data_nef_c18875_2m1p 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 2lye BMRB 18722 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 3 CYS SG 1 16 CYS SG 1 7 CYS SG 1 12 CYS SG 1 4 ARG C 1 5 ABA N 1 5 ABA C 1 6 VAL N 1 13 ARG C 1 14 ABA N 1 14 ABA C 1 15 VAL N 1 1 GLY N 1 18 ARG C 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 GLY cyclic . false 2 A 2 VAL middle . . 3 A 3 CYS middle -HG . 4 A 4 ARG middle . . 5 A 5 ABA middle . . 6 A 6 VAL middle . . 7 A 7 CYS middle -HG . 8 A 8 ARG middle . . 9 A 9 ARG middle . . 10 A 10 GLY middle . false 11 A 11 VAL middle . . 12 A 12 CYS middle -HG . 13 A 13 ARG middle . . 14 A 14 ABA middle . . 15 A 15 VAL middle . . 16 A 16 CYS middle -HG . 17 A 17 ARG middle . . 18 A 18 ARG cyclic . . 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 GLY H H 1 8.688 0.002 A 1 GLY HAx H 1 3.602 0.003 A 1 GLY HAy H 1 4.176 0.004 A 1 GLY CA C 13 45.255 0.01 A 2 VAL H H 1 7.800 0.002 A 2 VAL HA H 1 4.275 0.002 A 2 VAL HB H 1 2.132 0.009 A 2 VAL HGx% H 1 0.938 0.003 A 2 VAL HGy% H 1 0.938 0.003 A 2 VAL CA C 13 61.930 0.01 A 2 VAL CB C 13 33.240 0.01 A 2 VAL CGx C 13 20.894 0.01 A 2 VAL CGy C 13 20.894 0.01 A 3 CYS H H 1 9.072 0.01 A 3 CYS HA H 1 5.481 0.002 A 3 CYS HBy H 1 2.974 0.003 A 3 CYS HBx H 1 2.584 0.002 A 3 CYS CA C 13 55.307 0.01 A 3 CYS CB C 13 46.464 0.034 A 4 ARG H H 1 8.701 0.001 A 4 ARG HA H 1 4.650 0.003 A 4 ARG HBy H 1 1.834 0.001 A 4 ARG HBx H 1 1.766 0.002 A 4 ARG HDx H 1 3.188 0.002 A 4 ARG HDy H 1 3.188 0.002 A 4 ARG HE H 1 7.137 0.01 A 4 ARG HGy H 1 1.600 0.012 A 4 ARG HGx H 1 1.535 0.009 A 4 ARG CA C 13 54.333 0.01 A 4 ARG CB C 13 33.653 0.016 A 4 ARG CD C 13 43.370 0.01 A 4 ARG CG C 13 27.079 0.01 A 5 ABA H H 1 8.693 0.002 A 5 ABA HA1 H 1 4.559 0.004 A 5 ABA HA2 H 1 4.559 0.004 A 5 ABA HB1 H 1 1.663 0.01 A 5 ABA HB2 H 1 1.663 0.01 A 5 ABA HG1 H 1 0.814 0.002 A 5 ABA HG2 H 1 0.814 0.002 A 5 ABA CA C 13 57.902 0.01 A 5 ABA CB C 13 27.157 0.01 A 6 VAL H H 1 8.989 0.001 A 6 VAL HA H 1 4.302 0.003 A 6 VAL HB H 1 2.007 0.001 A 6 VAL HGx% H 1 0.929 0.006 A 6 VAL HGy% H 1 0.929 0.006 A 6 VAL CA C 13 61.833 0.01 A 6 VAL CB C 13 34.385 0.01 A 6 VAL CGx C 13 20.894 0.01 A 6 VAL