data_nef_c19693_2mit save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 18705 PDB 1ZMP PDB 2LXZ PDB 2mit 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 3 CYS SG 1 31 CYS SG 1 5 CYS SG 2 20 CYS SG 1 10 CYS SG 1 30 CYS SG 1 20 CYS SG 2 5 CYS SG 2 3 CYS SG 2 31 CYS SG 2 10 CYS SG 2 30 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 ALA start . . 2 A 2 THR middle . . 3 A 3 CYS middle -HG . 4 A 4 TYR middle . . 5 A 5 CYS middle -HG . 6 A 6 ARG middle . . 7 A 7 THR middle . . 8 A 8 GLY middle . false 9 A 9 ARG middle . . 10 A 10 CYS middle -HG . 11 A 11 ALA middle . . 12 A 12 THR middle . . 13 A 13 ARG middle . . 14 A 14 GLU middle . . 15 A 15 SER middle . . 16 A 16 LEU middle . . 17 A 17 SER middle . . 18 A 18 GLY middle . false 19 A 19 VAL middle . . 20 A 20 CYS middle -HG . 21 A 21 GLU middle . . 22 A 22 ILE middle . . 23 A 23 SER middle . . 24 A 24 GLY middle . false 25 A 25 ARG middle . . 26 A 26 LEU middle . . 27 A 27 TYR middle . . 28 A 28 ARG middle . . 29 A 29 LEU middle . . 30 A 30 CYS middle -HG . 31 A 31 CYS middle -HG . 32 A 32 ARG end . . 33 B 101 ALA start . . 34 B 102 THR middle . . 35 B 103 CYS middle -HG . 36 B 104 TYR middle . . 37 B 105 CYS middle -HG . 38 B 106 ARG middle . . 39 B 107 THR middle . . 40 B 108 GLY middle . false 41 B 109 ARG middle . . 42 B 110 CYS middle -HG . 43 B 111 ALA middle . . 44 B 112 THR middle . . 45 B 113 ARG middle . . 46 B 114 GLU middle . . 47 B 115 SER middle . . 48 B 116 LEU middle . . 49 B 117 SER middle . . 50 B 118 GLY middle . false 51 B 119 VAL middle . . 52 B 120 CYS middle -HG . 53 B 121 GLU middle . . 54 B 122 ILE middle . . 55 B 123 SER middle . . 56 B 124 GLY middle . false 57 B 125 ARG middle . . 58 B 126 LEU middle . . 59 B 127 TYR middle . . 60 B 128 ARG middle . . 61 B 129 LEU middle . . 62 B 130 CYS middle -HG . 63 B 131 CYS middle -HG . 64 B 132 ARG end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 ALA HA H 1 4.197 0.000 A 1 ALA HB% H 1 1.464 0.000 A 1 ALA C C 13 173.123 0.000 A 1 ALA CA C 13 49.241 0.000 A 1 ALA CB C 13 16.981 0.000 A 2 THR H H 1 8.365 0.000 A 2 THR HA H 1 4.571 0.000 A 2 THR HB H 1 4.001 0.000 A 2 THR HG2% H 1 1.182 0.000 A 2 THR C C 13 173.249 0.000 A 2 THR CA C 13 59.977 0.000 A 2 THR CB C 13 68.060 0.000 A 2 THR CG2 C 13 19.234 0.000 A 2 THR N N 15 115.586 0.000 A 3 CYS H H 1 8.279 0.000 A 3 CYS HA H 1 5.529 0.000 A 3 CYS HBy H 1 2.635 0.000 A 3 CYS HBx H 1 2.296 0.000 A 3 CYS C C 13 170.990 0.000 A 3 CYS CA C 13 52.424 0.000 A 3 CYS CB C 13 47.514 0.000 A 3 CYS N N 15 122.021 0.000 A 4 TYR H H 1 8.632 0.000 A 4 TYR HA H 1 4.736 0.000 A 4 TYR HBy H 1 3.164 0.000 A 4 TYR HBx H 1 2.430 0.000 A 4 TYR HDx H 1 7.119 0.000 A 4 TYR HDy H 1 7.119 0.000 A 4 TYR HEx H 1 6.680 0.000 A 4 TYR HEy H 1 6.680 0.000 A 4 TYR C C 13 174.633 0.000 A 4 TYR CA C 13 53.772 0.000 A 4 TYR CB C 13 39.602 0.000 A 4 TYR CDx C 13 131.116 0.000 A 4 TYR CEx C 13 115.594 0.000 A 4 TYR N N 15 117.786 0.000 A 5 CYS H H 1 8.902 0.000 A 5 CYS HA H 1 5.397 0.000 A 5 CYS HBy H 1 3.123 0.000 A 5 CYS HBx H 1 2.741 0.000 A 5 CYS C C 13 174.239 0.000 A 5 CYS CA C 13 53.833 0.000 A 5 CYS CB C 13 41.545 0.000 A 5 CYS N N 15 118.451 0.000 A 6 ARG H H 1 9.615 0.000 A 6 ARG HA H 1 5.018 0.000 A 6 ARG HBy H 1 1.933 0.000 A 6 ARG HBx H 1 1.706 0.000 A 6 ARG HDx H 1 3.263 0.000 A 6 ARG HDy H 1 3.263 0.000 A 6 ARG HGx H 1 1.570 0.000 A 6 ARG HGy H 1 1.570 0.000 A 6 ARG C C 13 175.445 0.000 A 6 ARG CA C 13 51.799 0.000 A 6 ARG CB C 13 30.528 0.000 A 6 ARG CD C 13 40.665 0.000 A 6 ARG CG C 13 24.736 0.000 A 6 ARG N N 15 123.236 0.000 A 7 THR H H 1 8.713 0.000 A 7 THR HA H 1 4.349 0.000 A 7 THR HB H 1 4.194 0.000 A 7 THR HG2% H 1 1.001 0.000 A 7 THR C C 13 175.851 0.000 A 7 THR CA C 13 59.780 0.000 A 7 THR CB C 13 66.445 0.000 A 7 THR CG2 C 13 19.557 0.000 A 7 THR N N 15 113.052 0.000 A 8 GLY H H 1 7.884 0.000 A 8 GLY HAy H 1 4.139 0.000 A 8 GLY HAx H 1 3.776 0.000 A 8 GLY C C 13 172.031 0.000 A 8 GLY CA C 13 41.730 0.000 A 8 GLY N N 15 111.886 0.000 A 9 ARG H H 1 8.031 0.000 A 9 ARG HA H 1 4.137 0.000 A 9 ARG HBy H 1 1.892 0.000 A 9 ARG HBx H 1 1.685 0.000 A 9 ARG HDx H 1 3.162 0.000 A 9 ARG HDy H 1 3.162 0.000 A 9 ARG HE H 1 7.121 0.000 A 9 ARG HGx H 1 1.623 0.000 A 9 ARG HGy H 1 1.623 0.000 A 9 ARG C C 13 177.133 0.000 A 9 ARG CA C 13 53.246 0.000 A 9 ARG CB C 13 28.531 0.000 A 9 ARG CD C 13 40.898 0.000 A 9 ARG CG C 13 24.425 0.000 A 9 ARG N N 15 117.348 0.000 A 9 ARG NE N 15 84.590 0.000 A 10 CYS H H 1 8.583 0.000 A 10 CYS HA H 1 4.714 0.000 A 10 CYS HBy H 1 3.336 0.000 A 10 CYS HBx H 1 2.714 0.000 A 10 CYS CA C 13 50.246 0.000 A 10 CYS CB C 13 33.460 0.000 A 10 CYS N N 15 117.348 0.000 A 11 ALA HA H 1 4.296 0.000 A 11 ALA HB% H 1 1.314 0.000 A 11 ALA CA C 13 49.629 0.000 A 11 ALA CB C 13 16.647 0.000 A 12 THR HB H 1 4.115 0.000 A 12 THR HG2% H 1 1.252 0.000 A 12 THR CB C 13 67.089 0.000 A 12 THR CG2 C 13 19.234 0.000 A 13 ARG HA H 1 4.073 0.000 A 13 ARG HBx H 1 1.995 0.000 A 13 ARG HBy H 1 1.995 0.000 A 13 ARG HDx H 1 3.202 0.000 A 13 ARG HDy H 1 3.202 0.000 A 13 ARG HE H 1 7.208 0.000 A 13 ARG HGx H 1 1.647 0.000 A 13 ARG HGy H 1 1.647 0.000 A 13 ARG CA C 13 55.450 0.000 A 13 ARG CB C 13 25.699 0.000 A 13 ARG CD C 13 40.575 0.000 A 13 ARG CG C 13 25.376 0.000 A 13 ARG NE N 15 84.363 0.000 A 14 GLU HGx H 1 2.327 0.000 A 14 GLU HGy H 1 2.327 0.000 A 14 GLU CG C 13 31.520 0.000 A 15 SER HA H 1 4.692 0.000 A 15 SER HBx H 1 3.770 0.000 A 15 SER HBy H 1 3.770 0.000 A 15 SER CB C 13 62.241 0.000 A 16 LEU HA H 1 4.760 0.000 A 16 LEU HBy H 1 1.986 0.000 A 16 LEU HBx H 1 1.514 0.000 A 16 LEU HDx% H 1 0.944 0.000 A 16 LEU HDy% H 1 1.581 0.000 A 16 LEU HG H 1 1.100 0.000 A 16 LEU C C 13 177.552 0.000 A 16 LEU CA C 13 54.175 0.000 A 16 LEU CB C 13 38.191 0.000 A 16 LEU CDx C 13 23.436 0.000 A 16 LEU CDy C 13 25.053 0.000 A 16 LEU CG C 13 21.498 0.000 A 17 SER H H 1 9.441 0.000 A 17 SER HA H 1 5.001 0.000 A 17 SER HBy H 1 3.948 0.000 A 17 SER HBx H 1 3.358 0.000 A 17 SER C C 13 171.536 0.000 A 17 SER CA C 13 55.531 0.000 A 17 SER CB C 13 63.316 0.000 A 17 SER N N 15 124.162 0.000 A 18 GLY H H 1 7.359 0.000 A 18 GLY HAy H 1 4.414 0.000 A 18 GLY HAx H 1 3.956 0.000 A 18 GLY C C 13 170.584 0.000 A 18 GLY CA C 13 41.868 0.000 A 18 GLY N N 15 108.239 0.000 A 19 VAL H H 1 8.303 0.000 A 19 VAL HA H 1 5.134 0.000 A 19 VAL HB H 1 1.994 0.000 A 19 VAL HGx% H 1 0.908 0.000 A 19 VAL HGy% H 1 0.828 0.000 A 19 VAL C C 13 174.836 0.000 A 19 VAL CA C 13 57.390 0.000 A 19 VAL CB C 13 33.578 0.000 A 19 VAL CGy C 13 19.296 0.000 A 19 VAL CGx C 13 16.647 0.000 A 19 VAL N N 15 112.833 0.000 A 20 CYS H H 1 9.245 0.000 A 20 CYS HA H 1 4.884 0.000 A 20 CYS HBx H 1 2.740 0.000 A 20 CYS HBy H 1 3.040 0.000 A 20 CYS C C 13 172.069 0.000 A 20 CYS CA C 13 51.297 0.000 A 20 CYS CB C 13 42.803 0.000 A 20 CYS N N 15 120.436 0.000 A 21 GLU H H 1 8.981 0.000 A 21 GLU HA H 1 5.183 0.000 A 21 GLU HBy H 1 2.091 0.000 A 21 GLU HBx H 1 1.841 0.000 A 21 GLU HGy H 1 2.294 0.000 A 21 GLU HGx H 1 2.112 0.000 A 21 GLU C C 13 174.811 0.000 A 21 GLU CA C 13 52.216 0.000 A 21 GLU CB C 13 25.376 0.000 A 21 GLU CG C 13 29.580 0.000 A 21 GLU N N 15 128.078 0.000 A 22 ILE H H 1 8.884 0.000 A 22 ILE HA H 1 4.245 0.000 A 22 ILE HB H 1 1.580 0.000 A 22 ILE HD1% H 1 -0.094 0.000 A 22 ILE HG1y H 1 0.987 0.000 A 22 ILE HG1x H 1 0.553 0.000 A 22 ILE HG2% H 1 0.669 0.000 A 22 ILE C C 13 175.839 0.000 A 22 ILE CA C 13 58.037 0.000 A 22 ILE CB C 13 38.309 0.000 A 22 ILE CD1 C 13 10.073 0.000 A 22 ILE CG1 C 13 24.347 0.000 A 22 ILE CG2 C 13 14.707 0.000 A 22 ILE N N 15 127.676 0.000 A 23 SER H H 1 9.442 0.000 A 23 SER HA H 1 4.016 0.000 A 23 SER HBy H 1 4.230 0.000 A 23 SER HBx H 1 3.820 0.000 A 23 SER C C 13 174.785 0.000 A 23 SER CA C 13 56.097 0.000 A 23 SER CB C 13 59.837 0.000 A 23 SER N N 15 123.963 0.000 A 24 GLY H H 1 8.570 0.000 A 24 GLY HAy H 1 4.100 0.000 A 24 GLY HAx H 1 3.633 0.000 A 24 GLY C C 13 173.389 0.000 A 24 GLY CA C 13 42.608 0.000 A 24 GLY N N 15 104.009 0.000 A 25 ARG H H 1 7.822 0.000 A 25 ARG HA H 1 4.513 0.000 A 25 ARG HBy H 1 1.724 0.000 A 25 ARG HBx H 1 1.554 0.000 A 25 ARG HDx H 1 3.109 0.000 A 25 ARG HDy H 1 3.109 0.000 A 25 ARG HE H 1 7.074 0.000 A 25 ARG HGy H 1 1.524 0.000 A 25 ARG HGx H 1 1.364 0.000 A 25 ARG C C 13 172.869 0.000 A 25 ARG CA C 13 51.617 0.000 A 25 ARG CB C 13 30.201 0.000 A 25 ARG CD C 13 40.575 0.000 A 25 ARG CG C 13 24.425 0.000 A 25 ARG N N 15 120.867 0.000 A 25 ARG NE N 15 84.641 0.000 A 26 LEU H H 1 8.091 0.000 A 26 LEU HA H 1 4.565 0.000 A 26 LEU HBx H 1 1.452 0.000 A 26 LEU HBy H 1 1.452 0.000 A 26 LEU HDx% H 1 0.729 0.000 A 26 LEU HDy% H 1 0.799 0.000 A 26 LEU HG H 1 1.329 0.000 A 26 LEU C C 13 175.712 0.000 A 26 LEU CA C 13 51.739 0.000 A 26 LEU CB C 13 40.261 0.000 A 26 LEU CDx C 13 21.820 0.000 A 26 LEU CDy C 13 21.820 0.000 A 26 LEU CG C 13 24.600 0.000 A 26 LEU N N 15 123.477 0.000 A 27 TYR H H 1 9.031 0.000 A 27 TYR HA H 1 4.460 0.000 A 27 TYR HBy H 1 2.693 0.000 A 27 TYR HBx H 1 2.345 0.000 A 27 TYR HDx H 1 6.768 0.000 A 27 TYR HDy H 1 6.768 0.000 A 27 TYR HEx H 1 6.679 0.000 A 27 TYR HEy H 1 6.679 0.000 A 27 TYR C C 13 174.976 0.000 A 27 TYR CA C 13 54.890 0.000 A 27 TYR CB C 13 37.029 0.000 A 27 TYR CDx C 13 130.146 0.000 A 27 TYR CEx C 13 115.594 0.000 A 27 TYR N N 15 124.804 0.000 A 28 ARG H H 1 9.196 0.000 A 28 ARG HA H 1 4.383 0.000 A 28 ARG HBx H 1 1.683 0.000 A 28 ARG HBy H 1 1.683 0.000 A 28 ARG HDy H 1 3.228 0.000 A 28 ARG HDx H 1 3.021 0.000 