data_nef_c25758_2n6b 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 2N6B 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 2 CYS SG 1 34 CYS SG 1 11 CYS SG 1 27 CYS SG 1 16 CYS SG 1 31 CYS SG 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 2 ALA start . . 2 A 3 CYS middle -HG . 3 A 4 LYS middle . . 4 A 5 ASP middle . . 5 A 6 TYR middle . . 6 A 7 LEU middle . . 7 A 8 PRO middle . false 8 A 9 LYS middle . . 9 A 10 SER middle . . 10 A 11 GLU middle . . 11 A 12 CYS middle -HG . 12 A 13 THR middle . . 13 A 14 GLN middle . . 14 A 15 PHE middle . . 15 A 16 ARG middle . . 16 A 17 CYS middle -HG . 17 A 18 ARG middle . . 18 A 19 THR middle . . 19 A 20 SER middle . . 20 A 21 MET middle . . 21 A 22 LYS middle . . 22 A 23 TYR middle . . 23 A 24 ARG middle . . 24 A 25 LEU middle . . 25 A 26 ASN middle . . 26 A 27 LEU middle . . 27 A 28 CYS middle -HG . 28 A 29 LYS middle . . 29 A 30 LYS middle . . 30 A 31 THR middle . . 31 A 32 CYS middle -HG . 32 A 33 GLY middle . false 33 A 34 THR middle . . 34 A 35 CYS end -HG . 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 3 CYS HA H 1 4.75 0.01 A 3 CYS HBx H 1 2.93 0.01 A 3 CYS HBy H 1 3.16 0.01 A 3 CYS CA C 13 55 0.1 A 4 LYS H H 1 8.1 0.01 A 4 LYS HA H 1 4.52 0.01 A 4 LYS HBx H 1 1.61 0.01 A 4 LYS HBy H 1 1.76 0.01 A 4 LYS HDx H 1 1.29 0.01 A 4 LYS HEx H 1 2.84 0.01 A 4 LYS HGx H 1 0.93 0.01 A 4 LYS CA C 13 54.8 0.1 A 4 LYS CB C 13 35.3 0.1 A 4 LYS N N 15 124.8 0.1 A 5 ASP H H 1 8.59 0.01 A 5 ASP HA H 1 4.96 0.01 A 5 ASP HBx H 1 2.69 0.01 A 5 ASP HBy H 1 3.17 0.01 A 5 ASP CA C 13 54.2 0.1 A 5 ASP N N 15 120.6 0.1 A 6 TYR H H 1 9.04 0.01 A 6 TYR HA H 1 4.67 0.01 A 6 TYR HBx H 1 2.92 0.01 A 6 TYR HBy H 1 3.42 0.01 A 6 TYR HDy H 1 7.23 0.01 A 6 TYR HEy H 1 6.87 0.01 A 6 TYR CA C 13 58.2 0.1 A 6 TYR CB C 13 39.1 0.1 A 6 TYR N N 15 120.4 0.1 A 7 LEU H H 1 7.06 0.01 A 7 LEU HA H 1 4.85 0.01 A 7 LEU HBx H 1 1.49 0.01 A 7 LEU HBy H 1 1.76 0.01 A 7 LEU HDx% H 1 1.02 0.01 A 7 LEU HDy% H 1 1.05 0.01 A 7 LEU HG H 1 1.66 0.01 A 7 LEU CA C 13 51.8 0.1 A 7 LEU CB C 13 43.5 0.1 A 7 LEU N N 15 118.8 0.1 A 8 PRO HA H 1 4.48 0.01 A 8 PRO HBx H 1 1.98 0.01 A 8 PRO HBy H 1 2.06 0.01 A 8 PRO HDx H 1 3.49 0.01 A 8 PRO HDy H 1 3.82 0.01 A 8 PRO HGx H 1 2.48 0.01 A 8 PRO HGy H 1 2.48 0.01 A 8 PRO CA C 13 62.3 0.1 A 9 LYS H H 1 8.46 0.01 A 9 LYS HA H 1 4.06 0.01 A 9 LYS HBx H 1 1.82 0.01 A 9 LYS HBy H 1 1.90 0.01 A 9 LYS HDx H 1 1.72 0.01 A 9 LYS HEx H 1 3.03 0.01 A 9 LYS HGx H 1 1.52 0.01 A 9 LYS CA C 13 62.7 0.1 A 9 LYS N N 15 122.7 0.1 A 10 SER H H 1 8.14 0.01 A 10 SER HA H 1 4.03 0.01 A 10 SER HBx H 1 3.86 0.01 A 10 SER HBy H 1 3.94 0.01 A 10 SER CA C 13 59.3 0.1 A 10 SER CB C 13 62.1 0.1 A 10 SER N N 15 111 0.1 A 11 GLU H H 1 7.82 0.01 A 11 GLU HA H 1 4.39 0.01 A 11 GLU HBx H 1 2.08 0.01 A 11 GLU HBy H 1 2.33 0.01 A 11 GLU HGx H 1 2.23 0.01 A 11 GLU HGy H 1 2.44 0.01 A 11 GLU CA C 13 58.1 0.1 A 11 GLU N N 15 117.8 0.1 A 12 CYS H H 1 7.62 0.01 A 12 CYS HA H 1 5.12 0.01 A 12 CYS HBx H 1 2.87 0.01 A 12 CYS CA C 13 52 0.1 A 12 CYS CB C 13 37.5 0.1 A 12 CYS N N 15 120.3 0.1 A 13 THR H H 1 6.91 0.01 A 13 THR HA H 1 4.49 0.01 A 13 THR HB H 1 4.65 0.01 A 13 THR HG21 H 1 1.19 0.01 A 13 THR HG22 H 1 1.19 0.01 A 13 THR HG23 H 1 1.19 0.01 A 13 THR CA C 13 59 0.1 A 13 THR CB C 13 70.9 0.1 A 13 THR N N 15 109.8 0.1 A 14 GLN H H 1 8.96 0.01 A 14 GLN HA H 1 3.83 0.01 A 14 GLN HBx H 1 2.04 0.01 A 14 GLN HBy H 1 2.12 0.01 A 14 GLN HE2x H 1 6.74 0.01 A 14 GLN HE2y H 1 7.63 0.01 A 14 GLN HGx H 1 2.47 0.01 A 14 GLN CA C 13 59.1 0.1 A 14 GLN N N 15 120.8 0.1 A 15 PHE H H 1 8.44 0.01 A 15 PHE HA H 1 4.15 0.01 A 15 PHE HBx H 1 2.77 0.01 A 15 PHE HBy H 1 3.27 0.01 A 15 PHE HDx