data_nef_c15499_2jvx 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 15500 PDB 2jvx PDB 2jvy 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 6 CYS SG 2 1 ZN ZN 1 9 CYS SG 2 1 ZN ZN 1 22 HIS NE2 2 1 ZN ZN 1 26 CYS SG 2 1 ZN ZN 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 SER start . . 2 A 2 SER middle . . 3 A 3 ASP middle . . 4 A 4 PHE middle . . 5 A 5 CYS middle . . 6 A 6 CYS middle -HG . 7 A 7 PRO middle . false 8 A 8 LYS middle . . 9 A 9 CYS middle -HG . 10 A 10 GLN middle . . 11 A 11 TYR middle . . 12 A 12 GLN middle . . 13 A 13 ALA middle . . 14 A 14 PRO middle . false 15 A 15 ASP middle . . 16 A 16 MET middle . . 17 A 17 ASP middle . . 18 A 18 THR middle . . 19 A 19 LEU middle . . 20 A 20 GLN middle . . 21 A 21 ILE middle . . 22 A 22 HIS middle -HE2 . 23 A 23 VAL middle . . 24 A 24 MET middle . . 25 A 25 GLU middle . . 26 A 26 CYS middle -HG . 27 A 27 ILE middle . . 28 A 28 GLU end . . 29 B 1 ZN . . . 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 SER H1 H 1 8.130 0.005 A 1 SER HA H 1 4.397 0.005 A 1 SER HBx H 1 3.718 0.005 A 1 SER HBy H 1 3.791 0.005 A 2 SER H H 1 8.370 0.005 A 2 SER HA H 1 4.300 0.005 A 2 SER HBx H 1 3.627 0.005 A 2 SER HBy H 1 3.762 0.005 A 3 ASP H H 1 7.946 0.005 A 3 ASP HA H 1 4.264 0.005 A 3 ASP HBx H 1 1.958 0.005 A 3 ASP HBy H 1 2.134 0.005 A 4 PHE H H 1 8.167 0.005 A 4 PHE HA H 1 4.643 0.005 A 4 PHE HBx H 1 2.967 0.005 A 4 PHE HBy H 1 2.967 0.005 A 4 PHE HDx H 1 6.980 0.005 A 4 PHE HDy H 1 6.980 0.005 A 4 PHE HEx H 1 7.263 0.005 A 4 PHE HEy H 1 7.263 0.005 A 5 CYS H H 1 7.840 0.005 A 5 CYS HA H 1 5.148 0.005 A 5 CYS HBx H 1 2.563 0.005 A 5 CYS HBy H 1 2.616 0.005 A 6 CYS H H 1 9.209 0.005 A 6 CYS HA H 1 4.512 0.005 A 6 CYS HBx H 1 2.717 0.005 A 6 CYS HBy H 1 3.270 0.005 A 7 PRO HA H 1 4.478 0.005 A 7 PRO HBx H 1 2.112 0.005 A 7 PRO HBy H 1 2.363 0.005 A 7 PRO HDx H 1 4.070 0.005 A 7 PRO HDy H 1 4.209 0.005 A 7 PRO HGx H 1 2.008 0.005 A 7 PRO HGy H 1 2.008 0.005 A 8 LYS H H 1 9.230 0.005 A 8 LYS HA H 1 4.344 0.005 A 8 LYS HBx H 1 1.899 0.005 A 8 LYS HBy H 1 1.977 0.005 A 8 LYS HDx H 1 1.635 0.005 A 8 LYS HDy H 1 1.820 0.005 A 8 LYS HEx H 1 2.921 0.005 A 8 LYS HEy H 1 3.015 0.005 A 8 LYS HGx H 1 1.249 0.005 A 8 LYS HGy H 1 1.357 0.005 A 9 CYS H H 1 8.263 0.005 A 9 CYS HA H 1 5.016 0.005 A 9 CYS HBx H 1 2.387 0.005 A 9 CYS HBy H 1 3.285 0.005 A 10 GLN H H 1 7.988 0.005 A 10 GLN HA H 1 4.091 0.005 A 10 GLN HBx H 1 2.235 0.005 A 10 GLN HBy H 1 2.366 0.005 A 11 TYR H H 1 8.798 0.005 A 11 TYR HA H 1 4.155 0.005 A 11 TYR HBx H 1 1.923 0.005 A 11 TYR HBy H 1 3.089 0.005 A 11 TYR HDx H 1 6.345 0.005 A 11 TYR HDy H 1 6.345 0.005 A 11 TYR HEx H 1 6.444 0.005 A 11 TYR HEy H 1 6.444 0.005 A 12 GLN H H 1 7.633 0.005 A 12 GLN HA H 1 4.378 0.005 A 12 GLN HBx H 1 1.641 0.005 A 12 GLN HBy H 1 1.718 0.005 A 12 GLN HGx H 1 2.127 0.005 A 12 GLN HGy H 1 2.207 0.005 A 13 ALA H H 1 8.275 0.005 A 13 ALA HA H 1 4.338 0.005 A 13 ALA HB% H 1 1.442 0.005 A 14 PRO HA H 1 4.420 0.005 A 14 PRO HBx H 1 2.087 0.005 A 14 PRO HBy H 1 2.239 0.005 A 14 PRO HDx H 1 3.636 0.005 A 14 PRO HDy H 1 3.724 0.005 A 14 PRO HGx H 1 1.963 0.005 A 14 PRO HGy H 1 1.963 0.005 A 15 ASP H H 1 6.948 0.005 A 15 ASP HA H 1 3.673 0.005 A 15 ASP HBx H 1 2.732 0.005 A 15 ASP HBy H 1 2.732 0.005 A 16 MET H H 1 8.139 0.005 A 16 MET HA H 1 3.906 0.005 A 16 MET HBx H 1 1.912 0.005 A 16 MET HBy H 1 1.912 0.005 A 16 MET HE% H 1 2.117 0.005 A 16 MET HGx H 1 2.532 0.005 A 16 MET HGy H 1 2.532 0.005 A 17 ASP H H 1 8.227 0.005 A 17 ASP HA H 1 4.271 0.005 A 17 ASP HBx H 1 2.534 0.005 A 17 ASP HBy H 1 2.534 0.005 A 18 THR H H 1 8.645 0.005 A 18 THR HA H 1 3.913 0.005 A 18 THR HB H 1 