data_nef_c25433_2mxv 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 2MXV 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 12 CYS SG 2 1 ZN ZN 1 15 CYS SG 2 1 ZN ZN 1 26 CYS SG 2 1 ZN ZN 1 29 CYS SG 2 1 ZN ZN stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 HIS middle . . 3 A 3 MET middle . . 4 A 4 PRO middle . false 5 A 5 LYS middle . . 6 A 6 ILE middle . . 7 A 7 ASN middle . . 8 A 8 GLU middle . . 9 A 9 ASP middle . . 10 A 10 TRP middle . . 11 A 11 LEU middle . . 12 A 12 CYS middle -HG . 13 A 13 ASN middle . . 14 A 14 LYS middle . . 15 A 15 CYS middle -HG . 16 A 16 GLY middle . false 17 A 17 VAL middle . . 18 A 18 GLN middle . . 19 A 19 ASN middle . . 20 A 20 PHE middle . . 21 A 21 LYS middle . . 22 A 22 ARG middle . . 23 A 23 ARG middle . . 24 A 24 GLU middle . . 25 A 25 LYS middle . . 26 A 26 CYS middle -HG . 27 A 27 PHE middle . . 28 A 28 LYS middle . . 29 A 29 CYS middle -HG . 30 A 30 GLY middle . false 31 A 31 VAL middle . . 32 A 32 PRO middle . false 33 A 33 LYS middle . . 34 A 34 SER middle . . 35 A 35 GLU middle . . 36 A 36 ALA middle . . 37 A 37 GLU middle . . 38 A 38 GLN middle . . 39 A 39 LYS middle . . 40 A 40 LEU middle . . 41 A 41 PRO middle . false 42 A 42 LEU middle . . 43 A 43 GLY end . false 44 B 1 ZN . . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 7 ASN H H 1 8.535 0.007 A 7 ASN HBx H 1 2.732 0.007 A 7 ASN HBy H 1 2.830 0.007 A 7 ASN HD2x H 1 6.845 0.007 A 7 ASN HD2y H 1 7.564 0.007 A 7 ASN CB C 13 30.000 0.18 A 7 ASN N N 15 121.300 0.12 A 7 ASN ND2 N 15 111.451 0.12 A 8 GLU H H 1 8.372 0.007 A 8 GLU HA H 1 4.440 0.007 A 8 GLU HBx H 1 1.906 0.007 A 8 GLU HBy H 1 2.199 0.007 A 8 GLU HGx H 1 2.166 0.007 A 8 GLU HGy H 1 2.267 0.007 A 8 GLU C C 13 175.693 0.18 A 8 GLU CA C 13 55.855 0.18 A 8 GLU CB C 13 31.029 0.18 A 8 GLU CG C 13 36.658 0.18 A 8 GLU N N 15 119.801 0.12 A 9 ASP H H 1 8.158 0.007 A 9 ASP HA H 1 4.727 0.007 A 9 ASP HBx H 1 2.510 0.007 A 9 ASP HBy H 1 2.580 0.007 A 9 ASP C C 13 175.618 0.18 A 9 ASP CA C 13 54.857 0.18 A 9 ASP CB C 13 41.330 0.18 A 9 ASP N N 15 120.567 0.12 A 10 TRP H H 1 8.476 0.007 A 10 TRP HA H 1 5.014 0.007 A 10 TRP HBy H 1 3.283 0.007 A 10 TRP HBx H 1 3.105 0.007 A 10 TRP HD1 H 1 7.081 0.007 A 10 TRP HE1 H 1 9.678 0.007 A 10 TRP HE3 H 1 7.287 0.007 A 10 TRP HH2 H 1 6.758 0.007 A 