H 1 7.10 0.01 A 15 PHE HEx H 1 7.31 0.01 A 15 PHE CA C 13 61.3 0.1 A 15 PHE CB C 13 39.2 0.1 A 15 PHE N N 15 118.3 0.1 A 16 ARG H H 1 7.61 0.01 A 16 ARG HA H 1 3.59 0.01 A 16 ARG HBy H 1 1.77 0.01 A 16 ARG HBx H 1 1.62 0.01 A 16 ARG HDx H 1 1.92 0.01 A 16 ARG HDy H 1 2.63 0.01 A 16 ARG HGx H 1 1.22 0.01 A 16 ARG HGy H 1 1.30 0.01 A 16 ARG CA C 13 59.6 0.1 A 16 ARG N N 15 121 0.1 A 17 CYS H H 1 8.25 0.01 A 17 CYS HA H 1 4.20 0.01 A 17 CYS HBx H 1 3.05 0.01 A 17 CYS HBy H 1 3.19 0.01 A 17 CYS CA C 13 56.5 0.1 A 17 CYS CB C 13 35.9 0.1 A 17 CYS N N 15 115.2 0.1 A 18 ARG H H 1 7.73 0.01 A 18 ARG HA H 1 4.13 0.01 A 18 ARG HBx H 1 1.59 0.01 A 18 ARG HBy H 1 1.82 0.01 A 18 ARG HDx H 1 3.18 0.01 A 18 ARG HGx H 1 1.72 0.01 A 18 ARG CA C 13 58 0.1 A 18 ARG N N 15 114.5 0.1 A 19 THR H H 1 7.40 0.01 A 19 THR HA H 1 4.31 0.01 A 19 THR HB H 1 4.02 0.01 A 19 THR HG21 H 1 0.79 0.01 A 19 THR HG22 H 1 0.79 0.01 A 19 THR HG23 H 1 0.79 0.01 A 19 THR CA C 13 61.8 0.1 A 19 THR CB C 13 71.2 0.1 A 19 THR N N 15 106 0.1 A 20 SER H H 1 8.01 0.01 A 20 SER HA H 1 5.06 0.01 A 20 SER HBx H 1 3.91 0.01 A 20 SER HBy H 1 4.07 0.01 A 20 SER CA C 13 56.1 0.1 A 20 SER CB C 13 63.2 0.1 A 20 SER N N 15 117 0.1 A 21 MET H H 1 9.24 0.01 A 21 MET HA H 1 4.15 0.01 A 21 MET HBx H 1 2.07 0.01 A 21 MET HBy H 1 2.17 0.01 A 21 MET HGx H 1 2.6 0.01 A 21 MET HGy H 1 2.73 0.01 A 21 MET CA C 13 58.7 0.1 A 21 MET CB C 13 32.3 0.1 A 21 MET N N 15 125.4 0.1 A 22 LYS H H 1 8.32 0.01 A 22 LYS HA H 1 4.11 0.01 A 22 LYS HBx H 1 1.60 0.01 A 22 LYS HBy H 1 1.84 0.01 A 22 LYS HDx H 1 1.27 0.01 A 22 LYS HEx H 1 2.77 0.01 A 22 LYS HEy H 1 2.84 0.01 A 22 LYS HGx H 1 1.12 0.01 A 22 LYS CA C 13 59.2 0.1 A 22 LYS N N 15 119.5 0.1 A 23 TYR H H 1 7.65 0.01 A 23 TYR HA H 1 4.04 0.01 A 23 TYR HBx H 1 2.67 0.01 A 23 TYR HBy H 1 3.00 0.01 A 23 TYR HDx H 1 7.37 0.01 A 23 TYR HEx H 1 6.82 0.01 A 23 TYR CA C 13 60.2 0.1 A 23 TYR N N 15 118.9 0.1 A 24 ARG H H 1 8.21 0.01 A 24 ARG HA H 1 4.07 0.01 A 24 ARG HBx H 1 1.78 0.01 A 24 ARG HBy H 1 2.43 0.01 A 24 ARG HDx H 1 3.24 0.01 A 24 ARG HDy H 1 3.36 0.01 A 24 ARG HE H 1 7.32 0.01 A 24 ARG HGx H 1 1.53 0.01 A 24 ARG HGy H 1 1.62 0.01 A 24 ARG CA C 13 60 0.1 A 24 ARG N N 15 117.4 0.1 A 25 LEU H H 1 8.37 0.01 A 25 LEU HA H 1 4.41 0.01 A 25 LEU HBy H 1 1.81 0.01 A 25 LEU HBx H 1 1.54 0.01 A 25 LEU HDx% H 1 0.91 0.01 A 25 LEU HDy% H 1 0.95 0.01 A 25 LEU HG H 1 1.68 0.01 A 25 LEU CA C 13 55.8 0.1 A 25 LEU CB C 13 42.7 0.1 A 25 LEU N N 15 110.6 0.1 A 26 ASN H H 1 7.14 0.01 A 26 ASN HA H 1 5.10 0.01 A 26 ASN HBx H 1 2.95 0.01 A 26 ASN CA C 13 55.1 0.1 A 26 ASN N N 15 113.4 0.1 A 27 LEU H H 1 7.97 0.01 A 27 LEU HA H 1 4.40 0.01 A 27 LEU HBx H 1 1.58 0.01 A 27 LEU HDx% H 1 0.37 0.01 A 27 LEU HDy% H 1 0.76 0.01 A 27 LEU HG H 1 1.46 0.01 A 27 LEU CA C 13 55.1 0.1 A 27 LEU CB C 13 43.5 0.1 A 27 LEU N N 15 117 0.1 A 28 CYS H H 1 8.58 0.01 A 28 CYS HA H 1 5.46 0.01 A 28 CYS HBx H 1 3.00 0.01 A 28 CYS HBy H 1 3.15 0.01 A 28 CYS CA C 13 53.6 0.1 A 28 CYS N N 15 118.6 0.1 A 29 LYS H H 1 8.51 0.01 A 29 LYS HA H 1 3.82 0.01 A 29 LYS HBx H 1 1.52 0.01 A 29 LYS HBy H 1 1.64 0.01 A 29 LYS HDx H 1 1.80 0.01 A 29 LYS HEx H 1 3.10 0.01 A 29 LYS HGx H 1 1.24 0.01 A 29 LYS HGy H 1 1.34 0.01 A 29 LYS CA C 13 60.2 0.1 A 29 LYS N N 15 118.3 0.1 A 30 LYS H H 1 7.33 0.01 A 30 LYS HA H 1 4.15 0.01 A 30 LYS HBx H 1 1.73 0.01 A 30 LYS HBy H 1 1.76 0.01 A 30 LYS HDx H 1 1.62 0.01 A 30 LYS HEx H 1 2.98 0.01 A 30 LYS HGx H 1 1.31 0.01 A 30 LYS CA C 13 58.7 0.1 A 30 LYS N N 15 116.9 0.1 A 31 THR H H 1 10.56 0.01 A 31 THR HA H 1 3.8 0.01 A 31 THR HB H 1 4.00 0.01 A 31 THR HG21 H 1 1.14 0.01 A 31 THR HG22 H 1 1.14 0.01 A 31 THR HG23 H 1 1.14 0.01 