3.944 0.005 A 18 THR HG2% H 1 1.403 0.005 A 19 LEU H H 1 7.795 0.005 A 19 LEU HA H 1 4.100 0.005 A 19 LEU HBx H 1 1.443 0.005 A 19 LEU HBy H 1 2.239 0.005 A 19 LEU HD11 H 1 0.874 0.005 A 19 LEU HD12 H 1 0.874 0.005 A 19 LEU HD13 H 1 0.874 0.005 A 19 LEU HD21 H 1 0.978 0.005 A 19 LEU HD22 H 1 0.978 0.005 A 19 LEU HD23 H 1 0.978 0.005 A 19 LEU HG H 1 1.715 0.005 A 20 GLN H H 1 8.305 0.005 A 20 GLN HA H 1 4.020 0.005 A 20 GLN HBx H 1 2.138 0.005 A 20 GLN HBy H 1 2.209 0.005 A 20 GLN HGx H 1 2.494 0.005 A 20 GLN HGy H 1 2.494 0.005 A 21 ILE H H 1 7.342 0.005 A 21 ILE HA H 1 3.754 0.005 A 21 ILE HB H 1 1.890 0.005 A 21 ILE HD1% H 1 0.817 0.005 A 21 ILE HG12 H 1 1.194 0.005 A 21 ILE HG13 H 1 1.688 0.005 A 21 ILE HG21 H 1 0.899 0.005 A 21 ILE HG22 H 1 0.899 0.005 A 21 ILE HG23 H 1 0.899 0.005 A 22 HIS H H 1 7.905 0.005 A 22 HIS HA H 1 4.094 0.005 A 22 HIS HBx H 1 3.072 0.005 A 22 HIS HBy H 1 3.635 0.005 A 22 HIS HD2 H 1 6.963 0.005 A 22 HIS HE1 H 1 7.538 0.005 A 23 VAL H H 1 9.191 0.005 A 23 VAL HA H 1 3.627 0.005 A 23 VAL HB H 1 2.247 0.005 A 23 VAL HG11 H 1 1.174 0.005 A 23 VAL HG12 H 1 1.174 0.005 A 23 VAL HG13 H 1 1.174 0.005 A 23 VAL HG21 H 1 1.348 0.005 A 23 VAL HG22 H 1 1.348 0.005 A 23 VAL HG23 H 1 1.348 0.005 A 24 MET H H 1 7.399 0.005 A 24 MET HA H 1 4.155 0.005 A 24 MET HBx H 1 2.142 0.005 A 24 MET HBy H 1 2.142 0.005 A 24 MET HGx H 1 2.622 0.005 A 24 MET HGy H 1 2.743 0.005 A 25 GLU H H 1 7.023 0.005 A 25 GLU HA H 1 4.263 0.005 A 25 GLU HBx H 1 1.836 0.005 A 25 GLU HBy H 1 1.936 0.005 A 25 GLU HGx H 1 2.112 0.005 A 25 GLU HGy H 1 2.182 0.005 A 26 CYS H H 1 7.757 0.005 A 26 CYS HA H 1 3.783 0.005 A 26 CYS HBx H 1 2.026 0.005 A 26 CYS HBy H 1 2.512 0.005 A 27 ILE H H 1 8.239 0.005 A 27 ILE HA H 1 4.142 0.005 A 27 ILE HB H 1 1.975 0.005 A 27 ILE HD1% H 1 0.863 0.005 A 27 ILE HG12 H 1 1.133 0.005 A 27 ILE HG13 H 1 1.455 0.005 A 27 ILE HG21 H 1 0.863 0.005 A 27 ILE HG22 H 1 0.863 0.005 A 27 ILE HG23 H 1 0.863 0.005 A 28 GLU H H 1 7.868 0.005 A 28 GLU HA H 1 4.143 0.005 A 28 GLU HBx H 1 1.902 0.005 A 28 GLU HBy H 1 2.056 0.005 A 28 GLU HGx H 1 2.244 0.005 A 28 GLU HGy H 1 2.244 0.005 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 9 CYS HBx A 9 CYS HA 1.0 1.70 3.30 2 2 A 9 CYS HA A 9 CYS HBy 1.0 1.70 3.50 3 3 A 6 CYS H A 5 CYS HA 1.0 1.80 3.60 4 4 A 6 CYS H A 6 CYS HA 1.0 2.00 4.60 5 5 A 8 LYS H A 8 LYS HA 1.0 1.80 4.00 6 6 A 8 LYS H A 7 PRO HDx 1.0 1.90 3.90 7 7 A 23 VAL H A 20 GLN HA 1.0 2.00 5.00 8 8 A 6 CYS H A 6 CYS HBx 1.0 1.90 4.30 9 9 A 23 VAL H A 22 HIS HBy 1.0 1.90 3.90 10 10 A 6 CYS H A 6 CYS HBy 1.0 1.90 4.10 11 11 A 6 CYS H A 5 CYS HBx 1.0 2.00 6.00 12 12 A 23 VAL H A 23 VAL HB 1.0 1.70 3.30 13 13 A 8 LYS H A 8 LYS HBx 1.0 1.70 3.30 14 14 A 8 LYS H A 8 LYS HBy 1.0 1.80 3.80 15 15 A 23 VAL H A 23 VAL HG21 1.0 1.60 3.00 16 16 A 23 VAL H A 23 VAL HG11 1.0 2.00 5.00 17 17 A 23 VAL H A 19 LEU HD11 1.0 1.90 5.10 18 18 A 18 THR H A 18 THR HB 1.0 1.80 3.60 19 19 A 18 THR H A 18 THR HA 1.0 1.70 3.50 20 20 A 18 THR H A 17 ASP HBx 1.0 1.70 3.30 21 21 A 18 THR H A 18 THR HG2% 1.0 2.00 4.80 22 22 A 18 THR H A 17 ASP HA 1.0 1.90 6.00 23 23 A 20 GLN HA A 20 GLN H 1.0 1.80 3.80 24 24 A 20 GLN H A 20 GLN HBy 1.0 1.90 3.90 25 25 A 27 ILE H A 27 ILE HA 1.0 2.00 4.60 26 26 A 27 ILE H A 27 ILE HD1% 1.0 2.00 5.80 27 26 A 27 ILE H A 27 ILE HG21 1.0 2.00 5.80 28 27 A 27 ILE H A 27 ILE HG13 1.0 1.70 3.50 29 28 A 17 ASP H A 17 ASP HBy 1.0 1.70 3.10 30 28 A 17 ASP HBx A 17 ASP H 1.0 1.70 3.10 31 29 A 4 PHE H A 4 PHE HBx 1.0 1.90 4.90 32 29 A 4 PHE H A 4 PHE HBy 1.0 1.90 4.90 33 30 A 22 HIS H A 22 HIS HBx 1.0 1.80 3.80 34 31 A 22 HIS H A 21 ILE HA 1.0 2.00 5.80 35 32 A 22 HIS H A 21 