A 28 ARG HE H 1 7.192 0.000 A 28 ARG HGy H 1 1.679 0.000 A 28 ARG HGx H 1 1.533 0.000 A 28 ARG HH1x H 1 6.516 0.000 A 28 ARG C C 13 174.481 0.000 A 28 ARG CA C 13 53.833 0.000 A 28 ARG CB C 13 28.603 0.000 A 28 ARG CD C 13 40.432 0.000 A 28 ARG CG C 13 26.911 0.000 A 28 ARG N N 15 123.114 0.000 A 28 ARG NE N 15 85.489 0.000 A 28 ARG NHx N 15 71.183 0.000 A 29 LEU H H 1 8.329 0.000 A 29 LEU HA H 1 4.982 0.000 A 29 LEU HBy H 1 1.490 0.000 A 29 LEU HBx H 1 0.596 0.000 A 29 LEU HDx% H 1 0.459 0.000 A 29 LEU HDy% H 1 0.561 0.000 A 29 LEU HG H 1 1.235 0.000 A 29 LEU C C 13 174.925 0.000 A 29 LEU CA C 13 50.185 0.000 A 29 LEU CB C 13 37.792 0.000 A 29 LEU CDy C 13 23.112 0.000 A 29 LEU CDx C 13 21.239 0.000 A 29 LEU CG C 13 24.347 0.000 A 29 LEU N N 15 120.619 0.000 A 30 CYS H H 1 8.786 0.000 A 30 CYS HA H 1 5.287 0.000 A 30 CYS HBy H 1 3.146 0.000 A 30 CYS HBx H 1 2.499 0.000 A 30 CYS C C 13 174.646 0.000 A 30 CYS CA C 13 50.276 0.000 A 30 CYS CB C 13 39.605 0.000 A 30 CYS N N 15 125.083 0.000 A 31 CYS H H 1 8.954 0.000 A 31 CYS HA H 1 5.666 0.000 A 31 CYS HBy H 1 2.975 0.000 A 31 CYS HBx H 1 2.892 0.000 A 31 CYS C C 13 174.011 0.000 A 31 CYS CA C 13 53.018 0.000 A 31 CYS CB C 13 46.072 0.000 A 31 CYS N N 15 120.846 0.000 A 32 ARG H H 1 9.060 0.000 A 32 ARG HA H 1 4.667 0.000 A 32 ARG HBx H 1 1.847 0.000 A 32 ARG HBy H 1 1.847 0.000 A 32 ARG HDx H 1 3.313 0.000 A 32 ARG HDy H 1 3.313 0.000 A 32 ARG HE H 1 7.306 0.000 A 32 ARG HGy H 1 2.044 0.000 A 32 ARG HGx H 1 2.018 0.000 A 32 ARG C C 13 177.980 0.000 A 32 ARG CA C 13 52.863 0.000 A 32 ARG CB C 13 24.729 0.000 A 32 ARG CD C 13 40.575 0.000 A 32 ARG CG C 13 28.933 0.000 A 32 ARG N N 15 123.114 0.000 A 32 ARG NE N 15 84.346 0.000 stop_ save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _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 TYR HA A 4 TYR HD% 1.0 . 3.94 2 2 A 4 TYR HD% A 4 TYR H 1.0 . 4.02 3 3 A 4 TYR HD% A 5 CYS H 1.0 . 4.73 4 4 A 4 TYR HE% A 6 ARG HGx 1.0 . 3.59 5 4 A 4 TYR HE% A 6 ARG HGy 1.0 . 3.59 6 5 A 4 TYR HE% A 6 ARG HBx 1.0 . 4.12 7 6 A 4 TYR HE% A 6 ARG HDx 1.0 . 5.28 8 6 A 4 TYR HE% A 6 ARG HDy 1.0 . 5.28 9 7 A 27 TYR H A 27 TYR HD% 1.0 . 3.78 10 8 A 27 TYR HD% A 25 ARG HDx 1.0 . 4.60 11 8 A 27 TYR HD% A 25 ARG HDy 1.0 . 4.60 12 9 A 27 TYR HD% A 22 ILE HB 1.0 . 4.06 13 10 A 27 TYR HD% A 7 THR HG2% 1.0 . 3.84 14 11 A 7 THR HG2% A 27 TYR HE% 1.0 . 3.53 15 12 A 27 TYR HD% A 28 ARG H 1.0 . 4.81 16 13 A 22 ILE HB A 27 TYR HE% 1.0 . 3.62 17 14 A 27 TYR HE% A 25 ARG H 1.0 . 4.78 18 15 A 27 TYR HE% A 22 ILE H 1.0 . 4.49 19 16 A 6 ARG HA A 6 ARG HGx 1.0 . 3.61 20 16 A 6 ARG HGy A 6 ARG HA 1.0 . 3.61 21 17 A 6 ARG HBy A 6 ARG HDx 1.0 . 3.76 22 17 A 6 ARG HDy A 6 ARG HBy 1.0 . 3.76 23 18 A 9 ARG HA A 13 ARG HDx 1.0 . 3.86 24 18 A 9 ARG HA A 13 ARG HDy 1.0 . 3.86 25 19 A 9 ARG HBy A 9 ARG HGx 1.0 . 2.90 26 19 A 9 ARG HBy A 9 ARG HGy 1.0 . 2.90 27 20 A 9 ARG HA A 9 ARG HGx 1.0 . 3.28 28 20 A 9 ARG HA A 9 ARG HGy 1.0 . 3.28 29 21 A 9 ARG HDx A 9 ARG HGx 1.0 . 2.87 30 21 A 9 ARG HDy A 9 ARG HGx 1.0 . 2.87 31 21 A 9 ARG HGy A 9 ARG HDx 1.0 . 2.87 32 21 A 9 ARG HGy A 9 ARG HDy 1.0 . 2.87 33 22 A 9 ARG HBy A 9 ARG HDx 1.0 . 3.54 34 22 A 9 ARG HBy A 9 ARG HDy 1.0 . 3.54 35 23 A 19 VAL HA A 19 VAL HGx% 1.0 . 3.53 36 24 A 22 ILE HB A 22 ILE HD1% 1.0 . 3.37 37 25 A 22 ILE HA A 22 ILE HG1y 1.0 . 3.99 38 26 A 22 ILE HA A 22 ILE HG1x 1.0 . 3.80 39 27 A 22 ILE HD1% A 22 ILE HA 1.0 . 4.09 40 28 A 25 ARG HA A 25 ARG HGx 1.0 . 3.95 41 29 A 25 ARG HA A 25 ARG HDx 1.0 . 4.31 42 29 A 25 ARG HDy A 25 ARG HA 1.0 . 4.31 43 30 A 25 ARG HBy A 25 ARG HDx 1.0 . 3.82 44 30 A 25 ARG HDy A 25 ARG HBy 1.0 . 3.82 45 31 A 25 ARG HA A 25 ARG HGy 1.0 . 3.48 46 32 A 26 LEU HA A 26 LEU HG 1.0 . 4.20 47 33 A 26 LEU HA A 26 LEU HDy% 1.0 . 3.62 48 34 A 26 LEU HDy% A 26 LEU HBx 1.0 . 3.29 49 34 A 26 LEU HDy% A 26 LEU HBy 1.0 . 3.29 50 35 A 28 ARG HA A 28 ARG HDy 1.0 . 4.53 51 36 A 28 ARG HDy A 28 ARG HBx 1.0 . 3.18 52 36 A 28 ARG HDy A 28 ARG HBy 1.0 . 3.18 53 37 A 28 ARG HA A 28 ARG HGy 1.0 . 3.37 54 38 A 28 ARG HA A 28 ARG HDx 1.0 . 4.90 55 39 A 28 ARG HDx A 28 ARG HBx 1.0 . 3.62 56 39 A 28 ARG HBy A 28 ARG HDx 1.0 . 3.62 57 40 A 4 TYR H A 3 CYS HA 1.0 . 3.56 58 41 A 3 CYS HBy B 117 SER HBx 1.0 . 5.07 59 42 A 3 CYS HBy A 3 CYS H 1.0 . 4.16 60 43 A 4 TYR H A 3 CYS HBx 1.0 . 3.90 61 44 A 3 CYS HBx A 31 CYS HA 1.0 . 4.68 62 45 A 3 CYS HBx B 129 LEU HD11 1.0 . 3.49 63 46 A 3 CYS HBx B 129 LEU HBx 1.0 . 5.10 64 47 A 4 TYR HA A 5 CYS H 1.0 . 3.41 65 48 A 5 CYS H A 4 TYR HBy 1.0 . 3.68 66 49 A 7 THR HG2% A 7 THR HA 1.0 . 3.32 67 50 A 7 THR HG2% A 25 ARG HDx 1.0 . 4.10 68 50 A 25 ARG HDy A 7 THR HG2% 1.0 . 4.10 69 51 A 7 THR HG2% A 7 THR H 1.0 . 3.63 70 52 A 7 THR HB A 8 GLY H 1.0 . 4.57 71 53 A 27 TYR HD% A 7 THR HA 1.0 . 4.80 72 54 A 28 ARG H A 7 THR HA 1.0 . 4.18 73 55 A 1 ALA HB% A 2 THR H 1.0 . 3.57 74 56 A 1 ALA HB% B 116 LEU HA 1.0 . 5.50 75 57 B 117 SER HBx A 1 ALA HB% 1.0 . 4.09 76 58 A 1 ALA HB% A 2 THR HA 1.0 . 4.71 77 59 A 2 THR HA A 32 ARG H 1.0 . 4.88 78 60 A 2 THR HA A 32 ARG HDx 1.0 . 5.41 79 60 A 2 THR HA A 32 ARG HDy 1.0 . 5.41 80 61 A 2 THR HB A 32 ARG HGy 1.0 . 4.81 81 62 A 2 THR H A 2 THR HB 1.0 . 3.71 82 63 A 2 THR HA A 2 THR HG2% 1.0 . 3.32 83 64 A 32 ARG H A 2 THR HG2% 1.0 . 5.25 84 65 A 5 CYS H A 5 CYS HBy 1.0 . 3.80 85 66 A 5 CYS HBx A 6 ARG H 1.0 . 4.27 86 67 A 5 CYS HBx A 27 TYR HBx 1.0 . 4.55 87 68 A 6 ARG HBx A 8 GLY H 1.0 . 4.16 88 69 A 6 ARG HBx A 6 ARG HDx 1.0 . 3.58 89 69 A 6 ARG HBx A 6 ARG HDy 1.0 . 3.58 90 70 A 6 ARG H A 6 ARG HDx 1.0 . 5.05 91 70 A 6 ARG HDy A 6 ARG H 1.0 . 5.05 92 71 A 6 ARG HA A 8 GLY H 1.0 . 4.38 93 72 A 8 GLY HAy A 9 ARG HGx 1.0 . 4.77 94 72 A 9 ARG HGy A 8 GLY HAy 1.0 . 4.77 95 73 A 6 ARG HBy A 8 GLY HAy 1.0 . 5.28 96 74 A 8 GLY HAx A 9 ARG HGx 1.0 . 4.99 97 74 A 9 ARG HGy A 8 GLY HAx 1.0 . 4.99 98 75 A 8 GLY HAx A 9 ARG H 1.0 . 3.31 99 76 A 9 ARG HBx A 9 ARG HDx 1.0 . 3.14 100 76 A 9 ARG HDy A 9 ARG HBx 1.0 . 3.14 101 77 A 9 ARG HBx A 9 ARG HGx 1.0 . 2.40 102 77 A 9 ARG HGy A 9 ARG HBx 1.0 . 2.40 103 78 A 9 ARG HA A 8 GLY HAx 1.0 . 4.73 104 79 A 9 ARG HA A 10 CYS HBx 1.0 . 4.84 105 80 A 9 ARG HA A 28 ARG HH1x 1.0 . 4.96 106 81 A 9 ARG HA A 10 CYS H 1.0 . 3.01 107 82 A 9 ARG HBy A 9 ARG H 1.0 . 3.74 108 83 A 6 ARG H A 28 ARG HBx 1.0 . 3.74 109 83 A 28 ARG HBy A 6 ARG H 1.0 . 3.74 110 84 A 9 ARG HBx A 10 CYS H 1.0 . 3.69 111 85 A 9 ARG H A 9 ARG HGx 1.0 . 3.57 112 85 A 9 ARG HGy A 9 ARG H 1.0 . 3.57 113 86 A 10 CYS H A 9 ARG HGx 1.0 . 4.23 114 86 A 9 ARG HGy A 10 CYS H 1.0 . 4.23 115 87 A 17 SER HA B 103 CYS H 1.0 . 5.22 116 88 A 17 SER HBy A 18 GLY H 1.0 . 5.42 117 89 A 17 SER H A 17 SER HBx 1.0 . 4.08 118 90 B 103 CYS H A 17 SER HBx 1.0 . 5.24 119 91 A 17 SER HBx B 101 ALA HB1 1.0 . 4.82 120 92 A 17 SER H A 16 LEU HBx 1.0 . 4.74 121 93 A 16 LEU HBx A 16 LEU HDx% 1.0 . 3.08 122 94 A 16 LEU HA A 16 LEU HG 1.0 . 3.39 123 95 A 28 ARG HA A 16 LEU HG 1.0 . 3.90 124 96 A 16 LEU HBx A 16 LEU HG 1.0 . 2.98 125 97 A 16 LEU HDx% A 16 LEU HA 1.0 . 4.64 126 98 A 28 ARG HDx A 16 LEU HDx% 1.0 . 4.58 127 99 A 16 LEU HDx% A 16 LEU HBy 1.0 . 3.25 128 100 A 18 GLY H A 16 LEU HDx% 1.0 . 4.71 129 101 A 17 SER H A 16 LEU HDx% 1.0 . 4.82 130 102 A 16 LEU HG A 28 ARG HE 1.0 . 4.84 131 103 A 16 LEU HG A 29 LEU H 1.0 . 3.70 132 104 A 17 SER H A 16 LEU HG 1.0 . 3.65 133 105 A 18 GLY HAy A 19 VAL H 1.0 . 3.54 134 106 B 103 CYS H A 18 GLY HAx 1.0 . 3.72 135 107 A 18 GLY HAx A 29 LEU HDx% 1.0 . 4.25 136 108 A 19 VAL HA A 28 ARG HA 1.0 . 3.56 137 109 A 19 VAL HA A 27 TYR HBy 1.0 . 5.29 138 110 A 19 VAL HA A 28 ARG HBx 1.0 . 4.67 139 110 A 19 VAL HA A 28 ARG HBy 1.0 . 4.67 140 111 A 19 VAL HA A 29 LEU HBy 1.0 . 4.68 141 112 A 19 VAL HA A 29 LEU HDy% 1.0 . 4.38 142 113 A 19 VAL HA A 20 CYS H 1.0 . 3.05 143 114 A 19 VAL HGx% A 19 VAL H 1.0 . 3.77 144 115 A 20 CYS H A 19 VAL HB 1.0 . 3.63 145 116 A 28 ARG HA A 19 VAL HB 1.0 . 5.36 146 117 A 26 LEU HG A 19 VAL HB 1.0 . 4.72 147 118 A 20 CYS H A 19 VAL HGy% 1.0 . 4.23 148 119 A 28 ARG HA A 19 VAL HGy% 1.0 . 4.58 149 120 A 19 VAL HA A 19 VAL HGy% 1.0 . 4.14 150 121 A 19 VAL H A 19 VAL HGy% 1.0 . 3.55 151 122 A 20 CYS HBy A 21 GLU H 1.0 . 4.52 152 123 A 20 CYS H A 20 CYS HBy 1.0 . 4.06 153 124 A 22 ILE HD1% A 20 CYS HBx 1.0 . 3.63 154 125 A 20 CYS H A 20 CYS HBx 1.0 . 3.83 155 126 A 21 GLU H A 20 CYS HA 1.0 . 3.20 156 127 A 22 ILE HG1y A 20 CYS HBx 1.0 . 4.67 157 128 A 22 ILE HG1y A 20 CYS HBy 1.0 . 4.73 158 129 A 22 ILE HG1x A 20 CYS HBx 1.0 . 4.05 159 130 A 22 ILE HG1x A 20 CYS HBy 1.0 . 5.15 160 131 A 22 ILE HD1% A 20 CYS HBy 1.0 . 4.05 161 132 A 22 ILE H A 22 ILE HD1% 1.0 . 4.45 162 133 A 22 ILE HG1x A 23 SER H 1.0 . 5.32 163 134 A 22 ILE HB A 22 ILE H 1.0 . 3.86 164 135 A 22 ILE HB A 23 SER H 1.0 . 4.38 165 136 A 22 ILE HD1% A 22 ILE HG2% 1.0 . 2.90 166 137 A 22 ILE HD1% B 127 TYR HD% 1.0 . 3.81 167 138 A 27 TYR HD% A 22 ILE HG1x 1.0 . 4.83 168 139 A 27 TYR HD% A 22 ILE HG1y 1.0 . 4.75 169 140 A 22 ILE HG1y A 22 ILE HG2% 1.0 . 3.31 170 141 A 22 ILE HG1x A 22 ILE HG2% 1.0 . 3.24 171 142 A 22 ILE HA A 22 ILE HG2% 1.0 . 3.15 172 143 A 20 CYS HBx A 22 ILE HG2% 1.0 . 5.04 173 144 A 22 ILE HG2% B 125 ARG HDx 1.0 . 4.92 174 144 A 22 ILE HG2% B 125 ARG HDy 1.0 . 4.92 175 145 A 22 ILE HG2% B 127 TYR HD% 1.0 . 4.13 176 146 A 25 ARG H A 22 ILE HG2% 1.0 . 5.12 177 147 A 26 LEU HDy% A 21 GLU HA 1.0 . 4.30 178 148 A 21 GLU HGy A 24 GLY H 1.0 . 4.67 179 149 A 27 TYR HD% A 21 GLU HA 1.0 . 5.01 180 150 A 22 ILE H A 21 GLU HA 1.0 . 