data_nef_c18363_2mdl 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 2MDL stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 2 CYS SG 1 23 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 THR start . . 2 A 2 CYS middle -HG . 3 A 3 HIS middle . . 4 A 4 ILE middle . . 5 A 5 ARG middle . . 6 A 6 ARG middle . . 7 A 7 LYS middle . . 8 A 8 PRO middle . false 9 A 9 LYS middle . . 10 A 10 PHE middle . . 11 A 11 ARG middle . . 12 A 12 LYS middle . . 13 A 13 PHE middle . . 14 A 14 LYS middle . . 15 A 15 LEU middle . . 16 A 16 TYR middle . . 17 A 17 HIS middle . . 18 A 18 GLU middle . . 19 A 19 GLY middle . false 20 A 20 LYS middle . . 21 A 21 PHE middle . . 22 A 22 TRP middle . . 23 A 23 CYS middle -HG . 24 A 24 PRO end . false 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 THR HA H 1 3.834 0.001 A 1 THR HB H 1 4.097 0.002 A 1 THR HG2% H 1 1.264 0.05 A 1 THR CA C 13 58.305 0.1 A 1 THR CB C 13 66.124 0.1 A 2 CYS H H 1 8.875 0.002 A 2 CYS HA H 1 4.867 0.003 A 2 CYS HBy H 1 3.192 0.05 A 2 CYS HBx H 1 3.053 0.05 A 2 CYS N N 15 122.143 0.1 A 3 HIS H H 1 9.010 0.014 A 3 HIS HA H 1 4.738 0.007 A 3 HIS HBx H 1 2.982 0.007 A 3 HIS HBy H 1 3.250 0.008 A 3 HIS CA C 13 52.500 0.1 A 3 HIS CB C 13 26.230 0.011 A 3 HIS N N 15 121.482 0.000 A 4 ILE H H 1 8.425 0.014 A 4 ILE HA H 1 4.189 0.001 A 4 ILE HB H 1 1.877 0.006 A 4 ILE HD1% H 1 0.901 0.05 A 4 ILE HG1y H 1 1.201 0.002 A 4 ILE HG2% H 1 0.934 0.05 A 4 ILE CA C 13 58.576 0.1 A 4 ILE CB C 13 35.731 0.1 A 4 ILE N N 15 123.626 0.1 A 5 ARG H H 1 8.711 0.006 A 5 ARG HA H 1 4.414 0.006 A 5 ARG HBx H 1 1.714 0.003 A 5 ARG HBy H 1 1.814 0.002 A 5 ARG HDy H 1 3.031 0.002 A 5 ARG HE H 1 7.201 0.002 A 5 ARG HGx H 1 1.524 0.003 A 5 ARG HGy H 1 1.579 0.003 A 5 ARG CA C 13 53.653 0.1 A 5 ARG CB C 13 29.043 0.1 A 5 ARG N N 15 126.410 0.1 A 6 ARG H H 1 8.325 0.010 A 6 ARG HA H 1 4.367 0.001 A 6 ARG HBx H 1 1.768 0.020 A 6 ARG HBy H 1 1.833 0.002 A 6 ARG HDy H 1 3.172 0.003 A 6 ARG HE H 1 7.228 0.011 A 6 ARG HGx H 1 1.610 0.05 A 6 ARG HGy H 1 1.655 0.05 A 6 ARG CA C 13 52.886 0.1 A 6 ARG CB C 13 28.586 0.1 A 6 ARG N N 15 122.179 0.1 A 7 LYS H H 1 8.447 0.002 A 7 LYS HA H 1 4.476 0.020 A 7 LYS HBy H 1 1.814 0.003 A 7 LYS HDy H 1 1.691 0.05 A 7 LYS HEy H 1 3.005 0.05 A 7 LYS HGy H 1 1.429 0.05 A 7 LYS CA C 13 51.935 0.1 A 7 LYS CB C 13 29.578 0.1 A 7 LYS N N 15 123.819 0.1 A 8 PRO HA H 1 4.393 0.003 A 8 PRO HBx H 1 2.242 0.002 A 8 PRO HDx H 1 3.571 0.004 A 8 PRO HDy H 1 3.802 0.002 A 8 PRO HGx H 1 1.845 0.05 A 8 PRO HGy H 1 1.981 0.001 A 8 PRO CA C 13 60.435 0.1 A 8 PRO CB C 13 29.255 0.1 A 8 PRO CD C 13 47.795 0.041 A 9 LYS H H 1 8.399 0.002 A 9 LYS HA H 1 4.166 0.007 A 9 LYS HBy H 1 1.688 0.05 A 9 LYS HBx H 1 1.662 0.05 A 9 LYS HDy H 1 1.335 0.05 A 9 LYS HEy H 1 2.697 0.05 A 9 LYS HGy H 1 1.227 0.05 A 9 LYS CA C 13 54.057 0.1 A 9 LYS CB C 13 29.997 0.1 A 9 LYS N N 15 120.323 0.1 A 10 PHE H H 1 8.053 0.008 A 10 PHE HA H 1 4.688 0.002 A 10 PHE HBy H 1 3.202 0.001 A 10 PHE HBx H 1 3.068 0.001 A 10 PHE CA C 13 55.395 0.1 A 10 PHE CB C 13 37.156 0.009 A 10 PHE N N 15 121.894 0.1 A 11 ARG H H 1 8.213 0.001 A 11 ARG HA H 1 4.269 0.001 A 11 ARG HBy H 1 1.809 0.017 A 11 ARG HBx H 1 1.727 0.016 A 11 ARG HDy H 1 3.173 0.004 A 11 ARG HE H 1 7.244 0.008 A 11 ARG HGx H 1 1.533 0.05 A 11 ARG HGy H 1 1.583 0.015 A 11 ARG CA C 13 53.554 0.1 A 11 ARG CB C 13 28.504 0.1 A 11 ARG N N 15 122.102 0.1 A 12 LYS H H 1 8.188 0.004 A 12 LYS HA H 1 4.215 0.002 A 12 LYS HBy H 1 1.743 0.05 A 12 LYS HDy H 1 1.680 0.05 A 12 LYS HEy H 1 2.916 0.05 A 12 LYS HGx H 1 1.268 0.05 A 12 LYS HGy H 1 1.352 0.05 A 12 LYS CA C 13 53.741 0.1 A 12 LYS CB C 13 29.790 0.1 A 12 LYS N N 15 121.158 0.1 A 13 PHE H H 1 8.042 0.006 A 13 PHE HA H 1 4.668 0.005 A 13 PHE HBx H 1 3.055 0.005 A 13 PHE HBy H 1 3.181 0.009 A 13 PHE CA C 13 54.624 0.1 A 13 PHE CB C 13 40.464 0.003 A 13 PHE N N 15 119.869 0.1 A 14 LYS H H 1 8.297 0.003 A 14 LYS HA H 1 4.228 0.004 A 14 LYS HBy H 1 1.730 0.004 A 14 LYS HDx H 1 1.597 0.05 A 14 LYS HDy H 1 1.676 0.05 A 14 LYS HEy H 1 2.969 0.05 A 14 LYS HGx H 1 1.307 0.05 A 14 LYS HGy H 1 1.364 0.05 A 14 LYS CA C 13 57.694 0.1 A 14 LYS CB C 13 29.816 0.1 A 14 LYS N N 15 122.425 0.1 A 15 LEU H H 1 8.064 0.010 A 15 LEU HA H 1 4.406 0.006 A 15 LEU HBx H 1 1.519 0.009 A 15 LEU HBy H 1 1.607 0.001 A 15 LEU HDx% H 1 0.885 0.003 A 15 LEU HDy% H 1 0.936 0.001 A 15 LEU HG H 1 1.186 0.05 A 15 LEU CA C 13 52.480 0.1 A 15 LEU CB C 13 40.168 0.066 A 15 LEU N N 15 118.890 0.1 A 16 TYR H H 1 8.382 0.005 A 16 TYR HA H 1 4.583 0.004 A 16 TYR HBy H 1 2.942 0.015 A 16 TYR HBx H 1 2.939 0.016 A 16 TYR HDx H 1 7.078 0.003 A 16 TYR HDy H 1 7.078 0.003 A 16 TYR HEx H 1 6.805 0.001 A 16 TYR HEy H 1 6.805 0.001 A 16 TYR CA C 13 54.902 0.1 A 16 TYR CB C 13 39.033 0.1 A 16 TYR CEx C 13 115.223 0.1 A 16 TYR CEy C 13 115.223 0.1 A 16 TYR N N 15 120.952 0.1 A 17 HIS H H 1 8.524 0.003 A 17 HIS HA H 1 4.526 0.010 A 17 HIS HBx H 1 2.845 0.05 A 17 HIS HBy H 1 3.082 0.001 A 17 HIS CA C 13 51.935 0.1 A 17 HIS CB C 13 26.308 0.1 A 17 HIS N N 15 120.795 0.1 A 18 GLU H H 1 8.489 0.012 A 18 GLU HA H 1 4.340 0.004 A 18 GLU HBx H 1 1.990 0.05 A 18 GLU HBy H 1 2.119 0.003 A 18 GLU HGy H 1 2.317 0.05 A 18 GLU CA C 13 52.989 0.1 A 18 GLU CB C 13 26.490 0.1 A 18 GLU N N 15 122.417 0.1 A 19 GLY H H 1 8.504 0.003 A 19 GLY HAx H 1 3.930 0.012 A 19 GLY HAy H 1 4.056 0.002 A 19 GLY CA C 13 42.690 0.005 A 19 GLY N N 15 110.487 0.1 A 20 LYS H H 1 8.348 0.002 A 20 LYS HA H 1 4.278 0.001 A 20 LYS HBy H 1 1.658 0.004 A 20 LYS HDy H 1 1.598 0.05 A 20 LYS HEy H 1 2.942 0.05 A 20 LYS HGy H 1 1.260 0.05 A 20 LYS CB C 13 29.824 0.1 A 20 LYS N N 15 120.892 0.1 A 21 PHE H H 1 8.196 0.001 A 21 PHE HA H 1 4.661 0.002 A 21 PHE HBx H 1 2.976 0.002 A 21 PHE HBy H 1 2.995 0.015 A 21 PHE HDx H 1 6.977 0.003 A 21 PHE HDy H 1 6.977 0.003 A 21 PHE HEx H 1 7.068 0.012 A 21 PHE HEy H 1 7.068 0.012 A 21 PHE HZ H 1 7.165 0.05 A 21 PHE CA C 13 54.625 0.1 A 21 PHE CB C 13 39.439 0.1 A 21 PHE N N 15 119.510 0.1 A 22 TRP H H 1 8.292 0.002 A 22 TRP HA H 1 5.003 0.007 A 22 TRP HBx H 1 3.181 0.005 A 22 TRP HBy H 1 3.265 0.009 A 22 TRP HD1 H 1 7.267 0.002 A 22 TRP HE1 H 1 10.151 0.004 A 22 TRP HE3 H 1 7.564 0.011 A 22 TRP HH2 H 1 7.121 0.05 A 22 TRP HZ2 H 1 7.241 0.000 A 22 TRP HZ3 H 1 7.445 0.002 A 22 TRP CA C 13 53.793 0.1 A 22 TRP CB C 13 26.551 0.003 A 22 TRP N N 15 120.353 0.1 A 22 TRP NE1 N 15 129.330 0.1 A 23 CYS H H 1 8.671 0.016 A 23 CYS HA H 1 4.989 0.014 A 23 CYS HBy H 1 2.777 0.008 A 23 CYS CA C 13 49.940 0.1 A 23 CYS CB C 13 38.541 0.1 A 23 CYS N N 15 122.911 0.1 A 24 PRO HA H 1 4.335 0.001 A 24 PRO HBx H 1 2.226 0.006 A 24 PRO HDx H 1 3.511 0.002 A 24 PRO HDy H 1 3.664 0.001 A 24 PRO HGx H 1 1.945 0.001 A 24 PRO HGy H 1 1.996 0.004 A 24 PRO CA C 13 61.317 0.1 A 24 PRO CB C 13 29.138 0.1 A 24 PRO CD C 13 47.462 0.042 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-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 4 ILE HA A 5 ARG H 1.0 . 3.23 2 2 A 11 ARG HA A 12 LYS H 1.0 . 3.29 3 3 A 20 LYS HA A 21 PHE H 1.0 . 3.24 4 4 A 16 TYR HA A 17 HIS H 1.0 . 3.30 5 5 A 14 LYS HA A 15 LEU H 1.0 . 3.08 6 6 A 13 PHE HA A 14 LYS H 1.0 . 3.33 7 7 A 21 PHE HA A 22 TRP H 1.0 . 3.50 8 8 A 10 PHE HA A 11 ARG H 1.0 . 3.29 9 9 A 8 PRO HA A 9 LYS H 1.0 . 3.03 10 10 A 6 ARG HA A 7 LYS H 1.0 . 3.09 11 11 A 3 HIS H A 2 CYS HBy 1.0 . 4.40 12 12 A 3 HIS H A 2 CYS HBx 1.0 . 4.40 13 13 A 14 LYS H A 13 PHE H 1.0 . 4.85 14 14 A 15 LEU H A 14 LYS H 1.0 . 5.19 15 15 A 15 LEU H A 16 TYR H 1.0 . 3.71 16 16 A 11 ARG H A 10 PHE H 1.0 . 4.02 17 17 A 12 LYS H A 13 PHE H 1.0 . 4.15 18 18 A 21 PHE H A 20 LYS H 1.0 . 