data_nef_c16332_2kjn 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 16333 stop_ 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 LYS start . . 2 A 2 LYS middle . . 3 A 3 ALA middle . . 4 A 4 LEU middle . . 5 A 5 LEU middle . . 6 A 6 ALA middle . . 7 A 7 LEU middle . . 8 A 8 ALA middle . . 9 A 9 LEU middle . . 10 A 10 HIS middle . . 11 A 11 HIS middle . . 12 A 12 LEU middle . . 13 A 13 ALA middle . . 14 A 14 HIS middle . . 15 A 15 LEU middle . . 16 A 16 ALA middle . . 17 A 17 LEU middle . . 18 A 18 HIS middle . . 19 A 19 LEU middle . . 20 A 20 ALA middle . . 21 A 21 LEU middle . . 22 A 22 ALA middle . . 23 A 23 LEU middle . . 24 A 24 LYS middle . . 25 A 25 LYS middle . . 26 A 26 ALA 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 LYS HA H 1 4.17 0.02 A 2 LYS H H 1 8.97 0.02 A 2 LYS HA H 1 4.43 0.02 A 2 LYS HBx H 1 1.91 0.03 A 2 LYS HDx H 1 1.78 0.02 A 2 LYS HE2 H 1 3.06 0.02 A 2 LYS HGx H 1 1.57 0.02 A 3 ALA H H 1 8.61 0.02 A 3 ALA HA H 1 4.13 0.02 A 3 ALA HB% H 1 1.61 0.02 A 4 LEU H H 1 7.99 0.02 A 4 LEU HA H 1 4.23 0.02 A 4 LEU HBx H 1 1.98 0.03 A 4 LEU HD1% H 1 1.06 0.02 A 4 LEU HD2% H 1 1.00 0.02 A 4 LEU HG H 1 1.82 0.02 A 5 LEU H H 1 8.46 0.02 A 5 LEU HA H 1 4.16 0.04 A 5 LEU HB2 H 1 1.88 0.02 A 5 LEU HB3 H 1 1.82 0.02 A 5 LEU HD1% H 1 1.03 0.02 A 5 LEU HD2% H 1 0.97 0.02 A 5 LEU HG H 1 1.67 0.02 A 6 ALA H H 1 8.44 0.02 A 6 ALA HA H 1 4.03 0.02 A 6 ALA HB% H 1 1.58 0.02 A 7 LEU H H 1 8.57 0.02 A 7 LEU HA H 1 4.22 0.02 A 7 LEU HB2 H 1 1.91 0.02 A 7 LEU HB3 H 1 1.89 0.02 A 7 LEU HD1% H 1 1.08 0.02 A 7 LEU HD2% H 1 0.99 0.02 A 7 LEU HG H 1 1.66 0.02 A 8 ALA H H 1 7.98 0.02 A 8 ALA HA H 1 4.15 0.05 A 8 ALA HB% H 1 1.60 0.02 A 9 LEU H H 1 8.61 0.02 A 9 LEU HA H 1 4.13 0.02 A 9 LEU HBx H 1 2.00 0.03 A 9 LEU HD1% H 1 1.06 0.02 A 9 LEU HD2% H 1 0.99 0.02 A 9 LEU HG H 1 1.82 0.02 A 10 HIS H H 1 8.46 0.02 A 10 HIS HA H 1 4.39 0.02 A 10 HIS HB2 H 1 3.49 0.02 A 10 HIS HB3 H 1 3.44 0.02 A 10 HIS HD2 H 1 7.14 0.02 A 10 HIS HE1 H 1 8.72 0.04 A 11 HIS H H 1 8.27 0.02 A 11 HIS HA H 1 4.55 0.02 A 11 HIS HB2 H 1 3.43 0.02 A 11 HIS HB3 H 1 3.37 0.02 A 11 HIS HD2 H 1 7.35 0.02 A 11 HIS HE1 H 1 8.76 0.05 A 12 LEU H H 1 8.76 0.05 A 12 LEU HA H 1 4.19 0.02 A 12 LEU HBx H 1 1.94 0.03 A 12 LEU