CGy C 13 20.894 0.01 A 7 CYS H H 1 9.093 0.001 A 7 CYS HA H 1 5.583 0.002 A 7 CYS HBy H 1 3.087 0.002 A 7 CYS HBx H 1 2.650 0.002 A 7 CYS CA C 13 55.198 0.01 A 7 CYS CB C 13 47.739 0.01 A 8 ARG H H 1 8.684 0.003 A 8 ARG HA H 1 4.507 0.001 A 8 ARG HBx H 1 1.777 0.001 A 8 ARG HBy H 1 1.777 0.001 A 8 ARG HDx H 1 3.207 0.003 A 8 ARG HDy H 1 3.207 0.003 A 8 ARG HE H 1 7.225 0.01 A 8 ARG HGx H 1 1.519 0.001 A 8 ARG HGy H 1 1.625 0.002 A 8 ARG CA C 13 55.577 0.01 A 8 ARG CB C 13 32.596 0.01 A 8 ARG CD C 13 43.265 0.01 A 8 ARG CG C 13 27.139 0.001 A 9 ARG H H 1 9.602 0.001 A 9 ARG HA H 1 3.911 0.003 A 9 ARG HBy H 1 2.085 0.008 A 9 ARG HBx H 1 1.830 0.002 A 9 ARG HDx H 1 3.226 0.002 A 9 ARG HDy H 1 3.226 0.002 A 9 ARG HE H 1 7.230 0.01 A 9 ARG HGx H 1 1.633 0.001 A 9 ARG HGy H 1 1.633 0.001 A 9 ARG CA C 13 57.091 0.01 A 9 ARG CB C 13 28.163 0.01 A 9 ARG CD C 13 43.300 0.01 A 9 ARG CG C 13 27.774 0.01 A 10 GLY H H 1 8.688 0.002 A 10 GLY HAx H 1 3.602 0.003 A 10 GLY HAy H 1 4.176 0.004 A 10 GLY CA C 13 45.255 0.01 A 11 VAL H H 1 7.800 0.002 A 11 VAL HA H 1 4.275 0.002 A 11 VAL HB H 1 2.132 0.009 A 11 VAL HGx% H 1 0.938 0.003 A 11 VAL HGy% H 1 0.938 0.003 A 11 VAL CA C 13 61.930 0.01 A 11 VAL CB C 13 33.240 0.01 A 11 VAL CGx C 13 20.894 0.01 A 11 VAL CGy C 13 20.894 0.01 A 12 CYS H H 1 9.072 0.01 A 12 CYS HA H 1 5.481 0.002 A 12 CYS HBy H 1 2.974 0.003 A 12 CYS HBx H 1 2.584 0.002 A 12 CYS CA C 13 55.307 0.01 A 12 CYS CB C 13 46.464 0.034 A 13 ARG H H 1 8.701 0.001 A 13 ARG HA H 1 4.650 0.003 A 13 ARG HBy H 1 1.834 0.001 A 13 ARG HBx H 1 1.766 0.002 A 13 ARG HDx H 1 3.188 0.002 A 13 ARG HDy H 1 3.188 0.002 A 13 ARG HE H 1 7.137 0.01 A 13 ARG HGy H 1 1.600 0.012 A 13 ARG HGx H 1 1.535 0.009 A 13 ARG CA C 13 54.333 0.01 A 13 ARG CB C 13 33.653 0.016 A 13 ARG CD C 13 43.370 0.01 A 13 ARG CG C 13 27.079 0.01 A 14 ABA H H 1 8.693 0.002 A 14 ABA HA1 H 1 4.559 0.004 A 14 ABA HA2 H 1 4.559 0.004 A 14 ABA HB1 H 1 1.663 0.01 A 14 ABA HB2 H 1 1.663 0.01 A 14 ABA HG1 H 1 0.814 0.002 A 14 ABA HG2 H 1 0.814 0.002 A 14 ABA CA C 13 57.902 0.01 A 14 ABA CB C 13 27.157 0.01 A 15 VAL H H 1 8.989 0.001 A 15 VAL HA H 1 4.302 0.003 A 15 VAL HB H 1 2.007 0.001 A 15 VAL