data_nef_c18184_2lny 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 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 MET start . . 2 A 2 ALA middle . . 3 A 3 ALA middle . . 4 A 4 VAL middle . . 5 A 5 ALA middle . . 6 A 6 GLY middle . false 7 A 7 LEU middle . . 8 A 8 TYR middle . . 9 A 9 GLY middle . false 10 A 10 LEU middle . . 11 A 11 GLY middle . false 12 A 12 GLU middle . . 13 A 13 ASP middle . . 14 A 14 ARG middle . . 15 A 15 GLN middle . . 16 A 16 HIS middle . . 17 A 17 ARG middle . . 18 A 18 LYS middle . . 19 A 19 LYS middle . . 20 A 20 GLN 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 MET CA C 13 54.8 . A 1 MET CB C 13 32.3 . A 1 MET CE C 13 17.2 . A 1 MET CG C 13 30.7 . A 2 ALA C C 13 175.4 . A 2 ALA CA C 13 51.2 . A 2 ALA CB C 13 23.5 . A 2 ALA N N 15 123.4 . A 3 ALA C C 13 175.4 . A 3 ALA CA C 13 51.1 . A 3 ALA CB C 13 23.6 . A 3 ALA N N 15 120.7 . A 4 VAL C C 13 172.6 . A 4 VAL CA C 13 59.5 . A 4 VAL CB C 13 35.9 . A 4 VAL CGx C 13 21.2 . A 4 VAL N N 15 115.8 . A 5 ALA C C 13 176.0 . A 5 ALA CA C 13 51.2 . A 5 ALA CB C 13 23.6 . A 5 ALA N N 15 124.1 . A 6 GLY C C 13 169.7 . A 6 GLY CA C 13 47.2 . A 6 GLY N N 15 106.4 . A 7 LEU C C 13 173.4 . A 7 LEU CA C 13 52.9 . A 7 LEU CB C 13 46.8 . A 7 LEU CDx C 13 23.2 . A 7 LEU CDy C 13 23.2 . A 7 LEU CG C 13 26.8 . A 7 LEU N N 15 116.1 . A 8 TYR C C 13 175.2 . A 8 TYR CA C 13 55.7 . A 8 TYR CB C 13 46.8 . A 8 TYR N N 15 116.2 . A 9 GLY C C 13 170.5 . A 9 GLY CA C 13 46.0 . A 9 GLY N N 15 104.5 . A 10 LEU C C 13 175.3 . A 10 LEU CA C 13 54.7 . A 10 LEU CB C 13 45.7 . A 10 LEU CDx C 13 23.7 . A 10 LEU CDy C 13 23.7 . A 10 LEU CG C 13 26.6 . A 10 LEU N N 15 119.5 . A 11 GLY C C 13 170.6 . A 11 GLY CA C 13 46.1 . A 11 GLY N N 15 104.9 . A 12 GLU C C 13 171.7 . A 12 GLU CA C 13 54.6 . A 12 GLU CB C 13 29.8 . A 12 GLU CD C 13 180.0 . A 12 GLU CG C 13 34.0 . A 12 GLU N N 15 122.4 . 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 2 ALA H A 1 MET HA 1.0 1.2 3.2 2 2 A 3 ALA H A 2 ALA HA 1.0 1.2 3.2 3 3 A 4 VAL H A 3 ALA HA 1.0 1.2 3.2 4 4 A 5 ALA H A 4 VAL HA 1.0 1.2 3.2 5 5 A 6 GLY H A 5 ALA HA 1.0 1.2 3.2 6 6 A 7 LEU H A 6 GLY HAx 1.0 1.2 3.2 7 6 A 7 LEU H A 6 GLY HAy 1.0 1.2 3.2 8 7 A 9 GLY H A 8 TYR HA 1.0 1.2 3.2 9 8 A 10 LEU H A 9 GLY HAx 1.0 1.2 3.2 10 8 A 10 LEU H A 9 GLY HAy 1.0 1.2 3.2 11 9 A 12 GLU H A 11 GLY HAx 1.0 1.2 3.2 12 9 A 12 GLU H A 11 GLY HAy 1.0 1.2 3.2 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 