 1.8 5.5 225 225 A 13 C H6 A 13 C H5' 1.0 1.8 4.5 226 226 A 13 C H6 A 13 C H1' 1.0 1.8 4.5 227 227 A 13 C H6 A 13 C H2' 1.0 1.8 4.5 228 228 A 13 C H6 A 13 C H4' 1.0 1.8 4.5 229 229 A 12 PSU H2' A 13 C H1' 1.0 1.8 4.5 230 230 A 13 C H2' A 14 PSU HN1 1.0 1.8 3.5 231 231 A 13 C H3' A 14 PSU HN1 1.0 1.8 3.5 232 232 A 3 G H1 A 13 C H41 1.0 1.8 3.5 233 233 A 12 PSU HN3 A 13 C H42 1.0 1.8 4.5 234 234 A 3 G H1 A 13 C H42 1.0 1.8 4.5 235 235 A 12 PSU H3' A 13 C H5 1.0 1.8 4.5 236 236 A 12 PSU H6 A 13 C H5 1.0 1.8 6.5 237 237 A 13 C H5 A 14 PSU H6 1.0 1.8 6.5 238 238 A 3 G H1 A 13 C H5 1.0 1.8 5.5 239 239 A 4 A H2 A 13 C H5 1.0 1.8 6.5 240 240 A 12 PSU H1' A 13 C H6 1.0 1.8 6.5 241 241 A 12 PSU H6 A 13 C H6 1.0 1.8 5.5 242 242 A 14 PSU H6 A 14 PSU H1' 1.0 1.8 4.5 243 243 A 14 PSU H6 A 14 PSU H2' 1.0 1.8 4.5 244 244 A 14 PSU H6 A 14 PSU H4' 1.0 1.8 4.5 245 245 A 14 PSU H6 A 14 PSU H5'' 1.0 1.8 4.5 246 246 A 14 PSU H6 A 14 PSU H5' 1.0 1.8 6.5 247 247 A 14 PSU H6 A 14 PSU H3' 1.0 1.8 3.5 248 248 A 15 C H1' A 14 PSU H2' 1.0 1.8 5.5 249 249 A 14 PSU HN3 A 15 C H42 1.0 1.8 5.5 250 250 A 14 PSU H3' A 15 C H5 1.0 1.8 4.5 251 251 A 2 A H2 A 14 PSU HN3 1.0 1.8 3.5 252 252 A 3 G H1 A 14 PSU HN3 1.0 1.8 5.5 253 253 A 13 C H1' A 14 PSU H5' 1.0 1.8 6.5 254 254 A 13 C H1' A 14 PSU H6 1.0 1.8 4.5 255 255 A 13 C H2' A 14 PSU H6 1.0 1.8 3.5 256 256 A 13 C H6 A 14 PSU H6 1.0 1.8 5.5 257 257 A 14 PSU H6 A 15 C H5 1.0 1.8 5.5 258 258 A 15 C H1' A 15 C H5' 1.0 1.8 5.5 259 259 A 15 C H1' A 15 C H2' 1.0 1.8 3.5 260 260 A 15 C H2' A 15 C H6 1.0 1.8 3.5 261 261 A 15 C H5 A 15 C H3' 1.0 1.8 4.5 262 262 A 15 C H1' A 15 C H3' 1.0 1.8 4.5 263 263 A 15 C H1' A 15 C H6 1.0 1.8 4.5 264 264 A 15 C H6 A 15 C H3' 1.0 1.8 3.5 265 265 A 15 C H6 A 15 C H5'' 1.0 1.8 4.5 266 266 A 14 PSU HN3 A 15 C H41 1.0 1.8 5.5 267 267 A 15 C H41 A 1 G H1 1.0 1.8 4.5 268 268 A 15 C H42 A 1 G H1 1.0 1.8 4.5 269 269 A 14 PSU HN1 A 15 C H5 1.0 1.8 5.5 270 270 A 14 PSU H2' A 15 C H5 1.0 1.8 3.5 271 271 A 14 PSU H2' A 15 C H6 1.0 1.8 3.5 272 272 A 14 PSU H3' A 15 C H6 1.0 1.8 3.5 273 273 A 14 PSU H6 A 15 C H6 1.0 1.8 5.5 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 H1 A 15 C N3 1.0 1.69 2.09 2 2 A 15 C N3 A 1 G N1 1.0 2.70 3.10 