data_nef_c19828_2mlo 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 19829 PDB 2MLO 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 GLU start . . 2 A 2 LYS middle . . 3 A 3 PHE middle . . 4 A 4 ARG middle . . 5 A 5 ARG middle . . 6 A 6 TYR middle . . 7 A 7 LEU middle . . 8 A 8 SER middle . . 9 A 9 VAL middle . . 10 A 10 PHE middle . . 11 A 11 PHE middle . . 12 A 12 ARG middle . . 13 A 13 LYS middle . . 14 A 14 HIS middle . . 15 A 15 ILE middle . . 16 A 16 THR 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 GLU HA H 1 3.9816 0 A 1 GLU HBy H 1 2.1136 0 A 1 GLU HBx H 1 2.1006 0 A 1 GLU HGx H 1 2.3466 0 A 1 GLU HGy H 1 2.3466 0 A 1 GLU CA C 13 55.799 0 A 1 GLU CB C 13 30.392 0.001 A 1 GLU CG C 13 35.603 0 A 2 LYS HA H 1 4.2076 0 A 2 LYS HBx H 1 1.7706 0 A 2 LYS HBy H 1 1.7706 0 A 2 LYS HDx H 1 1.6636 0 A 2 LYS HDy H 1 1.6636 0 A 2 LYS HEx H 1 2.9306 0 A 2 LYS HEy H 1 2.9306 0 A 2 LYS HGy H 1 1.3426 0 A 2 LYS HGx H 1 1.2936 0 A 2 LYS CA C 13 57.604 0 A 2 LYS CB C 13 32.8 0 A 2 LYS CD C 13 28.817 0 A 2 LYS CE C 13 41.439 0 A 2 LYS CG C 13 24.593 0.001 A 3 PHE H H 1 8.9796 0 A 3 PHE HA H 1 4.4156 0 A 3 PHE HBy H 1 3.3506 0 A 3 PHE HBx H 1 3.1566 0 A 3 PHE HDx H 1 7.2916 0 A 3 PHE HDy H 1 7.2916 0 A 3 PHE HE1 H 1 7.2736 0 A 3 PHE HZ H 1 7.1126 0 A 3 PHE CA C 13 60.64 0 A 3 PHE CB C 13 38.442 0.001 A 3 PHE CDx C 13 131.322 0 A 3 PHE CDy C 13 131.322 0 A 3 PHE CE1 C 13 130.625 0 A 3 PHE CZ C 13 132.584 0 A 3 PHE N N 15 120.909 0 A 4 ARG H H 1 8.9856 0 A 4 ARG HA H 1 3.8636 0 A 4 ARG HBx H 1 1.9026 0 A 4 ARG HBy H 1 1.9026 0 A 4 ARG HDx H 1 3.2236 0 A 4 ARG HDy H 1 3.2236 0 A 4 ARG HGy H 1 1.6986 0 A 4 ARG HGx H 1 1.6256 0 A 4 ARG CA C 13 59.263 0 A 4 ARG CB C 13 29.457 0 A 4 ARG CD C 13 42.983 0 A 4 ARG CG C 13 27.795 0.001 A 4 ARG N N 15 119.516 0 A 5 ARG H H 1 7.9966 0 A 5 ARG HA H 1 4.1246 0 A 5 ARG HBx H 1 1.8436 0 A 5 ARG HBy H 1 1.8436 0 A 5 ARG HDx H 1 3.1626 0 A 5 ARG HDy H 1 3.1626 0 A 5 ARG HG2 H 1 1.5316 0 A 5 ARG HG3 H 1 1.5156 0 A 5 ARG CA C 13 58.426 0 A 5 ARG CB C 13 29.266 0 A 5 ARG CD C 13 42.814 0 A 5 ARG CG C 13 26.885 0.002 A 5 ARG N N 15 119.466 0 A 6 TYR H H 1 7.9946 0 A 6 TYR HBy H 1 3.1206 0 A 6 TYR HBx H 1 3.0896 0 A 6 TYR HDx H 1 7.0636 0 A 6 TYR HDy H 1 7.0636 0 A 6 TYR HEx H 1 6.7866 0 A 6 TYR HEy