3.11 181 151 A 22 ILE HG2% A 23 SER HA 1.0 . 4.71 182 152 A 24 GLY H A 23 SER HBy 1.0 . 5.27 183 153 A 23 SER H A 23 SER HBx 1.0 . 4.05 184 154 A 22 ILE HG2% A 23 SER HBy 1.0 . 4.42 185 155 A 22 ILE HG2% A 23 SER HBx 1.0 . 3.61 186 156 A 25 ARG HBy A 26 LEU H 1.0 . 4.53 187 157 A 25 ARG HA A 26 LEU H 1.0 . 2.89 188 158 A 25 ARG HBx A 25 ARG HDx 1.0 . 4.18 189 158 A 25 ARG HDy A 25 ARG HBx 1.0 . 4.18 190 159 A 26 LEU H A 25 ARG HBx 1.0 . 4.32 191 160 A 25 ARG HGy A 25 ARG HBx 1.0 . 2.45 192 161 A 26 LEU H A 25 ARG HDx 1.0 . 4.95 193 161 A 25 ARG HDy A 26 LEU H 1.0 . 4.95 194 162 A 21 GLU HA A 26 LEU HBx 1.0 . 4.83 195 162 A 26 LEU HBy A 21 GLU HA 1.0 . 4.83 196 163 A 26 LEU H A 26 LEU HBx 1.0 . 3.13 197 163 A 26 LEU HBy A 26 LEU H 1.0 . 3.13 198 164 A 27 TYR H A 26 LEU HA 1.0 . 3.15 199 165 A 22 ILE H A 26 LEU HA 1.0 . 4.38 200 166 A 27 TYR HD% A 26 LEU HA 1.0 . 4.67 201 167 A 26 LEU HG A 26 LEU H 1.0 . 4.66 202 168 A 27 TYR H A 26 LEU HG 1.0 . 4.80 203 169 A 26 LEU HA A 26 LEU HDx% 1.0 . 4.08 204 170 A 21 GLU HA A 26 LEU HDx% 1.0 . 4.55 205 171 A 26 LEU H A 26 LEU HDx% 1.0 . 4.84 206 172 A 20 CYS H A 26 LEU HDx% 1.0 . 5.06 207 173 A 27 TYR H A 26 LEU HDx% 1.0 . 4.66 208 174 A 26 LEU HDx% A 21 GLU HBx 1.0 . 4.03 209 175 A 19 VAL HB A 26 LEU HDx% 1.0 . 4.17 210 176 A 26 LEU HDx% A 26 LEU HBx 1.0 . 3.17 211 176 A 26 LEU HBy A 26 LEU HDx% 1.0 . 3.17 212 177 A 27 TYR HD% A 27 TYR HA 1.0 . 4.10 213 178 A 28 ARG H A 27 TYR HA 1.0 . 3.12 214 179 A 7 THR HG2% A 27 TYR HA 1.0 . 4.78 215 180 A 22 ILE HG1x A 27 TYR HBy 1.0 . 4.94 216 181 A 22 ILE HD1% A 27 TYR HBy 1.0 . 4.76 217 182 A 27 TYR HBy A 20 CYS H 1.0 . 4.51 218 183 A 6 ARG H A 27 TYR HBx 1.0 . 4.82 219 184 A 28 ARG H A 27 TYR HBx 1.0 . 4.17 220 185 A 22 ILE HG1x A 27 TYR HBx 1.0 . 4.77 221 186 A 22 ILE HD1% A 27 TYR HBx 1.0 . 4.71 222 187 A 5 CYS HBy A 27 TYR HBx 1.0 . 4.39 223 188 A 28 ARG HGy A 29 LEU H 1.0 . 5.01 224 189 A 28 ARG H A 28 ARG HGy 1.0 . 4.17 225 190 A 28 ARG HA A 28 ARG HGx 1.0 . 3.82 226 191 A 28 ARG HGx A 28 ARG HBx 1.0 . 2.86 227 191 A 28 ARG HBy A 28 ARG HGx 1.0 . 2.86 228 192 A 28 ARG HGy A 16 LEU HDx% 1.0 . 4.54 229 193 A 28 ARG HGy A 16 LEU HG 1.0 . 4.12 230 194 A 16 LEU HDx% A 28 ARG HGx 1.0 . 4.40 231 195 A 29 LEU H A 28 ARG HGx 1.0 . 5.04 232 196 A 28 ARG H A 28 ARG HGx 1.0 . 4.20 233 197 A 28 ARG H A 28 ARG HDy 1.0 . 4.86 234 198 A 28 ARG HA A 29 LEU HG 1.0 . 4.70 235 199 A 16 LEU HG A 28 ARG HBx 1.0 . 3.01 236 199 A 28 ARG HBy A 16 LEU HG 1.0 . 3.01 237 200 A 16 LEU HDx% A 28 ARG HBx 1.0 . 4.76 238 200 A 28 ARG HBy A 16 LEU HDx% 1.0 . 4.76 239 201 A 28 ARG HDx A 16 LEU HG 1.0 . 3.82 240 202 A 29 LEU HA A 30 CYS H 1.0 . 3.21 241 203 A 29 LEU HA A 5 CYS HA 1.0 . 4.23 242 204 A 29 LEU H A 29 LEU HG 1.0 . 3.80 243 205 A 19 VAL HA A 29 LEU HG 1.0 . 4.12 244 206 A 29 LEU HDy% B 105 CYS H 1.0 . 4.40 245 207 A 29 LEU HDx% B 105 CYS H 1.0 . 4.31 246 208 A 29 LEU HDx% B 104 TYR H 1.0 . 4.61 247 209 A 19 VAL HA A 29 LEU HDx% 1.0 . 4.77 248 210 A 29 LEU HDx% B 103 CYS HA 1.0 . 4.93 249 211 A 29 LEU HDx% B 104 TYR HA 1.0 . 4.02 250 212 A 29 LEU HDx% A 29 LEU HBy 1.0 . 3.38 251 213 A 29 LEU HDx% B 105 CYS HBy 1.0 . 3.94 252 214 A 18 GLY HAy A 29 LEU HBy 1.0 . 4.77 253 215 A 18 GLY HAx A 29 LEU HBy 1.0 . 4.81 254 216 A 17 SER HBx A 29 LEU HBy 1.0 . 5.09 255 217 A 18 GLY H A 29 LEU HBy 1.0 . 4.05 256 218 A 29 LEU HBy A 30 CYS H 1.0 . 4.93 257 219 A 17 SER H A 29 LEU HBy 1.0 . 4.25 258 220 A 29 LEU HDx% A 29 LEU HA 1.0 . 4.11 259 221 A 29 LEU HBy A 29 LEU HDy% 1.0 . 3.28 260 222 A 16 LEU HA A 30 CYS HA 1.0 . 4.02 261 223 A 17 SER HBx A 30 CYS HA 1.0 . 5.22 262 224 A 30 CYS HA A 31 CYS H 1.0 . 3.38 263 225 A 3 CYS HBy A 31 CYS HA 1.0 . 5.19 264 226 A 3 CYS HA A 31 CYS HA 1.0 . 3.40 265 227 A 4 TYR H A 31 CYS HA 1.0 . 4.19 266 228 A 32 ARG H A 31 CYS HBy 1.0 . 4.48 267 229 A 32 ARG H A 31 CYS HBx 1.0 . 4.33 268 230 A 10 CYS H A 13 ARG HA 1.0 . 3.91 269 231 A 9 ARG H A 9 ARG HDx 1.0 . 4.51 270 231 A 9 ARG HDy A 9 ARG H 1.0 . 4.51 271 232 A 21 GLU H A 21 GLU HBx 1.0 . 3.78 272 233 A 2 THR HB A 32 ARG HBx 1.0 . 4.54 273 233 A 2 THR HB A 32 ARG HBy 1.0 . 4.54 274 234 A 32 ARG HGx A 32 ARG HBx 1.0 . 2.95 275 234 A 32 ARG HBy A 32 ARG HGx 1.0 . 2.95 276 235 A 32 ARG HGy A 32 ARG HBx 1.0 . 2.77 277 235 A 32 ARG HGy A 32 ARG HBy 1.0 . 2.77 278 236 A 32 ARG HGy A 32 ARG HA 1.0 . 3.86 279 237 A 32 ARG H A 32 ARG HGy 1.0 . 4.28 280 238 A 26 LEU HA A 21 GLU HBy 1.0 . 4.62 281 239 A 26 LEU HA A 21 GLU HGy 1.0 . 4.91 282 240 A 26 LEU HA A 21 GLU HBx 1.0 . 4.88 283 241 A 28 ARG HA A 29 LEU HDy% 1.0 . 4.56 284 242 A 13 ARG HA A 13 ARG HGx 1.0 . 3.59 285 242 A 13 ARG HA A 13 ARG HGy 1.0 . 3.59 286 243 A 10 CYS H A 13 ARG HBx 1.0 . 5.02 287 243 A 10 CYS H A 13 ARG HBy 1.0 . 5.02 288 244 A 10 CYS H A 13 ARG HGx 1.0 . 4.62 289 244 A 10 CYS H A 13 ARG HGy 1.0 . 4.62 290 245 A 9 ARG HA A 28 ARG HDx 1.0 . 4.35 291 246 A 9 ARG HA A 28 ARG HDy 1.0 . 3.80 292 247 A 13 ARG HBx A 13 ARG HDx 1.0 . 3.39 293 247 A 13 ARG HBy A 13 ARG HDx 1.0 . 3.39 294 247 A 13 ARG HDy A 13 ARG HBx 1.0 . 3.39 295 247 A 13 ARG HDy A 13 ARG HBy 1.0 . 3.39 296 248 A 13 ARG HA A 13 ARG HDx 1.0 . 3.75 297 248 A 13 ARG HDy A 13 ARG HA 1.0 . 3.75 298 249 A 10 CYS HBx A 10 CYS H 1.0 . 3.55 299 250 A 10 CYS H A 10 CYS HBy 1.0 . 4.05 300 251 A 7 THR HG2% A 6 ARG HA 1.0 . 4.78 301 252 A 28 ARG HE A 28 ARG HBx 1.0 . 4.27 302 252 A 28 ARG HBy A 28 ARG HE 1.0 . 4.27 303 253 A 32 ARG HBx A 32 ARG HDx 1.0 . 3.42 304 253 A 32 ARG HDy A 32 ARG HBx 1.0 . 3.42 305 253 A 32 ARG HDy A 32 ARG HBy 1.0 . 3.42 306 253 A 32 ARG HBy A 32 ARG HDx 1.0 . 3.42 307 254 A 32 ARG HA A 32 ARG HDx 1.0 . 4.61 308 254 A 32 ARG HDy A 32 ARG HA 1.0 . 4.61 309 255 A 21 GLU HGy A 24 GLY HAx 1.0 . 5.50 310 256 A 26 LEU HA A 21 GLU HGx 1.0 . 5.50 311 257 A 26 LEU HDx% A 21 GLU HGx 1.0 . 4.36 312 258 A 10 CYS HBy A 30 CYS HBy 1.0 . 4.83 313 259 A 10 CYS HBy A 30 CYS HBx 1.0 . 5.49 314 260 A 10 CYS HBx A 30 CYS HBx 1.0 . 5.50 315 261 A 19 VAL HGx% A 28 ARG HDx 1.0 . 4.73 316 262 A 19 VAL HGx% A 28 ARG HDy 1.0 . 5.28 317 263 A 17 SER HBx B 103 CYS HBx 1.0 . 5.22 318 264 A 27 TYR HBx A 5 CYS HA 1.0 . 5.40 319 265 A 5 CYS HA A 28 ARG HBx 1.0 . 5.20 320 265 A 28 ARG HBy A 5 CYS HA 1.0 . 5.20 321 266 A 25 ARG HBx A 25 ARG HE 1.0 . 4.53 322 267 A 25 ARG HBy A 25 ARG HE 1.0 . 4.93 323 268 A 29 LEU HDy% A 29 LEU HBx 1.0 . 2.40 324 269 A 29 LEU HDx% A 29 LEU HBx 1.0 . 2.86 325 270 B 103 CYS HBx A 29 LEU HBx 1.0 . 5.16 326 271 A 29 LEU HBx B 103 CYS HBy 1.0 . 5.19 327 272 A 30 CYS H A 29 LEU HBx 1.0 . 4.26 328 273 A 16 LEU HG A 30 CYS HA 1.0 . 5.42 329 274 A 2 THR H A 2 THR HG2% 1.0 . 4.16 330 275 A 18 GLY H A 17 SER HBx 1.0 . 4.80 331 276 A 17 SER H A 16 LEU HBy 1.0 . 5.10 332 277 A 29 LEU HDy% B 104 TYR H 1.0 . 4.93 333 278 A 31 CYS H A 15 SER HBx 1.0 . 4.87 334 278 A 31 CYS H A 15 SER HBy 1.0 . 4.87 335 279 A 1 ALA HB% B 131 CYS HBy 1.0 . 4.00 336 280 A 16 LEU HA A 16 LEU HDy% 1.0 . 4.32 337 281 A 30 CYS HBx A 6 ARG HGx 1.0 . 4.55 338 281 A 6 ARG HGy A 30 CYS HBx 1.0 . 4.55 339 282 A 16 LEU HBy A 16 LEU HDy% 1.0 . 3.47 340 283 A 16 LEU HBx A 16 LEU HDy% 1.0 . 2.46 341 284 A 29 LEU HDy% A 5 CYS HA 1.0 . 3.49 342 285 A 29 LEU HDy% A 29 LEU HA 1.0 . 3.07 343 286 A 27 TYR HBx A 29 LEU HDy% 1.0 . 4.07 344 287 A 6 ARG H A 29 LEU HDy% 1.0 . 4.10 345 288 A 27 TYR HD% A 5 CYS HBy 1.0 . 4.56 346 289 A 27 TYR HD% A 5 CYS HBx 1.0 . 4.46 347 290 A 27 TYR HD% A 6 ARG HA 1.0 . 4.81 348 291 A 3 CYS HA A 31 CYS HBy 1.0 . 5.16 349 292 A 3 CYS HA A 31 CYS HBx 1.0 . 4.78 350 293 A 29 LEU HBy B 103 CYS HBx 1.0 . 5.03 351 294 A 18 GLY HAy A 29 LEU HDx% 1.0 . 3.86 352 295 A 6 ARG H A 29 LEU HA 1.0 . 4.79 353 296 A 28 ARG HDy A 16 LEU HG 1.0 . 4.36 354 297 A 4 TYR HD% A 2 THR HG2% 1.0 . 4.85 355 298 A 4 TYR HE% A 2 THR HG2% 1.0 . 3.90 356 299 A 4 TYR HD% A 3 CYS HA 1.0 . 4.48 357 300 A 4 TYR HE% A 32 ARG HBx 1.0 . 4.50 358 300 A 4 TYR HE% A 32 ARG HBy 1.0 . 4.50 359 301 A 18 GLY HAy A 29 LEU HBx 1.0 . 5.50 360 302 A 29 LEU HDy% B 104 TYR HA 1.0 . 5.20 361 303 A 27 TYR HE% A 25 ARG HBy 1.0 . 4.12 362 304 A 27 TYR HE% A 25 ARG HBx 1.0 . 4.37 363 305 A 27 TYR HE% A 25 ARG HDx 1.0 . 4.36 364 305 A 25 ARG HDy A 27 TYR HE% 1.0 . 4.36 365 306 A 18 GLY H A 16 LEU HDy% 1.0 . 3.77 366 307 A 16 LEU HG A 28 ARG HGx 1.0 . 4.09 367 308 A 28 ARG HGy A 28 ARG HBx 1.0 . 2.60 368 308 A 28 ARG HBy A 28 ARG HGy 1.0 . 2.60 369 309 A 10 CYS H A 12 THR HG2% 1.0 . 4.48 370 310 A 28 ARG HDy A 16 LEU HDx% 1.0 . 4.78 371 311 A 19 VAL HGx% A 28 ARG HA 1.0 . 3.64 372 312 A 27 TYR H A 19 VAL HGx% 1.0 . 4.86 373 313 A 27 TYR HBx A 20 CYS HBx 1.0 . 4.78 374 314 A 26 LEU HA A 21 GLU HA 1.0 . 3.59 375 315 A 27 TYR HE% A 22 ILE HG1x 1.0 . 5.08 376 316 A 28 ARG HH1x A 26 LEU HDx% 1.0 . 4.39 377 317 A 4 TYR HE% A 32 ARG HDx 1.0 . 4.50 378 317 A 4 TYR HE% A 32 ARG HDy 1.0 . 4.50 379 318 A 21 GLU H A 21 GLU HGx 1.0 . 5.00 380 319 A 20 CYS HBy B 127 TYR HD% 1.0 . 5.50 381 320 A 10 CYS HBx A 30 CYS HBy 1.0 . 4.65 382 321 A 2 THR HG2% A 32 ARG HBx 1.0 . 4.73 383 321 A 2 THR HG2% A 32 ARG HBy 1.0 . 4.73 384 322 A 19 VAL HGx% A 26 LEU HBx 1.0 . 4.46 385 322 A 19 VAL HGx% A 26 LEU HBy 1.0 . 4.46 386 323 A 19 VAL HGx% A 26 LEU HG 1.0 . 4.41 387 324 A 26 LEU HDy% A 21 GLU HGy 1.0 . 4.63 388 325 A 26 LEU HDy% A 21 GLU HGx 1.0 . 4.09 389 326 A 19 VAL HB A 26 LEU HBx 1.0 . 5.34 390 326 A 26 LEU HBy A 19 VAL HB 1.0 . 5.34 391 327 A 21 GLU HBy A 21 GLU HGx 1.0 . 2.57 392 328 A 21 GLU HGy A 26 LEU HDx% 1.0 . 