ILE HB 1.0 1.80 3.80 36 33 A 22 HIS HBy A 22 HIS H 1.0 1.80 3.40 37 34 A 20 GLN H A 20 GLN HGy 1.0 1.90 4.50 38 34 A 20 GLN H A 20 GLN HGx 1.0 1.90 4.50 39 35 A 13 ALA H A 13 ALA HB% 1.0 1.90 4.30 40 36 A 8 LYS HBy A 9 CYS H 1.0 1.90 4.50 41 37 A 8 LYS HBx A 9 CYS H 1.0 1.90 4.50 42 38 A 19 LEU HD11 A 19 LEU H 1.0 1.90 6.00 43 39 A 19 LEU H A 19 LEU HD21 1.0 1.90 6.00 44 40 A 19 LEU H A 19 LEU HG 1.0 2.00 6.00 45 41 A 26 CYS H A 26 CYS HBy 1.0 1.70 3.50 46 42 A 19 LEU H A 19 LEU HBx 1.0 1.70 3.10 47 43 A 26 CYS H A 26 CYS HBx 1.0 1.80 3.60 48 44 A 5 CYS HBx A 5 CYS H 1.0 2.00 5.00 49 45 A 28 GLU H A 28 GLU HGy 1.0 1.90 6.00 50 45 A 28 GLU H A 28 GLU HGx 1.0 1.90 6.00 51 46 A 28 GLU H A 28 GLU HBx 1.0 1.90 4.30 52 47 A 28 GLU H A 28 GLU HBy 1.0 1.90 4.50 53 48 A 26 CYS H A 26 CYS HA 1.0 1.90 4.10 54 49 A 19 LEU H A 19 LEU HA 1.0 1.80 3.80 55 50 A 22 HIS H A 22 HIS HA 1.0 1.80 4.20 56 51 A 5 CYS HA A 5 CYS H 1.0 2.00 5.80 57 52 A 12 GLN H A 12 GLN HA 1.0 2.00 5.60 58 53 A 12 GLN H A 12 GLN HBy 1.0 1.90 4.30 59 54 A 12 GLN H A 12 GLN HBx 1.0 1.80 3.60 60 55 A 12 GLN H A 12 GLN HGx 1.0 2.00 5.40 61 56 A 24 MET H A 24 MET HA 1.0 1.90 4.10 62 57 A 24 MET H A 24 MET HGy 1.0 1.90 4.50 63 58 A 24 MET H A 24 MET HGx 1.0 1.90 4.30 64 59 A 24 MET H A 24 MET HBx 1.0 1.70 3.30 65 59 A 24 MET H A 24 MET HBy 1.0 1.70 3.30 66 60 A 21 ILE HA A 21 ILE H 1.0 1.80 3.80 67 61 A 21 ILE HB A 21 ILE H 1.0 1.70 3.30 68 62 A 21 ILE H A 21 ILE HG12 1.0 1.80 3.80 69 63 A 21 ILE H A 21 ILE HG13 1.0 1.80 3.60 70 64 A 21 ILE H A 21 ILE HG21 1.0 2.00 6.00 71 65 A 21 ILE H A 21 ILE HD1% 1.0 2.00 6.00 72 66 A 25 GLU H A 25 GLU HBy 1.0 1.90 3.90 73 67 A 25 GLU H A 25 GLU HBx 1.0 1.80 4.00 74 68 A 25 GLU H A 25 GLU HA 1.0 1.80 3.80 75 69 A 24 MET HA A 25 GLU H 1.0 2.00 5.00 76 70 A 24 MET H A 23 VAL HA 1.0 2.00 5.60 77 71 A 21 ILE HA A 24 MET H 1.0 1.90 5.10 78 72 A 20 GLN HA A 21 ILE H 1.0 2.00 5.80 79 73 A 20 GLN H A 19 LEU HA 1.0 2.00 6.00 80 74 A 18 THR HA A 19 LEU H 1.0 1.80 4.00 81 75 A 18 THR HB A 19 LEU H 1.0 1.90 4.10 82 76 A 17 ASP HA A 17 ASP H 1.0 1.90 4.30 83 77 A 5 CYS H A 4 PHE HA 1.0 2.00 5.60 84 78 A 23 VAL H A 24 MET H 1.0 1.80 3.60 85 79 A 23 VAL H A 22 HIS H 1.0 1.80 3.80 86 80 A 18 THR H A 19 LEU H 1.0 1.80 3.60 87 81 A 20 GLN H A 21 ILE H 1.0 1.80 3.60 88 82 A 27 ILE H A 28 GLU H 1.0 1.90 4.70 89 83 A 20 GLN H A 19 LEU H 1.0 1.80 3.80 90 84 A 27 ILE H A 26 CYS H 1.0 1.90 4.30 91 85 A 22 HIS H A 21 ILE H 1.0 1.80 3.60 92 86 A 26 CYS H A 25 GLU H 1.0 1.70 3.30 93 87 A 5 CYS HA A 5 CYS HBx 1.0 1.70 3.50 94 88 A 5 CYS HA A 5 CYS HBy 1.0 1.90 3.90 95 89 A 8 LYS H A 9 CYS H 1.0 1.70 3.10 96 90 A 10 GLN H A 11 TYR H 1.0 1.90 4.90 97 91 A 18 THR H A 17 ASP H 1.0 1.80 3.80 98 92 A 8 LYS H A 10 GLN H 1.0 1.80 6.00 99 93 A 24 MET H A 25 GLU H 1.0 1.80 3.60 100 94 A 11 TYR H A 11 TYR HA 1.0 2.00 4.60 101 95 A 6 CYS HBx A 11 TYR H 1.0 2.00 5.60 102 96 A 11 TYR H A 11 TYR HBx 1.0 1.90 4.50 103 97 A 6 CYS HBy A 11 TYR H 1.0 2.00 5.60 104 98 A 11 TYR H A 10 GLN HBx 1.0 1.80 6.00 105 99 A 11 TYR H A 11 TYR HBy 1.0 1.80 3.80 106 100 A 11 TYR H A 10 GLN HA 1.0 1.90 6.00 107 101 A 18 THR HA A 20 GLN H 1.0 2.00 6.00 108 102 A 17 ASP H A 16 MET HA 1.0 2.00 5.20 109 103 A 27 ILE H A 26 CYS HA 1.0 1.80 3.80 110 104 A 20 GLN H A 19 LEU HG 1.0 1.90 4.90 111 105 A 19 LEU HD11 A 20 GLN H 1.0 1.80 6.00 112 106 A 20 GLN H A 19 LEU HD21 1.0 1.90 6.00 113 107 A 13 ALA H A 12 GLN HA 1.0 1.90 4.30 114 108 A 5 CYS HA A 13 ALA H 1.0 1.90 6.00 115 109 A 4 PHE HBx A 13 ALA H 1.0 2.00 6.00 116 109 A 4 PHE HBy A 13 ALA H 1.0 2.00 6.00 117 110 A 9 CYS HA A 9 CYS H 1.0 1.90 4.10 118 111 A 9 CYS HBy A 9 CYS H 1.0 1.80 3.60 119 