HDx% H 1 0.97 0.03 A 12 LEU HG H 1 1.82 0.02 A 13 ALA H H 1 8.50 0.02 A 13 ALA HA H 1 4.02 0.02 A 13 ALA HB% H 1 1.59 0.02 A 14 HIS H H 1 7.88 0.02 A 14 HIS HA H 1 4.37 0.02 A 14 HIS HB2 H 1 3.45 0.02 A 14 HIS HB3 H 1 3.40 0.02 A 14 HIS HD2 H 1 7.28 0.02 A 14 HIS HE1 H 1 8.67 0.05 A 15 LEU H H 1 7.91 0.05 A 15 LEU HA H 1 4.21 0.05 A 15 LEU HBx H 1 1.97 0.03 A 15 LEU HD1% H 1 1.01 0.02 A 15 LEU HD2% H 1 0.96 0.02 A 15 LEU HG H 1 1.77 0.02 A 16 ALA H H 1 8.59 0.02 A 16 ALA HA H 1 4.44 0.02 A 16 ALA HB% H 1 1.58 0.02 A 17 LEU H H 1 8.48 0.02 A 17 LEU HA H 1 4.12 0.02 A 17 LEU HBx H 1 1.86 0.03 A 17 LEU HDx% H 1 1.00 0.03 A 17 LEU HG H 1 1.65 0.02 A 18 HIS H H 1 8.00 0.02 A 18 HIS HA H 1 4.36 0.02 A 18 HIS HB2 H 1 3.46 0.02 A 18 HIS HB3 H 1 3.35 0.02 A 18 HIS HD2 H 1 7.18 0.02 A 18 HIS HE1 H 1 8.74 0.05 A 19 LEU H H 1 8.11 0.02 A 19 LEU HA H 1 4.11 0.02 A 19 LEU HBx H 1 1.89 0.03 A 19 LEU HD1% H 1 0.99 0.02 A 19 LEU HD2% H 1 0.96 0.02 A 19 LEU HG H 1 1.78 0.02 A 20 ALA H H 1 8.66 0.02 A 20 ALA HA H 1 4.02 0.02 A 20 ALA HB% H 1 1.53 0.02 A 21 LEU H H 1 8.16 0.02 A 21 LEU HA H 1 4.19 0.02 A 21 LEU HBx H 1 1.97 0.03 A 21 LEU HDx% H 1 1.02 0.03 A 21 LEU HG H 1 1.81 0.02 A 22 ALA H H 1 7.89 0.02 A 22 ALA HA H 1 4.07 0.02 A 22 ALA HB% H 1 1.58 0.02 A 23 LEU H H 1 8.17 0.02 A 23 LEU HA H 1 4.18 0.02 A 23 LEU HB2 H 1 1.99 0.02 A 23 LEU HB3 H 1 1.94 0.02 A 23 LEU HDy% H 1 0.96 0.03 A 23 LEU HG H 1 1.63 0.02 A 24 LYS H H 1 7.97 0.02 A 24 LYS HA H 1 4.15 0.05 A 24 LYS HBx H 1 2.05 0.03 A 24 LYS HDx H 1 1.97 0.03 A 24 LYS HEx H 1 3.04 0.03 A 24 LYS HGx H 1 1.74 0.03 A 25 LYS H H 1 7.89 0.05 A 25 LYS HA H 1 4.24 0.05 A 25 LYS HBx H 1 1.98 0.03 A 25 LYS HDx H 1 1.78 0.03 A 25 LYS HEx H 1 3.06 0.03 A 25 LYS HGx H 1 1.61 0.03 A 26 ALA H H 1 7.86 0.05 A 26 ALA HA H 1 4.25 0.05 A 26 ALA HB% H 1 1.54 0.02 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 LYS HA A 3 ALA H 1.0 3.3 4.1 2 2 A 3 ALA H A 2 LYS HBx 1.0 3.7 6.1 3 2 A 3 ALA H A 2 LYS HBy 1.0 3.7 6.1 4 3 A 2 LYS HA A 2 LYS H 1.0 2.3 2.9 5 4 A 3 ALA H A 2 LYS HE2 1.0 3.6 6.0 6 4 A 3 ALA H A 2 LYS HEy 1.0 3.6 6.0 7 5 A 3 ALA H A 2 LYS HGx 1.0 3.5 5.3 8 5 A 3 ALA H A 2 LYS HGy 1.0 3.5 5.3 9 6 A 3 ALA HA A 4 LEU H 1.0 3.5 4.9 10 7 A 4 LEU H A 3 ALA HB% 1.0 