4.37 19 19 A 20 LYS H A 19 GLY H 1.0 . 4.57 20 20 A 5 ARG H A 6 ARG H 1.0 . 4.24 21 21 A 3 HIS H A 4 ILE H 1.0 . 4.47 22 22 A 21 PHE H A 22 TRP H 1.0 . 3.64 23 23 A 22 TRP H A 22 TRP HD1 1.0 . 4.04 24 24 A 21 PHE H A 22 TRP HD1 1.0 . 4.20 25 25 A 15 LEU H A 22 TRP HZ2 1.0 . 3.92 26 26 A 16 TYR HE% A 13 PHE HBx 1.0 . 5.50 27 27 A 16 TYR HE% A 18 GLU HA 1.0 . 5.24 28 28 A 11 ARG HA A 16 TYR HE% 1.0 . 5.26 29 29 A 22 TRP H A 22 TRP HBy 1.0 . 4.08 30 30 A 14 LYS H A 13 PHE HBy 1.0 . 4.22 31 31 A 22 TRP H A 22 TRP HBx 1.0 . 4.08 32 32 A 17 HIS H A 17 HIS HBy 1.0 . 4.18 33 33 A 22 TRP H A 21 PHE HBy 1.0 . 4.23 34 34 A 21 PHE H A 21 PHE HBx 1.0 . 3.63 35 35 A 21 PHE H A 21 PHE HBy 1.0 . 4.04 36 36 A 17 HIS H A 16 TYR HBy 1.0 . 4.04 37 37 A 16 TYR H A 16 TYR HBx 1.0 . 3.85 38 38 A 17 HIS H A 17 HIS HBx 1.0 . 4.18 39 39 A 5 ARG H A 4 ILE HB 1.0 . 4.66 40 40 A 5 ARG H A 5 ARG HBy 1.0 . 4.16 41 41 A 5 ARG H A 5 ARG HBx 1.0 . 3.88 42 42 A 5 ARG H A 5 ARG HGx 1.0 . 4.30 43 43 A 5 ARG H A 4 ILE HG2% 1.0 . 4.26 44 44 A 5 ARG H A 4 ILE HD1% 1.0 . 4.87 45 45 A 18 GLU H A 18 GLU HBy 1.0 . 4.20 46 46 A 18 GLU H A 18 GLU HBx 1.0 . 4.20 47 47 A 4 ILE H A 4 ILE HB 1.0 . 3.82 48 48 A 6 ARG H A 6 ARG HBy 1.0 . 3.99 49 49 A 6 ARG H A 6 ARG HBx 1.0 . 3.99 50 50 A 10 PHE H A 9 LYS HBy 1.0 . 4.76 51 51 A 9 LYS H A 9 LYS HBx 1.0 . 3.98 52 52 A 9 LYS H A 9 LYS HBy 1.0 . 3.98 53 53 A 10 PHE H A 9 LYS HBx 1.0 . 4.76 54 54 A 6 ARG H A 5 ARG HBx 1.0 . 4.34 55 55 A 16 TYR H A 15 LEU HBy 1.0 . 4.37 56 56 A 6 ARG H A 5 ARG HGx 1.0 . 3.67 57 57 A 16 TYR H A 15 LEU HBx 1.0 . 4.37 58 58 A 6 ARG H A 5 ARG HGy 1.0 . 4.64 59 59 A 14 LYS H A 14 LYS HGy 1.0 . 4.63 60 60 A 12 LYS H A 12 LYS HGy 1.0 . 4.60 61 61 A 12 LYS H A 12 LYS HGx 1.0 . 4.60 62 62 A 6 ARG H A 4 ILE HG2% 1.0 . 4.70 63 63 A 4 ILE H A 4 ILE HG2% 1.0 . 4.54 64 64 A 4 ILE H A 4 ILE HD1% 1.0 . 5.02 65 65 A 6 ARG HE A 6 ARG HBy 1.0 . 4.76 66 66 A 11 ARG HE A 11 ARG HBy 1.0 . 5.39 67 67 A 5 ARG HE A 5 ARG HBy 1.0 . 4.98 68 68 A 5 ARG HE A 5 ARG HBx 1.0 . 4.93 69 69 A 11 ARG HE A 14 LYS HGx 1.0 . 5.46 70 70 A 22 TRP HD1 A 15 LEU HDx% 1.0 . 4.91 71 71 A 8 PRO HDx A 24 PRO HDy 1.0 . 4.07 72 72 A 7 LYS HA A 8 PRO HDy 1.0 . 3.34 73 73 A 8 PRO HDx A 7 LYS HA 1.0 . 3.51 74 74 A 23 CYS HA A 24 PRO HDy 1.0 . 3.75 75 75 A 23 CYS HA A 24 PRO HDx 1.0 . 3.75 76 76 A 20 LYS HA A 21 PHE HBx 1.0 . 4.57 77 77 A 21 PHE HA A 20 LYS HBy 1.0 . 4.59 78 78 A 4 ILE HA A 5 ARG HGx 1.0 . 4.72 79 79 A 14 LYS HA A 14 LYS HDx 1.0 . 4.32 80 80 A 4 ILE HB A 4 ILE HD1% 1.0 . 3.74 81 81 A 23 CYS H A 22 TRP HBy 1.0 . 4.86 82 82 A 23 CYS H A 22 TRP HBx 1.0 . 4.86 83 83 A 22 TRP HA A 22 TRP HE3 1.0 . 4.16 84 84 A 22 TRP HD1 A 22 TRP HA 1.0 . 4.54 85 85 A 14 LYS H A 13 PHE HBx 1.0 . 4.22 86 86 A 16 TYR HA A 16 TYR HD% 1.0 . 3.88 87 87 A 13 PHE HA A 16 TYR HD% 1.0 . 5.40 88 88 A 21 PHE HA A 21 PHE HE% 1.0 . 5.50 89 89 A 21 PHE HA A 21 PHE HD% 1.0 . 4.66 90 90 A 14 LYS HA A 14 LYS HDy 1.0 . 4.32 91 91 A 14 LYS HA A 22 TRP HZ2 1.0 . 5.02 92 92 A 20 LYS HA A 22 TRP HD1 1.0 . 4.96 93 93 A 21 PHE HD% A 21 PHE HZ 1.0 . 3.80 94 94 A 14 LYS H A 16 TYR H 1.0 . 4.80 95 95 A 16 TYR H A 16 TYR HD% 1.0 . 4.52 96 96 A 14 LYS H A 14 LYS HGx 1.0 . 4.63 97 97 A 4 ILE H A 3 HIS HBx 1.0 . 4.94 98 98 A 4 ILE H A 3 HIS HBy 1.0 . 4.94 99 99 A 17 HIS HA A 16 TYR HBy 1.0 . 4.55 100 100 A 22 TRP HE3 A 15 LEU HDy% 1.0 . 5.50 101 101 A 22 TRP HE3 A 15 LEU HDx% 1.0 . 5.50 102 102 A 16 TYR HE% A 18 GLU HBx 1.0 . 5.50 103 103 A 16 TYR HE% A 18 GLU HBy 1.0 . 5.50 104 104 A 6 ARG HE A 6 ARG HBx 1.0 . 4.76 105 105 A 11 ARG HE A 11 ARG HBx 1.0 . 5.39 106 106 A 11 ARG HE A 14 LYS HGy 1.0 . 5.46 107 107 A 22 TRP HD1 A 15 LEU HG 1.0 . 5.50 108 108 A 22 TRP HD1 A 15 LEU HDy% 1.0 . 4.91 109 109 A 16 TYR HE% A 13 PHE HBy 1.0 . 5.50 110 110 A 22 TRP HE3 A 15 LEU HA 1.0 . 5.50 111 111 A 22 TRP HD1 A 15 LEU HA 1.0 . 5.50 112 112 A 22 TRP HZ2 A 15 LEU HA 1.0 . 5.41 113 113 A 14 LYS HA A 11 ARG HE 1.0 . 5.29 114 114 A 21 PHE HZ A 3 HIS HA 1.0 . 5.50 115 115 A 21 PHE HA A 22 TRP HD1 1.0 . 4.13 116 116 A 16 TYR HA A 22 TRP HZ2 1.0 . 5.50 117 117 A 21 PHE HE% A 3 HIS HA 1.0 . 5.50 118 118 A 16 TYR HD% A 17 HIS HA 1.0 . 5.05 119 119 A 16 TYR HD% A 15 LEU HA 1.0 . 5.16 120 120 A 15 LEU HA A 22 TRP HH2 1.0 . 5.50 121 121 A 16 TYR HA A 16 TYR HE% 1.0 . 5.50 122 122 A 16 TYR HE% A 15 LEU HA 1.0 . 5.50 123 123 A 11 ARG HE A 22 TRP HZ3 1.0 . 3.11 124 124 A 11 ARG HE A 22 TRP HE3 1.0 . 4.63 125 125 A 22 TRP HD1 A 21 PHE HD% 1.0 . 5.50 126 126 A 6 ARG HA A 5 ARG HBx 1.0 . 5.12 127 127 A 6 ARG HA A 5 ARG HGy 1.0 . 4.74 128 128 A 12 LYS HA A 12 LYS HGy 1.0 . 4.11 129 129 A 12 LYS HA A 12 LYS HGx 1.0 . 4.11 130 130 A 15 LEU HA A 15 LEU HDy% 1.0 . 4.89 131 131 A 4 ILE HA A 4 ILE HG2% 1.0 . 3.50 132 132 A 4 ILE HA A 4 ILE HD1% 1.0 . 3.91 133 133 A 1 THR HA A 1 THR HG2% 1.0 . 3.70 134 134 A 6 ARG HA A 5 ARG HA 1.0 . 5.12 135 135 A 6 ARG HA A 7 LYS HA 1.0 . 5.50 136 136 A 14 LYS HA A 15 LEU HA 1.0 . 4.62 137 137 A 8 PRO HDx A 24 PRO HDx 1.0 . 4.07 138 138 A 15 LEU HA A 15 LEU HDx% 1.0 . 4.89 139 139 A 23 CYS HA A 2 CYS HBy 1.0 . 4.61 140 139 A 23 CYS HA A 2 CYS HBx 1.0 . 4.61 141 140 A 2 CYS HBy A 23 CYS HBx 1.0 . 3.24 142 140 A 2 CYS HBx A 23 CYS HBx 1.0 . 3.24 143 140 A 23 CYS HBy A 2 CYS HBy 1.0 . 3.24 144 140 A 2 CYS HBx A 23 CYS HBy 1.0 . 3.24 145 141 A 3 HIS H A 3 HIS HBx 1.0 . 3.68 146 141 A 3 HIS H A 3 HIS HBy 1.0 . 3.68 147 142 A 4 ILE H A 3 HIS HBx 1.0 . 4.33 148 142 A 4 ILE H A 3 HIS HBy 1.0 . 4.33 149 143 A 21 PHE HE% A 3 HIS HBx 1.0 . 4.80 150 143 A 21 PHE HE% A 3 HIS HBy 1.0 . 4.80 151 144 A 21 PHE HZ A 3 HIS HBx 1.0 . 3.86 152 144 A 21 PHE HZ A 3 HIS HBy 1.0 . 3.86 153 145 A 4 ILE H A 4 ILE HG1x 1.0 . 4.87 154 145 A 4 ILE H A 4 ILE HG1y 1.0 . 4.87 155 146 A 4 ILE HA A 4 ILE HG1x 1.0 . 3.71 156 146 A 4 ILE HA A 4 ILE HG1y 1.0 . 3.71 157 147 A 5 ARG HA A 5 ARG HDx 1.0 . 4.81 158 147 A 5 ARG HA A 5 ARG HDy 1.0 . 4.81 159 148 A 6 ARG H A 6 ARG HBx 1.0 . 3.43 160 148 A 6 ARG H A 6 ARG HBy 1.0 . 3.43 161 149 A 6 ARG H A 6 ARG HGx 1.0 . 4.53 162 149 A 6 ARG H A 6 ARG HGy 1.0 . 4.53 163 150 A 6 ARG HA A 6 ARG HDx 1.0 . 4.28 164 150 A 6 ARG HA A 6 ARG HDy 1.0 . 4.28 165 151 A 6 ARG HBy A 6 ARG HDx 1.0 . 3.30 166 151 A 6 ARG HBx A 6 ARG HDx 1.0 . 3.30 167 151 A 6 ARG HDy A 6 ARG HBx 1.0 . 3.30 168 151 A 6 ARG HBy A 6 ARG HDy 1.0 . 3.30 169 152 A 6 ARG HE A 6 ARG HGx 1.0 . 3.68 170 152 A 6 ARG HE A 6 ARG HGy 1.0 . 3.68 171 153 A 7 LYS H A 6 ARG HDx 1.0 . 4.58 172 153 A 7 LYS H A 6 ARG HDy 1.0 . 4.58 173 154 A 7 LYS H A 7 LYS HBx 1.0 . 3.39 174 154 A 7 LYS H A 7 LYS HBy 1.0 . 3.39 175 155 A 7 LYS H A 7 LYS HGx 1.0 . 4.06 176 155 A 7 LYS H A 7 LYS HGy 1.0 . 4.06 177 156 A 7 LYS H A 7 LYS HDx 1.0 . 3.66 178 156 A 7 LYS H A 7 LYS HDy 1.0 . 3.66 179 157 A 7 LYS H A 7 LYS HEx 1.0 . 5.28 180 157 A 7 LYS H A 7 LYS HEy 1.0 . 5.28 181 158 A 7 LYS H A 24 PRO HBx 1.0 . 5.07 182 158 A 7 LYS H A 24 PRO HBy 1.0 . 5.07 183 159 A 7 LYS HA A 7 LYS HDx 1.0 . 4.20 184 159 A 7 LYS HA A 7 LYS HDy 1.0 . 4.20 185 160 A 7 LYS HBx A 24 PRO HBx 1.0 . 3.33 186 160 A 7 LYS HBy A 24 PRO HBx 1.0 . 3.33 187 160 A 24 PRO HBy A 7 LYS HBx 1.0 . 3.33 188 160 A 7 LYS HBy A 24 PRO HBy 1.0 . 3.33 189 161 A 8 PRO HDx A 7 LYS HGx 1.0 . 4.51 190 161 A 8 PRO HDx A 7 LYS HGy 1.0 . 4.51 191 162 A 8 PRO HDx A 7 LYS HDx 1.0 . 4.79 192 162 A 8 PRO HDx A 7 LYS HDy 1.0 . 4.79 193 163 A 8 PRO HDy A 7 LYS HDx 1.0 . 5.34 194 163 A 8 PRO HDy A 7 LYS HDy 1.0 . 5.34 195 164 A 9 LYS H A 8 PRO HBx 1.0 . 4.05 196 164 A 9 LYS H A 8 PRO HBy 1.0 . 4.05 197 165 A 11 ARG HE A 8 PRO HBx 1.0 . 5.34 198 165 A 11 ARG HE A 8 PRO HBy 1.0 . 5.34 199 166 A 9 LYS H A 8 PRO HGy 1.0 . 