10 TRP HZ2 H 1 6.676 0.007 A 10 TRP HZ3 H 1 6.946 0.007 A 10 TRP C C 13 173.732 0.18 A 10 TRP CA C 13 54.037 0.18 A 10 TRP CB C 13 31.370 0.18 A 10 TRP CD1 C 13 125.275 0.18 A 10 TRP CE3 C 13 118.065 0.18 A 10 TRP CH2 C 13 120.669 0.18 A 10 TRP CZ2 C 13 110.966 0.18 A 10 TRP CZ3 C 13 118.400 0.18 A 10 TRP N N 15 116.757 0.12 A 10 TRP NE1 N 15 128.795 0.12 A 11 LEU H H 1 8.810 0.007 A 11 LEU HA H 1 4.519 0.007 A 11 LEU HBy H 1 1.496 0.007 A 11 LEU HDx% H 1 0.702 0.007 A 11 LEU HDy% H 1 0.737 0.007 A 11 LEU HG H 1 1.326 0.007 A 11 LEU C C 13 176.547 0.18 A 11 LEU CA C 13 53.317 0.18 A 11 LEU CB C 13 43.660 0.18 A 11 LEU CDx C 13 24.178 0.18 A 11 LEU CDy C 13 24.729 0.18 A 11 LEU CG C 13 26.929 0.18 A 11 LEU N N 15 122.486 0.12 A 12 CYS H H 1 8.574 0.007 A 12 CYS HA H 1 4.587 0.007 A 12 CYS HBy H 1 3.027 0.007 A 12 CYS HBx H 1 2.573 0.007 A 12 CYS C C 13 177.636 0.18 A 12 CYS CA C 13 59.506 0.18 A 12 CYS CB C 13 31.330 0.18 A 12 CYS N N 15 126.739 0.12 A 13 ASN H H 1 9.229 0.007 A 13 ASN HA H 1 4.534 0.007 A 13 ASN HBy H 1 2.895 0.007 A 13 ASN HBx H 1 2.795 0.007 A 13 ASN HD2x H 1 6.883 0.007 A 13 ASN HD2y H 1 7.513 0.007 A 13 ASN C C 13 175.471 0.18 A 13 ASN CA C 13 54.972 0.18 A 13 ASN CB C 13 38.776 0.18 A 13 ASN N N 15 127.516 0.12 A 13 ASN ND2 N 15 111.204 0.12 A 14 LYS H H 1 9.274 0.007 A 14 LYS HA H 1 4.359 0.007 A 14 LYS HBx H 1 1.966 0.007 A 14 LYS HDx H 1 1.645 0.007 A 14 LYS HDy H 1 1.645 0.007 A 14 LYS HEx H 1 2.931 0.007 A 14 LYS HEy H 1 2.931 0.007 A 14 LYS HGx H 1 1.435 0.007 A 14 LYS HGy H 1 1.466 0.007 A 14 LYS C C 13 178.199 0.18 A 14 LYS CA C 13 57.428 0.18 A 14 LYS CB C 13 32.706 0.18 A 14 LYS CD C 13 29.129 0.18 A 14 LYS CE C 13 42.150 0.18 A 14 LYS CG C 13 24.750 0.18 A 14 LYS N N 15 120.919 0.12 A 15 CYS H H 1 9.014 0.007 A 15 CYS HA H 1 4.722 0.007 A 15 CYS HBx H 1 2.543 0.007 A 15 CYS HBy H 1 2.995 0.007 A 15 CYS CB C 13 32.353 0.18 A 15 CYS N N 15 119.236 0.12 A 16 GLY H H 1 7.817 0.007 A 16 GLY HAx H 1 3.830 0.007 A 16 GLY HAy H 1 4.064 0.007 A 16 GLY CA C 13 46.295 0.18 A 16 GLY N N 15 110.235 0.12 A 17 VAL H H 1 8.220 0.007 A 17 VAL HA H 1 4.250 0.007 A 17 VAL HB H 1 2.075 0.007 A 17 VAL HGx% H 1 0.663 0.007 A 17 VAL HGy% H 1 0.717 0.007 A 17 VAL CA C 13 61.124 0.18 A 17 VAL CB C 13 33.392 0.18 A 17 VAL CGy C 13 22.057 0.18 A 17 VAL