data_nef_c17618_2lcn 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 17619 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 ACE C 1 2 GLY N 1 20 ALA C 1 21 ETA N 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 0 ACE start . . 2 A 1 GLY middle . false 3 A 2 TRP middle . . 4 A 3 TRP middle . . 5 A 4 LEU middle . . 6 A 5 ALA middle . . 7 A 6 LEU middle . . 8 A 7 ALA middle . . 9 A 8 LEU middle . . 10 A 9 ALA middle . . 11 A 10 PRO middle . false 12 A 11 ALA middle . . 13 A 12 LEU middle . . 14 A 13 ALA middle . . 15 A 14 LEU middle . . 16 A 15 ALA middle . . 17 A 16 LEU middle . . 18 A 17 TRP middle . . 19 A 18 TRP middle . . 20 A 19 ALA middle . . 21 A 20 ETA 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 0 ACE H% H 1 2.13 0.004 A 1 GLY H H 1 6.98 0.001 A 1 GLY HAx H 1 3.92 0.028 A 1 GLY HAy H 1 3.92 0.028 A 1 GLY N N 15 111.20 0.00 A 2 TRP H H 1 8.08 0.002 A 2 TRP HA H 1 4.42 0.005 A 2 TRP HB2 H 1 3.34 0.003 A 2 TRP HB3 H 1 3.44 0.007 A 2 TRP HD1 H 1 7.52 0.002 A 2 TRP HE1 H 1 10.08 0.001 A 2 TRP HE3 H 1 7.59 0.001 A 2 TRP HZ2 H 1 7.58 0.026 A 2 TRP N N 15 119.50 0.00 A 2 TRP NE1 N 15 128.40 0.00 A 3 TRP H H 1 7.18 0.003 A 3 TRP HA H 1 4.36 0.005 A 3 TRP HB2 H 1 3.06 0.159 A 3 TRP HB3 H 1 3.41 0.003 A 3 TRP HD1 H 1 7.27 0.002 A 3 TRP HE1 H 1 10.11 0.002 A 3 TRP HE3 H 1 7.07 0.003 A 3 TRP HH2 H 1 7.44 0.006 A 3 TRP HZ2 H 1 7.61 0.001 A 3 TRP HZ3 H 1 7.24 0.00 A 3 TRP N N 15 117.30 0.00 A 3 TRP NE1 N 15 128.40 0.00 A 4 LEU H H 1 7.43 0.002 A 4 LEU HA H 1 4.08 0.004 A 4 LEU HBx H 1 1.58 0.002 A 4 LEU HBy H 1 1.58 0.002 A 4 LEU HD1% H 1 0.99 0.006 A 4 LEU HD2% H 1 0.90 0.002 A 4 LEU HG H 1 1.43 0.004 A 4 LEU N N 15 120.60 0.00 A 5 ALA H H 1 7.91 0.001 A 5 ALA HA H 1 4.17 0.002 A 5 ALA HB% H 1 1.76 0.002 A 5 ALA N N 15 117.30 0.00 A 6 LEU H H 1 7.81 0.002 A 6 LEU HA H 1 4.27 0.009 A 6 LEU HB2 H 1 2.20 0.027 A 6 LEU HB3 H 1 2.10 0.00 A 6 LEU HD1% H 1 1.27 0.002 A 6 LEU HD2% H 1 1.19 0.002 A 6 LEU HG H 1 1.93 0.003 A 6 LEU N N 15 115.10 0.00 A 7 ALA H H 1 7.89 0.002 A 7 ALA HA H 1 4.31 0.005 A 7 ALA HB% H 1 1.69 0.003 A 7 ALA N N 15 113.40 0.00 A 8 LEU H H 1 7.83 0.002 A 8 LEU HA H 1 4.42 0.01 A 8 LEU HBx H 1 2.00 0.014 A 8 LEU HBy H 1 2.00 0.014 A 8 LEU HD1% H 1 1.06 0.004 A 8 LEU HD2% H 1 1.01 0.005 A 8 LEU N N 15 118.30 0.00 A 9 ALA H H 1 8.14 0.002 A 9 ALA HA H 1 4.40 0.011 A 9 ALA HB% H 1 1.72 0.001 A 9 ALA N N 15 120.50 0.00 A 10 PRO HA H 1 4.12 0.003 A 10 PRO HB2 H 1 2.41 0.001 A 10 PRO HB3 H 1 1.99 0.019 A 10 PRO HDx H 1 3.88 0.007 A 10 PRO HDy H 1 3.88 0.007 A 10 PRO HGx H 1 1.73 0.006 A 10 PRO HGy H 1 1.73 0.006 A 11 ALA H H 1 7.35 0.00 A 11 ALA HA H 1 4.20 0.00 A 11 ALA HB% H 1 1.65 0.004 A 11 ALA N N 15 117.00 0.00 A 12 LEU H H 1 8.27 0.003 A 12 LEU HA H 1 4.23 0.005 A 12 LEU HBx H 1 1.97 0.004 A 12 LEU HBy H 1 1.97 0.004 A 12 LEU HDx% H 1 1.05 0.002 A 12 LEU HDy% H 1 1.05 0.002 A 12 LEU HG H 1 1.82 0.001 A 12 LEU N N 15 117.00 0.00 A 13 ALA H H 1 8.44 0.001 A 13 ALA HA H 1 4.22 0.004 A 13 ALA HB% H 1 1.66 0.003 A 13 ALA N N 15 119.80 0.00 A 14 LEU H H 1 8.26 0.004 A 14 LEU HA H 1 4.41 0.001 A 14 LEU HBx H 1 2.05 0.005 A 14 LEU HBy H 1 