undefined _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 2 ALA CA A 11 GLY CA 1.0 3.0 5.0 2 2 A 4 VAL CA A 9 GLY CA 1.0 3.0 5.0 3 3 A 8 TYR CDx A 3 ALA CA 1.0 4.0 6.0 4 4 A 8 TYR CDx A 10 LEU CG 1.0 4.5 6.5 5 5 A 10 LEU CG A 8 TYR CEx 1.0 4.0 6.0 stop_ 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 _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 2 ALA HA A 11 GLY HAx 1.0 1.0 3.0 2 1 A 2 ALA HA A 11 GLY HAy 1.0 1.0 3.0 3 2 A 4 VAL HA A 9 GLY HAx 1.0 1.0 3.0 4 2 A 4 VAL HA A 9 GLY HAy 1.0 1.0 3.0 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_5 _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 4 VAL H A 2 ALA O 1.0 2.0 3.0 2 2 A 1 MET O A 12 GLU N 1.0 2.0 4.0 3 3 A 3 ALA O A 10 LEU N 1.0 2.0 4.0 4 4 A 10 LEU O A 3 ALA N 1.0 2.0 4.0 5 5 A 8 TYR O A 5 ALA N 1.0 2.0 4.0 stop_ save_ save_CNS/XPLOR_dihedral_6 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_6 _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 MET C A 2 ALA N A 2 ALA CA A 2 ALA C 1.0 -143.95 -103.95 PHI 2 2 A 2 ALA C A 3 ALA N A 3 ALA CA A 3 ALA C 1.0 -156.22 -116.22 PHI 3 3 A 3 ALA C A 4 VAL N A 4 VAL CA A 4 VAL C 1.0 -159.33 -119.33 PHI 4 4 A 4 VAL C A 5 ALA N A 5 ALA CA A 5 ALA C 1.0 -156.69 -116.69 PHI 5 5 A 5 ALA C A 6 GLY N A 6 GLY CA A 6 GLY C 1.0 20.00 100.00 PHI 6 6 A 6 GLY C A 7 LEU N A 7 LEU CA A 7 LEU C 1.0 -120.00 -40.00 PHI 7 7 A 7 LEU C A 8 TYR N A 8 TYR CA A 8 TYR C 1.0 -157.91 -117.91 PHI 8 8 A 8 TYR C A 9 GLY N A 9 GLY CA A 9 GLY C 1.0 -183.42 -143.42 PHI 9 9 A 9 GLY C A 10 LEU N A 10 LEU CA A 10 LEU C 1.0 -167.75 -127.75 PHI 10 10 A 10 LEU C A 11 GLY N A 11 GLY CA A 11 GLY C 1.0 -156.59 -116.59 PHI 11 11 A 11 GLY C A 12 GLU N A 12 GLU CA A 12 GLU C 1.0 -180.00 -100.00 PHI 12 12 A 2 ALA N A 2 ALA CA A 2 ALA C A 3 ALA N 1.0 127.65 167.65 PSI 13 13 A 3 ALA N A 3 ALA CA A 3 ALA C A 4 VAL N 1.0 133.29 173.29 PSI 14 14 A 4 VAL N A 4 VAL CA A 4 VAL C A 5 ALA N 1.0 133.07 173.07 PSI 15 15 A 5 ALA N A 5 ALA CA A 5 ALA C A 6 GLY N 1.0 138.42 178.42 PSI 16 16 A 6 GLY N A 6 GLY CA A 6 GLY C A 7 LEU N 1.0 -160.00 -80.00 PSI 17 17 A 7 LEU N A 7 LEU CA A 7 LEU C A 8 TYR N 1.0 -40.00 40.00 PSI 18 18 A 9 GLY N A 9 GLY CA A 9 GLY C A 10 LEU N 1.0 145.33 185.33 PSI 19 19 A 10 LEU N A 10 LEU CA A 10 LEU C A 11 GLY N 1.0 140.22 180.22 PSI 20 20 A 11 GLY N A 11 GLY CA A 11 GLY C A 12 GLU N 1.0 95.29 135.29 PSI 21 21 A 11 GLY N A 11 GLY CA A 11 GLY C A 12 GLU N 1.0 95.00 175.00 PSI stop_ save_