data_nef_c30557_6nm2 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 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 6NM2 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 8 TRP C 1 9 NH2 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 1 TRP start . . 2 A 2 TRP middle . . 3 A 3 TRP middle . . 4 A 4 LEU middle . . 5 A 5 ARG middle . . 6 A 6 LYS middle . . 7 A 7 ILE middle . . 8 A 8 TRP middle -OXT . 9 A 9 NH2 end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_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 TRP HA H 1 3.5887 . A 1 TRP HBx H 1 2.4901 . A 1 TRP HBy H 1 2.8285 . A 1 TRP HD1 H 1 7.3610 . A 1 TRP HE1 H 1 10.7497 . A 1 TRP HE3 H 1 7.2320 . A 1 TRP HH2 H 1 7.0750 . A 1 TRP HZ2 H 1 7.4805 . A 1 TRP HZ3 H 1 6.9695 . A 1 TRP CA C 13 57.2218 . A 1 TRP CB C 13 32.0444 . A 1 TRP CD1 C 13 127.5395 . A 1 TRP CE3 C 13 121.1824 . A 1 TRP CH2 C 13 124.0601 . A 1 TRP CZ2 C 13 114.7493 . A 1 TRP CZ3 C 13 121.3796 . A 1 TRP NE1 N 15 131.1013 . A 2 TRP HA H 1 4.3027 . A 2 TRP HBx H 1 3.3565 . A 2 TRP HBy H 1 3.3914 . A 2 TRP HD1 H 1 7.5273 . A 2 TRP HE1 H 1 10.9549 . A 2 TRP HE3 H 1 7.4085 . A 2 TRP HH2 H 1 7.2030 . A 2 TRP HZ2 H 1 7.5728 . A 2 TRP HZ3 H 1 7.0515 . A 2 TRP CA C 13 59.3027 . A 2 TRP CB C 13 28.3175 . A 2 TRP CD1 C 13 128.3566 . A 2 TRP CE3 C 13 120.8729 . A 2 TRP CH2 C 13 124.6161 . A 2 TRP CZ2 C 13 115.2332 . A 2 TRP CZ3 C 13 121.8557 . A 2 TRP NE1 N 15 131.9467 . A 3 TRP H H 1 6.6149 . A 3 TRP HA H 1 3.9303 . A 3 TRP HBx H 1 1.9836 . A 3 TRP HBy H 1 2.9064 . A 3 TRP HD1 H 1 6.4907 . A 3 TRP HE1 H 1 10.4270 . A 3 TRP HE3 H 1 7.0720 . A 3 TRP HH2 H 1 6.8425 . A 3 TRP HZ2 H 1 7.0104 . A 3 TRP HZ3 H 1 6.8225 . A 3 TRP CA C 13 57.1829 . A 3 TRP CB C 13 27.6919 . A 3 TRP CD1 C 13 127.2193 . A 3 TRP CE3 C 13 120.7767 . A 3 TRP CH2 C 13 124.1556 . A 3 TRP CZ2 C 13 114.7721 . A 3 TRP CZ3 C 13 121.7382 . A 3 TRP N N 15 119.0160 . A 3 TRP NE1 N 15 131.2832 . A 4 LEU H H 1 6.8911 . A 4 LEU HA H 1 3.9720 . A 4 LEU HBx H 1 1.2640 . A 4 LEU HBy H 1 1.4390 . A 4 LEU HDx% H 1 0.7670 . A 4 LEU HDy% H 1 0.8590 . A 4 LEU CA C 