data_nef_c17733_2ley 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 2GW9 PDB 2GWP 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 4 CYS SG 1 29 CYS SG 1 6 CYS SG 1 21 CYS SG 1 11 CYS SG 1 28 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 1 GLY start . false 2 A 2 LEU middle . . 3 A 3 LEU middle . . 4 A 4 CYS middle -HG . 5 A 5 TYR middle . . 6 A 6 CYS middle -HG . 7 A 7 GLY middle . false 8 A 8 LYS middle . . 9 A 9 GLY middle . false 10 A 10 HIS middle . . 11 A 11 CYS middle -HG . 12 A 12 LYS middle . . 13 A 13 ARG middle . . 14 A 14 GLY middle . false 15 A 15 GLU middle . . 16 A 16 ARG middle . . 17 A 17 VAL middle . . 18 A 18 ARG middle . . 19 A 19 GLY middle . false 20 A 20 THR middle . . 21 A 21 CYS middle -HG . 22 A 22 GLY middle . false 23 A 23 ILE middle . . 24 A 24 ARG middle . . 25 A 25 PHE middle . . 26 A 26 LEU middle . . 27 A 27 TYR middle . . 28 A 28 CYS middle -HG . 29 A 29 CYS middle -HG . 30 A 30 PRO middle . false 31 A 31 ARG middle . . 32 A 32 ARG 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 2 LEU HA H 1 4.269 0 A 3 LEU H H 1 8.21 0 A 3 LEU HA H 1 4.347 0 A 3 LEU HBx H 1 1.55 0.004 A 3 LEU HBy H 1 1.55 0.004 A 3 LEU HDx% H 1 0.768 0 A 3 LEU HDy% H 1 0.768 0 A 4 CYS H H 1 8.049 0 A 4 CYS HA H 1 5.156 0 A 4 CYS HBy H 1 2.907 0 A 4 CYS HBx H 1 1.753 0 A 5 TYR H H 1 8.699 0 A 5 TYR HA H 1 4.778 0 A 5 TYR HBx H 1 2.777 0 A 5 TYR HBy H 1 2.777 0 A 5 TYR HDx H 1 6.756 0 A 5 TYR HDy H 1 6.756 0 A 5 TYR HEx H 1 6.676 0 A 5 TYR HEy H 1 6.676 0 A 6 CYS H H 1 8.782 0 A 6 CYS HA H 1 5.278 0 A 6 CYS HBy H 1 2.87 0 A 6 CYS HBx H 1 2.686 0 A 7 GLY H H 1 9.587 0 A 7 GLY HAy H 1 4.534 0 A 7 GLY HAx H 1 3.588 0 A 8 LYS H H 1 8.489 0 A 8 LYS HA H 1 3.859 0.001 A 8 LYS HBx H 1 1.609 0.006 A 8 LYS HBy H 1 1.609 0.006 A 8 LYS HDx H 1 1.427 0 A 8 LYS HDy H 1 1.427 0 A 8 LYS HGx H 1 0.946 0.004 A 8 LYS HGy H 1 0.946 0.004 A 9 GLY H H 1 8.494 0 A 9 GLY HAy H 1 4.11 0 A 9 GLY HAx H 1 3.404 0 A 10 HIS H H 1 7.805 0 A 10 HIS HA H 1 4.528 0.002 A 10 HIS HBy H 1 3.269 0 A 10 HIS HBx H 1 3.028 0 A 11 CYS H H 1 8.706 0 A 11 CYS HA H 1 4.897 0 A 11 CYS HBy H 1 3.567 0 A 11 CYS HBx