CGx C 13 22.050 0.18 A 17 VAL N N 15 121.337 0.12 A 18 GLN H H 1 8.218 0.007 A 18 GLN HA H 1 4.353 0.007 A 18 GLN HBx H 1 1.750 0.007 A 18 GLN HBy H 1 1.785 0.007 A 18 GLN HE2y H 1 7.511 0.007 A 18 GLN HE2x H 1 6.680 0.007 A 18 GLN HGx H 1 2.003 0.007 A 18 GLN C C 13 174.823 0.18 A 18 GLN CA C 13 55.308 0.18 A 18 GLN CB C 13 29.505 0.18 A 18 GLN CG C 13 34.009 0.18 A 18 GLN N N 15 121.310 0.12 A 18 GLN NE2 N 15 110.535 0.12 A 19 ASN H H 1 9.041 0.007 A 19 ASN HA H 1 4.490 0.007 A 19 ASN HBy H 1 1.401 0.007 A 19 ASN HBx H 1 0.238 0.007 A 19 ASN HD2x H 1 7.842 0.007 A 19 ASN HD2y H 1 7.842 0.007 A 19 ASN C C 13 173.360 0.18 A 19 ASN CA C 13 52.058 0.18 A 19 ASN CB C 13 43.372 0.18 A 19 ASN N N 15 122.482 0.12 A 19 ASN ND2 N 15 117.529 0.12 A 20 PHE H H 1 7.846 0.007 A 20 PHE HA H 1 4.658 0.007 A 20 PHE HBx H 1 2.963 0.007 A 20 PHE HBy H 1 3.103 0.007 A 20 PHE HDx H 1 7.313 0.007 A 20 PHE HDy H 1 7.313 0.007 A 20 PHE C C 13 176.810 0.18 A 20 PHE CA C 13 56.786 0.18 A 20 PHE CB C 13 40.003 0.18 A 20 PHE CDx C 13 128.992 0.18 A 20 PHE CDy C 13 128.992 0.18 A 20 PHE N N 15 117.484 0.12 A 21 LYS H H 1 8.516 0.007 A 21 LYS HA H 1 4.128 0.007 A 21 LYS HBy H 1 1.792 0.007 A 21 LYS HBx H 1 1.719 0.007 A 21 LYS HDx H 1 1.576 0.007 A 21 LYS HDy H 1 1.576 0.007 A 21 LYS HEx H 1 2.882 0.007 A 21 LYS HEy H 1 2.882 0.007 A 21 LYS HGy H 1 1.164 0.007 A 21 LYS HGx H 1 1.047 0.007 A 21 LYS C C 13 176.254 0.18 A 21 LYS CA C 13 58.878 0.18 A 21 LYS CB C 13 32.334 0.18 A 21 LYS CD C 13 29.514 0.18 A 21 LYS CG C 13 23.813 0.18 A 21 LYS N N 15 120.464 0.12 A 22 ARG H H 1 7.125 0.007 A 22 ARG HA H 1 4.229 0.007 A 22 ARG HBy H 1 1.989 0.007 A 22 ARG HBx H 1 1.836 0.007 A 22 ARG HDx H 1 3.199 0.007 A 22 ARG HGx H 1 1.564 0.007 A 22 ARG C C 13 176.851 0.18 A 22 ARG CA C 13 56.426 0.18 A 22 ARG CB C 13 29.732 0.18 A 22 ARG CD C 13 43.147 0.18 A 22 ARG CG C 13 27.851 0.18 A 22 ARG N N 15 112.820 0.12 A 23 ARG H H 1 8.349 0.007 A 23 ARG HA H 1 4.382 0.007 A 23 ARG HBx H 1 2.173 0.007 A 23 ARG HDx H 1 3.531 0.007 A 23 ARG HDy H 1 3.531 0.007 A 23 ARG HGx H 1 1.920 0.007 A 23 ARG HGy H 1 1.981 0.007 A 23 ARG C C 13 177.143 0.18 A 23 ARG CA C 13 57.037 0.18 A 23 ARG CB C 13 30.944 0.18 A 23 ARG CD C 13 43.479 0.18 A 23 ARG CG C 13 28.480 0.18 A 23 ARG N N 15 119.307 0.12 A 24 GLU H H 1 8.967 