13 57.1662 . A 4 LEU CB C 13 41.9176 . A 4 LEU CDx C 13 24.7559 . A 4 LEU CDy C 13 25.2393 . A 4 LEU N N 15 121.2910 . A 5 ARG H H 1 7.6024 . A 5 ARG HA H 1 4.0050 . A 5 ARG HBx H 1 1.8290 . A 5 ARG HBy H 1 1.9060 . A 5 ARG HDx H 1 3.1650 . A 5 ARG HDy H 1 3.1650 . A 5 ARG HGx H 1 1.6585 . A 5 ARG HGy H 1 1.6585 . A 5 ARG CA C 13 58.1798 . A 5 ARG CB C 13 30.0806 . A 5 ARG CD C 13 43.4806 . A 5 ARG CG C 13 27.7459 . A 5 ARG N N 15 116.4023 . A 6 LYS H H 1 7.7287 . A 6 LYS HA H 1 4.1090 . A 6 LYS HBx H 1 1.8730 . A 6 LYS HBy H 1 1.8730 . A 6 LYS HDx H 1 1.7390 . A 6 LYS HDy H 1 1.7390 . A 6 LYS HEx H 1 2.9880 . A 6 LYS HEy H 1 2.9880 . A 6 LYS HGx H 1 1.4655 . A 6 LYS HGy H 1 1.4655 . A 6 LYS CA C 13 57.6041 . A 6 LYS CB C 13 32.4357 . A 6 LYS CD C 13 28.9688 . A 6 LYS CE C 13 42.0750 . A 6 LYS CG C 13 25.0450 . A 6 LYS N N 15 117.4544 . A 7 ILE H H 1 7.4775 . A 7 ILE HA H 1 3.9740 . A 7 ILE HB H 1 1.9150 . A 7 ILE HD1% H 1 0.8970 . A 7 ILE HG1x H 1 1.2435 . A 7 ILE HG1y H 1 1.6130 . A 7 ILE HG2% H 1 0.7865 . A 7 ILE CA C 13 63.1688 . A 7 ILE CB C 13 38.6928 . A 7 ILE CD1 C 13 13.8873 . A 7 ILE CG1 C 13 27.5902 . A 7 ILE CG2 C 13 17.8126 . A 7 ILE N N 15 116.0646 . A 8 TRP H H 1 7.5899 . A 8 TRP HA H 1 4.5730 . A 8 TRP HBx H 1 3.1471 . A 8 TRP HBy H 1 3.2581 . A 8 TRP HD1 H 1 7.2407 . A 8 TRP HE1 H 1 10.5545 . A 8 TRP HE3 H 1 7.5050 . A 8 TRP HH2 H 1 7.0610 . A 8 TRP HZ2 H 1 7.4389 . A 8 TRP HZ3 H 1 6.9700 . A 8 TRP CA C 13 57.8159 . A 8 TRP CB C 13 30.5187 . A 8 TRP CD1 C 13 127.2991 . A 8 TRP CE3 C 13 120.7457 . A 8 TRP CH2 C 13 124.0080 . A 8 TRP CZ2 C 13 114.7185 . A 8 TRP CZ3 C 13 121.5091 . A 8 TRP N N 15 119.0111 . A 8 TRP NE1 N 15 130.1639 . A 9 NH2 HNy H 1 7.2180 . A 9 NH2 HNx H 1 7.0380 . A 9 NH2 N N 15 106.0312 . 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 1 TRP HZ3 A 1 TRP HA 1.0 1.8 6.0 2 2 A 1 TRP HE1 A 1 TRP HBx 1.0 1.8 6.0 3 2 A 1 TRP HE1 A 1 TRP HBy 1.0 1.8 6.0 4 3 A 1 TRP HZ3 A 1 TRP HBx 1.0 1.8 6.0 5 3 A 1 TRP HZ3 A 1 TRP HBy 1.0 1.8 6.0 6 4 A 1 TRP HA A 1 TRP HE1 1.0 1.8 6.0 7 5 A 1 TRP HE1 A 1 TRP HBx 1.0 1.8 6.0 8 5 A 1 TRP