4.69 393 329 A 26 LEU HDy% A 21 GLU HBx 1.0 . 4.01 394 330 A 20 CYS HBx B 127 TYR HD% 1.0 . 5.07 395 331 A 25 ARG H A 21 GLU HA 1.0 . 4.79 396 332 A 22 ILE H A 26 LEU HDy% 1.0 . 5.03 397 333 A 2 THR HG2% A 32 ARG HDx 1.0 . 4.61 398 333 A 32 ARG HDy A 2 THR HG2% 1.0 . 4.61 399 334 A 5 CYS HBx A 29 LEU HDy% 1.0 . 3.25 400 335 A 22 ILE H A 22 ILE HG1x 1.0 . 4.78 401 336 A 8 GLY HAy A 28 ARG HH1x 1.0 . 5.23 402 337 A 28 ARG HH1x A 28 ARG HBx 1.0 . 5.50 403 337 A 28 ARG HBy A 28 ARG HH1x 1.0 . 5.50 404 338 A 2 THR H A 32 ARG H 1.0 . 4.42 405 339 A 31 CYS HA A 2 THR H 1.0 . 5.50 406 340 A 2 THR H B 117 SER HA 1.0 . 5.50 407 341 A 2 THR H A 1 ALA HA 1.0 . 3.25 408 342 A 2 THR H A 32 ARG HDx 1.0 . 5.50 409 342 A 2 THR H A 32 ARG HDy 1.0 . 5.50 410 343 A 2 THR H A 32 ARG HGy 1.0 . 5.43 411 344 B 117 SER HBx A 3 CYS H 1.0 . 4.40 412 345 A 3 CYS H A 2 THR HA 1.0 . 3.25 413 346 A 3 CYS H B 118 GLY HAx 1.0 . 4.85 414 347 A 3 CYS H A 2 THR HG2% 1.0 . 3.76 415 348 A 3 CYS H A 1 ALA HB% 1.0 . 4.89 416 349 A 2 THR H A 32 ARG HBx 1.0 . 5.33 417 349 A 2 THR H A 32 ARG HBy 1.0 . 5.33 418 350 A 5 CYS H A 5 CYS HBx 1.0 . 4.16 419 351 A 5 CYS H A 4 TYR HBx 1.0 . 4.34 420 352 A 4 TYR H A 3 CYS H 1.0 . 5.30 421 353 A 4 TYR H A 5 CYS H 1.0 . 5.20 422 354 A 4 TYR H A 4 TYR HE% 1.0 . 5.50 423 355 A 4 TYR H A 29 LEU HA 1.0 . 5.38 424 356 A 4 TYR H A 4 TYR HBx 1.0 . 4.10 425 357 A 4 TYR H A 3 CYS HBy 1.0 . 4.33 426 358 A 18 GLY H A 17 SER H 1.0 . 3.45 427 359 A 18 GLY H A 16 LEU HA 1.0 . 4.20 428 360 A 18 GLY H A 29 LEU HDx% 1.0 . 4.94 429 361 A 18 GLY H A 29 LEU HBx 1.0 . 4.59 430 362 A 18 GLY H A 29 LEU HG 1.0 . 5.11 431 363 A 18 GLY H A 19 VAL H 1.0 . 5.01 432 364 A 19 VAL H A 18 GLY HAx 1.0 . 3.49 433 365 A 19 VAL H A 29 LEU HBy 1.0 . 5.22 434 366 A 19 VAL H A 29 LEU HG 1.0 . 5.39 435 367 A 19 VAL H A 29 LEU HDy% 1.0 . 5.50 436 368 A 3 CYS H A 31 CYS HA 1.0 . 5.38 437 369 A 3 CYS H A 32 ARG H 1.0 . 5.50 438 370 A 5 CYS H A 6 ARG H 1.0 . 5.24 439 371 A 6 ARG H A 30 CYS H 1.0 . 5.43 440 372 A 6 ARG H A 5 CYS HA 1.0 . 3.25 441 373 A 5 CYS HBy A 6 ARG H 1.0 . 4.47 442 374 A 6 ARG H A 6 ARG HGx 1.0 . 3.96 443 374 A 6 ARG HGy A 6 ARG H 1.0 . 3.96 444 375 A 6 ARG HA A 7 THR H 1.0 . 3.09 445 376 A 7 THR H A 6 ARG HGx 1.0 . 4.39 446 376 A 6 ARG HGy A 7 THR H 1.0 . 4.39 447 377 A 6 ARG HBx A 7 THR H 1.0 . 4.20 448 378 A 6 ARG HBy A 7 THR H 1.0 . 3.92 449 379 A 7 THR H A 6 ARG HDx 1.0 . 4.79 450 379 A 6 ARG HDy A 7 THR H 1.0 . 4.79 451 380 A 8 GLY H A 6 ARG H 1.0 . 5.50 452 381 A 28 ARG H A 8 GLY H 1.0 . 5.50 453 382 A 7 THR H A 8 GLY H 1.0 . 3.43 454 383 A 8 GLY H A 28 ARG HH1x 1.0 . 5.50 455 384 A 8 GLY H A 6 ARG HDx 1.0 . 4.90 456 384 A 6 ARG HDy A 8 GLY H 1.0 . 4.90 457 385 A 28 ARG HDx A 8 GLY H 1.0 . 5.50 458 386 A 7 THR HG2% A 8 GLY H 1.0 . 4.52 459 387 A 8 GLY H A 6 ARG HGx 1.0 . 4.68 460 387 A 6 ARG HGy A 8 GLY H 1.0 . 4.68 461 388 A 6 ARG HBy A 8 GLY H 1.0 . 3.91 462 389 A 9 ARG H A 10 CYS H 1.0 . 4.72 463 390 A 9 ARG H A 28 ARG HH1x 1.0 . 5.50 464 391 A 9 ARG H A 9 ARG HBx 1.0 . 3.29 465 392 A 9 ARG HBy A 10 CYS H 1.0 . 3.68 466 393 A 17 SER H A 31 CYS H 1.0 . 5.27 467 394 A 25 ARG H A 23 SER H 1.0 . 5.23 468 395 A 17 SER H A 30 CYS HA 1.0 . 4.49 469 396 A 23 SER H A 22 ILE HG2% 1.0 . 3.64 470 397 A 22 ILE HA A 23 SER H 1.0 . 2.95 471 398 A 17 SER H A 16 LEU HA 1.0 . 3.25 472 399 A 25 ARG H A 24 GLY H 1.0 . 3.56 473 400 A 25 ARG H A 22 ILE H 1.0 . 3.90 474 401 A 27 TYR HD% A 25 ARG H 1.0 . 5.50 475 402 A 25 ARG H A 22 ILE HA 1.0 . 4.84 476 403 A 25 ARG H A 23 SER HBx 1.0 . 5.28 477 404 A 25 ARG H A 25 ARG HBx 1.0 . 3.69 478 405 A 25 ARG H A 25 ARG HBy 1.0 . 3.65 479 406 A 25 ARG H A 21 GLU HGx 1.0 . 4.90 480 407 A 25 ARG H A 21 GLU HGy 1.0 . 5.34 481 408 A 25 ARG H A 25 ARG HDx 1.0 . 5.16 482 408 A 25 ARG HDy A 25 ARG H 1.0 . 5.16 483 409 A 23 SER H A 24 GLY H 1.0 . 3.77 484 410 A 22 ILE H A 24 GLY H 1.0 . 4.76 485 411 A 24 GLY H A 23 SER HBx 1.0 . 4.86 486 412 A 24 GLY H A 21 GLU HGx 1.0 . 4.70 487 413 A 22 ILE HB A 24 GLY H 1.0 . 5.45 488 414 A 22 ILE HG2% A 24 GLY H 1.0 . 5.25 489 415 A 22 ILE HA A 24 GLY H 1.0 . 4.11 490 416 A 24 GLY H A 23 SER HA 1.0 . 3.39 491 417 A 22 ILE H A 22 ILE HG2% 1.0 . 4.19 492 418 A 22 ILE H A 22 ILE HG1y 1.0 . 4.45 493 419 A 22 ILE H A 25 ARG HBy 1.0 . 5.32 494 420 A 22 ILE H A 21 GLU HBx 1.0 . 4.72 495 421 A 22 ILE H A 21 GLU HGx 1.0 . 4.38 496 422 A 22 ILE H A 21 GLU HGy 1.0 . 4.97 497 423 A 27 TYR HD% A 22 ILE H 1.0 . 4.25 498 424 A 22 ILE H A 23 SER H 1.0 . 5.08 499 425 A 26 LEU HA A 21 GLU H 1.0 . 5.50 500 426 A 21 GLU H A 20 CYS HBx 1.0 . 4.55 501 427 A 22 ILE HG1x A 21 GLU H 1.0 . 5.50 502 428 A 26 LEU HDy% A 21 GLU H 1.0 . 5.13 503 429 A 21 GLU H A 21 GLU HBy 1.0 . 3.66 504 430 A 21 GLU H A 21 GLU HGy 1.0 . 4.88 505 431 A 19 VAL H A 20 CYS H 1.0 . 4.48 506 432 A 27 TYR HD% A 20 CYS H 1.0 . 5.25 507 433 A 26 LEU HA A 20 CYS H 1.0 . 4.72 508 434 A 29 LEU HDx% A 20 CYS H 1.0 . 5.05 509 435 A 29 LEU HDy% A 20 CYS H 1.0 . 4.32 510 436 A 19 VAL HGx% A 20 CYS H 1.0 . 3.95 511 437 A 20 CYS H A 29 LEU HG 1.0 . 4.81 512 438 A 20 CYS H A 26 LEU HBx 1.0 . 5.50 513 438 A 26 LEU HBy A 20 CYS H 1.0 . 5.50 514 439 A 26 LEU HG A 20 CYS H 1.0 . 5.36 515 440 A 27 TYR HBx A 20 CYS H 1.0 . 4.57 516 441 A 28 ARG HA A 20 CYS H 1.0 . 4.24 517 442 A 25 ARG H A 25 ARG HGx 1.0 . 4.44 518 443 A 22 ILE H A 27 TYR HBy 1.0 . 5.50 519 444 A 22 ILE H A 26 LEU H 1.0 . 5.50 520 445 A 21 GLU HA A 26 LEU H 1.0 . 5.35 521 446 A 25 ARG HGx A 26 LEU H 1.0 . 4.10 522 447 A 27 TYR H A 20 CYS H 1.0 . 3.95 523 448 A 27 TYR H A 26 LEU H 1.0 . 4.88 524 449 A 27 TYR H A 21 GLU HA 1.0 . 4.14 525 450 A 27 TYR H A 27 TYR HBy 1.0 . 3.81 526 451 A 27 TYR H A 26 LEU HBx 1.0 . 4.22 527 451 A 27 TYR H A 26 LEU HBy 1.0 . 4.22 528 452 A 27 TYR H A 19 VAL HB 1.0 . 5.50 529 453 A 27 TYR H A 22 ILE HG1x 1.0 . 5.50 530 454 A 25 ARG HGy A 26 LEU H 1.0 . 3.76 531 455 A 27 TYR H A 26 LEU HDy% 1.0 . 4.05 532 456 A 27 TYR H A 7 THR HG2% 1.0 . 5.50 533 457 A 27 TYR H A 22 ILE HB 1.0 . 5.50 534 458 A 28 ARG H A 6 ARG H 1.0 . 4.08 535 459 A 28 ARG H A 29 LEU H 1.0 . 4.91 536 460 A 28 ARG H A 5 CYS HA 1.0 . 5.50 537 461 A 28 ARG H A 6 ARG HA 1.0 . 5.50 538 462 A 28 ARG H A 28 ARG HDx 1.0 . 5.15 539 463 A 28 ARG H A 27 TYR HBy 1.0 . 4.47 540 464 A 7 THR HG2% A 28 ARG H 1.0 . 5.50 541 465 A 28 ARG H A 28 ARG HBx 1.0 . 3.32 542 465 A 28 ARG H A 28 ARG HBy 1.0 . 3.32 543 466 A 17 SER H A 29 LEU H 1.0 . 5.30 544 467 A 18 GLY H A 29 LEU H 1.0 . 4.04 545 468 A 28 ARG HA A 29 LEU H 1.0 . 3.26 546 469 A 19 VAL HA A 29 LEU H 1.0 . 4.04 547 470 A 16 LEU HBy A 29 LEU H 1.0 . 5.50 548 471 A 29 LEU H A 28 ARG HBx 1.0 . 3.96 549 471 A 28 ARG HBy A 29 LEU H 1.0 . 3.96 550 472 A 29 LEU H A 29 LEU HBy 1.0 . 3.87 551 473 A 16 LEU HDx% A 29 LEU H 1.0 . 4.64 552 474 A 29 LEU H A 29 LEU HDy% 1.0 . 3.81 553 475 A 29 LEU H A 29 LEU HDx% 1.0 . 4.55 554 476 A 4 TYR H A 30 CYS H 1.0 . 4.11 555 477 A 29 LEU H A 30 CYS H 1.0 . 5.15 556 478 A 3 CYS HA A 30 CYS H 1.0 . 5.44 557 479 A 4 TYR HD% A 30 CYS H 1.0 . 5.50 558 480 A 30 CYS H A 5 CYS HA 1.0 . 4.84 559 481 A 29 LEU HG A 30 CYS H 1.0 . 5.50 560 482 A 30 CYS H A 28 ARG HBx 1.0 . 5.49 561 482 A 28 ARG HBy A 30 CYS H 1.0 . 5.49 562 483 A 3 CYS HBx A 30 CYS H 1.0 . 5.26 563 484 A 30 CYS H A 30 CYS HBx 1.0 . 4.02 564 485 A 3 CYS HA A 31 CYS H 1.0 . 5.50 565 486 A 16 LEU HA A 31 CYS H 1.0 . 4.98 566 487 A 17 SER HBx A 31 CYS H 1.0 . 5.50 567 488 A 31 CYS H A 30 CYS HBy 1.0 . 4.74 568 489 A 31 CYS H A 31 CYS HBy 1.0 . 4.04 569 490 A 31 CYS H A 31 CYS HBx 1.0 . 4.13 570 491 A 31 CYS H A 30 CYS HBx 1.0 . 5.34 571 492 B 101 ALA HB1 A 31 CYS H 1.0 . 5.50 572 493 A 31 CYS HA A 32 ARG H 1.0 . 3.53 573 494 A 3 CYS HA A 32 ARG H 1.0 . 4.27 574 495 A 32 ARG H A 2 THR HB 1.0 . 5.30 575 496 A 32 ARG H A 32 ARG HDx 1.0 . 5.50 576 496 A 32 ARG H A 32 ARG HDy 1.0 . 5.50 577 497 A 1 ALA HB% A 32 ARG H 1.0 . 5.03 578 498 A 32 ARG H A 32 ARG HBx 1.0 . 4.16 579 498 A 32 ARG H A 32 ARG HBy 1.0 . 4.16 580 499 A 3 CYS HBx A 32 ARG H 1.0 . 5.50 581 500 A 25 ARG HA A 25 ARG HE 1.0 . 5.50 582 501 A 7 THR HB A 25 ARG HE 1.0 . 5.50 583 502 A 7 THR HG2% A 25 ARG HE 1.0 . 5.39 584 503 A 9 ARG HBy A 9 ARG HE 1.0 . 5.01 585 504 A 9 ARG HBx A 9 ARG HE 1.0 . 4.72 586 505 A 13 ARG HE A 13 ARG HBx 1.0 . 4.65 587 505 A 13 ARG HBy A 13 ARG HE 1.0 . 4.65 588 506 A 13 ARG HA A 13 ARG HE 1.0 . 5.50 589 507 A 16 LEU HDx% A 28 ARG HE 1.0 . 4.95 590 508 A 2 THR HG2% A 32 ARG HE 1.0 . 5.50 591 509 A 32 ARG HE A 32 ARG HBx 1.0 . 4.31 592 509 A 32 ARG HBy A 32 ARG HE 1.0 . 4.31 593 510 A 3 CYS H B 129 LEU HD11 1.0 . 5.14 594 511 A 27 TYR HD% A 7 THR H 1.0 . 5.32 595 512 A 10 CYS H A 13 ARG HDx 1.0 . 4.72 596 512 A 13 ARG HDy A 10 CYS H 1.0 . 4.72 597 513 A 17 SER H A 29 LEU HBx 1.0 . 4.67 598 514 A 22 ILE HD1% A 23 SER H 1.0 . 5.04 599 515 A 6 ARG H A 27 TYR HA 1.0 . 5.04 600 516 A 7 THR H A 6 ARG H 1.0 . 5.02 601 517 A 19 VAL H A 29 LEU HDx% 1.0 . 3.83 602 518 A 26 LEU HDy% A 26 LEU H 1.0 . 4.57 603 519 A 27 TYR H A 22 ILE HD1% 1.0 . 5.50 604 520 A 28 ARG HE A 26 LEU HDx% 1.0 . 5.50 605 521 A 29 LEU H A 29 LEU HBx 1.0 . 4.18 606 522 B 129 LEU HD11 A 30 CYS H 1.0 . 5.06 607 523 A 29 LEU HDy% A 30 CYS H 1.0 . 3.97 608 524 A 31 CYS H A 15 SER HA 1.0 . 5.48 609 525 A 18 GLY H A 19 VAL HGy% 1.0 . 5.50 610 526 A 2 THR H A 31 CYS HBx 1.0 . 5.50 611 527 A 27 TYR HD% A 6 ARG H 1.0 . 5.04 612 528 A 20 CYS H A 28 ARG HBx 1.0 . 5.50 613 528 A 28 ARG HBy A 20 CYS H 1.0 . 5.50 614 529 A 22 ILE HG1y A 21 GLU H 1.0 . 