2.05 0.005 A 14 LEU HD1% H 1 1.11 0.004 A 14 LEU HD2% H 1 1.05 0.004 A 14 LEU N N 15 117.30 0.00 A 15 ALA H H 1 8.49 0.004 A 15 ALA HA H 1 4.39 0.005 A 15 ALA HB% H 1 1.78 0.002 A 15 ALA N N 15 121.10 0.00 A 16 LEU H H 1 8.61 0.002 A 16 LEU HA H 1 4.28 0.003 A 16 LEU HB2 H 1 2.19 0.002 A 16 LEU HB3 H 1 2.10 0.001 A 16 LEU HDx% H 1 1.09 0.003 A 16 LEU HDy% H 1 1.09 0.003 A 16 LEU N N 15 117.30 0.00 A 17 TRP H H 1 8.82 0.002 A 17 TRP HA H 1 4.45 0.013 A 17 TRP HB2 H 1 3.49 0.003 A 17 TRP HB3 H 1 3.90 0.004 A 17 TRP HD1 H 1 7.29 0.003 A 17 TRP HE1 H 1 10.00 0.002 A 17 TRP HE3 H 1 7.91 0.001 A 17 TRP HH2 H 1 7.22 0.002 A 17 TRP HZ2 H 1 7.69 0.00 A 17 TRP HZ3 H 1 7.89 0.003 A 17 TRP N N 15 121.30 0.00 A 17 TRP NE1 N 15 127.80 0.00 A 18 TRP H H 1 9.14 0.003 A 18 TRP HA H 1 4.01 0.006 A 18 TRP HB2 H 1 3.59 0.003 A 18 TRP HB3 H 1 3.66 0.003 A 18 TRP HD1 H 1 7.25 0.002 A 18 TRP HE1 H 1 9.89 0.003 A 18 TRP HE3 H 1 7.71 0.002 A 18 TRP HZ2 H 1 7.66 0.00 A 18 TRP HZ3 H 1 7.69 0.002 A 18 TRP N N 15 120.60 0.00 A 18 TRP NE1 N 15 127.20 0.00 A 19 ALA H H 1 8.71 0.002 A 19 ALA HA H 1 4.04 0.005 A 19 ALA HB% H 1 1.67 0.004 A 19 ALA N N 15 120.30 0.00 A 20 ETA HAx H 1 3.38 0.006 A 20 ETA HAy H 1 3.38 0.006 A 20 ETA HBx H 1 3.54 0.008 A 20 ETA HBy H 1 3.54 0.008 A 20 ETA HNx H 1 7.75 0.002 A 20 ETA HNy H 1 7.75 0.002 A 20 ETA HO H 1 3.82 0.00 A 20 ETA N N 15 111.70 0.00 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 TRP HD1 A 2 TRP HE1 1.0 1.8 2.8 2 2 A 2 TRP HE1 A 2 TRP HZ2 1.0 1.8 2.8 3 3 A 3 TRP HA A 3 TRP H 1.0 1.8 2.8 4 4 A 3 TRP HB3 A 4 LEU H 1.0 1.8 5.5 5 5 A 4 LEU H A 3 TRP HB2 1.0 1.8 5.5 6 6 A 3 TRP HD1 A 3 TRP HE1 1.0 1.8 2.8 7 7 A 3 TRP H A 2 TRP H 1.0 1.8 2.8 8 8 A 3 TRP HE1 A 3 TRP HZ2 1.0 1.8 2.8 9 9 A 4 LEU H A 4 LEU HA 1.0 1.8 2.8 10 10 A 4 LEU HA A 4 LEU HBx 1.0 1.8 2.8 11 10 A 4 LEU HA A 4 LEU HBy 1.0 1.8 2.8 12 11 A 4 LEU HG A 4 LEU HBx 1.0 1.8 2.8 13 11 A 4 LEU HBy A 4 LEU HG 1.0 1.8 2.8 14 12 A 4 LEU H A 4 LEU HG 1.0 1.8 2.8 15 13 A 4 LEU H A 4 LEU HBx 1.0 1.8 2.8 16 13 A 4 LEU H A 4 LEU HBy 1.0 1.8 2.8 17 14 A 5 ALA H A 4 LEU HBx 1.0 1.8 2.8 18 14 A 4 LEU HBy A 5 ALA H 1.0 1.8 2.8 19 15 A 4 LEU H A 5 ALA H 1.0 1.8 2.8 20 16 A 5 ALA H A 5 ALA HA 1.0 1.8 2.8 21 17 A 6 LEU HA A 6 LEU H 1.0 1.8 2.8 22 18 A 6 LEU HA A 6 LEU HG 1.0 1.8 2.8 23 19 A 7 ALA HA A 7 ALA H 1.0 1.8 2.8 24 20 A 8 LEU HA A 8 LEU H 1.0 1.8 2.8 25 21 A 8 LEU H A 9 ALA H 1.0 1.8 2.8 26 22 A 9 ALA H A 9 ALA HA 1.0 1.8 2.8 27 23 A 10 PRO HB3 A 10 PRO HB2 1.0 1.8 2.8 28 24 A 10 PRO HB3 A 10 PRO HGx 1.0 1.8 2.8 29 24 A 10 PRO HB3 A 10 PRO HGy 1.0 1.8 2.8 30 25 A 12 LEU HA A 12 LEU H 1.0 1.8 2.8 31 26 A 12 LEU HA A 12 LEU HBx 1.0 1.8 2.8 32 26 A 12 LEU HA A 12 LEU HBy 1.0 1.8 2.8 33 27 A 12 LEU H A 12 LEU HBx 1.0 1.8 2.8 34 27 A 12 LEU H A 12 LEU HBy 1.0 1.8 2.8 35 28 A 12 LEU HG A 12 LEU HBx 1.0 1.8 2.8 36 28 A 12 LEU HBy A 12 LEU HG 1.0 1.8 2.8 37 29 A 12 LEU H A 12 LEU HG 1.0 1.8 2.8 38 30 A 13 ALA HA A 13 ALA H 1.0 1.8 2.8 39 31 A 14 LEU HA A 14 LEU H 1.0 1.8 2.8 40 32 A 14 LEU H A 14 LEU HBx 1.0 1.8 2.8 41 32 A 14 LEU H A 14 LEU HBy 1.0 1.8 2.8 42 33 A 15 ALA HA A 15 ALA H 1.0 1.8 2.8 43 34 