0.007 A 24 GLU HA H 1 4.264 0.007 A 24 GLU HBy H 1 2.183 0.007 A 24 GLU HBx H 1 1.964 0.007 A 24 GLU HGx H 1 2.321 0.007 A 24 GLU HGy H 1 2.321 0.007 A 24 GLU C C 13 176.371 0.18 A 24 GLU CA C 13 56.975 0.18 A 24 GLU CB C 13 30.819 0.18 A 24 GLU CG C 13 33.836 0.18 A 24 GLU N N 15 120.195 0.12 A 25 LYS H H 1 7.862 0.007 A 25 LYS HA H 1 4.906 0.007 A 25 LYS HBx H 1 1.546 0.007 A 25 LYS HBy H 1 1.546 0.007 A 25 LYS HEx H 1 2.948 0.007 A 25 LYS HEy H 1 2.948 0.007 A 25 LYS HGx H 1 1.215 0.007 A 25 LYS HGy H 1 1.215 0.007 A 25 LYS C C 13 174.820 0.18 A 25 LYS CA C 13 54.064 0.18 A 25 LYS CB C 13 35.743 0.18 A 25 LYS CE C 13 42.002 0.18 A 25 LYS CG C 13 24.456 0.18 A 25 LYS N N 15 116.632 0.12 A 26 CYS H H 1 8.678 0.007 A 26 CYS HA H 1 4.181 0.007 A 26 CYS HBy H 1 3.178 0.007 A 26 CYS HBx H 1 2.983 0.007 A 26 CYS C C 13 178.895 0.18 A 26 CYS CA C 13 59.174 0.18 A 26 CYS CB C 13 30.942 0.18 A 26 CYS N N 15 124.535 0.12 A 27 PHE H H 1 9.344 0.007 A 27 PHE HA H 1 4.350 0.007 A 27 PHE HBy H 1 3.289 0.007 A 27 PHE HBx H 1 2.857 0.007 A 27 PHE HDx H 1 7.155 0.007 A 27 PHE HDy H 1 7.155 0.007 A 27 PHE HEx H 1 7.295 0.007 A 27 PHE HEy H 1 7.295 0.007 A 27 PHE HZ H 1 7.252 0.007 A 27 PHE C C 13 174.408 0.18 A 27 PHE CA C 13 59.726 0.18 A 27 PHE CB C 13 38.424 0.18 A 27 PHE CDx C 13 129.210 0.18 A 27 PHE CDy C 13 129.214 0.18 A 27 PHE CEx C 13 129.110 0.18 A 27 PHE CEy C 13 129.111 0.18 A 27 PHE CZ C 13 127.189 0.18 A 27 PHE N N 15 129.286 0.12 A 28 LYS H H 1 8.765 0.007 A 28 LYS HA H 1 4.063 0.007 A 28 LYS HBx H 1 0.897 0.007 A 28 LYS HBy H 1 2.001 0.007 A 28 LYS HGy H 1 1.029 0.007 A 28 LYS HGx H 1 0.966 0.007 A 28 LYS C C 13 177.362 0.18 A 28 LYS CA C 13 57.244 0.18 A 28 LYS CB C 13 33.310 0.18 A 28 LYS CG C 13 25.028 0.18 A 28 LYS N N 15 124.525 0.12 A 29 CYS H H 1 8.357 0.007 A 29 CYS HA H 1 4.797 0.007 A 29 CYS HBx H 1 2.543 0.007 A 29 CYS HBy H 1 3.114 0.007 A 29 CYS C C 13 177.501 0.18 A 29 CYS CA C 13 58.921 0.18 A 29 CYS CB C 13 32.088 0.18 A 29 CYS N N 15 117.596 0.12 A 30 GLY H H 1 7.519 0.007 A 30 GLY HAy H 1 4.088 0.007 A 30 GLY HAx H 1 3.817 0.007 A 30 GLY CA C 13 46.135 0.18 A 30 GLY N N 15 110.623 0.12 A 31 VAL H H 1 8.120 0.007 A 31 VAL HA H 1 4.348 0.007 A 31 VAL HB H 1 2.152 0.007 A 31 VAL HGx% H 1 1.060 0.007 A 31 VAL HGy% H 1 1.107 0.007 A 31 VAL CA