5.50 615 530 A 22 ILE HD1% A 21 GLU H 1.0 . 5.50 616 531 A 27 TYR H A 27 TYR HE% 1.0 . 5.21 617 532 A 6 ARG HBx A 6 ARG H 1.0 . 3.74 618 533 A 3 CYS HBy B 129 LEU HD11 1.0 . 3.49 619 534 A 3 CYS HBy B 129 LEU HD21 1.0 . 4.59 620 535 A 5 CYS HBx B 129 LEU HD21 1.0 . 4.06 621 536 A 5 CYS HBy B 122 ILE HD11 1.0 . 4.34 622 537 B 129 LEU HD11 A 5 CYS HA 1.0 . 4.21 623 538 A 5 CYS HA B 129 LEU HD21 1.0 . 3.92 624 539 A 20 CYS HBy B 105 CYS HBy 1.0 . 4.19 625 540 A 5 CYS HBx B 120 CYS HBx 1.0 . 4.18 626 541 A 5 CYS HBy B 120 CYS HBy 1.0 . 3.95 627 542 A 22 ILE HD1% B 122 ILE HG21 1.0 . 3.97 628 543 A 22 ILE HD1% B 105 CYS HBy 1.0 . 4.41 629 544 A 22 ILE HG1x B 122 ILE HD11 1.0 . 4.22 630 545 A 22 ILE HG1y B 122 ILE HD11 1.0 . 4.22 631 546 A 22 ILE HD1% B 127 TYR HE% 1.0 . 3.81 632 547 A 22 ILE HG2% B 127 TYR HE% 1.0 . 3.51 633 548 B 101 ALA HB1 A 31 CYS HBy 1.0 . 4.19 634 549 A 22 ILE HB B 122 ILE HD11 1.0 . 4.41 635 550 A 27 TYR HE% B 122 ILE HG1x 1.0 . 4.42 636 551 A 22 ILE HB B 127 TYR HE% 1.0 . 4.55 637 552 B 104 TYR HA B 104 TYR HD% 1.0 . 3.94 638 553 B 104 TYR H B 104 TYR HD% 1.0 . 4.02 639 554 B 105 CYS H B 104 TYR HD% 1.0 . 4.73 640 555 B 104 TYR HE% B 106 ARG HGx 1.0 . 3.59 641 555 B 104 TYR HE% B 106 ARG HGy 1.0 . 3.59 642 556 B 104 TYR HE% B 106 ARG HBy 1.0 . 4.12 643 557 B 104 TYR HE% B 106 ARG HDx 1.0 . 5.28 644 557 B 104 TYR HE% B 106 ARG HDy 1.0 . 5.28 645 558 B 127 TYR HD% B 127 TYR H 1.0 . 3.78 646 559 B 127 TYR HD% B 125 ARG HDx 1.0 . 4.60 647 559 B 127 TYR HD% B 125 ARG HDy 1.0 . 4.60 648 560 B 127 TYR HD% B 122 ILE HB 1.0 . 4.06 649 561 B 127 TYR HD% B 107 THR HG21 1.0 . 3.84 650 562 B 127 TYR HE% B 107 THR HG21 1.0 . 3.53 651 563 B 127 TYR HD% B 128 ARG H 1.0 . 4.81 652 564 B 127 TYR HE% B 122 ILE HB 1.0 . 3.62 653 565 B 127 TYR HE% B 125 ARG H 1.0 . 4.78 654 566 B 127 TYR HE% B 122 ILE H 1.0 . 4.49 655 567 B 106 ARG HA B 106 ARG HGx 1.0 . 3.61 656 567 B 106 ARG HGy B 106 ARG HA 1.0 . 3.61 657 568 B 106 ARG HBx B 106 ARG HDx 1.0 . 3.76 658 568 B 106 ARG HDy B 106 ARG HBx 1.0 . 3.76 659 569 B 109 ARG HA B 113 ARG HDx 1.0 . 3.86 660 569 B 109 ARG HA B 113 ARG HDy 1.0 . 3.86 661 570 B 109 ARG HBx B 109 ARG HGx 1.0 . 2.90 662 570 B 109 ARG HBx B 109 ARG HGy 1.0 . 2.90 663 571 B 109 ARG HA B 109 ARG HGx 1.0 . 3.28 664 571 B 109 ARG HA B 109 ARG HGy 1.0 . 3.28 665 572 B 109 ARG HDy B 109 ARG HGx 1.0 . 2.87 666 572 B 109 ARG HDx B 109 ARG HGx 1.0 . 2.87 667 572 B 109 ARG HGy B 109 ARG HDx 1.0 . 2.87 668 572 B 109 ARG HGy B 109 ARG HDy 1.0 . 2.87 669 573 B 109 ARG HBx B 109 ARG HDx 1.0 . 3.54 670 573 B 109 ARG HBx B 109 ARG HDy 1.0 . 3.54 671 574 B 119 VAL HA B 119 VAL HG11 1.0 . 3.53 672 575 B 122 ILE HD11 B 122 ILE HB 1.0 . 3.37 673 576 B 122 ILE HG1x B 122 ILE HA 1.0 . 3.99 674 577 B 122 ILE HA B 122 ILE HG1y 1.0 . 3.80 675 578 B 122 ILE HD11 B 122 ILE HA 1.0 . 4.09 676 579 B 125 ARG HA B 125 ARG HGy 1.0 . 3.95 677 580 B 125 ARG HA B 125 ARG HDx 1.0 . 4.31 678 580 B 125 ARG HDy B 125 ARG HA 1.0 . 4.31 679 581 B 125 ARG HBx B 125 ARG HDx 1.0 . 3.82 680 581 B 125 ARG HDy B 125 ARG HBx 1.0 . 3.82 681 582 B 125 ARG HA B 125 ARG HGx 1.0 . 3.48 682 583 B 126 LEU HA B 126 LEU HG 1.0 . 4.20 683 584 B 126 LEU HA B 126 LEU HD21 1.0 . 3.62 684 585 B 126 LEU HD21 B 126 LEU HBx 1.0 . 3.29 685 585 B 126 LEU HD21 B 126 LEU HBy 1.0 . 3.29 686 586 B 128 ARG HA B 128 ARG HDx 1.0 . 4.53 687 587 B 128 ARG HDx B 128 ARG HBx 1.0 . 3.18 688 587 B 128 ARG HDx B 128 ARG HBy 1.0 . 3.18 689 588 B 128 ARG HA B 128 ARG HGx 1.0 . 3.37 690 589 B 128 ARG HA B 128 ARG HDy 1.0 . 4.90 691 590 B 128 ARG HDy B 128 ARG HBx 1.0 . 3.62 692 590 B 128 ARG HBy B 128 ARG HDy 1.0 . 3.62 693 591 B 104 TYR H B 103 CYS HA 1.0 . 3.56 694 592 A 17 SER HBy B 103 CYS HBx 1.0 . 5.07 695 593 B 103 CYS H B 103 CYS HBx 1.0 . 4.16 696 594 B 104 TYR H B 103 CYS HBy 1.0 . 3.90 697 595 B 103 CYS HBy B 131 CYS HA 1.0 . 4.68 698 596 A 29 LEU HDx% B 103 CYS HBy 1.0 . 3.49 699 597 A 29 LEU HBy B 103 CYS HBy 1.0 . 5.10 700 598 B 105 CYS H B 104 TYR HA 1.0 . 3.41 701 599 B 105 CYS H B 104 TYR HBx 1.0 . 3.68 702 600 B 107 THR HG21 B 107 THR HA 1.0 . 3.32 703 601 B 107 THR HG21 B 125 ARG HDx 1.0 . 4.10 704 601 B 125 ARG HDy B 107 THR HG21 1.0 . 4.10 705 602 B 107 THR HG21 B 107 THR H 1.0 . 3.63 706 603 B 107 THR HB B 108 GLY H 1.0 . 4.57 707 604 B 127 TYR HD% B 107 THR HA 1.0 . 4.80 708 605 B 128 ARG H B 107 THR HA 1.0 . 4.18 709 606 B 101 ALA HB1 B 102 THR H 1.0 . 3.57 710 607 B 101 ALA HB1 A 16 LEU HA 1.0 . 5.50 711 608 A 17 SER HBy B 101 ALA HB1 1.0 . 4.09 712 609 B 101 ALA HB1 B 102 THR HA 1.0 . 4.71 713 610 B 102 THR HA B 132 ARG H 1.0 . 4.88 714 611 B 102 THR HA B 132 ARG HDx 1.0 . 5.41 715 611 B 102 THR HA B 132 ARG HDy 1.0 . 5.41 716 612 B 102 THR HB B 132 ARG HGx 1.0 . 4.81 717 613 B 102 THR H B 102 THR HB 1.0 . 3.71 718 614 B 102 THR HA B 102 THR HG21 1.0 . 3.32 719 615 B 132 ARG H B 102 THR HG21 1.0 . 5.25 720 616 B 105 CYS H B 105 CYS HBx 1.0 . 3.80 721 617 B 105 CYS HBy B 106 ARG H 1.0 . 4.27 722 618 B 105 CYS HBy B 127 TYR HBy 1.0 . 4.55 723 619 B 106 ARG HBy B 108 GLY H 1.0 . 4.16 724 620 B 106 ARG HBy B 106 ARG HDx 1.0 . 3.58 725 620 B 106 ARG HBy B 106 ARG HDy 1.0 . 3.58 726 621 B 106 ARG H B 106 ARG HDx 1.0 . 5.05 727 621 B 106 ARG HDy B 106 ARG H 1.0 . 5.05 728 622 B 106 ARG HA B 108 GLY H 1.0 . 4.38 729 623 B 108 GLY HAx B 109 ARG HGx 1.0 . 4.77 730 623 B 109 ARG HGy B 108 GLY HAx 1.0 . 4.77 731 624 B 106 ARG HBx B 108 GLY HAx 1.0 . 5.28 732 625 B 108 GLY HAy B 109 ARG HGx 1.0 . 4.99 733 625 B 109 ARG HGy B 108 GLY HAy 1.0 . 4.99 734 626 B 108 GLY HAy B 109 ARG H 1.0 . 3.31 735 627 B 109 ARG HBy B 109 ARG HDx 1.0 . 3.14 736 627 B 109 ARG HDy B 109 ARG HBy 1.0 . 3.14 737 628 B 109 ARG HBy B 109 ARG HGx 1.0 . 2.40 738 628 B 109 ARG HGy B 109 ARG HBy 1.0 . 2.40 739 629 B 109 ARG HA B 108 GLY HAy 1.0 . 4.73 740 630 B 109 ARG HA B 110 CYS HBy 1.0 . 4.84 741 631 B 109 ARG HA B 128 ARG HH1x 1.0 . 4.96 742 632 B 109 ARG HA B 110 CYS H 1.0 . 3.01 743 633 B 109 ARG HBx B 109 ARG H 1.0 . 3.74 744 634 B 106 ARG H B 128 ARG HBx 1.0 . 3.74 745 634 B 128 ARG HBy B 106 ARG H 1.0 . 3.74 746 635 B 109 ARG HBy B 110 CYS H 1.0 . 3.69 747 636 B 109 ARG H B 109 ARG HGx 1.0 . 3.57 748 636 B 109 ARG HGy B 109 ARG H 1.0 . 3.57 749 637 B 110 CYS H B 109 ARG HGx 1.0 . 4.23 750 637 B 109 ARG HGy B 110 CYS H 1.0 . 4.23 751 638 A 3 CYS H B 117 SER HA 1.0 . 5.22 752 639 B 117 SER HBx B 118 GLY H 1.0 . 5.42 753 640 B 117 SER H B 117 SER HBy 1.0 . 4.08 754 641 A 3 CYS H B 117 SER HBy 1.0 . 5.24 755 642 A 1 ALA HB% B 117 SER HBy 1.0 . 4.82 756 643 B 117 SER H B 116 LEU HBy 1.0 . 4.74 757 644 B 116 LEU HBy B 116 LEU HD11 1.0 . 3.08 758 645 B 116 LEU HA B 116 LEU HG 1.0 . 3.39 759 646 B 128 ARG HA B 116 LEU HG 1.0 . 3.90 760 647 B 116 LEU HBy B 116 LEU HG 1.0 . 2.98 761 648 B 116 LEU HA B 116 LEU HD11 1.0 . 4.64 762 649 B 128 ARG HDy B 116 LEU HD11 1.0 . 4.58 763 650 B 116 LEU HD11 B 116 LEU HBx 1.0 . 3.25 764 651 B 118 GLY H B 116 LEU HD11 1.0 . 4.71 765 652 B 117 SER H B 116 LEU HD11 1.0 . 4.82 766 653 B 116 LEU HG B 128 ARG HE 1.0 . 4.84 767 654 B 116 LEU HG B 129 LEU H 1.0 . 3.70 768 655 B 117 SER H B 116 LEU HG 1.0 . 3.65 769 656 B 118 GLY HAx B 119 VAL H 1.0 . 3.54 770 657 A 3 CYS H B 118 GLY HAy 1.0 . 3.72 771 658 B 129 LEU HD11 B 118 GLY HAy 1.0 . 4.25 772 659 B 119 VAL HA B 128 ARG HA 1.0 . 3.56 773 660 B 119 VAL HA B 127 TYR HBx 1.0 . 5.29 774 661 B 119 VAL HA B 128 ARG HBx 1.0 . 4.67 775 661 B 119 VAL HA B 128 ARG HBy 1.0 . 4.67 776 662 B 129 LEU HBx B 119 VAL HA 1.0 . 4.68 777 663 B 129 LEU HD21 B 119 VAL HA 1.0 . 4.38 778 664 B 119 VAL HA B 120 CYS H 1.0 . 3.05 779 665 B 119 VAL HG11 B 119 VAL H 1.0 . 3.77 780 666 B 120 CYS H B 119 VAL HB 1.0 . 3.63 781 667 B 128 ARG HA B 119 VAL HB 1.0 . 5.36 782 668 B 126 LEU HG B 119 VAL HB 1.0 . 4.72 783 669 B 120 CYS H B 119 VAL HG21 1.0 . 4.23 784 670 B 128 ARG HA B 119 VAL HG21 1.0 . 4.58 785 671 B 119 VAL HA B 119 VAL HG21 1.0 . 4.14 786 672 B 119 VAL H B 119 VAL HG21 1.0 . 3.55 787 673 B 120 CYS HBy B 121 GLU H 1.0 . 4.52 788 674 B 120 CYS HBy B 120 CYS H 1.0 . 4.06 789 675 B 122 ILE HD11 B 120 CYS HBx 1.0 . 3.63 790 676 B 120 CYS HBx B 120 CYS H 1.0 . 3.83 791 677 B 121 GLU H B 120 CYS HA 1.0 . 3.20 792 678 B 120 CYS HBx B 122 ILE HG1x 1.0 . 4.67 793 679 B 120 CYS HBy B 122 ILE HG1x 1.0 . 4.73 794 680 B 120 CYS HBx B 122 ILE HG1y 1.0 . 4.05 795 681 B 120 CYS HBy B 122 ILE HG1y 1.0 . 5.15 796 682 B 122 ILE HD11 B 120 CYS HBy 1.0 . 4.05 797 683 B 122 ILE HD11 B 122 ILE H 1.0 . 4.45 798 684 B 122 ILE HG1y B 123 SER H 1.0 . 5.32 799 685 B 122 ILE HB B 122 ILE H 1.0 . 3.86 800 686 B 122 ILE HB B 123 SER H 1.0 . 4.38 801 687 B 122 ILE HD11 B 122 ILE HG21 1.0 . 2.90 802 688 A 27 TYR HD% B 122 ILE HD11 1.0 . 3.81 803 689 B 127 TYR HD% B 122 ILE HG1y 1.0 . 4.83 804 690 B 127 TYR HD% B 122 ILE HG1x 1.0 . 4.75 805 691 B 122 ILE HG21 B 122 ILE HG1x 1.0 . 3.31 806 692 B 122 ILE HG21 B 122 ILE HG1y 1.0 . 3.24 807 693 B 122 ILE HG21 B 122 ILE HA 1.0 . 3.15 808 694 B 120 CYS HBx B 122 ILE HG21 1.0 . 5.04 809 695 B 122 ILE HG21 A 25 ARG HDx 1.0 . 4.92 810 695 A 25 ARG HDy B 122 ILE HG21 1.0 . 4.92 811 696 A 27 TYR HD% B 122 ILE HG21 1.0 . 4.13 812 697 B 122 ILE HG21 B 125 ARG H 1.0 . 5.12 813 698 B 126 LEU HD21 B 121 GLU HA 1.0 . 4.30 814 699 B 121 GLU HGx B 124 GLY H 1.0 . 4.67 815 700 B 127 TYR HD% B 121 GLU HA 1.0 . 5.01 816 701 B 122 ILE H B 121 GLU HA 1.0 . 3.11 817 702 B 122 ILE HG21 B 123 SER HA 1.0 . 4.71 818 703 B 124 GLY H B 123 SER HBx 1.0 . 