A 31 THR CA C 13 68.4 0.1 A 31 THR CB C 13 67.8 0.1 A 31 THR N N 15 123.6 0.1 A 32 CYS H H 1 8.82 0.01 A 32 CYS HA H 1 4.84 0.01 A 32 CYS HBx H 1 2.91 0.01 A 32 CYS HBy H 1 3.31 0.01 A 32 CYS CA C 13 52.7 0.1 A 32 CYS CB C 13 35.5 0.1 A 32 CYS N N 15 113.6 0.1 A 33 GLY H H 1 7.83 0.01 A 33 GLY HAx H 1 4.10 0.01 A 33 GLY CA C 13 46.7 0.1 A 33 GLY N N 15 109.7 0.1 A 34 THR H H 1 8.84 0.01 A 34 THR HA H 1 4.32 0.01 A 34 THR HB H 1 4.48 0.01 A 34 THR HG21 H 1 1.10 0.01 A 34 THR HG22 H 1 1.10 0.01 A 34 THR HG23 H 1 1.10 0.01 A 34 THR CA C 13 62.6 0.1 A 34 THR CB C 13 68.1 0.1 A 34 THR N N 15 113.8 0.1 A 35 CYS H H 1 7.71 0.01 A 35 CYS HA H 1 4.28 0.01 A 35 CYS HBx H 1 3.10 0.01 A 35 CYS HBy H 1 3.28 0.01 A 35 CYS CA C 13 56.2 0.1 A 35 CYS N N 15 122.9 0.1 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 3 CYS HBy A 4 LYS H 1.0 1.80 5.11 2 2 A 4 LYS H A 3 CYS HBx 1.0 1.80 5.14 3 3 A 4 LYS HA A 30 LYS H 1.0 1.80 4.70 4 4 A 4 LYS HA A 31 THR H 1.0 1.80 5.14 5 5 A 4 LYS HA A 5 ASP HBy 1.0 1.80 4.30 6 5 A 4 LYS HA A 5 ASP HBx 1.0 1.80 4.30 7 6 A 4 LYS HA A 5 ASP H 1.0 1.80 2.86 8 7 A 5 ASP H A 4 LYS HBy 1.0 1.80 3.38 9 8 A 5 ASP H A 4 LYS HBx 1.0 1.80 3.53 10 9 A 5 ASP H A 4 LYS HDx 1.0 1.80 3.85 11 9 A 5 ASP H A 4 LYS HDy 1.0 1.80 3.85 12 10 A 5 ASP H A 4 LYS HGx 1.0 1.80 4.80 13 10 A 5 ASP H A 4 LYS HGy 1.0 1.80 4.80 14 11 A 5 ASP HA A 29 LYS H 1.0 1.80 4.04 15 12 A 30 LYS H A 5 ASP HA 1.0 1.80 4.15 16 13 A 31 THR H A 5 ASP HA 1.0 1.80 5.26 17 14 A 5 ASP HA A 6 TYR H 1.0 1.80 3.07 18 15 A 5 ASP HA A 7 LEU H 1.0 1.80 4.46 19 16 A 31 THR H A 5 ASP HBy 1.0 1.80 5.65 20 17 A 6 TYR H A 5 ASP HBy 1.0 1.80 4.24 21 18 A 7 LEU H A 5 ASP HBy 1.0 1.80 4.18 22 19 A 5 ASP HBx A 6 TYR H 1.0 1.80 3.78 23 20 A 5 ASP HBx A 7 LEU H 1.0 1.80 3.90 24 21 A 5 ASP H A 6 TYR H 1.0 1.80 4.22 25 22 A 7 LEU H A 6 TYR HA 1.0 1.80 4.15 26 23 A 6 TYR HBy A 27 LEU HBx 1.0 1.80 3.25 27 23 A 6 TYR HBx A 27 LEU HBx 1.0 1.80 3.25 28 23 A 27 LEU HBy A 6 TYR HBy 1.0 1.80 3.25 29 23 A 6 TYR HBx A 27 LEU HBy 1.0 1.80 3.25 30 24 A 6 TYR HBy A 27 LEU HDx% 1.0 1.80 4.13 31 24 A 6 TYR HBx A 27 LEU HDx% 1.0 1.80 4.13 32 25 A 27 LEU HDy% A 6 TYR HBy 1.0 1.80 3.83 33 25 A 6 TYR HBx A 27 LEU HDy% 1.0 1.80 3.83 34 26 A 6 TYR HBx A 27 LEU HG 1.0 1.80 3.25 35 26 A 27 LEU HG A 6 TYR HBy 1.0 1.80 3.25 36 27 A 7 LEU HG A 6 TYR HBy 1.0 1.80 3.84 37 27 A 6 TYR HBx A 7 LEU HG 1.0 1.80 3.84 38 28 A 27 LEU HA A 6 TYR HBy 1.0 1.76 3.07 39 29 A 27 LEU HA A 6 TYR HBy 1.0 1.80 3.25 40 30 A 7 LEU HDy% A 6 TYR HBy 1.0 1.80 4.67 41 30 A 6 TYR HBy A 7 LEU HDx% 1.0 1.80 4.67 42 31 A 7 LEU HDy% A 6 TYR HBy 1.0 1.80 4.76 43 31 A 6 TYR HBy A 7 LEU HDx% 1.0 1.80 4.76 44 32 A 7 LEU H A 6 TYR HBy 1.0 1.80 4.43 45 33 A 6 TYR HBx A 27 LEU HA 1.0 1.80 3.47 46 34 A 6 TYR HBx A 27 LEU HA 1.0 1.80 3.47 47 35 A 6 TYR HBx A 7 LEU HDy% 1.0 1.80 4.50 48 35 A 6 TYR HBx A 7 LEU HDx% 1.0 1.80 4.50 49 36 A 7 LEU H A 6 TYR HBx 1.0 1.80 4.29 50 37 A 6 TYR HD% A 27 LEU HDy% 1.0 1.80 5.08 51 38 A 7 LEU HDy% A 6 TYR HD% 1.0 1.80 5.99 52 39 A 6 TYR H A 27 LEU HDy% 1.0 1.80 5.27 53 40 A 6 TYR H A 28 CYS HA 1.0 1.80 4.23 54 41 A 6 TYR H A 29 LYS HGx 1.0 1.80 5.71 55 42 A 29 LYS H A 6 TYR H 1.0 1.80 4.47 56 43 A 6 TYR H A 7 LEU H 1.0 1.80 3.15 57 44 A 7 LEU HA A 8 PRO HDy 1.0 1.80 3.25 58 45 A 7 LEU HA A 8 PRO HDx 1.0 1.80 3.25 59 46 A 7 LEU HBy A 11 GLU HBx 1.0 1.80 3.44 60 47 A 7 LEU HBy A 11 GLU H 1.0 1.80 4.76 61 48 A 7 LEU HBy A 8 PRO HDy 1.0 1.80 3.17 62 48 A 7 LEU HBy A 8 PRO HDx 1.0 1.80 3.17 63 49 A 7 LEU HBx A 11 GLU HBx 1.0 1.80 3.51 64 50 A 11 GLU H A 7 LEU HBx 1.0 1.80 4.73 65 51 A 7 LEU HBx A 8 PRO HDy 1.0 1.80 3.17 66 51 A 8 PRO HDx A 7 LEU HBx 1.0 1.80 3.17 67 52 