5.03 200 166 A 9 LYS H A 8 PRO HGx 1.0 . 5.03 201 167 A 11 ARG HE A 8 PRO HGy 1.0 . 5.05 202 167 A 11 ARG HE A 8 PRO HGx 1.0 . 5.05 203 168 A 8 PRO HGx A 24 PRO HDx 1.0 . 4.34 204 168 A 8 PRO HGy A 24 PRO HDx 1.0 . 4.34 205 168 A 24 PRO HDy A 8 PRO HGy 1.0 . 4.34 206 168 A 8 PRO HGx A 24 PRO HDy 1.0 . 4.34 207 169 A 8 PRO HDx A 24 PRO HBx 1.0 . 4.87 208 169 A 8 PRO HDx A 24 PRO HBy 1.0 . 4.87 209 170 A 8 PRO HDx A 24 PRO HGx 1.0 . 3.91 210 170 A 8 PRO HDx A 24 PRO HGy 1.0 . 3.91 211 171 A 8 PRO HDx A 24 PRO HDx 1.0 . 3.46 212 171 A 8 PRO HDx A 24 PRO HDy 1.0 . 3.46 213 172 A 8 PRO HDy A 24 PRO HBx 1.0 . 5.23 214 172 A 8 PRO HDy A 24 PRO HBy 1.0 . 5.23 215 173 A 8 PRO HDy A 24 PRO HDx 1.0 . 3.86 216 173 A 8 PRO HDy A 24 PRO HDy 1.0 . 3.86 217 174 A 9 LYS H A 9 LYS HGx 1.0 . 5.32 218 174 A 9 LYS H A 9 LYS HGy 1.0 . 5.32 219 175 A 9 LYS H A 9 LYS HDx 1.0 . 4.58 220 175 A 9 LYS H A 9 LYS HDy 1.0 . 4.58 221 176 A 9 LYS HA A 9 LYS HDx 1.0 . 4.00 222 176 A 9 LYS HDy A 9 LYS HA 1.0 . 4.00 223 177 A 10 PHE H A 9 LYS HBx 1.0 . 3.97 224 177 A 10 PHE H A 9 LYS HBy 1.0 . 3.97 225 178 A 10 PHE H A 9 LYS HGx 1.0 . 5.34 226 178 A 10 PHE H A 9 LYS HGy 1.0 . 5.34 227 179 A 10 PHE H A 9 LYS HDx 1.0 . 4.76 228 179 A 10 PHE H A 9 LYS HDy 1.0 . 4.76 229 180 A 9 LYS HEx A 10 PHE HBy 1.0 . 3.64 230 180 A 9 LYS HEy A 10 PHE HBy 1.0 . 3.64 231 180 A 10 PHE HBx A 9 LYS HEx 1.0 . 3.64 232 180 A 9 LYS HEy A 10 PHE HBx 1.0 . 3.64 233 181 A 10 PHE H A 10 PHE HBy 1.0 . 3.46 234 181 A 10 PHE H A 10 PHE HBx 1.0 . 3.46 235 182 A 11 ARG H A 10 PHE HBy 1.0 . 4.37 236 182 A 11 ARG H A 10 PHE HBx 1.0 . 4.37 237 183 A 11 ARG H A 11 ARG HBy 1.0 . 3.29 238 183 A 11 ARG H A 11 ARG HBx 1.0 . 3.29 239 184 A 11 ARG H A 11 ARG HGx 1.0 . 3.85 240 184 A 11 ARG H A 11 ARG HGy 1.0 . 3.85 241 185 A 11 ARG H A 11 ARG HDx 1.0 . 3.94 242 185 A 11 ARG H A 11 ARG HDy 1.0 . 3.94 243 186 A 11 ARG HA A 11 ARG HGx 1.0 . 3.53 244 186 A 11 ARG HA A 11 ARG HGy 1.0 . 3.53 245 187 A 11 ARG HA A 11 ARG HDx 1.0 . 4.03 246 187 A 11 ARG HA A 11 ARG HDy 1.0 . 4.03 247 188 A 11 ARG HBy A 11 ARG HDx 1.0 . 3.23 248 188 A 11 ARG HBx A 11 ARG HDx 1.0 . 3.23 249 188 A 11 ARG HDy A 11 ARG HBy 1.0 . 3.23 250 188 A 11 ARG HBx A 11 ARG HDy 1.0 . 3.23 251 189 A 12 LYS H A 11 ARG HBy 1.0 . 4.01 252 189 A 12 LYS H A 11 ARG HBx 1.0 . 4.01 253 190 A 13 PHE H A 11 ARG HBy 1.0 . 4.48 254 190 A 13 PHE H A 11 ARG HBx 1.0 . 4.48 255 191 A 16 TYR HE% A 11 ARG HBy 1.0 . 4.57 256 191 A 16 TYR HE% A 11 ARG HBx 1.0 . 4.57 257 192 A 22 TRP HH2 A 11 ARG HBy 1.0 . 5.28 258 192 A 22 TRP HH2 A 11 ARG HBx 1.0 . 5.28 259 193 A 14 LYS HA A 11 ARG HGx 1.0 . 5.04 260 193 A 14 LYS HA A 11 ARG HGy 1.0 . 5.04 261 194 A 22 TRP HE3 A 11 ARG HGx 1.0 . 5.34 262 194 A 22 TRP HE3 A 11 ARG HGy 1.0 . 5.34 263 195 A 22 TRP HH2 A 11 ARG HGx 1.0 . 5.24 264 195 A 22 TRP HH2 A 11 ARG HGy 1.0 . 5.24 265 196 A 16 TYR HE% A 11 ARG HDx 1.0 . 5.34 266 196 A 16 TYR HE% A 11 ARG HDy 1.0 . 5.34 267 197 A 11 ARG HE A 14 LYS HGx 1.0 . 4.62 268 197 A 11 ARG HE A 14 LYS HGy 1.0 . 4.62 269 198 A 11 ARG HE A 14 LYS HDy 1.0 . 4.34 270 198 A 11 ARG HE A 14 LYS HDx 1.0 . 4.34 271 199 A 11 ARG HE A 14 LYS HEx 1.0 . 4.82 272 199 A 11 ARG HE A 14 LYS HEy 1.0 . 4.82 273 200 A 12 LYS H A 12 LYS HGx 1.0 . 4.02 274 200 A 12 LYS H A 12 LYS HGy 1.0 . 4.02 275 201 A 12 LYS HA A 12 LYS HGx 1.0 . 3.58 276 201 A 12 LYS HA A 12 LYS HGy 1.0 . 3.58 277 202 A 13 PHE H A 12 LYS HGx 1.0 . 5.34 278 202 A 13 PHE H A 12 LYS HGy 1.0 . 5.34 279 203 A 13 PHE H A 13 PHE HBy 1.0 . 3.23 280 203 A 13 PHE H A 13 PHE HBx 1.0 . 3.23 281 204 A 14 LYS H A 13 PHE HBy 1.0 . 3.57 282 204 A 14 LYS H A 13 PHE HBx 1.0 . 3.57 283 205 A 14 LYS HA A 13 PHE HBy 1.0 . 4.79 284 205 A 14 LYS HA A 13 PHE HBx 1.0 . 4.79 285 206 A 16 TYR H A 13 PHE HBy 1.0 . 5.34 286 206 A 16 TYR H A 13 PHE HBx 1.0 . 5.34 287 207 A 16 TYR HA A 13 PHE HBy 1.0 . 5.32 288 207 A 16 TYR HA A 13 PHE HBx 1.0 . 5.32 289 208 A 16 TYR HD% A 13 PHE HBy 1.0 . 5.09 290 208 A 16 TYR HD% A 13 PHE HBx 1.0 . 5.09 291 209 A 14 LYS H A 14 LYS HGx 1.0 . 4.06 292 209 A 14 LYS H A 14 LYS HGy 1.0 . 4.06 293 210 A 14 LYS HA A 14 LYS HGx 1.0 . 3.72 294 210 A 14 LYS HA A 14 LYS HGy 1.0 . 3.72 295 211 A 14 LYS HA A 14 LYS HEx 1.0 . 4.76 296 211 A 14 LYS HA A 14 LYS HEy 1.0 . 4.76 297 212 A 14 LYS HBx A 14 LYS HDy 1.0 . 2.97 298 212 A 14 LYS HBy A 14 LYS HDy 1.0 . 2.97 299 212 A 14 LYS HDx A 14 LYS HBx 1.0 . 2.97 300 212 A 14 LYS HDx A 14 LYS HBy 1.0 . 2.97 301 213 A 22 TRP HE3 A 14 LYS HBx 1.0 . 5.34 302 213 A 22 TRP HE3 A 14 LYS HBy 1.0 . 5.34 303 214 A 15 LEU H A 14 LYS HGx 1.0 . 5.34 304 214 A 15 LEU H A 14 LYS HGy 1.0 . 5.34 305 215 A 15 LEU H A 14 LYS HDy 1.0 . 4.25 306 215 A 15 LEU H A 14 LYS HDx 1.0 . 4.25 307 216 A 22 TRP HE3 A 14 LYS HDy 1.0 . 4.71 308 216 A 22 TRP HE3 A 14 LYS HDx 1.0 . 4.71 309 217 A 22 TRP HH2 A 14 LYS HDy 1.0 . 5.34 310 217 A 22 TRP HH2 A 14 LYS HDx 1.0 . 5.34 311 218 A 22 TRP HE3 A 14 LYS HEx 1.0 . 4.40 312 218 A 22 TRP HE3 A 14 LYS HEy 1.0 . 4.40 313 219 A 15 LEU H A 15 LEU HBx 1.0 . 3.40 314 219 A 15 LEU H A 15 LEU HBy 1.0 . 3.40 315 220 A 15 LEU H A 15 LEU HDx% 1.0 . 4.68 316 220 A 15 LEU H A 15 LEU HDy% 1.0 . 4.68 317 221 A 15 LEU HA A 15 LEU HDx% 1.0 . 3.50 318 221 A 15 LEU HA A 15 LEU HDy% 1.0 . 3.50 319 222 A 15 LEU HBx A 15 LEU HDx% 1.0 . 2.83 320 222 A 15 LEU HBy A 15 LEU HDx% 1.0 . 2.83 321 222 A 15 LEU HDy% A 15 LEU HBx 1.0 . 2.83 322 222 A 15 LEU HBy A 15 LEU HDy% 1.0 . 2.83 323 223 A 20 LYS HA A 15 LEU HDx% 1.0 . 4.60 324 223 A 20 LYS HA A 15 LEU HDy% 1.0 . 4.60 325 224 A 15 LEU HDy% A 22 TRP HBx 1.0 . 4.04 326 224 A 15 LEU HDx% A 22 TRP HBx 1.0 . 4.04 327 224 A 22 TRP HBy A 15 LEU HDx% 1.0 . 4.04 328 224 A 15 LEU HDy% A 22 TRP HBy 1.0 . 4.04 329 225 A 22 TRP HD1 A 15 LEU HDx% 1.0 . 4.24 330 225 A 22 TRP HD1 A 15 LEU HDy% 1.0 . 4.24 331 226 A 22 TRP HZ2 A 15 LEU HDx% 1.0 . 5.38 332 226 A 22 TRP HZ2 A 15 LEU HDy% 1.0 . 5.38 333 227 A 22 TRP HH2 A 15 LEU HDx% 1.0 . 5.34 334 227 A 22 TRP HH2 A 15 LEU HDy% 1.0 . 5.34 335 228 A 16 TYR H A 18 GLU HBy 1.0 . 5.34 336 228 A 16 TYR H A 18 GLU HBx 1.0 . 5.34 337 229 A 16 TYR HD% A 18 GLU HBy 1.0 . 5.29 338 229 A 16 TYR HD% A 18 GLU HBx 1.0 . 5.29 339 230 A 16 TYR HD% A 18 GLU HGx 1.0 . 5.34 340 230 A 16 TYR HD% A 18 GLU HGy 1.0 . 5.34 341 231 A 16 TYR HE% A 18 GLU HBy 1.0 . 4.63 342 231 A 16 TYR HE% A 18 GLU HBx 1.0 . 4.63 343 232 A 16 TYR HE% A 18 GLU HGx 1.0 . 5.26 344 232 A 16 TYR HE% A 18 GLU HGy 1.0 . 5.26 345 233 A 17 HIS H A 17 HIS HBx 1.0 . 3.63 346 233 A 17 HIS H A 17 HIS HBy 1.0 . 3.63 347 234 A 18 GLU H A 18 GLU HBy 1.0 . 3.48 348 234 A 18 GLU H A 18 GLU HBx 1.0 . 3.48 349 235 A 18 GLU HA A 18 GLU HGx 1.0 . 3.56 350 235 A 18 GLU HA A 18 GLU HGy 1.0 . 3.56 351 236 A 19 GLY H A 18 GLU HBy 1.0 . 4.39 352 236 A 19 GLY H A 18 GLU HBx 1.0 . 4.39 353 237 A 19 GLY H A 18 GLU HGx 1.0 . 3.88 354 237 A 19 GLY H A 18 GLU HGy 1.0 . 3.88 355 238 A 20 LYS H A 20 LYS HGx 1.0 . 3.94 356 238 A 20 LYS H A 20 LYS HGy 1.0 . 3.94 357 239 A 20 LYS HA A 20 LYS HGx 1.0 . 3.59 358 239 A 20 LYS HA A 20 LYS HGy 1.0 . 3.59 359 240 A 22 TRP HD1 A 22 TRP HBx 1.0 . 3.39 360 240 A 22 TRP HD1 A 22 TRP HBy 1.0 . 3.39 361 241 A 22 TRP HE3 A 22 TRP HBx 1.0 . 3.65 362 241 A 22 TRP HE3 A 22 TRP HBy 1.0 . 3.65 363 242 A 23 CYS H A 22 TRP HBx 1.0 . 4.20 364 242 A 23 CYS H A 22 TRP HBy 1.0 . 4.20 365 243 A 23 CYS HA A 24 PRO HDx 1.0 . 3.28 366 243 A 23 CYS HA A 24 PRO HDy 1.0 . 3.28 367 244 A 10 PHE H A 9 LYS HA 1.0 . 3.52 368 245 A 14 LYS H A 13 PHE H 1.0 . 4.71 369 246 A 7 LYS H A 6 ARG H 1.0 . 4.30 370 247 A 21 PHE H A 22 TRP HBx 1.0 . 5.50 371 248 A 22 TRP H A 22 TRP HBx 1.0 . 3.57 372 249 A 22 TRP H A 21 PHE HBy 1.0 . 