HGx% H 1 0.929 0.006 A 15 VAL HGy% H 1 0.929 0.006 A 15 VAL CA C 13 61.833 0.01 A 15 VAL CB C 13 34.385 0.01 A 15 VAL CGx C 13 20.894 0.01 A 15 VAL CGy C 13 20.894 0.01 A 16 CYS H H 1 9.093 0.001 A 16 CYS HA H 1 5.583 0.002 A 16 CYS HBy H 1 3.087 0.002 A 16 CYS HBx H 1 2.650 0.002 A 16 CYS CA C 13 55.198 0.01 A 16 CYS CB C 13 47.739 0.01 A 17 ARG H H 1 8.684 0.003 A 17 ARG HA H 1 4.507 0.001 A 17 ARG HBx H 1 1.777 0.001 A 17 ARG HBy H 1 1.777 0.001 A 17 ARG HDx H 1 3.207 0.003 A 17 ARG HDy H 1 3.207 0.003 A 17 ARG HE H 1 7.225 0.01 A 17 ARG HGx H 1 1.519 0.001 A 17 ARG HGy H 1 1.625 0.002 A 17 ARG CA C 13 55.577 0.01 A 17 ARG CB C 13 32.596 0.01 A 17 ARG CD C 13 43.265 0.01 A 17 ARG CG C 13 27.139 0.001 A 18 ARG H H 1 9.602 0.001 A 18 ARG HA H 1 3.911 0.003 A 18 ARG HBy H 1 2.085 0.008 A 18 ARG HBx H 1 1.830 0.002 A 18 ARG HDx H 1 3.226 0.002 A 18 ARG HDy H 1 3.226 0.002 A 18 ARG HE H 1 7.230 0.01 A 18 ARG HGx H 1 1.633 0.001 A 18 ARG HGy H 1 1.633 0.001 A 18 ARG CA C 13 57.091 0.01 A 18 ARG CB C 13 28.163 0.01 A 18 ARG CD C 13 43.300 0.01 A 18 ARG CG C 13 27.774 0.01 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 11 VAL H A 11 VAL HB 1.0 1.8 3.70 2 2 A 9 ARG H A 9 ARG HA 1.0 1.8 2.65 3 3 A 8 ARG H A 8 ARG HBx 1.0 1.8 4.15 4 3 A 8 ARG H A 8 ARG HBy 1.0 1.8 4.15 5 4 A 7 CYS H A 7 CYS HBy 1.0 1.8 3.86 6 5 A 12 CYS H A 12 CYS HBy 1.0 1.8 3.61 7 6 A 12 CYS H A 12 CYS HBx 1.0 1.8 4.17 8 7 A 6 VAL H A 6 VAL HB 1.0 1.8 3.73 9 8 A 5 ABA H A 5 ABA HB2 1.0 1.8 3.87 10 8 A 5 ABA H A 5 ABA HBy 1.0 1.8 3.87 11 9 A 13 ARG H A 13 ARG HBy 1.0 1.8 3.24 12 10 A 13 ARG H A 13 ARG HBx 1.0 1.8 2.96 13 11 A 11 VAL H A 10 GLY H 1.0 1.8 2.56 14 12 A 9 ARG HA A 10 GLY H 1.0 1.8 2.80 15 13 A 12 CYS H A 11 VAL HA 1.0 1.8 2.74 16 14 A 11 VAL HB A 8 ARG H 1.0 1.8 4.60 17 15 A 13 ARG H A 12 CYS HA 1.0 1.8 2.49 18 16 A 8 ARG H A 12 CYS HA 1.0 1.8 3.17 19 17 A 12 CYS HA A 7 CYS HA 1.0 2.0 2.40 20 18 A 12 CYS HBx A 12 CYS HA 1.0 1.8 2.96 21 19 A 12 CYS HBy A 13 ARG H 1.0 1.8 4.01 22 20 A 12 CYS HBx A 13 ARG H 1.0 1.8 3.58 23 21 A 13 ARG H A 7 CYS HA 1.0 1.8 2.77 24 22 A 5 ABA H A 4 ARG HA 1.0 1.8 2.40 25 23 A 6 VAL H A 5 ABA HA 1.0 1.8 2.80 26 24 A 6 VAL H