A 16 LEU HA A 16 LEU H 1.0 1.8 2.8 44 35 A 16 LEU H A 16 LEU HB3 1.0 1.8 3.5 45 36 A 16 LEU H A 16 LEU HB2 1.0 1.8 2.8 46 37 A 16 LEU H A 17 TRP H 1.0 1.8 2.8 47 38 A 17 TRP H A 17 TRP HA 1.0 1.8 2.8 48 39 A 17 TRP H A 17 TRP HB3 1.0 1.8 2.8 49 40 A 17 TRP H A 17 TRP HB2 1.0 1.8 3.5 50 41 A 17 TRP HD1 A 17 TRP HE1 1.0 1.8 2.8 51 42 A 17 TRP H A 18 TRP H 1.0 1.8 2.8 52 43 A 17 TRP HE1 A 17 TRP HZ2 1.0 1.8 2.8 53 44 A 18 TRP H A 18 TRP HA 1.0 1.8 2.8 54 45 A 18 TRP H A 18 TRP HB3 1.0 1.8 2.8 55 46 A 18 TRP H A 18 TRP HB2 1.0 1.8 2.8 56 47 A 18 TRP HD1 A 18 TRP HE1 1.0 1.8 2.8 57 48 A 19 ALA HA A 19 ALA H 1.0 1.8 2.8 58 49 A 18 TRP H A 19 ALA H 1.0 1.8 2.8 59 50 A 2 TRP HD1 A 2 TRP HA 1.0 1.8 5.5 60 51 A 2 TRP HA A 2 TRP HE3 1.0 1.8 5.5 61 52 A 5 ALA H A 2 TRP HA 1.0 1.8 5.5 62 53 A 2 TRP HD1 A 2 TRP H 1.0 1.8 3.5 63 54 A 2 TRP HA A 2 TRP HB3 1.0 1.8 2.8 64 55 A 2 TRP HA A 2 TRP HB2 1.0 1.8 2.8 65 56 A 3 TRP HA A 4 LEU H 1.0 1.8 3.5 66 57 A 3 TRP HA A 3 TRP HB3 1.0 1.8 3.5 67 58 A 3 TRP HA A 3 TRP HB2 1.0 1.8 3.5 68 59 A 3 TRP HB3 A 3 TRP HD1 1.0 1.8 3.5 69 60 A 3 TRP HB2 A 3 TRP HD1 1.0 1.8 3.5 70 61 A 4 LEU HA A 6 LEU H 1.0 1.8 3.5 71 62 A 4 LEU HA A 7 ALA H 1.0 1.8 3.5 72 63 A 4 LEU HA A 4 LEU HG 1.0 1.8 3.5 73 64 A 6 LEU HA A 7 ALA H 1.0 1.8 3.5 74 65 A 6 LEU HA A 9 ALA H 1.0 1.8 3.5 75 66 A 6 LEU HG A 6 LEU HD1% 1.0 1.8 3.5 76 67 A 6 LEU HG A 6 LEU HD2% 1.0 1.8 3.5 77 68 A 6 LEU H A 6 LEU HG 1.0 1.8 3.5 78 69 A 6 LEU HG A 7 ALA H 1.0 1.8 5.5 79 70 A 7 ALA HA A 8 LEU H 1.0 1.8 3.5 80 71 A 9 ALA H A 10 PRO HA 1.0 1.8 5.5 81 72 A 10 PRO HB3 A 10 PRO HDx 1.0 1.8 3.5 82 72 A 10 PRO HB3 A 10 PRO HDy 1.0 1.8 3.5 83 73 A 10 PRO HB2 A 10 PRO HA 1.0 1.8 3.5 84 74 A 10 PRO HB2 A 10 PRO HDx 1.0 1.8 3.5 85 74 A 10 PRO HB2 A 10 PRO HDy 1.0 1.8 3.5 86 75 A 9 ALA H A 10 PRO HDx 1.0 1.8 3.5 87 75 A 9 ALA H A 10 PRO HDy 1.0 1.8 3.5 88 76 A 10 PRO HA A 10 PRO HDx 1.0 1.8 3.5 89 76 A 10 PRO HA A 10 PRO HDy 1.0 1.8 3.5 90 77 A 10 PRO HA A 10 PRO HGx 1.0 1.8 3.5 91 77 A 10 PRO HGy A 10 PRO HA 1.0 1.8 3.5 92 78 A 10 PRO HDy A 10 PRO HGx 1.0 1.8 3.5 93 78 A 10 PRO HDx A 10 PRO HGx 1.0 1.8 3.5 94 78 A 10 PRO HGy A 10 PRO HDx 1.0 1.8 3.5 95 78 A 10 PRO HGy A 10 PRO HDy 1.0 1.8 3.5 96 79 A 11 ALA HB% A 11 ALA H 1.0 1.8 3.5 97 80 A 15 ALA H A 11 ALA HB% 1.0 1.8 3.5 98 81 A 12 LEU H A 11 ALA H 1.0 1.8 3.5 99 82 A 12 LEU HA A 15 ALA H 1.0 1.8 3.5 100 83 A 13 ALA H A 12 LEU HBx 1.0 1.8 3.5 101 83 A 12 LEU HBy A 13 ALA H 1.0 1.8 3.5 102 84 A 15 ALA H A 12 LEU HBx 1.0 1.8 5.5 103 84 A 12 LEU HBy A 15 ALA H 1.0 1.8 5.5 104 85 A 12 LEU HA A 12 LEU HG 1.0 1.8 3.5 105 86 A 12 LEU H A 13 ALA H 1.0 1.8 3.5 106 87 A 13 ALA HA A 16 LEU H 1.0 1.8 3.5 107 88 A 14 LEU HA A 17 TRP H 1.0 1.8 3.5 108 89 A 14 LEU HA A 14 LEU HBx 1.0 1.8 3.5 109 89 A 14 LEU HA A 14 LEU HBy 1.0 1.8 3.5 110 90 A 15 ALA H A 14 LEU HBx 1.0 1.8 3.5 111 90 A 14 LEU HBy A 15 ALA H 1.0 1.8 3.5 112 91 A 14 LEU H A 15 ALA H 1.0 1.8 3.5 113 92 A 15 ALA HA A 16 LEU H 1.0 1.8 3.5 114 93 A 15 ALA HA A 18 TRP H 1.0 1.8 3.5 115 94 A 15 ALA HA A 19 ALA H 1.0 1.8 3.5 116 95 A 16 LEU HA A 17 TRP H 1.0 1.8 3.5 117 96 A 17 TRP HA A 17 TRP HD1 1.0 