3 3 A 15 C H41 A 1 G O6 1.0 1.75 2.15 4 4 A 1 G O6 A 15 C N4 1.0 2.75 3.15 5 5 A 1 G H2x A 15 C O2 1.0 1.75 2.15 6 6 A 15 C O2 A 1 G N2 1.0 2.75 3.15 7 7 A 14 PSU HN3 A 2 A N1 1.0 1.80 2.20 8 8 A 2 A N1 A 14 PSU N3 1.0 2.60 3.20 9 9 A 2 A H61 A 14 PSU O2 1.0 1.80 2.20 10 10 A 14 PSU O2 A 2 A N6 1.0 2.60 3.20 11 11 A 3 G H1 A 13 C N3 1.0 1.69 2.09 12 12 A 13 C N3 A 3 G N1 1.0 2.70 3.10 13 13 A 13 C H41 A 3 G O6 1.0 1.75 2.15 14 14 A 3 G O6 A 13 C N4 1.0 2.75 3.15 15 15 A 3 G H21 A 13 C O2 1.0 1.75 2.15 16 16 A 13 C O2 A 3 G N2 1.0 2.75 3.15 17 17 A 12 PSU HN3 A 4 A N1 1.0 1.80 2.20 18 18 A 4 A N1 A 12 PSU N3 1.0 2.60 3.20 19 19 A 4 A H61 A 12 PSU O2 1.0 1.80 2.20 20 20 A 12 PSU O2 A 4 A N6 1.0 2.60 3.20 21 21 A 5 G H1 A 11 C N3 1.0 1.69 2.09 22 22 A 11 C N3 A 5 G N1 1.0 2.70 3.10 23 23 A 11 C H41 A 5 G O6 1.0 1.75 2.15 24 24 A 5 G O6 A 11 C N4 1.0 2.75 3.15 25 25 A 5 G H21 A 11 C O2 1.0 1.75 2.15 26 26 A 11 C O2 A 5 G N2 1.0 2.75 3.15 27 27 A 10 G H1 A 6 PSU O4 1.0 1.69 2.09 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_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 A 1 G O4' A 1 G C1' A 1 G N9 A 1 G C4 1.0 -190.00 -130.00 CHI 2 2 A 2 A O4' A 2 A C1' A 2 A N9 A 2 A C4 1.0 -190.00 -130.00 CHI 3 3 A 3 G O4' A 3 G C1' A 3 G N9 A 3 G C4 1.0 -190.00 -130.00 CHI 4 4 A 4 A O4' A 4 A C1' A 4 A N9 A 4 A C4 1.0 -190.00 -130.00 CHI 5 5 A 5 G O4' A 5 G C1' A 5 G N9 A 5 G C4 1.0 -190.00 -130.00 CHI 6 6 A 6 PSU O4' A 6 PSU C1' A 6 PSU C5 A 6 PSU C4 1.0 -190.00 -130.00 . 7 7 A 7 PSU O4' A 7 PSU C1' A 7 PSU C5 A 7 PSU C4 1.0 -190.00 -130.00 . 8 8 A 8 G O4' A 8 G C1' A 8 G N9 A 8 G C4 1.0 -190.00 -130.00 CHI 9 9 A 9 G O4' A 9 G C1' A 9 G N9 A 9 G C4 1.0 30.00 90.00 CHI 10 10 A 10 G O4' A 10 G C1' A 10 G N9 A 10 G C4 1.0 -190.00 -130.00 CHI 11 11 A 11 C O4' A 11 C C1' A 11 C N1 A 11 C C2 1.0 -190.00 -130.00 CHI 12 12 A 12 PSU O4' A 12 PSU C1' A 12 PSU C5 A 12 PSU C4 1.0 -190.00 -130.00 . 13 13 A 13 C O4' A 13 C C1' A 13 C N1 A 13 C C2 1.0 -190.00 -130.00 CHI 14 14 A 14 PSU O4' A 14 PSU C1' A 14 PSU C5 A 14 PSU C4 1.0 -190.00 -130.00 . 