A 5 ABA HB2 1.0 1.8 6.38 27 24 A 6 VAL H A 5 ABA HBy 1.0 1.8 6.38 28 25 A 6 VAL H A 13 ARG H 1.0 1.8 3.83 29 26 A 7 CYS H A 6 VAL HA 1.0 1.8 2.87 30 27 A 8 ARG H A 7 CYS HA 1.0 1.8 2.52 31 28 A 8 ARG H A 7 CYS HBy 1.0 1.8 4.17 32 29 A 8 ARG H A 7 CYS HBx 1.0 1.8 3.45 33 30 A 7 CYS HA A 7 CYS HBx 1.0 1.8 2.99 34 31 A 11 VAL H A 8 ARG H 1.0 1.8 2.83 35 32 A 9 ARG H A 8 ARG HA 1.0 1.8 2.49 36 33 A 9 ARG H A 10 GLY H 1.0 1.8 3.48 37 34 A 9 ARG HA A 9 ARG HBy 1.0 1.8 3.02 38 35 A 9 ARG H A 9 ARG HDx 1.0 1.8 6.38 39 35 A 9 ARG H A 9 ARG HDy 1.0 1.8 6.38 40 36 A 9 ARG H A 9 ARG HGx 1.0 1.8 6.17 41 36 A 9 ARG H A 9 ARG HGy 1.0 1.8 6.17 42 37 A 8 ARG H A 8 ARG HDx 1.0 1.8 6.38 43 37 A 8 ARG H A 8 ARG HDy 1.0 1.8 6.38 44 38 A 13 ARG H A 13 ARG HDx 1.0 1.8 6.38 45 38 A 13 ARG H A 13 ARG HDy 1.0 1.8 6.38 46 39 A 9 ARG HA A 9 ARG HE 1.0 1.8 5.50 47 40 A 8 ARG HA A 8 ARG HE 1.0 1.8 5.50 48 41 A 13 ARG HA A 13 ARG HE 1.0 1.8 5.50 49 42 A 13 ARG H A 13 ARG HGy 1.0 1.8 4.85 50 43 A 13 ARG H A 13 ARG HGx 1.0 1.8 4.85 51 44 A 13 ARG HBx A 13 ARG HGy 1.0 1.8 2.40 52 45 A 13 ARG HBx A 13 ARG HGx 1.0 1.8 2.40 53 46 A 11 VAL H A 11 VAL HGx% 1.0 1.8 7.60 54 46 A 11 VAL H A 11 VAL HGy% 1.0 1.8 7.60 55 47 A 5 ABA H A 5 ABA HG1 1.0 1.8 5.43 56 48 A 6 VAL H A 6 VAL HGx% 1.0 1.8 7.60 57 48 A 6 VAL H A 6 VAL HGy% 1.0 1.8 7.60 58 49 A 8 ARG H A 11 VAL HGx% 1.0 1.8 6.58 59 49 A 8 ARG H A 11 VAL HGy% 1.0 1.8 6.58 60 50 A 12 CYS H A 11 VAL HGx% 1.0 1.8 7.60 61 50 A 12 CYS H A 11 VAL HGy% 1.0 1.8 7.60 62 51 A 6 VAL H A 5 ABA HG1 1.0 1.8 6.52 63 52 A 7 CYS H A 6 VAL HGx% 1.0 1.8 7.60 64 52 A 7 CYS H A 6 VAL HGy% 1.0 1.8 7.60 65 53 A 13 ARG H A 6 VAL HGx% 1.0 1.8 7.60 66 53 A 13 ARG H A 6 VAL HGy% 1.0 1.8 7.60 67 54 A 12 CYS HBx A 5 ABA HG1 1.0 1.8 6.52 68 55 A 12 CYS HBy A 5 ABA HG1 1.0 1.8 5.31 69 56 A 8 ARG H A 8 ARG HGx 1.0 1.8 3.23 70 56 A 8 ARG H A 8 ARG HGy 1.0 1.8 3.23 71 57 A 10 GLY H A 10 GLY HAx 1.0 1.8 2.41 72 57 A 10 GLY H A 10 GLY HAy 1.0 1.8 2.41 73 58 A 13 ARG H A 13 ARG HGx 1.0 1.8 4.15 74 58 A 13 ARG H A 13 ARG HGy 1.0 1.8 4.15 75 59 A 2 VAL H A 2 VAL HB 1.0 1.8 3.70 76 60 A 18 ARG H A 18 ARG HA 1.0 1.8 2.65 77 61 A 17 ARG H A 17 ARG HBx 1.0 1.8 4.15 78 