data_nef_c25189_2mtw 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 2MTW BMRB 25190 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 TYR start . . 2 A 2 THR middle . . 3 A 3 ASN middle . . 4 A 4 GLN middle . . 5 A 5 ASN middle . . 6 A 6 ILE middle . . 7 A 7 ASN middle . . 8 A 8 ILE middle . . 9 A 9 SER middle . . 10 A 10 GLN middle . . 11 A 11 GLU middle . . 12 A 12 ARG middle . . 13 A 13 ASP middle . . 14 A 14 LEU middle . . 15 A 15 GLN middle . . 16 A 16 LYS middle . . 17 A 17 HIS middle . . 18 A 18 GLY middle . false 19 A 19 PHE middle . . 20 A 20 HIS 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 TYR H1 H 1 8.510 0.02 A 1 TYR HA H 1 4.508 0.02 A 1 TYR HBy H 1 3.080 0.02 A 1 TYR HBx H 1 2.900 0.02 A 1 TYR HDx H 1 7.020 0.02 A 1 TYR HDy H 1 7.020 0.02 A 1 TYR HEx H 1 6.750 0.02 A 1 TYR HEy H 1 6.750 0.02 A 2 THR H H 1 7.920 0.02 A 2 THR HA H 1 4.220 0.02 A 2 THR HB H 1 4.160 0.02 A 2 THR HG2% H 1 1.090 0.02 A 3 ASN H H 1 8.110 0.02 A 3 ASN HA H 1 4.560 0.02 A 3 ASN HBx H 1 2.560 0.02 A 3 ASN HBy H 1 2.560 0.02 A 3 ASN HD2y H 1 7.340 0.02 A 3 ASN HD2x H 1 6.710 0.02 A 4 GLN H H 1 7.980 0.02 A 4 GLN HA H 1 4.210 0.02 A 4 GLN HBx H 1 1.900 0.02 A 4 GLN HBy H 1 2.050 0.02 A 4 GLN HGx H 1 2.280 0.02 A 4 GLN HGy H 1 2.280 0.02 A 5 ASN H H 1 8.210 0.02 A 5 ASN HA H 1 4.590 0.02 A 5 ASN HBx H 1 2.420 0.02 A 5 ASN HBy H 1 2.580 0.02 A 5 ASN HD2y H 1 7.420 0.02 A 5 ASN HD2x H 1 6.750 0.02 A 6 ILE H H 1 7.620 0.02 A 6 ILE HA H 1 4.180 0.02 A 6 ILE HB H 1 1.800 0.02 A 6 ILE HG1x H 1 1.100 0.02 A 6 ILE HG1y H 1 1.600 0.02 A 6 ILE HG2% H 1 0.800 0.02 A 7 ASN H H 1 8.250 0.02 A 7 ASN HA H 1 4.620 0.02 A 7 ASN HBx H 1 2.570 0.02 A 7 ASN HBy H 1 2.570 0.02 A 7 ASN HD2y H 1 6.980 0.02 A 7 ASN HD2x H 1 6.730 0.02 A 8 ILE H H 1 7.990 0.02 A 8 ILE HA H 1 4.050 0.02 A 8 ILE HB H 1 1.850 0.02 A 8 ILE HG1y H 1 1.510 0.02 A 8 ILE HG1x H 1 1.200 0.02 A 8 ILE HG2% H 1 0.850 0.02 A 9 SER H H 1 7.990 0.02 A 9 SER HA H 1 4.180 0.02 A 9 SER HBx H 1 3.620 0.02 A 9 SER HBy H 1 3.700 0.02 A 10 GLN H H 1 7.980 0.02 A 10 GLN HA H 1 4.190 0.02 A 10 GLN HBx H 1 2.020 0.02 A 10 GLN HBy H 1 2.120 0.02 A 10 GLN HGx H 1 2.300 0.02 A 10 GLN HGy H 1 2.300 0.02 A 11 GLU H H 1 7.850 0.02 A 11 GLU HA H 1 4.180 0.02 A 11 GLU HBx H 1 2.110 0.02 A 11 GLU HBy H 1 2.110 0.02 A 11 GLU HGx H 1 2.360 