H 1 6.7866 0 A 6 TYR CB C 13 37.706 0.001 A 6 TYR CDx C 13 132.19 0 A 6 TYR CDy C 13 132.19 0 A 6 TYR CEx C 13 117.778 0 A 6 TYR CEy C 13 117.778 0 A 6 TYR N N 15 118.856 0 A 7 LEU H H 1 8.1056 0 A 7 LEU HA H 1 4.1356 0 A 7 LEU HBy H 1 1.8756 0 A 7 LEU HBx H 1 1.5976 0 A 7 LEU HDx% H 1 0.9076 0 A 7 LEU HDy% H 1 0.9076 0 A 7 LEU HG H 1 1.8096 0 A 7 LEU CA C 13 57.261 0 A 7 LEU CB C 13 41.612 0.001 A 7 LEU CDx C 13 25.312 0 A 7 LEU CDy C 13 25.312 0 A 7 LEU CG C 13 26.777 0 A 7 LEU N N 15 117.83 0 A 8 SER H H 1 8.0896 0 A 8 SER HA H 1 4.1906 0 A 8 SER HBx H 1 4.0566 0 A 8 SER HBy H 1 4.0566 0 A 8 SER CA C 13 61.537 0 A 8 SER CB C 13 62.607 0 A 8 SER N N 15 113.703 0 A 9 VAL H H 1 7.7556 0 A 9 VAL HA H 1 3.7186 0 A 9 VAL HB H 1 2.1196 0 A 9 VAL HGx% H 1 1.0156 0 A 9 VAL HGy% H 1 0.8676 0 A 9 VAL CA C 13 65.38 0 A 9 VAL CB C 13 31.412 0 A 9 VAL CG1 C 13 21.861 0 A 9 VAL CG2 C 13 20.77 0 A 9 VAL N N 15 120.306 0 A 10 PHE H H 1 7.9026 0 A 10 PHE HA H 1 4.2136 0 A 10 PHE HBx H 1 3.0036 0 A 10 PHE HBy H 1 3.0036 0 A 10 PHE HDx H 1 7.0076 0 A 10 PHE HDy H 1 7.0076 0 A 10 PHE HEx H 1 7.0976 0 A 10 PHE HEy H 1 7.0976 0 A 10 PHE HZ H 1 7.0036 0 A 10 PHE CA C 13 60.757 0 A 10 PHE CB C 13 39.205 0 A 10 PHE CDx C 13 131.457 0 A 10 PHE CDy C 13 131.457 0 A 10 PHE CEx C 13 130.606 0 A 10 PHE CEy C 13 130.606 0 A 10 PHE CZ C 13 128.778 0 A 10 PHE N N 15 119.347 0 A 11 PHE H H 1 8.3526 0 A 11 PHE HA H 1 4.3506 0 A 11 PHE HB2 H 1 3.3016 0 A 11 PHE HB3 H 1 3.1326 0 A 11 PHE HDx H 1 7.3606 0 A 11 PHE HDy H 1 7.3606 0 A 11 PHE HEx H 1 7.1776 0 A 11 PHE HEy H 1 7.1776 0 A 11 PHE HZ H 1 7.2346 0 A 11 PHE CA C 13 59.844 0 A 11 PHE CB C 13 38.992 0.006 A 11 PHE CDx C 13 131.543 0 A 11 PHE CDy C 13 131.543 0 A 11 PHE CEx C 13 128.844 0 A 11 PHE CEy C 13 128.844 0 A 11 PHE CZ C 13 129.15 0 A 11 PHE N N 15 116.549 0 A 12 ARG H H 1 8.0536 0 A 12 ARG HA H 1 4.1246 0 A 12 ARG HBy H 1 1.9556 0 A 12 ARG HBx H 1 1.9376 0 A 12 ARG HGy H 1 1.7956 0 A 12 ARG HGx H 1 1.7096 0 A 12 ARG CA C 13 57.755 0 A 12 ARG CB C 13 29.799 0.001 A 12 ARG CG C 13 27.361 0.001 A 12 ARG N N 15 118.598 0 A 13 LYS H H 1 7.9846 0 A 13 LYS HA H 1 4.1066 0 A 13 LYS HBy H 1 1.6556 0 A 13 LYS HBx H 1 1.5246 0 A 13 LYS HEx H 1 2.8696 0 A 13 LYS HEy H 1 2.8696 0 A 13 LYS HGy H 1 1.2516 0 A 13 LYS