H 1 2.411 0.001 A 12 LYS H H 1 8.155 0 A 12 LYS HA H 1 4.321 0.004 A 12 LYS HBy H 1 1.844 0 A 12 LYS HBx H 1 1.348 0 A 12 LYS HDx H 1 1.589 0 A 12 LYS HDy H 1 1.589 0 A 12 LYS HEx H 1 2.875 0 A 12 LYS HEy H 1 2.875 0 A 12 LYS HGx H 1 1.454 0 A 12 LYS HGy H 1 1.454 0 A 13 ARG H H 1 8.48 0 A 13 ARG HA H 1 3.958 0.001 A 13 ARG HBy H 1 1.715 0 A 13 ARG HBx H 1 1.632 0 A 13 ARG HDx H 1 3.102 0 A 13 ARG HDy H 1 3.102 0 A 13 ARG HGy H 1 1.609 0.001 A 13 ARG HGx H 1 1.5 0 A 14 GLY H H 1 8.872 0 A 14 GLY HAy H 1 4.115 0 A 14 GLY HAx H 1 3.617 0 A 15 GLU H H 1 7.622 0 A 15 GLU HA H 1 4.372 0.01 A 15 GLU HBy H 1 1.912 0.005 A 15 GLU HBx H 1 1.525 0 A 15 GLU HGy H 1 2.158 0.002 A 15 GLU HGx H 1 2.02 0 A 16 ARG H H 1 8.712 0.005 A 16 ARG HA H 1 4.451 0 A 16 ARG HBx H 1 1.516 0.003 A 16 ARG HBy H 1 1.516 0.003 A 16 ARG HDx H 1 3.024 0 A 16 ARG HDy H 1 3.024 0 A 16 ARG HGx H 1 1.396 0 A 16 ARG HGy H 1 1.396 0 A 17 VAL H H 1 8.555 0 A 17 VAL HA H 1 4.281 0 A 17 VAL HB H 1 1.978 0 A 17 VAL HGx% H 1 0.961 0.002 A 17 VAL HGy% H 1 0.961 0.002 A 18 ARG H H 1 9.114 0 A 18 ARG HA H 1 4.584 0 A 18 ARG HBx H 1 2.006 0 A 18 ARG HBy H 1 2.006 0 A 18 ARG HDx H 1 3.093 0 A 18 ARG HDy H 1 3.093 0 A 18 ARG HGy H 1 1.525 0 A 18 ARG HGx H 1 1.433 0 A 19 GLY H H 1 7.576 0.001 A 19 GLY HAy H 1 4.346 0 A 19 GLY HAx H 1 3.878 0.004 A 20 THR H H 1 8.409 0 A 20 THR HA H 1 4.82 0 A 20 THR HB H 1 4.314 0 A 20 THR HG2% H 1 1.069 0.004 A 21 CYS H H 1 7.913 0 A 21 CYS HA H 1 4.735 0 A 21 CYS HBy H 1 3.105 0 A 21 CYS HBx H 1 2.943 0.001 A 22 GLY H H 1 8.196 0 A 22 GLY HAy H 1 3.957 0 A 22 GLY HAx H 1 3.703 0 A 23 ILE H H 1 8.182 0 A 23 ILE HA H 1 3.859 0 A 23 ILE HB H 1 1.781 0 A 23 ILE HG2% H 1 0.78 0 A 24 ARG H H 1 8.249 0 A 24 ARG HA H 1 3.999 0 A 24 ARG HBx H 1 1.568 0 A 24 ARG HBy H 1 1.568 0 A 24 ARG HGx H 1 1.302 0 A 24 ARG HGy H 1 1.302 0 A 25 PHE H H 1 7.555 0 A 25 PHE HA H 1 5.067 0 A 25 PHE HBy H 1 3.016 0 A 25 PHE HBx H 1 2.773 0.003 A 25 PHE HDx H 1 7.028 0 A 25 PHE HDy H 1 7.028 0 A 25 PHE HEx H 1 7.251 0 A 25 PHE HEy H 1 7.251 0 A 25 PHE HZ H 1 7.212 0.005 A 26 LEU H H 1 8.832 0 A 26 LEU HA H 1 4.595 0 A 26 LEU HBx H 1 