HE1 A 1 TRP HBy 1.0 1.8 6.0 9 6 A 1 TRP HA A 1 TRP HD1 1.0 1.8 3.8 10 7 A 1 TRP HBy A 1 TRP HD1 1.0 1.8 5.0 11 8 A 1 TRP HD1 A 1 TRP HBx 1.0 1.8 5.0 12 9 A 1 TRP HA A 2 TRP HD1 1.0 1.8 6.0 13 10 A 1 TRP HE3 A 2 TRP HA 1.0 1.8 6.0 14 11 A 3 TRP HD1 A 1 TRP HBx 1.0 1.8 6.0 15 12 A 1 TRP HBy A 3 TRP HZ2 1.0 1.8 5.0 16 13 A 3 TRP HE1 A 1 TRP HBx 1.0 1.8 5.0 17 14 A 1 TRP HA A 3 TRP HD1 1.0 1.8 5.0 18 15 A 1 TRP HD1 A 3 TRP HD1 1.0 1.8 5.0 19 16 A 1 TRP HBy A 3 TRP H 1.0 1.8 5.0 20 17 A 1 TRP HE3 A 3 TRP HE1 1.0 1.8 6.0 21 18 A 1 TRP HD1 A 3 TRP HE1 1.0 1.8 6.0 22 19 A 1 TRP HA A 3 TRP HE1 1.0 1.8 6.0 23 20 A 1 TRP HD1 A 3 TRP H 1.0 1.8 5.0 24 21 A 1 TRP HBy A 3 TRP HD1 1.0 1.8 6.0 25 22 A 1 TRP HBy A 3 TRP HE1 1.0 1.8 6.0 26 23 A 1 TRP HD1 A 4 LEU HDx% 1.0 1.8 6.5 27 24 A 1 TRP HBx A 4 LEU HBy 1.0 1.8 6.0 28 25 A 1 TRP HBy A 4 LEU HBy 1.0 1.8 6.0 29 26 A 1 TRP HD1 A 4 LEU HBx 1.0 1.8 5.0 30 27 A 1 TRP HBy A 4 LEU HDx% 1.0 1.8 6.5 31 28 A 1 TRP HZ3 A 4 LEU HBy 1.0 1.8 5.0 32 29 A 4 LEU H A 1 TRP HBx 1.0 1.8 5.0 33 30 A 1 TRP HD1 A 4 LEU H 1.0 1.8 5.0 34 31 A 1 TRP HBy A 4 LEU H 1.0 1.8 5.0 35 32 A 4 LEU HDx% A 1 TRP HBx 1.0 1.8 5.5 36 33 A 4 LEU HBx A 1 TRP HBx 1.0 1.8 5.0 37 34 A 1 TRP HD1 A 4 LEU HDy% 1.0 1.8 5.5 38 35 A 1 TRP HBy A 4 LEU HDy% 1.0 1.8 4.8 39 36 A 1 TRP HBy A 4 LEU HBx 1.0 1.8 4.3 40 37 A 1 TRP HZ3 A 4 LEU HBx 1.0 1.8 5.0 41 38 A 1 TRP HBx A 4 LEU HDy% 1.0 1.8 4.8 42 39 A 1 TRP HE3 A 4 LEU HBy 1.0 1.8 3.8 43 40 A 1 TRP HZ3 A 4 LEU HDy% 1.0 1.8 3.8 44 41 A 3 TRP HE3 A 4 LEU HDy% 1.0 1.8 5.8 45 41 A 3 TRP HE3 A 4 LEU HDx% 1.0 1.8 5.8 46 42 A 3 TRP HE3 A 4 LEU HBy 1.0 1.8 6.0 47 42 A 3 TRP HE3 A 4 LEU HBx 1.0 1.8 6.0 48 43 A 2 TRP HE1 A 2 TRP HBx 1.0 1.8 6.0 49 44 A 2 TRP HZ3 A 2 TRP HBx 1.0 1.8 6.0 50 44 A 2 TRP HZ3 A 2 TRP HBy 1.0 1.8 6.0 51 45 A 2 TRP HA A 2 TRP HE3 1.0 1.8 3.8 52 46 A 2 TRP HD1 A 2 TRP HA 1.0 1.8 4.2 53 47 A 2 TRP HBy A 2 TRP HE3 1.0 1.8 3.8 54 48 A 2 TRP HD1 A 2 TRP HBx 1.0 1.8 3.8 55 49 A 2 TRP HD1 A 3 TRP HE1 1.0 1.8 6.0 56 50 A 2 TRP HH2 A 3 TRP HBy 1.0 1.8 6.0 57 51 A 3 TRP HD1 A 2 TRP HBx 1.0 1.8 6.0 58 52 A 2 TRP