HGx H 1 1.1496 0 A 13 LYS CA C 13 56.948 0 A 13 LYS CB C 13 32.384 0.001 A 13 LYS CE C 13 41.383 0 A 13 LYS CG C 13 24.425 0.001 A 13 LYS N N 15 118.191 0 A 14 HIS H H 1 7.8236 0 A 14 HIS HA H 1 4.6296 0 A 14 HIS HBy H 1 3.1426 0 A 14 HIS HBx H 1 2.6986 0 A 14 HIS HD2 H 1 6.6946 0 A 14 HIS HE1 H 1 7.9986 0 A 14 HIS CA C 13 56.438 0 A 14 HIS CB C 13 30.785 0.002 A 14 HIS CD2 C 13 119.896 0 A 14 HIS CE1 C 13 137.285 0 A 14 HIS N N 15 116.316 0 A 15 ILE H H 1 7.8566 0 A 15 ILE HA H 1 4.3136 0 A 15 ILE HB H 1 1.8946 0 A 15 ILE HD1% H 1 0.7966 0 A 15 ILE HG1y H 1 1.3966 0 A 15 ILE HG1x H 1 1.1876 0 A 15 ILE HG2% H 1 0.8636 0 A 15 ILE CA C 13 60.556 0 A 15 ILE CB C 13 37.867 0 A 15 ILE CD1 C 13 12.614 0 A 15 ILE CG1 C 13 26.852 0.001 A 15 ILE CG2 C 13 17.528 0 A 15 ILE N N 15 119.074 0 A 16 THR H H 1 7.5236 0 A 16 THR HA H 1 4.1076 0 A 16 THR HB H 1 4.1796 0 A 16 THR HG2% H 1 1.1206 0 A 16 THR CA C 13 62.815 0 A 16 THR CB C 13 70.229 0 A 16 THR CG2 C 13 21.728 0 A 16 THR N N 15 121.191 0 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-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 8 SER HA A 9 VAL HA 1.0 . 4.86 2 2 A 9 VAL HA A 12 ARG HDx 1.0 . 4.90 3 2 A 9 VAL HA A 12 ARG HDy 1.0 . 4.90 4 3 A 9 VAL HA A 12 ARG HBy 1.0 . 3.93 5 4 A 9 VAL HA A 12 ARG HGx 1.0 . 4.29 6 5 A 9 VAL HA A 12 ARG HGy 1.0 . 4.44 7 6 A 15 ILE HB A 16 THR HA 1.0 . 4.29 8 7 A 16 THR HA A 16 THR HG2% 1.0 . 2.83 9 8 A 8 SER HA A 11 PHE HD% 1.0 . 4.45 10 9 A 3 PHE HA A 3 PHE HD% 1.0 . 3.72 11 10 A 10 PHE HA A 10 PHE HD% 1.0 . 3.52 12 11 A 15 ILE HA A 15 ILE HG1y 1.0 . 3.68 13 12 A 15 ILE HA A 15 ILE HG1x 1.0 . 3.68 14 13 A 6 TYR HA A 9 VAL HGy% 1.0 . 2.94 15 14 A 6 TYR HA A 6 TYR HE% 1.0 . 4.47 16 15 A 11 PHE HD% A 11 PHE HA 1.0 . 3.59 17 16 A 3 PHE HD% A 4 ARG HA 1.0 . 4.67 18 17 A 4 ARG HA A 5 ARG HA 1.0 . 4.85 19 18 A 4 ARG HA A 4 ARG HDx 1.0 . 3.75 20 18 A 4 ARG HA A 4 ARG HDy 1.0 . 3.75 21 19 A 12 ARG HA A 12 ARG HBx 1.0 . 2.90 22 20 A 11 PHE HD% A 7 LEU HA 1.0 . 4.70 23 21 A 10 PHE HD% A 7 LEU HA 1.0 . 4.44 24 22 A 12 ARG HA A 12 ARG HDx 1.0 . 3.37 25 22 A 12 ARG HDy A 12 ARG HA 1.0 . 3.37 26 23 A 12 ARG HGy A 12 ARG HA 1.0 . 3.21 27 24 A 2 LYS HA A 2 LYS HGy 1.0 . 4.23 28 25 A 2 LYS HA A 2 LYS HGx 1.0 . 4.23 29 26 A 7 LEU HA A 10 PHE HBx 1.0 . 