0.02 A 11 GLU HGy H 1 2.450 0.02 A 12 ARG H H 1 7.890 0.02 A 12 ARG HA H 1 4.160 0.02 A 12 ARG HBx H 1 1.790 0.02 A 12 ARG HBy H 1 1.880 0.02 A 12 ARG HGx H 1 1.610 0.02 A 12 ARG HGy H 1 1.610 0.02 A 13 ASP H H 1 8.210 0.02 A 13 ASP HA H 1 4.600 0.02 A 13 ASP HBy H 1 2.920 0.02 A 13 ASP HBx H 1 2.900 0.02 A 14 LEU H H 1 7.940 0.02 A 14 LEU HA H 1 4.120 0.02 A 14 LEU HBx H 1 1.850 0.02 A 14 LEU HBy H 1 1.850 0.02 A 14 LEU HDx% H 1 0.750 0.02 A 14 LEU HDy% H 1 0.680 0.02 A 15 GLN H H 1 8.000 0.02 A 15 GLN HA H 1 4.180 0.02 A 15 GLN HBx H 1 2.120 0.02 A 15 GLN HBy H 1 2.120 0.02 A 15 GLN HGy H 1 2.400 0.02 A 15 GLN HGx H 1 2.340 0.02 A 16 LYS H H 1 7.760 0.02 A 16 LYS HA H 1 4.120 0.02 A 16 LYS HBx H 1 1.780 0.02 A 16 LYS HBy H 1 1.840 0.02 A 16 LYS HDx H 1 1.600 0.02 A 16 LYS HDy H 1 1.600 0.02 A 16 LYS HGy H 1 1.420 0.02 A 16 LYS HGx H 1 1.380 0.02 A 17 HIS H H 1 8.110 0.02 A 17 HIS HA H 1 4.580 0.02 A 17 HIS HBx H 1 2.960 0.02 A 17 HIS HBy H 1 3.150 0.02 A 17 HIS HD2 H 1 7.300 0.02 A 18 GLY H H 1 8.210 0.02 A 18 GLY HAx H 1 3.700 0.02 A 18 GLY HAy H 1 3.700 0.02 A 19 PHE H H 1 8.280 0.02 A 19 PHE HA H 1 4.410 0.02 A 19 PHE HBy H 1 3.000 0.02 A 19 PHE HBx H 1 2.800 0.02 A 19 PHE HDx H 1 7.150 0.02 A 19 PHE HDy H 1 7.150 0.02 A 20 HIS H H 1 8.400 0.02 A 20 HIS HA H 1 4.540 0.02 A 20 HIS HBx H 1 2.960 0.02 A 20 HIS HBy H 1 3.120 0.02 A 20 HIS HD2 H 1 7.300 0.02 stop_ save_ save_Discover_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode Discover_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 THR H A 2 THR HA 1.0 2.8 3.5 2 2 A 3 ASN H A 3 ASN HA 1.0 1.8 2.8 3 3 A 4 GLN H A 4 GLN HA 1.0 1.8 2.8 4 4 A 5 ASN H A 5 ASN HA 1.0 1.8 2.8 5 5 A 6 ILE H A 6 ILE HA 1.0 1.8 2.8 6 6 A 7 ASN H A 7 ASN HA 1.0 1.8 2.8 7 7 A 8 ILE H A 8 ILE HA 1.0 1.8 2.8 8 8 A 9 SER H A 9 SER HA 1.0 1.8 2.8 9 9 A 10 GLN H A 10 GLN HA 1.0 1.8 2.8 10 10 A 11 GLU H A 11 GLU HA 1.0 1.8 2.8 11 11 A 12 ARG H A 12 ARG HA 1.0 1.8 2.8 12 12 A 13 ASP H A 13 ASP HA 1.0 1.8 2.8 13 13 A 14 LEU H A 14 LEU HA 1.0 1.8 2.8 14 14 A 15 GLN H A 15 GLN HA 1.0 1.8 2.8 15 15 A 16 LYS H A 16 LYS HA 1.0 1.8 2.8 16 16 A 17 HIS H A 17 HIS HA 1.0 2.8 3.5 17 17 A 19 PHE H A 19 PHE HA 1.0 1.8 2.8 18 18 A 20 HIS H A 20 HIS HA 1.0 2.8 3.5 19 19 A 1 TYR HA A 2 THR H 1.0 1.8 2.8 20 20 A 2 THR HA A 3 ASN H 1.0 1.8 2.8 21 