61 A 17 ARG H A 17 ARG HBy 1.0 1.8 4.15 79 62 A 16 CYS H A 16 CYS HBy 1.0 1.8 3.86 80 63 A 3 CYS H A 3 CYS HBy 1.0 1.8 3.61 81 64 A 3 CYS H A 3 CYS HBx 1.0 1.8 4.17 82 65 A 15 VAL H A 15 VAL HB 1.0 1.8 3.73 83 66 A 14 ABA H A 14 ABA HB2 1.0 1.8 3.87 84 66 A 14 ABA H A 14 ABA HBy 1.0 1.8 3.87 85 67 A 4 ARG H A 4 ARG HBy 1.0 1.8 3.24 86 68 A 4 ARG H A 4 ARG HBx 1.0 1.8 2.96 87 69 A 3 CYS H A 2 VAL HA 1.0 1.8 2.74 88 70 A 2 VAL HB A 17 ARG H 1.0 1.8 4.60 89 71 A 4 ARG H A 3 CYS HA 1.0 1.8 2.49 90 72 A 17 ARG H A 3 CYS HA 1.0 1.8 3.17 91 73 A 3 CYS HA A 16 CYS HA 1.0 2.0 2.40 92 74 A 3 CYS HBx A 3 CYS HA 1.0 1.8 2.96 93 75 A 3 CYS HBy A 4 ARG H 1.0 1.8 4.01 94 76 A 3 CYS HBx A 4 ARG H 1.0 1.8 3.58 95 77 A 4 ARG H A 16 CYS HA 1.0 1.8 2.77 96 78 A 13 ARG HA A 14 ABA H 1.0 1.8 2.40 97 79 A 15 VAL H A 14 ABA HA 1.0 1.8 2.80 98 80 A 15 VAL H A 14 ABA HB2 1.0 1.8 6.38 99 80 A 15 VAL H A 14 ABA HBy 1.0 1.8 6.38 100 81 A 15 VAL H A 4 ARG H 1.0 1.8 3.83 101 82 A 16 CYS H A 15 VAL HA 1.0 1.8 2.87 102 83 A 17 ARG H A 16 CYS HA 1.0 1.8 2.52 103 84 A 17 ARG H A 16 CYS HBy 1.0 1.8 4.17 104 85 A 17 ARG H A 16 CYS HBx 1.0 1.8 3.45 105 86 A 16 CYS HA A 16 CYS HBx 1.0 1.8 2.99 106 87 A 2 VAL H A 17 ARG H 1.0 1.8 2.83 107 88 A 18 ARG H A 17 ARG HA 1.0 1.8 2.49 108 89 A 18 ARG HA A 18 ARG HBy 1.0 1.8 3.02 109 90 A 18 ARG H A 18 ARG HDx 1.0 1.8 6.38 110 90 A 18 ARG H A 18 ARG HDy 1.0 1.8 6.38 111 91 A 18 ARG H A 18 ARG HGx 1.0 1.8 6.17 112 91 A 18 ARG H A 18 ARG HGy 1.0 1.8 6.17 113 92 A 17 ARG H A 17 ARG HDx 1.0 1.8 6.38 114 92 A 17 ARG H A 17 ARG HDy 1.0 1.8 6.38 115 93 A 4 ARG H A 4 ARG HDx 1.0 1.8 6.38 116 93 A 4 ARG H A 4 ARG HDy 1.0 1.8 6.38 117 94 A 18 ARG HA A 18 ARG HE 1.0 1.8 5.50 118 95 A 17 ARG HA A 17 ARG HE 1.0 1.8 5.50 119 96 A 4 ARG HA A 4 ARG HE 1.0 1.8 5.50 120 97 A 4 ARG H A 4 ARG HGy 1.0 1.8 4.85 121 98 A 4 ARG H A 4 ARG HGx 1.0 1.8 4.85 122 99 A 4 ARG HBx A 4 ARG HGy 1.0 1.8 2.40 123 100 A 4 ARG HBx A 4 ARG HGx 1.0 1.8 2.40 124 101 A 2 VAL H A 2 VAL HGx% 1.0 1.8 7.60 125 101 A 2 VAL H A 2 VAL HGy% 1.0 1.8 7.60 126 102 A 14 ABA H A 14 ABA HG1 1.0 1.8 5.43 127 103 A 15 VAL H A 15 VAL HGx% 1.0 1.8 7.60 128 103 A 15 VAL H A 15 VAL HGy% 1.0 