3.76 30 26 A 7 LEU HA A 10 PHE HBy 1.0 . 3.76 31 27 A 13 LYS HA A 13 LYS HDx 1.0 . 3.52 32 27 A 13 LYS HA A 13 LYS HDy 1.0 . 3.52 33 28 A 13 LYS HA A 13 LYS HGy 1.0 . 3.85 34 29 A 13 LYS HA A 13 LYS HGx 1.0 . 3.85 35 30 A 7 LEU HA A 7 LEU HDx% 1.0 . 3.06 36 30 A 7 LEU HA A 7 LEU HDy% 1.0 . 3.06 37 31 A 14 HIS HA A 14 HIS HD2 1.0 . 4.75 38 32 A 15 ILE HA A 14 HIS HA 1.0 . 4.82 39 33 A 13 LYS HA A 14 HIS HA 1.0 . 4.89 40 34 A 14 HIS HA A 13 LYS HBx 1.0 . 4.60 41 35 A 1 GLU HA A 1 GLU HGx 1.0 . 4.07 42 35 A 1 GLU HA A 1 GLU HGy 1.0 . 4.07 43 36 A 4 ARG HBx A 4 ARG HDx 1.0 . 3.79 44 36 A 4 ARG HBy A 4 ARG HDx 1.0 . 3.79 45 36 A 4 ARG HDy A 4 ARG HBx 1.0 . 3.79 46 36 A 4 ARG HDy A 4 ARG HBy 1.0 . 3.79 47 37 A 15 ILE HB A 11 PHE HD% 1.0 . 4.63 48 38 A 15 ILE HB A 12 ARG HA 1.0 . 4.62 49 39 A 6 TYR HA A 9 VAL HB 1.0 . 4.59 50 40 A 5 ARG HA A 4 ARG HBx 1.0 . 4.13 51 40 A 5 ARG HA A 4 ARG HBy 1.0 . 4.13 52 41 A 4 ARG HA A 7 LEU HG 1.0 . 4.94 53 42 A 3 PHE HD% A 7 LEU HDx% 1.0 . 3.57 54 42 A 3 PHE HD% A 7 LEU HDy% 1.0 . 3.57 55 43 A 3 PHE HA A 7 LEU HDx% 1.0 . 4.77 56 43 A 3 PHE HA A 7 LEU HDy% 1.0 . 4.77 57 44 A 4 ARG HA A 7 LEU HDx% 1.0 . 3.62 58 44 A 4 ARG HA A 7 LEU HDy% 1.0 . 3.62 59 45 A 7 LEU HDy% A 7 LEU HBy 1.0 . 3.40 60 45 A 7 LEU HBy A 7 LEU HDx% 1.0 . 3.40 61 46 A 7 LEU HDy% A 7 LEU HBx 1.0 . 3.40 62 46 A 7 LEU HBx A 7 LEU HDx% 1.0 . 3.40 63 47 A 6 TYR HD% A 9 VAL HGx% 1.0 . 4.17 64 48 A 6 TYR HA A 9 VAL HGx% 1.0 . 3.66 65 49 A 5 ARG HA A 9 VAL HGx% 1.0 . 4.22 66 50 A 9 VAL HGx% A 8 SER HBx 1.0 . 4.40 67 50 A 9 VAL HGx% A 8 SER HBy 1.0 . 4.40 68 51 A 9 VAL HA A 9 VAL HGx% 1.0 . 2.96 69 52 A 10 PHE HD% A 9 VAL HGy% 1.0 . 4.78 70 53 A 10 PHE HA A 9 VAL HGy% 1.0 . 3.81 71 54 A 9 VAL HA A 9 VAL HGy% 1.0 . 3.26 72 55 A 9 VAL HGy% A 5 ARG HDx 1.0 . 4.77 73 55 A 9 VAL HGy% A 5 ARG HDy 1.0 . 4.77 74 56 A 9 VAL HGy% A 10 PHE HBx 1.0 . 4.14 75 56 A 9 VAL HGy% A 10 PHE HBy 1.0 . 4.14 76 57 A 15 ILE HA A 15 ILE HG2% 1.0 . 2.90 77 58 A 16 THR HA A 15 ILE HG2% 1.0 . 3.65 78 59 A 15 ILE HG2% A 11 PHE HB3 1.0 . 4.52 79 60 A 15 ILE HG2% A 15 ILE HG1y 1.0 . 3.20 80 61 A 15 ILE HG2% A 15 ILE HG1x 1.0 . 3.20 81 62 A 11 PHE HD% A 15 ILE HD1% 1.0 . 3.81 82 63 A 11 PHE HA A 15 ILE HD1% 1.0 . 3.02 83 64 A 12 ARG HA A 15 ILE HD1% 1.0 . 4.25 84 65 A 15 ILE HD1% A 11 PHE HB2 1.0 . 