HZ2 A 3 TRP HBy 1.0 1.8 5.0 59 53 A 3 TRP HE1 A 2 TRP HE1 1.0 1.8 6.0 60 54 A 2 TRP HH2 A 3 TRP HBx 1.0 1.8 5.0 61 55 A 2 TRP HA A 3 TRP HD1 1.0 1.8 5.0 62 56 A 3 TRP HD1 A 2 TRP HE1 1.0 1.8 4.0 63 57 A 2 TRP HH2 A 3 TRP HA 1.0 1.8 5.0 64 58 A 3 TRP HD1 A 2 TRP HH2 1.0 1.8 5.0 65 59 A 2 TRP HE3 A 3 TRP HBx 1.0 1.8 6.0 66 59 A 2 TRP HE3 A 3 TRP HBy 1.0 1.8 6.0 67 60 A 2 TRP HE3 A 3 TRP HBx 1.0 1.8 4.8 68 60 A 2 TRP HE3 A 3 TRP HBy 1.0 1.8 4.8 69 61 A 3 TRP H A 2 TRP HBx 1.0 1.8 4.8 70 61 A 3 TRP H A 2 TRP HBy 1.0 1.8 4.8 71 62 A 3 TRP HD1 A 2 TRP HZ2 1.0 1.8 3.8 72 63 A 3 TRP H A 2 TRP HE1 1.0 1.8 3.8 73 64 A 2 TRP HD1 A 3 TRP H 1.0 1.8 3.8 74 65 A 2 TRP HZ3 A 3 TRP HBx 1.0 1.8 4.8 75 65 A 2 TRP HZ3 A 3 TRP HBy 1.0 1.8 4.8 76 66 A 2 TRP HA A 3 TRP H 1.0 1.8 3.5 77 67 A 2 TRP HD1 A 3 TRP HD1 1.0 1.8 3.3 78 68 A 3 TRP HD1 A 2 TRP HE1 1.0 1.8 3.3 79 69 A 2 TRP HZ3 A 3 TRP HA 1.0 1.8 3.8 80 70 A 2 TRP HZ2 A 3 TRP HBx 1.0 1.8 4.8 81 70 A 2 TRP HZ2 A 3 TRP HBy 1.0 1.8 4.8 82 71 A 2 TRP HD1 A 4 LEU H 1.0 1.8 6.0 83 72 A 4 LEU H A 2 TRP HE1 1.0 1.8 6.0 84 73 A 2 TRP HA A 4 LEU H 1.0 1.8 5.0 85 74 A 2 TRP HE3 A 5 ARG HGx 1.0 1.8 6.5 86 74 A 2 TRP HE3 A 5 ARG HGy 1.0 1.8 6.5 87 75 A 2 TRP HA A 5 ARG HBx 1.0 1.8 6.0 88 76 A 2 TRP HA A 5 ARG HGx 1.0 1.8 5.5 89 76 A 2 TRP HA A 5 ARG HGy 1.0 1.8 5.5 90 77 A 2 TRP HE3 A 5 ARG HDx 1.0 1.8 5.5 91 77 A 2 TRP HE3 A 5 ARG HDy 1.0 1.8 5.5 92 78 A 2 TRP HA A 5 ARG H 1.0 1.8 3.5 93 79 A 2 TRP HH2 A 6 LYS HEx 1.0 1.8 5.5 94 79 A 2 TRP HH2 A 6 LYS HEy 1.0 1.8 5.5 95 80 A 2 TRP HE3 A 6 LYS HDx 1.0 1.8 4.8 96 80 A 2 TRP HE3 A 6 LYS HDy 1.0 1.8 4.8 97 81 A 2 TRP HE3 A 6 LYS HBx 1.0 1.8 4.8 98 81 A 2 TRP HE3 A 6 LYS HBy 1.0 1.8 4.8 99 82 A 2 TRP HE3 A 6 LYS HEx 1.0 1.8 4.8 100 82 A 2 TRP HE3 A 6 LYS HEy 1.0 1.8 4.8 101 83 A 2 TRP HZ3 A 6 LYS HEx 1.0 1.8 4.8 102 83 A 2 TRP HZ3 A 6 LYS HEy 1.0 1.8 4.8 103 84 A 2 TRP HZ3 A 6 LYS HDx 1.0 1.8 4.8 104 84 A 2 TRP HZ3 A 6 LYS HDy 1.0 1.8 4.8 105 85 A 2 TRP HE3 A 6 LYS HGx 1.0 1.8 4.8 106 85 A 2 TRP HE3 A 6 LYS HGy 1.0 1.8 4.8 107 86 A 2 TRP HZ3 A 6 LYS HGx 1.0 1.8 4.8 108 86 A 2 TRP HZ3 A 