112 A 27 ILE H A 23 VAL HA 1.0 2.00 6.00 120 113 A 6 CYS HBy A 9 CYS H 1.0 1.90 4.70 121 114 A 4 PHE H A 3 ASP HA 1.0 1.90 4.30 122 115 A 10 GLN H A 10 GLN HA 1.0 1.80 3.80 123 116 A 9 CYS HA A 10 GLN H 1.0 2.00 4.80 124 117 A 9 CYS HBx A 10 GLN H 1.0 1.70 3.30 125 118 A 10 GLN H A 10 GLN HBy 1.0 1.80 4.00 126 119 A 22 HIS H A 21 ILE HG21 1.0 2.00 5.40 127 120 A 22 HIS H A 21 ILE HG13 1.0 1.90 6.00 128 121 A 23 VAL HG21 A 22 HIS H 1.0 1.90 6.00 129 122 A 22 HIS H A 21 ILE HG12 1.0 1.90 6.00 130 123 A 27 ILE HG21 A 28 GLU H 1.0 2.00 5.20 131 124 A 19 LEU H A 19 LEU HBy 1.0 1.70 2.90 132 125 A 26 CYS H A 23 VAL HA 1.0 1.90 4.70 133 126 A 26 CYS H A 25 GLU HA 1.0 1.90 4.90 134 127 A 26 CYS H A 25 GLU HBx 1.0 2.00 5.80 135 128 A 26 CYS H A 25 GLU HBy 1.0 1.80 6.00 136 129 A 12 GLN H A 11 TYR HA 1.0 1.50 2.70 137 130 A 12 GLN H A 11 TYR HBx 1.0 1.90 6.00 138 131 A 12 GLN H A 12 GLN HGy 1.0 2.00 6.00 139 132 A 20 GLN HA A 24 MET H 1.0 2.00 6.00 140 133 A 23 VAL HG21 A 24 MET H 1.0 2.00 6.00 141 134 A 23 VAL HG11 A 24 MET H 1.0 2.00 5.40 142 135 A 18 THR HA A 21 ILE H 1.0 2.00 5.00 143 136 A 21 ILE H A 20 GLN HBx 1.0 1.90 4.70 144 137 A 20 GLN HBy A 21 ILE H 1.0 1.90 4.90 145 138 A 4 PHE H A 5 CYS H 1.0 1.90 6.00 146 139 A 9 CYS H A 11 TYR H 1.0 1.90 6.00 147 140 A 9 CYS H A 10 GLN H 1.0 2.00 4.80 148 141 A 11 TYR HA A 11 TYR HBx 1.0 1.70 2.90 149 142 A 22 HIS HBy A 22 HIS HA 1.0 1.70 3.30 150 143 A 22 HIS HBy A 22 HIS HBx 1.0 1.40 2.20 151 144 A 15 ASP HA A 15 ASP HBx 1.0 1.70 3.30 152 144 A 15 ASP HA A 15 ASP HBy 1.0 1.70 3.30 153 145 A 27 ILE HA A 27 ILE HG21 1.0 1.80 3.60 154 146 A 19 LEU HA A 19 LEU HBy 1.0 1.70 3.10 155 147 A 18 THR HB A 18 THR HG2% 1.0 1.60 2.80 156 148 A 18 THR HA A 18 THR HG2% 1.0 1.60 2.80 157 149 A 23 VAL HG11 A 23 VAL HA 1.0 1.60 3.00 158 150 A 26 CYS HBy A 26 CYS HA 1.0 1.70 3.30 159 151 A 8 LYS HA A 8 LYS HBy 1.0 1.70 3.10 160 152 A 8 LYS HA A 8 LYS HBx 1.0 1.70 3.10 161 153 A 25 GLU HBx A 25 GLU HA 1.0 1.80 3.60 162 154 A 20 GLN HA A 20 GLN HBx 1.0 1.70 3.10 163 155 A 20 GLN HA A 20 GLN HBy 1.0 1.70 3.10 164 156 A 24 MET HA A 24 MET HBy 1.0 1.60 3.00 165 156 A 24 MET HA A 24 MET HBx 1.0 1.60 3.00 166 157 A 17 ASP HBx A 17 ASP HA 1.0 1.70 2.90 167 157 A 17 ASP HA A 17 ASP HBy 1.0 1.70 2.90 168 158 A 21 ILE HA A 21 ILE HG21 1.0 1.70 3.10 169 159 A 21 ILE HA A 21 ILE HG13 1.0 1.90 3.90 170 160 A 20 GLN HA A 23 VAL HG21 1.0 1.70 3.10 171 161 A 8 LYS HA A 8 LYS HGx 1.0 1.90 4.10 172 162 A 6 CYS HBx A 6 CYS HBy 1.0 1.40 2.20 173 163 A 9 CYS HBx A 9 CYS HBy 1.0 1.50 2.30 174 164 A 11 TYR HBx A 11 TYR HBy 1.0 1.40 2.20 175 165 A 8 LYS HEy A 8 LYS HDy 1.0 1.70 3.30 176 166 A 4 PHE HBy A 19 LEU HD21 1.0 1.70 3.10 177 166 A 4 PHE HBx A 19 LEU HD21 1.0 1.70 3.10 178 167 A 26 CYS HBy A 26 CYS HBx 1.0 1.40 2.20 179 168 A 23 VAL HB A 23 VAL HG11 1.0 1.60 2.80 180 169 A 27 ILE HD1% A 27 ILE HB 1.0 1.60 2.80 181 169 A 27 ILE HG21 A 27 ILE HB 1.0 1.60 2.80 182 170 A 21 ILE HB A 21 ILE HG21 1.0 1.50 2.70 183 171 A 19 LEU HD11 A 19 LEU HBx 1.0 1.90 3.90 184 172 A 12 GLN HA A 12 GLN HBx 1.0 1.90 4.70 185 173 A 21 ILE HA A 21 ILE HG12 1.0 1.80 3.80 186 174 A 19 LEU HG A 19 LEU HA 1.0 1.90 3.90 187 175 A 8 LYS HA A 8 LYS HGy 1.0 1.80 4.00 188 176 A 18 THR HA A 21 ILE HD1% 1.0 1.80 3.60 189 177 A 4 PHE HBy A 4 PHE HA 1.0 1.70 3.50 190 177 A 4 PHE HBx A 4 PHE HA 1.0 1.70 3.50 191 178 A 6 CYS HA A 6 CYS HBy 1.0 1.70 3.30 192 179 A 14 PRO HBx A 14 PRO HA 1.0 1.80 3.40 193 180 A 10 GLN HBx A 10 GLN HA 1.0 2.00 4.60 194 181 A 13 ALA HB% A 13 ALA HA 1.0 1.60 2.80 195 182 A 19 LEU HD21 A 4 PHE HA 1.0 2.00 5.60 196 183 A 6 CYS HA A 19 LEU HD11 1.0 1.70 3.10 197 184 A 19 LEU HD11 