1.8 3.5 118 97 A 17 TRP HB3 A 17 TRP HB2 1.0 1.8 3.5 119 98 A 17 TRP HH2 A 17 TRP HZ3 1.0 1.8 3.5 120 99 A 18 TRP H A 17 TRP HZ3 1.0 1.8 3.5 121 100 A 18 TRP HA A 18 TRP HD1 1.0 1.8 3.5 122 101 A 18 TRP HA A 18 TRP HE3 1.0 1.8 5.5 123 102 A 18 TRP HA A 18 TRP HB3 1.0 1.8 3.5 124 103 A 18 TRP HA A 18 TRP HB2 1.0 1.8 3.5 125 104 A 18 TRP HB3 A 18 TRP HD1 1.0 1.8 3.5 126 105 A 18 TRP HB2 A 18 TRP HD1 1.0 1.8 3.5 127 106 A 18 TRP HB3 A 19 ALA H 1.0 1.8 3.5 128 107 A 18 TRP HB2 A 19 ALA H 1.0 1.8 3.5 129 108 A 18 TRP HB3 A 18 TRP HB2 1.0 1.8 3.5 130 109 A 2 TRP HD1 A 2 TRP HB3 1.0 1.8 3.5 131 110 A 2 TRP HD1 A 2 TRP HB2 1.0 1.8 3.5 132 111 A 2 TRP H A 2 TRP HB3 1.0 1.8 2.8 133 112 A 2 TRP H A 2 TRP HB2 1.0 1.8 3.5 134 113 A 2 TRP HB3 A 2 TRP HB2 1.0 1.8 2.8 135 114 A 2 TRP HE3 A 2 TRP HB3 1.0 1.8 5.5 136 115 A 2 TRP HE3 A 2 TRP HB2 1.0 1.8 5.5 137 116 A 3 TRP HD1 A 2 TRP H 1.0 1.8 5.5 138 117 A 3 TRP HB3 A 3 TRP HB2 1.0 1.8 2.8 139 118 A 3 TRP HA A 2 TRP HE3 1.0 1.8 5.5 140 119 A 2 TRP HZ2 A 3 TRP HA 1.0 1.8 5.5 141 120 A 3 TRP HA A 3 TRP HD1 1.0 1.8 5.5 142 121 A 3 TRP HA A 6 LEU H 1.0 1.8 5.5 143 122 A 3 TRP H A 4 LEU H 1.0 1.8 5.5 144 123 A 5 ALA HA A 6 LEU H 1.0 1.8 5.5 145 124 A 5 ALA HA A 8 LEU H 1.0 1.8 5.5 146 125 A 5 ALA HA A 9 ALA H 1.0 1.8 5.5 147 126 A 10 PRO HB3 A 10 PRO HA 1.0 1.8 5.5 148 127 A 9 ALA H A 10 PRO HB2 1.0 1.8 5.5 149 128 A 15 ALA H A 11 ALA HB% 1.0 1.8 5.5 150 129 A 12 LEU HG A 13 ALA H 1.0 1.8 5.5 151 130 A 13 ALA HA A 17 TRP H 1.0 1.8 5.5 152 131 A 11 ALA HA A 14 LEU HBx 1.0 1.8 5.5 153 131 A 14 LEU HBy A 11 ALA HA 1.0 1.8 5.5 154 132 A 15 ALA HA A 18 TRP HE3 1.0 1.8 5.5 155 133 A 15 ALA HA A 18 TRP HZ3 1.0 1.8 5.5 156 134 A 18 TRP HZ3 A 15 ALA HB% 1.0 1.8 5.5 157 135 A 15 ALA H A 16 LEU H 1.0 1.8 5.5 158 136 A 16 LEU HA A 19 ALA H 1.0 1.8 5.5 159 137 A 17 TRP HA A 17 TRP HE1 1.0 1.8 5.5 160 138 A 17 TRP HA A 17 TRP HB3 1.0 1.8 5.5 161 139 A 17 TRP HA A 17 TRP HB2 1.0 1.8 5.5 162 140 A 17 TRP HB3 A 17 TRP HD1 1.0 1.8 5.5 163 141 A 17 TRP HB2 A 17 TRP HD1 1.0 1.8 5.5 164 142 A 17 TRP H A 17 TRP HZ3 1.0 1.8 5.5 165 143 A 18 TRP HA A 17 TRP HE3 1.0 1.8 5.5 166 144 A 18 TRP HB3 A 18 TRP HE3 1.0 1.8 5.5 167 145 A 18 TRP HB2 A 18 TRP HE3 1.0 1.8 5.5 168 146 A 18 TRP HB3 A 18 TRP HZ3 1.0 1.8 6.0 169 147 A 18 TRP HB2 A 18 TRP HZ3 1.0 1.8 6.0 170 148 A 15 ALA HA A 18 TRP HB3 1.0 1.8 6.0 171 149 A 15 ALA HA A 18 TRP HB2 1.0 1.8 6.0 172 150 A 19 ALA H A 18 TRP HE3 1.0 1.8 5.5 173 151 A 19 ALA H A 18 TRP HZ3 1.0 1.8 5.5 174 152 A 3 TRP HE1 A 4 LEU HG 1.0 1.8 6.0 175 153 A 17 TRP H A 17 TRP HD1 1.0 1.8 6.0 176 154 A 18 TRP HA A 17 TRP HZ3 1.0 1.8 6.0 177 155 A 18 TRP HA A 18 TRP HE1 1.0 1.8 6.0 178 156 A 4 LEU H A 4 LEU HD1% 1.0 1.8 6.5 179 157 A 4 LEU H A 4 LEU HD2% 1.0 1.8 6.0 180 158 A 4 LEU HA A 4 LEU HD1% 1.0 1.8 4.0 181 159 A 4 LEU HA A 4 LEU HD2% 1.0 1.8 3.5 182 160 A 7 ALA H A 4 LEU HD2% 1.0 1.8 6.5 183 161 A 6 LEU H A 6 LEU HB3 1.0 1.8 3.5 184 162 A 6 LEU H A 6 LEU HB2 1.0 1.8 2.8 185 163 A 2 TRP HZ2 A 6 LEU HD1% 1.0 1.8 6.5 186 164 A 2 TRP HZ2 A 6 LEU HD2% 1.0 1.8 6.5 187 165 A 7 ALA H A 6 LEU HD1% 1.0 1.8 6.5 188 166 A 7 ALA H A 6 LEU HD2% 1.0 