6 LYS HGy 1.0 1.8 4.8 109 87 A 3 TRP HE1 A 3 TRP HA 1.0 1.8 6.0 110 88 A 3 TRP HZ3 A 3 TRP HBx 1.0 1.8 6.0 111 89 A 3 TRP HZ2 A 3 TRP H 1.0 1.8 6.0 112 90 A 3 TRP HE1 A 3 TRP HBx 1.0 1.8 7.0 113 90 A 3 TRP HE1 A 3 TRP HBy 1.0 1.8 7.0 114 91 A 3 TRP HBy A 3 TRP HZ3 1.0 1.8 6.0 115 92 A 3 TRP HE1 A 3 TRP H 1.0 1.8 5.0 116 93 A 3 TRP HE1 A 3 TRP H 1.0 1.8 3.8 117 94 A 3 TRP H A 3 TRP HBy 1.0 1.8 3.8 118 95 A 3 TRP H A 3 TRP HBx 1.0 1.8 3.8 119 96 A 3 TRP HD1 A 3 TRP HA 1.0 1.8 3.8 120 97 A 3 TRP HE3 A 3 TRP HA 1.0 1.8 4.3 121 98 A 3 TRP HE1 A 3 TRP HBx 1.0 1.8 4.8 122 98 A 3 TRP HE1 A 3 TRP HBy 1.0 1.8 4.8 123 99 A 3 TRP HD1 A 3 TRP HBy 1.0 1.8 4.8 124 100 A 3 TRP HD1 A 3 TRP H 1.0 1.8 5.0 125 101 A 3 TRP HD1 A 3 TRP HBx 1.0 1.8 4.8 126 102 A 3 TRP HE1 A 4 LEU HBx 1.0 1.8 6.0 127 103 A 3 TRP HZ3 A 4 LEU HBy 1.0 1.8 6.0 128 103 A 4 LEU HBx A 3 TRP HZ3 1.0 1.8 6.0 129 104 A 3 TRP HE1 A 4 LEU HDy% 1.0 1.8 5.5 130 105 A 3 TRP HD1 A 4 LEU HBx 1.0 1.8 5.0 131 106 A 3 TRP H A 4 LEU HBx 1.0 1.8 5.0 132 107 A 3 TRP HZ2 A 4 LEU HBx 1.0 1.8 6.0 133 108 A 3 TRP HE1 A 4 LEU HDx% 1.0 1.8 6.5 134 109 A 3 TRP HD1 A 4 LEU HDx% 1.0 1.8 7.0 135 110 A 3 TRP HZ2 A 4 LEU HDy% 1.0 1.8 6.5 136 111 A 4 LEU H A 3 TRP HBx 1.0 1.8 5.0 137 112 A 3 TRP HD1 A 4 LEU H 1.0 1.8 5.0 138 113 A 4 LEU H A 3 TRP HBy 1.0 1.8 5.0 139 114 A 3 TRP HZ2 A 4 LEU HDx% 1.0 1.8 4.8 140 115 A 3 TRP HZ3 A 4 LEU HA 1.0 1.8 3.8 141 116 A 3 TRP HZ3 A 4 LEU HDy% 1.0 1.8 5.3 142 117 A 3 TRP H A 4 LEU H 1.0 1.8 3.8 143 118 A 4 LEU HDx% A 3 TRP HZ3 1.0 1.8 4.8 144 119 A 3 TRP HE1 A 7 ILE HB 1.0 1.8 8.0 145 120 A 3 TRP H A 5 ARG H 1.0 1.8 5.0 146 121 A 3 TRP HA A 5 ARG H 1.0 1.8 5.0 147 122 A 3 TRP HA A 6 LYS HDx 1.0 1.8 5.5 148 122 A 3 TRP HA A 6 LYS HDy 1.0 1.8 5.5 149 123 A 3 TRP HD1 A 6 LYS HEx 1.0 1.8 7.0 150 123 A 3 TRP HD1 A 6 LYS HEy 1.0 1.8 7.0 151 124 A 3 TRP HA A 6 LYS HEx 1.0 1.8 5.5 152 124 A 3 TRP HA A 6 LYS HEy 1.0 1.8 5.5 153 125 A 3 TRP HA A 6 LYS HBx 1.0 1.8 4.8 154 125 A 3 TRP HA A 6 LYS HBy 1.0 1.8 4.8 155 126 A 3 TRP HA A 6 LYS H 1.0 1.8 3.8 156 127 A 3 TRP HA A 6 LYS HGx 1.0 1.8 4.8 157 127 