4.18 373 250 A 5 ARG H A 4 ILE HB 1.0 . 4.44 374 251 A 5 ARG H A 5 ARG HGx 1.0 . 5.00 375 252 A 5 ARG H A 5 ARG HGy 1.0 . 5.00 376 253 A 5 ARG H A 4 ILE HD1% 1.0 . 4.88 377 254 A 18 GLU H A 18 GLU HBy 1.0 . 4.20 378 255 A 18 GLU H A 18 GLU HBx 1.0 . 4.20 379 256 A 10 PHE H A 9 LYS HBy 1.0 . 4.08 380 257 A 10 PHE H A 9 LYS HBx 1.0 . 4.08 381 258 A 11 ARG H A 11 ARG HGx 1.0 . 5.50 382 259 A 11 ARG H A 11 ARG HGy 1.0 . 5.50 383 260 A 16 TYR H A 15 LEU HBy 1.0 . 4.99 384 261 A 16 TYR H A 15 LEU HBx 1.0 . 5.34 385 262 A 15 LEU H A 15 LEU HBx 1.0 . 3.63 386 263 A 12 LYS H A 12 LYS HGy 1.0 . 4.48 387 264 A 12 LYS H A 12 LYS HGx 1.0 . 4.48 388 265 A 4 ILE H A 4 ILE HD1% 1.0 . 5.07 389 266 A 16 TYR HA A 15 LEU HBx 1.0 . 5.50 390 267 A 14 LYS HA A 15 LEU HBx 1.0 . 5.49 391 268 A 22 TRP HBx A 23 CYS HBx 1.0 . 5.27 392 269 A 22 TRP HD1 A 15 LEU HBy 1.0 . 5.50 393 270 A 21 PHE HA A 21 PHE HE% 1.0 . 5.21 394 271 A 16 TYR HA A 16 TYR HE% 1.0 . 5.60 395 272 A 4 ILE HA A 4 ILE HG2% 1.0 . 3.35 396 273 A 22 TRP HBy A 23 CYS HBx 1.0 . 4.61 397 274 A 15 LEU HA A 15 LEU HDx% 1.0 . 4.13 398 275 A 15 LEU HA A 15 LEU HDy% 1.0 . 4.13 399 276 A 4 ILE H A 3 HIS HBx 1.0 . 4.23 400 276 A 4 ILE H A 3 HIS HBy 1.0 . 4.23 401 277 A 5 ARG H A 5 ARG HGx 1.0 . 4.32 402 277 A 5 ARG H A 5 ARG HGy 1.0 . 4.32 403 278 A 6 ARG H A 5 ARG HBx 1.0 . 3.57 404 278 A 6 ARG H A 5 ARG HBy 1.0 . 3.57 405 279 A 7 LYS H A 6 ARG HGx 1.0 . 4.57 406 279 A 7 LYS H A 6 ARG HGy 1.0 . 4.57 407 280 A 7 LYS HBx A 7 LYS HEx 1.0 . 4.68 408 280 A 7 LYS HBy A 7 LYS HEx 1.0 . 4.68 409 280 A 7 LYS HEy A 7 LYS HBx 1.0 . 4.68 410 280 A 7 LYS HBy A 7 LYS HEy 1.0 . 4.68 411 281 A 8 PRO HDx A 24 PRO HDx 1.0 . 3.95 412 281 A 8 PRO HDx A 24 PRO HDy 1.0 . 3.95 413 282 A 8 PRO HDy A 24 PRO HDx 1.0 . 4.08 414 282 A 8 PRO HDy A 24 PRO HDy 1.0 . 4.08 415 283 A 9 LYS H A 9 LYS HDx 1.0 . 4.92 416 283 A 9 LYS H A 9 LYS HDy 1.0 . 4.92 417 284 A 10 PHE H A 11 ARG HBy 1.0 . 5.34 418 284 A 10 PHE H A 11 ARG HBx 1.0 . 5.34 419 285 A 11 ARG HA A 11 ARG HDx 1.0 . 4.45 420 285 A 11 ARG HA A 11 ARG HDy 1.0 . 4.45 421 286 A 11 ARG HE A 11 ARG HBy 1.0 . 5.16 422 286 A 11 ARG HE A 11 ARG HBx 1.0 . 5.16 423 287 A 22 TRP HZ3 A 11 ARG HBy 1.0 . 5.34 424 287 A 22 TRP HZ3 A 11 ARG HBx 1.0 . 5.34 425 288 A 12 LYS H A 11 ARG HGx 1.0 . 5.34 426 288 A 12 LYS H A 11 ARG HGy 1.0 . 5.34 427 289 A 22 TRP HZ3 A 11 ARG HGx 1.0 . 5.34 428 289 A 22 TRP HZ3 A 11 ARG HGy 1.0 . 5.34 429 290 A 12 LYS H A 12 LYS HBx 1.0 . 3.52 430 290 A 12 LYS H A 12 LYS HBy 1.0 . 3.52 431 291 A 12 LYS H A 12 LYS HGx 1.0 . 3.88 432 291 A 12 LYS H A 12 LYS HGy 1.0 . 3.88 433 292 A 12 LYS HA A 12 LYS HEx 1.0 . 5.30 434 292 A 12 LYS HA A 12 LYS HEy 1.0 . 5.30 435 293 A 14 LYS H A 15 LEU HDx% 1.0 . 5.44 436 293 A 14 LYS H A 15 LEU HDy% 1.0 . 5.44 437 294 A 15 LEU HDy% A 22 TRP HBx 1.0 . 4.26 438 294 A 15 LEU HDx% A 22 TRP HBx 1.0 . 4.26 439 295 A 15 LEU HDy% A 22 TRP HBy 1.0 . 4.83 440 295 A 22 TRP HBy A 15 LEU HDx% 1.0 . 4.83 441 296 A 17 HIS H A 16 TYR HBy 1.0 . 4.13 442 296 A 17 HIS H A 16 TYR HBx 1.0 . 4.13 443 297 A 20 LYS H A 20 LYS HBy 1.0 . 3.44 444 297 A 20 LYS H A 20 LYS HBx 1.0 . 3.44 445 298 A 24 PRO HDy A 22 TRP HBy 1.0 . 5.24 446 298 A 22 TRP HBy A 24 PRO HDx 1.0 . 5.24 447 299 A 11 ARG HA A 12 LYS H 1.0 . 3.15 448 300 A 21 PHE HA A 22 TRP H 1.0 . 3.37 449 301 A 15 LEU H A 14 LYS H 1.0 . 5.23 450 302 A 11 ARG H A 10 PHE H 1.0 . 3.86 451 303 A 12 LYS H A 13 PHE H 1.0 . 4.09 452 304 A 21 PHE H A 20 LYS H 1.0 . 4.08 453 305 A 16 TYR HE% A 13 PHE HBy 1.0 . 5.50 454 306 A 16 TYR HE% A 15 LEU HA 1.0 . 5.50 455 307 A 14 LYS HA A 16 TYR HE% 1.0 . 5.50 456 308 A 13 PHE H A 13 PHE HBx 1.0 . 3.64 457 309 A 18 GLU H A 17 HIS HBy 1.0 . 4.75 458 310 A 14 LYS H A 13 PHE HBy 1.0 . 4.17 459 311 A 18 GLU H A 16 TYR HBy 1.0 . 5.15 460 312 A 16 TYR H A 16 TYR HBx 1.0 . 3.88 461 313 A 18 GLU H A 17 HIS HBx 1.0 . 4.75 462 314 A 4 ILE H A 4 ILE HB 1.0 . 3.81 463 315 A 6 ARG H A 5 ARG HBy 1.0 . 4.14 464 316 A 6 ARG H A 5 ARG HBx 1.0 . 4.14 465 317 A 9 LYS H A 9 LYS HBy 1.0 . 4.03 466 318 A 9 LYS H A 9 LYS HBx 1.0 . 4.03 467 319 A 6 ARG H A 5 ARG HGx 1.0 . 5.50 468 320 A 6 ARG H A 5 ARG HGy 1.0 . 5.50 469 321 A 14 LYS H A 14 LYS HGx 1.0 . 5.50 470 322 A 14 LYS H A 14 LYS HGy 1.0 . 5.50 471 323 A 4 ILE H A 4 ILE HG2% 1.0 . 4.55 472 324 A 8 PRO HDy A 24 PRO HDy 1.0 . 4.15 473 325 A 21 PHE HBy A 22 TRP HA 1.0 . 4.40 474 326 A 22 TRP HD1 A 22 TRP HBx 1.0 . 3.46 475 327 A 22 TRP HD1 A 21 PHE HBx 1.0 . 5.50 476 328 A 23 CYS H A 22 TRP HBx 1.0 . 4.64 477 329 A 22 TRP HE3 A 22 TRP HBy 1.0 . 3.99 478 330 A 22 TRP HD1 A 21 PHE HBy 1.0 . 5.38 479 331 A 22 TRP HZ3 A 8 PRO HGy 1.0 . 5.07 480 332 A 22 TRP HZ3 A 8 PRO HGx 1.0 . 5.07 481 333 A 22 TRP HZ3 A 11 ARG HGx 1.0 . 5.50 482 334 A 22 TRP HZ3 A 11 ARG HGy 1.0 . 5.50 483 335 A 22 TRP HZ3 A 14 LYS HGy 1.0 . 5.50 484 336 A 22 TRP HZ3 A 14 LYS HGx 1.0 . 5.50 485 337 A 22 TRP HD1 A 15 LEU HG 1.0 . 5.50 486 338 A 22 TRP HH2 A 11 ARG HGx 1.0 . 5.50 487 339 A 22 TRP HH2 A 11 ARG HGy 1.0 . 5.50 488 340 A 16 TYR HE% A 13 PHE HBx 1.0 . 5.46 489 341 A 8 PRO HA A 22 TRP HZ3 1.0 . 5.50 490 342 A 22 TRP HD1 A 15 LEU HA 1.0 . 5.41 491 343 A 16 TYR HD% A 15 LEU HA 1.0 . 4.95 492 344 A 18 GLU HA A 16 TYR HD% 1.0 . 5.50 493 345 A 15 LEU HA A 22 TRP HBx 1.0 . 5.35 494 346 A 14 LYS HA A 14 LYS HGx 1.0 . 4.23 495 347 A 14 LYS HA A 14 LYS HGy 1.0 . 4.23 496 348 A 24 PRO HDy A 22 TRP HBy 1.0 . 5.60 497 349 A 15 LEU HDx% A 22 TRP HBx 1.0 . 5.03 498 350 A 15 LEU HDy% A 22 TRP HBx 1.0 . 5.03 499 351 A 4 ILE HB A 4 ILE HD1% 1.0 . 3.71 500 352 A 4 ILE H A 4 ILE HG1x 1.0 . 4.57 501 352 A 4 ILE H A 4 ILE HG1y 1.0 . 4.57 502 353 A 6 ARG H A 6 ARG HGx 1.0 . 4.02 503 353 A 6 ARG H A 6 ARG HGy 1.0 . 4.02 504 354 A 8 PRO HDx A 7 LYS HDx 1.0 . 4.57 505 354 A 8 PRO HDx A 7 LYS HDy 1.0 . 4.57 506 355 A 22 TRP HZ3 A 8 PRO HBx 1.0 . 5.34 507 355 A 22 TRP HZ3 A 8 PRO HBy 1.0 . 5.34 508 356 A 9 LYS H A 9 LYS HBx 1.0 . 3.41 509 356 A 9 LYS H A 9 LYS HBy 1.0 . 3.41 510 357 A 10 PHE H A 9 LYS HBx 1.0 . 3.51 511 357 A 10 PHE H A 9 LYS HBy 1.0 . 3.51 512 358 A 10 PHE HA A 9 LYS HBx 1.0 . 4.98 513 358 A 10 PHE HA A 9 LYS HBy 1.0 . 4.98 514 359 A 11 ARG HBy A 11 ARG HDx 1.0 . 3.32 515 359 A 11 ARG HDy A 11 ARG HBy 1.0 . 3.32 516 359 A 11 ARG HBx A 11 ARG HDy 1.0 . 3.32 517 359 A 11 ARG HBx A 11 ARG HDx 1.0 . 3.32 518 360 A 13 PHE H A 11 ARG HBy 1.0 . 4.52 519 360 A 13 PHE H A 11 ARG HBx 1.0 . 4.52 520 361 A 22 TRP HH2 A 11 ARG HBy 1.0 . 5.34 521 361 A 22 TRP HH2 A 11 ARG HBx 1.0 . 5.34 522 362 A 22 TRP HH2 A 11 ARG HDx 1.0 . 4.61 523 362 A 22 TRP HH2 A 11 ARG HDy 1.0 . 4.61 524 363 A 13 PHE H A 12 LYS HBx 1.0 . 4.04 525 363 A 13 PHE H A 12 LYS HBy 1.0 . 4.04 526 364 A 14 LYS HA A 15 LEU HDx% 1.0 . 4.63 527 364 A 14 LYS HA A 15 LEU HDy% 1.0 . 4.63 528 365 A 15 LEU H A 15 LEU HDx% 1.0 . 4.71 529 365 A 15 LEU H A 15 LEU HDy% 1.0 . 4.71 530 366 A 22 TRP HD1 A 15 LEU HBx 1.0 . 5.34 531 366 A 22 TRP HD1 A 15 LEU HBy 1.0 . 5.34 532 367 A 16 TYR H A 15 LEU HDx% 1.0 . 5.31 533 367 A 16 TYR H A 15 LEU HDy% 1.0 . 5.31 534 368 A 22 TRP HE3 A 15 LEU HDx% 1.0 . 5.28 535 368 A 22 TRP HE3 A 15 LEU HDy% 1.0 . 5.28 536 369 A 22 TRP HZ3 A 15 LEU HDx% 1.0 . 4.59 537 369 A 22 TRP HZ3 A 15 LEU HDy% 1.0 . 4.59 538 370 A 18 GLU H A 18 GLU HBy 1.0 . 3.53 539 370 A 18 GLU H A 18 GLU HBx 1.0 . 3.53 540 371 A 20 LYS HA A 20 LYS HEx 1.0 . 5.34 541 371 A 20 LYS HA A 20 LYS HEy 1.0 . 5.34 542 372 A 22 TRP HD1 A 20 LYS HBy 1.0 . 5.53 543 372 A 22 TRP HD1 A 20 LYS HBx 1.0 . 5.53 544 373 A 21 PHE H A 20 LYS HGx 1.0 . 5.18 545 373 A 21 PHE H A 20 LYS HGy 1.0 . 5.18 546 374 A 23 CYS HBy A 22 TRP HBx 1.0 . 