1.8 6.5 189 167 A 9 ALA H A 6 LEU HD1% 1.0 1.8 6.5 190 168 A 9 ALA H A 6 LEU HD2% 1.0 1.8 6.5 191 169 A 6 LEU HD1% A 6 LEU HB3 1.0 1.8 3.5 192 170 A 6 LEU HD2% A 6 LEU HB3 1.0 1.8 3.5 193 171 A 6 LEU HD2% A 6 LEU HB2 1.0 1.8 3.5 194 172 A 6 LEU H A 6 LEU HD1% 1.0 1.8 4.0 195 173 A 6 LEU H A 6 LEU HD2% 1.0 1.8 4.0 196 174 A 3 TRP HA A 6 LEU HD1% 1.0 1.8 6.5 197 175 A 3 TRP HA A 6 LEU HD2% 1.0 1.8 6.5 198 176 A 9 ALA H A 8 LEU HD1% 1.0 1.8 5.5 199 177 A 9 ALA H A 8 LEU HD2% 1.0 1.8 6.5 200 178 A 16 LEU H A 13 ALA HB% 1.0 1.8 6.5 201 179 A 17 TRP H A 13 ALA HB% 1.0 1.8 6.5 202 180 A 15 ALA H A 14 LEU HD2% 1.0 1.8 6.5 203 180 A 15 ALA H A 14 LEU HD1% 1.0 1.8 6.5 204 181 A 14 LEU H A 14 LEU HD1% 1.0 1.8 6.5 205 182 A 14 LEU H A 14 LEU HD2% 1.0 1.8 6.5 206 183 A 17 TRP HB3 A 17 TRP HZ3 1.0 1.8 5.5 207 184 A 17 TRP HE3 A 14 LEU HD1% 1.0 1.8 6.0 208 185 A 17 TRP HE3 A 14 LEU HD2% 1.0 1.8 6.0 209 186 A 18 TRP HZ3 A 14 LEU HD1% 1.0 1.8 6.5 210 187 A 18 TRP HZ3 A 14 LEU HD2% 1.0 1.8 6.5 211 188 A 14 LEU HD1% A 14 LEU HBx 1.0 1.8 6.5 212 188 A 14 LEU HBy A 14 LEU HD1% 1.0 1.8 6.5 213 189 A 14 LEU HD2% A 14 LEU HBx 1.0 1.8 6.5 214 189 A 14 LEU HBy A 14 LEU HD2% 1.0 1.8 6.5 215 190 A 17 TRP HH2 A 14 LEU HD2% 1.0 1.8 6.5 216 191 A 17 TRP HH2 A 14 LEU HD1% 1.0 1.8 6.5 217 192 A 18 TRP H A 15 ALA HB% 1.0 1.8 6.5 218 193 A 18 TRP H A 19 ALA HB% 1.0 1.8 6.5 219 194 A 8 LEU H A 5 ALA HB% 1.0 1.8 6.0 220 195 A 12 LEU HA A 12 LEU HDx% 1.0 1.8 6.0 221 195 A 12 LEU HA A 12 LEU HDy% 1.0 1.8 6.0 222 196 A 15 ALA H A 12 LEU HDx% 1.0 1.8 6.0 223 196 A 15 ALA H A 12 LEU HDy% 1.0 1.8 6.0 224 197 A 18 TRP HE3 A 15 ALA HB% 1.0 1.8 6.0 225 198 A 2 TRP HE3 A 5 ALA HB% 1.0 1.8 4.0 226 199 A 2 TRP HZ2 A 5 ALA HB% 1.0 1.8 4.0 227 200 A 8 LEU HA A 8 LEU HBx 1.0 1.8 3.5 228 200 A 8 LEU HA A 8 LEU HBy 1.0 1.8 3.5 229 201 A 8 LEU H A 8 LEU HBx 1.0 1.8 2.8 230 201 A 8 LEU H A 8 LEU HBy 1.0 1.8 2.8 231 202 A 9 ALA H A 8 LEU HBx 1.0 1.8 2.8 232 202 A 9 ALA H A 8 LEU HBy 1.0 1.8 2.8 233 203 A 8 LEU HD1% A 8 LEU HBx 1.0 1.8 4.0 234 203 A 8 LEU HD1% A 8 LEU HBy 1.0 1.8 4.0 235 204 A 8 LEU HD2% A 8 LEU HBx 1.0 1.8 4.0 236 204 A 8 LEU HD2% A 8 LEU HBy 1.0 1.8 4.0 237 205 A 8 LEU H A 8 LEU HD1% 1.0 1.8 4.0 238 206 A 8 LEU H A 8 LEU HD2% 1.0 1.8 4.0 239 207 A 12 LEU HBx A 12 LEU HDx% 1.0 1.8 4.0 240 207 A 12 LEU HBy A 12 LEU HDx% 1.0 1.8 4.0 241 207 A 12 LEU HDy% A 12 LEU HBx 1.0 1.8 4.0 242 207 A 12 LEU HBy A 12 LEU HDy% 1.0 1.8 4.0 243 208 A 12 LEU HG A 12 LEU HDx% 1.0 1.8 4.0 244 208 A 12 LEU HG A 12 LEU HDy% 1.0 1.8 4.0 245 209 A 12 LEU H A 12 LEU HDx% 1.0 1.8 4.0 246 209 A 12 LEU H A 12 LEU HDy% 1.0 1.8 4.0 247 210 A 14 LEU H A 13 ALA HB% 1.0 1.8 4.0 248 211 A 12 LEU HA A 15 ALA HB% 1.0 1.8 4.0 249 212 A 15 ALA HA A 15 ALA HB% 1.0 1.8 4.0 250 213 A 17 TRP H A 15 ALA HB% 1.0 1.8 6.0 251 214 A 16 LEU HA A 19 ALA HB% 1.0 1.8 4.0 252 215 A 18 TRP HE3 A 19 ALA HB% 1.0 1.8 4.0 253 216 A 18 TRP HZ3 A 19 ALA HB% 1.0 1.8 4.0 254 217 A 5 ALA HA A 5 ALA HB% 1.0 1.8 3.5 255 218 A 5 ALA H A 5 ALA HB% 1.0 1.8 3.5 256 219 A 6 LEU H A 5 ALA HB% 1.0 1.8 3.5 257 220 A 7 ALA HA A 7 ALA HB% 1.0 1.8 3.5 258 221 A 7 ALA H A 7 ALA