A 19 LEU HA 1.0 1.60 2.60 198 185 A 18 THR HA A 18 THR HG2% 1.0 1.60 2.80 199 185 A 18 THR HB A 18 THR HG2% 1.0 1.60 2.80 200 186 A 26 CYS HBx A 26 CYS HA 1.0 1.80 3.80 201 187 A 26 CYS HBx A 23 VAL HA 1.0 1.70 3.30 202 188 A 14 PRO HBx A 14 PRO HDx 1.0 1.90 5.10 203 189 A 23 VAL HG21 A 23 VAL HA 1.0 1.60 2.80 204 190 A 13 ALA HB% A 14 PRO HDy 1.0 1.90 4.70 205 191 A 13 ALA HB% A 14 PRO HDx 1.0 1.80 3.80 206 192 A 4 PHE HBx A 13 ALA HB% 1.0 1.60 2.80 207 192 A 4 PHE HBy A 13 ALA HB% 1.0 1.60 2.80 208 193 A 6 CYS HBx A 11 TYR HBy 1.0 1.70 3.50 209 194 A 14 PRO HDx A 14 PRO HGy 1.0 1.60 2.80 210 194 A 14 PRO HDx A 14 PRO HGx 1.0 1.60 2.80 211 195 A 14 PRO HDy A 14 PRO HGx 1.0 1.60 2.80 212 195 A 14 PRO HDy A 14 PRO HGy 1.0 1.60 2.80 213 196 A 12 GLN HA A 12 GLN HBy 1.0 2.00 4.80 214 197 A 6 CYS HA A 6 CYS HBx 1.0 1.80 3.60 215 198 A 5 CYS HA A 5 CYS HBx 1.0 1.70 3.30 216 198 A 5 CYS HA A 5 CYS HBy 1.0 1.70 3.30 217 199 A 19 LEU HD21 A 19 LEU HBx 1.0 1.70 2.90 218 200 A 19 LEU HD21 A 19 LEU HG 1.0 1.70 2.90 219 201 A 21 ILE HG12 A 21 ILE HG13 1.0 1.40 2.20 220 202 A 23 VAL HB A 23 VAL HG21 1.0 1.60 2.80 221 203 A 19 LEU HBx A 19 LEU HBy 1.0 1.40 2.20 222 204 A 19 LEU HD11 A 19 LEU HG 1.0 1.90 4.30 223 205 A 13 ALA HA A 11 TYR HE% 1.0 1.80 3.60 224 206 A 4 PHE HA A 4 PHE HD% 1.0 1.80 3.80 225 207 A 4 PHE HBx A 4 PHE HD% 1.0 1.50 2.70 226 207 A 4 PHE HBy A 4 PHE HD% 1.0 1.50 2.70 227 208 A 6 CYS HBx A 11 TYR HD% 1.0 1.80 3.80 228 209 A 6 CYS HBy A 11 TYR HD% 1.0 1.90 4.90 229 210 A 13 ALA HA A 11 TYR HD% 1.0 2.00 5.40 230 211 A 11 TYR HA A 11 TYR HD% 1.0 1.70 3.30 231 212 A 11 TYR HA A 11 TYR HE% 1.0 2.00 5.20 232 213 A 19 LEU HA A 11 TYR HE% 1.0 1.70 3.50 233 214 A 11 TYR H A 11 TYR HD% 1.0 2.00 6.00 234 215 A 6 CYS H A 11 TYR HD% 1.0 2.00 6.00 235 216 A 12 GLN H A 11 TYR HD% 1.0 1.90 4.30 236 217 A 12 GLN H A 11 TYR HE% 1.0 2.00 5.00 237 218 A 4 PHE H A 4 PHE HD% 1.0 2.00 4.80 238 219 A 19 LEU HD11 A 11 TYR HD% 1.0 1.70 3.30 239 220 A 19 LEU HD11 A 11 TYR HE% 1.0 1.90 3.90 240 221 A 13 ALA HB% A 11 TYR HE% 1.0 1.50 2.50 241 222 A 13 ALA HB% A 11 TYR HD% 1.0 1.80 3.60 242 223 A 11 TYR HBy A 11 TYR HD% 1.0 1.50 2.70 243 224 A 11 TYR HBx A 11 TYR HD% 1.0 1.60 3.00 244 225 A 22 HIS HBx A 11 TYR HD% 1.0 1.90 4.50 245 226 A 11 TYR HBy A 11 TYR HE% 1.0 2.00 4.80 246 227 A 22 HIS HBx A 11 TYR HE% 1.0 1.70 3.30 247 228 A 4 PHE HBx A 4 PHE HE% 1.0 1.90 5.10 248 228 A 4 PHE HBy A 4 PHE HE% 1.0 1.90 5.10 249 229 A 19 LEU HD21 A 4 PHE HD% 1.0 1.90 3.90 250 230 A 13 ALA HB% A 15 ASP H 1.0 1.70 3.30 251 231 A 23 VAL H A 22 HIS HD2 1.0 1.90 4.10 252 232 A 11 TYR HD% A 22 HIS HD2 1.0 1.80 3.80 253 233 A 11 TYR HE% A 22 HIS HD2 1.0 1.90 4.70 254 234 A 6 CYS HBy A 11 TYR HE% 1.0 1.90 6.00 255 235 A 19 LEU HA A 11 TYR HD% 1.0 2.00 5.80 256 236 A 15 ASP HA A 4 PHE HE% 1.0 1.90 4.30 257 237 A 15 ASP HA A 4 PHE HD% 1.0 2.00 4.60 258 238 A 8 LYS H A 8 LYS HGx 1.0 2.00 5.00 259 239 A 8 LYS H A 8 LYS HGy 1.0 2.00 6.00 260 240 A 8 LYS H A 23 VAL HG11 1.0 1.90 6.00 261 241 A 18 THR H A 15 ASP HBy 1.0 2.00 6.00 262 241 A 18 THR H A 15 ASP HBx 1.0 2.00 6.00 263 242 A 17 ASP HA A 20 GLN H 1.0 2.00 4.80 264 243 A 8 LYS HA A 9 CYS H 1.0 1.80 4.20 265 244 A 25 GLU H A 23 VAL HA 1.0 2.00 5.80 266 245 A 22 HIS HA A 25 GLU H 1.0 2.00 6.00 267 246 A 15 ASP HA A 15 ASP H 1.0 2.00 5.60 268 247 A 14 PRO HA A 15 ASP H 1.0 2.00 5.80 269 248 A 13 ALA HA A 15 ASP H 1.0 1.00 6.00 270 249 A 26 CYS HA A 22 HIS HE1 1.0 2.00 6.00 271 250 A 22 HIS HBx A 22 HIS HE1 1.0 1.80 6.00 272 251 A 22 HIS HA A 22 HIS HE1 1.0 1.90 6.00 273 252 A 23 VAL HA A 22 HIS HD2 1.0 1.60 3.00 274 253 A 22 HIS HA A 22 HIS HD2 1.0 2.00 5.40 275 254 