4.14 85 66 A 11 PHE HB3 A 15 ILE HD1% 1.0 . 3.72 86 67 A 15 ILE HB A 15 ILE HD1% 1.0 . 3.04 87 68 A 15 ILE HB A 11 PHE HB3 1.0 . 4.77 88 69 A 3 PHE HA A 6 TYR HD% 1.0 . 3.91 89 70 A 7 LEU HA A 7 LEU HG 1.0 . 4.05 90 71 A 9 VAL HGx% A 5 ARG HDx 1.0 . 3.82 91 71 A 9 VAL HGx% A 5 ARG HDy 1.0 . 3.82 92 72 A 6 TYR HD% A 5 ARG HBx 1.0 . 4.29 93 72 A 6 TYR HD% A 5 ARG HBy 1.0 . 4.29 94 73 A 9 VAL HGy% A 6 TYR HD% 1.0 . 4.08 95 74 A 3 PHE HA A 6 TYR HE% 1.0 . 4.29 96 75 A 9 VAL HGy% A 6 TYR HE% 1.0 . 4.48 97 76 A 6 TYR HE% A 5 ARG HBx 1.0 . 4.89 98 76 A 6 TYR HE% A 5 ARG HBy 1.0 . 4.89 99 77 A 6 TYR HA A 6 TYR HD% 1.0 . 3.69 100 78 A 15 ILE H A 16 THR H 1.0 . 3.62 101 79 A 12 ARG HA A 16 THR H 1.0 . 3.54 102 80 A 15 ILE HB A 16 THR H 1.0 . 3.64 103 81 A 16 THR HG2% A 16 THR H 1.0 . 3.93 104 82 A 15 ILE HG2% A 16 THR H 1.0 . 3.62 105 83 A 8 SER H A 9 VAL H 1.0 . 3.71 106 84 A 6 TYR HA A 9 VAL H 1.0 . 4.27 107 85 A 9 VAL H A 8 SER HBx 1.0 . 3.61 108 85 A 8 SER HBy A 9 VAL H 1.0 . 3.61 109 86 A 9 VAL H A 10 PHE HBx 1.0 . 4.63 110 86 A 10 PHE HBy A 9 VAL H 1.0 . 4.63 111 87 A 9 VAL HB A 9 VAL H 1.0 . 3.74 112 88 A 9 VAL HGx% A 9 VAL H 1.0 . 3.25 113 89 A 9 VAL HGy% A 9 VAL H 1.0 . 3.56 114 90 A 4 ARG H A 3 PHE HBx 1.0 . 4.52 115 91 A 4 ARG H A 4 ARG HBx 1.0 . 3.62 116 91 A 4 ARG HBy A 4 ARG H 1.0 . 3.62 117 92 A 4 ARG H A 4 ARG HGy 1.0 . 4.35 118 93 A 8 SER H A 10 PHE H 1.0 . 4.52 119 94 A 10 PHE H A 12 ARG H 1.0 . 4.98 120 95 A 9 VAL H A 10 PHE H 1.0 . 3.81 121 96 A 10 PHE HD% A 10 PHE H 1.0 . 4.27 122 97 A 10 PHE H A 10 PHE HBx 1.0 . 3.29 123 97 A 10 PHE HBy A 10 PHE H 1.0 . 3.29 124 98 A 9 VAL HB A 10 PHE H 1.0 . 4.19 125 99 A 4 ARG H A 4 ARG HGx 1.0 . 4.35 126 100 A 9 VAL HGx% A 10 PHE H 1.0 . 3.97 127 101 A 9 VAL HGy% A 10 PHE H 1.0 . 3.76 128 102 A 6 TYR HA A 10 PHE H 1.0 . 4.58 129 103 A 5 ARG H A 5 ARG HG2 1.0 . 5.44 130 104 A 5 ARG H A 5 ARG HG3 1.0 . 5.44 131 105 A 5 ARG H A 5 ARG HBx 1.0 . 3.71 132 105 A 5 ARG HBy A 5 ARG H 1.0 . 3.71 133 106 A 6 TYR H A 5 ARG HBx 1.0 . 4.20 134 106 A 5 ARG HBy A 6 TYR H 1.0 . 4.20 135 107 A 15 ILE H A 15 ILE HG1y 1.0 . 4.17 136 108 A 6 TYR HD% A 6 TYR H 1.0 . 3.96 137 109 A 12 ARG HA A 15 ILE H 1.0 . 4.23 138 110 A 15 ILE HB A 15 ILE H 1.0 . 3.80 139 111 A 15 ILE H A 15 ILE HG1x 1.0 . 