1.402 0.004 A 26 LEU HBy H 1 1.402 0.004 A 26 LEU HDx% H 1 0.696 0 A 26 LEU HDy% H 1 0.696 0 A 26 LEU HG H 1 1.196 0.004 A 27 TYR H H 1 8.168 0 A 27 TYR HA H 1 4.804 0.002 A 27 TYR HBy H 1 2.557 0 A 27 TYR HBx H 1 2.138 0 A 27 TYR HDx H 1 6.706 0 A 27 TYR HDy H 1 6.706 0 A 27 TYR HEx H 1 6.509 0 A 27 TYR HEy H 1 6.509 0 A 28 CYS H H 1 8.546 0.003 A 28 CYS HA H 1 4.761 0 A 28 CYS HBy H 1 2.528 0.006 A 28 CYS HBx H 1 1.332 0 A 29 CYS H H 1 8.975 0 A 29 CYS HA H 1 5.069 0 A 29 CYS HBy H 1 2.934 0 A 29 CYS HBx H 1 2.379 0 A 30 PRO HA H 1 4.443 0.005 A 30 PRO HBy H 1 2.386 0.005 A 30 PRO HBx H 1 1.847 0 A 30 PRO HDy H 1 3.668 0 A 30 PRO HDx H 1 3.541 0.006 A 30 PRO HGy H 1 2.009 0.003 A 30 PRO HGx H 1 1.948 0.006 A 31 ARG H H 1 8.523 0 A 31 ARG HA H 1 4.025 0 A 31 ARG HBy H 1 1.704 0 A 31 ARG HBx H 1 1.615 0 A 31 ARG HDx H 1 3.061 0 A 31 ARG HDy H 1 3.061 0 A 31 ARG HGx H 1 1.477 0 A 31 ARG HGy H 1 1.477 0 A 32 ARG H H 1 7.716 0 A 32 ARG HA H 1 4.026 0 A 32 ARG HBy H 1 1.712 0.006 A 32 ARG HBx H 1 1.593 0 A 32 ARG HDx H 1 3.069 0 A 32 ARG HDy H 1 3.069 0 A 32 ARG HGx H 1 1.446 0 A 32 ARG HGy H 1 1.446 0 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 8 LYS H A 7 GLY HAx 1.0 1.8 3.14 2 2 A 8 LYS H A 7 GLY HAy 1.0 1.8 3.14 3 3 A 6 CYS HA A 7 GLY H 1.0 1.8 2.49 4 4 A 7 GLY H A 6 CYS HBx 1.0 1.8 4.51 5 5 A 5 TYR HA A 6 CYS H 1.0 1.8 2.56 6 6 A 18 ARG HA A 19 GLY H 1.0 1.8 3.61 7 7 A 20 THR HA A 21 CYS H 1.0 1.8 2.59 8 8 A 21 CYS H A 20 THR HB 1.0 1.8 2.93 9 9 A 21 CYS HBy A 22 GLY H 1.0 1.8 4.26 10 10 A 25 PHE HA A 26 LEU H 1.0 1.8 2.52 11 11 A 26 LEU H A 25 PHE HBx 1.0 1.8 2.87 12 12 A 26 LEU H A 25 PHE HBy 1.0 1.8 4.54 13 13 A 27 TYR H A 26 LEU HBx 1.0 1.8 5.23 14 13 A 26 LEU HBy A 27 TYR H 1.0 1.8 5.23 15 14 A 27 TYR H A 26 LEU HA 1.0 1.8 2.56 16 15 A 23 ILE HA A 24 ARG H 1.0 1.8 2.93 17 16 A 23 ILE H A 22 GLY HAx 1.0 1.8 3.33 18 17 A 6 CYS H A 5 TYR HBx 1.0 1.8 4.21 19 17 A 6 CYS H A 5 TYR HBy 1.0 1.8 4.21 20 18 A 10 HIS HA A 11 CYS H 1.0 1.8 2.68 21 19 A 11 CYS H A 10 HIS HBy 1.0 1.8 3.67 22 20 A 4 CYS HA A 5 TYR H 1.0 1.8 2.59 23 21 A 5 TYR H A 4 CYS HBy 1.0 1.8 4.07 24 22 A 5 TYR H A 4 CYS