data_nef_c25669_2n4j 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 2N4J 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 1 8XG O3' 1 2 8XU P 1 2 8XU O3' 1 3 8XG P 1 3 8XG O3' 1 4 8XU P 1 4 8XU O3' 1 5 8XA P 1 5 8XA O3' 1 6 8XC P 1 6 8XC O3' 1 7 8XA P 1 7 8XA O3' 1 8 8XC P 2 1 8XG O3' 2 2 8XU P 2 2 8XU O3' 2 3 8XG P 2 3 8XG O3' 2 4 8XU P 2 4 8XU O3' 2 5 8XA P 2 5 8XA O3' 2 6 8XC P 2 6 8XC O3' 2 7 8XA P 2 7 8XA O3' 2 8 8XC 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 8XG start . . 2 A 2 8XU middle . . 3 A 3 8XG middle . . 4 A 4 8XU middle . . 5 A 5 8XA middle . . 6 A 6 8XC middle . . 7 A 7 8XA middle . . 8 A 8 8XC end . . 9 B 9 8XG start . . 10 B 10 8XU middle . . 11 B 11 8XG middle . . 12 B 12 8XU middle . . 13 B 13 8XA middle . . 14 B 14 8XC middle . . 15 B 15 8XA middle . . 16 B 16 8XC 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 8XG H1 H 1 13.368 0.02 A 1 8XG H1' H 1 6.023 0.02 A 1 8XG H2' H 1 4.623 0.02 A 1 8XG H3' H 1 4.69 0.02 A 1 8XG H4' H 1 4.685 0.02 A 1 8XG H5' H 1 4.12 0.02 A 1 8XG H5'' H 1 4.114 0.02 A 1 8XG H8 H 1 7.944 0.02 A 1 8XG C1' C 13 92.397 0.3 A 1 8XG C2' C 13 79.271 0.3 A 1 8XG C3' C 13 79.855 0.3 A 1 8XG C4 C 13 152.073 0.3 A 1 8XG C4' C 13 85.605 0.3 A 1 8XG C5 C 13 117.46 0.3 A 1 8XG C5' C 13 60.987 0.3 A 1 8XG C8 C 13 138.2 0.3 A 2 8XU H1' H 1 5.825 0.02 A 2 8XU H2' H 1 4.654 0.02 A 2 8XU H3 H 1 14.011 0.02 A 2 8XU H3' H 1 4.539 0.02 A 2 8XU H4' H 1 4.332 0.02 A 2 8XU H5 H 1 5.866 0.02 A 2 8XU H5' H 1 4.021 0.02 A 2 8XU H5'' H 1 2.94 0.02 A 2 8XU H6 H 1 7.523 0.02 A 2 8XU C1' C 13 93.449 0.3 A 2 8XU C2 C 13 152.146 0.3 A 2 8XU C2' C 13 78.612 0.3 A 2 8XU C3' C 13 79.161 0.3 A 2 8XU C4 C 13 169.208 0.3 A 2 8XU C4' C 13 83.537 0.3 A 2 8XU C5 C 13 102.116 0.3 A 2 8XU C5' C 13 62.107 0.3 A 2 8XU C6 C 13 142.774 0.3 A 2 8XU P P 31 -0.705 0.03 A 3 8XG H1 H 1 13.128 0.02 A 3 8XG H1' H 1 5.713 0.02 A 3 8XG H2' H 1 4.277 0.02 A 3 8XG H21 H 1 8.802 0.02 A 3 8XG H22 H 1 8.812 0.02 A 3 8XG H3' H 1 4.583 0.02 A 3 8XG H4' H 1 4.621 0.02 A 3 8XG H5' H 1 4.269 0.02 A 3 8XG H5'' H 1 4.01 0.02 A 3 8XG H8 H 1 7.623 0.02 A 3 8XG C1' C 13 92.51 0.3 A 3 8XG C2' C 13 79.182 0.3 A 3 8XG C3' C 13 79.385 0.3 A 3 8XG C4 C 13 150.645 0.3 A 3 8XG C4' C 13 85.246 0.3 A 3 8XG C5 C 13 116.961 0.3 A 3 8XG C5' C 13 64.378 0.3 A 3 8XG C8 C 13 137.351 0.3 A 3 8XG P P 31 0.23 0.03 A 4 8XU H1' H 1 5.568 0.02 A 4 8XU H2' H 1 4.633 0.02 A 4 8XU H3 H 1 14.163 0.02 A 4 8XU H3' H 1 4.442 0.02 A 4 8XU H4' H 1 4.136 0.02 A 4 8XU H5 H 1 5.795 0.02 A 4 8XU H5' H 1 3.763 0.02 A 4 8XU H5'' H 1 2.276 0.02 A 4 8XU H6 H 1 7.277 0.02 A 4 8XU C1' C 13 93.336 0.3 