A 7 LEU HDy% A 11 GLU HBy 1.0 1.80 4.12 68 52 A 7 LEU HDx% A 11 GLU HBy 1.0 1.80 4.12 69 53 A 7 LEU HDy% A 11 GLU HBx 1.0 1.80 3.48 70 53 A 11 GLU HBx A 7 LEU HDx% 1.0 1.80 3.48 71 54 A 11 GLU H A 7 LEU HDx% 1.0 1.80 5.59 72 54 A 7 LEU HDy% A 11 GLU H 1.0 1.80 5.59 73 55 A 23 TYR HD% A 7 LEU HDx% 1.0 1.80 5.06 74 55 A 7 LEU HDy% A 23 TYR HD% 1.0 1.80 5.06 75 56 A 23 TYR HE% A 7 LEU HDx% 1.0 1.80 4.18 76 56 A 7 LEU HDy% A 23 TYR HE% 1.0 1.80 4.18 77 57 A 7 LEU HDy% A 27 LEU HDx% 1.0 1.80 3.46 78 57 A 7 LEU HDx% A 27 LEU HDx% 1.0 1.80 3.46 79 58 A 27 LEU H A 7 LEU HDx% 1.0 1.80 5.66 80 58 A 7 LEU HDy% A 27 LEU H 1.0 1.80 5.66 81 59 A 28 CYS H A 7 LEU HDx% 1.0 1.58 5.84 82 59 A 7 LEU HDy% A 28 CYS H 1.0 1.58 5.84 83 60 A 11 GLU HGx A 7 LEU HDx% 1.0 1.80 4.07 84 60 A 7 LEU HDx% A 11 GLU HGy 1.0 1.80 4.07 85 61 A 12 CYS H A 7 LEU HDx% 1.0 1.80 5.94 86 62 A 7 LEU HDx% A 8 PRO HDy 1.0 1.80 4.30 87 63 A 7 LEU HDy% A 11 GLU HGx 1.0 1.80 4.13 88 63 A 7 LEU HDy% A 11 GLU HGy 1.0 1.80 4.13 89 64 A 7 LEU HDy% A 8 PRO HDy 1.0 1.80 3.47 90 65 A 7 LEU HDy% A 8 PRO HDx 1.0 1.80 3.51 91 66 A 7 LEU HG A 8 PRO HDy 1.0 1.80 3.82 92 67 A 7 LEU H A 27 LEU HDy% 1.0 1.80 6.12 93 68 A 8 PRO HA A 10 SER H 1.0 1.80 5.04 94 69 A 11 GLU H A 8 PRO HA 1.0 1.80 4.67 95 70 A 8 PRO HA A 9 LYS HGx 1.0 1.80 3.56 96 70 A 8 PRO HA A 9 LYS HGy 1.0 1.80 3.56 97 71 A 8 PRO HA A 9 LYS H 1.0 1.80 3.07 98 72 A 10 SER H A 8 PRO HBy 1.0 1.80 4.29 99 73 A 9 LYS H A 8 PRO HBy 1.0 1.80 4.25 100 74 A 10 SER H A 8 PRO HBx 1.0 1.80 4.75 101 75 A 11 GLU HBx A 8 PRO HDy 1.0 1.80 3.90 102 76 A 8 PRO HDy A 11 GLU HGy 1.0 1.80 3.59 103 77 A 8 PRO HDx A 11 GLU HBx 1.0 1.80 4.56 104 78 A 8 PRO HDx A 11 GLU HGy 1.0 1.80 3.93 105 79 A 10 SER H A 8 PRO HGx 1.0 1.80 4.77 106 79 A 10 SER H A 8 PRO HGy 1.0 1.80 4.77 107 80 A 9 LYS H A 8 PRO HGx 1.0 1.80 4.16 108 80 A 9 LYS H A 8 PRO HGy 1.0 1.80 4.16 109 81 A 10 SER H A 9 LYS HBy 1.0 1.80 4.10 110 82 A 10 SER H A 9 LYS HBx 1.0 1.80 4.43 111 83 A 10 SER H A 9 LYS H 1.0 1.80 4.11 112 84 A 11 GLU H A 10 SER HA 1.0 1.80 3.90 113 85 A 11 GLU H A 10 SER H 1.0 1.80 3.59 114 86 A 12 CYS H A 11 GLU HA 1.0 1.80 4.23 115 87 A 11 GLU HA A 13 THR HG21 1.0 1.80 4.11 116 88 A 23 TYR HE% A 11 GLU HBy 1.0 1.80 5.08 117 88 A 23 TYR HE% A 11 GLU HBx 1.0 1.80 5.08 118 89 A 12 CYS HBy A 11 GLU HBy 1.0 1.80 3.98 119 89 A 11 GLU HBy A 12 CYS HBx 1.0 1.80 3.98 120 90 A 12 CYS H A 11 GLU HBy 1.0 1.80 4.07 121 91 A 12 CYS H A 11 GLU HBx 1.0 1.80 4.49 122 92 A 12 CYS H A 11 GLU HGy 1.0 1.80 5.02 123 93 A 11 GLU H A 12 CYS H 1.0 1.80 2.97 124 94 A 11 GLU H A 13 THR HG21 1.0 1.80 5.63 125 95 A 12 CYS HA A 13 THR H 1.0 1.80 3.08 126 96 A 23 TYR HD% A 12 CYS HA 1.0 1.80 5.54 127 97 A 13 THR H A 12 CYS HBx 1.0 1.80 4.12 128 97 A 12 CYS HBy A 13 THR H 1.0 1.80 4.12 129 98 A 28 CYS H A 12 CYS HBx 1.0 1.80 4.98 130 98 A 28 CYS H A 12 CYS HBy 1.0 1.80 4.98 131 99 A 31 THR HB A 12 CYS HBx 1.0 1.80 3.25 132 99 A 12 CYS HBy A 31 THR HB 1.0 1.80 3.25 133 100 A 31 THR HG21 A 12 CYS HBx 1.0 1.80 3.06 134 100 A 12 CYS HBy A 31 THR HG21 1.0 1.80 3.06 135 101 A 31 THR H A 12 CYS HBx 1.0 1.80 4.39 136 101 A 31 THR H A 12 CYS HBy 1.0 1.80 4.39 137 102 A 33 GLY H A 12 CYS HBx 1.0 1.80 4.55 138 102 A 12 CYS HBy A 33 GLY H 1.0 1.80 4.55 139 103 A 13 THR HA A 14 GLN H 1.0 1.80 4.02 140 104 A 13 THR HA A 16 ARG H 1.0 1.80 4.84 141 105 A 14 GLN H A 13 THR HB 1.0 1.80 4.59 142 106 A 13 THR HB A 15 PHE HBy 1.0 1.80 3.99 143 107 A 13 THR HB A 15 PHE HBx 1.0 1.80 4.28 144 108 A 13 THR HB A 15 PHE H 1.0 1.80 4.38 145 109 A 16 ARG H A 13 THR HB 1.0 1.80 4.56 146 110 A 13 THR HG21 A 14 GLN H 1.0 1.80 5.84 147 111 A 13 THR H A 16 ARG HBx 1.0 1.80 3.83 148 