HBx 1.0 1.8 2.96 25 23 A 4 CYS H A 3 LEU HBx 1.0 1.8 4.55 26 23 A 3 LEU HBy A 4 CYS H 1.0 1.8 4.55 27 24 A 4 CYS H A 3 LEU HA 1.0 1.8 2.52 28 25 A 15 GLU HA A 16 ARG H 1.0 1.8 2.62 29 26 A 16 ARG H A 15 GLU HBx 1.0 1.8 3.52 30 27 A 16 ARG HA A 17 VAL H 1.0 1.8 2.40 31 28 A 17 VAL H A 16 ARG HBx 1.0 1.8 4.45 32 28 A 17 VAL H A 16 ARG HBy 1.0 1.8 4.45 33 29 A 28 CYS HBx A 29 CYS H 1.0 1.8 4.60 34 30 A 29 CYS H A 28 CYS HA 1.0 1.8 2.46 35 31 A 27 TYR HBx A 28 CYS H 1.0 1.8 4.11 36 32 A 5 TYR H A 29 CYS HA 1.0 1.8 3.67 37 33 A 5 TYR H A 28 CYS H 1.0 1.8 2.83 38 34 A 4 CYS HA A 29 CYS HA 1.0 1.8 4.38 39 35 A 6 CYS HA A 28 CYS H 1.0 1.8 3.70 40 36 A 6 CYS HA A 27 TYR HA 1.0 1.8 3.92 41 37 A 7 GLY H A 27 TYR HA 1.0 1.8 4.48 42 38 A 7 GLY H A 26 LEU H 1.0 1.8 3.48 43 39 A 16 ARG H A 29 CYS H 1.0 1.8 3.02 44 40 A 28 CYS HA A 18 ARG H 1.0 1.8 4.94 45 41 A 23 ILE H A 25 PHE H 1.0 1.8 4.94 46 42 A 19 GLY H A 27 TYR H 1.0 1.8 3.89 47 43 A 20 THR HA A 27 TYR H 1.0 1.8 3.21 48 44 A 21 CYS H A 26 LEU HA 1.0 1.8 3.48 49 45 A 25 PHE H A 24 ARG HA 1.0 1.8 3.52 50 46 A 19 GLY H A 18 ARG H 1.0 1.8 2.83 51 47 A 31 ARG H A 30 PRO HBy 1.0 1.8 3.67 52 48 A 24 ARG H A 23 ILE HB 1.0 1.8 3.48 53 49 A 21 CYS H A 25 PHE HBy 1.0 1.8 3.95 54 50 A 25 PHE HA A 9 GLY H 1.0 1.8 3.61 55 51 A 13 ARG HA A 14 GLY H 1.0 1.8 2.83 56 52 A 11 CYS HBx A 12 LYS H 1.0 1.8 2.71 57 53 A 24 ARG H A 25 PHE H 1.0 1.8 2.90 58 54 A 31 ARG H A 32 ARG H 1.0 1.8 3.45 59 55 A 8 LYS H A 10 HIS H 1.0 1.8 3.79 60 56 A 21 CYS H A 22 GLY H 1.0 1.8 3.55 61 57 A 21 CYS H A 25 PHE H 1.0 1.8 4.54 62 58 A 7 GLY H A 28 CYS H 1.0 1.8 3.83 63 59 A 23 ILE H A 22 GLY HAy 1.0 1.8 3.33 64 60 A 2 LEU HA A 3 LEU H 1.0 1.8 2.74 65 61 A 12 LYS H A 11 CYS HBy 1.0 1.8 3.42 66 62 A 12 LYS H A 11 CYS HA 1.0 1.8 2.90 67 63 A 13 ARG H A 12 LYS HBy 1.0 1.8 4.14 68 63 A 12 LYS HBx A 13 ARG H 1.0 1.8 4.14 69 64 A 13 ARG H A 12 LYS HA 1.0 1.8 2.62 70 65 A 15 GLU HA A 31 ARG H 1.0 1.8 3.30 71 66 A 13 ARG HA A 15 GLU H 1.0 1.8 4.60 72 67 A 10 HIS H A 9 GLY HAx 1.0 1.8 3.64 73 68 A 10 HIS H A 9 GLY HAy 1.0 1.8 3.64 74 69 A 31 ARG H A 30 PRO HBx 1.0 1.8 3.67 75 70 A 16 ARG H A 30 PRO HA 