3.5 5.9 11 8 A 3 ALA H A 3 ALA HB% 1.0 2.6 3.4 12 9 A 3 ALA H A 3 ALA HA 1.0 2.4 3.0 13 10 A 3 ALA HA A 3 ALA HB% 1.0 2.4 3.2 14 11 A 4 LEU HA A 5 LEU H 1.0 3.7 5.1 15 12 A 5 LEU H A 4 LEU HBx 1.0 3.5 5.9 16 12 A 5 LEU H A 4 LEU HBy 1.0 3.5 5.9 17 13 A 4 LEU H A 4 LEU HBx 1.0 2.6 4.0 18 13 A 4 LEU H A 4 LEU HBy 1.0 2.6 4.0 19 14 A 4 LEU H A 4 LEU HA 1.0 2.4 3.0 20 15 A 5 LEU H A 4 LEU HD1% 1.0 3.5 5.9 21 16 A 5 LEU H A 4 LEU HD2% 1.0 3.8 6.2 22 17 A 5 LEU H A 4 LEU HG 1.0 3.4 4.8 23 18 A 5 LEU HA A 6 ALA H 1.0 3.5 4.9 24 19 A 6 ALA H A 5 LEU HB2 1.0 3.5 5.9 25 19 A 6 ALA H A 5 LEU HB3 1.0 3.5 5.9 26 20 A 5 LEU H A 5 LEU HB3 1.0 2.3 2.9 27 21 A 5 LEU H A 5 LEU HB2 1.0 2.6 3.4 28 22 A 5 LEU H A 5 LEU HA 1.0 2.3 2.9 29 23 A 6 ALA H A 5 LEU HD2% 1.0 3.5 5.9 30 24 A 6 ALA H A 5 LEU HD1% 1.0 3.7 6.1 31 25 A 6 ALA H A 5 LEU HG 1.0 3.5 4.3 32 26 A 6 ALA HA A 7 LEU H 1.0 3.6 5.0 33 27 A 7 LEU H A 6 ALA HB% 1.0 3.5 5.9 34 28 A 6 ALA H A 6 ALA HB% 1.0 2.8 3.6 35 29 A 6 ALA H A 6 ALA HA 1.0 2.4 3.0 36 30 A 6 ALA HA A 6 ALA HB% 1.0 2.4 3.2 37 31 A 7 LEU HA A 8 ALA H 1.0 3.5 4.9 38 32 A 8 ALA H A 7 LEU HB2 1.0 3.5 5.9 39 32 A 8 ALA H A 7 LEU HB3 1.0 3.5 5.9 40 33 A 7 LEU H A 7 LEU HB3 1.0 2.9 4.3 41 34 A 7 LEU H A 7 LEU HB2 1.0 2.2 2.8 42 35 A 7 LEU H A 7 LEU HA 1.0 2.4 3.0 43 36 A 8 ALA H A 7 LEU HD1% 1.0 3.5 5.9 44 37 A 8 ALA H A 7 LEU HD2% 1.0 3.7 6.1 45 38 A 8 ALA HA A 9 LEU H 1.0 2.9 3.5 46 39 A 8 ALA H A 9 LEU H 1.0 2.2 2.8 47 40 A 8 ALA H A 10 HIS H 1.0 3.4 4.8 48 41 A 8 ALA HA A 10 HIS H 1.0 3.4 4.8 49 42 A 9 LEU H A 8 ALA HB% 1.0 2.6 4.2 50 43 A 8 ALA H A 8 ALA HB% 1.0 2.6 3.4 51 44 A 8 ALA H A 8 ALA HA 1.0 2.3 2.9 52 45 A 8 ALA HA A 8 ALA HB% 1.0 2.4 3.2 53 46 A 8 ALA HA A 11 HIS HB3 1.0 2.8 3.6 54 47 A 9 LEU H A 10 HIS H 1.0 2.2 2.8 55 48 A 9 LEU H A 11 HIS H 1.0 3.4 4.8 56 49 A 10 HIS H A 9 LEU HA 1.0 2.9 3.5 57 50 A 11 HIS H A 9 LEU HA 1.0 3.4 4.8 58 51 A 9 LEU HA A 12 LEU H 1.0 2.8 3.4 59 52 A 9 LEU HA A 13 ALA H 1.0 3.4 4.8 60 53 A 10 HIS H A 9 LEU HBx 1.0 2.5 4.1 61 53 A 10 HIS H A 9 LEU HBy 1.0 2.5 4.1 62 54 A 9 LEU HA A 12 LEU HBx 1.0 2.8 4.4 63 54 A 9 LEU HA A 12 LEU HBy 1.0 2.8 4.4 64 55 A 9 LEU H A 11 HIS HD2 1.0 3.2 4.0 65 56 A 9 LEU H A 10 HIS HD2 1.0 3.4 4.8 66 57 A 9 LEU H A 9 LEU