data_nef_c15983_2k9e 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 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 36 CYS SG 1 13 CYS SG 1 29 CYS SG 1 18 CYS SG 1 33 CYS SG 1 1 PFX C 1 2 ARG N 1 21 SER C 1 22 NLE N 1 22 NLE C 1 23 LYS N 1 36 CYS C 1 37 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 0 PFX start -OXT . 2 A 1 ARG middle . . 3 A 2 SER middle . . 4 A 3 CYS middle -HG . 5 A 4 ILE middle . . 6 A 5 ASP middle . . 7 A 6 THR middle . . 8 A 7 ILE middle . . 9 A 8 PRO middle . false 10 A 9 LYS middle . . 11 A 10 SER middle . . 12 A 11 ARG middle . . 13 A 12 CYS middle -HG . 14 A 13 THR middle . . 15 A 14 ALA middle . . 16 A 15 PHE middle . . 17 A 16 GLN middle . . 18 A 17 CYS middle -HG . 19 A 18 LYS middle . . 20 A 19 HIS middle . . 21 A 20 SER middle -OXT . 22 A 21 NLE middle -HN2,-OXT . 23 A 22 LYS middle -H2 . 24 A 23 TYR middle . . 25 A 24 ARG middle . . 26 A 25 LEU middle . . 27 A 26 SER middle . . 28 A 27 PHE middle . . 29 A 28 CYS middle -HG . 30 A 29 ARG middle . . 31 A 30 LYS middle . . 32 A 31 THR middle . . 33 A 32 CYS middle -HG . 34 A 33 GLY middle . false 35 A 34 THR middle . . 36 A 35 CYS middle -HG,-OXT . 37 A 36 NH2 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 0 PFX HA H 1 4.2 0.03 A 0 PFX HB2 H 1 3.19 0.03 A 0 PFX HB3 H 1 3.19 0.03 A 0 PFX HD1 H 1 7.73 0.03 A 0 PFX HD2 H 1 7.73 0.03 A 0 PFX HE1 H 1 7.36 0.03 A 0 PFX HE2 H 1 7.36 0.03 A 0 PFX CA C 13 58.69 0.3 A 1 ARG HBy H 1 1.87 0.03 A 1 ARG HBx H 1 1.75 0.03 A 1 ARG HD2 H 1 3.17 0.03 A 1 ARG HD3 H 1 3.17 0.03 A 1 ARG HE H 1 7.29 0.03 A 1 ARG HG2 H 1 1.62 0.03 A 1 ARG HG3 H 1 1.62 0.03 A 2 SER H H 1 8.44 0.03 A 2 SER HA H 1 4.37 0.03 A 2 SER HB2 H 1 3.82 0.03 A 2 SER HB3 H 1 3.82 0.03 A 2 SER CA C 13 58.74 0.3 A 2 SER N N 15 117.03 0.3 A 3 CYS H H 1 8.79 0.03 A 3 CYS HA H 1 4.82 0.03 A 3 CYS HB2 H 1 3.0 0.03 A 3 CYS HB3 H 1 3.0 0.03 A 3 CYS CA C 13 53.66 0.3 A 3 CYS N N 15 124.53 0.3 A 4 ILE H H 1 7.76 0.03 A 4 ILE HA H 1 4.65 0.03 A 4 ILE HB H 1 1.94 0.03 A 4 ILE HD1% H 1 0.81 0.03 A 4 ILE HG1y H 1 1.17 0.03 A 4 ILE HG1x H 1 0.98 0.03 A 4 ILE HG2% H 1 0.84 0.03 A 4 ILE CA C 13 60.18 0.3 A 4 ILE N N 15 120.38 0.3 A 5 ASP H H 1 8.61 0.03 A 5 ASP HA H 1 5.33 0.03 A 5 ASP HBy H 1 3.24 0.03 A 5 ASP HBx H 1 2.69 0.03 A 5 ASP CA C 13 54.73 0.3 A 5 ASP N N 15 115.73 0.3 A 6 THR H H 1 9.5 0.03 A 6 THR HA H 1 4.48 0.03 A 6 THR HB H 1 4.57 0.03 A 6 THR HG2% H 1 1.25 0.03 A 6 THR CA C 13 62.4 0.3 A 6 THR N N 15 112.78 0.3 A 7 ILE H H 1 7.24 0.03 A 7 ILE HA H 1 4.77 0.03 A 7 ILE HB H 1 1.84 0.03 A 7 ILE HD1% H 1 0.47 0.03 A 7 ILE HG1y H 1 1.33 0.03 A 7 ILE HG1x H 1 0.80 0.03 A 7 ILE HG2% H 1 0.40 0.03 A 7 ILE CA C 13 60.19 0.3 A 7 ILE N N 15 120.62 0.3 A 8 PRO HA H 1 4.27 0.03 A 8 PRO HBy H 1 2.43 0.03 A 8 PRO HBx H 1 1.75 0.03 A 8 PRO HDy H 1 3.81 0.03 A 8 PRO HDx H 1 3.38 0.03 A 8 PRO HGy H 1 2.07 0.03 A 8 PRO HGx H 1 1.96 0.03 A 8 PRO CA C 13 64.02 0.3 A 9 LYS H H 1 8.34 0.03 A 9 LYS HA H 1 3.87 0.03 A 9 LYS HBx H 1 1.78 0.03 A 9 LYS HBy H 1 1.86 0.03 A 9 LYS HD2 H 1 1.68 0.03 A 9 LYS HD3 H 1 1.68 0.03 A 9 LYS HE2 H 1 3.25 0.03 A 9 LYS HE3 H 1 3.25 0.03 A 9 LYS HG2 H 1 1.49 0.03 A 9 LYS HG3 H 1 1.49 0.03 A 9 LYS HZ1 H 1 7.34 0.03 A 9 LYS HZ2 H 1 7.34 0.03 A 9 LYS HZ3 H 1 7.34 0.03 A 9 LYS C C 13 60.26 0.3 A 9 LYS N N 15 124.13 0.3 A 10 SER H H 1 8.44 0.03 A 10 SER HA H 1 4.1 0.03 A 10 SER HB2 H 1 3.91 0.03 A 10 SER HB3 H 1 3.91 0.03 A 10 SER CA C 13 60.77 0.3 A 10 SER N N 15 114.16 0.3 A 11 ARG H H 1 8.13 0.03 A 11 ARG HA H 1 4.43 0.03 A 11 ARG HBy H 1 2.28 0.03 A 11 ARG HBx H 1 1.93 0.03 A 11 ARG HDy H 1 3.27 0.03 A 11 ARG HDx H 1 3.13 0.03 A 11 ARG HE H 1 7.45 0.03 A 11 ARG HG2 H 1 1.75 0.03 A 11 ARG HG3 H 1 1.75 0.03 A 11 ARG HH11 H 1 7.24 0.03 A 11 ARG HH12 H 1 7.24 0.03 A 11 ARG CA C 13 56.82 0.3 A 11 ARG N N 15 118.92 0.3 A 12 CYS H H 1 7.98 0.03 A 12 CYS HA H 1 5.03 0.03 A 12 CYS HBy H 1 3.27 0.03 A 12 CYS HBx H 1 2.91 0.03 A 12 CYS CA C 13 56.25 0.3 A 12 CYS N N 15 122.66 0.3 A 13 THR H H 1 7.26 0.03 A 13 THR HA H 1 4.38 0.03 A 13 THR HB H 1 4.75 0.03 A 13 THR HG1 H 1 5.78 0.03 A 13 THR HG2% H 1 1.31 0.03 A 13 THR CA C 13 60.24 0.3 A 13 THR N N 15 110.44 0.3 A 14 ALA H H 1 8.86 0.03 A 14 ALA HA H 1 3.99 0.03 A 14 ALA HB% H 1 1.47 0.03 A 14 ALA CA C 13 55.78 0.3 A 14 ALA N N 15 124.10 0.3 A 15 PHE H H 1 8.52 0.03 A 15 PHE HA H 1 4.14 0.03 A 15 PHE HBy H 1 3.24 0.03 A 15 PHE HBx H 1 2.88 0.03 A 15 PHE HD1 H 1 7.09 0.03 A 15 PHE HD2 H 1 7.09 0.03 A 15 PHE HE1 H 1 7.06 0.03 A 15 PHE HE2 H 1 7.06 0.03 A 15 PHE HZ H 1 6.85 0.03 A 15 PHE CA C 13 62.45 0.3 A 15 PHE N N 15 117.05 0.3 A 16 GLN H H 1 7.82 0.03 A 16 GLN HA H 1 4.15 0.03 A 16 GLN HBy H 1 1.97 0.03 A 16 GLN HBx H 1 1.51 0.03 A 16 GLN HE2x H 1 6.37 0.03 A 16 GLN HE2y H 1 6.48 0.03 A 16 GLN HGx H 1 2.28 0.03 A 16 GLN HGy H 1 2.34 0.03 A 16 GLN CA C 13 58.81 0.3 A 16 GLN N N 15 119.45 0.3 A 17 CYS H H 1 8.53 0.03 A 17 CYS HA H 1 4.23 0.03 A 17 CYS HBy H 1 3.23 0.03 A 17 CYS HBx H 1 2.94 0.03 A 17 CYS CA C 13 57.13 0.3 A 17 CYS N N 15 114.86 0.3 A 18 LYS H H 1 7.57 0.03 A 18 LYS HA H 1 4.01 0.03 A 18 LYS HBy H 1 1.58 0.03 A 18 LYS HBx H 1 1.41 0.03 A 18 LYS HD2 H 1 0.98 0.03 A 18 LYS HD3 H 1 0.98 0.03 A 18 LYS HE2 H 1 2.94 0.03 A 18 LYS HE3 H 1 2.94 0.03 A 18 LYS HG2 H 1 1.16 0.03 A 18 LYS HG3 H 1 1.16 0.03 A 18 LYS CA C 13 55.85 0.3 A 18 LYS N N 15 115.60 0.3 A 19 HIS H H 1 7.78 0.03 A 19 HIS HA H 1 4.48 0.03 A 19 HIS HBy H 1 3.08 0.03 A 19 HIS HBx H 1 2.35 0.03 A 19 HIS HD1 H 1 8.34 0.03 A 19 HIS HD2 H 1 8.34 0.03 A 19 HIS HE1 H 1 6.55 0.03 A 19 HIS CA C 13 57.66 0.3 A 19 HIS N N 15 113.02 0.3 A 20 SER H H 1 8.31 0.03 A 20 SER HA H 1 4.99 0.03 A 20 SER HBx H 1 3.86 0.03 A 20 SER HBy H 1 4.07 0.03 A 20 SER CA C 13 59.19 0.3 A 20 SER N N 15 119.4 0.3 A 21 NLE H H 1 8.99 0.03 A 21 NLE HA H 1 3.85 0.03 A 21 NLE HB2 H 1 1.77 0.03 A 21 NLE HB3 H 1 1.77 0.03 A 21 NLE HDy H 1 0.86 0.03 A 21 NLE HDx H 1 0.66 0.03 A 21 NLE HGx H 1 1.30 0.03 A 21 NLE HGy H 1 1.35 0.03 A 21 NLE CA C 13 60.66 0.3 A 21 NLE N N 15 132.41 0.3 A 22 LYS H H 1 8.21 0.03 A 22 LYS HA H 1 3.83 0.03 A 22 LYS HBx H 1 1.42 0.03 A 22 LYS HBy H 1 1.66 0.03 A 22 LYS HD2 H 1 1.00 0.03 A 22 LYS HD3 H 1 1.00 0.03 A 22 LYS HE2 H 1 2.81 0.03 A 22 LYS HE3 H 1 2.81 0.03 A 22 LYS HG2 H 1 1.54 0.03 A 22 LYS HG3 H 1 1.54 0.03 A 22 LYS HZ1 H 1 7.48 0.03 A 22 LYS HZ2 H 1 7.48 0.03 A 22 LYS HZ3 H 1 7.48 0.03 A 22 LYS CA C 13 51.39 0.3 A 22 LYS N N 15 118.1 0.3 A 23 TYR H H 1 7.99 0.03 A 23 TYR HA H 1 4.01 0.03 A 23 TYR HBy H 1 3.33 0.03 A 23 TYR HBx H 1 2.60 