A 6 CYS HA A 22 HIS HD2 1.0 2.00 5.80 276 255 A 4 PHE HA A 4 PHE HE% 1.0 2.00 6.00 277 256 A 20 GLN H A 19 LEU HBy 1.0 1.90 4.70 278 257 A 27 ILE H A 26 CYS HBx 1.0 2.00 5.60 279 258 A 27 ILE H A 27 ILE HG12 1.0 1.90 5.10 280 259 A 27 ILE H A 26 CYS HBy 1.0 2.00 6.00 281 260 A 17 ASP H A 16 MET HBx 1.0 1.90 3.90 282 260 A 17 ASP H A 16 MET HBy 1.0 1.90 3.90 283 261 A 17 ASP H A 15 ASP HBy 1.0 1.90 4.50 284 261 A 17 ASP H A 15 ASP HBx 1.0 1.90 4.50 285 262 A 10 GLN H A 11 TYR HBy 1.0 2.00 6.00 286 263 A 28 GLU H A 27 ILE HB 1.0 2.00 5.20 287 264 A 19 LEU HD21 A 5 CYS H 1.0 2.00 6.00 288 265 A 5 CYS H A 19 LEU HBy 1.0 1.50 6.00 289 266 A 12 GLN H A 11 TYR HBy 1.0 1.80 6.00 290 267 A 23 VAL HB A 24 MET H 1.0 1.90 4.50 291 268 A 18 THR HB A 15 ASP H 1.0 1.80 3.60 292 269 A 14 PRO HDx A 15 ASP H 1.0 2.00 5.00 293 270 A 14 PRO HGx A 15 ASP H 1.0 1.80 3.80 294 270 A 14 PRO HGy A 15 ASP H 1.0 1.80 3.80 295 271 A 15 ASP H A 14 PRO HBy 1.0 2.00 6.00 296 272 A 14 PRO HBx A 15 ASP H 1.0 2.00 5.20 297 273 A 15 ASP HBx A 15 ASP H 1.0 1.90 4.90 298 273 A 15 ASP HBy A 15 ASP H 1.0 1.90 4.90 299 274 A 12 GLN H A 11 TYR H 1.0 1.90 6.00 300 275 A 4 PHE H A 4 PHE HE% 1.0 2.00 6.00 301 276 A 19 LEU H A 15 ASP H 1.0 2.00 5.80 302 277 A 11 TYR HD% A 22 HIS HE1 1.0 2.00 4.80 303 278 A 11 TYR HE% A 22 HIS HE1 1.0 1.80 6.00 304 279 A 22 HIS HD2 A 22 HIS HE1 1.0 2.00 6.00 305 280 A 22 HIS H A 11 TYR HD% 1.0 1.80 6.00 306 281 A 22 HIS H A 11 TYR HE% 1.0 2.00 6.00 307 282 A 9 CYS HBx A 22 HIS HE1 1.0 2.00 5.80 308 283 A 11 TYR HBx A 22 HIS HE1 1.0 1.80 3.80 309 284 A 9 CYS HBy A 22 HIS HE1 1.0 2.00 5.80 310 285 A 11 TYR HBy A 22 HIS HE1 1.0 1.90 4.70 311 286 A 26 CYS HBy A 22 HIS HE1 1.0 2.00 5.80 312 287 A 26 CYS HBx A 22 HIS HE1 1.0 2.00 6.00 313 288 A 6 CYS HBx A 22 HIS HD2 1.0 1.80 3.60 314 289 A 22 HIS HBy A 22 HIS HD2 1.0 1.90 4.10 315 290 A 6 CYS HBy A 22 HIS HD2 1.0 1.90 4.30 316 291 A 23 VAL HB A 22 HIS HD2 1.0 2.00 6.00 317 292 A 23 VAL HG21 A 22 HIS HD2 1.0 1.80 3.60 318 293 A 23 VAL HG11 A 22 HIS HD2 1.0 1.90 4.50 319 294 A 26 CYS HBx A 22 HIS HD2 1.0 1.90 4.30 320 295 A 26 CYS HBy A 22 HIS HD2 1.0 2.00 5.60 321 296 A 19 LEU HD11 A 22 HIS HD2 1.0 1.80 3.60 322 297 A 19 LEU HG A 22 HIS HD2 1.0 2.00 6.00 323 298 A 15 ASP HBy A 4 PHE HE% 1.0 2.00 6.00 324 298 A 15 ASP HBx A 4 PHE HE% 1.0 2.00 6.00 325 299 A 14 PRO HA A 4 PHE HD% 1.0 2.00 5.40 326 300 A 19 LEU HD21 A 4 PHE HE% 1.0 2.00 6.00 327 301 A 6 CYS HBx A 11 TYR HE% 1.0 1.90 6.00 328 302 A 13 ALA HA A 14 PRO HDy 1.0 1.70 3.10 329 303 A 13 ALA HA A 14 PRO HDx 1.0 1.70 3.10 330 304 A 22 HIS HBx A 22 HIS HA 1.0 1.60 2.80 331 305 A 18 THR HB A 22 HIS HBx 1.0 0.00 6.00 332 306 A 14 PRO HA A 14 PRO HGx 1.0 2.00 5.40 333 306 A 14 PRO HA A 14 PRO HGy 1.0 2.00 5.40 334 307 A 14 PRO HA A 14 PRO HBy 1.0 1.80 4.00 335 308 A 14 PRO HDy A 14 PRO HBy 1.0 1.70 3.50 336 309 A 14 PRO HDx A 14 PRO HBy 1.0 1.90 4.30 337 310 A 21 ILE HA A 21 ILE HB 1.0 1.80 3.60 338 311 A 5 CYS HA A 19 LEU HD11 1.0 1.90 4.50 339 312 A 6 CYS HA A 19 LEU HD21 1.0 2.00 5.80 340 313 A 18 THR HB A 13 ALA HB% 1.0 1.70 3.50 341 314 A 18 THR HG2% A 14 PRO HDy 1.0 1.90 3.90 342 315 A 18 THR HG2% A 14 PRO HDx 1.0 1.80 4.20 343 316 A 20 GLN HA A 23 VAL HG11 1.0 2.00 6.00 344 317 A 24 MET HA A 24 MET HGx 1.0 2.00 5.60 345 318 A 24 MET HA A 24 MET HGy 1.0 1.90 4.50 346 319 A 20 GLN HA A 20 GLN HGx 1.0 1.80 3.80 347 319 A 20 GLN HA A 20 GLN HGy 1.0 1.80 3.80 348 320 A 6 CYS HBy A 11 TYR HBy 1.0 1.80 3.60 349 321 A 8 LYS HGx A 8 LYS HEy 1.0 2.00 5.20 350 322 A 8 LYS HGx A 8 LYS HEx 1.0 2.00 5.80 351 323 A 6 CYS HBy A 19 LEU HD11 1.0 2.00 5.20 352 324 A 17 ASP HBy A 21 ILE HD1% 1.0 1.80 