4.97 547 374 A 22 TRP HBx A 23 CYS HBx 1.0 . 4.97 548 375 A 23 CYS HBy A 22 TRP HBy 1.0 . 4.46 549 375 A 22 TRP HBy A 23 CYS HBx 1.0 . 4.46 550 376 A 4 ILE HA A 5 ARG H 1.0 . 3.27 551 377 A 20 LYS HA A 21 PHE H 1.0 . 3.29 552 378 A 18 GLU H A 17 HIS HA 1.0 . 3.51 553 379 A 16 TYR HA A 17 HIS H 1.0 . 3.33 554 380 A 14 LYS HA A 15 LEU H 1.0 . 3.11 555 381 A 13 PHE HA A 14 LYS H 1.0 . 3.32 556 382 A 10 PHE HA A 11 ARG H 1.0 . 3.31 557 383 A 8 PRO HA A 9 LYS H 1.0 . 3.11 558 384 A 16 TYR H A 15 LEU HA 1.0 . 3.52 559 385 A 6 ARG HA A 7 LYS H 1.0 . 3.14 560 386 A 3 HIS H A 2 CYS HBy 1.0 . 4.44 561 387 A 3 HIS H A 2 CYS HBx 1.0 . 4.44 562 388 A 9 LYS H A 10 PHE H 1.0 . 4.35 563 389 A 15 LEU H A 16 TYR H 1.0 . 4.34 564 390 A 20 LYS H A 19 GLY H 1.0 . 4.02 565 391 A 5 ARG H A 6 ARG H 1.0 . 4.21 566 392 A 3 HIS H A 4 ILE H 1.0 . 4.52 567 393 A 21 PHE H A 22 TRP H 1.0 . 3.67 568 394 A 22 TRP H A 22 TRP HD1 1.0 . 4.08 569 395 A 21 PHE H A 22 TRP HD1 1.0 . 4.24 570 396 A 16 TYR HE% A 18 GLU HA 1.0 . 5.29 571 397 A 22 TRP H A 22 TRP HBy 1.0 . 4.12 572 398 A 13 PHE H A 13 PHE HBy 1.0 . 4.16 573 399 A 17 HIS H A 17 HIS HBy 1.0 . 4.12 574 400 A 21 PHE H A 21 PHE HBx 1.0 . 3.51 575 401 A 17 HIS H A 16 TYR HBy 1.0 . 4.07 576 402 A 17 HIS H A 17 HIS HBx 1.0 . 4.12 577 403 A 5 ARG H A 5 ARG HBy 1.0 . 4.20 578 404 A 5 ARG H A 5 ARG HBx 1.0 . 4.20 579 405 A 5 ARG H A 4 ILE HG2% 1.0 . 4.31 580 406 A 19 GLY H A 18 GLU HBy 1.0 . 4.58 581 407 A 19 GLY H A 18 GLU HBx 1.0 . 4.58 582 408 A 13 PHE H A 11 ARG HBy 1.0 . 4.62 583 409 A 12 LYS H A 11 ARG HBy 1.0 . 4.11 584 410 A 11 ARG H A 11 ARG HBx 1.0 . 4.05 585 411 A 12 LYS H A 11 ARG HBx 1.0 . 4.36 586 412 A 6 ARG H A 4 ILE HG2% 1.0 . 4.65 587 413 A 6 ARG HE A 6 ARG HBy 1.0 . 5.13 588 414 A 11 ARG HE A 11 ARG HBy 1.0 . 5.34 589 415 A 5 ARG HE A 5 ARG HBy 1.0 . 5.02 590 416 A 5 ARG HE A 5 ARG HBx 1.0 . 5.02 591 417 A 11 ARG HE A 11 ARG HBx 1.0 . 5.38 592 418 A 21 PHE HZ A 3 HIS HBy 1.0 . 4.70 593 419 A 21 PHE HZ A 3 HIS HBx 1.0 . 4.70 594 420 A 8 PRO HDx A 24 PRO HDy 1.0 . 4.50 595 421 A 7 LYS HA A 8 PRO HDy 1.0 . 3.37 596 422 A 8 PRO HDx A 7 LYS HA 1.0 . 3.54 597 423 A 23 CYS HA A 24 PRO HDy 1.0 . 3.65 598 424 A 23 CYS HA A 24 PRO HDx 1.0 . 3.79 599 425 A 20 LYS HA A 21 PHE HBx 1.0 . 4.62 600 426 A 11 ARG HA A 11 ARG HGy 1.0 . 4.18 601 427 A 16 TYR HE% A 11 ARG HBx 1.0 . 4.72 602 428 A 23 CYS H A 22 TRP HBy 1.0 . 4.91 603 429 A 22 TRP HA A 22 TRP HE3 1.0 . 4.20 604 430 A 14 LYS H A 13 PHE HBx 1.0 . 4.26 605 431 A 16 TYR HA A 16 TYR HD% 1.0 . 3.92 606 432 A 21 PHE HA A 21 PHE HD% 1.0 . 4.71 607 433 A 20 LYS HA A 22 TRP HD1 1.0 . 4.84 608 434 A 21 PHE HD% A 21 PHE HZ 1.0 . 3.84 609 435 A 22 TRP HD1 A 22 TRP HA 1.0 . 4.54 610 436 A 22 TRP HE3 A 14 LYS HDx 1.0 . 5.50 611 437 A 22 TRP HE3 A 15 LEU HDy% 1.0 . 5.50 612 438 A 22 TRP HE3 A 15 LEU HDx% 1.0 . 5.50 613 439 A 22 TRP HE3 A 14 LYS HDy 1.0 . 5.50 614 440 A 16 TYR HE% A 18 GLU HBx 1.0 . 5.50 615 441 A 16 TYR HE% A 18 GLU HBy 1.0 . 5.50 616 442 A 22 TRP HZ2 A 16 TYR HBy 1.0 . 5.50 617 443 A 22 TRP HZ2 A 16 TYR HBx 1.0 . 5.50 618 444 A 6 ARG HE A 6 ARG HBx 1.0 . 5.13 619 445 A 11 ARG HE A 14 LYS HGy 1.0 . 5.50 620 446 A 11 ARG HE A 14 LYS HGx 1.0 . 5.50 621 447 A 22 TRP HZ2 A 15 LEU HDx% 1.0 . 5.50 622 448 A 22 TRP HD1 A 15 LEU HDy% 1.0 . 5.24 623 449 A 22 TRP HZ2 A 15 LEU HDy% 1.0 . 5.50 624 450 A 22 TRP HD1 A 15 LEU HDx% 1.0 . 5.24 625 451 A 22 TRP HH2 A 11 ARG HBx 1.0 . 5.50 626 452 A 22 TRP HE3 A 15 LEU HA 1.0 . 5.44 627 453 A 22 TRP HZ2 A 15 LEU HA 1.0 . 5.21 628 454 A 21 PHE HZ A 3 HIS HA 1.0 . 5.50 629 455 A 16 TYR HA A 22 TRP HZ2 1.0 . 5.50 630 456 A 21 PHE HE% A 3 HIS HA 1.0 . 5.50 631 457 A 16 TYR HD% A 17 HIS HA 1.0 . 5.04 632 458 A 15 LEU HA A 22 TRP HH2 1.0 . 5.50 633 459 A 11 ARG HE A 22 TRP HE3 1.0 . 4.62 634 460 A 16 TYR HE% A 22 TRP HH2 1.0 . 3.65 635 461 A 17 HIS HA A 16 TYR HBy 1.0 . 5.05 636 462 A 11 ARG HA A 11 ARG HGx 1.0 . 4.18 637 463 A 4 ILE HA A 4 ILE HD1% 1.0 . 3.86 638 464 A 1 THR HA A 1 THR HG2% 1.0 . 3.69 639 465 A 6 ARG HA A 7 LYS HA 1.0 . 4.81 640 466 A 14 LYS HA A 15 LEU HA 1.0 . 4.61 641 467 A 8 PRO HDx A 24 PRO HDx 1.0 . 4.00 642 468 A 22 TRP HBy A 15 LEU HDx% 1.0 . 5.40 643 469 A 15 LEU HDy% A 22 TRP HBy 1.0 . 5.40 644 470 A 15 LEU HBy A 15 LEU HDy% 1.0 . 3.68 645 471 A 15 LEU HBx A 15 LEU HDx% 1.0 . 3.68 646 472 A 15 LEU HDy% A 15 LEU HBx 1.0 . 3.68 647 473 A 15 LEU HBy A 15 LEU HDx% 1.0 . 3.68 648 474 A 3 HIS H A 3 HIS HBx 1.0 . 3.70 649 474 A 3 HIS H A 3 HIS HBy 1.0 . 3.70 650 475 A 4 ILE HA A 3 HIS HBx 1.0 . 5.34 651 475 A 4 ILE HA A 3 HIS HBy 1.0 . 5.34 652 476 A 21 PHE HE% A 3 HIS HBx 1.0 . 4.79 653 476 A 21 PHE HE% A 3 HIS HBy 1.0 . 4.79 654 477 A 21 PHE HZ A 3 HIS HBx 1.0 . 3.84 655 477 A 21 PHE HZ A 3 HIS HBy 1.0 . 3.84 656 478 A 4 ILE HA A 4 ILE HG1x 1.0 . 3.73 657 478 A 4 ILE HA A 4 ILE HG1y 1.0 . 3.73 658 479 A 4 ILE HA A 5 ARG HGx 1.0 . 4.37 659 479 A 4 ILE HA A 5 ARG HGy 1.0 . 4.37 660 480 A 5 ARG H A 5 ARG HBx 1.0 . 3.60 661 480 A 5 ARG H A 5 ARG HBy 1.0 . 3.60 662 481 A 5 ARG HA A 5 ARG HDx 1.0 . 4.80 663 481 A 5 ARG HA A 5 ARG HDy 1.0 . 4.80 664 482 A 5 ARG HE A 5 ARG HBx 1.0 . 4.30 665 482 A 5 ARG HE A 5 ARG HBy 1.0 . 4.30 666 483 A 6 ARG HA A 5 ARG HBx 1.0 . 5.34 667 483 A 6 ARG HA A 5 ARG HBy 1.0 . 5.34 668 484 A 6 ARG H A 5 ARG HGx 1.0 . 3.53 669 484 A 6 ARG H A 5 ARG HGy 1.0 . 3.53 670 485 A 6 ARG HA A 5 ARG HGx 1.0 . 4.89 671 485 A 6 ARG HA A 5 ARG HGy 1.0 . 4.89 672 486 A 6 ARG H A 6 ARG HBx 1.0 . 3.26 673 486 A 6 ARG H A 6 ARG HBy 1.0 . 3.26 674 487 A 6 ARG HA A 6 ARG HDx 1.0 . 4.27 675 487 A 6 ARG HA A 6 ARG HDy 1.0 . 4.27 676 488 A 6 ARG HA A 7 LYS HDx 1.0 . 5.34 677 488 A 6 ARG HA A 7 LYS HDy 1.0 . 5.34 678 489 A 6 ARG HBy A 6 ARG HDx 1.0 . 3.26 679 489 A 6 ARG HBx A 6 ARG HDx 1.0 . 3.26 680 489 A 6 ARG HDy A 6 ARG HBx 1.0 . 3.26 681 489 A 6 ARG HBy A 6 ARG HDy 1.0 . 3.26 682 490 A 6 ARG HE A 6 ARG HBx 1.0 . 4.46 683 490 A 6 ARG HE A 6 ARG HBy 1.0 . 4.46 684 491 A 6 ARG HE A 6 ARG HGx 1.0 . 3.57 685 491 A 6 ARG HE A 6 ARG HGy 1.0 . 3.57 686 492 A 7 LYS H A 7 LYS HBx 1.0 . 3.42 687 492 A 7 LYS H A 7 LYS HBy 1.0 . 3.42 688 493 A 7 LYS H A 7 LYS HGx 1.0 . 4.10 689 493 A 7 LYS H A 7 LYS HGy 1.0 . 4.10 690 494 A 7 LYS H A 7 LYS HDx 1.0 . 3.43 691 494 A 7 LYS H A 7 LYS HDy 1.0 . 3.43 692 495 A 7 LYS HA A 7 LYS HDx 1.0 . 4.03 693 495 A 7 LYS HA A 7 LYS HDy 1.0 . 4.03 694 496 A 8 PRO HDx A 7 LYS HBx 1.0 . 4.06 695 496 A 8 PRO HDx A 7 LYS HBy 1.0 . 4.06 696 497 A 8 PRO HDx A 7 LYS HGx 1.0 . 4.50 697 497 A 8 PRO HDx A 7 LYS HGy 1.0 . 4.50 698 498 A 9 LYS H A 8 PRO HBx 1.0 . 4.08 699 498 A 9 LYS H A 8 PRO HBy 1.0 . 4.08 700 499 A 11 ARG HE A 8 PRO HGy 1.0 . 4.73 701 499 A 11 ARG HE A 8 PRO HGx 1.0 . 4.73 702 500 A 9 LYS H A 9 LYS HGx 1.0 . 5.11 703 500 A 9 LYS H A 9 LYS HGy 1.0 . 5.11 704 501 A 9 LYS HA A 9 LYS HDx 1.0 . 4.23 705 501 A 9 LYS HDy A 9 LYS HA 1.0 . 4.23 706 502 A 10 PHE H A 10 PHE HBy 1.0 . 3.49 707 502 A 10 PHE H A 10 PHE HBx 1.0 . 3.49 708 503 A 11 ARG H A 10 PHE HBy 1.0 . 4.24 709 503 A 11 ARG H A 10 PHE HBx 1.0 . 4.24 710 504 A 11 ARG H A 11 ARG HGx 1.0 . 3.96 711 504 A 11 ARG H A 11 ARG HGy 1.0 . 3.96 712 505 A 11 ARG H A 11 ARG HDx 1.0 . 4.80 713 505 A 11 ARG H A 11 ARG HDy 1.0 . 4.80 714 506 A 11 ARG HA A 11 ARG HGx 1.0 . 3.53 715 506 A 11 ARG HA A 11 ARG HGy 1.0 . 3.53 716 507 A 11 ARG HBx A 11 ARG HDy 1.0 . 3.54 717 507 A 11 ARG HBx A 11 ARG HDx 1.0 . 3.54 718 508 A 12 LYS HA A 12 LYS HGx 1.0 . 3.62 719 508 A 12 LYS HA A 12 LYS HGy 1.0 . 3.62 720 509 A 13 PHE H A 13 PHE HBy 1.0 . 3.31 721 509 A 13 PHE H A 13 PHE HBx 1.0 . 3.31 722 510 A 14 LYS H A 13 PHE HBy 1.0 . 3.60 723 510 A 14 LYS H A 13 PHE HBx 1.0 . 