1.0 1.8 5.50 76 71 A 31 ARG H A 30 PRO HA 1.0 1.8 2.43 77 72 A 14 GLY H A 15 GLU H 1.0 1.8 4.01 78 73 A 18 ARG H A 17 VAL HA 1.0 1.8 2.40 79 74 A 19 GLY H A 18 ARG HDx 1.0 1.8 6.38 80 74 A 19 GLY H A 18 ARG HDy 1.0 1.8 6.38 81 75 A 19 GLY H A 18 ARG HGy 1.0 1.8 6.38 82 75 A 19 GLY H A 18 ARG HGx 1.0 1.8 6.38 83 76 A 27 TYR H A 26 LEU HG 1.0 1.8 3.89 84 77 A 17 VAL H A 16 ARG HGx 1.0 1.8 6.38 85 77 A 17 VAL H A 16 ARG HGy 1.0 1.8 6.38 86 78 A 29 CYS H A 16 ARG HBx 1.0 1.8 5.54 87 78 A 16 ARG HBy A 29 CYS H 1.0 1.8 5.54 88 79 A 5 TYR HD% A 28 CYS HBy 1.0 1.8 7.64 89 80 A 28 CYS HBy A 5 TYR HE% 1.0 1.8 6.92 90 81 A 27 TYR HD% A 18 ARG HBx 1.0 1.8 8.05 91 81 A 18 ARG HBy A 27 TYR HD% 1.0 1.8 8.05 92 82 A 4 CYS HBy A 27 TYR HE% 1.0 1.8 6.76 93 83 A 4 CYS HBy A 27 TYR HD% 1.0 1.8 6.74 94 84 A 4 CYS HBx A 27 TYR HE% 1.0 1.8 7.63 95 85 A 19 GLY H A 27 TYR HBy 1.0 1.8 4.69 96 86 A 5 TYR HE% A 7 GLY HAy 1.0 1.8 6.21 97 87 A 5 TYR HD% A 7 GLY HAy 1.0 1.8 6.93 98 88 A 5 TYR HE% A 7 GLY HAx 1.0 1.8 6.21 99 89 A 5 TYR HD% A 7 GLY HAx 1.0 1.8 6.93 100 90 A 4 CYS HA A 5 TYR HD% 1.0 1.8 7.21 101 91 A 8 LYS HA A 25 PHE HD% 1.0 1.8 7.19 102 92 A 6 CYS H A 5 TYR HD% 1.0 1.8 6.99 103 93 A 28 CYS H A 27 TYR HD% 1.0 1.8 7.58 104 94 A 6 CYS H A 5 TYR HE% 1.0 1.8 7.63 105 95 A 28 CYS HBx A 11 CYS HBx 1.0 1.8 3.92 106 96 A 11 CYS HBx A 15 GLU HBy 1.0 1.8 3.92 107 97 A 13 ARG H A 12 LYS HGx 1.0 1.8 6.07 108 97 A 13 ARG H A 12 LYS HGy 1.0 1.8 6.07 109 98 A 13 ARG H A 12 LYS HDx 1.0 1.8 6.13 110 98 A 13 ARG H A 12 LYS HDy 1.0 1.8 6.13 111 99 A 5 TYR H A 28 CYS HBy 1.0 1.8 4.69 112 100 A 4 CYS HA A 30 PRO HDy 1.0 1.8 5.16 113 101 A 4 CYS HA A 30 PRO HDx 1.0 1.8 5.16 114 102 A 29 CYS HA A 30 PRO HDy 1.0 1.8 3.08 115 103 A 29 CYS HA A 30 PRO HDx 1.0 1.8 3.08 116 104 A 25 PHE HD% A 8 LYS HBx 1.0 1.8 8.50 117 104 A 25 PHE HD% A 8 LYS HBy 1.0 1.8 8.50 118 105 A 25 PHE HE% A 8 LYS HBx 1.0 1.8 8.50 119 105 A 8 LYS HBy A 25 PHE HE% 1.0 1.8 8.50 120 106 A 6 CYS HA A 27 TYR HD% 1.0 1.8 7.64 121 107 A 7 GLY H A 25 PHE HBx 1.0 1.8 5.50 122 108 A 28 CYS HBx A 5 TYR HE% 1.0 1.8 7.26 123 109 A 27 TYR HE% A 18 ARG HBx 1.0 1.8 8.51 124 109 