0.03 A 23 TYR HD1 H 1 7.48 0.03 A 23 TYR HD2 H 1 7.48 0.03 A 23 TYR HE1 H 1 6.93 0.03 A 23 TYR HE2 H 1 6.93 0.03 A 23 TYR CA C 13 57.98 0.3 A 23 TYR N N 15 120.07 0.3 A 24 ARG H H 1 8.09 0.03 A 24 ARG HA H 1 3.95 0.03 A 24 ARG HBy H 1 2.23 0.03 A 24 ARG HBx H 1 1.78 0.03 A 24 ARG HDx H 1 3.19 0.03 A 24 ARG HDy H 1 3.39 0.03 A 24 ARG HE H 1 7.33 0.03 A 24 ARG HGy H 1 1.68 0.03 A 24 ARG HGx H 1 1.52 0.03 A 24 ARG HH11 H 1 6.52 0.03 A 24 ARG HH12 H 1 6.52 0.03 A 24 ARG HH21 H 1 6.77 0.03 A 24 ARG HH22 H 1 6.77 0.03 A 24 ARG CA C 13 60.66 0.3 A 24 ARG N N 15 117.34 0.3 A 25 LEU H H 1 8.34 0.03 A 25 LEU HA H 1 4.46 0.03 A 25 LEU HBy H 1 1.78 0.03 A 25 LEU HBx H 1 1.48 0.03 A 25 LEU HD1% H 1 0.86 0.03 A 25 LEU HD2% H 1 0.86 0.03 A 25 LEU HG H 1 1.68 0.03 A 25 LEU CA C 13 57.67 0.3 A 25 LEU N N 15 111.65 0.3 A 26 SER H H 1 7.48 0.03 A 26 SER HA H 1 4.77 0.03 A 26 SER HBy H 1 3.57 0.03 A 26 SER HBx H 1 3.45 0.03 A 26 SER CA C 13 58.89 0.3 A 26 SER N N 15 120.33 0.3 A 27 PHE H H 1 7.57 0.03 A 27 PHE HA H 1 5.31 0.03 A 27 PHE HBy H 1 3.20 0.03 A 27 PHE HBx H 1 2.56 0.03 A 27 PHE HD1 H 1 6.19 0.03 A 27 PHE HD2 H 1 6.19 0.03 A 27 PHE HE1 H 1 7.12 0.03 A 27 PHE HE2 H 1 7.12 0.03 A 27 PHE HZ H 1 7.19 0.03 A 27 PHE CA C 13 57.1 0.3 A 27 PHE N N 15 119.10 0.3 A 28 CYS H H 1 8.7 0.03 A 28 CYS HA H 1 5.85 0.03 A 28 CYS HBy H 1 3.29 0.03 A 28 CYS HBx H 1 3.18 0.03 A 28 CYS CA C 13 54.17 0.3 A 28 CYS N N 15 116.94 0.3 A 29 ARG H H 1 8.45 0.03 A 29 ARG HA H 1 3.93 0.03 A 29 ARG HBy H 1 1.76 0.03 A 29 ARG HBx H 1 1.66 0.03 A 29 ARG HDx H 1 3.29 0.03 A 29 ARG HDy H 1 3.39 0.03 A 29 ARG HE H 1 7.17 0.03 A 29 ARG HG2 H 1 1.49 0.03 A 29 ARG HG3 H 1 1.49 0.03 A 29 ARG HH11 H 1 6.65 0.03 A 29 ARG HH12 H 1 6.65 0.03 A 29 ARG HH21 H 1 7.21 0.03 A 29 ARG HH22 H 1 7.21 0.03 A 29 ARG CA C 13 60.33 0.3 A 29 ARG N N 15 119.05 0.3 A 30 LYS H H 1 7.25 0.03 A 30 LYS HA H 1 4.15 0.03 A 30 LYS HB2 H 1 1.84 0.03 A 30 LYS HB3 H 1 1.84 0.03 A 30 LYS HD2 H 1 1.66 0.03 A 30 LYS HD3 H 1 1.66 0.03 A 30 LYS HE2 H 1 3.01 0.03 A 30 LYS HE3 H 1 3.01 0.03 A 30 LYS HG2 H 1 1.32 0.03 A 30 LYS HG3 H 1 1.32 0.03 A 30 LYS HZ1 H 1 7.49 0.03 A 30 LYS HZ2 H 1 7.49 0.03 A 30 LYS HZ3 H 1 7.49 0.03 A 30 LYS CA C 13 59.02 0.3 A 30 LYS N N 15 116.24 0.3 A 31 THR H H 1 10.89 0.03 A 31 THR HA H 1 3.86 0.03 A 31 THR HB H 1 4.07 0.03 A 31 THR HG2% H 1 1.31 0.03 A 31 THR CA C 13 60.65 0.3 A 31 THR N N 15 124.41 0.3 A 32 CYS H H 1 9.13 0.03 A 32 CYS HA H 1 4.79 0.03 A 32 CYS HBy H 1 3.33 0.03 A 32 CYS HBx H 1 2.93 0.03 A 32 CYS CA C 13 55.24 0.3 A 32 CYS N N 15 114.2 0.3 A 33 GLY H H 1 7.82 0.03 A 33 GLY HA2 H 1 4.05 0.03 A 33 GLY HA3 H 1 4.05 0.03 A 33 GLY CA C 13 46.96 0.3 A 33 GLY N N 15 109.12 0.3 A 34 THR H H 1 8.61 0.03 A 34 THR HA H 1 4.16 0.03 A 34 THR HB H 1 4.43 0.03 A 34 THR HG2% H 1 1.15 0.03 A 34 THR CA C 13 63.1 0.3 A 34 THR N N 15 123.2 0.3 A 35 CYS H H 1 8.04 0.03 A 35 CYS HA H 1 4.56 0.03 A 35 CYS HBx H 1 3.08 0.03 A 35 CYS HBy H 1 3.31 0.03 A 35 CYS CA C 13 54.59 0.03 A 36 NH2 HNy H 1 7.64 0.3 A 36 NH2 HNx H 1 7.17 0.3 A 36 NH2 N N 15 117.51 0.3 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 undefined _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 12 CYS SG A 28 CYS SG 1.0 1.92 2.12 2 2 A 3 CYS SG A 35 CYS SG 1.0 1.92 2.12 3 3 A 17 CYS SG A 32 CYS SG 1.0 1.92 2.12 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 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 2 SER HA A 2 SER HB2 1.0 1.8 3.50 2 1 A 2 SER HA A 2 SER HB3 1.0 1.8 3.50 3 2 A 3 CYS H A 3 CYS HB2 1.0 1.8 3.37 4 2 A 3 CYS H A 3 CYS HB3 1.0 1.8 3.37 5 3 A 4 ILE HA A 4 ILE HD1% 1.0 1.8 4.73 6 4 A 4 ILE HA A 4 ILE HG2% 1.0 1.8 4.15 7 5 A 4 ILE HA A 4 ILE HG1y 1.0 1.8 3.97 8 5 A 4 ILE HA A 4 ILE HG1x 1.0 1.8 3.97 9 6 A 4 ILE HD1% A 4 ILE HG2% 1.0 1.8 3.50 10 7 A 4 ILE HD1% A 4 ILE HG2% 1.0 1.8 3.81 11 8 A 4 ILE H A 4 ILE HG2% 1.0 1.8 4.63 12 9 A 4 ILE H A 4 ILE HG1y 1.0 1.8 3.60 13 9 A 4 ILE HG1x A 4 ILE H 1.0 1.8 3.60 14 10 A 5 ASP HA A 5 ASP HBx 1.0 1.8 3.50 15 10 A 5 ASP HA A 5 ASP HBy 1.0 1.8 3.50 16 11 A 5 ASP HA A 5 ASP HBy 1.0 1.8 3.50 17 12 A 5 ASP H A 5 ASP HBx 1.0 1.8 4.58 18 13 A 5 ASP HBy A 5 ASP H 1.0 1.8 4.58 19 14 A 5 ASP H A 5 ASP HBx 1.0 1.8 4.31 20 14 A 5 ASP HBy A 5 ASP H 1.0 1.8 4.31 21 15 A 6 THR H A 6 THR HG2% 1.0 1.8 3.34 22 16 A 7 ILE HA A 7 ILE HB 1.0 1.8 3.02 23 17 A 7 ILE HB A 7 ILE HG1y 1.0 1.8 2.64 24 17 A 7 ILE HB A 7 ILE HG1x 1.0 1.8 2.64 25 18 A 7 ILE HD1% A 7 ILE HG1y 1.0 1.8 3.50 26 18 A 7 ILE HG1x A 7 ILE HD1% 1.0 1.8 3.50 27 19 A 7 ILE HD1% A 7 ILE HG1y 1.0 1.8 4.61 28 19 A 7 ILE HG1x A 7 ILE HD1% 1.0 1.8 4.61 29 20 A 7 ILE HG2% A 7 ILE HG1y 1.0 1.8 2.69 30 20 A 7 ILE HG1x A 7 ILE HG2% 1.0 1.8 2.69 31 21 A 7 ILE HB A 7 ILE H 1.0 1.8 4.20 32 22 A 7 ILE HD1% A 7 ILE H 1.0 1.8 5.18 33 23 A 7 ILE HG2% A 7 ILE H 1.0 1.8 3.27 34 24 A 7 ILE HD1% A 7 ILE HG1y 1.0 1.8 3.73 35 24 A 7 ILE HG1x A 7 ILE HD1% 1.0 1.8 3.73 36 25 A 8 PRO HA A 8 PRO HDy 1.0 1.8 5.00 37 26 A 8 PRO HA A 8 PRO HDx 1.0 1.8 5.00 38 27 A 8 PRO HA A 8 PRO HGx 1.0 1.8 4.50 39 28 A 8 PRO HA A 8 PRO HGy 1.0 1.8 4.50 40 29 A 8 PRO HA A 8 PRO HBy 1.0 1.8 3.50 41 30 A 8 PRO HBy A 8 PRO HGx 1.0 1.8 3.50 42 30 A 8 PRO HGx A 8 PRO HBx 1.0 1.8 3.50 43 31 A 9 LYS HA A 9 LYS HG2 1.0 1.8 3.84 44 31 A 9 LYS HA A 9 LYS HG3 1.0 1.8 3.84 45 32 A 9 LYS HG3 A 9 LYS HBx 1.0 1.8 3.50 46 32 A 9 LYS HBx A 9 LYS HG2 1.0 1.8 3.50 47 33 A 9 LYS HBx A 9 LYS HE2 1.0 1.8 5.06 48 33 A 9 LYS HBy A 9 LYS HE2 1.0 1.8 5.06 49 33 A 9 LYS HE3 A 9 LYS HBy 1.0 1.8 5.06 50 33 A 9 LYS HBx A 9 LYS HE3 1.0 1.8 5.06 51 34 A 9 LYS H A 9 LYS HBy 1.0 1.8 3.68 52 34 A 9 LYS HBx A 9 LYS H 1.0 1.8 3.68 53 35 A 9 LYS H A 9 LYS HD2 1.0 1.8 3.97 54 35 A 9 LYS H A 9 LYS HD3 1.0 1.8 3.97 55 36 A 9 LYS H A 9 LYS HE2 1.0 1.8 5.96 56 36 A 9 LYS HE3 A 9 LYS H 1.0 1.8 5.96 57 37 A 9 LYS H A 9 LYS HG2 1.0 1.8 4.05 58 37 A 9 LYS HG3 A 9 LYS H 1.0 1.8 4.05 59 38 A 10 SER HA A 10 SER HB2 1.0 1.8 3.70 60 38 A 10 SER HA A 10 SER HB3 1.0 1.8 3.70 61 39 A 10 SER HA A 10 SER H 1.0 1.8 2.90 62 40 A 11 ARG HA A 11 ARG HDx 1.0 1.8 5.69 63 41 A 11 ARG HA A 11 ARG HDy 1.0 1.8 5.69 64 42 A 11 ARG HA A 11 ARG HDx 1.0 1.8 5.41 65 42 A 11 ARG HA A 11 ARG HDy 1.0 1.8 5.41 66 43 A 11 ARG HA A 11 ARG HG2 1.0 1.8 4.19 67 43 A 11 ARG HA A 11 ARG HG3 1.0 1.8 4.19 68 44 A 11 ARG HDy A 11 ARG HBx 1.0 1.8 4.50 69 44 A 11 ARG HBx A 11 ARG HDx 1.0 1.8 4.50 70 45 A 11 ARG HH1% A 11 ARG HBx 1.0 1.8 6.50 71 46 A 11 ARG HH1% A 11 ARG HBy 1.0 1.8 6.50 72 47 A 11 ARG HH1% A 11 ARG HDx 1.0 1.8 5.00 73 48 A 11 ARG HDy A 11 ARG HH1% 