3.60 724 511 A 14 LYS HA A 13 PHE HBy 1.0 . 5.34 725 511 A 14 LYS HA A 13 PHE HBx 1.0 . 5.34 726 512 A 16 TYR HD% A 13 PHE HBy 1.0 . 5.19 727 512 A 16 TYR HD% A 13 PHE HBx 1.0 . 5.19 728 513 A 16 TYR HE% A 13 PHE HBy 1.0 . 5.34 729 513 A 16 TYR HE% A 13 PHE HBx 1.0 . 5.34 730 514 A 14 LYS H A 14 LYS HGx 1.0 . 4.57 731 514 A 14 LYS H A 14 LYS HGy 1.0 . 4.57 732 515 A 14 LYS HA A 14 LYS HGx 1.0 . 3.54 733 515 A 14 LYS HA A 14 LYS HGy 1.0 . 3.54 734 516 A 14 LYS HA A 14 LYS HDy 1.0 . 4.43 735 516 A 14 LYS HA A 14 LYS HDx 1.0 . 4.43 736 517 A 14 LYS HA A 14 LYS HEx 1.0 . 5.34 737 517 A 14 LYS HA A 14 LYS HEy 1.0 . 5.34 738 518 A 15 LEU H A 14 LYS HGx 1.0 . 4.77 739 518 A 15 LEU H A 14 LYS HGy 1.0 . 4.77 740 519 A 15 LEU H A 14 LYS HDy 1.0 . 5.16 741 519 A 15 LEU H A 14 LYS HDx 1.0 . 5.16 742 520 A 22 TRP HE3 A 14 LYS HEx 1.0 . 4.44 743 520 A 22 TRP HE3 A 14 LYS HEy 1.0 . 4.44 744 521 A 15 LEU H A 15 LEU HBx 1.0 . 3.42 745 521 A 15 LEU H A 15 LEU HBy 1.0 . 3.42 746 522 A 15 LEU HA A 15 LEU HDx% 1.0 . 3.48 747 522 A 15 LEU HA A 15 LEU HDy% 1.0 . 3.48 748 523 A 15 LEU HBx A 15 LEU HDx% 1.0 . 2.76 749 523 A 15 LEU HBy A 15 LEU HDx% 1.0 . 2.76 750 523 A 15 LEU HDy% A 15 LEU HBx 1.0 . 2.76 751 523 A 15 LEU HBy A 15 LEU HDy% 1.0 . 2.76 752 524 A 15 LEU HDy% A 22 TRP HBx 1.0 . 3.89 753 524 A 15 LEU HDx% A 22 TRP HBx 1.0 . 3.89 754 524 A 22 TRP HBy A 15 LEU HDx% 1.0 . 3.89 755 524 A 15 LEU HDy% A 22 TRP HBy 1.0 . 3.89 756 525 A 22 TRP HD1 A 15 LEU HDx% 1.0 . 4.41 757 525 A 22 TRP HD1 A 15 LEU HDy% 1.0 . 4.41 758 526 A 22 TRP HZ2 A 15 LEU HDx% 1.0 . 4.83 759 526 A 22 TRP HZ2 A 15 LEU HDy% 1.0 . 4.83 760 527 A 22 TRP HH2 A 15 LEU HDx% 1.0 . 5.33 761 527 A 22 TRP HH2 A 15 LEU HDy% 1.0 . 5.33 762 528 A 17 HIS HBy A 16 TYR HBy 1.0 . 3.86 763 528 A 16 TYR HBy A 17 HIS HBx 1.0 . 3.86 764 529 A 16 TYR HD% A 18 GLU HBy 1.0 . 5.28 765 529 A 16 TYR HD% A 18 GLU HBx 1.0 . 5.28 766 530 A 16 TYR HD% A 18 GLU HGx 1.0 . 5.34 767 530 A 16 TYR HD% A 18 GLU HGy 1.0 . 5.34 768 531 A 16 TYR HE% A 18 GLU HBy 1.0 . 4.62 769 531 A 16 TYR HE% A 18 GLU HBx 1.0 . 4.62 770 532 A 16 TYR HE% A 18 GLU HGx 1.0 . 5.25 771 532 A 16 TYR HE% A 18 GLU HGy 1.0 . 5.25 772 533 A 18 GLU H A 18 GLU HGx 1.0 . 4.42 773 533 A 18 GLU H A 18 GLU HGy 1.0 . 4.42 774 534 A 18 GLU HA A 18 GLU HGx 1.0 . 3.55 775 534 A 18 GLU HA A 18 GLU HGy 1.0 . 3.55 776 535 A 19 GLY H A 18 GLU HBy 1.0 . 3.99 777 535 A 19 GLY H A 18 GLU HBx 1.0 . 3.99 778 536 A 19 GLY H A 18 GLU HGx 1.0 . 4.58 779 536 A 19 GLY H A 18 GLU HGy 1.0 . 4.58 780 537 A 20 LYS H A 20 LYS HGx 1.0 . 4.22 781 537 A 20 LYS H A 20 LYS HGy 1.0 . 4.22 782 538 A 20 LYS HA A 20 LYS HGx 1.0 . 3.59 783 538 A 20 LYS HA A 20 LYS HGy 1.0 . 3.59 784 539 A 21 PHE HA A 20 LYS HBy 1.0 . 4.53 785 539 A 21 PHE HA A 20 LYS HBx 1.0 . 4.53 786 540 A 22 TRP HD1 A 20 LYS HGx 1.0 . 5.23 787 540 A 22 TRP HD1 A 20 LYS HGy 1.0 . 5.23 788 541 A 21 PHE H A 22 TRP HBx 1.0 . 4.93 789 541 A 21 PHE H A 22 TRP HBy 1.0 . 4.93 790 542 A 22 TRP HD1 A 22 TRP HBx 1.0 . 3.42 791 542 A 22 TRP HD1 A 22 TRP HBy 1.0 . 3.42 792 543 A 22 TRP HE3 A 22 TRP HBx 1.0 . 3.65 793 543 A 22 TRP HE3 A 22 TRP HBy 1.0 . 3.65 794 544 A 23 CYS H A 22 TRP HBx 1.0 . 4.24 795 544 A 23 CYS H A 22 TRP HBy 1.0 . 4.24 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin undefined _nef_distance_restraint_list.potential_type upper-bound-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 CYS SG A 23 CYS SG 1.0 . 2.1 2 2 A 2 CYS SG A 23 CYS CB 1.0 . 3.1 3 3 A 23 CYS SG A 2 CYS CB 1.0 . 3.1 stop_ save_ save_DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_4 _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 CYS C A 3 HIS N A 3 HIS CA A 3 HIS C 1.0 -149.4 -70.6 PHI 2 2 A 2 CYS C A 3 HIS N A 3 HIS CA A 3 HIS C 1.0 -175.0 75.0 PHI 3 3 A 2 CYS C A 3 HIS N A 3 HIS CA A 3 HIS C 1.0 -255.0 -25.0 PHI 4 4 A 2 CYS C A 3 HIS N A 3 HIS CA A 3 HIS C 1.0 -135.0 75.0 PHI 5 5 A 3 HIS N A 3 HIS CA A 3 HIS C A 4 ILE N 1.0 90.3 191.6 PSI 6 6 A 3 HIS N A 3 HIS CA A 3 HIS C A 4 ILE N 1.0 -75.0 185.0 PSI 7 7 A 3 HIS N A 3 HIS CA A 3 HIS C A 4 ILE N 1.0 25.0 55.0 PSI 8 8 A 3 HIS N A 3 HIS CA A 3 HIS C A 4 ILE N 1.0 105.0 185.0 PSI 9 9 A 6 ARG C A 7 LYS N A 7 LYS CA A 7 LYS C 1.0 -108.4 -47.1 PHI 10 10 A 7 LYS N A 7 LYS CA A 7 LYS C A 8 PRO N 1.0 96.2 175.0 PSI 11 11 A 8 PRO N A 8 PRO CA A 8 PRO C A 9 LYS N 1.0 131.8 171.8 PSI 12 12 A 12 LYS C A 13 PHE N A 13 PHE CA A 13 PHE C 1.0 -169.6 -55.7 PHI 13 13 A 12 LYS C A 13 PHE N A 13 PHE CA A 13 PHE C 1.0 -175.0 75.0 PHI 14 14 A 12 LYS C A 13 PHE N A 13 PHE CA A 13 PHE C 1.0 -255.0 -25.0 PHI 15 15 A 12 LYS C A 13 PHE N A 13 PHE CA A 13 PHE C 1.0 -135.0 75.0 PHI 16 16 A 13 PHE N A 13 PHE CA A 13 PHE C A 14 LYS N 1.0 88.6 185.7 PSI 17 17 A 13 PHE N A 13 PHE CA A 13 PHE C A 14 LYS N 1.0 -75.0 185.0 PSI 18 18 A 13 PHE N A 13 PHE CA A 13 PHE C A 14 LYS N 1.0 25.0 55.0 PSI 19 19 A 13 PHE N A 13 PHE CA A 13 PHE C A 14 LYS N 1.0 105.0 185.0 PSI 20 20 A 16 TYR C A 17 HIS N A 17 HIS CA A 17 HIS C 1.0 -173.1 -63.5 PHI 21 21 A 16 TYR C A 17 HIS N A 17 HIS CA A 17 HIS C 1.0 -175.0 75.0 PHI 22 22 A 16 TYR C A 17 HIS N A 17 HIS CA A 17 HIS C 1.0 -255.0 -25.0 PHI 23 23 A 16 TYR C A 17 HIS N A 17 HIS CA A 17 HIS C 1.0 -135.0 75.0 PHI 24 24 A 17 HIS N A 17 HIS CA A 17 HIS C A 18 GLU N 1.0 70.2 200.3 PSI 25 25 A 17 HIS N A 17 HIS CA A 17 HIS C A 18 GLU N 1.0 -75.0 185.0 PSI 26 26 A 17 HIS N A 17 HIS CA A 17 HIS C A 18 GLU N 1.0 25.0 55.0 PSI 27 27 A 17 HIS N A 17 HIS CA A 17 HIS C A 18 GLU N 1.0 105.0 185.0 PSI 28 28 A 17 HIS C A 18 GLU N A 18 GLU CA A 18 GLU C 1.0 -150.6 -83.3 PHI 29 29 A 17 HIS C A 18 GLU N A 18 GLU CA A 18 GLU C 1.0 -175.0 75.0 PHI 30 30 A 17 HIS C A 18 GLU N A 18 GLU CA A 18 GLU C 1.0 -255.0 -25.0 PHI 31 31 A 17 HIS C A 18 GLU N A 18 GLU CA A 18 GLU C 1.0 -135.0 75.0 PHI 32 32 A 18 GLU N A 18 GLU CA A 18 GLU C A 19 GLY N 1.0 92.0 171.3 PSI 33 33 A 18 GLU N A 18 GLU CA A 18 GLU C A 19 GLY N 1.0 -75.0 185.0 PSI 34 34 A 18 GLU N A 18 GLU CA A 18 GLU C A 19 GLY N 1.0 25.0 55.0 PSI 35 35 A 18 GLU N A 18 GLU CA A 18 GLU C A 19 GLY N 1.0 105.0 185.0 PSI 36 36 A 19 GLY C A 20 LYS N A 20 LYS CA A 20 LYS C 1.0 -143.2 -23.2 PHI 37 37 A 19 GLY C A 20 LYS N A 20 LYS CA A 20 LYS C 1.0 -175.0 75.0 PHI 38 38 A 19 GLY C A 20 LYS N A 20 LYS CA A 20 LYS C 1.0 -255.0 -25.0 PHI 39 39 A 19 GLY C A 20 LYS N A 20 LYS CA A 20 LYS C 1.0 -135.0 75.0 PHI 40 40 A 20 LYS N A 20 LYS CA A 20 LYS C A 21 PHE N 1.0 91.6 195.9 PSI 41 41 A 20 LYS N A 20 LYS CA A 20 LYS C A 21 PHE N 1.0 -75.0 185.0 PSI 42 42 A 20 LYS N A 20 LYS CA A 20 LYS C A 21 PHE N 1.0 25.0 55.0 PSI 43 43 A 20 LYS N A 20 LYS CA A 20 LYS C A 21 PHE N 1.0 105.0 185.0 PSI 44 44 A 21 PHE C A 22 TRP N A 22 TRP CA A 22 TRP C 1.0 -139.2 -74.2 PHI 45 45 A 21 PHE C A 22 TRP N A 22 TRP CA A 22 TRP C 1.0 -175.0 75.0 PHI 46 46 A 21 PHE C A 22 TRP N A 22 TRP CA A 22 TRP C 1.0 -255.0 -25.0 PHI 47 47 A 21 PHE C A 22 TRP N A 22 TRP CA A 22 TRP C 1.0 -135.0 75.0 PHI 48 48 A 22 TRP N A 22 TRP CA A 22 TRP C A 23 CYS N 1.0 79.8 185.3 PSI 49 49 A 22 TRP N A 22 TRP CA A 22 TRP C A 23 CYS N 1.0 -75.0 185.0 PSI 50 50 A 22 TRP N A 22 TRP CA A 22 TRP C A 23 CYS N 1.0 25.0 55.0 PSI 51 51 A 22 TRP N A 22 TRP CA A 22 TRP C A 23 CYS N 1.0 105.0 185.0 PSI 52 52 A 22 TRP C A 23 CYS N A 23 CYS CA A 23 CYS C 1.0 -182.1 -48.8 PHI 53 53 A 23 CYS N A 23 CYS CA A 23 CYS C A 24 PRO N 1.0 101.5 180.9 PSI 54 54 A 1 THR N A 1 THR CA A 1 THR C A 2 CYS N 1.0 -75.0 185.0 PSI 55 55 A 1 THR N A 1 THR CA A 1 THR C A 2 CYS N 1.0 25.0 55.0 PSI 56 56 A 1 THR N A 1 THR CA A 1 THR C A 2 CYS N 1.0 105.0 185.0 PSI 57 57 A 1 THR C A 2 CYS N A 2 CYS CA A 2 CYS C 1.0 -175.0 75.0 PHI 