3.80 353 325 A 25 GLU HBy A 25 GLU HA 1.0 1.70 3.10 354 326 A 19 LEU HD21 A 19 LEU HA 1.0 2.00 5.80 355 327 A 18 THR HA A 21 ILE HG12 1.0 2.00 6.00 356 328 A 18 THR HA A 21 ILE HG13 1.0 2.00 5.20 357 329 A 18 THR HA A 21 ILE HG21 1.0 2.00 6.00 358 330 A 21 ILE HA A 21 ILE HD1% 1.0 2.00 5.40 359 331 A 19 LEU HD11 A 22 HIS HBx 1.0 2.00 5.00 360 332 A 18 THR HB A 21 ILE HG13 1.0 1.90 6.00 361 333 A 20 GLN HA A 19 LEU HG 1.0 1.90 4.10 362 334 A 20 GLN HA A 19 LEU HD11 1.0 2.00 4.80 363 335 A 27 ILE HA A 27 ILE HG13 1.0 1.80 3.80 364 336 A 6 CYS HBx A 19 LEU HD11 1.0 1.90 4.30 365 337 A 19 LEU HD11 A 4 PHE HBx 1.0 2.00 5.80 366 337 A 19 LEU HD11 A 4 PHE HBy 1.0 2.00 5.80 367 338 A 8 LYS HEy A 8 LYS HGy 1.0 1.90 5.30 368 339 A 8 LYS HGy A 8 LYS HEx 1.0 2.00 6.00 369 340 A 8 LYS HDy A 8 LYS HEx 1.0 1.90 4.10 370 341 A 23 VAL HG11 A 24 MET HGy 1.0 1.80 6.00 371 342 A 23 VAL HG11 A 24 MET HGx 1.0 2.00 6.00 372 343 A 23 VAL HG21 A 24 MET HGx 1.0 2.00 5.40 373 344 A 8 LYS HBx A 8 LYS HGx 1.0 1.80 3.40 374 345 A 8 LYS HBy A 8 LYS HGx 1.0 1.60 3.00 375 346 A 8 LYS HBy A 8 LYS HGy 1.0 1.80 3.60 376 347 A 21 ILE HB A 21 ILE HD1% 1.0 1.80 3.40 377 348 A 8 LYS HGx A 8 LYS HDx 1.0 1.80 3.60 378 349 A 8 LYS HGy A 8 LYS HDx 1.0 1.80 3.80 379 350 A 8 LYS HDy A 8 LYS HGy 1.0 1.80 4.00 380 351 A 19 LEU HD21 A 19 LEU HBy 1.0 1.70 3.10 381 352 A 23 VAL HG21 A 19 LEU HD21 1.0 1.80 4.00 382 353 A 21 ILE HG12 A 21 ILE HG21 1.0 1.80 3.80 383 354 A 21 ILE HG12 A 21 ILE HD1% 1.0 1.60 3.00 384 355 A 19 LEU HD11 A 19 LEU HBy 1.0 1.90 3.90 385 356 A 23 VAL HG21 A 19 LEU HD11 1.0 1.80 3.60 386 357 A 6 CYS HA A 7 PRO HDx 1.0 1.70 3.30 387 358 A 6 CYS HA A 7 PRO HDy 1.0 1.60 2.80 388 359 A 7 PRO HDx A 7 PRO HDy 1.0 1.40 2.20 389 360 A 8 LYS H A 7 PRO HBx 1.0 2.00 6.00 390 361 A 8 LYS H A 7 PRO HA 1.0 1.90 4.90 391 362 A 8 LYS H A 7 PRO HDy 1.0 2.00 6.00 392 363 A 7 PRO HBx A 7 PRO HA 1.0 1.80 3.60 393 364 A 7 PRO HA A 7 PRO HBy 1.0 1.80 4.20 394 365 A 7 PRO HA A 7 PRO HGy 1.0 2.00 5.20 395 365 A 7 PRO HA A 7 PRO HGx 1.0 2.00 5.20 396 366 A 7 PRO HDx A 7 PRO HBy 1.0 1.90 4.50 397 367 A 7 PRO HDy A 7 PRO HGx 1.0 1.80 3.60 398 367 A 7 PRO HDy A 7 PRO HGy 1.0 1.80 3.60 399 368 A 7 PRO HDx A 23 VAL HG21 1.0 1.60 3.00 400 369 A 23 VAL HG21 A 7 PRO HDy 1.0 1.90 4.50 401 370 A 23 VAL HG11 A 7 PRO HDy 1.0 2.00 5.80 402 371 A 7 PRO HDx A 19 LEU HD21 1.0 2.00 6.00 403 372 A 7 PRO HDy A 7 PRO HBy 1.0 1.70 3.30 404 373 A 7 PRO HDx A 19 LEU HD11 1.0 1.90 4.90 405 374 A 27 ILE HG13 A 28 GLU H 1.0 1.50 6.00 406 375 A 16 MET HA A 16 MET H 1.0 2.00 5.00 407 376 A 15 ASP HA A 16 MET H 1.0 1.80 4.20 408 377 A 15 ASP HBy A 16 MET H 1.0 1.80 3.80 409 377 A 15 ASP HBx A 16 MET H 1.0 1.80 3.80 410 378 A 16 MET H A 16 MET HGx 1.0 1.70 6.00 411 378 A 16 MET H A 16 MET HGy 1.0 1.70 6.00 412 379 A 16 MET HBx A 16 MET H 1.0 1.80 3.60 413 379 A 16 MET HBy A 16 MET H 1.0 1.80 3.60 414 380 A 16 MET HA A 16 MET HBy 1.0 1.60 3.00 415 380 A 16 MET HA A 16 MET HBx 1.0 1.60 3.00 416 381 A 16 MET HA A 16 MET HGx 1.0 1.90 4.50 417 381 A 16 MET HA A 16 MET HGy 1.0 1.90 4.50 418 382 A 19 LEU HBx A 16 MET HA 1.0 1.90 3.70 419 383 A 19 LEU HD21 A 16 MET HA 1.0 2.00 5.20 420 384 A 19 LEU HBx A 16 MET HBy 1.0 2.00 5.40 421 384 A 19 LEU HBx A 16 MET HBx 1.0 2.00 5.40 422 385 A 16 MET HBy A 16 MET HGy 1.0 1.70 3.10 423 385 A 16 MET HBx A 16 MET HGx 1.0 1.70 3.10 424 385 A 16 MET HBx A 16 MET HGy 1.0 1.70 3.10 425 385 A 16 MET HBy A 16 MET HGx 1.0 1.70 3.10 426 386 A 19 LEU HD21 A 16 MET HGy 1.0 1.90 3.90 427 387 A 16 MET HA A 4 PHE HD% 1.0 1.90 4.10 428 388 A 16 MET HA A 4 PHE HE% 1.0 2.00 6.00 429 389 A 4 PHE HE% A 16 MET HGx 1.0 2.00 4.80 430 389 A 4 