1.8 7.60 129 104 A 17 ARG H A 2 VAL HGx% 1.0 1.8 6.58 130 104 A 17 ARG H A 2 VAL HGy% 1.0 1.8 6.58 131 105 A 3 CYS H A 2 VAL HGx% 1.0 1.8 7.60 132 105 A 3 CYS H A 2 VAL HGy% 1.0 1.8 7.60 133 106 A 15 VAL H A 14 ABA HG1 1.0 1.8 6.52 134 107 A 16 CYS H A 15 VAL HGx% 1.0 1.8 7.60 135 107 A 16 CYS H A 15 VAL HGy% 1.0 1.8 7.60 136 108 A 4 ARG H A 15 VAL HGx% 1.0 1.8 7.60 137 108 A 4 ARG H A 15 VAL HGy% 1.0 1.8 7.60 138 109 A 3 CYS HBx A 14 ABA HG1 1.0 1.8 6.52 139 110 A 3 CYS HBy A 14 ABA HG1 1.0 1.8 5.31 140 111 A 17 ARG H A 17 ARG HGx 1.0 1.8 3.23 141 111 A 17 ARG H A 17 ARG HGy 1.0 1.8 3.23 142 112 A 4 ARG H A 4 ARG HGx 1.0 1.8 4.15 143 112 A 4 ARG H A 4 ARG HGy 1.0 1.8 4.15 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 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 2 VAL H A 17 ARG O 1.0 1.8 2.0 2 2 A 17 ARG O A 2 VAL N 1.0 1.8 3.0 3 3 A 17 ARG H A 2 VAL O 1.0 1.8 2.0 4 4 A 2 VAL O A 17 ARG N 1.0 1.8 3.0 5 5 A 4 ARG H A 15 VAL O 1.0 1.8 2.0 6 6 A 15 VAL O A 4 ARG N 1.0 1.8 3.0 7 7 A 15 VAL H A 4 ARG O 1.0 1.8 2.0 8 8 A 4 ARG O A 15 VAL N 1.0 1.8 3.0 9 9 A 6 VAL H A 13 ARG O 1.0 1.8 2.0 10 10 A 13 ARG O A 6 VAL N 1.0 1.8 3.0 11 11 A 13 ARG H A 6 VAL O 1.0 1.8 2.0 12 12 A 6 VAL O A 13 ARG N 1.0 1.8 3.0 13 13 A 8 ARG H A 11 VAL O 1.0 1.8 2.0 14 14 A 11 VAL O A 8 ARG N 1.0 1.8 3.0 15 15 A 11 VAL H A 8 ARG O 1.0 1.8 2.0 16 16 A 8 ARG O A 11 VAL N 1.0 1.8 3.0 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _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 GLY N A 1 GLY CA A 1 GLY C A 2 VAL N 1.0 -31.0 21.2 PSI 2 2 A 1 GLY C A 2 VAL N A 2 VAL CA A 2 VAL C 1.0 -160.1 -88.7 PHI 3 3 A 2 VAL N A 2 VAL CA A 2 VAL C A 3 CYS N 1.0 108.5 162.1 PSI 4 4 A 2 VAL C A 3 CYS N A 3 CYS CA A 3 CYS C 1.0 -160.3 -80.9 PHI 5 5 A 3 CYS N A 3 CYS CA A 3 CYS C A 4 ARG N 1.0 113.2 166.0 PSI 6 6 A 3 CYS N A 3 CYS CA A 3 CYS CB A 3 CYS SG 1.0 -90.0 -30.0 CHI1 7 7 A 3 CYS C A 4 ARG N A 4 ARG CA A 4 ARG C 1.0 -155.6 -97.4 PHI 8 8 A 4 ARG N A 4 ARG CA A 4 ARG C A 5 ABA N 1.0 122.0 169.6 PSI 9 9 A 4 ARG N A 4 ARG CA A 4 ARG CB A 4 ARG CG 1.0 150.0 210.0 CHI1 10 10 A 4 ARG C A 5 ABA N A 5 ABA CA A 5 ABA C 1.0 -133.2 -64.2 PHI 11 11 A 5 ABA N A 5 