21 A 3 ASN HA A 4 GLN H 1.0 1.8 2.8 22 22 A 4 GLN HA A 5 ASN H 1.0 1.8 2.8 23 23 A 5 ASN HA A 6 ILE H 1.0 1.8 2.8 24 24 A 6 ILE HA A 7 ASN H 1.0 1.8 2.8 25 25 A 7 ASN HA A 8 ILE H 1.0 1.8 2.8 26 26 A 8 ILE HA A 9 SER H 1.0 1.8 2.8 27 27 A 9 SER HA A 10 GLN H 1.0 1.8 2.8 28 28 A 10 GLN HA A 11 GLU H 1.0 2.8 3.5 29 29 A 11 GLU HA A 12 ARG H 1.0 2.8 3.5 30 30 A 12 ARG HA A 13 ASP H 1.0 2.8 3.5 31 31 A 13 ASP HA A 14 LEU H 1.0 1.8 2.8 32 32 A 14 LEU HA A 15 GLN H 1.0 2.8 3.5 33 33 A 15 GLN HA A 16 LYS H 1.0 2.8 3.5 34 34 A 16 LYS HA A 17 HIS H 1.0 1.8 2.8 35 35 A 17 HIS HA A 18 GLY H 1.0 1.8 2.8 36 36 A 19 PHE HA A 20 HIS H 1.0 1.8 2.8 37 37 A 1 TYR HA A 3 ASN H 1.0 3.5 5.0 38 38 A 5 ASN HA A 7 ASN H 1.0 3.5 5.0 39 39 A 6 ILE HA A 8 ILE H 1.0 3.5 5.0 40 40 A 7 ASN HA A 9 SER H 1.0 3.5 5.0 41 41 A 17 HIS HA A 19 PHE H 1.0 3.5 5.0 42 42 A 6 ILE HA A 9 SER H 1.0 2.8 3.5 43 43 A 7 ASN HA A 10 GLN H 1.0 2.8 3.5 44 44 A 8 ILE HA A 11 GLU H 1.0 1.8 2.8 45 45 A 9 SER HA A 12 ARG H 1.0 1.8 2.8 46 46 A 10 GLN HA A 13 ASP H 1.0 1.8 2.8 47 47 A 11 GLU HA A 14 LEU H 1.0 2.8 3.5 48 48 A 13 ASP HA A 16 LYS H 1.0 1.8 2.8 49 49 A 14 LEU HA A 17 HIS H 1.0 2.8 3.5 50 50 A 4 GLN HA A 8 ILE H 1.0 3.5 5.0 51 51 A 6 ILE HA A 10 GLN H 1.0 3.5 5.0 52 52 A 8 ILE HA A 12 ARG H 1.0 3.5 5.0 53 53 A 2 THR H A 3 ASN H 1.0 1.8 2.8 54 54 A 3 ASN H A 4 GLN H 1.0 1.8 2.8 55 55 A 5 ASN H A 6 ILE H 1.0 1.8 2.8 56 56 A 7 ASN H A 8 ILE H 1.0 1.8 2.8 57 57 A 6 ILE H A 7 ASN H 1.0 1.8 2.8 58 58 A 8 ILE H A 9 SER H 1.0 1.8 2.8 59 59 A 10 GLN H A 11 GLU H 1.0 1.8 2.8 60 60 A 11 GLU H A 12 ARG H 1.0 1.8 2.8 61 61 A 12 ARG H A 13 ASP H 1.0 1.8 2.8 62 62 A 13 ASP H A 14 LEU H 1.0 1.8 2.8 63 63 A 14 LEU H A 15 GLN H 1.0 1.8 2.8 64 64 A 16 LYS H A 17 HIS H 1.0 1.8 2.8 65 65 A 17 HIS H A 18 GLY H 1.0 1.8 2.8 66 66 A 10 GLN H A 12 ARG H 1.0 3.5 5.0 67 67 A 11 GLU H A 13 ASP H 1.0 3.5 5.0 68 68 A 4 GLN HA A 7 ASN HBx 1.0 2.8 4.5 69 68 A 4 GLN HA A 7 ASN HBy 1.0 2.8 4.5 70 69 A 7 ASN HA A 10 GLN HBx 1.0 2.8 4.5 71 69 A 7 ASN HA A 10 GLN HBy 1.0 2.8 4.5 72 70 A 8 ILE HA A 11 GLU HBx 1.0 1.8 3.8 73 70 A 8 ILE HA A 11 GLU HBy 1.0 1.8 3.8 74 71 A 9 SER HA A 12 ARG HBx 1.0 2.8 4.5 75 71 A 9 SER HA A 12 ARG HBy 1.0 2.8 4.5 76 72 A 10 GLN HA A 13 ASP HBx 1.0 2.8 3.5 77 73 A 10 GLN HA A 13 ASP HBy 1.0 2.8 3.5 78 74 A 11 GLU HA A 