HBx 1.0 2.5 3.8 67 57 A 9 LEU H A 9 LEU HBy 1.0 2.5 3.8 68 58 A 9 LEU H A 9 LEU HA 1.0 2.2 2.8 69 59 A 10 HIS H A 9 LEU HD1% 1.0 3.6 5.4 70 60 A 10 HIS H A 9 LEU HD2% 1.0 3.3 5.1 71 61 A 10 HIS H A 9 LEU HG 1.0 3.2 4.0 72 62 A 11 HIS HB2 A 9 LEU HBx 1.0 3.4 5.8 73 62 A 9 LEU HBy A 11 HIS HB2 1.0 3.4 5.8 74 63 A 10 HIS H A 11 HIS H 1.0 2.2 2.8 75 64 A 10 HIS H A 12 LEU H 1.0 3.4 4.8 76 65 A 11 HIS H A 10 HIS HA 1.0 2.9 3.5 77 66 A 12 LEU H A 10 HIS HA 1.0 3.4 4.8 78 67 A 13 ALA H A 10 HIS HA 1.0 2.8 3.4 79 68 A 10 HIS HA A 14 HIS H 1.0 3.4 4.8 80 69 A 11 HIS H A 10 HIS HB3 1.0 2.8 3.4 81 70 A 11 HIS H A 10 HIS HB2 1.0 3.2 4.0 82 71 A 12 LEU H A 10 HIS HB3 1.0 3.4 4.8 83 72 A 12 LEU H A 10 HIS HB2 1.0 3.7 5.1 84 73 A 10 HIS HA A 13 ALA HB% 1.0 2.8 4.4 85 74 A 10 HIS H A 10 HIS HD2 1.0 3.1 3.7 86 75 A 10 HIS HD2 A 10 HIS HB3 1.0 2.7 3.5 87 76 A 10 HIS HB3 A 10 HIS HE1 1.0 4.6 5.2 88 77 A 10 HIS HB2 A 10 HIS HE1 1.0 4.6 5.2 89 78 A 10 HIS HD2 A 10 HIS HB2 1.0 2.7 3.5 90 79 A 10 HIS H A 10 HIS HB3 1.0 2.2 2.8 91 80 A 10 HIS H A 10 HIS HB2 1.0 3.0 4.4 92 81 A 10 HIS H A 10 HIS HA 1.0 2.2 2.8 93 82 A 10 HIS H A 11 HIS HD2 1.0 3.5 4.3 94 83 A 11 HIS H A 12 LEU H 1.0 2.2 2.8 95 84 A 11 HIS H A 13 ALA H 1.0 3.4 4.8 96 85 A 12 LEU H A 11 HIS HA 1.0 2.9 3.5 97 86 A 13 ALA H A 11 HIS HA 1.0 3.4 4.8 98 87 A 14 HIS H A 11 HIS HA 1.0 2.8 3.4 99 88 A 11 HIS HB3 A 12 LEU H 1.0 2.8 3.4 100 89 A 12 LEU H A 11 HIS HB2 1.0 3.2 4.0 101 90 A 11 HIS HB3 A 13 ALA H 1.0 3.4 4.8 102 91 A 13 ALA H A 11 HIS HB2 1.0 3.7 5.1 103 92 A 11 HIS HA A 14 HIS HB3 1.0 2.8 4.4 104 92 A 11 HIS HA A 14 HIS HB2 1.0 2.8 4.4 105 93 A 11 HIS H A 11 HIS HD2 1.0 3.2 4.0 106 94 A 11 HIS HB2 A 11 HIS HD1 1.0 2.7 3.5 107 95 A 11 HIS HB3 A 11 HIS HE1 1.0 4.6 5.2 108 96 A 11 HIS HB3 A 11 HIS HD2 1.0 2.7 3.5 109 97 A 11 HIS HB2 A 11 HIS HE1 1.0 4.6 5.2 110 98 A 11 HIS HB3 A 11 HIS H 1.0 3.0 4.4 111 99 A 11 HIS H A 11 HIS HB2 1.0 2.2 2.8 112 100 A 11 HIS H A 11 HIS HA 1.0 2.2 2.8 113 101 A 12 LEU H A 13 ALA H 1.0 2.2 2.8 114 102 A 12 LEU H A 14 HIS H 1.0 3.4 4.8 115 103 A 13 ALA H A 12 LEU HA 1.0 2.9 3.5 116 104 A 14 HIS H A 12 LEU HA 1.0 3.4 4.8 117 105 A 12 LEU HA A 15 LEU H 1.0 2.8 3.4 118 106 A 13 ALA H A 12 LEU HBx 1.0 2.5 4.1 119 106 A 13 ALA