C 13 61.591 0.18 A 31 VAL CB C 13 32.238 0.18 A 31 VAL CGy C 13 23.635 0.18 A 31 VAL CGx C 13 21.464 0.18 A 31 VAL N N 15 122.592 0.12 A 32 PRO HA H 1 4.650 0.007 A 32 PRO HBy H 1 2.383 0.007 A 32 PRO HBx H 1 1.861 0.007 A 32 PRO HDx H 1 3.676 0.007 A 32 PRO HDy H 1 4.037 0.007 A 32 PRO HGy H 1 2.093 0.007 A 32 PRO HGx H 1 1.893 0.007 A 32 PRO C C 13 176.413 0.18 A 32 PRO CA C 13 62.772 0.18 A 32 PRO CB C 13 32.650 0.18 A 32 PRO CD C 13 51.630 0.18 A 32 PRO CG C 13 27.996 0.18 A 33 LYS H H 1 7.956 0.007 A 33 LYS HA H 1 3.109 0.007 A 33 LYS HBx H 1 0.595 0.007 A 33 LYS HBy H 1 0.921 0.007 A 33 LYS HEx H 1 2.173 0.007 A 33 LYS HEy H 1 2.267 0.007 A 33 LYS HGy H 1 0.492 0.007 A 33 LYS HGx H 1 -0.512 0.007 A 33 LYS C C 13 176.726 0.18 A 33 LYS CA C 13 58.359 0.18 A 33 LYS CB C 13 32.700 0.18 A 33 LYS CE C 13 41.765 0.18 A 33 LYS CG C 13 23.627 0.18 A 33 LYS N N 15 122.957 0.12 A 34 SER H H 1 8.139 0.007 A 34 SER HA H 1 4.138 0.007 A 34 SER HBy H 1 3.790 0.007 A 34 SER HBx H 1 3.736 0.007 A 34 SER C C 13 175.141 0.18 A 34 SER CA C 13 59.160 0.18 A 34 SER CB C 13 62.820 0.18 A 34 SER N N 15 112.323 0.12 A 35 GLU H H 1 7.750 0.007 A 35 GLU HA H 1 4.251 0.007 A 35 GLU HBy H 1 2.004 0.007 A 35 GLU HBx H 1 1.857 0.007 A 35 GLU HGx H 1 2.141 0.007 A 35 GLU HGy H 1 2.235 0.007 A 35 GLU C C 13 176.796 0.18 A 35 GLU CA C 13 56.589 0.18 A 35 GLU CB C 13 30.584 0.18 A 35 GLU CG C 13 36.401 0.18 A 35 GLU N N 15 120.171 0.12 A 36 ALA H H 1 8.216 0.007 A 36 ALA HA H 1 4.272 0.007 A 36 ALA HB% H 1 1.543 0.007 A 36 ALA C C 13 177.942 0.18 A 36 ALA CA C 13 52.881 0.18 A 36 ALA CB C 13 20.587 0.18 A 36 ALA N N 15 122.364 0.12 A 37 GLU H H 1 8.161 0.007 A 37 GLU HA H 1 4.353 0.007 A 37 GLU HBx H 1 1.872 0.007 A 37 GLU HBy H 1 1.872 0.007 A 37 GLU HGx H 1 2.183 0.007 A 37 GLU HGy H 1 2.183 0.007 A 37 GLU C C 13 176.592 0.18 A 37 GLU CA C 13 56.475 0.18 A 37 GLU CB C 13 30.170 0.18 A 37 GLU CG C 13 35.996 0.18 A 37 GLU N N 15 117.040 0.12 A 38 GLN H H 1 8.262 0.007 A 38 GLN HA H 1 4.254 0.007 A 38 GLN HBx H 1 1.928 0.007 A 38 GLN HBy H 1 2.048 0.007 A 38 GLN HE2x H 1 7.278 0.007 A 38 GLN HGy H 1 2.078 0.007 A 38 GLN HGx H 1 2.057 0.007 A 38 GLN C C 13 175.615 0.18 A 38 GLN CA C 13 55.689 0.18 A 38 GLN CB C 13 29.560 0.18 A 38 GLN CG C 13 33.345 0.18 A 38 GLN N N 15 120.895 0.12 A 