14 LEU HBx 1.0 2.8 4.5 79 74 A 11 GLU HA A 14 LEU HBy 1.0 2.8 4.5 80 75 A 12 ARG HA A 15 GLN HBx 1.0 2.8 4.5 81 75 A 12 ARG HA A 15 GLN HBy 1.0 2.8 4.5 82 76 A 13 ASP HA A 16 LYS HBx 1.0 2.8 4.5 83 76 A 13 ASP HA A 16 LYS HBy 1.0 2.8 4.5 84 77 A 14 LEU HA A 17 HIS HBx 1.0 1.8 2.8 85 78 A 14 LEU HA A 17 HIS HBy 1.0 1.8 2.8 86 79 A 2 THR H A 2 THR HB 1.0 1.8 2.8 87 80 A 2 THR H A 2 THR HG2% 1.0 1.8 3.8 88 81 A 3 ASN H A 3 ASN HBx 1.0 1.8 2.8 89 82 A 3 ASN H A 3 ASN HBy 1.0 1.8 2.8 90 83 A 4 GLN H A 4 GLN HBx 1.0 1.8 2.8 91 84 A 4 GLN H A 4 GLN HBy 1.0 1.8 2.8 92 85 A 4 GLN H A 4 GLN HGx 1.0 2.8 4.5 93 85 A 4 GLN H A 4 GLN HGy 1.0 2.8 4.5 94 86 A 5 ASN H A 5 ASN HBx 1.0 1.8 3.8 95 86 A 5 ASN H A 5 ASN HBy 1.0 1.8 3.8 96 87 A 6 ILE H A 6 ILE HB 1.0 1.8 2.8 97 88 A 6 ILE H A 6 ILE HG1x 1.0 1.8 2.8 98 89 A 6 ILE H A 6 ILE HG1y 1.0 2.8 3.5 99 90 A 6 ILE H A 6 ILE HD11 1.0 1.8 3.8 100 91 A 7 ASN H A 7 ASN HBx 1.0 1.8 3.8 101 91 A 7 ASN H A 7 ASN HBy 1.0 1.8 3.8 102 92 A 8 ILE H A 8 ILE HB 1.0 1.8 2.8 103 93 A 8 ILE H A 8 ILE HG1y 1.0 1.8 2.8 104 94 A 8 ILE H A 8 ILE HG1x 1.0 1.8 2.8 105 95 A 8 ILE H A 8 ILE HD11 1.0 1.8 3.8 106 96 A 9 SER H A 9 SER HBx 1.0 1.8 2.8 107 97 A 9 SER H A 9 SER HBy 1.0 1.8 2.8 108 98 A 10 GLN H A 10 GLN HBx 1.0 1.8 3.8 109 98 A 10 GLN H A 10 GLN HBy 1.0 1.8 3.8 110 99 A 10 GLN H A 10 GLN HGx 1.0 1.8 2.8 111 100 A 10 GLN H A 10 GLN HGy 1.0 1.8 2.8 112 101 A 11 GLU H A 11 GLU HBx 1.0 1.8 3.8 113 101 A 11 GLU H A 11 GLU HBy 1.0 1.8 3.8 114 102 A 11 GLU H A 11 GLU HGx 1.0 2.8 3.5 115 103 A 11 GLU H A 11 GLU HGy 1.0 2.8 3.5 116 104 A 12 ARG H A 12 ARG HDx 1.0 2.8 4.5 117 104 A 12 ARG H A 12 ARG HDy 1.0 2.8 4.5 118 105 A 12 ARG H A 12 ARG HBx 1.0 1.8 3.8 119 105 A 12 ARG H A 12 ARG HBy 1.0 1.8 3.8 120 106 A 12 ARG H A 12 ARG HGx 1.0 1.8 2.8 121 107 A 12 ARG H A 12 ARG HGy 1.0 1.8 2.8 122 108 A 13 ASP H A 13 ASP HBy 1.0 2.8 3.5 123 109 A 13 ASP H A 13 ASP HBx 1.0 2.8 3.5 124 110 A 14 LEU H A 14 LEU HBx 1.0 1.8 3.8 125 110 A 14 LEU H A 14 LEU HBy 1.0 1.8 3.8 126 111 A 14 LEU H A 14 LEU HDx% 1.0 1.8 3.8 127 112 A 14 LEU H A 14 LEU HDy% 1.0 1.8 3.8 128 113 A 15 GLN H A 15 GLN HBx 1.0 1.8 3.8 129 113 A 15 GLN H A 15 GLN HBy 1.0 1.8 3.8 130 114 A 15 GLN H A 15 GLN HGy 1.0 1.8 2.8 131 115 A 15 GLN H A 15 GLN HGx 1.0 1.8 2.8 132 116 A 16 LYS H A 16 LYS HBx 1.0 