15 15 A 15 C O4' A 15 C C1' A 15 C N1 A 15 C C2 1.0 -190.00 -130.00 CHI 16 16 A 1 G C5' A 1 G C4' A 1 G C3' A 1 G O3' 1.0 85.00 145.00 DELTA 17 17 A 2 A C5' A 2 A C4' A 2 A C3' A 2 A O3' 1.0 55.00 115.00 DELTA 18 18 A 3 G C5' A 3 G C4' A 3 G C3' A 3 G O3' 1.0 55.00 115.00 DELTA 19 19 A 4 A C5' A 4 A C4' A 4 A C3' A 4 A O3' 1.0 55.00 115.00 DELTA 20 20 A 5 G C5' A 5 G C4' A 5 G C3' A 5 G O3' 1.0 55.00 115.00 DELTA 21 21 A 6 PSU C5' A 6 PSU C4' A 6 PSU C3' A 6 PSU O3' 1.0 55.00 115.00 DELTA 22 22 A 7 PSU C5' A 7 PSU C4' A 7 PSU C3' A 7 PSU O3' 1.0 55.00 175.00 DELTA 23 23 A 8 G C5' A 8 G C4' A 8 G C3' A 8 G O3' 1.0 115.00 175.00 DELTA 24 24 A 9 G C5' A 9 G C4' A 9 G C3' A 9 G O3' 1.0 115.00 175.00 DELTA 25 25 A 10 G C5' A 10 G C4' A 10 G C3' A 10 G O3' 1.0 55.00 115.00 DELTA 26 26 A 11 C C5' A 11 C C4' A 11 C C3' A 11 C O3' 1.0 55.00 115.00 DELTA 27 27 A 12 PSU C5' A 12 PSU C4' A 12 PSU C3' A 12 PSU O3' 1.0 55.00 115.00 DELTA 28 28 A 13 C C5' A 13 C C4' A 13 C C3' A 13 C O3' 1.0 55.00 115.00 DELTA 29 29 A 14 PSU C5' A 14 PSU C4' A 14 PSU C3' A 14 PSU O3' 1.0 55.00 115.00 DELTA 30 30 A 15 C C5' A 15 C C4' A 15 C C3' A 15 C O3' 1.0 85.00 145.00 DELTA 31 31 A 1 G O3' A 2 A P A 2 A O5' A 2 A C5' 1.0 -92.10 -32.10 ALPHA 32 32 A 2 A O3' A 3 G P A 3 G O5' A 3 G C5' 1.0 -92.10 -32.10 ALPHA 33 33 A 3 G O3' A 4 A P A 4 A O5' A 4 A C5' 1.0 -92.10 -32.10 ALPHA 34 34 A 4 A O3' A 5 G P A 5 G O5' A 5 G C5' 1.0 -92.10 -32.10 ALPHA 35 35 A 11 C O3' A 12 PSU P A 12 PSU O5' A 12 PSU C5' 1.0 -92.10 -32.10 ALPHA 36 36 A 12 PSU O3' A 13 C P A 13 C O5' A 13 C C5' 1.0 -92.10 -32.10 ALPHA 37 37 A 13 C O3' A 14 PSU P A 14 PSU O5' A 14 PSU C5' 1.0 -92.10 -32.10 ALPHA 38 38 A 14 PSU O3' A 15 C P A 15 C O5' A 15 C C5' 1.0 -92.10 -32.10 ALPHA 39 39 A 2 A P A 2 A O5' A 2 A C5' A 2 A C4' 1.0 150.10 210.10 BETA 40 40 A 3 G P A 3 G O5' A 3 G C5' A 3 G C4' 1.0 150.10 210.10 BETA 41 41 A 4 A P A 4 A O5' A 4 A C5' A 4 A C4' 1.0 150.10 210.10 BETA 42 42 A 5 G P A 5 G O5' A 5 G C5' A 5 G C4' 1.0 150.10 210.10 BETA 43 43 A 10 G P A 10 G O5' A 10 G C5' A 10 G C4' 1.0 150.10 210.10 BETA 44 44 A 11 C P A 11 C O5' A 11 C C5' A 11 C C4' 1.0 150.10 210.10 BETA 45 45 A 12 PSU P A 12 PSU O5' A 12 PSU C5' A 12 PSU C4' 1.0 150.10 210.10 BETA 46 46 A 13 C P A 13 C O5' A 13 C C5' A 13 C C4' 1.0 150.10 210.10 BETA 47 47 A 14 PSU P A 14 PSU O5' A 14 PSU