ABA CA A 5 ABA C A 6 VAL N 1.0 89.3 160.5 PSI 12 12 A 5 ABA C A 6 VAL N A 6 VAL CA A 6 VAL C 1.0 -176.5 -74.7 PHI 13 13 A 6 VAL N A 6 VAL CA A 6 VAL C A 7 CYS N 1.0 106.6 169.6 PSI 14 14 A 6 VAL C A 7 CYS N A 7 CYS CA A 7 CYS C 1.0 -154.0 -95.6 PHI 15 15 A 7 CYS N A 7 CYS CA A 7 CYS C A 8 ARG N 1.0 122.3 162.5 PSI 16 16 A 7 CYS N A 7 CYS CA A 7 CYS CB A 7 CYS SG 1.0 -90.0 -30.0 CHI1 17 17 A 7 CYS C A 8 ARG N A 8 ARG CA A 8 ARG C 1.0 -184.1 -48.3 PHI 18 18 A 8 ARG N A 8 ARG CA A 8 ARG C A 9 ARG N 1.0 110.0 164.4 PSI 19 19 A 8 ARG C A 9 ARG N A 9 ARG CA A 9 ARG C 1.0 10.0 90.0 PHI 20 20 A 9 ARG N A 9 ARG CA A 9 ARG CB A 9 ARG CG 1.0 150.0 210.0 CHI1 21 21 A 9 ARG C A 10 GLY N A 10 GLY CA A 10 GLY C 1.0 69.1 101.5 PHI 22 22 A 10 GLY N A 10 GLY CA A 10 GLY C A 11 VAL N 1.0 -31.0 21.2 PSI 23 23 A 10 GLY C A 11 VAL N A 11 VAL CA A 11 VAL C 1.0 -160.1 -88.7 PHI 24 24 A 11 VAL N A 11 VAL CA A 11 VAL C A 12 CYS N 1.0 108.5 162.1 PSI 25 25 A 11 VAL C A 12 CYS N A 12 CYS CA A 12 CYS C 1.0 -160.3 -80.9 PHI 26 26 A 12 CYS N A 12 CYS CA A 12 CYS C A 13 ARG N 1.0 113.2 166.0 PSI 27 27 A 12 CYS N A 12 CYS CA A 12 CYS CB A 12 CYS SG 1.0 -90.0 -30.0 CHI1 28 28 A 12 CYS C A 13 ARG N A 13 ARG CA A 13 ARG C 1.0 -155.6 -97.4 PHI 29 29 A 13 ARG N A 13 ARG CA A 13 ARG C A 14 ABA N 1.0 122.0 169.6 PSI 30 30 A 13 ARG N A 13 ARG CA A 13 ARG CB A 13 ARG CG 1.0 150.0 210.0 CHI1 31 31 A 13 ARG C A 14 ABA N A 14 ABA CA A 14 ABA C 1.0 -133.2 -64.2 PHI 32 32 A 14 ABA N A 14 ABA CA A 14 ABA C A 15 VAL N 1.0 89.3 160.5 PSI 33 33 A 14 ABA C A 15 VAL N A 15 VAL CA A 15 VAL C 1.0 -176.5 -74.7 PHI 34 34 A 15 VAL N A 15 VAL CA A 15 VAL C A 16 CYS N 1.0 106.6 169.6 PSI 35 35 A 15 VAL C A 16 CYS N A 16 CYS CA A 16 CYS C 1.0 -154.0 -95.6 PHI 36 36 A 16 CYS N A 16 CYS CA A 16 CYS C A 17 ARG N 1.0 122.3 162.5 PSI 37 37 A 16 CYS N A 16 CYS CA A 16 CYS CB A 16 CYS SG 1.0 -90.0 -30.0 CHI1 38 38 A 16 CYS C A 17 ARG N A 17 ARG CA A 17 ARG C 1.0 -184.1 -48.3 PHI 39 39 A 17 ARG N A 17 ARG CA A 17 ARG C A 18 ARG N 1.0 110.0 164.4 PSI 40 40 A 17 ARG C A 18 ARG N A 18 ARG CA A 18 ARG C 1.0 10.0 90.0 PHI 41 41 A 18 ARG N A 18 ARG CA A 18 ARG CB A 18 ARG CG 1.0 150.0 210.0 CHI1 stop_ save_