1.8 3.8 133 116 A 16 LYS H A 16 LYS HBy 1.0 1.8 3.8 134 117 A 16 LYS H A 16 LYS HDx 1.0 1.8 3.8 135 117 A 16 LYS H A 16 LYS HDy 1.0 1.8 3.8 136 118 A 16 LYS H A 16 LYS HGy 1.0 1.8 2.8 137 119 A 16 LYS H A 16 LYS HGx 1.0 1.8 2.8 138 120 A 17 HIS H A 17 HIS HBx 1.0 1.8 2.8 139 121 A 17 HIS H A 17 HIS HBy 1.0 1.8 2.8 140 122 A 19 PHE H A 19 PHE HBy 1.0 1.8 3.8 141 122 A 19 PHE H A 19 PHE HBx 1.0 1.8 3.8 142 123 A 20 HIS H A 20 HIS HBx 1.0 2.8 3.5 143 124 A 20 HIS H A 20 HIS HBy 1.0 2.8 3.5 144 125 A 18 GLY H A 17 HIS HBx 1.0 2.8 3.5 145 126 A 18 GLY H A 17 HIS HBy 1.0 2.8 3.5 146 127 A 2 THR H A 1 TYR HBy 1.0 2.8 3.5 147 128 A 2 THR H A 1 TYR HBx 1.0 2.8 3.5 148 129 A 14 LEU H A 13 ASP HBy 1.0 2.8 3.5 149 130 A 14 LEU H A 13 ASP HBx 1.0 2.8 3.5 150 131 A 20 HIS H A 19 PHE HBy 1.0 2.8 4.5 151 131 A 20 HIS H A 19 PHE HBx 1.0 2.8 4.5 152 132 A 9 SER H A 7 ASN HBx 1.0 2.8 4.5 153 132 A 9 SER H A 7 ASN HBy 1.0 2.8 4.5 154 133 A 8 ILE H A 7 ASN HBx 1.0 1.8 3.8 155 133 A 8 ILE H A 7 ASN HBy 1.0 1.8 3.8 156 134 A 6 ILE H A 5 ASN HBx 1.0 1.8 3.8 157 134 A 6 ILE H A 5 ASN HBy 1.0 1.8 3.8 158 135 A 4 GLN H A 3 ASN HBy 1.0 2.8 3.5 159 136 A 4 GLN H A 3 ASN HBx 1.0 2.8 3.5 160 137 A 5 ASN H A 4 GLN HBx 1.0 2.8 3.5 161 138 A 5 ASN H A 4 GLN HBy 1.0 2.8 3.5 162 139 A 12 ARG H A 11 GLU HBx 1.0 1.8 3.8 163 139 A 12 ARG H A 11 GLU HBy 1.0 1.8 3.8 164 140 A 5 ASN H A 4 GLN HGx 1.0 2.8 4.5 165 140 A 5 ASN H A 4 GLN HGy 1.0 2.8 4.5 166 141 A 7 ASN H A 6 ILE HB 1.0 1.8 2.8 167 142 A 11 GLU H A 10 GLN HBx 1.0 1.8 3.8 168 142 A 11 GLU H A 10 GLN HBy 1.0 1.8 3.8 169 143 A 9 SER H A 8 ILE HB 1.0 1.8 2.8 170 144 A 7 ASN H A 6 ILE HG1y 1.0 2.8 3.5 171 145 A 9 SER H A 8 ILE HD11 1.0 1.8 3.8 172 146 A 7 ASN H A 6 ILE HD11 1.0 1.8 3.8 173 147 A 1 TYR HA A 1 TYR HBy 1.0 1.8 2.8 174 148 A 1 TYR HA A 1 TYR HBx 1.0 1.8 2.8 175 149 A 1 TYR HBy A 1 TYR HBx 1.0 1.8 2.8 176 150 A 2 THR HA A 2 THR HB 1.0 1.8 2.8 177 151 A 2 THR HA A 2 THR HG2% 1.0 1.8 3.8 178 152 A 2 THR HB A 2 THR HG2% 1.0 1.8 3.8 179 153 A 3 ASN HA A 3 ASN HBx 1.0 1.8 2.8 180 154 A 3 ASN HA A 3 ASN HBy 1.0 1.8 2.8 181 155 A 3 ASN HBx A 3 ASN HBy 1.0 1.8 2.8 182 156 A 4 GLN HA A 4 GLN HBx 1.0 1.8 2.8 183 157 A 4 GLN HA A 4 GLN HBy 1.0 1.8 2.8 184 158 A 4 GLN HA A 4 GLN HGx 1.0 1.8 3.8 185 158 A 4 GLN HA A 4 GLN HGy 1.0 1.8 3.8 186 159 A 4 GLN