1.0 1.8 5.00 74 49 A 11 ARG HH1% A 11 ARG HDx 1.0 1.8 5.09 75 49 A 11 ARG HDy A 11 ARG HH1% 1.0 1.8 5.09 76 50 A 11 ARG HH1% A 11 ARG HG2 1.0 1.8 4.50 77 50 A 11 ARG HG3 A 11 ARG HH1% 1.0 1.8 4.50 78 51 A 11 ARG H A 11 ARG HBx 1.0 1.7 3.73 79 51 A 11 ARG H A 11 ARG HBy 1.0 1.7 3.73 80 52 A 11 ARG H A 11 ARG HDx 1.0 1.8 5.91 81 53 A 11 ARG HDy A 11 ARG H 1.0 1.8 5.91 82 54 A 11 ARG H A 11 ARG HDx 1.0 1.8 5.46 83 54 A 11 ARG HDy A 11 ARG H 1.0 1.8 5.46 84 55 A 11 ARG H A 11 ARG HG2 1.0 1.8 3.74 85 55 A 11 ARG HG3 A 11 ARG H 1.0 1.8 3.74 86 56 A 12 CYS H A 12 CYS HBx 1.0 1.8 4.10 87 56 A 12 CYS H A 12 CYS HBy 1.0 1.8 4.10 88 57 A 13 THR H A 13 THR HB 1.0 1.8 3.80 89 58 A 13 THR H A 13 THR HG2% 1.0 1.8 3.80 90 59 A 14 ALA H A 14 ALA HA 1.0 1.8 2.92 91 60 A 14 ALA H A 14 ALA HB% 1.0 1.8 2.56 92 61 A 15 PHE HZ A 15 PHE HBx 1.0 1.8 5.57 93 61 A 15 PHE HBy A 15 PHE HZ 1.0 1.8 5.57 94 62 A 15 PHE H A 15 PHE HBx 1.0 1.8 4.30 95 63 A 15 PHE HBy A 15 PHE H 1.0 1.8 4.30 96 64 A 15 PHE H A 15 PHE HBx 1.0 1.8 3.92 97 64 A 15 PHE HBy A 15 PHE H 1.0 1.8 3.92 98 65 A 16 GLN HA A 16 GLN HE2x 1.0 1.8 5.08 99 65 A 16 GLN HA A 16 GLN HE2y 1.0 1.8 5.08 100 66 A 16 GLN HA A 16 GLN HGy 1.0 1.8 3.95 101 67 A 16 GLN HA A 16 GLN HGx 1.0 1.8 3.95 102 68 A 16 GLN HA A 16 GLN HGy 1.0 1.8 3.63 103 68 A 16 GLN HA A 16 GLN HGx 1.0 1.8 3.63 104 69 A 16 GLN HE2y A 16 GLN HBx 1.0 1.8 5.15 105 69 A 16 GLN HBx A 16 GLN HE2x 1.0 1.8 5.15 106 70 A 16 GLN HE2y A 16 GLN HBy 1.0 1.8 5.15 107 70 A 16 GLN HBy A 16 GLN HE2x 1.0 1.8 5.15 108 71 A 16 GLN HBx A 16 GLN HE2x 1.0 1.8 4.68 109 71 A 16 GLN HBy A 16 GLN HE2x 1.0 1.8 4.68 110 71 A 16 GLN HE2y A 16 GLN HBx 1.0 1.8 4.68 111 71 A 16 GLN HE2y A 16 GLN HBy 1.0 1.8 4.68 112 72 A 16 GLN HBy A 16 GLN H 1.0 1.8 3.39 113 73 A 16 GLN H A 16 GLN HBx 1.0 1.8 3.09 114 73 A 16 GLN HBy A 16 GLN H 1.0 1.8 3.09 115 74 A 16 GLN H A 16 GLN HGy 1.0 1.8 4.47 116 75 A 16 GLN HGx A 16 GLN H 1.0 1.8 4.47 117 76 A 16 GLN H A 16 GLN HGy 1.0 1.8 4.23 118 76 A 16 GLN HGx A 16 GLN H 1.0 1.8 4.23 119 77 A 17 CYS H A 17 CYS HBx 1.0 1.8 3.94 120 78 A 17 CYS H A 17 CYS HBy 1.0 1.8 3.94 121 79 A 17 CYS H A 17 CYS HBx 1.0 1.8 3.74 122 79 A 17 CYS H A 17 CYS HBy 1.0 1.8 3.74 123 80 A 18 LYS HA A 18 LYS HD2 1.0 1.8 4.48 124 80 A 18 LYS HA A 18 LYS HD3 1.0 1.8 4.48 125 81 A 18 LYS HA A 18 LYS HE2 1.0 1.8 4.78 126 81 A 18 LYS HA A 18 LYS HE3 1.0 1.8 4.78 127 82 A 18 LYS HA A 18 LYS H 1.0 1.8 3.01 128 83 A 18 LYS H A 18 LYS HBx 1.0 1.8 3.67 129 84 A 18 LYS H A 18 LYS HBy 1.0 1.8 3.67 130 85 A 18 LYS H A 18 LYS HBx 1.0 1.8 3.48 131 85 A 18 LYS H A 18 LYS HBy 1.0 1.8 3.48 132 86 A 18 LYS H A 18 LYS HD2 1.0 1.8 5.22 133 86 A 18 LYS HD3 A 18 LYS H 1.0 1.8 5.22 134 87 A 19 HIS HA A 19 HIS HD1 1.0 1.8 4.50 135 87 A 19 HIS HA A 19 HIS HD2 1.0 1.8 4.50 136 88 A 19 HIS HBx A 19 HIS HD2 1.0 1.8 4.50 137 88 A 19 HIS HBx A 19 HIS HD1 1.0 1.8 4.50 138 89 A 19 HIS HD2 A 19 HIS HBy 1.0 1.8 3.50 139 89 A 19 HIS HD1 A 19 HIS HBy 1.0 1.8 3.50 140 90 A 19 HIS H A 19 HIS HBx 1.0 1.8 4.02 141 91 A 19 HIS H A 19 HIS HBy 1.0 1.8 4.02 142 92 A 19 HIS H A 19 HIS HBy 1.0 1.8 3.75 143 92 A 19 HIS H A 19 HIS HBx 1.0 1.8 3.75 144 93 A 19 HIS H A 19 HIS HD1 1.0 1.8 5.05 145 93 A 19 HIS H A 19 HIS HD2 1.0 1.8 5.05 146 94 A 20 SER H A 20 SER HBy 1.0 1.8 4.58 147 95 A 20 SER H A 20 SER HBx 1.0 1.8 4.58 148 96 A 20 SER H A 20 SER HBy 1.0 1.8 4.40 149 96 A 20 SER H A 20 SER HBx 1.0 1.8 4.40 150 97 A 22 LYS HD3 A 22 LYS HBy 1.0 1.8 3.80 151 97 A 22 LYS HBy A 22 LYS HD2 1.0 1.8 3.80 152 98 A 22 LYS HD3 A 22 LYS HBx 1.0 1.8 3.80 153 98 A 22 LYS HBx A 22 LYS HD2 1.0 1.8 3.80 154 99 A 22 LYS HBx A 22 LYS HD2 1.0 1.8 3.47 155 99 A 22 LYS HBy A 22 LYS HD2 1.0 1.8 3.47 156 99 A 22 LYS HD3 A 22 LYS HBy 1.0 1.8 3.47 157 99 A 22 LYS HD3 A 22 LYS HBx 1.0 1.8 3.47 158 100 A 22 LYS H A 22 LYS HBy 1.0 1.7 4.16 159 101 A 22 LYS HBx A 22 LYS H 1.0 1.7 4.16 160 102 A 22 LYS H A 22 LYS HBy 1.0 1.8 4.03 161 102 A 22 LYS HBx A 22 LYS H 1.0 1.8 4.03 162 103 A 22 LYS H A 22 LYS HD2 1.0 2.0 4.05 163 103 A 22 LYS HD3 A 22 LYS H 1.0 2.0 4.05 164 104 A 22 LYS H A 22 LYS HG2 1.0 1.8 4.79 165 104 A 22 LYS H A 22 LYS HG3 1.0 1.8 4.79 166 105 A 22 LYS H A 22 LYS HZ% 1.0 1.8 4.10 167 106 A 22 LYS H A 22 LYS HA 1.0 1.8 2.90 168 107 A 23 TYR HA A 23 TYR HD% 1.0 1.8 3.39 169 108 A 23 TYR HA A 23 TYR HE% 1.0 1.8 6.43 170 109 A 23 TYR H A 23 TYR HBx 1.0 1.8 3.83 171 110 A 23 TYR H A 23 TYR HBy 1.0 1.8 3.33 172 111 A 23 TYR H A 23 TYR HBx 1.0 1.8 3.07 173 111 A 23 TYR H A 23 TYR HBy 1.0 1.8 3.07 174 112 A 24 ARG HA A 24 ARG HGx 1.0 1.8 4.28 175 113 A 24 ARG HA A 24 ARG HGy 1.0 1.8 4.28 176 114 A 24 ARG HDy A 24 ARG HBx 1.0 1.8 4.50 177 115 A 24 ARG HBy A 24 ARG HGy 1.0 1.8 3.50 178 116 A 24 ARG HH2% A 24 ARG HBx 1.0 1.8 6.50 179 116 A 24 ARG HBy A 24 ARG HH2% 1.0 1.8 6.50 180 117 A 24 ARG HDy A 24 ARG HH1% 1.0 1.8 4.50 181 118 A 24 ARG HH2% A 24 ARG HGx 1.0 1.8 6.94 182 119 A 24 ARG HH2% A 24 ARG HGy 1.0 1.8 6.94 183 120 A 24 ARG HH1% A 24 ARG HGy 1.0 1.8 4.66 184 120 A 24 ARG HH1% A 24 ARG HGx 1.0 1.8 4.66 185 121 A 24 ARG HH2% A 24 ARG HGy 1.0 1.8 5.63 186 121 A 24 ARG HH2% A 24 ARG HGx 1.0 1.8 5.63 187 122 A 24 ARG H A 24 ARG HBx 1.0 1.8 3.56 188 122 A 24 ARG HBy A 24 ARG H 1.0 1.8 3.56 189 123 A 24 ARG HGx A 24 ARG H 1.0 1.8 3.45 190 124 A 24 ARG H A 24 ARG HGy 1.0 1.8 3.95 191 125 A 24 ARG H A 24 ARG HGy 1.0 1.8 3.25 192 125 A 24 ARG HGx A 24 ARG H 1.0 1.8 3.25 193 126 A 24 ARG HH1% A 24 ARG H 1.0 1.8 5.14 194 127 A 25 LEU HBy A 25 LEU HD2% 1.0 1.8 4.50 195 127 A 25 LEU HBx A 25 LEU HD2% 1.0 1.8 4.50 196 127 A 25 LEU HD1% A 25 LEU HBy 1.0 1.8 4.50 197 127 A 25 LEU HBx A 25 LEU HD1% 1.0 1.8 4.50 198 128 A 25 LEU HG A 25 LEU HD2% 1.0 1.8 3.50 199 128 A 25 LEU HD1% A 25 LEU HG 1.0 1.8 3.50 200 129 A 25 LEU H A 25 LEU HBy 1.0 1.8 3.99 201 129 A 25 LEU HBx A 25 LEU H 1.0 1.8 3.99 202 130 A 25 LEU HG A 25 LEU H 1.0 1.7 3.10 203 131 A 25 LEU H A 25 LEU HD2% 1.0 1.8 5.19 204 132 A 26 SER H A 26 SER HBx 1.0 1.8 3.84 205 133 A 26 SER H A 26 SER HBy 1.0 1.8 3.84 206 134 A 26 SER H A 26 SER HBx 1.0 1.8 3.65 207 134 A 26 SER H A 26 SER HBy 1.0 1.8 3.65 208 135 A 27 PHE HA A 27 PHE HBy 1.0 1.8 3.50 209 136 A 27 PHE HA A 27 PHE HD% 1.0 1.8 2.89 210 137 A 27 PHE HD% A 27 PHE HBy 1.0 1.8 4.50 211 138 A 27 PHE HD% A 27 PHE HBx 1.0 1.8 4.50 212 139 A 27 PHE HD% A 27 PHE HZ 1.0 1.8 4.50 213 140 A 27 PHE H A 27 PHE HBx 1.0 1.8 4.19 214 141 A 27 PHE H A 27 PHE HBy 1.0 1.8 4.19 215 142 A 27 PHE HD% A 27 PHE H 1.0 1.8 3.46 216 143 A 28 CYS HA A 28 CYS HBy 1.0 1.8 3.50 217 144 