A 18 ARG HBy A 27 TYR HE% 1.0 1.8 8.51 125 110 A 28 CYS HBx A 5 TYR HD% 1.0 1.8 7.64 126 111 A 15 GLU HBx A 11 CYS HBx 1.0 1.8 4.79 127 112 A 18 ARG H A 17 VAL HGx% 1.0 1.8 6.29 128 112 A 18 ARG H A 17 VAL HGy% 1.0 1.8 6.29 129 113 A 21 CYS H A 20 THR HG2% 1.0 1.8 5.88 130 114 A 27 TYR H A 26 LEU HDx% 1.0 1.8 7.63 131 114 A 27 TYR H A 26 LEU HDy% 1.0 1.8 7.63 132 115 A 24 ARG H A 23 ILE HG2% 1.0 1.8 5.38 133 116 A 11 CYS H A 26 LEU HDx% 1.0 1.8 7.63 134 116 A 11 CYS H A 26 LEU HDy% 1.0 1.8 7.63 135 117 A 19 GLY H A 17 VAL HGx% 1.0 1.8 5.76 136 117 A 19 GLY H A 17 VAL HGy% 1.0 1.8 5.76 137 118 A 26 LEU HA A 20 THR HG2% 1.0 1.8 6.53 138 119 A 18 ARG HA A 17 VAL HGx% 1.0 1.8 6.66 139 119 A 18 ARG HA A 17 VAL HGy% 1.0 1.8 6.66 140 120 A 17 VAL HA A 26 LEU HDx% 1.0 1.8 7.45 141 120 A 17 VAL HA A 26 LEU HDy% 1.0 1.8 7.45 142 121 A 27 TYR H A 17 VAL HGx% 1.0 1.8 7.34 143 121 A 27 TYR H A 17 VAL HGy% 1.0 1.8 7.34 144 122 A 10 HIS HA A 26 LEU HDx% 1.0 1.8 6.08 145 122 A 10 HIS HA A 26 LEU HDy% 1.0 1.8 6.08 146 123 A 20 THR HA A 26 LEU HDx% 1.0 1.8 7.54 147 123 A 20 THR HA A 26 LEU HDy% 1.0 1.8 7.54 148 124 A 4 CYS HA A 30 PRO HDy 1.0 1.8 4.65 149 124 A 4 CYS HA A 30 PRO HDx 1.0 1.8 4.65 150 125 A 5 TYR HD% A 7 GLY HAy 1.0 1.8 6.78 151 125 A 5 TYR HD% A 7 GLY HAx 1.0 1.8 6.78 152 126 A 5 TYR HE% A 7 GLY HAy 1.0 1.8 6.04 153 126 A 5 TYR HE% A 7 GLY HAx 1.0 1.8 6.04 154 127 A 8 LYS H A 7 GLY HAy 1.0 1.8 2.82 155 127 A 8 LYS H A 7 GLY HAx 1.0 1.8 2.82 156 128 A 25 PHE HD% A 8 LYS HDx 1.0 1.8 8.50 157 128 A 25 PHE HD% A 8 LYS HDy 1.0 1.8 8.50 158 129 A 25 PHE HE% A 8 LYS HDx 1.0 1.8 8.50 159 129 A 25 PHE HE% A 8 LYS HDy 1.0 1.8 8.50 160 130 A 25 PHE HZ A 8 LYS HDx 1.0 1.8 6.38 161 130 A 8 LYS HDy A 25 PHE HZ 1.0 1.8 6.38 162 131 A 11 CYS HBx A 15 GLU HGy 1.0 1.8 3.90 163 131 A 11 CYS HBx A 15 GLU HGx 1.0 1.8 3.90 164 132 A 12 LYS H A 15 GLU HGy 1.0 1.8 6.38 165 132 A 12 LYS H A 15 GLU HGx 1.0 1.8 6.38 166 133 A 15 GLU HBy A 30 PRO HBx 1.0 1.8 3.93 167 133 A 15 GLU HBy A 30 PRO HBy 1.0 1.8 3.93 168 134 A 16 ARG H A 15 GLU HGy 1.0 1.8 6.38 169 134 A 16 ARG H A 15 GLU HGx 1.0 1.8 6.38 170 135 A 27 TYR HD% A 