A 4 8XU C2 C 13 151.887 0.3 A 4 8XU C2' C 13 79.258 0.3 A 4 8XU C3' C 13 78.562 0.3 A 4 8XU C4 C 13 169.24 0.3 A 4 8XU C4' C 13 83.073 0.3 A 4 8XU C5 C 13 101.921 0.3 A 4 8XU C5' C 13 60.763 0.3 A 4 8XU C6 C 13 142.602 0.3 A 4 8XU P P 31 -1.332 0.03 A 5 8XA H1' H 1 5.953 0.02 A 5 8XA H2 H 1 7.953 0.02 A 5 8XA H2' H 1 4.358 0.02 A 5 8XA H3' H 1 4.591 0.02 A 5 8XA H4' H 1 4.668 0.02 A 5 8XA H5' H 1 4.249 0.02 A 5 8XA H5'' H 1 4.025 0.02 A 5 8XA H61 H 1 7.684 0.02 A 5 8XA H62 H 1 6.71 0.02 A 5 8XA H8 H 1 7.972 0.02 A 5 8XA C1' C 13 92.753 0.3 A 5 8XA C2 C 13 151.619 0.3 A 5 8XA C2' C 13 79.179 0.3 A 5 8XA C3' C 13 79.624 0.3 A 5 8XA C4 C 13 147.55 0.3 A 5 8XA C4' C 13 85.26 0.3 A 5 8XA C5 C 13 119.665 0.3 A 5 8XA C5' C 13 64.415 0.3 A 5 8XA C6 C 13 156.247 0.3 A 5 8XA C8 C 13 139.987 0.3 A 5 8XA P P 31 0.497 0.03 A 6 8XC H1' H 1 5.224 0.02 A 6 8XC H2' H 1 4.466 0.02 A 6 8XC H3' H 1 4.323 0.02 A 6 8XC H4' H 1 3.907 0.02 A 6 8XC H41 H 1 8.302 0.02 A 6 8XC H42 H 1 7.103 0.02 A 6 8XC H5 H 1 5.881 0.02 A 6 8XC H5' H 1 3.65 0.02 A 6 8XC H5'' H 1 2.135 0.02 A 6 8XC H6 H 1 7.107 0.02 A 6 8XC C1' C 13 93.449 0.3 A 6 8XC C2 C 13 158.232 0.3 A 6 8XC C2' C 13 78.921 0.3 A 6 8XC C3' C 13 78.562 0.3 A 6 8XC C4 C 13 167.597 0.3 A 6 8XC C4' C 13 82.721 0.3 A 6 8XC C5 C 13 96.106 0.3 A 6 8XC C5' C 13 61.212 0.3 A 6 8XC C6 C 13 142.248 0.3 A 6 8XC P P 31 -1.094 0.03 A 7 8XA H1' H 1 6.12 0.02 A 7 8XA H2 H 1 8.079 0.02 A 7 8XA H2' H 1 4.581 0.02 A 7 8XA H3' H 1 4.559 0.02 A 7 8XA H4' H 1 4.587 0.02 A 7 8XA H5' H 1 4.191 0.02 A 7 8XA H5'' H 1 3.807 0.02 A 7 8XA H8 H 1 7.924 0.02 A 7 8XA C1' C 13 92.874 0.3 A 7 8XA C2 C 13 151.779 0.3 A 7 8XA C2' C 13 79.181 0.3 A 7 8XA C3' C 13 79.621 0.3 A 7 8XA C4 C 13 147.899 0.3 A 7 8XA C4' C 13 84.78 0.3 A 7 8XA C5 C 13 119.761 0.3 A 7 8XA C5' C 13 64.032 0.3 A 7 8XA C6 C 13 156.477 0.3 A 7 8XA C8 C 13 140.217 0.3 A 7 8XA P P 31 0.039 0.03 A 8 8XC H1' H 1 5.239 0.02 A 8 8XC H2' H 1 4.273 0.02 A 8 8XC H3' H 1 4.193 0.02 A 8 8XC H4' H 1 4.087 0.02 A 8 8XC H41 H 1 8.15 0.02 A 8 8XC H42 H 1 7.035 0.02 A 8 8XC H5 H 1 5.776 0.02 A 8 8XC H5' H 1 3.86 0.02 A 8 8XC H5'' H 1 2.904 0.02 A 8 8XC H6 H 1 7.069 0.02 A 8 8XC C1' C 13 93.798 0.3 A 8 8XC C2 C 13 158.64 0.3 A 8 8XC C2' C 13 80.759 0.3 A 8 8XC C3' C 13 77.043 0.3 A 8 8XC C4 C 13 167.871 0.3 A 8 8XC C4' C 13 84.213 0.3 A 8 8XC C5 C 13 96.139 0.3 A 8 8XC C5' C 13 63.561 0.3 A 8 8XC C6 C 13 142.575 0.3 A 8 8XC P P 31 -0.317 0.03 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 save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin noe save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_2 save_