A 28 CYS H A 28 CYS HBx 1.0 1.8 3.77 218 145 A 28 CYS H A 28 CYS HBy 1.0 1.8 3.77 219 146 A 28 CYS H A 28 CYS HBx 1.0 1.8 3.43 220 146 A 28 CYS H A 28 CYS HBy 1.0 1.8 3.43 221 147 A 29 ARG HA A 29 ARG HH1% 1.0 1.8 6.50 222 148 A 29 ARG HH1% A 29 ARG HBx 1.0 1.8 5.50 223 149 A 29 ARG HH1% A 29 ARG HBy 1.0 1.8 5.50 224 150 A 29 ARG HG3 A 29 ARG HDx 1.0 1.8 3.50 225 150 A 29 ARG HDx A 29 ARG HG2 1.0 1.8 3.50 226 151 A 29 ARG HH1% A 29 ARG HG2 1.0 1.8 4.50 227 151 A 29 ARG HH1% A 29 ARG HG3 1.0 1.8 4.50 228 152 A 29 ARG H A 29 ARG HBx 1.0 1.8 3.71 229 152 A 29 ARG H A 29 ARG HBy 1.0 1.8 3.71 230 153 A 29 ARG H A 29 ARG HG2 1.0 1.8 4.73 231 153 A 29 ARG HG3 A 29 ARG H 1.0 1.8 4.73 232 154 A 29 ARG H A 29 ARG HDy 1.0 1.8 5.50 233 154 A 29 ARG H A 29 ARG HDx 1.0 1.8 5.50 234 155 A 30 LYS HA A 30 LYS HD2 1.0 1.8 4.44 235 155 A 30 LYS HA A 30 LYS HD3 1.0 1.8 4.44 236 156 A 30 LYS HA A 30 LYS HE2 1.0 1.8 5.55 237 156 A 30 LYS HA A 30 LYS HE3 1.0 1.8 5.55 238 157 A 30 LYS HA A 30 LYS HG2 1.0 1.8 3.52 239 157 A 30 LYS HA A 30 LYS HG3 1.0 1.8 3.52 240 158 A 30 LYS HD3 A 30 LYS HG2 1.0 1.8 3.47 241 158 A 30 LYS HD2 A 30 LYS HG2 1.0 1.8 3.47 242 158 A 30 LYS HG3 A 30 LYS HD2 1.0 1.8 3.47 243 158 A 30 LYS HD3 A 30 LYS HG3 1.0 1.8 3.47 244 159 A 30 LYS HE3 A 30 LYS HG2 1.0 1.8 3.47 245 159 A 30 LYS HE2 A 30 LYS HG2 1.0 1.8 3.47 246 159 A 30 LYS HG3 A 30 LYS HE2 1.0 1.8 3.47 247 159 A 30 LYS HE3 A 30 LYS HG3 1.0 1.8 3.47 248 160 A 30 LYS H A 30 LYS HB2 1.0 1.8 3.99 249 160 A 30 LYS H A 30 LYS HB3 1.0 1.8 3.99 250 161 A 30 LYS H A 30 LYS HD2 1.0 1.8 4.73 251 161 A 30 LYS HD3 A 30 LYS H 1.0 1.8 4.73 252 162 A 30 LYS H A 30 LYS HG2 1.0 1.8 2.74 253 162 A 30 LYS HG3 A 30 LYS H 1.0 1.8 2.74 254 163 A 31 THR HA A 31 THR HB 1.0 1.8 3.64 255 164 A 31 THR HB A 31 THR HG2% 1.0 1.8 3.90 256 165 A 31 THR HB A 31 THR H 1.0 1.8 3.46 257 166 A 31 THR HG2% A 31 THR H 1.0 1.8 3.54 258 167 A 32 CYS H A 32 CYS HBx 1.0 1.8 4.36 259 168 A 32 CYS H A 32 CYS HBy 1.0 1.8 3.36 260 169 A 32 CYS H A 32 CYS HBx 1.0 1.8 3.07 261 169 A 32 CYS H A 32 CYS HBy 1.0 1.8 3.07 262 170 A 34 THR HA A 34 THR HG2% 1.0 1.8 3.42 263 171 A 34 THR H A 34 THR HB 1.0 1.8 3.19 264 172 A 34 THR HG2% A 34 THR H 1.0 1.8 4.44 265 173 A 35 CYS HA A 35 CYS HBy 1.0 1.8 3.50 266 173 A 35 CYS HA A 35 CYS HBx 1.0 1.8 3.50 267 174 A 35 CYS H A 35 CYS HBy 1.0 1.8 3.55 268 175 A 35 CYS HBx A 35 CYS H 1.0 1.8 3.55 269 176 A 35 CYS H A 35 CYS HBy 1.0 1.8 3.28 270 176 A 35 CYS HBx A 35 CYS H 1.0 1.8 3.28 271 177 A 2 SER HA A 1 ARG HG3 1.0 1.8 7.50 272 178 A 2 SER HA A 1 ARG HBx 1.0 1.8 4.50 273 179 A 3 CYS H A 2 SER HB2 1.0 1.8 4.50 274 179 A 2 SER HB3 A 3 CYS H 1.0 1.8 4.50 275 180 A 2 SER HA A 3 CYS H 1.0 1.8 3.30 276 181 A 3 CYS H A 2 SER H 1.0 1.8 4.84 277 182 A 4 ILE H A 3 CYS HA 1.0 1.8 3.35 278 183 A 4 ILE HA A 3 CYS HB2 1.0 1.8 5.66 279 183 A 3 CYS HB3 A 4 ILE HA 1.0 1.8 5.66 280 184 A 4 ILE H A 3 CYS HB2 1.0 1.8 3.94 281 184 A 3 CYS HB3 A 4 ILE H 1.0 1.8 3.94 282 185 A 3 CYS HB2 A 4 ILE HG1y 1.0 1.8 4.60 283 185 A 3 CYS HB3 A 4 ILE HG1y 1.0 1.8 4.60 284 185 A 4 ILE HG1x A 3 CYS HB2 1.0 1.8 4.60 285 185 A 3 CYS HB3 A 4 ILE HG1x 1.0 1.8 4.60 286 186 A 3 CYS H A 4 ILE H 1.0 1.8 4.82 287 187 A 3 CYS H A 4 ILE HG1y 1.0 1.8 4.77 288 187 A 3 CYS H A 4 ILE HG1x 1.0 1.8 4.77 289 188 A 4 ILE HA A 5 ASP HBx 1.0 1.8 5.27 290 188 A 4 ILE HA A 5 ASP HBy 1.0 1.8 5.27 291 189 A 5 ASP HA A 4 ILE HB 1.0 1.8 5.50 292 190 A 4 ILE HB A 5 ASP HBx 1.0 1.8 5.44 293 190 A 5 ASP HBy A 4 ILE HB 1.0 1.8 5.44 294 191 A 5 ASP H A 4 ILE HB 1.0 1.8 3.49 295 192 A 5 ASP HA A 4 ILE HG1y 1.0 1.8 6.50 296 192 A 4 ILE HG1x A 5 ASP HA 1.0 1.8 6.50 297 193 A 4 ILE HG2% A 5 ASP H 1.0 1.8 4.53 298 194 A 4 ILE H A 5 ASP HA 1.0 1.7 5.12 299 195 A 5 ASP HA A 6 THR HG2% 1.0 1.8 4.99 300 196 A 5 ASP HA A 6 THR H 1.0 1.8 2.89 301 197 A 5 ASP HA A 6 THR HG2% 1.0 1.8 5.50 302 198 A 6 THR H A 5 ASP HBx 1.0 1.8 4.07 303 199 A 5 ASP HBy A 6 THR H 1.0 1.8 4.07 304 200 A 6 THR H A 5 ASP HBx 1.0 1.8 3.72 305 200 A 5 ASP HBy A 6 THR H 1.0 1.8 3.72 306 201 A 5 ASP H A 6 THR H 1.0 1.8 4.76 307 202 A 7 ILE H A 6 THR HB 1.0 1.8 4.72 308 203 A 6 THR HG2% A 7 ILE H 1.0 1.8 4.96 309 204 A 6 THR H A 7 ILE HA 1.0 1.8 4.83 310 205 A 6 THR H A 7 ILE HB 1.0 1.8 5.50 311 206 A 6 THR H A 7 ILE HD1% 1.0 1.8 6.06 312 207 A 6 THR H A 7 ILE HG2% 1.0 1.8 4.09 313 208 A 6 THR H A 7 ILE H 1.0 1.8 2.94 314 209 A 6 THR H A 7 ILE HG1y 1.0 1.8 5.83 315 209 A 6 THR H A 7 ILE HG1x 1.0 1.8 5.83 316 210 A 7 ILE HA A 8 PRO HA 1.0 1.8 4.70 317 211 A 7 ILE HA A 8 PRO HDy 1.0 1.8 2.50 318 212 A 7 ILE HA A 8 PRO HBx 1.0 1.8 5.28 319 212 A 7 ILE HA A 8 PRO HBy 1.0 1.8 5.28 320 213 A 7 ILE HA A 8 PRO HDx 1.0 1.8 3.43 321 213 A 7 ILE HA A 8 PRO HDy 1.0 1.8 3.43 322 214 A 7 ILE HA A 8 PRO HGx 1.0 1.8 4.81 323 215 A 7 ILE HA A 8 PRO HGy 1.0 1.8 4.81 324 216 A 7 ILE HA A 8 PRO HGy 1.0 1.7 4.66 325 216 A 7 ILE HA A 8 PRO HGx 1.0 1.7 4.66 326 217 A 7 ILE HB A 8 PRO HGy 1.0 1.8 6.50 327 218 A 7 ILE HD1% A 8 PRO HDy 1.0 1.8 6.20 328 219 A 7 ILE HD1% A 8 PRO HDx 1.0 1.8 4.85 329 219 A 7 ILE HD1% A 8 PRO HDy 1.0 1.8 4.85 330 220 A 7 ILE HG1x A 8 PRO HDx 1.0 1.8 5.34 331 220 A 7 ILE HG1y A 8 PRO HDx 1.0 1.8 5.34 332 220 A 8 PRO HDy A 7 ILE HG1y 1.0 1.8 5.34 333 220 A 7 ILE HG1x A 8 PRO HDy 1.0 1.8 5.34 334 221 A 8 PRO HA A 9 LYS H 1.0 1.8 3.50 335 222 A 9 LYS H A 8 PRO HBx 1.0 1.8 5.00 336 222 A 8 PRO HBy A 9 LYS H 1.0 1.8 5.00 337 223 A 8 PRO HDy A 9 LYS HBy 1.0 1.8 6.53 338 223 A 8 PRO HDx A 9 LYS HBy 1.0 1.8 6.53 339 223 A 9 LYS HBx A 8 PRO HDx 1.0 1.8 6.53 340 223 A 9 LYS HBx A 8 PRO HDy 1.0 1.8 6.53 341 224 A 10 SER H A 9 LYS HBy 1.0 1.8 5.15 342 224 A 9 LYS HBx A 10 SER H 1.0 1.8 5.15 343 225 A 9 LYS H A 10 SER H 1.0 1.8 4.15 344 226 A 11 ARG H A 10 SER HB2 1.0 1.8 5.00 345 226 A 10 SER HB3 A 11 ARG H 1.0 1.8 5.00 346 227 A 10 SER H A 11 ARG H 1.0 1.8 3.12 347 228 A 12 CYS H A 11 ARG HBx 1.0 1.8 5.22 348 229 A 11 ARG HBy A 12 CYS H 1.0 1.8 5.22 349 230 A 12 CYS H A 11 ARG HBx 1.0 1.8 5.02 350 230 A 11 ARG HBy A 12 CYS H 1.0 1.8 5.02 351 231 A 12 CYS H A 11 ARG HG2 1.0 1.8 5.00 352 231 A 11 ARG HG3 A 12 CYS H 1.0 1.8 5.00 353 232 A 11 ARG H A 12 CYS HA 1.0 1.8 4.97 354 233 A 11 ARG H A 12 CYS HBx 1.0 1.8 5.98 355 233 A 11 ARG H A 12 CYS HBy 1.0 1.8 5.98 356 234 A 11 ARG H A 12 CYS H 1.0 1.8 3.47 357 235 A 13 THR H A 12 CYS HA 1.0 1.8 2.81 358 236 A 13 THR H A 12 CYS HBx 1.0 1.8 5.02 359 236 A 12 CYS HBy A 13 THR H 1.0 1.8 5.02 360 237 A 12 CYS H A 13 THR HG2% 1.0 1.8 4.30 361 238 A 12 CYS H A 13 THR H 1.0 1.8 4.23 362 239 A 