A 3 TRP HA A 6 LYS HGy 1.0 1.8 4.8 158 128 A 4 LEU H A 4 LEU HDx% 1.0 1.8 5.5 159 129 A 4 LEU H A 4 LEU HDy% 1.0 1.8 5.5 160 130 A 4 LEU H A 4 LEU HBy 1.0 1.8 4.8 161 131 A 4 LEU HBy A 4 LEU HDy% 1.0 1.8 4.2 162 132 A 4 LEU HA A 4 LEU HDy% 1.0 1.8 4.2 163 133 A 4 LEU HDx% A 4 LEU HBy 1.0 1.8 4.2 164 134 A 4 LEU H A 4 LEU HBx 1.0 1.8 3.9 165 135 A 4 LEU HDx% A 4 LEU HBx 1.0 1.8 4.2 166 136 A 4 LEU HBx A 4 LEU HDy% 1.0 1.8 4.2 167 137 A 4 LEU H A 5 ARG HBx 1.0 1.8 6.0 168 138 A 4 LEU H A 5 ARG HGx 1.0 1.8 6.0 169 138 A 4 LEU H A 5 ARG HGy 1.0 1.8 6.0 170 139 A 5 ARG H A 4 LEU HDy% 1.0 1.8 5.5 171 140 A 5 ARG H A 4 LEU HBy 1.0 1.8 4.8 172 141 A 4 LEU HBx A 5 ARG H 1.0 1.8 3.8 173 142 A 4 LEU H A 5 ARG H 1.0 1.8 2.9 174 143 A 7 ILE HA A 6 LYS HDx 1.0 1.8 5.5 175 143 A 6 LYS HDy A 7 ILE HA 1.0 1.8 5.5 176 144 A 4 LEU H A 6 LYS H 1.0 1.8 5.0 177 145 A 5 ARG HA A 5 ARG HDx 1.0 1.8 4.8 178 145 A 5 ARG HDy A 5 ARG HA 1.0 1.8 4.8 179 146 A 5 ARG HBx A 5 ARG HDx 1.0 1.8 4.8 180 146 A 5 ARG HBx A 5 ARG HDy 1.0 1.8 4.8 181 147 A 5 ARG HBy A 5 ARG HDx 1.0 1.8 4.8 182 147 A 5 ARG HDy A 5 ARG HBy 1.0 1.8 4.8 183 148 A 5 ARG HA A 5 ARG HGx 1.0 1.8 4.2 184 148 A 5 ARG HGy A 5 ARG HA 1.0 1.8 4.2 185 149 A 5 ARG H A 5 ARG HGx 1.0 1.8 4.4 186 149 A 5 ARG HGy A 5 ARG H 1.0 1.8 4.4 187 150 A 5 ARG HBx A 5 ARG H 1.0 1.8 3.9 188 151 A 5 ARG H A 5 ARG HBy 1.0 1.8 3.9 189 152 A 6 LYS HA A 5 ARG HGx 1.0 1.8 6.5 190 152 A 5 ARG HGy A 6 LYS HA 1.0 1.8 6.5 191 153 A 6 LYS H A 5 ARG HDx 1.0 1.8 5.5 192 153 A 5 ARG HDy A 6 LYS H 1.0 1.8 5.5 193 154 A 6 LYS HA A 6 LYS HBx 1.0 1.8 3.8 194 154 A 6 LYS HBy A 6 LYS HA 1.0 1.8 3.8 195 155 A 6 LYS H A 5 ARG HGx 1.0 1.8 5.0 196 155 A 5 ARG HGy A 6 LYS H 1.0 1.8 5.0 197 156 A 6 LYS H A 5 ARG HA 1.0 1.8 3.8 198 157 A 5 ARG H A 6 LYS H 1.0 1.8 2.9 199 158 A 7 ILE H A 6 LYS HBx 1.0 1.8 4.8 200 158 A 6 LYS HBy A 7 ILE H 1.0 1.8 4.8 201 159 A 8 TRP HZ3 A 8 TRP HBx 1.0 1.8 6.5 202 159 A 8 TRP HBy A 8 TRP HZ3 1.0 1.8 6.5 203 160 A 5 ARG HA A 8 TRP HE1 1.0 1.8 6.0 204 161 A 8 TRP HD1 A 7 ILE HG1y 1.0 1.8 6.5 205 161 A 7 ILE HG1x A 8 TRP HD1 1.0 1.8 6.5 