4.17 140 112 A 15 ILE HG2% A 15 ILE H 1.0 . 4.03 141 113 A 3 PHE HA A 5 ARG H 1.0 . 4.95 142 114 A 3 PHE HA A 6 TYR H 1.0 . 5.12 143 115 A 11 PHE HB2 A 12 ARG H 1.0 . 3.86 144 116 A 11 PHE HB3 A 12 ARG H 1.0 . 3.86 145 117 A 12 ARG HBy A 12 ARG H 1.0 . 3.32 146 118 A 12 ARG HGy A 12 ARG H 1.0 . 3.90 147 119 A 13 LYS H A 13 LYS HBy 1.0 . 3.62 148 120 A 13 LYS HBx A 13 LYS H 1.0 . 3.79 149 121 A 6 TYR H A 7 LEU H 1.0 . 3.83 150 122 A 4 ARG HA A 7 LEU H 1.0 . 4.33 151 123 A 11 PHE HB3 A 13 LYS H 1.0 . 5.49 152 124 A 12 ARG HBy A 13 LYS H 1.0 . 4.10 153 125 A 7 LEU H A 7 LEU HBy 1.0 . 3.76 154 126 A 6 TYR HD% A 7 LEU H 1.0 . 4.63 155 127 A 7 LEU H A 7 LEU HBx 1.0 . 3.76 156 128 A 7 LEU H A 7 LEU HDx% 1.0 . 3.56 157 128 A 7 LEU HDy% A 7 LEU H 1.0 . 3.56 158 129 A 12 ARG H A 11 PHE H 1.0 . 3.81 159 130 A 10 PHE H A 11 PHE H 1.0 . 3.85 160 131 A 11 PHE HD% A 11 PHE H 1.0 . 4.07 161 132 A 8 SER HA A 11 PHE H 1.0 . 4.04 162 133 A 11 PHE HB2 A 11 PHE H 1.0 . 3.72 163 134 A 11 PHE HB3 A 11 PHE H 1.0 . 3.67 164 135 A 11 PHE H A 10 PHE HBx 1.0 . 3.70 165 135 A 10 PHE HBy A 11 PHE H 1.0 . 3.70 166 136 A 12 ARG HBy A 11 PHE H 1.0 . 4.60 167 137 A 8 SER H A 5 ARG HDx 1.0 . 5.50 168 137 A 5 ARG HDy A 8 SER H 1.0 . 5.50 169 138 A 8 SER H A 7 LEU HDx% 1.0 . 4.42 170 138 A 7 LEU HDy% A 8 SER H 1.0 . 4.42 171 139 A 9 VAL HGy% A 8 SER H 1.0 . 4.63 172 140 A 8 SER H A 8 SER HBx 1.0 . 3.23 173 140 A 8 SER HBy A 8 SER H 1.0 . 3.23 174 141 A 8 SER H A 7 LEU HBy 1.0 . 3.90 175 142 A 8 SER H A 7 LEU HBx 1.0 . 3.90 176 143 A 9 VAL HGx% A 8 SER H 1.0 . 4.38 177 144 A 16 THR H A 12 ARG H 1.0 . 4.63 178 145 A 3 PHE H A 2 LYS HBx 1.0 . 4.66 179 145 A 2 LYS HBy A 3 PHE H 1.0 . 4.66 180 146 A 14 HIS HA A 16 THR H 1.0 . 5.50 181 147 A 9 VAL H A 5 ARG HBx 1.0 . 5.50 182 147 A 5 ARG HBy A 9 VAL H 1.0 . 5.50 183 148 A 12 ARG HGx A 9 VAL H 1.0 . 5.50 184 149 A 9 VAL H A 5 ARG HDx 1.0 . 5.50 185 149 A 5 ARG HDy A 9 VAL H 1.0 . 5.50 186 150 A 6 TYR H A 7 LEU HDx% 1.0 . 4.83 187 150 A 7 LEU HDy% A 6 TYR H 1.0 . 4.83 188 151 A 9 VAL HGy% A 6 TYR H 1.0 . 5.20 189 152 A 4 ARG H A 3 PHE HBy 1.0 . 4.52 190 153 A 4 ARG H A 5 ARG H 1.0 . 4.45 191 154 A 15 ILE H A 14 HIS HBx 1.0 . 4.57 192 155 A 15 ILE H A 14 HIS HBy 1.0 . 4.57 193 156 A 9 VAL HGy% A 12 ARG H 1.0 . 