18 ARG HGy 1.0 1.8 7.00 171 135 A 18 ARG HGx A 27 TYR HD% 1.0 1.8 7.00 172 136 A 27 TYR HE% A 18 ARG HGy 1.0 1.8 8.51 173 136 A 18 ARG HGx A 27 TYR HE% 1.0 1.8 8.51 174 137 A 20 THR H A 19 GLY HAy 1.0 1.8 3.20 175 137 A 19 GLY HAx A 20 THR H 1.0 1.8 3.20 176 138 A 23 ILE H A 22 GLY HAy 1.0 1.8 2.98 177 138 A 23 ILE H A 22 GLY HAx 1.0 1.8 2.98 178 139 A 25 PHE HD% A 22 GLY HAy 1.0 1.8 8.50 179 139 A 25 PHE HD% A 22 GLY HAx 1.0 1.8 8.50 180 140 A 29 CYS HA A 30 PRO HDy 1.0 1.8 2.84 181 140 A 29 CYS HA A 30 PRO HDx 1.0 1.8 2.84 182 141 A 29 CYS HBx A 30 PRO HDy 1.0 1.8 5.39 183 141 A 29 CYS HBy A 30 PRO HDy 1.0 1.8 5.39 184 141 A 30 PRO HDx A 29 CYS HBy 1.0 1.8 5.39 185 141 A 30 PRO HDx A 29 CYS HBx 1.0 1.8 5.39 186 142 A 32 ARG H A 30 PRO HBx 1.0 1.8 5.04 187 142 A 32 ARG H A 30 PRO HBy 1.0 1.8 5.04 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _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 5 TYR H A 28 CYS O 1.0 1.8 2.0 2 2 A 28 CYS O A 5 TYR N 1.0 1.8 3.0 3 3 A 28 CYS H A 5 TYR O 1.0 1.8 2.0 4 4 A 5 TYR O A 28 CYS N 1.0 1.8 3.0 5 5 A 7 GLY H A 26 LEU O 1.0 1.8 2.0 6 6 A 26 LEU O A 7 GLY N 1.0 1.8 3.0 7 7 A 26 LEU H A 7 GLY O 1.0 1.8 2.0 8 8 A 7 GLY O A 26 LEU N 1.0 1.8 3.0 9 9 A 12 LYS H A 15 GLU OE2 1.0 1.8 2.0 10 9 A 12 LYS H A 15 GLU OE1 1.0 1.8 2.0 11 10 A 15 GLU OE2 A 12 LYS N 1.0 1.8 3.0 12 10 A 15 GLU OE1 A 12 LYS N 1.0 1.8 3.0 13 11 A 15 GLU H A 12 LYS O 1.0 1.8 2.0 14 12 A 12 LYS O A 15 GLU N 1.0 1.8 3.0 15 13 A 16 ARG H A 29 CYS O 1.0 1.8 2.0 16 14 A 29 CYS O A 16 ARG N 1.0 1.8 3.0 17 15 A 29 CYS H A 16 ARG O 1.0 1.8 2.0 18 16 A 16 ARG O A 29 CYS N 1.0 1.8 3.0 19 17 A 27 TYR H A 19 GLY O 1.0 1.8 2.0 20 18 A 19 GLY O A 27 TYR N 1.0 1.8 3.0 21 19 A 21 CYS H A 25 PHE O 1.0 1.8 2.0 22 20 A 25 PHE O A 21 CYS N 1.0 1.8 3.0 23 21 A 25 PHE H A 22 GLY O 1.0 1.8 2.0 24 22 A 22 GLY O A 25 PHE N 1.0 1.8 3.0 25 23 A 18 ARG H A 27 TYR O 1.0 1.8 2.0 26 24 A 27 TYR O A 18 ARG N 1.0 1.8 3.0 27 25 A 10 HIS H A 8 LYS O 1.0 1.8 2.0 28 26 A 8 LYS O A 10 HIS N 1.0 1.8 3.0 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 LEU C A 3 LEU N A 3 LEU CA A 3 LEU C 1.0 -180.0 -20.0 PHI 2 2 A 3 