206 162 A 5 ARG HA A 8 TRP HBy 1.0 1.8 3.8 207 163 A 5 ARG HA A 8 TRP HD1 1.0 1.8 3.8 208 164 A 6 LYS H A 6 LYS HEx 1.0 1.8 6.5 209 164 A 6 LYS HEy A 6 LYS H 1.0 1.8 6.5 210 165 A 6 LYS HBy A 6 LYS HEx 1.0 1.8 4.3 211 165 A 6 LYS HEy A 6 LYS HBx 1.0 1.8 4.3 212 165 A 6 LYS HEy A 6 LYS HBy 1.0 1.8 4.3 213 165 A 6 LYS HBx A 6 LYS HEx 1.0 1.8 4.3 214 166 A 6 LYS H A 6 LYS HDx 1.0 1.8 5.0 215 166 A 6 LYS HDy A 6 LYS H 1.0 1.8 5.0 216 167 A 6 LYS HA A 6 LYS HDx 1.0 1.8 4.8 217 167 A 6 LYS HDy A 6 LYS HA 1.0 1.8 4.8 218 168 A 6 LYS HEy A 6 LYS HGx 1.0 1.8 5.3 219 168 A 6 LYS HEx A 6 LYS HGx 1.0 1.8 5.3 220 168 A 6 LYS HGy A 6 LYS HEx 1.0 1.8 5.3 221 168 A 6 LYS HEy A 6 LYS HGy 1.0 1.8 5.3 222 169 A 6 LYS HA A 6 LYS HGx 1.0 1.8 4.8 223 169 A 6 LYS HGy A 6 LYS HA 1.0 1.8 4.8 224 170 A 6 LYS H A 6 LYS HGx 1.0 1.8 4.4 225 170 A 6 LYS HGy A 6 LYS H 1.0 1.8 4.4 226 171 A 6 LYS H A 6 LYS HBx 1.0 1.8 4.4 227 171 A 6 LYS HBy A 6 LYS H 1.0 1.8 4.4 228 172 A 7 ILE H A 6 LYS HDx 1.0 1.8 6.5 229 172 A 6 LYS HDy A 7 ILE H 1.0 1.8 6.5 230 173 A 6 LYS H A 7 ILE HG2% 1.0 1.8 7.5 231 174 A 6 LYS H A 7 ILE HG1y 1.0 1.8 7.0 232 174 A 6 LYS H A 7 ILE HG1x 1.0 1.8 7.0 233 175 A 6 LYS HA A 7 ILE HG2% 1.0 1.8 6.5 234 176 A 7 ILE H A 6 LYS HGx 1.0 1.8 5.0 235 176 A 6 LYS HGy A 7 ILE H 1.0 1.8 5.0 236 177 A 6 LYS HA A 7 ILE H 1.0 1.8 3.8 237 178 A 6 LYS H A 7 ILE H 1.0 1.8 2.9 238 179 A 2 TRP HH2 A 6 LYS HDx 1.0 1.8 6.5 239 179 A 2 TRP HH2 A 6 LYS HDy 1.0 1.8 6.5 240 180 A 2 TRP HZ2 A 6 LYS HEx 1.0 1.8 5.5 241 180 A 2 TRP HZ2 A 6 LYS HEy 1.0 1.8 5.5 242 181 A 2 TRP HZ3 A 6 LYS HBx 1.0 1.8 6.0 243 181 A 2 TRP HZ3 A 6 LYS HBy 1.0 1.8 6.0 244 182 A 6 LYS HA A 8 TRP H 1.0 1.8 5.0 245 183 A 7 ILE H A 7 ILE HD1% 1.0 1.8 5.5 246 184 A 7 ILE HA A 7 ILE HG1y 1.0 1.8 3.8 247 185 A 7 ILE H A 7 ILE HG1y 1.0 1.8 4.8 248 185 A 7 ILE H A 7 ILE HG1x 1.0 1.8 4.8 249 186 A 7 ILE H A 7 ILE HG2% 1.0 1.8 4.5 250 187 A 7 ILE HD1% A 7 ILE HB 1.0 1.8 4.2 251 188 A 7 ILE HA A 7 ILE HD1% 1.0 1.8 5.2 252 189 A 7 ILE H A 7 ILE HB 1.0 1.8 3.4 253 190 A 7 ILE HA A 7 ILE HG2% 1.0 1.8 4.2 254 191 A 8 TRP HE1 A 7 