HBx A 4 GLN HBy 1.0 1.8 2.8 187 160 A 4 GLN HBy A 4 GLN HGx 1.0 1.8 3.8 188 160 A 4 GLN HBy A 4 GLN HGy 1.0 1.8 3.8 189 161 A 4 GLN HBx A 4 GLN HGx 1.0 1.8 3.8 190 161 A 4 GLN HBx A 4 GLN HGy 1.0 1.8 3.8 191 162 A 5 ASN HA A 5 ASN HBx 1.0 1.8 3.8 192 162 A 5 ASN HA A 5 ASN HBy 1.0 1.8 3.8 193 163 A 6 ILE HA A 6 ILE HB 1.0 1.8 2.8 194 164 A 6 ILE HA A 6 ILE HG1x 1.0 1.8 2.8 195 165 A 6 ILE HA A 6 ILE HG1y 1.0 1.8 2.8 196 166 A 6 ILE HA A 6 ILE HD11 1.0 1.8 3.8 197 167 A 6 ILE HB A 6 ILE HG1x 1.0 1.8 2.8 198 168 A 6 ILE HB A 6 ILE HG1y 1.0 1.8 2.8 199 169 A 6 ILE HB A 6 ILE HD11 1.0 1.8 3.8 200 170 A 6 ILE HG1x A 6 ILE HG1y 1.0 1.8 2.8 201 171 A 6 ILE HG1x A 6 ILE HD11 1.0 1.8 3.8 202 172 A 6 ILE HG1y A 6 ILE HD11 1.0 1.8 3.8 203 173 A 7 ASN HA A 7 ASN HBx 1.0 1.8 3.8 204 173 A 7 ASN HA A 7 ASN HBy 1.0 1.8 3.8 205 174 A 8 ILE HA A 8 ILE HB 1.0 1.8 2.8 206 175 A 8 ILE HA A 8 ILE HG1y 1.0 1.8 2.8 207 176 A 8 ILE HA A 8 ILE HG1x 1.0 1.8 2.8 208 177 A 8 ILE HA A 8 ILE HD11 1.0 1.8 3.8 209 178 A 8 ILE HB A 8 ILE HG1y 1.0 1.8 2.8 210 179 A 8 ILE HB A 8 ILE HG1x 1.0 1.8 2.8 211 180 A 8 ILE HB A 8 ILE HD11 1.0 1.8 3.8 212 181 A 8 ILE HG1y A 8 ILE HG1x 1.0 1.8 2.8 213 182 A 8 ILE HG1y A 8 ILE HD11 1.0 1.8 3.8 214 183 A 8 ILE HG1x A 8 ILE HD11 1.0 1.8 3.8 215 184 A 9 SER HA A 9 SER HBx 1.0 1.8 2.8 216 185 A 9 SER HA A 9 SER HBy 1.0 1.8 2.8 217 186 A 9 SER HBx A 9 SER HBy 1.0 1.8 2.8 218 187 A 10 GLN HA A 10 GLN HBx 1.0 1.8 3.8 219 187 A 10 GLN HA A 10 GLN HBy 1.0 1.8 3.8 220 188 A 10 GLN HA A 10 GLN HGx 1.0 1.8 2.8 221 189 A 10 GLN HA A 10 GLN HGy 1.0 1.8 2.8 222 190 A 10 GLN HGx A 10 GLN HBx 1.0 1.8 3.8 223 190 A 10 GLN HBy A 10 GLN HGx 1.0 1.8 3.8 224 191 A 10 GLN HGy A 10 GLN HBx 1.0 1.8 3.8 225 191 A 10 GLN HBy A 10 GLN HGy 1.0 1.8 3.8 226 192 A 10 GLN HGx A 10 GLN HGy 1.0 1.8 2.8 227 193 A 11 GLU HA A 11 GLU HBx 1.0 1.8 3.8 228 193 A 11 GLU HA A 11 GLU HBy 1.0 1.8 3.8 229 194 A 11 GLU HA A 11 GLU HGx 1.0 1.8 2.8 230 195 A 11 GLU HA A 11 GLU HGy 1.0 1.8 2.8 231 196 A 11 GLU HGx A 11 GLU HBx 1.0 1.8 3.8 232 196 A 11 GLU HBy A 11 GLU HGx 1.0 1.8 3.8 233 197 A 11 GLU HGy A 11 GLU HBx 1.0 1.8 3.8 234 197 A 11 GLU HBy A 11 GLU HGy 1.0 1.8 3.8 235 198 A 11 GLU HGx A 11 GLU HGy 1.0 1.8 2.8 236 199 A 12 ARG HA A 12 ARG HDx 1.0 1.8 3.8 237 199 A 12 ARG HA A 12 ARG HDy 1.0 1.8 3.8 