14 ALA HB% A 13 THR HA 1.0 1.8 5.50 363 240 A 14 ALA H A 13 THR HA 1.0 1.8 3.46 364 241 A 13 THR HB A 14 ALA H 1.0 1.8 3.18 365 242 A 13 THR HG2% A 14 ALA HA 1.0 1.8 7.50 366 243 A 13 THR H A 14 ALA H 1.0 1.8 5.32 367 244 A 14 ALA HA A 15 PHE H 1.0 2.0 3.70 368 245 A 14 ALA HB% A 15 PHE HBx 1.0 1.8 5.47 369 245 A 14 ALA HB% A 15 PHE HBy 1.0 1.8 5.47 370 246 A 14 ALA HB% A 15 PHE H 1.0 1.8 4.04 371 247 A 14 ALA H A 15 PHE HA 1.0 1.8 5.50 372 248 A 14 ALA H A 15 PHE HBx 1.0 1.8 4.32 373 248 A 14 ALA H A 15 PHE HBy 1.0 1.8 4.32 374 249 A 14 ALA H A 15 PHE H 1.0 1.8 3.12 375 250 A 16 GLN H A 15 PHE HBx 1.0 1.8 4.43 376 251 A 15 PHE HBy A 16 GLN H 1.0 1.8 4.43 377 252 A 16 GLN H A 15 PHE HBx 1.0 1.7 4.15 378 252 A 15 PHE HBy A 16 GLN H 1.0 1.7 4.15 379 253 A 15 PHE HD% A 16 GLN HBx 1.0 1.8 6.38 380 253 A 16 GLN HBy A 15 PHE HD% 1.0 1.8 6.38 381 254 A 15 PHE HD% A 16 GLN HGy 1.0 1.8 4.97 382 254 A 16 GLN HGx A 15 PHE HD% 1.0 1.8 4.97 383 255 A 15 PHE HD% A 16 GLN HE2x 1.0 1.8 5.39 384 255 A 16 GLN HE2y A 15 PHE HD% 1.0 1.8 5.39 385 256 A 15 PHE HE% A 16 GLN HBx 1.0 1.8 5.41 386 256 A 16 GLN HBy A 15 PHE HE% 1.0 1.8 5.41 387 257 A 15 PHE HE% A 16 GLN HGy 1.0 1.8 4.27 388 257 A 16 GLN HGx A 15 PHE HE% 1.0 1.8 4.27 389 258 A 15 PHE HE% A 16 GLN HE2x 1.0 1.8 6.06 390 258 A 16 GLN HE2y A 15 PHE HE% 1.0 1.8 6.06 391 259 A 15 PHE H A 16 GLN H 1.0 1.8 2.77 392 260 A 15 PHE HZ A 16 GLN HA 1.0 1.8 4.96 393 261 A 15 PHE HZ A 16 GLN HGy 1.0 1.8 5.36 394 261 A 15 PHE HZ A 16 GLN HGx 1.0 1.8 5.36 395 262 A 17 CYS H A 16 GLN HBx 1.0 1.8 4.05 396 262 A 16 GLN HBy A 17 CYS H 1.0 1.8 4.05 397 263 A 17 CYS H A 16 GLN HGy 1.0 1.8 5.21 398 264 A 16 GLN HGx A 17 CYS H 1.0 1.8 5.21 399 265 A 17 CYS H A 16 GLN HGy 1.0 1.8 5.05 400 265 A 16 GLN HGx A 17 CYS H 1.0 1.8 5.05 401 266 A 17 CYS HBx A 18 LYS HG2 1.0 1.8 5.88 402 266 A 17 CYS HBy A 18 LYS HG2 1.0 1.8 5.88 403 266 A 18 LYS HG3 A 17 CYS HBx 1.0 1.8 5.88 404 266 A 17 CYS HBy A 18 LYS HG3 1.0 1.8 5.88 405 267 A 17 CYS H A 18 LYS H 1.0 1.8 2.99 406 268 A 19 HIS H A 18 LYS HBx 1.0 1.8 4.02 407 269 A 18 LYS HBy A 19 HIS H 1.0 1.8 4.02 408 270 A 19 HIS H A 18 LYS HBx 1.0 1.8 3.81 409 270 A 18 LYS HBy A 19 HIS H 1.0 1.8 3.81 410 271 A 18 LYS HD3 A 19 HIS HD2 1.0 1.8 4.91 411 271 A 19 HIS HD1 A 18 LYS HD2 1.0 1.8 4.91 412 271 A 19 HIS HD2 A 18 LYS HD2 1.0 1.8 4.91 413 271 A 18 LYS HD3 A 19 HIS HD1 1.0 1.8 4.91 414 272 A 18 LYS HG2 A 19 HIS HBy 1.0 1.8 5.83 415 272 A 18 LYS HG3 A 19 HIS HBy 1.0 1.8 5.83 416 272 A 19 HIS HBx A 18 LYS HG2 1.0 1.8 5.83 417 272 A 19 HIS HBx A 18 LYS HG3 1.0 1.8 5.83 418 273 A 19 HIS HD2 A 18 LYS HG2 1.0 1.8 4.96 419 273 A 18 LYS HG3 A 19 HIS HD2 1.0 1.8 4.96 420 273 A 19 HIS HD1 A 18 LYS HG2 1.0 1.8 4.96 421 273 A 18 LYS HG3 A 19 HIS HD1 1.0 1.8 4.96 422 274 A 18 LYS H A 19 HIS HA 1.0 1.8 4.66 423 275 A 18 LYS H A 19 HIS H 1.0 1.8 3.32 424 276 A 19 HIS HBx A 20 SER H 1.0 1.8 4.25 425 277 A 20 SER H A 19 HIS HBy 1.0 1.8 4.25 426 278 A 20 SER H A 19 HIS HBy 1.0 1.8 4.06 427 278 A 19 HIS HBx A 20 SER H 1.0 1.8 4.06 428 279 A 19 HIS H A 20 SER H 1.0 1.8 3.21 429 280 A 23 TYR HD% A 22 LYS HBy 1.0 1.8 5.77 430 280 A 22 LYS HBx A 23 TYR HD% 1.0 1.8 5.77 431 281 A 23 TYR HE% A 22 LYS HBy 1.0 1.8 6.38 432 281 A 22 LYS HBx A 23 TYR HE% 1.0 1.8 6.38 433 282 A 23 TYR H A 22 LYS HBy 1.0 2.3 4.19 434 282 A 22 LYS HBx A 23 TYR H 1.0 2.3 4.19 435 283 A 23 TYR HD% A 22 LYS HD2 1.0 1.6 4.10 436 283 A 22 LYS HD3 A 23 TYR HD% 1.0 1.6 4.10 437 284 A 23 TYR HE% A 22 LYS HD2 1.0 1.8 5.50 438 284 A 22 LYS HD3 A 23 TYR HE% 1.0 1.8 5.50 439 285 A 23 TYR H A 22 LYS HD2 1.0 1.8 4.39 440 285 A 22 LYS HD3 A 23 TYR H 1.0 1.8 4.39 441 286 A 22 LYS H A 23 TYR HBy 1.0 1.8 5.23 442 287 A 22 LYS H A 23 TYR HBx 1.0 1.8 4.87 443 287 A 22 LYS H A 23 TYR HBy 1.0 1.8 4.87 444 288 A 22 LYS H A 23 TYR H 1.0 1.8 3.17 445 289 A 24 ARG H A 23 TYR HBx 1.0 1.8 4.02 446 290 A 23 TYR HBy A 24 ARG H 1.0 1.8 4.02 447 291 A 24 ARG H A 23 TYR HBx 1.0 1.8 3.76 448 291 A 23 TYR HBy A 24 ARG H 1.0 1.8 3.76 449 292 A 23 TYR H A 24 ARG H 1.0 1.8 3.08 450 293 A 24 ARG HA A 25 LEU HD2% 1.0 1.8 6.26 451 294 A 24 ARG HH1% A 25 LEU HD2% 1.0 1.8 5.70 452 295 A 24 ARG H A 25 LEU HA 1.0 1.8 5.50 453 296 A 24 ARG H A 25 LEU H 1.0 1.8 3.42 454 297 A 24 ARG H A 25 LEU HD2% 1.0 1.8 6.10 455 298 A 26 SER H A 25 LEU HD2% 1.0 1.8 6.27 456 299 A 25 LEU H A 26 SER H 1.0 2.0 3.03 457 300 A 27 PHE HD% A 26 SER HA 1.0 1.8 5.11 458 301 A 27 PHE HD% A 26 SER HBx 1.0 1.8 4.28 459 302 A 27 PHE HE% A 26 SER HBx 1.0 1.8 4.43 460 303 A 27 PHE H A 26 SER HBx 1.0 1.8 3.25 461 304 A 26 SER HBy A 27 PHE HD% 1.0 1.8 4.28 462 305 A 26 SER HBy A 27 PHE HE% 1.0 1.8 4.43 463 306 A 26 SER HBy A 27 PHE H 1.0 1.8 3.25 464 307 A 27 PHE HD% A 26 SER HBx 1.0 1.8 4.10 465 307 A 26 SER HBy A 27 PHE HD% 1.0 1.8 4.10 466 308 A 27 PHE HE% A 26 SER HBx 1.0 1.8 4.20 467 308 A 26 SER HBy A 27 PHE HE% 1.0 1.8 4.20 468 309 A 26 SER H A 27 PHE HA 1.0 1.8 4.63 469 310 A 26 SER H A 27 PHE H 1.0 1.8 2.85 470 311 A 28 CYS HA A 27 PHE HBx 1.0 1.8 6.12 471 311 A 28 CYS HA A 27 PHE HBy 1.0 1.8 6.12 472 312 A 28 CYS H A 27 PHE HBx 1.0 1.8 4.54 473 312 A 28 CYS H A 27 PHE HBy 1.0 1.8 4.54 474 313 A 27 PHE HD% A 28 CYS H 1.0 1.8 4.66 475 314 A 27 PHE H A 28 CYS HA 1.0 1.8 4.97 476 315 A 27 PHE H A 28 CYS H 1.0 1.8 3.31 477 316 A 28 CYS HA A 29 ARG H 1.0 1.8 3.14 478 317 A 28 CYS HA A 29 ARG HG2 1.0 1.8 6.50 479 317 A 28 CYS HA A 29 ARG HG3 1.0 1.8 6.50 480 318 A 28 CYS HA A 29 ARG HBx 1.0 1.8 5.56 481 318 A 28 CYS HA A 29 ARG HBy 1.0 1.8 5.56 482 319 A 29 ARG HG3 A 28 CYS HBx 1.0 1.8 6.50 483 319 A 28 CYS HBx A 29 ARG HG2 1.0 1.8 6.50 484 320 A 29 ARG H A 28 CYS HBx 1.0 1.8 5.19 485 321 A 28 CYS HBy A 29 ARG H 1.0 1.7 5.19 486 322 A 28 CYS HBy A 29 ARG HBy 1.0 1.8 7.50 487 323 A 29 ARG H A 28 CYS HBx 1.0 1.8 4.82 488 323 A 28 CYS HBy A 29 ARG H 1.0 1.8 4.82 489 324 A 28 CYS H A 29 ARG HG2 1.0 1.8 5.50 490 324 A 28 CYS H A 29 ARG HG3 1.0 1.8 5.50 491 325 A 28 CYS H A 29 ARG HBx 1.0 1.8 5.38 492 325 A 28 CYS H A 29 ARG HBy 1.0 1.8 5.38 493 326 A 28 CYS H A 29 ARG H 1.0 1.8 4.62 494 327 A 29 ARG H A 30 LYS H 1.0 1.8 3.21 495 328 A 30 LYS HA A 31 THR H 1.0 1.8 4.00 496 329 A 31 THR H A 30 LYS HB2 1.0 1.8 3.13 497 329 A 30 LYS HB3 A 31 THR H 1.0 1.8 3.13 498 330 A 30 LYS H A 31 THR HB 1.0 1.8 5.51 499 331 A 30 LYS H A 31 THR H 1.0 1.8 3.06 500 332 A 31 THR HA A 32 CYS HBx 1.0 1.8 6.33 501 332 A 31 THR HA A 32 CYS HBy 1.0 1.8 6.33 502 333 A 31 THR HB A 32 CYS HBx 1.0 1.8 4.74 503 333 A 31 THR HB A 32 CYS HBy 1.0 1.8 4.74 504 334 A 31 THR