HB% 1.0 1.8 3.5 259 222 A 8 LEU H A 7 ALA HB% 1.0 1.8 3.5 260 223 A 9 ALA HA A 9 ALA HB% 1.0 1.8 3.5 261 224 A 9 ALA H A 9 ALA HB% 1.0 1.8 3.5 262 225 A 12 LEU H A 11 ALA HB% 1.0 1.8 3.5 263 226 A 13 ALA HA A 13 ALA HB% 1.0 1.8 3.5 264 227 A 13 ALA H A 13 ALA HB% 1.0 1.8 3.5 265 228 A 15 ALA H A 15 ALA HB% 1.0 1.8 3.5 266 229 A 16 LEU H A 15 ALA HB% 1.0 1.8 3.5 267 230 A 19 ALA HA A 19 ALA HB% 1.0 1.8 3.5 268 231 A 19 ALA H A 19 ALA HB% 1.0 1.8 3.5 269 232 A 3 TRP HA A 3 TRP HE3 1.0 1.8 6.0 270 233 A 4 LEU HA A 3 TRP HE3 1.0 1.8 6.0 271 234 A 6 LEU HD1% A 3 TRP HE3 1.0 1.8 6.0 272 235 A 6 LEU HD2% A 3 TRP HE3 1.0 1.8 6.0 273 236 A 7 ALA HB% A 3 TRP HE3 1.0 1.8 6.0 274 237 A 6 LEU HD1% A 3 TRP HH2 1.0 1.8 6.5 275 238 A 4 LEU HD1% A 3 TRP HH2 1.0 1.8 6.5 276 239 A 4 LEU HD2% A 3 TRP HH2 1.0 1.8 6.5 277 240 A 6 LEU HD1% A 3 TRP HZ3 1.0 1.8 6.0 278 241 A 6 LEU HD2% A 3 TRP HZ3 1.0 1.8 6.0 279 242 A 7 ALA HB% A 3 TRP HZ3 1.0 1.8 6.0 280 243 A 7 ALA HA A 10 PRO HA 1.0 1.8 5.5 281 244 A 6 LEU HA A 10 PRO HA 1.0 1.8 5.5 282 245 A 1 GLY HAy A 1 GLY H 1.0 1.8 2.8 283 246 A 1 GLY H A 1 GLY HAx 1.0 1.8 2.8 284 247 A 2 TRP H A 1 GLY HAy 1.0 1.8 2.8 285 248 A 2 TRP H A 1 GLY HAx 1.0 1.8 2.8 286 249 A 3 TRP HE1 A 1 GLY HAy 1.0 1.8 5.5 287 250 A 3 TRP HE1 A 1 GLY HAx 1.0 1.8 5.5 288 251 A 3 TRP HE1 A 1 GLY H 1.0 1.8 5.5 289 252 A 4 LEU H A 1 GLY HAy 1.0 1.8 6.0 290 253 A 4 LEU H A 1 GLY HAx 1.0 1.8 6.0 291 254 A 1 GLY HAy A 1 GLY HAx 1.0 1.8 3.5 292 255 A 2 TRP H A 1 GLY H 1.0 1.8 3.5 293 256 A 3 TRP H A 1 GLY HAy 1.0 1.8 5.5 294 257 A 3 TRP H A 1 GLY HAx 1.0 1.8 5.5 295 258 A 1 GLY H A 4 LEU HBx 1.0 1.8 5.5 296 258 A 4 LEU HBy A 1 GLY H 1.0 1.8 5.5 297 259 A 4 LEU HG A 1 GLY H 1.0 1.8 3.5 298 260 A 2 TRP HD1 A 1 GLY HAx 1.0 1.8 6.0 299 260 A 2 TRP HD1 A 1 GLY HAy 1.0 1.8 6.0 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 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 3 TRP H A 3 TRP HB2 1.0 1.8 2.8 2 1 A 3 TRP H A 3 TRP HB3 1.0 1.8 2.8 3 2 A 3 TRP HB2 A 3 TRP HE1 1.0 1.8 6.0 4 2 A 3 TRP HB3 A 3 TRP HE1 1.0 1.8 6.0 5 3 A 17 TRP HB2 A 18 TRP H 1.0 1.8 2.8 6 3 A 17 TRP HB3 A 18 TRP H 1.0 1.8 2.8 7 4 A 17 TRP HB2 A 18 TRP H 1.0 1.8 6.0 8 4 A 17 TRP HB3 A 18 TRP H 1.0 1.8 6.0 9 5 A 14 LEU HA A 17 TRP HB2 1.0 1.8 6.0 10 5 A 14 LEU HA A 17 TRP HB3 1.0 1.8 6.0 11 6 A 14 LEU HA A 17 TRP HB2 1.0 1.8 5.5 12 6 A 14 LEU HA A 17 TRP HB3 1.0 1.8 5.5 13 7 A 16 LEU H A 17 TRP HB2 1.0 1.8 6.0 14 7 A 16 LEU H A 17 TRP HB3 1.0 1.8 6.0 15 8 A 17 TRP HB2 A 17 TRP HE3 1.0 1.8 5.5 16 8 A 17 TRP HB3 A 17 TRP HE3 1.0 1.8 5.5 17 9 A 17 TRP HB2 A 17 TRP HE3 1.0 1.8 3.5 18 9 A 17 TRP HB3 A 17 TRP HE3 1.0 1.8 3.5 19 10 A 18 TRP HB2 A 17 TRP HE3 1.0 1.8 5.5 20 10 A 18 TRP HB3 A 17 TRP HE3 1.0 1.8 5.5 21 11 A 18 TRP HB2 A 17 TRP HZ3 1.0 1.8 6.0 22 11 A 18 TRP HB3 A 17 TRP HZ3 1.0 1.8 6.0 23 12 A 4 LEU HD2% A 4 LEU HBx 1.0 1.8 2.8 24 12 A 4 LEU HD1% A 4 LEU HBx 1.0 1.8 2.8 25 12 A 4 LEU HBy A 4 LEU HD2% 1.0 1.8 2.8 26 12 A 4 LEU HBy A 4 LEU HD1% 1.0 1.8 2.8 27 13 A 6 LEU HA A 6 LEU HD2% 1.0 1.8 3.5 28 13 A 6 LEU HA A 6 LEU HD1% 1.0 1.8 3.5 29 14 A 6 LEU HA A 6 LEU HD2% 1.0 1.8 4.0 30 14 A 6 LEU HA