112 A 13 THR H A 16 ARG HBy 1.0 1.80 4.68 149 113 A 13 THR H A 16 ARG HDy 1.0 1.80 4.94 150 113 A 13 THR H A 16 ARG HDx 1.0 1.80 4.94 151 114 A 13 THR H A 16 ARG HGy 1.0 1.80 4.82 152 114 A 13 THR H A 16 ARG HGx 1.0 1.80 4.82 153 115 A 15 PHE H A 14 GLN HA 1.0 1.80 4.96 154 116 A 14 GLN HA A 17 CYS H 1.0 1.80 4.55 155 117 A 14 GLN HA A 18 ARG H 1.0 1.80 4.65 156 118 A 15 PHE H A 14 GLN HBy 1.0 1.80 5.20 157 119 A 15 PHE H A 14 GLN HBx 1.0 1.80 5.20 158 120 A 31 THR HG21 A 14 GLN HE2x 1.0 1.80 4.94 159 121 A 31 THR HG21 A 14 GLN HE2x 1.0 1.80 4.94 160 122 A 31 THR HG21 A 14 GLN HE2y 1.0 1.80 4.76 161 123 A 31 THR HG21 A 14 GLN HE2y 1.0 1.80 4.76 162 124 A 15 PHE HBy A 16 ARG HGy 1.0 1.80 3.94 163 124 A 15 PHE HBy A 16 ARG HGx 1.0 1.80 3.94 164 125 A 16 ARG H A 15 PHE HBy 1.0 1.80 3.61 165 126 A 15 PHE HBx A 16 ARG HGy 1.0 1.80 4.30 166 126 A 15 PHE HBx A 16 ARG HGx 1.0 1.80 4.30 167 127 A 16 ARG H A 15 PHE HBx 1.0 1.80 4.12 168 128 A 15 PHE HD% A 16 ARG HA 1.0 1.80 5.63 169 129 A 15 PHE HD% A 19 THR HG21 1.0 1.80 5.93 170 130 A 19 THR HG21 A 15 PHE HE% 1.0 1.80 4.69 171 131 A 16 ARG H A 15 PHE H 1.0 1.80 4.13 172 132 A 17 CYS H A 16 ARG HA 1.0 1.80 4.42 173 133 A 18 ARG H A 16 ARG HA 1.0 1.80 5.02 174 134 A 16 ARG HA A 19 THR HG21 1.0 1.80 4.71 175 135 A 16 ARG HA A 19 THR H 1.0 1.80 4.55 176 136 A 16 ARG HA A 20 SER H 1.0 1.80 4.54 177 137 A 16 ARG HA A 24 ARG HE 1.0 1.80 5.08 178 138 A 16 ARG HBx A 17 CYS H 1.0 1.80 3.74 179 139 A 23 TYR HD% A 16 ARG HBy 1.0 1.80 5.39 180 140 A 23 TYR HE% A 16 ARG HBy 1.0 1.80 5.24 181 141 A 23 TYR HE% A 16 ARG HDx 1.0 1.80 5.49 182 142 A 16 ARG HGx A 32 CYS HBy 1.0 1.80 4.30 183 142 A 16 ARG HGy A 32 CYS HBy 1.0 1.80 4.30 184 142 A 32 CYS HBx A 16 ARG HGy 1.0 1.80 4.30 185 142 A 16 ARG HGx A 32 CYS HBx 1.0 1.80 4.30 186 143 A 17 CYS H A 16 ARG HGy 1.0 1.80 4.75 187 144 A 23 TYR HD% A 16 ARG HGy 1.0 1.80 4.99 188 145 A 16 ARG HGx A 17 CYS H 1.0 1.80 4.25 189 146 A 23 TYR HD% A 16 ARG HGx 1.0 1.80 4.99 190 147 A 16 ARG H A 17 CYS H 1.0 1.80 3.90 191 148 A 17 CYS HA A 23 TYR HBy 1.0 1.80 4.26 192 148 A 17 CYS HA A 23 TYR HBx 1.0 1.80 4.26 193 149 A 17 CYS HA A 24 ARG HBy 1.0 1.80 3.48 194 149 A 17 CYS HA A 24 ARG HBx 1.0 1.80 3.48 195 150 A 17 CYS HBx A 25 LEU HDx% 1.0 1.80 4.82 196 150 A 17 CYS HBy A 25 LEU HDx% 1.0 1.80 4.82 197 150 A 25 LEU HDy% A 17 CYS HBy 1.0 1.80 4.82 198 150 A 17 CYS HBx A 25 LEU HDy% 1.0 1.80 4.82 199 151 A 18 ARG H A 17 CYS HBy 1.0 1.80 3.59 200 152 A 17 CYS H A 18 ARG H 1.0 1.80 3.42 201 153 A 19 THR HG21 A 18 ARG HA 1.0 1.80 4.23 202 154 A 19 THR H A 18 ARG HA 1.0 1.80 4.11 203 155 A 19 THR HB A 18 ARG HBx 1.0 1.80 2.60 204 155 A 18 ARG HBy A 19 THR HB 1.0 1.80 2.60 205 156 A 19 THR HG21 A 18 ARG HBx 1.0 1.80 3.45 206 156 A 19 THR HG21 A 18 ARG HBy 1.0 1.80 3.45 207 157 A 19 THR H A 18 ARG HBx 1.0 1.80 3.73 208 157 A 19 THR H A 18 ARG HBy 1.0 1.80 3.73 209 158 A 20 SER H A 18 ARG HBx 1.0 1.80 5.10 210 158 A 20 SER H A 18 ARG HBy 1.0 1.80 5.10 211 159 A 19 THR HG21 A 18 ARG HDx 1.0 1.80 4.50 212 159 A 19 THR HG21 A 18 ARG HDy 1.0 1.80 4.50 213 160 A 18 ARG H A 19 THR H 1.0 1.80 3.42 214 161 A 20 SER H A 19 THR HA 1.0 1.80 4.20 215 162 A 19 THR H A 20 SER H 1.0 1.80 3.32 216 163 A 20 SER HBy A 23 TYR HBy 1.0 1.80 4.33 217 163 A 20 SER HBx A 23 TYR HBy 1.0 1.80 4.33 218 164 A 23 TYR HBx A 20 SER HBx 1.0 1.80 3.67 219 164 A 23 TYR HBx A 20 SER HBy 1.0 1.80 3.67 220 165 A 23 TYR HD% A 20 SER HBy 1.0 1.80 4.70 221 166 A 20 SER HBy A 23 TYR H 1.0 1.80 4.54 222 167 A 21 MET HA A 24 ARG H 1.0 1.80 3.80 223 168 A 21 MET HA A 25 LEU HDx% 1.0 1.80 4.36 224 168 A 25 LEU HDy% A 21 MET HA 1.0 1.80 4.36 225 169 A 21 MET HA A 25 LEU H 