H A 12 LEU HBy 1.0 2.5 4.1 120 107 A 12 LEU H A 12 LEU HBx 1.0 2.5 3.8 121 107 A 12 LEU H A 12 LEU HBy 1.0 2.5 3.8 122 108 A 12 LEU H A 12 LEU HA 1.0 2.2 2.8 123 109 A 13 ALA H A 12 LEU HDx% 1.0 3.4 6.4 124 109 A 13 ALA H A 12 LEU HD21 1.0 3.4 6.4 125 110 A 13 ALA H A 12 LEU HG 1.0 3.8 5.2 126 111 A 12 LEU HA A 14 HIS HD2 1.0 3.4 4.8 127 112 A 13 ALA H A 15 LEU H 1.0 3.4 4.8 128 113 A 13 ALA H A 14 HIS H 1.0 2.2 2.8 129 114 A 14 HIS H A 13 ALA HA 1.0 2.9 3.5 130 115 A 15 LEU H A 13 ALA HA 1.0 3.4 4.8 131 116 A 13 ALA HA A 16 ALA H 1.0 2.8 3.4 132 117 A 14 HIS H A 13 ALA HB% 1.0 2.6 4.2 133 118 A 13 ALA HA A 16 ALA HB% 1.0 2.9 4.5 134 119 A 13 ALA H A 13 ALA HB% 1.0 2.6 3.4 135 120 A 13 ALA H A 13 ALA HA 1.0 2.2 2.8 136 121 A 14 HIS H A 15 LEU H 1.0 2.2 2.8 137 122 A 14 HIS H A 16 ALA H 1.0 3.4 4.8 138 123 A 15 LEU H A 14 HIS HA 1.0 2.9 3.5 139 124 A 16 ALA H A 14 HIS HA 1.0 3.4 4.8 140 125 A 14 HIS HA A 17 LEU H 1.0 2.8 3.4 141 126 A 14 HIS HA A 18 HIS H 1.0 3.4 4.8 142 127 A 15 LEU H A 14 HIS HB3 1.0 2.6 3.2 143 128 A 14 HIS HB2 A 15 LEU H 1.0 3.2 4.0 144 129 A 16 ALA H A 14 HIS HB3 1.0 3.4 4.8 145 130 A 14 HIS HB2 A 16 ALA H 1.0 3.7 5.1 146 131 A 14 HIS H A 14 HIS HD2 1.0 3.1 3.7 147 132 A 14 HIS HB2 A 14 HIS HD2 1.0 2.7 3.5 148 133 A 14 HIS HE1 A 14 HIS HB3 1.0 4.6 5.2 149 134 A 14 HIS HD2 A 14 HIS HB3 1.0 2.7 3.5 150 135 A 14 HIS HB2 A 14 HIS HE1 1.0 4.5 5.1 151 136 A 14 HIS H A 14 HIS HB2 1.0 2.9 4.3 152 137 A 14 HIS H A 14 HIS HB3 1.0 2.2 2.8 153 138 A 14 HIS H A 14 HIS HA 1.0 2.2 2.8 154 139 A 14 HIS HA A 17 LEU HBy 1.0 2.6 3.4 155 140 A 14 HIS HE1 A 18 HIS HD2 1.0 3.5 4.3 156 141 A 15 LEU H A 16 ALA H 1.0 2.2 2.8 157 142 A 15 LEU H A 17 LEU H 1.0 3.4 4.8 158 143 A 16 ALA H A 15 LEU HA 1.0 2.9 3.5 159 144 A 17 LEU H A 15 LEU HA 1.0 3.4 4.8 160 145 A 18 HIS H A 15 LEU HA 1.0 2.8 3.4 161 146 A 15 LEU HA A 19 LEU H 1.0 3.4 4.8 162 147 A 16 ALA H A 15 LEU HBx 1.0 2.5 4.1 163 147 A 16 ALA H A 15 LEU HBy 1.0 2.5 4.1 164 148 A 15 LEU H A 15 LEU HBx 1.0 2.4 3.8 165 148 A 15 LEU H A 15 LEU HBy 1.0 2.4 3.8 166 149 A 15 LEU H A 15 LEU HA 1.0 2.2 2.8 167 150 A 16 ALA H A 15 LEU HD1% 1.0 3.3 5.1 168 151 A 16 ALA H A 15 LEU HD2% 1.0 3.6 5.4 169 152 A 16 ALA H A 15 LEU HG 1.0 3.2 4.0 170 153 A 15 