238 200 A 12 ARG HA A 12 ARG HBx 1.0 1.8 3.8 239 200 A 12 ARG HA A 12 ARG HBy 1.0 1.8 3.8 240 201 A 12 ARG HA A 12 ARG HGx 1.0 1.8 2.8 241 202 A 12 ARG HA A 12 ARG HGy 1.0 1.8 2.8 242 203 A 12 ARG HGx A 12 ARG HBx 1.0 1.8 3.8 243 203 A 12 ARG HBy A 12 ARG HGx 1.0 1.8 3.8 244 204 A 12 ARG HGy A 12 ARG HBx 1.0 1.8 3.8 245 204 A 12 ARG HBy A 12 ARG HGy 1.0 1.8 3.8 246 205 A 12 ARG HGx A 12 ARG HGy 1.0 1.8 2.8 247 206 A 13 ASP HA A 13 ASP HBx 1.0 1.8 2.8 248 207 A 13 ASP HA A 13 ASP HBy 1.0 1.8 2.8 249 208 A 13 ASP HBx A 13 ASP HBy 1.0 1.8 2.8 250 209 A 14 LEU HA A 14 LEU HBx 1.0 1.8 3.8 251 209 A 14 LEU HA A 14 LEU HBy 1.0 1.8 3.8 252 210 A 14 LEU HA A 14 LEU HDx% 1.0 1.8 3.8 253 211 A 14 LEU HA A 14 LEU HDy% 1.0 1.8 3.8 254 212 A 14 LEU HDx% A 14 LEU HBx 1.0 1.8 4.8 255 212 A 14 LEU HBy A 14 LEU HDx% 1.0 1.8 4.8 256 213 A 14 LEU HDy% A 14 LEU HBx 1.0 1.8 4.8 257 213 A 14 LEU HBy A 14 LEU HDy% 1.0 1.8 4.8 258 214 A 14 LEU HDx% A 14 LEU HDy% 1.0 1.8 4.8 259 215 A 15 GLN HA A 15 GLN HBx 1.0 1.8 3.8 260 215 A 15 GLN HA A 15 GLN HBy 1.0 1.8 3.8 261 216 A 15 GLN HA A 15 GLN HGy 1.0 1.8 2.8 262 217 A 15 GLN HA A 15 GLN HGx 1.0 1.8 2.8 263 218 A 15 GLN HGy A 15 GLN HBx 1.0 1.8 3.8 264 218 A 15 GLN HBy A 15 GLN HGy 1.0 1.8 3.8 265 219 A 15 GLN HGx A 15 GLN HBx 1.0 1.8 3.8 266 219 A 15 GLN HBy A 15 GLN HGx 1.0 1.8 3.8 267 220 A 15 GLN HGy A 15 GLN HGx 1.0 1.8 2.8 268 221 A 16 LYS HA A 16 LYS HBx 1.0 1.8 3.8 269 221 A 16 LYS HA A 16 LYS HBy 1.0 1.8 3.8 270 222 A 16 LYS HA A 16 LYS HDx 1.0 1.8 3.8 271 222 A 16 LYS HA A 16 LYS HDy 1.0 1.8 3.8 272 223 A 16 LYS HA A 16 LYS HGy 1.0 1.8 2.8 273 224 A 16 LYS HA A 16 LYS HGx 1.0 1.8 2.8 274 225 A 16 LYS HBx A 16 LYS HDx 1.0 1.8 4.8 275 225 A 16 LYS HBy A 16 LYS HDx 1.0 1.8 4.8 276 225 A 16 LYS HDy A 16 LYS HBx 1.0 1.8 4.8 277 225 A 16 LYS HBy A 16 LYS HDy 1.0 1.8 4.8 278 226 A 16 LYS HGy A 16 LYS HBx 1.0 1.8 3.8 279 226 A 16 LYS HBy A 16 LYS HGy 1.0 1.8 3.8 280 227 A 16 LYS HGx A 16 LYS HBx 1.0 1.8 3.8 281 227 A 16 LYS HBy A 16 LYS HGx 1.0 1.8 3.8 282 228 A 16 LYS HGy A 16 LYS HDx 1.0 1.8 3.8 283 228 A 16 LYS HDy A 16 LYS HGy 1.0 1.8 3.8 284 229 A 16 LYS HGx A 16 LYS HDx 1.0 1.8 3.8 285 229 A 16 LYS HDy A 16 LYS HGx 1.0 1.8 3.8 286 230 A 16 LYS HGy A 16 LYS HGx 1.0 1.8 2.8 287 231 A 17 HIS HA A 17 HIS HBy 1.0 1.8 2.8 288 232 A 17 HIS HA A 