1.0 1.80 4.55 226 170 A 21 MET HBx A 25 LEU HDx% 1.0 1.80 3.90 227 170 A 21 MET HBy A 25 LEU HDx% 1.0 1.80 3.90 228 170 A 25 LEU HDy% A 21 MET HBx 1.0 1.80 3.90 229 170 A 25 LEU HDy% A 21 MET HBy 1.0 1.80 3.90 230 171 A 21 MET HGy A 25 LEU HDx% 1.0 1.80 4.01 231 171 A 25 LEU HDy% A 21 MET HGy 1.0 1.80 4.01 232 172 A 21 MET HGx A 25 LEU HDx% 1.0 1.80 4.03 233 172 A 25 LEU HDy% A 21 MET HGx 1.0 1.80 4.03 234 173 A 22 LYS HA A 26 ASN H 1.0 1.80 4.55 235 174 A 23 TYR H A 22 LYS HBy 1.0 1.80 3.80 236 175 A 23 TYR H A 22 LYS HBx 1.0 1.80 4.37 237 176 A 22 LYS HDy A 27 LEU HDx% 1.0 1.80 4.21 238 176 A 22 LYS HDx A 27 LEU HDx% 1.0 1.80 4.21 239 176 A 27 LEU HDy% A 22 LYS HDx 1.0 1.80 4.21 240 176 A 22 LYS HDy A 27 LEU HDy% 1.0 1.80 4.21 241 177 A 27 LEU H A 22 LYS HDx 1.0 1.80 5.30 242 177 A 27 LEU H A 22 LYS HDy 1.0 1.80 5.30 243 178 A 22 LYS HEy A 27 LEU HDx% 1.0 1.80 4.75 244 179 A 22 LYS HEx A 27 LEU HDx% 1.0 1.80 4.75 245 180 A 22 LYS HGx A 27 LEU HDx% 1.0 1.80 4.12 246 180 A 22 LYS HGy A 27 LEU HDx% 1.0 1.80 4.12 247 180 A 27 LEU HDy% A 22 LYS HGx 1.0 1.80 4.12 248 180 A 27 LEU HDy% A 22 LYS HGy 1.0 1.80 4.12 249 181 A 27 LEU H A 22 LYS HGx 1.0 1.80 5.34 250 181 A 27 LEU H A 22 LYS HGy 1.0 1.80 5.34 251 182 A 23 TYR HA A 27 LEU HDx% 1.0 1.80 3.80 252 182 A 27 LEU HDy% A 23 TYR HA 1.0 1.80 3.80 253 183 A 24 ARG H A 23 TYR HBy 1.0 1.80 4.00 254 184 A 23 TYR HBx A 24 ARG H 1.0 1.80 3.90 255 185 A 23 TYR HD% A 24 ARG H 1.0 1.80 4.21 256 186 A 23 TYR HD% A 27 LEU HDx% 1.0 1.80 5.38 257 187 A 23 TYR HE% A 27 LEU HDx% 1.0 1.80 5.14 258 188 A 23 TYR H A 24 ARG H 1.0 1.80 3.90 259 189 A 23 TYR H A 27 LEU HDx% 1.0 1.80 5.62 260 189 A 23 TYR H A 27 LEU HDy% 1.0 1.80 5.62 261 190 A 25 LEU H A 24 ARG HA 1.0 1.80 4.33 262 191 A 24 ARG HA A 32 CYS HBy 1.0 1.80 3.25 263 192 A 32 CYS HBx A 24 ARG HA 1.0 1.80 3.25 264 193 A 24 ARG HBx A 25 LEU H 1.0 1.80 4.15 265 194 A 24 ARG HDy A 25 LEU HDx% 1.0 1.80 4.33 266 195 A 25 LEU HDy% A 24 ARG HDy 1.0 1.80 4.26 267 196 A 24 ARG HDx A 25 LEU HDx% 1.0 1.80 4.41 268 197 A 25 LEU HDy% A 24 ARG HDx 1.0 1.80 4.47 269 198 A 25 LEU H A 24 ARG HDx 1.0 1.80 5.29 270 199 A 34 THR HG21 A 24 ARG HGx 1.0 1.80 4.67 271 199 A 24 ARG HGy A 34 THR HG21 1.0 1.80 4.67 272 200 A 24 ARG H A 25 LEU H 1.0 1.80 3.38 273 201 A 26 ASN H A 25 LEU HA 1.0 1.80 4.29 274 202 A 25 LEU HA A 29 LYS HGy 1.0 1.80 3.80 275 202 A 25 LEU HA A 29 LYS HGx 1.0 1.80 3.80 276 203 A 25 LEU HBy A 26 ASN HBx 1.0 1.80 3.50 277 203 A 25 LEU HBx A 26 ASN HBx 1.0 1.80 3.50 278 203 A 26 ASN HBy A 25 LEU HBy 1.0 1.80 3.50 279 203 A 25 LEU HBx A 26 ASN HBy 1.0 1.80 3.50 280 204 A 26 ASN H A 25 LEU HBx 1.0 1.80 4.04 281 205 A 26 ASN H A 25 LEU HBy 1.0 1.80 4.50 282 206 A 25 LEU HDx% A 29 LYS HEx 1.0 1.80 4.97 283 206 A 25 LEU HDy% A 29 LYS HEx 1.0 1.80 4.97 284 206 A 29 LYS HEy A 25 LEU HDx% 1.0 1.80 4.97 285 206 A 25 LEU HDy% A 29 LYS HEy 1.0 1.80 4.97 286 207 A 25 LEU HDy% A 32 CYS HBy 1.0 1.80 5.33 287 207 A 25 LEU HDx% A 32 CYS HBy 1.0 1.80 5.33 288 207 A 32 CYS HBx A 25 LEU HDx% 1.0 1.80 5.33 289 207 A 32 CYS HBx A 25 LEU HDy% 1.0 1.80 5.33 290 208 A 34 THR HB A 25 LEU HDx% 1.0 1.80 3.90 291 208 A 25 LEU HDy% A 34 THR HB 1.0 1.80 3.90 292 209 A 26 ASN H A 25 LEU HG 1.0 1.80 4.97 293 210 A 25 LEU H A 26 ASN H 1.0 1.80 3.28 294 211 A 27 LEU H A 26 ASN HA 1.0 1.80 4.46 295 212 A 27 LEU H A 26 ASN HBx 1.0 1.80 3.11 296 212 A 27 LEU H A 26 ASN HBy 1.0 1.80 3.11 297 213 A 27 LEU H A 26 ASN H 1.0 1.80 3.26 298 214 A 27 LEU HA A 28 CYS H 1.0 1.80 4.26 299 215 A 28 CYS H A 27 LEU HDx% 1.0 1.80 5.71 300 216 A 28 CYS H A 27 LEU HDy% 1.0 1.80 5.77 301 217 A 28 CYS H A 27 LEU HG 1.0 1.80 4.63 302 218 A 27 LEU H A 28 CYS