LEU H A 16 ALA HB% 1.0 3.9 6.3 171 154 A 15 LEU H A 16 ALA HA 1.0 3.7 5.1 172 155 A 14 HIS HE1 A 15 LEU HD1% 1.0 3.5 5.9 173 156 A 16 ALA H A 17 LEU H 1.0 2.2 2.8 174 157 A 16 ALA H A 18 HIS H 1.0 3.4 4.8 175 158 A 17 LEU H A 16 ALA HA 1.0 2.9 3.5 176 159 A 18 HIS H A 16 ALA HA 1.0 3.4 4.8 177 160 A 19 LEU H A 16 ALA HA 1.0 2.8 3.4 178 161 A 16 ALA HB% A 17 LEU H 1.0 2.9 4.5 179 162 A 16 ALA HA A 19 LEU HBx 1.0 3.0 4.6 180 162 A 16 ALA HA A 19 LEU HBy 1.0 3.0 4.6 181 163 A 16 ALA H A 16 ALA HB% 1.0 2.6 3.4 182 164 A 16 ALA H A 16 ALA HA 1.0 2.2 2.8 183 165 A 17 LEU H A 18 HIS H 1.0 2.2 2.8 184 166 A 17 LEU H A 19 LEU H 1.0 3.4 4.8 185 167 A 18 HIS H A 17 LEU HA 1.0 2.9 3.5 186 168 A 19 LEU H A 17 LEU HA 1.0 3.4 4.8 187 169 A 17 LEU HA A 20 ALA H 1.0 2.8 3.4 188 170 A 17 LEU HA A 21 LEU H 1.0 3.4 4.8 189 171 A 18 HIS H A 17 LEU HBx 1.0 2.6 4.2 190 171 A 18 HIS H A 17 LEU HBy 1.0 2.6 4.2 191 172 A 17 LEU HA A 20 ALA HB% 1.0 2.8 4.4 192 173 A 18 HIS HD2 A 17 LEU HDx% 1.0 3.5 6.3 193 173 A 18 HIS HD2 A 17 LEU HD21 1.0 3.5 6.3 194 174 A 18 HIS HD2 A 17 LEU HBx 1.0 3.2 5.0 195 174 A 18 HIS HD2 A 17 LEU HBy 1.0 3.2 5.0 196 175 A 18 HIS HD2 A 17 LEU HG 1.0 3.5 4.9 197 176 A 17 LEU H A 17 LEU HBx 1.0 2.5 3.8 198 176 A 17 LEU H A 17 LEU HBy 1.0 2.5 3.8 199 177 A 17 LEU H A 17 LEU HA 1.0 2.2 2.8 200 178 A 18 HIS H A 17 LEU HDx% 1.0 3.5 6.3 201 178 A 18 HIS H A 17 LEU HD21 1.0 3.5 6.3 202 179 A 18 HIS H A 17 LEU HG 1.0 3.8 5.2 203 180 A 17 LEU HG A 18 HIS HB2 1.0 3.4 4.8 204 181 A 18 HIS H A 19 LEU H 1.0 2.2 2.8 205 182 A 18 HIS H A 20 ALA H 1.0 3.4 4.8 206 183 A 19 LEU H A 18 HIS HA 1.0 2.9 3.5 207 184 A 20 ALA H A 18 HIS HA 1.0 3.4 4.8 208 185 A 21 LEU H A 18 HIS HA 1.0 2.8 3.4 209 186 A 19 LEU H A 18 HIS HB3 1.0 2.8 3.4 210 187 A 19 LEU H A 18 HIS HB2 1.0 3.2 4.0 211 188 A 20 ALA H A 18 HIS HB3 1.0 3.4 4.8 212 189 A 20 ALA H A 18 HIS HB2 1.0 3.7 5.1 213 190 A 18 HIS H A 18 HIS HD2 1.0 3.1 3.7 214 191 A 18 HIS HB2 A 18 HIS HE1 1.0 4.6 5.2 215 192 A 18 HIS HD2 A 18 HIS HB3 1.0 2.7 3.5 216 193 A 18 HIS HB3 A 18 HIS HE1 1.0 4.6 5.2 217 194 A 18 HIS HD2 A 18 HIS HB2 1.0 2.7 3.5 218 195 A 18 HIS H A 18 HIS HB3 1.0 2.2 2.8 219 196 A 18 HIS H A 18 HIS HB2 1.0 3.0 4.4 220 197 A 18 HIS H A 18 HIS HA 1.0 2.2 2.8 