58 58 A 1 THR C A 2 CYS N A 2 CYS CA A 2 CYS C 1.0 -255.0 -25.0 PHI 59 59 A 1 THR C A 2 CYS N A 2 CYS CA A 2 CYS C 1.0 -135.0 75.0 PHI 60 60 A 2 CYS N A 2 CYS CA A 2 CYS C A 3 HIS N 1.0 -75.0 185.0 PSI 61 61 A 2 CYS N A 2 CYS CA A 2 CYS C A 3 HIS N 1.0 25.0 55.0 PSI 62 62 A 2 CYS N A 2 CYS CA A 2 CYS C A 3 HIS N 1.0 105.0 185.0 PSI 63 63 A 3 HIS C A 4 ILE N A 4 ILE CA A 4 ILE C 1.0 -175.0 75.0 PHI 64 64 A 3 HIS C A 4 ILE N A 4 ILE CA A 4 ILE C 1.0 -255.0 -25.0 PHI 65 65 A 3 HIS C A 4 ILE N A 4 ILE CA A 4 ILE C 1.0 -135.0 75.0 PHI 66 66 A 4 ILE N A 4 ILE CA A 4 ILE C A 5 ARG N 1.0 -75.0 185.0 PSI 67 67 A 4 ILE N A 4 ILE CA A 4 ILE C A 5 ARG N 1.0 25.0 55.0 PSI 68 68 A 4 ILE N A 4 ILE CA A 4 ILE C A 5 ARG N 1.0 105.0 185.0 PSI 69 69 A 4 ILE C A 5 ARG N A 5 ARG CA A 5 ARG C 1.0 -175.0 75.0 PHI 70 70 A 4 ILE C A 5 ARG N A 5 ARG CA A 5 ARG C 1.0 -255.0 -25.0 PHI 71 71 A 4 ILE C A 5 ARG N A 5 ARG CA A 5 ARG C 1.0 -135.0 75.0 PHI 72 72 A 5 ARG N A 5 ARG CA A 5 ARG C A 6 ARG N 1.0 -75.0 185.0 PSI 73 73 A 5 ARG N A 5 ARG CA A 5 ARG C A 6 ARG N 1.0 25.0 55.0 PSI 74 74 A 5 ARG N A 5 ARG CA A 5 ARG C A 6 ARG N 1.0 105.0 185.0 PSI 75 75 A 5 ARG C A 6 ARG N A 6 ARG CA A 6 ARG C 1.0 -175.0 75.0 PHI 76 76 A 5 ARG C A 6 ARG N A 6 ARG CA A 6 ARG C 1.0 -255.0 -25.0 PHI 77 77 A 5 ARG C A 6 ARG N A 6 ARG CA A 6 ARG C 1.0 -135.0 75.0 PHI 78 78 A 6 ARG N A 6 ARG CA A 6 ARG C A 7 LYS N 1.0 -75.0 185.0 PSI 79 79 A 6 ARG N A 6 ARG CA A 6 ARG C A 7 LYS N 1.0 25.0 55.0 PSI 80 80 A 6 ARG N A 6 ARG CA A 6 ARG C A 7 LYS N 1.0 105.0 185.0 PSI 81 81 A 8 PRO C A 9 LYS N A 9 LYS CA A 9 LYS C 1.0 -175.0 75.0 PHI 82 82 A 8 PRO C A 9 LYS N A 9 LYS CA A 9 LYS C 1.0 -255.0 -25.0 PHI 83 83 A 8 PRO C A 9 LYS N A 9 LYS CA A 9 LYS C 1.0 -135.0 75.0 PHI 84 84 A 9 LYS N A 9 LYS CA A 9 LYS C A 10 PHE N 1.0 -75.0 185.0 PSI 85 85 A 9 LYS N A 9 LYS CA A 9 LYS C A 10 PHE N 1.0 25.0 55.0 PSI 86 86 A 9 LYS N A 9 LYS CA A 9 LYS C A 10 PHE N 1.0 105.0 185.0 PSI 87 87 A 9 LYS C A 10 PHE N A 10 PHE CA A 10 PHE C 1.0 -175.0 75.0 PHI 88 88 A 9 LYS C A 10 PHE N A 10 PHE CA A 10 PHE C 1.0 -255.0 -25.0 PHI 89 89 A 9 LYS C A 10 PHE N A 10 PHE CA A 10 PHE C 1.0 -135.0 75.0 PHI 90 90 A 10 PHE N A 10 PHE CA A 10 PHE C A 11 ARG N 1.0 -75.0 185.0 PSI 91 91 A 10 PHE N A 10 PHE CA A 10 PHE C A 11 ARG N 1.0 25.0 55.0 PSI 92 92 A 10 PHE N A 10 PHE CA A 10 PHE C A 11 ARG N 1.0 105.0 185.0 PSI 93 93 A 10 PHE C A 11 ARG N A 11 ARG CA A 11 ARG C 1.0 -175.0 75.0 PHI 94 94 A 10 PHE C A 11 ARG N A 11 ARG CA A 11 ARG C 1.0 -255.0 -25.0 PHI 95 95 A 10 PHE C A 11 ARG N A 11 ARG CA A 11 ARG C 1.0 -135.0 75.0 PHI 96 96 A 11 ARG N A 11 ARG CA A 11 ARG C A 12 LYS N 1.0 -75.0 185.0 PSI 97 97 A 11 ARG N A 11 ARG CA A 11 ARG C A 12 LYS N 1.0 25.0 55.0 PSI 98 98 A 11 ARG N A 11 ARG CA A 11 ARG C A 12 LYS N 1.0 105.0 185.0 PSI 99 99 A 11 ARG C A 12 LYS N A 12 LYS CA A 12 LYS C 1.0 -175.0 75.0 PHI 100 100 A 11 ARG C A 12 LYS N A 12 LYS CA A 12 LYS C 1.0 -255.0 -25.0 PHI 101 101 A 11 ARG C A 12 LYS N A 12 LYS CA A 12 LYS C 1.0 -135.0 75.0 PHI 102 102 A 12 LYS N A 12 LYS CA A 12 LYS C A 13 PHE N 1.0 -75.0 185.0 PSI 103 103 A 12 LYS N A 12 LYS CA A 12 LYS C A 13 PHE N 1.0 25.0 55.0 PSI 104 104 A 12 LYS N A 12 LYS CA A 12 LYS C A 13 PHE N 1.0 105.0 185.0 PSI 105 105 A 13 PHE C A 14 LYS N A 14 LYS CA A 14 LYS C 1.0 -175.0 75.0 PHI 106 106 A 13 PHE C A 14 LYS N A 14 LYS CA A 14 LYS C 1.0 -255.0 -25.0 PHI 107 107 A 13 PHE C A 14 LYS N A 14 LYS CA A 14 LYS C 1.0 -135.0 75.0 PHI 108 108 A 14 LYS N A 14 LYS CA A 14 LYS C A 15 LEU N 1.0 -75.0 185.0 PSI 109 109 A 14 LYS N A 14 LYS CA A 14 LYS C A 15 LEU N 1.0 25.0 55.0 PSI 110 110 A 14 LYS N A 14 LYS CA A 14 LYS C A 15 LEU N 1.0 105.0 185.0 PSI 111 111 A 14 LYS C A 15 LEU N A 15 LEU CA A 15 LEU C 1.0 -175.0 75.0 PHI 112 112 A 14 LYS C A 15 LEU N A 15 LEU CA A 15 LEU C 1.0 -255.0 -25.0 PHI 113 113 A 14 LYS C A 15 LEU N A 15 LEU CA A 15 LEU C 1.0 -135.0 75.0 PHI 114 114 A 15 LEU N A 15 LEU CA A 15 LEU C A 16 TYR N 1.0 -75.0 185.0 PSI 115 115 A 15 LEU N A 15 LEU CA A 15 LEU C A 16 TYR N 1.0 25.0 55.0 PSI 116 116 A 15 LEU N A 15 LEU CA A 15 LEU C A 16 TYR N 1.0 105.0 185.0 PSI 117 117 A 15 LEU C A 16 TYR N A 16 TYR CA A 16 TYR C 1.0 -175.0 75.0 PHI 118 118 A 15 LEU C A 16 TYR N A 16 TYR CA A 16 TYR C 1.0 -255.0 -25.0 PHI 119 119 A 15 LEU C A 16 TYR N A 16 TYR CA A 16 TYR C 1.0 -135.0 75.0 PHI 120 120 A 16 TYR N A 16 TYR CA A 16 TYR C A 17 HIS N 1.0 -75.0 185.0 PSI 121 121 A 16 TYR N A 16 TYR CA A 16 TYR C A 17 HIS N 1.0 25.0 55.0 PSI 122 122 A 16 TYR N A 16 TYR CA A 16 TYR C A 17 HIS N 1.0 105.0 185.0 PSI 123 123 A 20 LYS C A 21 PHE N A 21 PHE CA A 21 PHE C 1.0 -175.0 75.0 PHI 124 124 A 20 LYS C A 21 PHE N A 21 PHE CA A 21 PHE C 1.0 -255.0 -25.0 PHI 125 125 A 20 LYS C A 21 PHE N A 21 PHE CA A 21 PHE C 1.0 -135.0 75.0 PHI 126 126 A 21 PHE N A 21 PHE CA A 21 PHE C A 22 TRP N 1.0 -75.0 185.0 PSI 127 127 A 21 PHE N A 21 PHE CA A 21 PHE C A 22 TRP N 1.0 25.0 55.0 PSI 128 128 A 21 PHE N A 21 PHE CA A 21 PHE C A 22 TRP N 1.0 105.0 185.0 PSI 129 129 A 1 THR N A 1 THR CA A 1 THR CB A 1 THR OG1 1.0 -90.0 210.0 CHI1 130 130 A 1 THR N A 1 THR CA A 1 THR CB A 1 THR OG1 1.0 -330.0 -30.0 CHI1 131 131 A 1 THR N A 1 THR CA A 1 THR CB A 1 THR OG1 1.0 -210.0 90.0 CHI1 132 132 A 2 CYS N A 2 CYS CA A 2 CYS CB A 2 CYS SG 1.0 -90.0 210.0 CHI1 133 133 A 2 CYS N A 2 CYS CA A 2 CYS CB A 2 CYS SG 1.0 -330.0 -30.0 CHI1 134 134 A 2 CYS N A 2 CYS CA A 2 CYS CB A 2 CYS SG 1.0 -210.0 90.0 CHI1 135 135 A 3 HIS N A 3 HIS CA A 3 HIS CB A 3 HIS CG 1.0 -90.0 210.0 CHI1 136 136 A 3 HIS N A 3 HIS CA A 3 HIS CB A 3 HIS CG 1.0 -330.0 -30.0 CHI1 137 137 A 3 HIS N A 3 HIS CA A 3 HIS CB A 3 HIS CG 1.0 -210.0 90.0 CHI1 138 138 A 4 ILE N A 4 ILE CA A 4 ILE CB A 4 ILE CG1 1.0 -90.0 210.0 CHI1 139 139 A 4 ILE N A 4 ILE CA A 4 ILE CB A 4 ILE CG1 1.0 -330.0 -30.0 CHI1 140 140 A 4 ILE N A 4 ILE CA A 4 ILE CB A 4 ILE CG1 1.0 -210.0 90.0 CHI1 141 141 A 4 ILE CA A 4 ILE CB A 4 ILE CG1 A 4 ILE CD1 1.0 -90.0 210.0 CHI21 142 142 A 4 ILE CA A 4 ILE CB A 4 ILE CG1 A 4 ILE CD1 1.0 -330.0 -30.0 CHI21 143 143 A 4 ILE CA A 4 ILE CB A 4 ILE CG1 A 4 ILE CD1 1.0 -210.0 90.0 CHI21 144 144 A 5 ARG N A 5 ARG CA A 5 ARG CB A 5 ARG CG 1.0 -90.0 210.0 CHI1 145 145 A 5 ARG N A 5 ARG CA A 5 ARG CB A 5 ARG CG 1.0 -330.0 -30.0 CHI1 146 146 A 5 ARG N A 5 ARG CA A 5 ARG CB A 5 ARG CG 1.0 -210.0 90.0 CHI1 147 147 A 5 ARG CA A 5 ARG CB A 5 ARG CG A 5 ARG CD 1.0 -90.0 210.0 CHI2 148 148 A 5 ARG CA A 5 ARG CB A 5 ARG CG A 5 ARG CD 1.0 -330.0 -30.0 CHI2 149 149 A 5 ARG CA A 5 ARG CB A 5 ARG CG A 5 ARG CD 1.0 -210.0 90.0 CHI2 150 150 A 5 ARG CB A 5 ARG CG A 5 ARG CD A 5 ARG NE 1.0 -90.0 210.0 CHI3 151 151 A 5 ARG CB A 5 ARG CG A 5 ARG CD A 5 ARG NE 1.0 -330.0 -30.0 CHI3 152 152 A 5 ARG CB A 5 ARG CG A 5 ARG CD A 5 ARG NE 1.0 -210.0 90.0 CHI3 153 153 A 6 ARG N A 6 ARG CA A 6 ARG CB A 6 ARG CG 1.0 -90.0 210.0 CHI1 154 154 A 6 ARG N A 6 ARG CA A 6 ARG CB A 6 ARG CG 1.0 -330.0 -30.0 CHI1 155 155 A 6 ARG N A 6 ARG CA A 6 ARG CB A 6 ARG CG 1.0 -210.0 90.0 CHI1 156 156 A 6 ARG CA A 6 ARG CB A 6 ARG CG A 6 ARG CD 1.0 -90.0 210.0 CHI2 157 157 A 6 ARG CA A 6 ARG CB A 6 ARG CG A 6 ARG CD 1.0 -330.0 -30.0 CHI2 158 158 A 6 ARG CA A 6 ARG CB A 6 ARG CG A 6 ARG CD 1.0 -210.0 90.0 CHI2 159 159 A 6 ARG CB A 6 ARG CG A 6 ARG CD A 6 ARG NE 1.0 -90.0 210.0 CHI3 160 160 A 6 ARG CB A 6 ARG CG A 6 ARG CD A 6 ARG NE 1.0 -330.0 -30.0 CHI3 161 161 A 6 ARG CB A 6 ARG CG A 6 ARG CD A 6 ARG NE 1.0 -210.0 90.0 CHI3 162 162 A 7 LYS N A 7 LYS CA A 7 LYS CB A 7 LYS CG 1.0 -90.0 210.0 CHI1 163 163 A 7 LYS N A 7 LYS CA A 7 LYS CB A 7 LYS CG 1.0 -330.0 -30.0 CHI1 164 164 A 7 LYS N A 7 LYS CA A 7 LYS CB A 