HB A 32 CYS H 1.0 1.8 3.34 505 335 A 31 THR H A 32 CYS H 1.0 1.8 3.28 506 336 A 32 CYS HA A 33 GLY H 1.0 1.8 3.58 507 337 A 33 GLY H A 32 CYS HBx 1.0 1.8 4.04 508 337 A 32 CYS HBy A 33 GLY H 1.0 1.8 4.04 509 338 A 32 CYS H A 33 GLY H 1.0 1.8 3.14 510 339 A 34 THR HG2% A 33 GLY H 1.0 1.8 4.65 511 340 A 34 THR H A 33 GLY H 1.0 1.8 3.16 512 341 A 34 THR HA A 35 CYS HBy 1.0 1.8 5.62 513 341 A 34 THR HA A 35 CYS HBx 1.0 1.8 5.62 514 342 A 34 THR HA A 35 CYS H 1.0 1.9 4.36 515 343 A 34 THR HB A 35 CYS H 1.0 1.8 4.54 516 344 A 34 THR HG2% A 35 CYS HA 1.0 1.8 7.50 517 345 A 34 THR HG2% A 35 CYS H 1.0 1.8 4.26 518 346 A 34 THR H A 35 CYS H 1.0 1.8 2.93 519 347 A 34 THR H A 35 CYS HBx 1.0 1.8 5.50 520 348 A 2 SER HA A 4 ILE HG1y 1.0 1.8 4.46 521 348 A 2 SER HA A 4 ILE HG1x 1.0 1.8 4.46 522 349 A 2 SER H A 4 ILE HG1y 1.0 1.8 4.64 523 349 A 4 ILE HG1x A 2 SER H 1.0 1.8 4.64 524 350 A 4 ILE HA A 6 THR HG2% 1.0 1.8 7.50 525 351 A 4 ILE HD1% A 6 THR HG2% 1.0 1.8 7.00 526 352 A 5 ASP HA A 7 ILE HB 1.0 1.8 7.50 527 353 A 5 ASP HA A 7 ILE HD1% 1.0 1.8 6.50 528 354 A 5 ASP HA A 7 ILE H 1.0 1.8 3.96 529 355 A 7 ILE H A 5 ASP HBx 1.0 1.8 4.96 530 356 A 5 ASP HBy A 7 ILE H 1.0 1.8 3.96 531 357 A 7 ILE HB A 5 ASP HBx 1.0 1.8 5.77 532 357 A 5 ASP HBy A 7 ILE HB 1.0 1.8 5.77 533 358 A 7 ILE H A 5 ASP HBx 1.0 1.8 3.64 534 358 A 5 ASP HBy A 7 ILE H 1.0 1.8 3.64 535 359 A 7 ILE HD1% A 11 ARG HBx 1.0 1.8 3.87 536 360 A 7 ILE HD1% A 11 ARG HBy 1.0 1.8 3.87 537 361 A 7 ILE HD1% A 11 ARG HBx 1.0 2.1 3.61 538 361 A 7 ILE HD1% A 11 ARG HBy 1.0 2.1 3.61 539 362 A 7 ILE HD1% A 11 ARG HG2 1.0 1.8 4.49 540 362 A 7 ILE HD1% A 11 ARG HG3 1.0 1.8 4.49 541 363 A 7 ILE HD1% A 11 ARG H 1.0 1.8 4.31 542 364 A 7 ILE HG2% A 11 ARG HBx 1.0 1.8 6.07 543 364 A 7 ILE HG2% A 11 ARG HBy 1.0 1.8 6.07 544 365 A 7 ILE HG2% A 11 ARG H 1.0 1.8 6.50 545 366 A 7 ILE H A 9 LYS H 1.0 1.8 7.47 546 367 A 8 PRO HA A 11 ARG H 1.0 1.8 5.30 547 368 A 8 PRO HA A 10 SER H 1.0 1.8 3.88 548 369 A 10 SER H A 8 PRO HBx 1.0 1.8 4.69 549 369 A 8 PRO HBy A 10 SER H 1.0 1.8 4.69 550 370 A 11 ARG H A 8 PRO HBx 1.0 1.8 5.48 551 370 A 8 PRO HBy A 11 ARG H 1.0 1.8 5.48 552 371 A 11 ARG H A 8 PRO HDx 1.0 1.8 6.50 553 371 A 11 ARG H A 8 PRO HDy 1.0 1.8 6.50 554 372 A 8 PRO HDy A 11 ARG HDx 1.0 1.8 6.31 555 372 A 8 PRO HDx A 11 ARG HDx 1.0 1.8 6.31 556 372 A 11 ARG HDy A 8 PRO HDx 1.0 1.8 6.31 557 372 A 11 ARG HDy A 8 PRO HDy 1.0 1.8 6.31 558 373 A 8 PRO HGx A 11 ARG HDx 1.0 1.8 6.45 559 373 A 8 PRO HGy A 11 ARG HDx 1.0 1.8 6.45 560 373 A 11 ARG HDy A 8 PRO HGy 1.0 1.8 6.45 561 373 A 11 ARG HDy A 8 PRO HGx 1.0 1.8 6.45 562 374 A 11 ARG H A 8 PRO HGy 1.0 1.8 6.38 563 374 A 11 ARG H A 8 PRO HGx 1.0 1.8 6.38 564 375 A 9 LYS HA A 12 CYS H 1.0 1.8 3.50 565 376 A 9 LYS H A 11 ARG H 1.0 1.8 4.62 566 377 A 10 SER HA A 12 CYS H 1.0 1.8 4.20 567 378 A 10 SER H A 12 CYS H 1.0 1.8 4.59 568 379 A 14 ALA H A 12 CYS HA 1.0 2.8 6.50 569 380 A 16 GLN H A 12 CYS HA 1.0 1.8 4.88 570 381 A 12 CYS H A 16 GLN HBx 1.0 1.8 5.69 571 381 A 12 CYS H A 16 GLN HBy 1.0 1.8 5.69 572 382 A 15 PHE H A 13 THR HA 1.0 1.8 3.75 573 383 A 16 GLN H A 13 THR HA 1.0 1.8 4.72 574 384 A 13 THR HB A 16 GLN H 1.0 2.2 4.20 575 385 A 13 THR HG2% A 15 PHE HE% 1.0 1.8 5.84 576 386 A 13 THR HG2% A 15 PHE H 1.0 1.8 3.98 577 387 A 13 THR HG2% A 16 GLN H 1.0 1.8 3.81 578 388 A 13 THR HG2% A 16 GLN HE2x 1.0 1.8 6.37 579 388 A 13 THR HG2% A 16 GLN HE2y 1.0 1.8 6.37 580 389 A 13 THR H A 16 GLN HGy 1.0 1.8 3.80 581 389 A 13 THR H A 16 GLN HGx 1.0 1.8 3.80 582 390 A 13 THR H A 16 GLN HBx 1.0 1.8 3.73 583 391 A 13 THR H A 16 GLN HBy 1.0 1.8 3.73 584 392 A 13 THR H A 16 GLN HBx 1.0 1.8 3.56 585 392 A 13 THR H A 16 GLN HBy 1.0 1.8 3.56 586 393 A 13 THR H A 16 GLN H 1.0 1.8 3.99 587 394 A 13 THR H A 17 CYS H 1.0 1.8 4.37 588 395 A 14 ALA HA A 17 CYS H 1.0 1.8 4.72 589 396 A 14 ALA H A 16 GLN H 1.0 1.8 4.52 590 397 A 18 LYS H A 15 PHE HA 1.0 1.8 4.91 591 398 A 18 LYS HBy A 15 PHE HA 1.0 1.7 5.00 592 399 A 15 PHE HA A 19 HIS HD1 1.0 1.8 3.24 593 400 A 19 HIS HE1 A 15 PHE HBx 1.0 1.8 6.29 594 401 A 15 PHE HBy A 19 HIS HE1 1.0 1.8 4.79 595 402 A 19 HIS HE1 A 15 PHE HBx 1.0 1.8 5.06 596 402 A 15 PHE HBy A 19 HIS HE1 1.0 1.8 5.06 597 403 A 15 PHE HD% A 19 HIS HE1 1.0 1.8 5.50 598 404 A 15 PHE HD% A 19 HIS HBy 1.0 1.8 5.42 599 404 A 19 HIS HBx A 15 PHE HD% 1.0 1.8 5.42 600 405 A 15 PHE HD% A 19 HIS HD2 1.0 1.8 3.95 601 406 A 15 PHE HE% A 19 HIS HE1 1.0 1.8 7.50 602 407 A 19 HIS H A 15 PHE HE% 1.0 1.8 6.14 603 408 A 15 PHE HZ A 19 HIS HBy 1.0 1.8 4.62 604 409 A 16 GLN HA A 19 HIS H 1.0 1.8 4.76 605 410 A 16 GLN HA A 20 SER HBy 1.0 1.8 5.90 606 410 A 16 GLN HA A 20 SER HBx 1.0 1.8 5.90 607 411 A 19 HIS HBx A 16 GLN HE2x 1.0 1.8 6.05 608 411 A 16 GLN HE2y A 19 HIS HBx 1.0 1.8 6.05 609 412 A 16 GLN HE2y A 19 HIS HBy 1.0 1.8 6.05 610 412 A 16 GLN HE2x A 19 HIS HBy 1.0 1.8 6.05 611 413 A 16 GLN HE2x A 20 SER HBy 1.0 1.8 6.86 612 413 A 16 GLN HE2y A 20 SER HBy 1.0 1.8 6.86 613 414 A 20 SER HBx A 16 GLN HE2x 1.0 1.8 6.86 614 414 A 16 GLN HE2y A 20 SER HBx 1.0 1.8 6.86 615 415 A 16 GLN HE2y A 19 HIS HBy 1.0 1.8 4.97 616 415 A 16 GLN HE2x A 19 HIS HBy 1.0 1.8 4.97 617 415 A 19 HIS HBx A 16 GLN HE2x 1.0 1.8 4.97 618 415 A 16 GLN HE2y A 19 HIS HBx 1.0 1.8 4.97 619 416 A 16 GLN HE2x A 20 SER HBy 1.0 1.8 5.80 620 416 A 16 GLN HE2y A 20 SER HBy 1.0 1.8 5.80 621 416 A 20 SER HBx A 16 GLN HE2x 1.0 1.8 5.80 622 416 A 16 GLN HE2y A 20 SER HBx 1.0 1.8 5.80 623 417 A 18 LYS H A 16 GLN HGy 1.0 1.8 5.64 624 417 A 16 GLN HGx A 18 LYS H 1.0 1.8 5.64 625 418 A 16 GLN H A 20 SER H 1.0 1.8 6.00 626 419 A 17 CYS H A 19 HIS HD1 1.0 1.8 5.32 627 420 A 18 LYS H A 20 SER H 1.0 1.8 4.94 628 421 A 22 LYS H A 20 SER HA 1.0 1.8 3.84 629 422 A 20 SER HBy A 23 TYR HBx 1.0 1.8 7.26 630 423 A 23 TYR HBy A 20 SER HBy 1.0 1.8 7.26 631 424 A 20 SER HBx A 23 TYR HBx 1.0 1.8 6.26 632 425 A 20 SER HBx A 23 TYR HBy 1.0 1.8 6.26 633 426 A 23 TYR HE% A 20 SER HBy 1.0 1.8 6.50 634 426 A 20 SER HBx A 23 TYR HE% 1.0 1.8 6.50 635 427 A 22 LYS H A 20 SER HBy 1.0 1.8 5.41 636 427 A 20 SER HBx A 22 LYS H 1.0 1.8 5.41 637 428 A 20 SER HBy A 23 TYR HBx 1.0 1.8 5.66 638 428 A 20 SER HBx A 23 TYR HBx 1.0 1.8 5.66 639 428 A 23 TYR HBy A 20 SER HBy 1.0 1.8 5.66 640 428 A 20 SER HBx A 23 TYR HBy 1.0 1.8 5.66 641 429 A 21 NLE HA A 23 TYR HBx 1.0 1.8 5.71 642 429 A 21 NLE HA A 23 TYR HBy 1.0 1.8 5.71 643 430 A 21 NLE HA A 23 TYR H 1.0 1.8 3.39 644 431 A 21 NLE HA A 24 ARG HBx 1.0 1.8 4.88 645 431 A 21 NLE HA A 24 ARG HBy 1.0 1.8 4.88 646 432 A 21 NLE HA A 24 ARG HH2% 1.0 