C5' A 14 PSU C4' 1.0 150.10 210.10 BETA 48 48 A 15 C P A 15 C O5' A 15 C C5' A 15 C C4' 1.0 150.10 210.10 BETA 49 49 A 1 G O5' A 1 G C5' A 1 G C4' A 1 G C3' 1.0 17.40 77.40 GAMMA 50 50 A 2 A O5' A 2 A C5' A 2 A C4' A 2 A C3' 1.0 17.40 77.40 GAMMA 51 51 A 3 G O5' A 3 G C5' A 3 G C4' A 3 G C3' 1.0 17.40 77.40 GAMMA 52 52 A 4 A O5' A 4 A C5' A 4 A C4' A 4 A C3' 1.0 17.40 77.40 GAMMA 53 53 A 5 G O5' A 5 G C5' A 5 G C4' A 5 G C3' 1.0 17.40 77.40 GAMMA 54 54 A 11 C O5' A 11 C C5' A 11 C C4' A 11 C C3' 1.0 17.40 77.40 GAMMA 55 55 A 12 PSU O5' A 12 PSU C5' A 12 PSU C4' A 12 PSU C3' 1.0 17.40 77.40 GAMMA 56 56 A 13 C O5' A 13 C C5' A 13 C C4' A 13 C C3' 1.0 17.40 77.40 GAMMA 57 57 A 14 PSU O5' A 14 PSU C5' A 14 PSU C4' A 14 PSU C3' 1.0 17.40 77.40 GAMMA 58 58 A 15 C O5' A 15 C C5' A 15 C C4' A 15 C C3' 1.0 17.40 77.40 GAMMA 59 59 A 1 G C3' A 1 G O3' A 2 A P A 2 A O5' 1.0 -104.70 -44.70 ZETA 60 60 A 2 A C3' A 2 A O3' A 3 G P A 3 G O5' 1.0 -104.70 -44.70 ZETA 61 61 A 3 G C3' A 3 G O3' A 4 A P A 4 A O5' 1.0 -104.70 -44.70 ZETA 62 62 A 4 A C3' A 4 A O3' A 5 G P A 5 G O5' 1.0 -104.70 -44.70 ZETA 63 63 A 11 C C3' A 11 C O3' A 12 PSU P A 12 PSU O5' 1.0 -104.70 -44.70 ZETA 64 64 A 12 PSU C3' A 12 PSU O3' A 13 C P A 13 C O5' 1.0 -104.70 -44.70 ZETA 65 65 A 13 C C3' A 13 C O3' A 14 PSU P A 14 PSU O5' 1.0 -104.70 -44.70 ZETA 66 66 A 14 PSU C3' A 14 PSU O3' A 15 C P A 15 C O5' 1.0 -104.70 -44.70 ZETA 67 67 A 1 G C1' A 1 G C2' A 1 G C3' A 1 G C4' 1.0 7.27 67.27 NU2 68 68 A 2 A C1' A 2 A C2' A 2 A C3' A 2 A C4' 1.0 7.27 67.27 NU2 69 69 A 3 G C1' A 3 G C2' A 3 G C3' A 3 G C4' 1.0 7.27 67.27 NU2 70 70 A 4 A C1' A 4 A C2' A 4 A C3' A 4 A C4' 1.0 7.27 67.27 NU2 71 71 A 5 G C1' A 5 G C2' A 5 G C3' A 5 G C4' 1.0 7.27 67.27 NU2 72 72 A 11 C C1' A 11 C C2' A 11 C C3' A 11 C C4' 1.0 7.27 67.27 NU2 73 73 A 12 PSU C1' A 12 PSU C2' A 12 PSU C3' A 12 PSU C4' 1.0 7.27 67.27 NU2 74 74 A 13 C C1' A 13 C C2' A 13 C C3' A 13 C C4' 1.0 7.27 67.27 NU2 75 75 A 14 PSU C1' A 14 PSU C2' A 14 PSU C3' A 14 PSU C4' 1.0 7.27 67.27 NU2 76 76 A 15 C C1' A 15 C C2' A 15 C C3' A 15 C C4' 1.0 7.27 67.27 NU2 77 77 A 1 G C4' A 1 G C3' A 1 G O3' A 2 A P 1.0 -194.01 -124.01 EPSILON 78 78 A 2 A C4' A 2 A C3' A 2 A O3' A 3 G P 1.0 -194.01 -124.01 EPSILON 79 79 A 3 G C4' A 3 G C3' A 3 G O3' A 4 A P 1.0 -194.01 -124.01 EPSILON 80 80 A 4 A C4' A 4 A C3' A 4 A O3' A 5 G P 1.0 -194.01 -124.01 EPSILON 81 81 A 5 G C4' A 5 G C3' A 5 G O3' A 6 PSU P 1.0 180.78 250.78 EPSILON 82 82 A 6 PSU C4' A 6 PSU C3' A 6 PSU O3' A 7 PSU P 1.0 -194.01 -124.01 EPSILON 83 83 A 8 G C4' A 8 G C3' A 8 G O3' A 9 G P 1.0 196.49 266.49 EPSILON 84 84 A 9 G C4' A 9 G C3' A 9 G O3' A 10 G P 1.0 178.01 248.01 EPSILON 85 85 A 10 G C4' A 10 G C3' A 10 G O3' A 11 C P 1.0 204.16 274.16 EPSILON 86 86 A 11 C C4' A 11 C C3' A 11 C O3' A 12 PSU P 1.0 -194.01 -124.01 EPSILON 87 87 A 12 PSU C4' A 12 PSU C3' A 12 PSU O3' A 13 C P 1.0 -194.01 -124.01 EPSILON 88 88 A 13 C C4' A 13 C C3' A 13 C O3' A 14 PSU P 1.0 -194.01 -124.01 EPSILON 89 89 A 14 PSU C4' A 14 PSU C3' A 14 PSU O3' A 15 C P 1.0 -194.01 -124.01 EPSILON stop_ save_ save_CNS/XPLOR_dipolar_coupling_5 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_5 _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 1 G H8 A 1 G C8 1.0 3.653 4.913 . 2 2 A 2 A H2 A 2 A C2 1.0 5.858 7.118 . 3 3 A 3 G H8 A 3 G C8 1.0 3.691 4.951 . 4 4 A 4 A H8 A 4 A C8 1.0 5.996 7.256 . 5 5 A 4 A H2 A 4 A C2 1.0 2.154 3.414 . 6 6 A 5 G H8 A 5 G C8 1.0 6.109 7.369 . 7 7 A 6 PSU H6 A 6 PSU C6 1.0 2.746 4.006 . 8 8 A 9 G H8 A 9 G C8 1.0 2.368 3.628 . 9 9 A 10 G H8 A 10 G C8 1.0 0.630 1.890 . 10 10 A 11 C H6 A 11 C C6 1.0 1.826 3.086 . 11 11 A 11 C H5 A 11 C C5 1.0 -0.756 0.504 . 12 12 A 12 PSU H6 A 12 PSU C6 1.0 5.593 6.853 . 13 13 A 13 C H6 A 13 C C6 1.0 4.484 5.744 . 14 14 A 13 C H5 A 13 C C5 1.0 0.466 1.726 . 15 15 A 14 PSU H6 A 14 PSU C6 1.0 3.351 4.611 . 16 16 A 15 C H6 A 15 C C6 1.0 5.505 6.765 . 17 17 A 15 C H5 A 15 C C5 1.0 1.348 2.608 . 18 18 A 2 A H1' A 2 A C1' 1.0 -3.536 -2.240 . 19 19 A 3 G H1' A 3 G C1' 1.0 -0.337 0.959 . 20 20 A 4 A H1' A 4 A C1' 1.0 3.807 5.103 . 21 21 A 5 G H1' A 5 G C1' 1.0 5.141 6.437 . 22 22 A 8 G H1' A 8 G C1' 1.0 -5.621 -4.325 . 23 23 A 9 G H1' A 9 G C1' 1.0 0.155 1.451 . 24 24 A 11 C H1' A 11 C C1' 1.0 -10.102 -8.806 . 25 25 A 13 C H1' A 13 C C1' 1.0 -0.247 1.049 . 26 26 A 14 PSU H1' A 14 PSU C1' 1.0 6.993 8.289 . 27 27 A 15 C H1' A 15 C C1' 1.0 5.167 6.463 . stop_ save_