5.40 194 157 A 12 ARG H A 10 PHE HBx 1.0 . 5.03 195 157 A 10 PHE HBy A 12 ARG H 1.0 . 5.03 196 158 A 9 VAL HA A 12 ARG H 1.0 . 4.61 197 159 A 11 PHE HD% A 12 ARG H 1.0 . 4.76 198 160 A 11 PHE HB2 A 13 LYS H 1.0 . 4.96 199 161 A 9 VAL HGy% A 11 PHE H 1.0 . 4.57 200 162 A 9 VAL HA A 11 PHE H 1.0 . 4.82 201 163 A 10 PHE HD% A 11 PHE H 1.0 . 4.75 202 164 A 12 ARG HGy A 11 PHE H 1.0 . 4.64 203 165 A 2 LYS HA A 2 LYS HGx 1.0 . 3.63 204 165 A 2 LYS HA A 2 LYS HGy 1.0 . 3.63 205 166 A 4 ARG H A 3 PHE HBx 1.0 . 3.81 206 166 A 4 ARG H A 3 PHE HBy 1.0 . 3.81 207 167 A 3 PHE HBx A 7 LEU HDx% 1.0 . 4.15 208 167 A 3 PHE HBy A 7 LEU HDx% 1.0 . 4.15 209 167 A 7 LEU HDy% A 3 PHE HBx 1.0 . 4.15 210 167 A 7 LEU HDy% A 3 PHE HBy 1.0 . 4.15 211 168 A 4 ARG HA A 4 ARG HGx 1.0 . 3.54 212 168 A 4 ARG HA A 4 ARG HGy 1.0 . 3.54 213 169 A 4 ARG HA A 7 LEU HBy 1.0 . 3.70 214 169 A 4 ARG HA A 7 LEU HBx 1.0 . 3.70 215 170 A 5 ARG H A 5 ARG HG3 1.0 . 4.63 216 170 A 5 ARG H A 5 ARG HG2 1.0 . 4.63 217 171 A 6 TYR HA A 5 ARG HG3 1.0 . 4.25 218 171 A 6 TYR HA A 5 ARG HG2 1.0 . 4.25 219 172 A 6 TYR HE% A 5 ARG HG3 1.0 . 5.18 220 172 A 6 TYR HE% A 5 ARG HG2 1.0 . 5.18 221 173 A 9 VAL H A 5 ARG HG3 1.0 . 4.85 222 173 A 9 VAL H A 5 ARG HG2 1.0 . 4.85 223 174 A 9 VAL HGx% A 5 ARG HG3 1.0 . 3.59 224 174 A 9 VAL HGx% A 5 ARG HG2 1.0 . 3.59 225 175 A 9 VAL HGy% A 5 ARG HG3 1.0 . 3.79 226 175 A 9 VAL HGy% A 5 ARG HG2 1.0 . 3.79 227 176 A 6 TYR H A 6 TYR HBy 1.0 . 3.27 228 176 A 6 TYR H A 6 TYR HBx 1.0 . 3.27 229 177 A 7 LEU H A 6 TYR HBy 1.0 . 3.65 230 177 A 7 LEU H A 6 TYR HBx 1.0 . 3.65 231 178 A 6 TYR HBx A 7 LEU HDx% 1.0 . 3.84 232 178 A 6 TYR HBy A 7 LEU HDx% 1.0 . 3.84 233 178 A 7 LEU HDy% A 6 TYR HBy 1.0 . 3.84 234 178 A 7 LEU HDy% A 6 TYR HBx 1.0 . 3.84 235 179 A 8 SER H A 6 TYR HBy 1.0 . 5.34 236 179 A 8 SER H A 6 TYR HBx 1.0 . 5.34 237 180 A 9 VAL HGy% A 6 TYR HBy 1.0 . 5.00 238 180 A 9 VAL HGy% A 6 TYR HBx 1.0 . 5.00 239 181 A 7 LEU H A 7 LEU HBy 1.0 . 3.25 240 181 A 7 LEU H A 7 LEU HBx 1.0 . 3.25 241 182 A 8 SER H A 7 LEU HBy 1.0 . 3.39 242 182 A 8 SER H A 7 LEU HBx 1.0 . 3.39 243 183 A 9 VAL H A 7 LEU HBy 1.0 . 5.34 244 183 A 9 VAL H A 7 LEU HBx 1.0 . 5.34 245 184 A 10 PHE H A 7 LEU HBy 1.0 . 5.34 246 184 A 10 PHE H A 7 LEU HBx 1.0 . 5.34 247 185 A 13 LYS H A 13 LYS HGx 1.0 . 