1.8 4.26 647 433 A 21 NLE HA A 24 ARG H 1.0 2.8 3.86 648 434 A 21 NLE HA A 24 ARG HH1% 1.0 1.8 6.30 649 435 A 22 LYS HA A 25 LEU HD2% 1.0 1.8 6.28 650 436 A 22 LYS HA A 26 SER HBx 1.0 1.8 4.50 651 436 A 22 LYS HA A 26 SER HBy 1.0 1.8 4.50 652 437 A 22 LYS HD3 A 26 SER HBx 1.0 0.8 4.70 653 437 A 22 LYS HD2 A 26 SER HBx 1.0 0.8 4.70 654 437 A 26 SER HBy A 22 LYS HD2 1.0 0.8 4.70 655 437 A 22 LYS HD3 A 26 SER HBy 1.0 0.8 4.70 656 438 A 23 TYR HA A 27 PHE HA 1.0 0.8 6.00 657 439 A 23 TYR HA A 27 PHE HBx 1.0 1.8 4.51 658 439 A 23 TYR HA A 27 PHE HBy 1.0 1.8 4.51 659 440 A 23 TYR HA A 27 PHE HD% 1.0 1.8 3.33 660 441 A 23 TYR HA A 27 PHE HE% 1.0 1.8 4.89 661 442 A 27 PHE HD% A 23 TYR HBx 1.0 1.8 6.00 662 442 A 23 TYR HBy A 27 PHE HD% 1.0 1.8 6.00 663 443 A 27 PHE H A 23 TYR HBx 1.0 1.8 5.57 664 443 A 23 TYR HBy A 27 PHE H 1.0 1.8 5.57 665 444 A 23 TYR HD% A 27 PHE HD% 1.0 1.8 3.72 666 445 A 23 TYR HE% A 27 PHE HBx 1.0 1.8 7.11 667 445 A 23 TYR HE% A 27 PHE HBy 1.0 1.8 7.11 668 446 A 23 TYR HE% A 27 PHE HD% 1.0 1.6 3.90 669 447 A 23 TYR HE% A 27 PHE HE% 1.0 1.8 4.06 670 448 A 24 ARG HA A 28 CYS HBx 1.0 1.8 5.20 671 449 A 24 ARG HA A 28 CYS HBy 1.0 1.8 5.20 672 450 A 24 ARG HA A 28 CYS HBx 1.0 1.8 4.74 673 450 A 24 ARG HA A 28 CYS HBy 1.0 1.8 4.74 674 451 A 24 ARG HBx A 28 CYS HBx 1.0 1.8 6.59 675 451 A 24 ARG HBy A 28 CYS HBx 1.0 1.8 6.59 676 451 A 28 CYS HBy A 24 ARG HBx 1.0 1.8 6.59 677 451 A 24 ARG HBy A 28 CYS HBy 1.0 1.8 6.59 678 452 A 24 ARG H A 27 PHE H 1.0 1.8 5.44 679 453 A 27 PHE H A 25 LEU HBy 1.0 1.8 5.93 680 453 A 25 LEU HBx A 27 PHE H 1.0 1.8 5.93 681 454 A 25 LEU HG A 27 PHE HD% 1.0 1.8 7.50 682 455 A 25 LEU H A 27 PHE H 1.0 1.8 4.11 683 456 A 26 SER HBx A 29 ARG HDy 1.0 1.8 5.62 684 456 A 26 SER HBy A 29 ARG HDy 1.0 1.8 5.62 685 456 A 29 ARG HDx A 26 SER HBx 1.0 1.8 5.62 686 456 A 26 SER HBy A 29 ARG HDx 1.0 1.8 5.62 687 457 A 26 SER H A 30 LYS H 1.0 1.8 7.00 688 458 A 26 SER H A 28 CYS HA 1.0 1.8 5.39 689 459 A 26 SER H A 28 CYS H 1.0 1.8 4.08 690 460 A 26 SER H A 29 ARG H 1.0 1.8 5.14 691 461 A 27 PHE H A 29 ARG HG2 1.0 1.8 5.50 692 461 A 27 PHE H A 29 ARG HG3 1.0 1.8 5.50 693 462 A 29 ARG HG3 A 27 PHE HBx 1.0 1.8 6.50 694 462 A 27 PHE HBx A 29 ARG HG2 1.0 1.8 6.50 695 463 A 27 PHE HA A 29 ARG HG2 1.0 1.8 5.50 696 463 A 27 PHE HA A 29 ARG HG3 1.0 1.8 5.50 697 464 A 27 PHE H A 29 ARG H 1.0 1.6 4.80 698 465 A 28 CYS HA A 30 LYS H 1.0 1.8 3.56 699 466 A 28 CYS HA A 31 THR HB 1.0 1.8 5.72 700 467 A 28 CYS HA A 31 THR H 1.0 1.8 4.28 701 468 A 28 CYS HA A 32 CYS H 1.0 1.7 4.28 702 469 A 31 THR H A 28 CYS HBx 1.0 1.8 5.29 703 470 A 28 CYS HBy A 31 THR H 1.0 2.1 5.59 704 471 A 30 LYS HZ% A 28 CYS HBx 1.0 1.8 4.93 705 471 A 28 CYS HBy A 30 LYS HZ% 1.0 1.8 4.93 706 472 A 31 THR HB A 28 CYS HBx 1.0 1.8 5.42 707 472 A 28 CYS HBy A 31 THR HB 1.0 1.8 5.42 708 473 A 31 THR H A 28 CYS HBx 1.0 1.8 4.82 709 473 A 28 CYS HBy A 31 THR H 1.0 1.8 4.82 710 474 A 32 CYS H A 28 CYS HBx 1.0 1.8 4.88 711 474 A 28 CYS HBy A 32 CYS H 1.0 1.8 4.88 712 475 A 31 THR H A 29 ARG HBx 1.0 1.8 5.55 713 475 A 29 ARG HBy A 31 THR H 1.0 1.8 5.55 714 476 A 31 THR H A 29 ARG HG2 1.0 1.8 6.50 715 476 A 29 ARG HG3 A 31 THR H 1.0 1.8 6.50 716 477 A 29 ARG H A 31 THR H 1.0 1.8 4.72 717 478 A 29 ARG H A 31 THR HA 1.0 1.8 7.50 718 479 A 29 ARG H A 32 CYS HBy 1.0 1.8 7.50 719 480 A 30 LYS HA A 32 CYS H 1.0 1.9 5.65 720 481 A 34 THR H A 30 LYS HB2 1.0 1.8 7.50 721 481 A 30 LYS HB3 A 34 THR H 1.0 1.8 7.50 722 482 A 34 THR H A 30 LYS HD2 1.0 1.8 7.50 723 482 A 30 LYS HD3 A 34 THR H 1.0 1.8 7.50 724 483 A 34 THR H A 30 LYS HG2 1.0 1.8 6.30 725 483 A 30 LYS HG3 A 34 THR H 1.0 1.8 6.30 726 484 A 30 LYS H A 32 CYS H 1.0 1.8 4.20 727 485 A 30 LYS H A 34 THR H 1.0 1.8 4.20 728 486 A 31 THR HA A 33 GLY H 1.0 1.8 4.16 729 487 A 31 THR H A 33 GLY H 1.0 1.8 4.62 730 488 A 31 THR H A 34 THR H 1.0 1.8 4.80 731 489 A 34 THR H A 32 CYS HA 1.0 1.8 4.62 732 490 A 34 THR HG2% A 32 CYS HBx 1.0 1.8 5.25 733 491 A 34 THR H A 32 CYS HBx 1.0 1.8 4.27 734 492 A 32 CYS HBy A 34 THR HG2% 1.0 1.8 5.25 735 493 A 32 CYS HBy A 34 THR H 1.0 1.8 4.27 736 494 A 34 THR H A 32 CYS HBx 1.0 1.8 5.12 737 494 A 32 CYS HBy A 34 THR H 1.0 1.8 5.12 738 495 A 32 CYS H A 34 THR HG2% 1.0 1.8 5.34 739 496 A 32 CYS H A 34 THR H 1.0 1.8 4.44 740 497 A 35 CYS H A 33 GLY HA2 1.0 1.8 5.18 741 497 A 35 CYS H A 33 GLY HA3 1.0 1.8 5.18 742 498 A 2 SER HB2 A 29 ARG HBx 1.0 1.8 6.50 743 498 A 2 SER HB3 A 29 ARG HBx 1.0 1.8 6.50 744 498 A 29 ARG HBy A 2 SER HB2 1.0 1.8 6.50 745 498 A 2 SER HB3 A 29 ARG HBy 1.0 1.8 6.50 746 499 A 29 ARG HH1% A 3 CYS HA 1.0 1.8 4.50 747 500 A 29 ARG HH1% A 3 CYS HB2 1.0 1.8 6.50 748 500 A 3 CYS HB3 A 29 ARG HH1% 1.0 1.8 6.50 749 501 A 35 CYS HA A 3 CYS HB2 1.0 1.0 5.50 750 501 A 3 CYS HB3 A 35 CYS HA 1.0 1.0 5.50 751 502 A 3 CYS HB2 A 35 CYS HBy 1.0 1.8 4.32 752 502 A 3 CYS HB3 A 35 CYS HBy 1.0 1.8 4.32 753 502 A 35 CYS HBx A 3 CYS HB2 1.0 1.8 4.32 754 502 A 3 CYS HB3 A 35 CYS HBx 1.0 1.8 4.32 755 503 A 4 ILE HA A 29 ARG HBx 1.0 1.8 5.20 756 503 A 4 ILE HA A 29 ARG HBy 1.0 1.8 5.20 757 504 A 4 ILE H A 29 ARG H 1.0 1.8 5.32 758 505 A 27 PHE HA A 5 ASP HBx 1.0 1.8 4.39 759 506 A 5 ASP HBy A 27 PHE HA 1.0 1.8 4.50 760 507 A 5 ASP HBy A 28 CYS HA 1.0 1.8 6.50 761 508 A 28 CYS HA A 5 ASP HBx 1.0 1.8 5.27 762 508 A 5 ASP HBy A 28 CYS HA 1.0 1.8 5.27 763 509 A 5 ASP HBx A 30 LYS HG2 1.0 1.8 5.82 764 509 A 5 ASP HBy A 30 LYS HG2 1.0 1.8 5.82 765 509 A 30 LYS HG3 A 5 ASP HBx 1.0 1.8 5.82 766 509 A 5 ASP HBy A 30 LYS HG3 1.0 1.8 5.82 767 510 A 5 ASP H A 29 ARG HG2 1.0 1.8 4.04 768 510 A 5 ASP H A 29 ARG HG3 1.0 1.8 4.04 769 511 A 27 PHE HD% A 6 THR HB 1.0 1.8 5.50 770 512 A 6 THR HG2% A 27 PHE HD% 1.0 1.8 4.67 771 513 A 6 THR H A 27 PHE HBx 1.0 1.8 6.21 772 513 A 6 THR H A 27 PHE HBy 1.0 1.8 6.21 773 514 A 6 THR H A 27 PHE HD% 1.0 1.8 5.19 774 515 A 7 ILE HD1% A 12 CYS H 1.0 1.8 5.02 775 516 A 7 ILE HD1% A 23 TYR HD% 1.0 1.8 4.40 776 517 A 7 ILE HD1% A 23 TYR HE% 1.0 1.8 4.05 777 518 A 7 ILE HD1% A 27 PHE HBx 1.0 1.8 3.38 778 519 A 7 ILE HD1% A 27 PHE HBy 1.0 1.8 3.38 779 520 A 7 ILE HD1% A 27 PHE HBx 1.0 1.8 3.07 780 520 A 7 ILE HD1% A 27 PHE HBy 1.0 1.8 3.07 781 521 A 7 ILE HD1% A 27 PHE HD% 1.0 1.8 4.61 782 522 A 7 ILE HD1% A 28 CYS H 1.0 1.8 5.19 783 523 A 7 ILE HD1% A 23 TYR HA 1.0 1.8 4.97 784 524 A 7 ILE HD1% A 27 PHE HE% 1.0 1.8 5.56 785 525 A 7 ILE HD1% A 27 PHE H 1.0 1.8 5.99 786 526 A 7 ILE HG2% A 27 PHE HBx 1.0 1.8 5.04 787 527 A 7 ILE HG2% A 27 PHE HBy 1.0 1.8 5.04 788 528 A 7 ILE HG2% A 27 PHE HBx 1.0 1.8 4.71 789 528 A 