PHE HE% A 16 MET HGy 1.0 2.00 4.80 431 390 A 4 PHE HE% A 16 MET HBy 1.0 1.70 3.50 432 390 A 4 PHE HE% A 16 MET HBx 1.0 1.70 3.50 433 391 A 4 PHE HD% A 16 MET HBy 1.0 2.00 5.20 434 391 A 4 PHE HD% A 16 MET HBx 1.0 2.00 5.20 435 392 A 4 PHE HD% A 16 MET HE% 1.0 2.00 5.40 436 393 A 4 PHE HD% A 16 MET HGx 1.0 2.00 5.40 437 393 A 4 PHE HD% A 16 MET HGy 1.0 2.00 5.40 438 394 A 19 LEU HBx A 4 PHE HD% 1.0 2.00 5.20 439 395 A 19 LEU HBy A 4 PHE HD% 1.0 2.00 6.00 440 396 A 20 GLN HA A 23 VAL HB 1.0 1.80 3.60 441 397 A 21 ILE HA A 24 MET HBx 1.0 1.90 4.30 442 397 A 21 ILE HA A 24 MET HBy 1.0 1.90 4.30 443 398 A 22 HIS HA A 25 GLU HBx 1.0 1.90 4.50 444 399 A 22 HIS HA A 25 GLU HBy 1.0 1.90 4.30 445 400 A 26 CYS HBy A 23 VAL HA 1.0 1.70 3.10 446 401 A 5 CYS HA A 12 GLN HA 1.0 1.80 3.60 447 402 A 6 CYS SG A 9 CYS SG 1.0 3.68 3.72 448 403 A 6 CYS SG A 26 CYS SG 1.0 3.68 3.72 449 404 A 6 CYS SG A 22 HIS NE2 1.0 3.48 3.52 450 405 A 9 CYS SG A 26 CYS SG 1.0 3.68 3.72 451 406 A 9 CYS SG A 22 HIS NE2 1.0 3.48 3.52 452 407 A 26 CYS SG A 22 HIS NE2 1.0 3.48 3.52 453 408 A 23 VAL H A 19 LEU HA 1.0 1.90 4.90 454 408 A 23 VAL H A 22 HIS HA 1.0 1.90 4.90 455 409 A 23 VAL H A 22 HIS HBx 1.0 1.80 3.40 456 409 A 23 VAL H A 23 VAL HA 1.0 1.80 3.40 457 410 A 20 GLN H A 20 GLN HBx 1.0 1.80 3.80 458 410 A 20 GLN H A 19 LEU HBx 1.0 1.80 3.80 459 411 A 28 GLU H A 28 GLU HA 1.0 1.80 3.80 460 411 A 27 ILE HA A 28 GLU H 1.0 1.80 3.80 461 412 A 25 GLU H A 25 GLU HGx 1.0 1.70 3.30 462 412 A 24 MET HBx A 25 GLU H 1.0 1.70 3.30 463 412 A 24 MET HBy A 25 GLU H 1.0 1.70 3.30 464 413 A 6 CYS H A 10 GLN H 1.0 2.00 5.60 465 413 A 8 LYS H A 10 GLN H 1.0 2.00 5.60 466 414 A 6 CYS HBx A 9 CYS H 1.0 2.00 4.40 467 414 A 9 CYS HBx A 9 CYS H 1.0 2.00 4.40 468 415 A 9 CYS HBy A 10 GLN H 1.0 2.00 5.40 469 415 A 10 GLN H A 10 GLN HBx 1.0 2.00 5.40 470 416 A 18 THR HG2% A 14 PRO HDy 1.0 1.80 4.00 471 416 A 13 ALA HB% A 14 PRO HDy 1.0 1.80 4.00 472 417 A 14 PRO HBx A 14 PRO HDy 1.0 1.70 3.30 473 417 A 23 VAL HB A 23 VAL HA 1.0 1.70 3.30 474 418 A 19 LEU HBx A 19 LEU HA 1.0 1.50 2.70 475 418 A 10 GLN HA A 10 GLN HBy 1.0 1.50 2.70 476 419 A 11 TYR HBx A 11 TYR HE% 1.0 1.70 3.10 477 419 A 22 HIS HBx A 11 TYR HE% 1.0 1.70 3.10 478 420 A 6 CYS HBx A 10 GLN HA 1.0 2.00 6.00 479 420 A 9 CYS HBx A 10 GLN HA 1.0 2.00 6.00 480 421 A 18 THR HG2% A 14 PRO HDx 1.0 1.70 3.30 481 421 A 13 ALA HB% A 14 PRO HDx 1.0 1.70 3.30 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 4 PHE C A 5 CYS N A 5 CYS CA A 5 CYS C 1.0 -140.0 -100.0 PHI 2 2 A 7 PRO C A 8 LYS N A 8 LYS CA A 8 LYS C 1.0 -160.0 -80.0 PHI 3 3 A 8 LYS C A 9 CYS N A 9 CYS CA A 9 CYS C 1.0 -160.0 -80.0 PHI 4 4 A 9 CYS C A 10 GLN N A 10 GLN CA A 10 GLN C 1.0 -160.0 -80.0 PHI 5 5 A 11 TYR C A 12 GLN N A 12 GLN CA A 12 GLN C 1.0 -160.0 -80.0 PHI 6 6 A 12 GLN C A 13 ALA N A 13 ALA CA A 13 ALA C 1.0 -160.0 -80.0 PHI 7 7 A 14 PRO C A 15 ASP N A 15 ASP CA A 15 ASP C 1.0 -105.0 -25.0 PHI 8 8 A 15 ASP C A 16 MET N A 16 MET CA A 16 MET C 1.0 -85.0 -45.0 PHI 9 9 A 16 MET C A 17 ASP N A 17 ASP CA A 17 ASP C 1.0 -85.0 -45.0 PHI 10 10 A 17 ASP C A 18 THR N A 18 THR CA A 18 THR C 1.0 -85.0 -45.0 PHI 11 11 A 18 THR C A 19 LEU N A 19 LEU CA A 19 LEU C 1.0 -85.0 -45.0 PHI 12 12 A 19 LEU C A 20 GLN N A 20 GLN CA A 20 GLN C 1.0 -85.0 -45.0 PHI 13 13 A 20 GLN C A 21 ILE N A 21 ILE CA A 21 ILE C 1.0 -85.0 -45.0 PHI 14 14 A 22 HIS C A 23 VAL N A 23 VAL CA A 23 VAL C 1.0 -85.0 -45.0 PHI 15 15 A 23 VAL C A 24 MET N A 24 MET CA A 24 MET C 1.0 -85.0 -45.0 PHI 16 16 A 24 MET C A 25 GLU N A 25 GLU CA A 25 GLU C 1.0 -105.0 -25.0 PHI 17 17 A 25 GLU C A 26 CYS N A 26 CYS CA A 26 CYS C 1.0 -105.0 -25.0 PHI stop_ save_