5.27 819 704 B 123 SER H B 123 SER HBy 1.0 . 4.05 820 705 B 122 ILE HG21 B 123 SER HBx 1.0 . 4.42 821 706 B 122 ILE HG21 B 123 SER HBy 1.0 . 3.61 822 707 B 125 ARG HBx B 126 LEU H 1.0 . 4.53 823 708 B 125 ARG HA B 126 LEU H 1.0 . 2.89 824 709 B 125 ARG HBy B 125 ARG HDx 1.0 . 4.18 825 709 B 125 ARG HDy B 125 ARG HBy 1.0 . 4.18 826 710 B 126 LEU H B 125 ARG HBy 1.0 . 4.32 827 711 B 125 ARG HGx B 125 ARG HBy 1.0 . 2.45 828 712 B 126 LEU H B 125 ARG HDx 1.0 . 4.95 829 712 B 125 ARG HDy B 126 LEU H 1.0 . 4.95 830 713 B 121 GLU HA B 126 LEU HBx 1.0 . 4.83 831 713 B 126 LEU HBy B 121 GLU HA 1.0 . 4.83 832 714 B 126 LEU H B 126 LEU HBx 1.0 . 3.13 833 714 B 126 LEU HBy B 126 LEU H 1.0 . 3.13 834 715 B 127 TYR H B 126 LEU HA 1.0 . 3.15 835 716 B 122 ILE H B 126 LEU HA 1.0 . 4.38 836 717 B 127 TYR HD% B 126 LEU HA 1.0 . 4.67 837 718 B 126 LEU HG B 126 LEU H 1.0 . 4.66 838 719 B 127 TYR H B 126 LEU HG 1.0 . 4.80 839 720 B 126 LEU HA B 126 LEU HD11 1.0 . 4.08 840 721 B 121 GLU HA B 126 LEU HD11 1.0 . 4.55 841 722 B 126 LEU H B 126 LEU HD11 1.0 . 4.84 842 723 B 120 CYS H B 126 LEU HD11 1.0 . 5.06 843 724 B 127 TYR H B 126 LEU HD11 1.0 . 4.66 844 725 B 126 LEU HD11 B 121 GLU HBy 1.0 . 4.03 845 726 B 119 VAL HB B 126 LEU HD11 1.0 . 4.17 846 727 B 126 LEU HD11 B 126 LEU HBx 1.0 . 3.17 847 727 B 126 LEU HBy B 126 LEU HD11 1.0 . 3.17 848 728 B 127 TYR HD% B 127 TYR HA 1.0 . 4.10 849 729 B 128 ARG H B 127 TYR HA 1.0 . 3.12 850 730 B 107 THR HG21 B 127 TYR HA 1.0 . 4.78 851 731 B 122 ILE HG1y B 127 TYR HBx 1.0 . 4.94 852 732 B 122 ILE HD11 B 127 TYR HBx 1.0 . 4.76 853 733 B 127 TYR HBx B 120 CYS H 1.0 . 4.51 854 734 B 106 ARG H B 127 TYR HBy 1.0 . 4.82 855 735 B 128 ARG H B 127 TYR HBy 1.0 . 4.17 856 736 B 122 ILE HG1y B 127 TYR HBy 1.0 . 4.77 857 737 B 122 ILE HD11 B 127 TYR HBy 1.0 . 4.71 858 738 B 105 CYS HBx B 127 TYR HBy 1.0 . 4.39 859 739 B 128 ARG HGx B 129 LEU H 1.0 . 5.01 860 740 B 128 ARG H B 128 ARG HGx 1.0 . 4.17 861 741 B 128 ARG HA B 128 ARG HGy 1.0 . 3.82 862 742 B 128 ARG HGy B 128 ARG HBx 1.0 . 2.86 863 742 B 128 ARG HBy B 128 ARG HGy 1.0 . 2.86 864 743 B 128 ARG HGx B 116 LEU HD11 1.0 . 4.54 865 744 B 128 ARG HGx B 116 LEU HG 1.0 . 4.12 866 745 B 116 LEU HD11 B 128 ARG HGy 1.0 . 4.40 867 746 B 129 LEU H B 128 ARG HGy 1.0 . 5.04 868 747 B 128 ARG H B 128 ARG HGy 1.0 . 4.20 869 748 B 128 ARG H B 128 ARG HDx 1.0 . 4.86 870 749 B 128 ARG HA B 129 LEU HG 1.0 . 4.70 871 750 B 116 LEU HG B 128 ARG HBx 1.0 . 3.01 872 750 B 128 ARG HBy B 116 LEU HG 1.0 . 3.01 873 751 B 116 LEU HD11 B 128 ARG HBx 1.0 . 4.76 874 751 B 128 ARG HBy B 116 LEU HD11 1.0 . 4.76 875 752 B 128 ARG HDy B 116 LEU HG 1.0 . 3.82 876 753 B 129 LEU HA B 130 CYS H 1.0 . 3.21 877 754 B 129 LEU HA B 105 CYS HA 1.0 . 4.23 878 755 B 129 LEU H B 129 LEU HG 1.0 . 3.80 879 756 B 119 VAL HA B 129 LEU HG 1.0 . 4.12 880 757 A 5 CYS H B 129 LEU HD21 1.0 . 4.40 881 758 A 5 CYS H B 129 LEU HD11 1.0 . 4.31 882 759 A 4 TYR H B 129 LEU HD11 1.0 . 4.61 883 760 B 129 LEU HD11 B 119 VAL HA 1.0 . 4.77 884 761 A 3 CYS HA B 129 LEU HD11 1.0 . 4.93 885 762 A 4 TYR HA B 129 LEU HD11 1.0 . 4.02 886 763 B 129 LEU HD11 B 129 LEU HBx 1.0 . 3.38 887 764 B 129 LEU HD11 A 5 CYS HBx 1.0 . 3.94 888 765 B 129 LEU HBx B 118 GLY HAx 1.0 . 4.77 889 766 B 129 LEU HBx B 118 GLY HAy 1.0 . 4.81 890 767 B 129 LEU HBx B 117 SER HBy 1.0 . 5.09 891 768 B 129 LEU HBx B 118 GLY H 1.0 . 4.05 892 769 B 129 LEU HBx B 130 CYS H 1.0 . 4.93 893 770 B 129 LEU HBx B 117 SER H 1.0 . 4.25 894 771 B 129 LEU HD11 B 129 LEU HA 1.0 . 4.11 895 772 B 129 LEU HBx B 129 LEU HD21 1.0 . 3.28 896 773 B 116 LEU HA B 130 CYS HA 1.0 . 4.02 897 774 B 117 SER HBy B 130 CYS HA 1.0 . 5.22 898 775 B 130 CYS HA B 131 CYS H 1.0 . 3.38 899 776 B 103 CYS HBx B 131 CYS HA 1.0 . 5.19 900 777 B 103 CYS HA B 131 CYS HA 1.0 . 3.40 901 778 B 104 TYR H B 131 CYS HA 1.0 . 4.19 902 779 B 132 ARG H B 131 CYS HBx 1.0 . 4.48 903 780 B 131 CYS HBy B 132 ARG H 1.0 . 4.33 904 781 B 110 CYS H B 113 ARG HA 1.0 . 3.91 905 782 B 109 ARG H B 109 ARG HDx 1.0 . 4.51 906 782 B 109 ARG HDy B 109 ARG H 1.0 . 4.51 907 783 B 121 GLU H B 121 GLU HBy 1.0 . 3.78 908 784 B 102 THR HB B 132 ARG HBx 1.0 . 4.54 909 784 B 102 THR HB B 132 ARG HBy 1.0 . 4.54 910 785 B 132 ARG HGy B 132 ARG HBx 1.0 . 2.95 911 785 B 132 ARG HBy B 132 ARG HGy 1.0 . 2.95 912 786 B 132 ARG HGx B 132 ARG HBx 1.0 . 2.77 913 786 B 132 ARG HGx B 132 ARG HBy 1.0 . 2.77 914 787 B 132 ARG HGx B 132 ARG HA 1.0 . 3.86 915 788 B 132 ARG H B 132 ARG HGx 1.0 . 4.28 916 789 B 126 LEU HA B 121 GLU HBx 1.0 . 4.62 917 790 B 126 LEU HA B 121 GLU HGx 1.0 . 4.91 918 791 B 126 LEU HA B 121 GLU HBy 1.0 . 4.88 919 792 B 129 LEU HD21 B 128 ARG HA 1.0 . 4.56 920 793 B 113 ARG HA B 113 ARG HGx 1.0 . 3.59 921 793 B 113 ARG HA B 113 ARG HGy 1.0 . 3.59 922 794 B 110 CYS H B 113 ARG HBx 1.0 . 5.02 923 794 B 110 CYS H B 113 ARG HBy 1.0 . 5.02 924 795 B 110 CYS H B 113 ARG HGx 1.0 . 4.62 925 795 B 110 CYS H B 113 ARG HGy 1.0 . 4.62 926 796 B 109 ARG HA B 128 ARG HDy 1.0 . 4.35 927 797 B 109 ARG HA B 128 ARG HDx 1.0 . 3.80 928 798 B 113 ARG HBy B 113 ARG HDx 1.0 . 3.39 929 798 B 113 ARG HBx B 113 ARG HDx 1.0 . 3.39 930 798 B 113 ARG HDy B 113 ARG HBx 1.0 . 3.39 931 798 B 113 ARG HDy B 113 ARG HBy 1.0 . 3.39 932 799 B 113 ARG HA B 113 ARG HDx 1.0 . 3.75 933 799 B 113 ARG HDy B 113 ARG HA 1.0 . 3.75 934 800 B 110 CYS HBy B 110 CYS H 1.0 . 3.55 935 801 B 110 CYS H B 110 CYS HBx 1.0 . 4.05 936 802 B 107 THR HG21 B 106 ARG HA 1.0 . 4.78 937 803 B 128 ARG HE B 128 ARG HBx 1.0 . 4.27 938 803 B 128 ARG HBy B 128 ARG HE 1.0 . 4.27 939 804 B 132 ARG HBy B 132 ARG HDx 1.0 . 3.42 940 804 B 132 ARG HDy B 132 ARG HBx 1.0 . 3.42 941 804 B 132 ARG HDy B 132 ARG HBy 1.0 . 3.42 942 804 B 132 ARG HBx B 132 ARG HDx 1.0 . 3.42 943 805 B 132 ARG HA B 132 ARG HDx 1.0 . 4.61 944 805 B 132 ARG HDy B 132 ARG HA 1.0 . 4.61 945 806 B 121 GLU HGx B 124 GLY HAy 1.0 . 5.50 946 807 B 126 LEU HA B 121 GLU HGy 1.0 . 5.50 947 808 B 126 LEU HD11 B 121 GLU HGy 1.0 . 4.36 948 809 B 110 CYS HBx B 130 CYS HBx 1.0 . 4.83 949 810 B 110 CYS HBx B 130 CYS HBy 1.0 . 5.49 950 811 B 110 CYS HBy B 130 CYS HBy 1.0 . 5.50 951 812 B 119 VAL HG11 B 128 ARG HDy 1.0 . 4.73 952 813 B 119 VAL HG11 B 128 ARG HDx 1.0 . 5.28 953 814 A 3 CYS HBy B 117 SER HBy 1.0 . 5.22 954 815 B 127 TYR HBy B 105 CYS HA 1.0 . 5.40 955 816 B 105 CYS HA B 128 ARG HBx 1.0 . 5.20 956 816 B 128 ARG HBy B 105 CYS HA 1.0 . 5.20 957 817 B 125 ARG HBy B 125 ARG HE 1.0 . 4.53 958 818 B 125 ARG HBx B 125 ARG HE 1.0 . 4.93 959 819 B 129 LEU HD21 B 129 LEU HBy 1.0 . 2.40 960 820 B 129 LEU HD11 B 129 LEU HBy 1.0 . 2.86 961 821 A 3 CYS HBy B 129 LEU HBy 1.0 . 5.16 962 822 A 3 CYS HBx B 129 LEU HBy 1.0 . 5.19 963 823 B 130 CYS H B 129 LEU HBy 1.0 . 4.26 964 824 B 116 LEU HG B 130 CYS HA 1.0 . 5.42 965 825 B 102 THR H B 102 THR HG21 1.0 . 4.16 966 826 B 118 GLY H B 117 SER HBy 1.0 . 4.80 967 827 B 117 SER H B 116 LEU HBx 1.0 . 5.10 968 828 A 4 TYR H B 129 LEU HD21 1.0 . 4.93 969 829 B 131 CYS H B 115 SER HBx 1.0 . 4.87 970 829 B 131 CYS H B 115 SER HBy 1.0 . 4.87 971 830 B 101 ALA HB1 A 31 CYS HBx 1.0 . 4.00 972 831 B 116 LEU HA B 116 LEU HD21 1.0 . 4.32 973 832 B 130 CYS HBy B 106 ARG HGx 1.0 . 4.55 974 832 B 106 ARG HGy B 130 CYS HBy 1.0 . 4.55 975 833 B 116 LEU HBx B 116 LEU HD21 1.0 . 3.47 976 834 B 116 LEU HBy B 116 LEU HD21 1.0 . 2.46 977 835 B 129 LEU HD21 B 105 CYS HA 1.0 . 3.49 978 836 B 129 LEU HD21 B 129 LEU HA 1.0 . 3.07 979 837 B 129 LEU HD21 B 127 TYR HBy 1.0 . 4.07 980 838 B 129 LEU HD21 B 106 ARG H 1.0 . 4.10 981 839 B 127 TYR HD% B 105 CYS HBx 1.0 . 4.56 982 840 B 127 TYR HD% B 105 CYS HBy 1.0 . 4.46 983 841 B 127 TYR HD% B 106 ARG HA 1.0 . 4.81 984 842 B 103 CYS HA B 131 CYS HBx 1.0 . 5.16 985 843 B 103 CYS HA B 131 CYS HBy 1.0 . 4.78 986 844 A 3 CYS HBy B 129 LEU HBx 1.0 . 5.03 987 845 B 129 LEU HD11 B 118 GLY HAx 1.0 . 3.86 988 846 B 106 ARG H B 129 LEU HA 1.0 . 4.79 989 847 B 128 ARG HDx B 116 LEU HG 1.0 . 4.36 990 848 B 104 TYR HD% B 102 THR HG21 1.0 . 4.85 991 849 B 104 TYR HE% B 102 THR HG21 1.0 . 3.90 992 850 B 103 CYS HA B 104 TYR HD% 1.0 . 4.48 993 851 B 104 TYR HE% B 132 ARG HBx 1.0 . 4.50 994 851 B 104 TYR HE% B 132 ARG HBy 1.0 . 4.50 995 852 B 118 GLY HAx B 129 LEU HBy 1.0 . 5.50 996 853 A 4 TYR HA B 129 LEU HD21 1.0 . 5.20 997 854 B 127 TYR HE% B 125 ARG HBx 1.0 . 4.12 998 855 B 127 TYR HE% B 125 ARG HBy 1.0 . 4.37 999 856 B 127 TYR HE% B 125 ARG HDx 1.0 . 4.36 1000 856 B 125 ARG HDy B 127 TYR HE% 1.0 . 4.36 1001 857 B 118 GLY H B 116 LEU HD21 1.0 . 3.77 1002 858 B 116 LEU HG B 128 ARG HGy 1.0 . 4.09 1003 859 B 128 ARG HGx B 128 ARG HBx 1.0 . 2.60 1004 859 B 128 ARG HBy B 128 ARG HGx 1.0 . 2.60 1005 860 B 110 CYS H B 112 THR HG21 1.0 . 4.48 1006 861 B 128 ARG HDx B 116 LEU HD11 1.0 . 4.78 1007 862 B 119 VAL HG11 B 128 ARG HA 1.0 . 3.64 1008 863 B 127 TYR H B 119 VAL HG11 1.0 . 4.86 1009 864 B 120 CYS HBx B 127 TYR HBy 1.0 . 4.78 1010 865 B 126 LEU HA B 121 GLU HA 1.0 . 3.59 1011 866 B 127 TYR HE% B 122 ILE HG1y 1.0 . 5.08 1012 867 B 128 ARG HH1x B 126 LEU HD11 1.0 . 4.39 1013 868 B 104 TYR HE% B 132 ARG HDx 1.0 . 4.50 1014 868 B 104 TYR HE% B 132 ARG HDy 1.0 . 4.50 1015 869 B 121 GLU H B 121 GLU HGy 1.0 . 5.00 1016 870 A 27 TYR HD% B 120 CYS HBy 1.0 . 5.50 1017 871 B 110 CYS HBy B 130 CYS HBx 1.0 . 4.65 1018 872 B 102 THR HG21 B 132 ARG HBx 1.0 . 4.73 1019 872 B 102 THR HG21 B 132 ARG HBy 1.0 . 4.73 1020 873 B 119 VAL HG11 B 126 LEU HBx 1.0 . 4.46 1021 873 B 119 VAL HG11 B 126 LEU HBy 1.0 . 