39 LYS H H 1 8.416 0.007 A 39 LYS HA H 1 4.296 0.007 A 39 LYS HBx H 1 1.686 0.007 A 39 LYS HBy H 1 1.767 0.007 A 39 LYS HGy H 1 1.360 0.007 A 39 LYS C C 13 176.240 0.18 A 39 LYS CA C 13 55.795 0.18 A 39 LYS CB C 13 32.981 0.18 A 39 LYS CG C 13 24.648 0.18 A 39 LYS N N 15 122.996 0.12 A 40 LEU H H 1 8.292 0.007 A 40 LEU HA H 1 4.575 0.007 A 40 LEU HBy H 1 1.568 0.007 A 40 LEU HBx H 1 1.510 0.007 A 40 LEU HDx% H 1 0.864 0.007 A 40 LEU HDy% H 1 0.864 0.007 A 40 LEU HG H 1 1.633 0.007 A 40 LEU CA C 13 52.786 0.18 A 40 LEU CB C 13 41.468 0.18 A 40 LEU CDx C 13 23.271 0.18 A 40 LEU CG C 13 27.035 0.18 A 40 LEU N N 15 123.709 0.12 A 41 PRO HA H 1 4.348 0.007 A 41 PRO HBx H 1 2.150 0.007 A 41 PRO HBy H 1 2.150 0.007 A 41 PRO HDx H 1 3.609 0.007 A 41 PRO HDy H 1 3.746 0.007 A 41 PRO HGx H 1 1.955 0.007 A 41 PRO CA C 13 61.562 0.18 A 41 PRO CB C 13 32.340 0.18 A 41 PRO CD C 13 50.513 0.18 A 41 PRO CG C 13 27.338 0.18 A 43 GLY H H 1 7.855 0.007 A 43 GLY HAy H 1 3.697 0.007 A 43 GLY CA C 13 45.954 0.18 A 43 GLY N N 15 114.350 0.12 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 27 PHE H A 27 PHE HD% 1.0 . 3.55 2 2 A 27 PHE H A 23 ARG HDx 1.0 . 4.81 3 2 A 27 PHE H A 23 ARG HDy 1.0 . 4.81 4 3 A 27 PHE H A 27 PHE HBx 1.0 . 3.41 5 4 A 27 PHE H A 28 LYS HBy 1.0 . 5.50 6 5 A 27 PHE H A 17 VAL HGy% 1.0 . 5.50 7 6 A 10 TRP HE1 A 21 LYS HA 1.0 . 4.76 8 7 A 10 TRP HE1 A 23 ARG HBx 1.0 . 3.93 9 8 A 10 TRP HE1 A 33 LYS HBx 1.0 . 4.55 10 9 A 10 TRP HE1 A 19 ASN HBy 1.0 . 4.79 11 10 A 12 CYS HBx A 13 ASN H 1.0 . 5.14 12 11 A 13 ASN H A 14 LYS HBx 1.0 . 5.46 13 12 A 13 ASN H A 10 TRP HZ3 1.0 . 5.13 14 13 A 13 ASN H A 15 CYS H 1.0 . 4.10 15 14 A 13 ASN H A 13 ASN HD2y 1.0 . 5.50 16 15 A 13 ASN H A 14 LYS HA 1.0 . 5.50 17 16 A 13 ASN H A 13 ASN HBy 1.0 . 3.49 18 17 A 13 ASN H A 36 ALA HB% 1.0 . 5.06 19 18 A 11 LEU H A 12 CYS H 1.0 . 5.39 20 19 A 12 CYS H A 17 VAL H 1.0 . 5.34 21 20 A 12 CYS H A 16 GLY HAx 1.0 . 5.50 22 21 A 12 CYS H A 12 CYS HBy 1.0 . 3.36 23 22 A 12 CYS H A 11 LEU HBy 1.0 . 4.10 24 23 A 12 CYS H A 11 LEU HDx% 1.0 . 4.22 25 24 A 10 TRP HZ3 A 26 CYS H 1.0 . 5.46 26 25 A 27 PHE H A 28 LYS H 1.0 . 3.72 27 26 A 27 PHE HBx A 28 LYS H 1.0 . 4.80 28 27 A 17 VAL HGy% A 28 LYS H 1.0 . 4.46 29 28 A 28 LYS H A 29 CYS H 1.0 . 3.29 30 29 A 27 PHE HD% A 28 LYS H 1.0 . 