221 198 A 18 HIS HE1 A 19 LEU HD1% 1.0 2.7 5.5 222 198 A 18 HIS HE1 A 19 LEU HD2% 1.0 2.7 5.5 223 199 A 19 LEU H A 20 ALA H 1.0 2.2 2.8 224 200 A 19 LEU H A 21 LEU H 1.0 3.4 4.8 225 201 A 20 ALA H A 19 LEU HA 1.0 2.9 3.5 226 202 A 21 LEU H A 19 LEU HA 1.0 3.4 4.8 227 203 A 19 LEU HA A 22 ALA H 1.0 2.8 3.4 228 204 A 20 ALA H A 19 LEU HBx 1.0 2.6 4.2 229 204 A 19 LEU HBy A 20 ALA H 1.0 2.6 4.2 230 205 A 19 LEU HA A 22 ALA HB% 1.0 3.1 4.7 231 206 A 19 LEU H A 19 LEU HBx 1.0 2.4 3.7 232 206 A 19 LEU H A 19 LEU HBy 1.0 2.4 3.7 233 207 A 19 LEU H A 19 LEU HA 1.0 2.2 2.8 234 208 A 20 ALA H A 19 LEU HD1% 1.0 3.6 6.6 235 208 A 20 ALA H A 19 LEU HD2% 1.0 3.6 6.6 236 209 A 20 ALA H A 19 LEU HG 1.0 3.7 5.1 237 210 A 20 ALA H A 21 LEU H 1.0 2.2 2.8 238 211 A 20 ALA H A 22 ALA H 1.0 3.4 4.8 239 212 A 21 LEU H A 20 ALA HA 1.0 2.9 3.5 240 213 A 22 ALA H A 20 ALA HA 1.0 3.4 4.8 241 214 A 20 ALA HA A 23 LEU H 1.0 2.8 3.4 242 215 A 20 ALA HA A 24 LYS H 1.0 3.4 4.8 243 216 A 21 LEU H A 20 ALA HB% 1.0 2.5 4.1 244 217 A 20 ALA HA A 23 LEU HB2 1.0 2.8 4.4 245 217 A 20 ALA HA A 23 LEU HB3 1.0 2.8 4.4 246 218 A 20 ALA H A 20 ALA HB% 1.0 2.6 3.4 247 219 A 20 ALA H A 20 ALA HA 1.0 2.2 2.8 248 220 A 21 LEU H A 22 ALA H 1.0 2.2 2.8 249 221 A 21 LEU H A 23 LEU H 1.0 3.4 4.8 250 222 A 22 ALA H A 21 LEU HA 1.0 2.9 3.5 251 223 A 23 LEU H A 21 LEU HA 1.0 3.4 4.8 252 224 A 24 LYS H A 21 LEU HA 1.0 2.8 3.4 253 225 A 22 ALA H A 21 LEU HBx 1.0 2.5 4.1 254 225 A 22 ALA H A 21 LEU HBy 1.0 2.5 4.1 255 226 A 21 LEU HA A 24 LYS HBx 1.0 2.9 4.5 256 226 A 21 LEU HA A 24 LYS HBy 1.0 2.9 4.5 257 227 A 21 LEU H A 21 LEU HBx 1.0 2.3 3.6 258 227 A 21 LEU H A 21 LEU HBy 1.0 2.3 3.6 259 228 A 21 LEU H A 21 LEU HA 1.0 2.2 2.8 260 229 A 22 ALA H A 21 LEU HDx% 1.0 3.5 6.3 261 229 A 22 ALA H A 21 LEU HD21 1.0 3.5 6.3 262 230 A 22 ALA H A 23 LEU H 1.0 2.2 2.8 263 231 A 22 ALA H A 24 LYS H 1.0 3.4 4.8 264 232 A 23 LEU H A 22 ALA HA 1.0 2.9 3.5 265 233 A 24 LYS H A 22 ALA HA 1.0 3.4 4.8 266 234 A 22 ALA HA A 25 LYS H 1.0 2.8 3.4 267 235 A 22 ALA HB% A 23 LEU H 1.0 2.8 4.4 268 236 A 22 ALA H A 22 ALA HB% 1.0 2.6 3.4 269 237 A 22 ALA H A 22 ALA HA 1.0 2.2 2.8 270 238 A 23 LEU H A 24 LYS H 1.0 2.2 2.8 271 239 A 24 LYS H A 23 LEU HA 1.0 2.9 3.5 272 240 