A 6 LEU HD1% 1.0 1.8 4.0 31 15 A 2 TRP HE3 A 6 LEU HD2% 1.0 1.8 6.5 32 15 A 2 TRP HE3 A 6 LEU HD1% 1.0 1.8 6.5 33 16 A 8 LEU HA A 8 LEU HD2% 1.0 1.8 6.0 34 16 A 8 LEU HA A 8 LEU HD1% 1.0 1.8 6.0 35 17 A 18 TRP HE1 A 14 LEU HD2% 1.0 1.8 6.5 36 17 A 18 TRP HE1 A 14 LEU HD1% 1.0 1.8 6.5 37 18 A 6 LEU HD1% A 6 LEU HB2 1.0 1.8 4.0 38 18 A 6 LEU HD1% A 6 LEU HB3 1.0 1.8 4.0 39 19 A 6 LEU HD2% A 6 LEU HB2 1.0 1.8 4.0 40 19 A 6 LEU HD2% A 6 LEU HB3 1.0 1.8 4.0 41 20 A 19 ALA H A 16 LEU HDx% 1.0 1.8 6.5 42 20 A 19 ALA H A 16 LEU HDy% 1.0 1.8 6.5 43 21 A 16 LEU HA A 16 LEU HDx% 1.0 1.8 4.0 44 21 A 16 LEU HA A 16 LEU HDy% 1.0 1.8 4.0 45 22 A 6 LEU HD1% A 10 PRO HGx 1.0 1.8 6.0 46 22 A 6 LEU HD2% A 10 PRO HGx 1.0 1.8 6.0 47 22 A 10 PRO HGy A 6 LEU HD2% 1.0 1.8 6.0 48 22 A 10 PRO HGy A 6 LEU HD1% 1.0 1.8 6.0 49 23 A 6 LEU HD1% A 10 PRO HGx 1.0 1.8 6.5 50 23 A 6 LEU HD2% A 10 PRO HGx 1.0 1.8 6.5 51 23 A 10 PRO HGy A 6 LEU HD2% 1.0 1.8 6.5 52 23 A 10 PRO HGy A 6 LEU HD1% 1.0 1.8 6.5 53 24 A 17 TRP HZ3 A 14 LEU HD2% 1.0 1.8 6.0 54 24 A 17 TRP HZ3 A 14 LEU HD1% 1.0 1.8 6.0 55 25 A 17 TRP HZ3 A 14 LEU HD2% 1.0 1.8 6.5 56 25 A 17 TRP HZ3 A 14 LEU HD1% 1.0 1.8 6.5 57 26 A 4 LEU HD2% A 3 TRP HE3 1.0 1.8 6.0 58 27 A 4 LEU HD1% A 3 TRP HE3 1.0 1.8 6.5 59 28 A 6 LEU HG A 6 LEU HB3 1.0 1.8 2.8 60 29 A 6 LEU HG A 6 LEU HB2 1.0 1.8 4.0 61 30 A 13 ALA HA A 16 LEU HB2 1.0 1.8 4.0 62 31 A 7 ALA H A 6 LEU HB2 1.0 1.8 2.8 63 32 A 16 LEU HB2 A 17 TRP H 1.0 1.8 2.8 64 33 A 13 ALA HA A 16 LEU HDy% 1.0 1.8 6.0 65 34 A 13 ALA HA A 16 LEU HDx% 1.0 1.8 6.0 66 35 A 17 TRP H A 16 LEU HDx% 1.0 1.8 4.0 67 36 A 4 LEU HD1% A 1 GLY H 1.0 1.8 4.0 68 37 A 4 LEU HD2% A 1 GLY H 1.0 1.8 6.0 69 38 A 6 LEU HA A 6 LEU HB2 1.0 1.8 2.8 70 39 A 16 LEU HA A 16 LEU HB3 1.0 1.8 2.8 71 40 A 16 LEU HB2 A 16 LEU HDx% 1.0 1.8 4.0 72 40 A 16 LEU HB2 A 16 LEU HDy% 1.0 1.8 4.0 73 41 A 16 LEU H A 16 LEU HDx% 1.0 1.8 4.0 74 42 A 16 LEU H A 16 LEU HDy% 1.0 1.8 4.0 75 43 A 3 TRP HE1 A 0 ACE CH3 1.0 1.8 4.0 76 44 A 3 TRP HD1 A 0 ACE CH3 1.0 1.8 6.0 77 45 A 1 GLY H A 0 ACE CH3 1.0 1.8 3.5 78 46 A 3 TRP HD1 A 0 ACE CH3 1.0 1.8 6.0 79 47 A 4 LEU H A 0 ACE CH3 1.0 1.8 6.5 80 48 A 3 TRP HZ2 A 0 ACE CH3 1.0 1.8 6.0 81 49 A 19 ALA HB% A 20 ETA HNy 1.0 1.8 4.0 82 49 A 19 ALA HB% A 20 ETA HNx 1.0 1.8 4.0 83 50 A 19 ALA HA A 20 ETA HNy 1.0 1.8 3.5 84 50 A 19 ALA HA A 20 ETA HNx 1.0 1.8 3.5 85 51 A 16 LEU HA A 20 ETA HNy 1.0 1.8 5.5 86 51 A 16 LEU HA A 20 ETA HNx 1.0 1.8 5.5 87 52 A 17 TRP HA A 20 ETA HNy 1.0 1.8 5.5 88 52 A 17 TRP HA A 20 ETA HNx 1.0 1.8 5.5 89 53 A 16 LEU HDy% A 20 ETA HNy 1.0 1.8 6.0 90 53 A 16 LEU HDx% A 20 ETA HNy 1.0 1.8 6.0 91 53 A 20 ETA HNx A 16 LEU HDx% 1.0 1.8 6.0 92 53 A 16 LEU HDy% A 20 ETA HNx 1.0 1.8 6.0 93 54 A 20 ETA HBx A 20 ETA HNy 1.0 1.8 3.5 94 54 A 20 ETA HBy A 20 ETA HNy 1.0 1.8 3.5 95 54 A 20 ETA HNx A 20 ETA HBy 1.0 1.8 3.5 96 54 A 20 ETA HNx A 20 ETA HBx 1.0 1.8 3.5 97 55 A 20 ETA HAy A 20 ETA HNy 1.0 1.8 3.5 98 55 A 20 ETA HNx A 20 ETA HAx 1.0 1.8 3.5 99 55 A 20 ETA HNx A 20 ETA HAy 1.0 1.8 3.5 100 55 A 20 ETA HAx A 20 ETA HNy 1.0 1.8 3.5 101 56 A 20 ETA HO A 20 ETA HNy 1.0 1.8 3.5 102 56 A 20 ETA HNx