7 LYS CG 1.0 -210.0 90.0 CHI1 165 165 A 7 LYS CA A 7 LYS CB A 7 LYS CG A 7 LYS CD 1.0 -90.0 210.0 CHI2 166 166 A 7 LYS CA A 7 LYS CB A 7 LYS CG A 7 LYS CD 1.0 -330.0 -30.0 CHI2 167 167 A 7 LYS CA A 7 LYS CB A 7 LYS CG A 7 LYS CD 1.0 -210.0 90.0 CHI2 168 168 A 7 LYS CB A 7 LYS CG A 7 LYS CD A 7 LYS CE 1.0 -90.0 210.0 CHI3 169 169 A 7 LYS CB A 7 LYS CG A 7 LYS CD A 7 LYS CE 1.0 -330.0 -30.0 CHI3 170 170 A 7 LYS CB A 7 LYS CG A 7 LYS CD A 7 LYS CE 1.0 -210.0 90.0 CHI3 171 171 A 7 LYS CG A 7 LYS CD A 7 LYS CE A 7 LYS NZ 1.0 -90.0 210.0 CHI4 172 172 A 7 LYS CG A 7 LYS CD A 7 LYS CE A 7 LYS NZ 1.0 -330.0 -30.0 CHI4 173 173 A 7 LYS CG A 7 LYS CD A 7 LYS CE A 7 LYS NZ 1.0 -210.0 90.0 CHI4 174 174 A 9 LYS N A 9 LYS CA A 9 LYS CB A 9 LYS CG 1.0 -90.0 210.0 CHI1 175 175 A 9 LYS N A 9 LYS CA A 9 LYS CB A 9 LYS CG 1.0 -330.0 -30.0 CHI1 176 176 A 9 LYS N A 9 LYS CA A 9 LYS CB A 9 LYS CG 1.0 -210.0 90.0 CHI1 177 177 A 9 LYS CA A 9 LYS CB A 9 LYS CG A 9 LYS CD 1.0 -90.0 210.0 CHI2 178 178 A 9 LYS CA A 9 LYS CB A 9 LYS CG A 9 LYS CD 1.0 -330.0 -30.0 CHI2 179 179 A 9 LYS CA A 9 LYS CB A 9 LYS CG A 9 LYS CD 1.0 -210.0 90.0 CHI2 180 180 A 9 LYS CB A 9 LYS CG A 9 LYS CD A 9 LYS CE 1.0 -90.0 210.0 CHI3 181 181 A 9 LYS CB A 9 LYS CG A 9 LYS CD A 9 LYS CE 1.0 -330.0 -30.0 CHI3 182 182 A 9 LYS CB A 9 LYS CG A 9 LYS CD A 9 LYS CE 1.0 -210.0 90.0 CHI3 183 183 A 9 LYS CG A 9 LYS CD A 9 LYS CE A 9 LYS NZ 1.0 -90.0 210.0 CHI4 184 184 A 9 LYS CG A 9 LYS CD A 9 LYS CE A 9 LYS NZ 1.0 -330.0 -30.0 CHI4 185 185 A 9 LYS CG A 9 LYS CD A 9 LYS CE A 9 LYS NZ 1.0 -210.0 90.0 CHI4 186 186 A 10 PHE N A 10 PHE CA A 10 PHE CB A 10 PHE CG 1.0 -90.0 210.0 CHI1 187 187 A 10 PHE N A 10 PHE CA A 10 PHE CB A 10 PHE CG 1.0 -330.0 -30.0 CHI1 188 188 A 10 PHE N A 10 PHE CA A 10 PHE CB A 10 PHE CG 1.0 -210.0 90.0 CHI1 189 189 A 11 ARG N A 11 ARG CA A 11 ARG CB A 11 ARG CG 1.0 -90.0 210.0 CHI1 190 190 A 11 ARG N A 11 ARG CA A 11 ARG CB A 11 ARG CG 1.0 -330.0 -30.0 CHI1 191 191 A 11 ARG N A 11 ARG CA A 11 ARG CB A 11 ARG CG 1.0 -210.0 90.0 CHI1 192 192 A 11 ARG CA A 11 ARG CB A 11 ARG CG A 11 ARG CD 1.0 -90.0 210.0 CHI2 193 193 A 11 ARG CA A 11 ARG CB A 11 ARG CG A 11 ARG CD 1.0 -330.0 -30.0 CHI2 194 194 A 11 ARG CA A 11 ARG CB A 11 ARG CG A 11 ARG CD 1.0 -210.0 90.0 CHI2 195 195 A 11 ARG CB A 11 ARG CG A 11 ARG CD A 11 ARG NE 1.0 -90.0 210.0 CHI3 196 196 A 11 ARG CB A 11 ARG CG A 11 ARG CD A 11 ARG NE 1.0 -330.0 -30.0 CHI3 197 197 A 11 ARG CB A 11 ARG CG A 11 ARG CD A 11 ARG NE 1.0 -210.0 90.0 CHI3 198 198 A 12 LYS N A 12 LYS CA A 12 LYS CB A 12 LYS CG 1.0 -90.0 210.0 CHI1 199 199 A 12 LYS N A 12 LYS CA A 12 LYS CB A 12 LYS CG 1.0 -330.0 -30.0 CHI1 200 200 A 12 LYS N A 12 LYS CA A 12 LYS CB A 12 LYS CG 1.0 -210.0 90.0 CHI1 201 201 A 12 LYS CA A 12 LYS CB A 12 LYS CG A 12 LYS CD 1.0 -90.0 210.0 CHI2 202 202 A 12 LYS CA A 12 LYS CB A 12 LYS CG A 12 LYS CD 1.0 -330.0 -30.0 CHI2 203 203 A 12 LYS CA A 12 LYS CB A 12 LYS CG A 12 LYS CD 1.0 -210.0 90.0 CHI2 204 204 A 12 LYS CB A 12 LYS CG A 12 LYS CD A 12 LYS CE 1.0 -90.0 210.0 CHI3 205 205 A 12 LYS CB A 12 LYS CG A 12 LYS CD A 12 LYS CE 1.0 -330.0 -30.0 CHI3 206 206 A 12 LYS CB A 12 LYS CG A 12 LYS CD A 12 LYS CE 1.0 -210.0 90.0 CHI3 207 207 A 12 LYS CG A 12 LYS CD A 12 LYS CE A 12 LYS NZ 1.0 -90.0 210.0 CHI4 208 208 A 12 LYS CG A 12 LYS CD A 12 LYS CE A 12 LYS NZ 1.0 -330.0 -30.0 CHI4 209 209 A 12 LYS CG A 12 LYS CD A 12 LYS CE A 12 LYS NZ 1.0 -210.0 90.0 CHI4 210 210 A 13 PHE N A 13 PHE CA A 13 PHE CB A 13 PHE CG 1.0 -90.0 210.0 CHI1 211 211 A 13 PHE N A 13 PHE CA A 13 PHE CB A 13 PHE CG 1.0 -330.0 -30.0 CHI1 212 212 A 13 PHE N A 13 PHE CA A 13 PHE CB A 13 PHE CG 1.0 -210.0 90.0 CHI1 213 213 A 14 LYS N A 14 LYS CA A 14 LYS CB A 14 LYS CG 1.0 -90.0 210.0 CHI1 214 214 A 14 LYS N A 14 LYS CA A 14 LYS CB A 14 LYS CG 1.0 -330.0 -30.0 CHI1 215 215 A 14 LYS N A 14 LYS CA A 14 LYS CB A 14 LYS CG 1.0 -210.0 90.0 CHI1 216 216 A 14 LYS CA A 14 LYS CB A 14 LYS CG A 14 LYS CD 1.0 -90.0 210.0 CHI2 217 217 A 14 LYS CA A 14 LYS CB A 14 LYS CG A 14 LYS CD 1.0 -330.0 -30.0 CHI2 218 218 A 14 LYS CA A 14 LYS CB A 14 LYS CG A 14 LYS CD 1.0 -210.0 90.0 CHI2 219 219 A 14 LYS CB A 14 LYS CG A 14 LYS CD A 14 LYS CE 1.0 -90.0 210.0 CHI3 220 220 A 14 LYS CB A 14 LYS CG A 14 LYS CD A 14 LYS CE 1.0 -330.0 -30.0 CHI3 221 221 A 14 LYS CB A 14 LYS CG A 14 LYS CD A 14 LYS CE 1.0 -210.0 90.0 CHI3 222 222 A 14 LYS CG A 14 LYS CD A 14 LYS CE A 14 LYS NZ 1.0 -90.0 210.0 CHI4 223 223 A 14 LYS CG A 14 LYS CD A 14 LYS CE A 14 LYS NZ 1.0 -330.0 -30.0 CHI4 224 224 A 14 LYS CG A 14 LYS CD A 14 LYS CE A 14 LYS NZ 1.0 -210.0 90.0 CHI4 225 225 A 15 LEU N A 15 LEU CA A 15 LEU CB A 15 LEU CG 1.0 -90.0 210.0 CHI1 226 226 A 15 LEU N A 15 LEU CA A 15 LEU CB A 15 LEU CG 1.0 -330.0 -30.0 CHI1 227 227 A 15 LEU N A 15 LEU CA A 15 LEU CB A 15 LEU CG 1.0 -210.0 90.0 CHI1 228 228 A 15 LEU CA A 15 LEU CB A 15 LEU CG A 15 LEU CD1 1.0 -90.0 210.0 CHI2 229 229 A 15 LEU CA A 15 LEU CB A 15 LEU CG A 15 LEU CD1 1.0 -330.0 -30.0 CHI2 230 230 A 15 LEU CA A 15 LEU CB A 15 LEU CG A 15 LEU CD1 1.0 -210.0 90.0 CHI2 231 231 A 16 TYR N A 16 TYR CA A 16 TYR CB A 16 TYR CG 1.0 -90.0 210.0 CHI1 232 232 A 16 TYR N A 16 TYR CA A 16 TYR CB A 16 TYR CG 1.0 -330.0 -30.0 CHI1 233 233 A 16 TYR N A 16 TYR CA A 16 TYR CB A 16 TYR CG 1.0 -210.0 90.0 CHI1 234 234 A 17 HIS N A 17 HIS CA A 17 HIS CB A 17 HIS CG 1.0 -90.0 210.0 CHI1 235 235 A 17 HIS N A 17 HIS CA A 17 HIS CB A 17 HIS CG 1.0 -330.0 -30.0 CHI1 236 236 A 17 HIS N A 17 HIS CA A 17 HIS CB A 17 HIS CG 1.0 -210.0 90.0 CHI1 237 237 A 18 GLU N A 18 GLU CA A 18 GLU CB A 18 GLU CG 1.0 -90.0 210.0 CHI1 238 238 A 18 GLU N A 18 GLU CA A 18 GLU CB A 18 GLU CG 1.0 -330.0 -30.0 CHI1 239 239 A 18 GLU N A 18 GLU CA A 18 GLU CB A 18 GLU CG 1.0 -210.0 90.0 CHI1 240 240 A 18 GLU CA A 18 GLU CB A 18 GLU CG A 18 GLU CD 1.0 -90.0 210.0 CHI2 241 241 A 18 GLU CA A 18 GLU CB A 18 GLU CG A 18 GLU CD 1.0 -330.0 -30.0 CHI2 242 242 A 18 GLU CA A 18 GLU CB A 18 GLU CG A 18 GLU CD 1.0 -210.0 90.0 CHI2 243 243 A 20 LYS N A 20 LYS CA A 20 LYS CB A 20 LYS CG 1.0 -90.0 210.0 CHI1 244 244 A 20 LYS N A 20 LYS CA A 20 LYS CB A 20 LYS CG 1.0 -330.0 -30.0 CHI1 245 245 A 20 LYS N A 20 LYS CA A 20 LYS CB A 20 LYS CG 1.0 -210.0 90.0 CHI1 246 246 A 20 LYS CA A 20 LYS CB A 20 LYS CG A 20 LYS CD 1.0 -90.0 210.0 CHI2 247 247 A 20 LYS CA A 20 LYS CB A 20 LYS CG A 20 LYS CD 1.0 -330.0 -30.0 CHI2 248 248 A 20 LYS CA A 20 LYS CB A 20 LYS CG A 20 LYS CD 1.0 -210.0 90.0 CHI2 249 249 A 20 LYS CB A 20 LYS CG A 20 LYS CD A 20 LYS CE 1.0 -90.0 210.0 CHI3 250 250 A 20 LYS CB A 20 LYS CG A 20 LYS CD A 20 LYS CE 1.0 -330.0 -30.0 CHI3 251 251 A 20 LYS CB A 20 LYS CG A 20 LYS CD A 20 LYS CE 1.0 -210.0 90.0 CHI3 252 252 A 20 LYS CG A 20 LYS CD A 20 LYS CE A 20 LYS NZ 1.0 -90.0 210.0 CHI4 253 253 A 20 LYS CG A 20 LYS CD A 20 LYS CE A 20 LYS NZ 1.0 -330.0 -30.0 CHI4 254 254 A 20 LYS CG A 20 LYS CD A 20 LYS CE A 20 LYS NZ 1.0 -210.0 90.0 CHI4 255 255 A 21 PHE N A 21 PHE CA A 21 PHE CB A 21 PHE CG 1.0 -90.0 210.0 CHI1 256 256 A 21 PHE N A 21 PHE CA A 21 PHE CB A 21 PHE CG 1.0 -330.0 -30.0 CHI1 257 257 A 21 PHE N A 21 PHE CA A 21 PHE CB A 21 PHE CG 1.0 -210.0 90.0 CHI1 258 258 A 22 TRP N A 22 TRP CA A 22 TRP CB A 22 TRP CG 1.0 -90.0 210.0 CHI1 259 259 A 22 TRP N A 22 TRP CA A 22 TRP CB A 22 TRP CG 1.0 -330.0 -30.0 CHI1 260 260 A 22 TRP N A 22 TRP CA A 22 TRP CB A 22 TRP CG 1.0 -210.0 90.0 CHI1 261 261 A 23 CYS N A 23 CYS CA A 23 CYS CB A 23 CYS SG 1.0 -90.0 210.0 CHI1 262 262 A 23 CYS N A 23 CYS CA A 23 CYS CB A 23 CYS SG 1.0 -330.0 -30.0 CHI1 263 263 A 23 CYS N A 23 CYS CA A 23 CYS CB A 23 CYS SG 1.0 -210.0 90.0 CHI1 stop_ save_