A 24 LYS H A 23 LEU HB2 1.0 2.5 4.1 273 240 A 24 LYS H A 23 LEU HB3 1.0 2.5 4.1 274 241 A 23 LEU H A 23 LEU HB3 1.0 2.2 2.8 275 242 A 23 LEU H A 23 LEU HB2 1.0 2.9 4.3 276 243 A 23 LEU H A 23 LEU HA 1.0 2.2 2.8 277 244 A 24 LYS H A 23 LEU HD11 1.0 3.6 6.6 278 244 A 24 LYS H A 23 LEU HDy% 1.0 3.6 6.6 279 245 A 25 LYS H A 24 LYS HA 1.0 2.9 3.5 280 246 A 25 LYS H A 24 LYS HBx 1.0 3.5 5.3 281 246 A 24 LYS HBy A 25 LYS H 1.0 3.5 5.3 282 247 A 24 LYS H A 24 LYS HBx 1.0 2.5 3.9 283 247 A 24 LYS H A 24 LYS HBy 1.0 2.5 3.9 284 248 A 24 LYS H A 24 LYS HA 1.0 2.2 2.8 285 249 A 24 LYS HA A 24 LYS HDx 1.0 3.5 4.9 286 249 A 24 LYS HA A 24 LYS HDy 1.0 3.5 4.9 287 250 A 24 LYS HA A 24 LYS HGx 1.0 2.4 3.6 288 250 A 24 LYS HA A 24 LYS HGy 1.0 2.4 3.6 289 251 A 25 LYS H A 24 LYS HGy 1.0 3.5 5.3 290 251 A 25 LYS H A 24 LYS HGx 1.0 3.5 5.3 291 252 A 25 LYS H A 24 LYS HEx 1.0 3.7 6.1 292 252 A 25 LYS H A 24 LYS HEy 1.0 3.7 6.1 293 253 A 25 LYS HA A 26 ALA H 1.0 3.5 4.3 294 254 A 25 LYS H A 25 LYS HBx 1.0 2.6 4.0 295 254 A 25 LYS H A 25 LYS HBy 1.0 2.6 4.0 296 255 A 25 LYS H A 25 LYS HA 1.0 2.3 2.9 297 256 A 25 LYS HA A 25 LYS HGx 1.0 2.4 3.6 298 256 A 25 LYS HA A 25 LYS HGy 1.0 2.4 3.6 299 257 A 25 LYS HA A 25 LYS HDx 1.0 3.5 4.9 300 257 A 25 LYS HA A 25 LYS HDy 1.0 3.5 4.9 301 258 A 26 ALA H A 25 LYS HGy 1.0 3.4 5.8 302 258 A 26 ALA H A 25 LYS HGx 1.0 3.4 5.8 303 259 A 26 ALA H A 25 LYS HEx 1.0 3.5 5.3 304 259 A 26 ALA H A 25 LYS HEy 1.0 3.5 5.3 305 260 A 26 ALA H A 26 ALA HB% 1.0 2.6 3.4 306 261 A 26 ALA H A 26 ALA HA 1.0 2.4 3.0 307 262 A 26 ALA HB% A 26 ALA HA 1.0 2.4 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 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 12 LEU H A 9 LEU O 1.0 1.5 2.3 2 2 A 13 ALA H A 9 LEU O 1.0 1.5 2.3 3 3 A 14 HIS H A 10 HIS O 1.0 1.5 2.3 4 4 A 15 LEU H A 11 HIS O 1.0 1.5 2.3 5 5 A 16 ALA H A 12 LEU O 1.0 1.5 2.3 6 6 A 17 LEU H A 13 ALA O 1.0 1.5 2.3 7 7 A 18 HIS H A 14 HIS O 1.0 1.5 2.3 8 8 A 19 LEU H A 15 LEU O 1.0 1.5 2.3 9 9 A 20 ALA H A 16 ALA O 1.0 1.5 2.3 10 10 A 21 LEU H A 17 LEU O 1.0 1.5 2.3 11 11 A 22 ALA H A 18 HIS O 1.0 1.5 2.3 12 12 A 23 LEU H A 19 LEU O 1.0 1.5 2.3 13 13 A 24 LYS H A 20 ALA O 1.0 1.5 2.3 14 14 A 25 LYS H A 21 LEU O 1.0 1.5 2.3 stop_ save_