4.46 1022 874 B 119 VAL HG11 B 126 LEU HG 1.0 . 4.41 1023 875 B 126 LEU HD21 B 121 GLU HGx 1.0 . 4.63 1024 876 B 126 LEU HD21 B 121 GLU HGy 1.0 . 4.09 1025 877 B 119 VAL HB B 126 LEU HBx 1.0 . 5.34 1026 877 B 126 LEU HBy B 119 VAL HB 1.0 . 5.34 1027 878 B 121 GLU HBx B 121 GLU HGy 1.0 . 2.57 1028 879 B 121 GLU HGx B 126 LEU HD11 1.0 . 4.69 1029 880 B 126 LEU HD21 B 121 GLU HBy 1.0 . 4.01 1030 881 A 27 TYR HD% B 120 CYS HBx 1.0 . 5.07 1031 882 B 125 ARG H B 121 GLU HA 1.0 . 4.79 1032 883 B 122 ILE H B 126 LEU HD21 1.0 . 5.03 1033 884 B 102 THR HG21 B 132 ARG HDx 1.0 . 4.61 1034 884 B 132 ARG HDy B 102 THR HG21 1.0 . 4.61 1035 885 B 105 CYS HBy B 129 LEU HD21 1.0 . 3.25 1036 886 B 122 ILE H B 122 ILE HG1y 1.0 . 4.78 1037 887 B 108 GLY HAx B 128 ARG HH1x 1.0 . 5.23 1038 888 B 128 ARG HH1x B 128 ARG HBx 1.0 . 5.50 1039 888 B 128 ARG HBy B 128 ARG HH1x 1.0 . 5.50 1040 889 B 102 THR H B 132 ARG H 1.0 . 4.42 1041 890 B 131 CYS HA B 102 THR H 1.0 . 5.50 1042 891 A 17 SER HA B 102 THR H 1.0 . 5.50 1043 892 B 102 THR H B 101 ALA HA 1.0 . 3.25 1044 893 B 102 THR H B 132 ARG HDx 1.0 . 5.50 1045 893 B 102 THR H B 132 ARG HDy 1.0 . 5.50 1046 894 B 102 THR H B 132 ARG HGx 1.0 . 5.43 1047 895 B 103 CYS H A 17 SER HBy 1.0 . 4.40 1048 896 B 103 CYS H B 102 THR HA 1.0 . 3.25 1049 897 B 103 CYS H A 18 GLY HAy 1.0 . 4.85 1050 898 B 103 CYS H B 102 THR HG21 1.0 . 3.76 1051 899 B 103 CYS H B 101 ALA HB1 1.0 . 4.89 1052 900 B 102 THR H B 132 ARG HBx 1.0 . 5.33 1053 900 B 102 THR H B 132 ARG HBy 1.0 . 5.33 1054 901 B 105 CYS H B 105 CYS HBy 1.0 . 4.16 1055 902 B 105 CYS H B 104 TYR HBy 1.0 . 4.34 1056 903 B 103 CYS H B 104 TYR H 1.0 . 5.30 1057 904 B 105 CYS H B 104 TYR H 1.0 . 5.20 1058 905 B 104 TYR H B 104 TYR HE% 1.0 . 5.50 1059 906 B 104 TYR H B 129 LEU HA 1.0 . 5.38 1060 907 B 104 TYR H B 104 TYR HBy 1.0 . 4.10 1061 908 B 104 TYR H B 103 CYS HBx 1.0 . 4.33 1062 909 B 118 GLY H B 117 SER H 1.0 . 3.45 1063 910 B 116 LEU HA B 118 GLY H 1.0 . 4.20 1064 911 B 129 LEU HD11 B 118 GLY H 1.0 . 4.94 1065 912 B 118 GLY H B 129 LEU HBy 1.0 . 4.59 1066 913 B 118 GLY H B 129 LEU HG 1.0 . 5.11 1067 914 B 118 GLY H B 119 VAL H 1.0 . 5.01 1068 915 B 119 VAL H B 118 GLY HAy 1.0 . 3.49 1069 916 B 129 LEU HBx B 119 VAL H 1.0 . 5.22 1070 917 B 119 VAL H B 129 LEU HG 1.0 . 5.39 1071 918 B 129 LEU HD21 B 119 VAL H 1.0 . 5.50 1072 919 B 103 CYS H B 131 CYS HA 1.0 . 5.38 1073 920 B 103 CYS H B 132 ARG H 1.0 . 5.50 1074 921 B 105 CYS H B 106 ARG H 1.0 . 5.24 1075 922 B 106 ARG H B 130 CYS H 1.0 . 5.43 1076 923 B 106 ARG H B 105 CYS HA 1.0 . 3.25 1077 924 B 105 CYS HBx B 106 ARG H 1.0 . 4.47 1078 925 B 106 ARG H B 106 ARG HGx 1.0 . 3.96 1079 925 B 106 ARG HGy B 106 ARG H 1.0 . 3.96 1080 926 B 106 ARG HA B 107 THR H 1.0 . 3.09 1081 927 B 107 THR H B 106 ARG HGx 1.0 . 4.39 1082 927 B 106 ARG HGy B 107 THR H 1.0 . 4.39 1083 928 B 106 ARG HBy B 107 THR H 1.0 . 4.20 1084 929 B 106 ARG HBx B 107 THR H 1.0 . 3.92 1085 930 B 107 THR H B 106 ARG HDx 1.0 . 4.79 1086 930 B 106 ARG HDy B 107 THR H 1.0 . 4.79 1087 931 B 108 GLY H B 106 ARG H 1.0 . 5.50 1088 932 B 128 ARG H B 108 GLY H 1.0 . 5.50 1089 933 B 107 THR H B 108 GLY H 1.0 . 3.43 1090 934 B 108 GLY H B 128 ARG HH1x 1.0 . 5.50 1091 935 B 108 GLY H B 106 ARG HDx 1.0 . 4.90 1092 935 B 106 ARG HDy B 108 GLY H 1.0 . 4.90 1093 936 B 128 ARG HDy B 108 GLY H 1.0 . 5.50 1094 937 B 107 THR HG21 B 108 GLY H 1.0 . 4.52 1095 938 B 108 GLY H B 106 ARG HGx 1.0 . 4.68 1096 938 B 106 ARG HGy B 108 GLY H 1.0 . 4.68 1097 939 B 106 ARG HBx B 108 GLY H 1.0 . 3.91 1098 940 B 109 ARG H B 110 CYS H 1.0 . 4.72 1099 941 B 109 ARG H B 128 ARG HH1x 1.0 . 5.50 1100 942 B 109 ARG H B 109 ARG HBy 1.0 . 3.29 1101 943 B 109 ARG HBx B 110 CYS H 1.0 . 3.68 1102 944 B 117 SER H B 131 CYS H 1.0 . 5.27 1103 945 B 125 ARG H B 123 SER H 1.0 . 5.23 1104 946 B 117 SER H B 130 CYS HA 1.0 . 4.49 1105 947 B 122 ILE HG21 B 123 SER H 1.0 . 3.64 1106 948 B 122 ILE HA B 123 SER H 1.0 . 2.95 1107 949 B 116 LEU HA B 117 SER H 1.0 . 3.25 1108 950 B 125 ARG H B 124 GLY H 1.0 . 3.56 1109 951 B 125 ARG H B 122 ILE H 1.0 . 3.90 1110 952 B 127 TYR HD% B 125 ARG H 1.0 . 5.50 1111 953 B 125 ARG H B 122 ILE HA 1.0 . 4.84 1112 954 B 125 ARG H B 123 SER HBy 1.0 . 5.28 1113 955 B 125 ARG H B 125 ARG HBy 1.0 . 3.69 1114 956 B 125 ARG H B 125 ARG HBx 1.0 . 3.65 1115 957 B 125 ARG H B 121 GLU HGy 1.0 . 4.90 1116 958 B 125 ARG H B 121 GLU HGx 1.0 . 5.34 1117 959 B 125 ARG H B 125 ARG HDx 1.0 . 5.16 1118 959 B 125 ARG HDy B 125 ARG H 1.0 . 5.16 1119 960 B 123 SER H B 124 GLY H 1.0 . 3.77 1120 961 B 122 ILE H B 124 GLY H 1.0 . 4.76 1121 962 B 124 GLY H B 123 SER HBy 1.0 . 4.86 1122 963 B 124 GLY H B 121 GLU HGy 1.0 . 4.70 1123 964 B 122 ILE HB B 124 GLY H 1.0 . 5.45 1124 965 B 122 ILE HG21 B 124 GLY H 1.0 . 5.25 1125 966 B 122 ILE HA B 124 GLY H 1.0 . 4.11 1126 967 B 124 GLY H B 123 SER HA 1.0 . 3.39 1127 968 B 122 ILE HG21 B 122 ILE H 1.0 . 4.19 1128 969 B 122 ILE HG1x B 122 ILE H 1.0 . 4.45 1129 970 B 122 ILE H B 125 ARG HBx 1.0 . 5.32 1130 971 B 122 ILE H B 121 GLU HBy 1.0 . 4.72 1131 972 B 122 ILE H B 121 GLU HGy 1.0 . 4.38 1132 973 B 122 ILE H B 121 GLU HGx 1.0 . 4.97 1133 974 B 127 TYR HD% B 122 ILE H 1.0 . 4.25 1134 975 B 122 ILE H B 123 SER H 1.0 . 5.08 1135 976 B 126 LEU HA B 121 GLU H 1.0 . 5.50 1136 977 B 120 CYS HBx B 121 GLU H 1.0 . 4.55 1137 978 B 122 ILE HG1y B 121 GLU H 1.0 . 5.50 1138 979 B 126 LEU HD21 B 121 GLU H 1.0 . 5.13 1139 980 B 121 GLU H B 121 GLU HBx 1.0 . 3.66 1140 981 B 121 GLU H B 121 GLU HGx 1.0 . 4.88 1141 982 B 119 VAL H B 120 CYS H 1.0 . 4.48 1142 983 B 127 TYR HD% B 120 CYS H 1.0 . 5.25 1143 984 B 126 LEU HA B 120 CYS H 1.0 . 4.72 1144 985 B 129 LEU HD11 B 120 CYS H 1.0 . 5.05 1145 986 B 129 LEU HD21 B 120 CYS H 1.0 . 4.32 1146 987 B 119 VAL HG11 B 120 CYS H 1.0 . 3.95 1147 988 B 120 CYS H B 129 LEU HG 1.0 . 4.81 1148 989 B 120 CYS H B 126 LEU HBx 1.0 . 5.50 1149 989 B 126 LEU HBy B 120 CYS H 1.0 . 5.50 1150 990 B 126 LEU HG B 120 CYS H 1.0 . 5.36 1151 991 B 127 TYR HBy B 120 CYS H 1.0 . 4.57 1152 992 B 128 ARG HA B 120 CYS H 1.0 . 4.24 1153 993 B 125 ARG H B 125 ARG HGy 1.0 . 4.44 1154 994 B 122 ILE H B 127 TYR HBx 1.0 . 5.50 1155 995 B 122 ILE H B 126 LEU H 1.0 . 5.50 1156 996 B 121 GLU HA B 126 LEU H 1.0 . 5.35 1157 997 B 125 ARG HGy B 126 LEU H 1.0 . 4.10 1158 998 B 127 TYR H B 120 CYS H 1.0 . 3.95 1159 999 B 127 TYR H B 126 LEU H 1.0 . 4.88 1160 1000 B 127 TYR H B 121 GLU HA 1.0 . 4.14 1161 1001 B 127 TYR H B 127 TYR HBx 1.0 . 3.81 1162 1002 B 127 TYR H B 126 LEU HBx 1.0 . 4.22 1163 1002 B 127 TYR H B 126 LEU HBy 1.0 . 4.22 1164 1003 B 127 TYR H B 119 VAL HB 1.0 . 5.50 1165 1004 B 127 TYR H B 122 ILE HG1y 1.0 . 5.50 1166 1005 B 125 ARG HGx B 126 LEU H 1.0 . 3.76 1167 1006 B 127 TYR H B 126 LEU HD21 1.0 . 4.05 1168 1007 B 127 TYR H B 107 THR HG21 1.0 . 5.50 1169 1008 B 127 TYR H B 122 ILE HB 1.0 . 5.50 1170 1009 B 128 ARG H B 106 ARG H 1.0 . 4.08 1171 1010 B 128 ARG H B 129 LEU H 1.0 . 4.91 1172 1011 B 128 ARG H B 105 CYS HA 1.0 . 5.50 1173 1012 B 128 ARG H B 106 ARG HA 1.0 . 5.50 1174 1013 B 128 ARG H B 128 ARG HDy 1.0 . 5.15 1175 1014 B 128 ARG H B 127 TYR HBx 1.0 . 4.47 1176 1015 B 107 THR HG21 B 128 ARG H 1.0 . 5.50 1177 1016 B 128 ARG H B 128 ARG HBx 1.0 . 3.32 1178 1016 B 128 ARG H B 128 ARG HBy 1.0 . 3.32 1179 1017 B 117 SER H B 129 LEU H 1.0 . 5.30 1180 1018 B 118 GLY H B 129 LEU H 1.0 . 4.04 1181 1019 B 128 ARG HA B 129 LEU H 1.0 . 3.26 1182 1020 B 119 VAL HA B 129 LEU H 1.0 . 4.04 1183 1021 B 116 LEU HBx B 129 LEU H 1.0 . 5.50 1184 1022 B 129 LEU H B 128 ARG HBx 1.0 . 3.96 1185 1022 B 128 ARG HBy B 129 LEU H 1.0 . 3.96 1186 1023 B 129 LEU HBx B 129 LEU H 1.0 . 3.87 1187 1024 B 116 LEU HD11 B 129 LEU H 1.0 . 4.64 1188 1025 B 129 LEU HD21 B 129 LEU H 1.0 . 3.81 1189 1026 B 129 LEU HD11 B 129 LEU H 1.0 . 4.55 1190 1027 B 104 TYR H B 130 CYS H 1.0 . 4.11 1191 1028 B 129 LEU H B 130 CYS H 1.0 . 5.15 1192 1029 B 103 CYS HA B 130 CYS H 1.0 . 5.44 1193 1030 B 104 TYR HD% B 130 CYS H 1.0 . 5.50 1194 1031 B 130 CYS H B 105 CYS HA 1.0 . 4.84 1195 1032 B 129 LEU HG B 130 CYS H 1.0 . 5.50 1196 1033 B 130 CYS H B 128 ARG HBx 1.0 . 5.49 1197 1033 B 128 ARG HBy B 130 CYS H 1.0 . 5.49 1198 1034 B 103 CYS HBy B 130 CYS H 1.0 . 5.26 1199 1035 B 130 CYS H B 130 CYS HBy 1.0 . 4.02 1200 1036 B 103 CYS HA B 131 CYS H 1.0 . 5.50 1201 1037 B 116 LEU HA B 131 CYS H 1.0 . 4.98 1202 1038 B 117 SER HBy B 131 CYS H 1.0 . 5.50 1203 1039 B 131 CYS H B 130 CYS HBx 1.0 . 4.74 1204 1040 B 131 CYS H B 131 CYS HBx 1.0 . 4.04 1205 1041 B 131 CYS HBy B 131 CYS H 1.0 . 4.13 1206 1042 B 131 CYS H B 130 CYS HBy 1.0 . 5.34 1207 1043 A 1 ALA HB% B 131 CYS H 1.0 . 5.50 1208 1044 B 131 CYS HA B 132 ARG H 1.0 . 3.53 1209 1045 B 103 CYS HA B 132 ARG H 1.0 . 4.27 1210 1046 B 132 ARG H B 102 THR HB 1.0 . 5.30 1211 1047 B 132 ARG H B 132 ARG HDx 1.0 . 5.50 1212 1047 B 132 ARG H B 132 ARG HDy 1.0 . 5.50 1213 1048 B 101 ALA HB1 B 132 ARG H 1.0 . 5.03 1214 1049 B 132 ARG H B 132 ARG HBx 1.0 . 4.16 1215 1049 B 132 ARG H B 132 ARG HBy 1.0 . 4.16 1216 1050 B 103 CYS HBy B 132 ARG H 1.0 . 5.50 1217 1051 B 125 ARG HA B 125 ARG HE 1.0 . 5.50 1218 1052 B 107 THR HB B 125 ARG HE 1.0 . 5.50 1219 1053 B 107 THR HG21 B 125 ARG HE 1.0 . 5.39 1220 1054 B 109 ARG HBx B 109 ARG HE 1.0 . 5.01 1221 1055 B 109 ARG HBy B 109 ARG HE 1.0 . 4.72 1222 1056 B 113 ARG HE B 113 ARG HBx 1.0 . 4.65 1223 1056 B 113 ARG HBy B 113 ARG HE 1.0 . 4.65 1224 1057 B 113 ARG HA B 113 ARG HE 1.0 . 