LEU C A 4 CYS N A 4 CYS CA A 4 CYS C 1.0 -180.0 -20.0 PHI 3 3 A 4 CYS C A 5 TYR N A 5 TYR CA A 5 TYR C 1.0 -160.0 -80.0 PHI 4 4 A 5 TYR C A 6 CYS N A 6 CYS CA A 6 CYS C 1.0 -160.0 -80.0 PHI 5 5 A 7 GLY C A 8 LYS N A 8 LYS CA A 8 LYS C 1.0 -90.0 -30.0 PHI 6 6 A 9 GLY C A 10 HIS N A 10 HIS CA A 10 HIS C 1.0 -180.0 -20.0 PHI 7 7 A 10 HIS C A 11 CYS N A 11 CYS CA A 11 CYS C 1.0 -160.0 -80.0 PHI 8 8 A 11 CYS C A 12 LYS N A 12 LYS CA A 12 LYS C 1.0 -160.0 -80.0 PHI 9 9 A 12 LYS C A 13 ARG N A 13 ARG CA A 13 ARG C 1.0 -180.0 -20.0 PHI 10 10 A 14 GLY C A 15 GLU N A 15 GLU CA A 15 GLU C 1.0 -160.0 -80.0 PHI 11 11 A 15 GLU C A 16 ARG N A 16 ARG CA A 16 ARG C 1.0 -160.0 -80.0 PHI 12 12 A 16 ARG C A 17 VAL N A 17 VAL CA A 17 VAL C 1.0 -180.0 -20.0 PHI 13 13 A 17 VAL C A 18 ARG N A 18 ARG CA A 18 ARG C 1.0 -150.0 -90.0 PHI 14 14 A 19 GLY C A 20 THR N A 20 THR CA A 20 THR C 1.0 -150.0 -90.0 PHI 15 15 A 20 THR C A 21 CYS N A 21 CYS CA A 21 CYS C 1.0 -160.0 -80.0 PHI 16 16 A 22 GLY C A 23 ILE N A 23 ILE CA A 23 ILE C 1.0 -90.0 -30.0 PHI 17 17 A 23 ILE C A 24 ARG N A 24 ARG CA A 24 ARG C 1.0 10.0 90.0 PHI 18 18 A 24 ARG C A 25 PHE N A 25 PHE CA A 25 PHE C 1.0 -150.0 -90.0 PHI 19 19 A 25 PHE C A 26 LEU N A 26 LEU CA A 26 LEU C 1.0 -150.0 -90.0 PHI 20 20 A 26 LEU C A 27 TYR N A 27 TYR CA A 27 TYR C 1.0 -160.0 -80.0 PHI 21 21 A 27 TYR C A 28 CYS N A 28 CYS CA A 28 CYS C 1.0 -150.0 -90.0 PHI 22 22 A 28 CYS C A 29 CYS N A 29 CYS CA A 29 CYS C 1.0 -160.0 -80.0 PHI 23 23 A 30 PRO C A 31 ARG N A 31 ARG CA A 31 ARG C 1.0 -180.0 -20.0 PHI 24 24 A 4 CYS N A 4 CYS CA A 4 CYS CB A 4 CYS SG 1.0 -90.0 -30.0 CHI1 25 25 A 5 TYR N A 5 TYR CA A 5 TYR CB A 5 TYR CG 1.0 30.0 90.0 CHI1 26 26 A 10 HIS N A 10 HIS CA A 10 HIS CB A 10 HIS CG 1.0 30.0 90.0 CHI1 27 27 A 11 CYS N A 11 CYS CA A 11 CYS CB A 11 CYS SG 1.0 -90.0 -30.0 CHI1 28 28 A 25 PHE N A 25 PHE CA A 25 PHE CB A 25 PHE CG 1.0 -90.0 -30.0 CHI1 29 29 A 27 TYR N A 27 TYR CA A 27 TYR CB A 27 TYR CG 1.0 -210.0 -150.0 CHI1 30 30 A 28 CYS N A 28 CYS CA A 28 CYS CB A 28 CYS SG 1.0 -90.0 -30.0 CHI1 31 31 A 29 CYS N A 29 CYS CA A 29 CYS CB A 29 CYS SG 1.0 -90.0 -30.0 CHI1 stop_ save_