H 1.0 1.80 3.90 303 219 A 29 LYS H A 28 CYS HA 1.0 1.80 3.76 304 220 A 30 LYS H A 28 CYS HA 1.0 1.80 4.58 305 221 A 31 THR H A 28 CYS HA 1.0 1.80 4.94 306 222 A 31 THR HB A 28 CYS HBy 1.0 1.80 3.64 307 223 A 31 THR HG21 A 28 CYS HBy 1.0 1.80 4.20 308 224 A 31 THR H A 28 CYS HBy 1.0 1.80 4.90 309 225 A 28 CYS HBy A 32 CYS H 1.0 1.80 4.60 310 226 A 29 LYS H A 28 CYS HBx 1.0 1.80 4.80 311 227 A 30 LYS H A 28 CYS HBx 1.0 1.80 4.89 312 228 A 31 THR HB A 28 CYS HBx 1.0 1.80 3.64 313 229 A 31 THR HG21 A 28 CYS HBx 1.0 1.80 4.17 314 230 A 31 THR H A 28 CYS HBx 1.0 1.80 4.36 315 231 A 32 CYS H A 28 CYS HBx 1.0 1.80 4.28 316 232 A 30 LYS H A 29 LYS HA 1.0 1.80 4.46 317 233 A 35 CYS HA A 29 LYS HBx 1.0 1.80 3.68 318 233 A 29 LYS HBy A 35 CYS HA 1.0 1.80 3.68 319 234 A 34 THR H A 29 LYS HGy 1.0 1.80 5.25 320 234 A 29 LYS HGx A 34 THR H 1.0 1.80 5.25 321 235 A 30 LYS H A 29 LYS H 1.0 1.80 3.65 322 236 A 31 THR H A 29 LYS H 1.0 1.80 5.01 323 237 A 29 LYS H A 32 CYS H 1.0 1.80 4.49 324 238 A 31 THR H A 30 LYS HA 1.0 1.80 4.19 325 239 A 31 THR H A 30 LYS HBx 1.0 1.80 3.31 326 239 A 31 THR H A 30 LYS HBy 1.0 1.80 3.31 327 240 A 32 CYS H A 30 LYS HBx 1.0 1.80 5.11 328 240 A 32 CYS H A 30 LYS HBy 1.0 1.80 5.11 329 241 A 31 THR H A 30 LYS HDx 1.0 1.80 4.99 330 241 A 31 THR H A 30 LYS HDy 1.0 1.80 4.99 331 242 A 33 GLY H A 30 LYS HDx 1.0 1.80 5.34 332 242 A 33 GLY H A 30 LYS HDy 1.0 1.80 5.34 333 243 A 34 THR H A 30 LYS HDx 1.0 1.80 4.52 334 243 A 34 THR H A 30 LYS HDy 1.0 1.80 4.52 335 244 A 31 THR H A 30 LYS HGx 1.0 1.80 3.58 336 244 A 31 THR H A 30 LYS HGy 1.0 1.80 3.58 337 245 A 32 CYS H A 30 LYS HGx 1.0 1.80 5.13 338 245 A 32 CYS H A 30 LYS HGy 1.0 1.80 5.13 339 246 A 33 GLY H A 30 LYS HGx 1.0 1.80 5.12 340 246 A 33 GLY H A 30 LYS HGy 1.0 1.80 5.12 341 247 A 35 CYS H A 30 LYS HGx 1.0 1.80 5.30 342 247 A 30 LYS HGy A 35 CYS H 1.0 1.80 5.30 343 248 A 30 LYS H A 31 THR H 1.0 1.80 3.13 344 249 A 30 LYS H A 32 CYS H 1.0 1.80 4.37 345 250 A 31 THR HB A 32 CYS H 1.0 1.80 3.48 346 251 A 31 THR HG21 A 32 CYS H 1.0 1.80 4.36 347 252 A 31 THR H A 32 CYS H 1.0 1.80 3.47 348 253 A 31 THR H A 33 GLY H 1.0 1.80 4.99 349 254 A 33 GLY H A 32 CYS HA 1.0 1.80 4.19 350 255 A 34 THR HG21 A 32 CYS HBy 1.0 1.80 4.24 351 256 A 33 GLY H A 32 CYS HBx 1.0 1.80 4.80 352 257 A 32 CYS HBx A 34 THR HG21 1.0 1.80 4.03 353 258 A 34 THR H A 33 GLY HAx 1.0 1.80 3.50 354 258 A 34 THR H A 33 GLY HAy 1.0 1.80 3.50 355 259 A 33 GLY H A 34 THR H 1.0 1.80 3.16 356 260 A 35 CYS H A 34 THR HA 1.0 1.80 3.73 357 261 A 34 THR HB A 35 CYS H 1.0 1.80 4.02 358 262 A 34 THR HG21 A 35 CYS HBy 1.0 1.80 4.50 359 263 A 34 THR HG21 A 35 CYS H 1.0 1.80 5.02 360 264 A 34 THR H A 35 CYS H 1.0 1.80 3.12 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 3 CYS C A 4 LYS N A 4 LYS CA A 4 LYS C 1.0 -150.0 -50.0 PHI 2 2 A 4 LYS C A 5 ASP N A 5 ASP CA A 5 ASP C 1.0 -147.0 -67.0 PHI 3 3 A 7 LEU C A 8 PRO N A 8 PRO CA A 8 PRO C 1.0 -83.0 -43.0 PHI 4 4 A 8 PRO C A 9 LYS N A 9 LYS CA A 9 LYS C 1.0 -74.0 -34.0 PHI 5 5 A 9 LYS C A 10 SER N A 10 SER CA A 10 SER C 1.0 -85.0 -45.0 PHI 6 6 A 10 SER C A 11 GLU N A 11 GLU CA A 11 GLU C 1.0 -99.0 -59.0 PHI 7 7 A 11 GLU C A 12 CYS N A 12 CYS CA A 12 CYS C 1.0 -105.0 -65.0 PHI 8 8 A 12 CYS C A 13 THR N A 13 THR CA A 13 THR C 1.0 -136.0 -76.0 PHI 9 9 A 13 THR C A 14 GLN N A 14 GLN CA A 14 GLN C 1.0 -83.0 -43.0 PHI 10 10 A 14 GLN C A 15 PHE N A 15 PHE CA A 15 PHE C 1.0 -85.0 -45.0 PHI 11 11 A 15 PHE C A 16 ARG N A 16 ARG CA A 16 ARG C 1.0 -83.0 -43.0 PHI 12 12 A 16 ARG C A 17 CYS N A 17 CYS CA A 17 CYS C 1.0 -90.0 -50.0 PHI 13 13 A 17 CYS C A 18 ARG N A 18 ARG CA A 18 ARG C 1.0 -85.0 -45.0 PHI 14 14 A 18 ARG C A 19 THR N