4.66 31 30 A 27 PHE H A 26 CYS H 1.0 . 5.25 32 31 A 26 CYS H A 10 TRP HH2 1.0 . 3.69 33 32 A 26 CYS H A 25 LYS HA 1.0 . 3.03 34 33 A 26 CYS H A 32 PRO HA 1.0 . 4.23 35 34 A 26 CYS H A 26 CYS HBx 1.0 . 3.31 36 35 A 26 CYS H A 25 LYS HBx 1.0 . 3.46 37 35 A 26 CYS H A 25 LYS HBy 1.0 . 3.46 38 36 A 26 CYS H A 30 GLY H 1.0 . 5.20 39 37 A 26 CYS H A 26 CYS HBy 1.0 . 3.28 40 38 A 26 CYS H A 31 VAL HB 1.0 . 5.10 41 39 A 39 LYS HA A 40 LEU H 1.0 . 2.91 42 40 A 40 LEU H A 40 LEU HBy 1.0 . 3.11 43 41 A 39 LYS H A 39 LYS HGy 1.0 . 4.33 44 42 A 39 LYS H A 38 GLN HA 1.0 . 2.85 45 43 A 39 LYS H A 39 LYS HBx 1.0 . 3.47 46 44 A 33 LYS H A 33 LYS HEx 1.0 . 5.15 47 45 A 33 LYS H A 33 LYS HGx 1.0 . 4.88 48 46 A 10 TRP HH2 A 33 LYS H 1.0 . 5.50 49 47 A 33 LYS H A 24 GLU HA 1.0 . 4.63 50 48 A 33 LYS H A 32 PRO HBy 1.0 . 3.96 51 49 A 33 LYS H A 32 PRO HBx 1.0 . 4.22 52 50 A 33 LYS H A 25 LYS HBx 1.0 . 4.68 53 50 A 25 LYS HBy A 33 LYS H 1.0 . 4.68 54 51 A 33 LYS H A 33 LYS HBy 1.0 . 3.20 55 52 A 33 LYS HBx A 33 LYS H 1.0 . 3.10 56 53 A 33 LYS H A 25 LYS HGx 1.0 . 5.22 57 53 A 33 LYS H A 25 LYS HGy 1.0 . 5.22 58 54 A 26 CYS HBx A 31 VAL H 1.0 . 4.64 59 55 A 29 CYS H A 31 VAL H 1.0 . 4.86 60 56 A 26 CYS H A 31 VAL H 1.0 . 4.86 61 57 A 30 GLY H A 31 VAL H 1.0 . 4.14 62 58 A 27 PHE HD% A 19 ASN H 1.0 . 5.50 63 59 A 19 ASN H A 9 ASP HBy 1.0 . 4.68 64 60 A 19 ASN H A 18 GLN HGx 1.0 . 4.17 65 61 A 19 ASN H A 18 GLN HBx 1.0 . 4.90 66 62 A 19 ASN HBy A 19 ASN H 1.0 . 4.03 67 63 A 19 ASN H A 11 LEU HDy% 1.0 . 5.30 68 64 A 19 ASN H A 19 ASN HBx 1.0 . 3.35 69 65 A 11 LEU H A 37 GLU HGx 1.0 . 5.50 70 65 A 11 LEU H A 37 GLU HGy 1.0 . 5.50 71 66 A 11 LEU H A 10 TRP HE3 1.0 . 4.62 72 67 A 11 LEU H A 10 TRP HBy 1.0 . 3.60 73 68 A 11 LEU H A 11 LEU HDy% 1.0 . 5.23 74 69 A 11 LEU H A 10 TRP H 1.0 . 4.35 75 70 A 31 VAL H A 25 LYS HBx 1.0 . 5.50 76 70 A 25 LYS HBy A 31 VAL H 1.0 . 5.50 77 71 A 11 LEU H A 37 GLU HA 1.0 . 5.50 78 72 A 35 GLU H A 36 ALA H 1.0 . 3.27 79 73 A 36 ALA H A 33 LYS HA 1.0 . 4.99 80 74 A 36 ALA H A 31 VAL HGy% 1.0 . 4.40 81 75 A 36 ALA H A 35 GLU HA 1.0 . 3.20 82 76 A 7 ASN H A 7 ASN HBy 1.0 . 3.53 83 77 A 17 VAL HA A 18 GLN H 1.0 . 2.91 84 78 A 18 GLN H A 18 GLN HBy 1.0 . 3.07 85 79 A 17 VAL HGy% A 17 VAL H 1.0 . 3.86 86 80 A 14 LYS H A 16 GLY H 1.0 . 5.50 87 81 A 14 LYS H A 12 CYS HA 1.0 . 