A 20 ETA HO 1.0 1.8 3.5 103 57 A 20 ETA HAy A 20 ETA HBy 1.0 1.8 2.8 104 57 A 20 ETA HAx A 20 ETA HBy 1.0 1.8 2.8 105 57 A 20 ETA HBx A 20 ETA HAx 1.0 1.8 2.8 106 57 A 20 ETA HBx A 20 ETA HAy 1.0 1.8 2.8 107 58 A 19 ALA H A 20 ETA HNy 1.0 1.8 2.8 108 58 A 19 ALA H A 20 ETA HNx 1.0 1.8 2.8 109 59 A 18 TRP H A 20 ETA HNy 1.0 1.8 6.0 110 59 A 18 TRP H A 20 ETA HNx 1.0 1.8 6.0 111 60 A 18 TRP HB3 A 15 ALA HB% 1.0 1.8 6.5 112 61 A 18 TRP HB3 A 19 ALA HB% 1.0 1.8 6.5 113 62 A 18 TRP HB2 A 15 ALA HB% 1.0 1.8 6.0 114 63 A 18 TRP HB2 A 19 ALA HB% 1.0 1.8 6.0 115 64 A 19 ALA HB% A 20 ETA HBx 1.0 1.8 6.5 116 64 A 19 ALA HB% A 20 ETA HBy 1.0 1.8 6.5 117 65 A 19 ALA HB% A 20 ETA HAx 1.0 1.8 6.5 118 65 A 19 ALA HB% A 20 ETA HAy 1.0 1.8 6.5 119 66 A 2 TRP HB3 A 5 ALA HB% 1.0 1.8 6.5 120 67 A 2 TRP HB2 A 5 ALA HB% 1.0 1.8 6.5 121 68 A 3 TRP HB3 A 5 ALA HB% 1.0 1.8 6.5 122 69 A 18 TRP HB3 A 14 LEU HD1% 1.0 1.8 6.5 123 70 A 3 TRP HA A 6 LEU HB2 1.0 1.8 3.5 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 GLY C A 2 TRP N A 2 TRP CA A 2 TRP C 1.0 -68.00 -56.00 PHI 2 2 A 2 TRP C A 3 TRP N A 3 TRP CA A 3 TRP C 1.0 -96.27 -42.73 PHI 3 3 A 3 TRP C A 4 LEU N A 4 LEU CA A 4 LEU C 1.0 -71.06 -56.12 PHI 4 4 A 4 LEU C A 5 ALA N A 5 ALA CA A 5 ALA C 1.0 -88.18 -48.54 PHI 5 5 A 5 ALA C A 6 LEU N A 6 LEU CA A 6 LEU C 1.0 -95.23 -44.43 PHI 6 6 A 6 LEU C A 7 ALA N A 7 ALA CA A 7 ALA C 1.0 -113.00 -53.00 PHI 7 7 A 7 ALA C A 8 LEU N A 8 LEU CA A 8 LEU C 1.0 -109.00 -49.00 PHI 8 8 A 10 PRO C A 11 ALA N A 11 ALA CA A 11 ALA C 1.0 -111.00 -31.00 PHI 9 9 A 11 ALA C A 12 LEU N A 12 LEU CA A 12 LEU C 1.0 -73.00 -61.00 PHI 10 10 A 12 LEU C A 13 ALA N A 13 ALA CA A 13 ALA C 1.0 -88.92 -45.96 PHI 11 11 A 13 ALA C A 14 LEU N A 14 LEU CA A 14 LEU C 1.0 -83.00 -51.00 PHI 12 12 A 14 LEU C A 15 ALA N A 15 ALA CA A 15 ALA C 1.0 -80.97 -54.05 PHI 13 13 A 15 ALA C A 16 LEU N A 16 LEU CA A 16 LEU C 1.0 -72.90 -54.24 PHI 14 14 A 16 LEU C A 17 TRP N A 17 TRP CA A 17 TRP C 1.0 -74.20 -54.44 PHI 15 15 A 17 TRP C A 18 TRP N A 18 TRP CA A 18 TRP C 1.0 -69.00 -53.00 PHI 16 16 A 2 TRP N A 2 TRP CA A 2 TRP C A 3 TRP N 1.0 -53.00 -33.00 PSI 17 17 A 3 TRP N A 3 TRP CA A 3 TRP C A 4 LEU N 1.0 -69.28 -2.60 PSI 18 18 A 4 LEU N A 4 LEU CA A 4 LEU C A 5 ALA N 1.0 -54.66 -23.40 PSI 19 19 A 5 ALA N A 5 ALA CA A 5 ALA C A 6 LEU N 1.0 -60.13 -1.49 PSI 20 20 A 6 LEU N A 6 LEU CA A 6 LEU C A 7 ALA N 1.0 -56.44 -3.14 PSI 21 21 A 7 ALA N A 7 ALA CA A 7 ALA C A 8 LEU N 1.0 -70.00 30.00 PSI 22 22 A 8 LEU N A 8 LEU CA A 8 LEU C A 9 ALA N 1.0 -65.00 31.00 PSI 23 23 A 11 ALA N A 11 ALA CA A 11 ALA C A 12 LEU N 1.0 -66.00 26.00 PSI 24 24 A 12 LEU N A 12 LEU CA A 12 LEU C A 13 ALA N 1.0 -57.00 -17.00 PSI 25 25 A 13 ALA N A 13 ALA CA A 13 ALA C A 14 LEU N 1.0 -74.62 8.88 PSI 26 26 A 14 LEU N A 14 LEU CA A 14 LEU C A 15 ALA N 1.0 -61.00 -13.00 PSI 27 27 A 15 ALA N A 15 ALA CA A 15 ALA C A 16 LEU N 1.0 -55.15 -27.85 PSI 28 28 A 16 LEU N A 16 LEU CA A 16 LEU C A 17 TRP N 1.0 -53.46 -27.94 PSI 29 29 A 17 TRP N A 17 TRP CA A 17 TRP C A 18 TRP N 1.0 -52.84 -35.94 PSI 30 30 A 18 TRP N A 18 TRP CA A 18 TRP C A 19 ALA N 1.0 -52.00 -36.00 PSI stop_ save_