A 19 THR CA A 19 THR C 1.0 -110.0 -70.0 PHI 15 15 A 19 THR C A 20 SER N A 20 SER CA A 20 SER C 1.0 -130.0 -70.0 PHI 16 16 A 20 SER C A 21 MET N A 21 MET CA A 21 MET C 1.0 -79.0 -39.0 PHI 17 17 A 21 MET C A 22 LYS N A 22 LYS CA A 22 LYS C 1.0 -83.0 -43.0 PHI 18 18 A 22 LYS C A 23 TYR N A 23 TYR CA A 23 TYR C 1.0 -85.0 -45.0 PHI 19 19 A 23 TYR C A 24 ARG N A 24 ARG CA A 24 ARG C 1.0 -80.0 -40.0 PHI 20 20 A 24 ARG C A 25 LEU N A 25 LEU CA A 25 LEU C 1.0 -90.0 -50.0 PHI 21 21 A 25 LEU C A 26 ASN N A 26 ASN CA A 26 ASN C 1.0 -105.0 -65.0 PHI 22 22 A 27 LEU C A 28 CYS N A 28 CYS CA A 28 CYS C 1.0 -135.0 -65.0 PHI 23 23 A 28 CYS C A 29 LYS N A 29 LYS CA A 29 LYS C 1.0 -78.0 -38.0 PHI 24 24 A 29 LYS C A 30 LYS N A 30 LYS CA A 30 LYS C 1.0 -85.0 -45.0 PHI 25 25 A 30 LYS C A 31 THR N A 31 THR CA A 31 THR C 1.0 -82.0 -42.0 PHI 26 26 A 31 THR C A 32 CYS N A 32 CYS CA A 32 CYS C 1.0 -105.0 -65.0 PHI 27 27 A 32 CYS C A 33 GLY N A 33 GLY CA A 33 GLY C 1.0 30.0 90.0 PHI 28 28 A 4 LYS N A 4 LYS CA A 4 LYS C A 5 ASP N 1.0 92.0 192.0 PSI 29 29 A 5 ASP N A 5 ASP CA A 5 ASP C A 6 TYR N 1.0 110.0 170.0 PSI 30 30 A 8 PRO N A 8 PRO CA A 8 PRO C A 9 LYS N 1.0 125.0 165.0 PSI 31 31 A 9 LYS N A 9 LYS CA A 9 LYS C A 10 SER N 1.0 -55.0 -15.0 PSI 32 32 A 10 SER N A 10 SER CA A 10 SER C A 11 GLU N 1.0 -54.0 6.0 PSI 33 33 A 11 GLU N A 11 GLU CA A 11 GLU C A 12 CYS N 1.0 -38.0 2.0 PSI 34 34 A 12 CYS N A 12 CYS CA A 12 CYS C A 13 THR N 1.0 100.0 200.0 PSI 35 35 A 13 THR N A 13 THR CA A 13 THR C A 14 GLN N 1.0 140.0 180.0 PSI 36 36 A 14 GLN N A 14 GLN CA A 14 GLN C A 15 PHE N 1.0 -56.0 -16.0 PSI 37 37 A 15 PHE N A 15 PHE CA A 15 PHE C A 16 ARG N 1.0 -61.0 -21.0 PSI 38 38 A 16 ARG N A 16 ARG CA A 16 ARG C A 17 CYS N 1.0 -64.0 -24.0 PSI 39 39 A 17 CYS N A 17 CYS CA A 17 CYS C A 18 ARG N 1.0 -35.0 5.0 PSI 40 40 A 18 ARG N A 18 ARG CA A 18 ARG C A 19 THR N 1.0 -50.0 -10.0 PSI 41 41 A 19 THR N A 19 THR CA A 19 THR C A 20 SER N 1.0 -31.0 29.0 PSI 42 42 A 20 SER N A 20 SER CA A 20 SER C A 21 MET N 1.0 77.0 137.0 PSI 43 43 A 21 MET N A 21 MET CA A 21 MET C A 22 LYS N 1.0 -50.0 -10.0 PSI 44 44 A 22 LYS N A 22 LYS CA A 22 LYS C A 23 TYR N 1.0 -60.0 -20.0 PSI 45 45 A 23 TYR N A 23 TYR CA A 23 TYR C A 24 ARG N 1.0 -64.0 -24.0 PSI 46 46 A 24 ARG N A 24 ARG CA A 24 ARG C A 25 LEU N 1.0 -60.0 -20.0 PSI 47 47 A 25 LEU N A 25 LEU CA A 25 LEU C A 26 ASN N 1.0 -60.0 0.0 PSI 48 48 A 26 ASN N A 26 ASN CA A 26 ASN C A 27 LEU N 1.0 -45.0 15.0 PSI 49 49 A 28 CYS N A 28 CYS CA A 28 CYS C A 29 LYS N 1.0 130.0 210.0 PSI 50 50 A 29 LYS N A 29 LYS CA A 29 LYS C A 30 LYS N 1.0 -60.0 -20.0 PSI 51 51 A 30 LYS N A 30 LYS CA A 30 LYS C A 31 THR N 1.0 -60.0 -20.0 PSI 52 52 A 31 THR N A 31 THR CA A 31 THR C A 32 CYS N 1.0 -54.0 -14.0 PSI 53 53 A 32 CYS N A 32 CYS CA A 32 CYS C A 33 GLY N 1.0 -15.0 25.0 PSI 54 54 A 33 GLY N A 33 GLY CA A 33 GLY C A 34 THR N 1.0 7.0 67.0 PSI 55 55 A 5 ASP C A 6 TYR N A 6 TYR CA A 6 TYR C 1.0 -126.0 -66.0 PHI 56 56 A 6 TYR N A 6 TYR CA A 6 TYR C A 7 LEU N 1.0 -52.0 8.0 PSI 57 57 A 6 TYR C A 7 LEU N A 7 LEU CA A 7 LEU C 1.0 -160.0 -100.0 PHI 58 58 A 7 LEU N A 7 LEU CA A 7 LEU C A 8 PRO N 1.0 110.0 190.0 PSI 59 59 A 4 LYS N A 4 LYS CA A 4 LYS CB A 4 LYS CG 1.0 -100.0 -20.0 CHI1 60 60 A 5 ASP N A 5 ASP CA A 5 ASP CB A 5 ASP CG 1.0 -100.0 -20.0 CHI1 61 61 A 9 LYS N A 9 LYS CA A 9 LYS CB A 9 LYS CG 1.0 -100.0 -20.0 CHI1 62 62 A 15 PHE N A 15 PHE CA A 15 PHE CB A 15 PHE CG 1.0 -100.0 -20.0 CHI1 63 63 A 21 MET N A 21 MET CA A 21 MET CB A 21 MET CG 1.0 -100.0 -20.0 CHI1 64 64 A 23 TYR N A 23 TYR CA A 23 TYR CB A 23 TYR CG 1.0 -100.0 -20.0 CHI1 65 65 A 24 ARG N A 24 ARG CA A 24 ARG CB A 24 ARG CG 1.0 -100.0 -20.0 CHI1 stop_ save_