ILE HD1% 1.0 1.8 6.5 255 192 A 7 ILE HD1% A 8 TRP HBx 1.0 1.8 6.5 256 193 A 8 TRP HE1 A 7 ILE HB 1.0 1.8 5.0 257 194 A 8 TRP HD1 A 7 ILE HB 1.0 1.8 6.0 258 195 A 8 TRP HE1 A 7 ILE HG2% 1.0 1.8 5.5 259 196 A 8 TRP HH2 A 7 ILE HG1y 1.0 1.8 5.0 260 197 A 7 ILE H A 8 TRP HA 1.0 1.8 5.0 261 198 A 7 ILE HG2% A 8 TRP HBx 1.0 1.8 5.8 262 198 A 8 TRP HBy A 7 ILE HG2% 1.0 1.8 5.8 263 199 A 7 ILE HD1% A 8 TRP HE3 1.0 1.8 4.8 264 200 A 7 ILE HG2% A 8 TRP HZ2 1.0 1.8 4.8 265 201 A 7 ILE HD1% A 8 TRP HZ2 1.0 1.8 4.8 266 202 A 7 ILE HG2% A 8 TRP HA 1.0 1.8 4.8 267 203 A 7 ILE HG2% A 8 TRP H 1.0 1.8 5.5 268 204 A 4 LEU HDx% A 8 TRP HD1 1.0 1.8 4.8 269 204 A 8 TRP HD1 A 7 ILE HD1% 1.0 1.8 4.8 270 205 A 8 TRP HD1 A 4 LEU HDy% 1.0 1.8 4.2 271 205 A 8 TRP HD1 A 7 ILE HG2% 1.0 1.8 4.2 272 206 A 7 ILE H A 8 TRP H 1.0 1.8 2.9 273 207 A 8 TRP HE1 A 8 TRP HBx 1.0 1.8 5.0 274 208 A 8 TRP HBy A 8 TRP HE1 1.0 1.8 5.0 275 209 A 8 TRP HZ3 A 8 TRP HA 1.0 1.8 5.0 276 210 A 8 TRP HE3 A 8 TRP HBx 1.0 1.8 4.8 277 210 A 8 TRP HBy A 8 TRP HE3 1.0 1.8 4.8 278 211 A 8 TRP HD1 A 8 TRP HA 1.0 1.8 5.0 279 212 A 8 TRP HE3 A 8 TRP HBx 1.0 1.8 4.8 280 212 A 8 TRP HBy A 8 TRP HE3 1.0 1.8 4.8 281 213 A 8 TRP HD1 A 8 TRP HBx 1.0 1.8 3.7 282 214 A 8 TRP H A 8 TRP HBx 1.0 1.8 4.8 283 214 A 8 TRP HBy A 8 TRP H 1.0 1.8 4.8 284 215 A 8 TRP HA A 8 TRP HE3 1.0 1.8 3.8 285 216 A 8 TRP HBy A 8 TRP HD1 1.0 1.8 3.8 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 2 TRP C A 3 TRP N A 3 TRP CA A 3 TRP C 1.0 -103.0 -43.0 PHI 2 2 A 3 TRP N A 3 TRP CA A 3 TRP C A 4 LEU N 1.0 -55.0 5.0 PSI 3 3 A 3 TRP C A 4 LEU N A 4 LEU CA A 4 LEU C 1.0 -78.0 -58.0 PHI 4 4 A 4 LEU N A 4 LEU CA A 4 LEU C A 5 ARG N 1.0 -50.0 -20.0 PSI 5 5 A 4 LEU C A 5 ARG N A 5 ARG CA A 5 ARG C 1.0 -80.0 -50.0 PHI 6 6 A 5 ARG N A 5 ARG CA A 5 ARG C A 6 LYS N 1.0 -48.0 -18.0 PSI 7 7 A 5 ARG C A 6 LYS N A 6 LYS CA A 6 LYS C 1.0 -85.0 -55.0 PHI 8 8 A 6 LYS N A 6 LYS CA A 6 LYS C A 7 ILE N 1.0 -45.0 -15.0 PSI 9 9 A 6 LYS C A 7 ILE N A 7 ILE CA A 7 ILE C 1.0 -93.0 -53.0 PHI 10 10 A 7 ILE N A 7 ILE CA A 7 ILE C A 8 TRP N 1.0 -45.0 -5.0 PSI stop_ save_