5.50 1225 1058 B 116 LEU HD11 B 128 ARG HE 1.0 . 4.95 1226 1059 B 102 THR HG21 B 132 ARG HE 1.0 . 5.50 1227 1060 B 132 ARG HE B 132 ARG HBx 1.0 . 4.31 1228 1060 B 132 ARG HBy B 132 ARG HE 1.0 . 4.31 1229 1061 B 103 CYS H A 29 LEU HDx% 1.0 . 5.14 1230 1062 B 127 TYR HD% B 107 THR H 1.0 . 5.32 1231 1063 B 110 CYS H B 113 ARG HDx 1.0 . 4.72 1232 1063 B 113 ARG HDy B 110 CYS H 1.0 . 4.72 1233 1064 B 117 SER H B 129 LEU HBy 1.0 . 4.67 1234 1065 B 122 ILE HD11 B 123 SER H 1.0 . 5.04 1235 1066 B 106 ARG H B 127 TYR HA 1.0 . 5.04 1236 1067 B 107 THR H B 106 ARG H 1.0 . 5.02 1237 1068 B 129 LEU HD11 B 119 VAL H 1.0 . 3.83 1238 1069 B 126 LEU HD21 B 126 LEU H 1.0 . 4.57 1239 1070 B 122 ILE HD11 B 127 TYR H 1.0 . 5.50 1240 1071 B 128 ARG HE B 126 LEU HD11 1.0 . 5.50 1241 1072 B 129 LEU H B 129 LEU HBy 1.0 . 4.18 1242 1073 A 29 LEU HDx% B 130 CYS H 1.0 . 5.06 1243 1074 B 129 LEU HD21 B 130 CYS H 1.0 . 3.97 1244 1075 B 131 CYS H B 115 SER HA 1.0 . 5.48 1245 1076 B 118 GLY H B 119 VAL HG21 1.0 . 5.50 1246 1077 B 131 CYS HBy B 102 THR H 1.0 . 5.50 1247 1078 B 127 TYR HD% B 106 ARG H 1.0 . 5.04 1248 1079 B 120 CYS H B 128 ARG HBx 1.0 . 5.50 1249 1079 B 128 ARG HBy B 120 CYS H 1.0 . 5.50 1250 1080 B 122 ILE HG1x B 121 GLU H 1.0 . 5.50 1251 1081 B 122 ILE HD11 B 121 GLU H 1.0 . 5.50 1252 1082 B 127 TYR HE% B 127 TYR H 1.0 . 5.21 1253 1083 B 106 ARG HBy B 106 ARG H 1.0 . 3.74 1254 1084 A 29 LEU HDx% B 103 CYS HBx 1.0 . 3.49 1255 1085 A 29 LEU HDy% B 103 CYS HBx 1.0 . 4.59 1256 1086 A 29 LEU HDy% B 105 CYS HBy 1.0 . 4.06 1257 1087 A 22 ILE HD1% B 105 CYS HBx 1.0 . 4.34 1258 1088 A 29 LEU HDx% B 105 CYS HA 1.0 . 4.21 1259 1089 A 29 LEU HDy% B 105 CYS HA 1.0 . 3.92 1260 1090 A 5 CYS HBx B 120 CYS HBy 1.0 . 4.19 1261 1091 A 20 CYS HBx B 105 CYS HBy 1.0 . 4.18 1262 1092 A 20 CYS HBy B 105 CYS HBx 1.0 . 3.95 1263 1093 A 22 ILE HG2% B 122 ILE HD11 1.0 . 3.97 1264 1094 A 22 ILE HD1% B 122 ILE HD11 1.0 . 3.87 1265 1095 A 29 LEU HDy% B 129 LEU HD21 1.0 . 3.41 1266 1096 A 5 CYS HBx B 122 ILE HD11 1.0 . 4.41 1267 1097 A 22 ILE HD1% B 122 ILE HG1y 1.0 . 4.22 1268 1098 A 22 ILE HD1% B 122 ILE HG1x 1.0 . 4.22 1269 1099 A 27 TYR HE% B 122 ILE HD11 1.0 . 3.81 1270 1100 A 27 TYR HE% B 122 ILE HG21 1.0 . 3.51 1271 1101 A 1 ALA HB% B 131 CYS HBx 1.0 . 4.19 1272 1102 A 22 ILE HG2% B 122 ILE HG21 1.0 . 3.68 1273 1103 A 22 ILE HD1% B 122 ILE HB 1.0 . 4.41 1274 1104 A 22 ILE HG1y B 127 TYR HE% 1.0 . 4.42 1275 1105 A 27 TYR HE% B 122 ILE HB 1.0 . 4.55 stop_ save_ save_DYANA/DIANA_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_5 _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 3 CYS SG A 31 CYS SG 1.0 . 2.10 2 2 A 3 CYS SG A 31 CYS CB 1.0 . 3.10 3 3 A 31 CYS SG A 3 CYS CB 1.0 . 3.15 4 4 B 103 CYS SG B 131 CYS SG 1.0 . 2.10 5 5 B 103 CYS SG B 131 CYS CB 1.0 . 3.10 6 6 B 131 CYS SG B 103 CYS CB 1.0 . 3.15 7 7 A 5 CYS SG B 120 CYS SG 1.0 . 2.10 8 8 A 5 CYS SG B 120 CYS CB 1.0 . 3.10 9 9 B 120 CYS SG A 5 CYS CB 1.0 . 3.10 10 10 A 20 CYS SG B 105 CYS SG 1.0 . 2.10 11 11 B 105 CYS SG A 20 CYS CB 1.0 . 3.10 12 12 A 20 CYS SG B 105 CYS CB 1.0 . 3.10 13 13 B 110 CYS SG B 130 CYS SG 1.0 . 2.20 14 14 B 110 CYS SG B 130 CYS CB 1.0 . 3.10 15 15 B 130 CYS SG B 110 CYS CB 1.0 . 3.10 16 16 A 10 CYS SG A 30 CYS SG 1.0 . 2.20 17 17 A 10 CYS SG A 30 CYS CB 1.0 . 3.10 18 18 A 30 CYS SG A 10 CYS CB 1.0 . 3.10 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 1 ALA C A 2 THR N A 2 THR CA A 2 THR C 1.0 -148.9 -108.0 PHI 2 2 A 2 THR N A 2 THR CA A 2 THR C A 3 CYS N 1.0 114.3 154.1 PSI 3 3 A 8 GLY C A 9 ARG N A 9 ARG CA A 9 ARG C 1.0 -137.8 -98.8 PHI 4 4 A 9 ARG N A 9 ARG CA A 9 ARG C A 10 CYS N 1.0 121.1 177.8 PSI 5 5 A 9 ARG C A 10 CYS N A 10 CYS CA A 10 CYS C 1.0 -146.2 -126.2 PHI 6 6 A 10 CYS N A 10 CYS CA A 10 CYS C A 11 ALA N 1.0 134.7 166.2 PSI 7 7 A 10 CYS C A 11 ALA N A 11 ALA CA A 11 ALA C 1.0 -98.5 -73.7 PHI 8 8 A 15 SER C A 16 LEU N A 16 LEU CA A 16 LEU C 1.0 -99.4 -79.4 PHI 9 9 A 16 LEU N A 16 LEU CA A 16 LEU C A 17 SER N 1.0 107.4 154.9 PSI 10 10 A 17 SER C A 18 GLY N A 18 GLY CA A 18 GLY C 1.0 -175.1 -112.1 PHI 11 11 A 18 GLY N A 18 GLY CA A 18 GLY C A 19 VAL N 1.0 142.1 163.4 PSI 12 12 A 18 GLY C A 19 VAL N A 19 VAL CA A 19 VAL C 1.0 -143.0 -111.3 PHI 13 13 A 19 VAL N A 19 VAL CA A 19 VAL C A 20 CYS N 1.0 143.6 163.6 PSI 14 14 A 20 CYS C A 21 GLU N A 21 GLU CA A 21 GLU C 1.0 -126.5 -99.1 PHI 15 15 A 21 GLU N A 21 GLU CA A 21 GLU C A 22 ILE N 1.0 108.6 137.3 PSI 16 16 A 21 GLU C A 22 ILE N A 22 ILE CA A 22 ILE C 1.0 -136.7 -93.0 PHI 17 17 A 22 ILE N A 22 ILE CA A 22 ILE C A 23 SER N 1.0 114.6 141.1 PSI 18 18 A 22 ILE C A 23 SER N A 23 SER CA A 23 SER C 1.0 42.9 62.9 PHI 19 19 A 23 SER N A 23 SER CA A 23 SER C A 24 GLY N 1.0 33.9 53.9 PSI 20 20 A 25 ARG C A 26 LEU N A 26 LEU CA A 26 LEU C 1.0 -124.6 -95.1 PHI 21 21 A 26 LEU N A 26 LEU CA A 26 LEU C A 27 TYR N 1.0 108.7 136.2 PSI 22 22 A 28 ARG C A 29 LEU N A 29 LEU CA A 29 LEU C 1.0 -132.9 -105.9 PHI 23 23 A 29 LEU N A 29 LEU CA A 29 LEU C A 30 CYS N 1.0 108.8 150.8 PSI 24 24 A 29 LEU C A 30 CYS N A 30 CYS CA A 30 CYS C 1.0 -133.0 -103.0 PHI 25 25 A 30 CYS N A 30 CYS CA A 30 CYS C A 31 CYS N 1.0 116.6 142.3 PSI 26 26 A 30 CYS C A 31 CYS N A 31 CYS CA A 31 CYS C 1.0 -148.8 -109.8 PHI 27 27 A 31 CYS N A 31 CYS CA A 31 CYS C A 32 ARG N 1.0 119.9 163.7 PSI 28 28 B 101 ALA C B 102 THR N B 102 THR CA B 102 THR C 1.0 -148.9 -108.0 PHI 29 29 B 102 THR N B 102 THR CA B 102 THR C B 103 CYS N 1.0 114.3 154.1 PSI 30 30 B 108 GLY C B 109 ARG N B 109 ARG CA B 109 ARG C 1.0 -137.8 -98.8 PHI 31 31 B 109 ARG N B 109 ARG CA B 109 ARG C B 110 CYS N 1.0 121.1 177.8 PSI 32 32 B 109 ARG C B 110 CYS N B 110 CYS CA B 110 CYS C 1.0 -146.2 -126.2 PHI 33 33 B 110 CYS N B 110 CYS CA B 110 CYS C B 111 ALA N 1.0 134.7 166.2 PSI 34 34 B 110 CYS C B 111 ALA N B 111 ALA CA B 111 ALA C 1.0 -98.5 -73.7 PHI 35 35 B 115 SER C B 116 LEU N B 116 LEU CA B 116 LEU C 1.0 -99.4 -79.4 PHI 36 36 B 116 LEU N B 116 LEU CA B 116 LEU C B 117 SER N 1.0 107.4 154.9 PSI 37 37 B 117 SER C B 118 GLY N B 118 GLY CA B 118 GLY C 1.0 -175.1 -112.1 PHI 38 38 B 118 GLY N B 118 GLY CA B 118 GLY C B 119 VAL N 1.0 142.1 163.4 PSI 39 39 B 118 GLY C B 119 VAL N B 119 VAL CA B 119 VAL C 1.0 -143.0 -111.3 PHI 40 40 B 119 VAL N B 119 VAL CA B 119 VAL C B 120 CYS N 1.0 143.6 163.6 PSI 41 41 B 120 CYS C B 121 GLU N B 121 GLU CA B 121 GLU C 1.0 -126.5 -99.1 PHI 42 42 B 121 GLU N B 121 GLU CA B 121 GLU C B 122 ILE N 1.0 108.6 137.3 PSI 43 43 B 121 GLU C B 122 ILE N B 122 ILE CA B 122 ILE C 1.0 -136.7 -93.0 PHI 44 44 B 122 ILE N B 122 ILE CA B 122 ILE C B 123 SER N 1.0 114.6 141.1 PSI 45 45 B 122 ILE C B 123 SER N B 123 SER CA B 123 SER C 1.0 42.9 62.9 PHI 46 46 B 123 SER N B 123 SER CA B 123 SER C B 124 GLY N 1.0 33.9 53.9 PSI 47 47 B 125 ARG C B 126 LEU N B 126 LEU CA B 126 LEU C 1.0 -124.6 -95.1 PHI 48 48 B 126 LEU N B 126 LEU CA B 126 LEU C B 127 TYR N 1.0 108.7 136.2 PSI 49 49 B 128 ARG C B 129 LEU N B 129 LEU CA B 129 LEU C 1.0 -132.9 -105.9 PHI 50 50 B 129 LEU N B 129 LEU CA B 129 LEU C B 130 CYS N 1.0 108.8 150.8 PSI 51 51 B 129 LEU C B 130 CYS N B 130 CYS CA B 130 CYS C 1.0 -133.0 -103.0 PHI 52 52 B 130 CYS N B 130 CYS CA B 130 CYS C B 131 CYS N 1.0 116.6 142.3 PSI 53 53 B 130 CYS C B 131 CYS N B 131 CYS CA B 131 CYS C 1.0 -148.8 -109.8 PHI 54 54 B 131 CYS N B 131 CYS CA B 131 CYS C B 132 ARG N 1.0 119.9 163.7 PSI 55 55 A 3 CYS N A 3 CYS CA A 3 CYS CB A 3 CYS SG 1.0 -30.0 270.0 CHI1 56 56 A 4 TYR N A 4 TYR CA A 4 TYR CB A 4 TYR CG 1.0 30.0 90.0 CHI1 57 57 A 5 CYS N A 5 CYS CA A 5 CYS CB A 5 CYS SG 1.0 -30.0 270.0 CHI1 58 58 A 6 ARG N A 6 ARG CA A 6 ARG CB A 6 ARG CG 1.0 30.0 90.0 CHI1 59 59 A 9 ARG N A 9 ARG CA A 9 ARG CB A 9 ARG CG 1.0 30.0 90.0 CHI1 60 60 A 10 CYS N A 10 CYS CA A 10 CYS CB A 10 CYS SG 1.0 30.0 90.0 CHI1 61 61 A 17 SER N A 17 SER CA A 17 SER CB A 17 SER OG 1.0 30.0 90.0 CHI1 62 62 A 20 CYS N A 20 CYS CA A 20 CYS CB A 20 CYS SG 1.0 30.0 90.0 CHI1 63 63 A 21 GLU N A 21 GLU CA A 21 GLU CB A 21 GLU CG 1.0 -30.0 270.0 CHI1 64 64 A 23 SER N A 23 SER CA A 23 SER CB A 23 SER OG 1.0 30.0 90.0 CHI1 65 65 A 25 ARG N A 25 ARG CA A 25 ARG CB A 25 ARG CG 1.0 -30.0 270.0 CHI1 66 66 A 27 TYR N A 27 TYR CA A 27 TYR CB A 27 TYR CG 1.0 -30.0 270.0 CHI1 67 67 A 30 CYS N A 30 CYS CA A 30 CYS CB A 30 CYS SG 1.0 30.0 90.0 CHI1 68 68 A 31 CYS N A 31 CYS CA A 31 CYS CB A 31 CYS SG 1.0 -30.0 270.0 CHI1 69 69 B 103 CYS N B 103 CYS CA B 103 CYS CB B 103 CYS SG 1.0 -30.0 270.0 CHI1 70 70 B 104 TYR N B 104 TYR CA B 104 TYR CB B 104 TYR CG 1.0 30.0 90.0 CHI1 71 71 B 105 CYS N B 105 CYS CA B 105 CYS CB B 105 CYS SG 1.0 -30.0 270.0 CHI1 72 72 B 106 ARG N B 106 ARG CA B 106 ARG CB B 106 ARG CG 1.0 30.0 90.0 CHI1 73 73 B 109 ARG N B 109 ARG CA B 109 ARG CB B 109 ARG CG 1.0 30.0 90.0 CHI1 74 74 B 110 CYS N B 110 CYS CA B 110 CYS CB B 110 CYS SG 1.0 30.0 90.0 CHI1 75 75 B 117 SER N B 117 SER CA B 117 SER CB B 117 SER OG 1.0 30.0 90.0 CHI1 76 76 B 120 CYS N B 120 CYS CA B 120 CYS CB B 120 CYS SG 1.0 30.0 90.0 CHI1 77 77 B 121 GLU N B 121 GLU CA B 121 GLU CB B 121 GLU CG 1.0 -30.0 270.0 CHI1 78 78 B 123 SER N B 123 SER CA B 123 SER CB B 123 SER OG 1.0 30.0 90.0 CHI1 79 79 B 125 ARG N B 125 ARG CA B 125 ARG CB B 125 ARG CG 1.0 -30.0 270.0 CHI1 80 80 B 127 TYR N B 127 TYR CA B 127 TYR CB B 127 TYR CG 1.0 -30.0 270.0 CHI1 81 81 B 130 CYS N B 130 CYS CA B 130 CYS CB B 130 CYS SG 1.0 30.0 90.0 CHI1 82 82 B 131 CYS N B 131 CYS CA B 131 CYS CB B 131 CYS SG 1.0 -30.0 270.0 CHI1 stop_ save_