7 ILE HG2% A 27 PHE HBy 1.0 1.8 4.71 790 529 A 27 PHE HD% A 7 ILE HG1y 1.0 1.8 4.66 791 529 A 7 ILE HG1x A 27 PHE HD% 1.0 1.8 4.66 792 530 A 27 PHE H A 7 ILE HG1y 1.0 1.8 6.32 793 530 A 7 ILE HG1x A 27 PHE H 1.0 1.8 6.32 794 531 A 23 TYR HD% A 7 ILE HG1y 1.0 1.8 5.59 795 531 A 7 ILE HG1x A 23 TYR HD% 1.0 1.8 5.59 796 532 A 7 ILE H A 27 PHE HBx 1.0 1.8 6.38 797 532 A 7 ILE H A 27 PHE HBy 1.0 1.8 6.38 798 533 A 7 ILE HG1y A 27 PHE HBx 1.0 1.8 4.57 799 533 A 7 ILE HG1x A 27 PHE HBx 1.0 1.8 4.57 800 534 A 27 PHE HBy A 7 ILE HG1y 1.0 1.8 4.57 801 534 A 7 ILE HG1x A 27 PHE HBy 1.0 1.8 4.57 802 535 A 7 ILE HG1y A 27 PHE HBx 1.0 1.8 4.08 803 535 A 7 ILE HG1x A 27 PHE HBx 1.0 1.8 4.08 804 535 A 27 PHE HBy A 7 ILE HG1y 1.0 1.8 4.08 805 535 A 7 ILE HG1x A 27 PHE HBy 1.0 1.8 4.08 806 536 A 23 TYR HD% A 11 ARG HBx 1.0 1.8 5.92 807 536 A 11 ARG HBy A 23 TYR HD% 1.0 1.8 5.92 808 537 A 23 TYR HE% A 11 ARG HBx 1.0 1.8 4.72 809 537 A 11 ARG HBy A 23 TYR HE% 1.0 1.8 4.72 810 538 A 17 CYS H A 12 CYS HA 1.0 1.8 4.91 811 539 A 23 TYR HD% A 12 CYS HA 1.0 1.8 3.63 812 540 A 23 TYR HE% A 12 CYS HA 1.0 1.8 4.43 813 541 A 28 CYS HA A 12 CYS HA 1.0 1.8 7.51 814 542 A 12 CYS HBy A 23 TYR HD% 1.0 1.8 7.50 815 543 A 31 THR HA A 12 CYS HBx 1.0 1.8 6.14 816 543 A 12 CYS HBy A 31 THR HA 1.0 1.8 6.14 817 544 A 28 CYS HA A 12 CYS HBx 1.0 1.8 6.56 818 544 A 12 CYS HBy A 28 CYS HA 1.0 1.8 6.56 819 545 A 31 THR H A 12 CYS HBx 1.0 1.8 6.25 820 545 A 12 CYS HBy A 31 THR H 1.0 1.8 6.25 821 546 A 20 SER H A 15 PHE HE% 1.0 1.8 5.50 822 547 A 16 GLN HBx A 23 TYR HBx 1.0 1.8 5.92 823 548 A 23 TYR HBy A 16 GLN HBx 1.0 1.8 5.92 824 549 A 23 TYR HD% A 16 GLN HBx 1.0 1.8 4.97 825 550 A 16 GLN HBy A 23 TYR HBx 1.0 1.8 5.92 826 551 A 16 GLN HBy A 23 TYR HBy 1.0 1.8 5.92 827 552 A 16 GLN HBy A 23 TYR HD% 1.0 1.8 4.97 828 553 A 16 GLN HBx A 23 TYR HBx 1.0 1.8 4.73 829 553 A 16 GLN HBy A 23 TYR HBx 1.0 1.8 4.73 830 553 A 23 TYR HBy A 16 GLN HBx 1.0 1.8 4.73 831 553 A 16 GLN HBy A 23 TYR HBy 1.0 1.8 4.73 832 554 A 23 TYR HD% A 16 GLN HBx 1.0 1.8 4.62 833 554 A 16 GLN HBy A 23 TYR HD% 1.0 1.8 4.62 834 555 A 23 TYR HD% A 16 GLN HE2x 1.0 1.8 5.27 835 555 A 16 GLN HE2y A 23 TYR HD% 1.0 1.8 5.27 836 556 A 23 TYR HE% A 16 GLN HE2x 1.0 1.8 4.57 837 556 A 16 GLN HE2y A 23 TYR HE% 1.0 1.8 4.57 838 557 A 23 TYR HE% A 16 GLN HE2x 1.0 1.8 4.30 839 557 A 16 GLN HE2y A 23 TYR HE% 1.0 1.8 4.30 840 558 A 23 TYR HD% A 16 GLN HGy 1.0 1.8 5.60 841 558 A 16 GLN HGx A 23 TYR HD% 1.0 1.8 5.60 842 559 A 17 CYS HA A 23 TYR HBx 1.0 1.8 4.50 843 560 A 23 TYR HBy A 17 CYS HA 1.0 1.8 4.50 844 561 A 17 CYS HA A 23 TYR HBx 1.0 1.8 4.31 845 561 A 23 TYR HBy A 17 CYS HA 1.0 1.8 4.31 846 562 A 23 TYR H A 17 CYS HA 1.0 1.8 5.22 847 563 A 24 ARG HA A 17 CYS HA 1.0 1.8 5.53 848 564 A 17 CYS HA A 24 ARG HBx 1.0 1.8 5.98 849 564 A 24 ARG HBy A 17 CYS HA 1.0 1.8 5.98 850 565 A 24 ARG H A 17 CYS HA 1.0 1.8 3.93 851 566 A 32 CYS HBy A 17 CYS HA 1.0 1.8 5.50 852 567 A 17 CYS H A 23 TYR HBx 1.0 1.8 4.82 853 568 A 17 CYS H A 23 TYR HBx 1.0 1.8 4.57 854 568 A 17 CYS H A 23 TYR HBy 1.0 1.8 4.57 855 569 A 22 LYS HA A 27 PHE H 1.0 1.8 4.56 856 570 A 22 LYS HA A 27 PHE HD% 1.0 1.8 6.50 857 571 A 22 LYS HA A 27 PHE HE% 1.0 1.8 7.00 858 572 A 27 PHE HE% A 22 LYS HBy 1.0 1.3 5.28 859 573 A 22 LYS HBx A 27 PHE HE% 1.0 1.8 5.28 860 574 A 27 PHE HD% A 22 LYS HBy 1.0 1.8 5.97 861 574 A 22 LYS HBx A 27 PHE HD% 1.0 1.8 5.97 862 575 A 27 PHE HE% A 22 LYS HBy 1.0 1.8 5.99 863 575 A 22 LYS HBx A 27 PHE HE% 1.0 1.8 5.99 864 576 A 27 PHE HZ A 22 LYS HBy 1.0 1.8 6.04 865 576 A 22 LYS HBx A 27 PHE HZ 1.0 1.8 6.04 866 577 A 27 PHE HD% A 22 LYS HD2 1.0 1.8 4.63 867 577 A 22 LYS HD3 A 27 PHE HD% 1.0 1.8 4.63 868 578 A 27 PHE HE% A 22 LYS HD2 1.0 1.8 4.58 869 578 A 22 LYS HD3 A 27 PHE HE% 1.0 1.8 4.58 870 579 A 27 PHE HZ A 22 LYS HD2 1.0 1.8 4.48 871 579 A 22 LYS HD3 A 27 PHE HZ 1.0 1.8 4.48 872 580 A 27 PHE HE% A 22 LYS HG2 1.0 1.8 4.70 873 580 A 22 LYS HG3 A 27 PHE HE% 1.0 1.8 4.70 874 581 A 23 TYR HD% A 28 CYS HBy 1.0 1.8 7.50 875 582 A 24 ARG HA A 30 LYS H 1.0 1.7 6.30 876 583 A 24 ARG HA A 32 CYS HBx 1.0 0.8 4.73 877 584 A 24 ARG HA A 32 CYS HBy 1.0 0.8 4.73 878 585 A 24 ARG HA A 32 CYS H 1.0 2.8 4.95 879 586 A 24 ARG HA A 34 THR H 1.0 2.2 5.90 880 587 A 24 ARG HA A 34 THR HB 1.0 1.8 3.66 881 588 A 24 ARG HA A 34 THR HG2% 1.0 1.8 4.24 882 589 A 24 ARG HBx A 32 CYS HBx 1.0 1.8 7.49 883 589 A 24 ARG HBy A 32 CYS HBx 1.0 1.8 7.49 884 589 A 32 CYS HBy A 24 ARG HBx 1.0 1.8 7.49 885 589 A 24 ARG HBy A 32 CYS HBy 1.0 1.8 7.49 886 590 A 34 THR HG2% A 24 ARG HBx 1.0 1.8 5.99 887 590 A 24 ARG HBy A 34 THR HG2% 1.0 1.8 5.99 888 591 A 24 ARG HGx A 32 CYS HBx 1.0 1.8 6.31 889 592 A 24 ARG HGx A 32 CYS HBy 1.0 1.8 6.31 890 593 A 24 ARG HGy A 32 CYS HBx 1.0 1.8 6.31 891 594 A 32 CYS HBy A 24 ARG HGy 1.0 1.8 6.31 892 595 A 32 CYS HA A 24 ARG HGy 1.0 1.8 6.80 893 595 A 24 ARG HGx A 32 CYS HA 1.0 1.8 6.80 894 596 A 24 ARG HGx A 32 CYS HBx 1.0 1.8 5.13 895 596 A 24 ARG HGy A 32 CYS HBx 1.0 1.8 5.13 896 596 A 32 CYS HBy A 24 ARG HGy 1.0 1.8 5.13 897 596 A 24 ARG HGx A 32 CYS HBy 1.0 1.8 5.13 898 597 A 32 CYS H A 24 ARG HGy 1.0 1.8 7.06 899 597 A 24 ARG HGx A 32 CYS H 1.0 1.8 7.06 900 598 A 34 THR HG2% A 24 ARG HGy 1.0 1.8 5.75 901 598 A 24 ARG HGx A 34 THR HG2% 1.0 1.8 5.75 902 599 A 24 ARG H A 32 CYS HBx 1.0 1.8 5.71 903 599 A 24 ARG H A 32 CYS HBy 1.0 1.8 5.71 904 600 A 24 ARG H A 34 THR HG2% 1.0 1.8 5.16 905 601 A 28 CYS HA A 33 GLY H 1.0 1.8 6.50 906 602 A 29 ARG HA A 35 CYS H 1.0 1.8 4.50 907 603 A 35 CYS H A 29 ARG HG2 1.0 1.8 6.50 908 603 A 29 ARG HG3 A 35 CYS H 1.0 1.8 6.50 909 604 A 29 ARG HH1% A 34 THR HG2% 1.0 1.8 4.51 910 605 A 29 ARG HH1% A 35 CYS HA 1.0 1.8 6.51 911 606 A 29 ARG HH1% A 35 CYS HBx 1.0 1.8 5.51 912 607 A 29 ARG H A 34 THR HG2% 1.0 1.8 6.50 913 608 A 35 CYS H A 30 LYS HD2 1.0 1.8 6.53 914 608 A 30 LYS HD3 A 35 CYS H 1.0 1.8 6.53 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _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 11 ARG H A 8 PRO O 1.0 1.6 2.6 2 2 A 8 PRO O A 11 ARG N 1.0 2.5 3.5 3 3 A 12 CYS H A 9 LYS O 1.0 1.6 2.6 4 4 A 9 LYS O A 12 CYS N 1.0 2.5 3.5 5 5 A 17 CYS H A 13 THR O 1.0 1.6 2.6 6 6 A 13 THR O A 17 CYS N 1.0 2.5 3.5 7 7 A 19 HIS H A 15 PHE O 1.0 1.6 2.6 8 8 A 15 PHE O A 19 HIS N 1.0 2.5 3.5 9 9 A 20 SER H A 16 GLN O 1.0 1.6 2.6 10 10 A 16 GLN O A 20 SER N 1.0 2.5 3.5 11 11 A 27 PHE H A 22 LYS O 1.0 1.6 2.6 12 12 A 22 LYS O A 27 PHE N 1.0 2.5 3.5 13 13 A 33 GLY H A 30 LYS O 1.0 1.6 2.6 14 14 A 30 LYS O A 33 GLY N 1.0 2.5 3.5 stop_ save_