17 HIS HBx 1.0 1.8 2.8 289 233 A 17 HIS HBx A 17 HIS HBy 1.0 1.8 2.8 290 234 A 19 PHE HA A 19 PHE HBy 1.0 1.8 3.8 291 234 A 19 PHE HA A 19 PHE HBx 1.0 1.8 3.8 292 235 A 20 HIS HA A 20 HIS HBy 1.0 1.8 2.8 293 236 A 20 HIS HA A 20 HIS HBx 1.0 1.8 2.8 294 237 A 20 HIS HBx A 20 HIS HBy 1.0 1.8 2.8 295 238 A 1 TYR HD% A 1 TYR HE% 1.0 1.8 6.8 296 239 A 3 ASN HD2y A 3 ASN HD2x 1.0 1.8 2.8 297 240 A 4 GLN HE2x A 4 GLN HE2y 1.0 1.8 2.8 298 241 A 5 ASN HD2y A 5 ASN HD2x 1.0 1.8 2.8 299 242 A 7 ASN HD2y A 7 ASN HD2x 1.0 1.8 2.8 300 243 A 10 GLN HE2x A 10 GLN HE2y 1.0 1.8 2.8 301 244 A 15 GLN HE2x A 15 GLN HE2y 1.0 1.8 2.8 302 245 A 5 ASN H A 5 ASN HD2y 1.0 3.5 5.0 303 246 A 5 ASN H A 5 ASN HD2x 1.0 3.5 5.0 304 247 A 7 ASN H A 7 ASN HD2y 1.0 3.5 5.0 305 248 A 7 ASN H A 7 ASN HD2x 1.0 3.5 5.0 stop_ save_ save_Discover_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode Discover_dihedral_5 _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 TYR CA A 1 TYR C A 2 THR N A 2 THR CA 1.0 178.0 180.0 OMEGA 2 2 A 2 THR CA A 2 THR C A 3 ASN N A 3 ASN CA 1.0 178.0 180.0 OMEGA 3 3 A 3 ASN CA A 3 ASN C A 4 GLN N A 4 GLN CA 1.0 178.0 180.0 OMEGA 4 4 A 4 GLN CA A 4 GLN C A 5 ASN N A 5 ASN CA 1.0 178.0 180.0 OMEGA 5 5 A 5 ASN CA A 5 ASN C A 6 ILE N A 6 ILE CA 1.0 178.0 180.0 OMEGA 6 6 A 6 ILE CA A 6 ILE C A 7 ASN N A 7 ASN CA 1.0 178.0 180.0 OMEGA 7 7 A 7 ASN CA A 7 ASN C A 8 ILE N A 8 ILE CA 1.0 178.0 180.0 OMEGA 8 8 A 8 ILE CA A 8 ILE C A 9 SER N A 9 SER CA 1.0 178.0 180.0 OMEGA 9 9 A 9 SER CA A 9 SER C A 10 GLN N A 10 GLN CA 1.0 178.0 180.0 OMEGA 10 10 A 10 GLN CA A 10 GLN C A 11 GLU N A 11 GLU CA 1.0 178.0 180.0 OMEGA 11 11 A 11 GLU CA A 11 GLU C A 12 ARG N A 12 ARG CA 1.0 178.0 180.0 OMEGA 12 12 A 12 ARG CA A 12 ARG C A 13 ASP N A 13 ASP CA 1.0 178.0 180.0 OMEGA 13 13 A 13 ASP CA A 13 ASP C A 14 LEU N A 14 LEU CA 1.0 178.0 180.0 OMEGA 14 14 A 14 LEU CA A 14 LEU C A 15 GLN N A 15 GLN CA 1.0 178.0 180.0 OMEGA 15 15 A 15 GLN CA A 15 GLN C A 16 LYS N A 16 LYS CA 1.0 178.0 180.0 OMEGA 16 16 A 16 LYS CA A 16 LYS C A 17 HIS N A 17 HIS CA 1.0 178.0 180.0 OMEGA 17 17 A 17 HIS CA A 17 HIS C A 18 GLY N A 18 GLY CA 1.0 178.0 180.0 OMEGA 18 18 A 18 GLY CA A 18 GLY C A 19 PHE N A 19 PHE CA 1.0 178.0 180.0 OMEGA 19 19 A 19 PHE CA A 19 PHE C A 20 HIS N A 20 HIS CA 1.0 178.0 180.0 OMEGA stop_ save_