4.61 248 185 A 13 LYS H A 13 LYS HGy 1.0 . 4.61 249 186 A 13 LYS HA A 13 LYS HGx 1.0 . 3.26 250 186 A 13 LYS HA A 13 LYS HGy 1.0 . 3.26 251 187 A 14 HIS HA A 13 LYS HGx 1.0 . 4.55 252 187 A 14 HIS HA A 13 LYS HGy 1.0 . 4.55 253 188 A 15 ILE H A 14 HIS HBx 1.0 . 4.02 254 188 A 15 ILE H A 14 HIS HBy 1.0 . 4.02 255 189 A 15 ILE HG2% A 14 HIS HBx 1.0 . 5.03 256 189 A 15 ILE HG2% A 14 HIS HBy 1.0 . 5.03 257 190 A 15 ILE HD1% A 14 HIS HBx 1.0 . 4.18 258 190 A 15 ILE HD1% A 14 HIS HBy 1.0 . 4.18 259 191 A 15 ILE HA A 15 ILE HG1x 1.0 . 3.22 260 191 A 15 ILE HA A 15 ILE HG1y 1.0 . 3.22 261 192 A 16 THR H A 15 ILE HG1x 1.0 . 4.40 262 192 A 16 THR H A 15 ILE HG1y 1.0 . 4.40 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _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 2 LYS C A 3 PHE N A 3 PHE CA A 3 PHE C 1.0 -90.0 -40.0 PHI 2 2 A 3 PHE N A 3 PHE CA A 3 PHE C A 4 ARG N 1.0 -64.9 -14.8 PSI 3 3 A 3 PHE C A 4 ARG N A 4 ARG CA A 4 ARG C 1.0 -90.0 -40.0 PHI 4 4 A 4 ARG N A 4 ARG CA A 4 ARG C A 5 ARG N 1.0 -72.8 -2.7 PSI 5 5 A 4 ARG C A 5 ARG N A 5 ARG CA A 5 ARG C 1.0 -90.0 -40.0 PHI 6 6 A 5 ARG N A 5 ARG CA A 5 ARG C A 6 TYR N 1.0 -69.0 -15.0 PSI 7 7 A 5 ARG C A 6 TYR N A 6 TYR CA A 6 TYR C 1.0 -90.0 -40.0 PHI 8 8 A 6 TYR N A 6 TYR CA A 6 TYR C A 7 LEU N 1.0 -65.6 -6.6 PSI 9 9 A 6 TYR C A 7 LEU N A 7 LEU CA A 7 LEU C 1.0 -90.0 -40.0 PHI 10 10 A 7 LEU N A 7 LEU CA A 7 LEU C A 8 SER N 1.0 -68.9 14.7 PSI 11 11 A 7 LEU C A 8 SER N A 8 SER CA A 8 SER C 1.0 -90.0 -40.0 PHI 12 12 A 8 SER N A 8 SER CA A 8 SER C A 9 VAL N 1.0 -68.5 -19.5 PSI 13 13 A 8 SER C A 9 VAL N A 9 VAL CA A 9 VAL C 1.0 -90.0 -40.0 PHI 14 14 A 9 VAL N A 9 VAL CA A 9 VAL C A 10 PHE N 1.0 -68.7 -8.7 PSI 15 15 A 9 VAL C A 10 PHE N A 10 PHE CA A 10 PHE C 1.0 -90.0 -40.0 PHI 16 16 A 10 PHE N A 10 PHE CA A 10 PHE C A 11 PHE N 1.0 -63.9 -9.8 PSI 17 17 A 10 PHE C A 11 PHE N A 11 PHE CA A 11 PHE C 1.0 -90.0 -40.0 PHI 18 18 A 11 PHE N A 11 PHE CA A 11 PHE C A 12 ARG N 1.0 -71.8 -3.6 PSI 19 19 A 11 PHE C A 12 ARG N A 12 ARG CA A 12 ARG C 1.0 -90.0 -40.0 PHI 20 20 A 12 ARG N A 12 ARG CA A 12 ARG C A 13 LYS N 1.0 -69.3 -1.4 PSI 21 21 A 12 ARG C A 13 LYS N A 13 LYS CA A 13 LYS C 1.0 -90.0 -40.0 PHI 22 22 A 13 LYS N A 13 LYS CA A 13 LYS C A 14 HIS N 1.0 -63.8 1.6 PSI stop_ save_