4.51 88 82 A 14 LYS H A 14 LYS HGy 1.0 . 4.25 89 83 A 13 ASN HBy A 14 LYS H 1.0 . 5.42 90 84 A 38 GLN H A 38 GLN HBx 1.0 . 3.17 91 85 A 9 ASP H A 21 LYS HBy 1.0 . 3.23 92 86 A 9 ASP H A 21 LYS H 1.0 . 4.19 93 87 A 9 ASP H A 9 ASP HBx 1.0 . 3.02 94 88 A 9 ASP H A 8 GLU HBy 1.0 . 3.58 95 89 A 21 LYS H A 20 PHE H 1.0 . 4.74 96 90 A 21 LYS H A 20 PHE HD% 1.0 . 4.16 97 91 A 21 LYS H A 22 ARG H 1.0 . 4.11 98 92 A 21 LYS H A 20 PHE HBy 1.0 . 4.05 99 93 A 21 LYS H A 20 PHE HBx 1.0 . 4.34 100 94 A 21 LYS H A 21 LYS HGx 1.0 . 3.72 101 95 A 9 ASP H A 21 LYS HEx 1.0 . 5.50 102 95 A 9 ASP H A 21 LYS HEy 1.0 . 5.50 103 96 A 24 GLU H A 23 ARG HDx 1.0 . 5.50 104 96 A 23 ARG HDy A 24 GLU H 1.0 . 5.50 105 97 A 24 GLU H A 23 ARG H 1.0 . 5.45 106 98 A 24 GLU H A 23 ARG HA 1.0 . 3.20 107 99 A 24 GLU H A 24 GLU HBy 1.0 . 3.86 108 100 A 24 GLU H A 24 GLU HBx 1.0 . 3.73 109 101 A 33 LYS HBx A 35 GLU H 1.0 . 5.50 110 102 A 9 ASP H A 8 GLU H 1.0 . 3.36 111 103 A 7 ASN HBy A 8 GLU H 1.0 . 4.42 112 104 A 8 GLU HBy A 8 GLU H 1.0 . 3.75 113 105 A 8 GLU H A 8 GLU HBx 1.0 . 3.65 114 106 A 15 CYS H A 14 LYS H 1.0 . 3.15 115 107 A 15 CYS H A 12 CYS HBy 1.0 . 3.58 116 108 A 15 CYS H A 15 CYS HBx 1.0 . 3.66 117 109 A 14 LYS HBx A 15 CYS H 1.0 . 3.16 118 110 A 15 CYS H A 14 LYS HGy 1.0 . 5.12 119 111 A 15 CYS H A 31 VAL HGx% 1.0 . 5.50 120 112 A 20 PHE H A 23 ARG H 1.0 . 5.43 121 113 A 22 ARG H A 23 ARG H 1.0 . 3.67 122 114 A 20 PHE HBy A 23 ARG H 1.0 . 5.00 123 115 A 23 ARG HBx A 23 ARG H 1.0 . 3.08 124 116 A 23 ARG H A 23 ARG HGy 1.0 . 4.84 125 117 A 23 ARG H A 22 ARG HGx 1.0 . 4.74 126 118 A 10 TRP HE1 A 23 ARG H 1.0 . 4.23 127 119 A 23 ARG H A 23 ARG HDx 1.0 . 5.26 128 119 A 23 ARG HDy A 23 ARG H 1.0 . 5.26 129 120 A 15 CYS H A 16 GLY HAx 1.0 . 5.04 130 121 A 29 CYS H A 30 GLY HAx 1.0 . 5.50 131 122 A 29 CYS H A 30 GLY H 1.0 . 3.84 132 123 A 29 CYS H A 28 LYS HBx 1.0 . 4.76 133 124 A 20 PHE H A 20 PHE HD% 1.0 . 4.30 134 125 A 20 PHE H A 23 ARG HDx 1.0 . 4.33 135 125 A 23 ARG HDy A 20 PHE H 1.0 . 4.33 136 126 A 20 PHE H A 20 PHE HBx 1.0 . 3.35 137 127 A 20 PHE H A 23 ARG HGy 1.0 . 4.86 138 128 A 19 ASN HBy A 20 PHE H 1.0 . 4.05 139 129 A 19 ASN HBx A 20 PHE H 1.0 . 5.07 140 130 A 37 GLU H A 37 GLU HGx 1.0 . 3.66 141 130 A 37 GLU HGy A 37 GLU H 1.0 . 3.66 142 131 A 37 GLU H A 37 GLU HBx 1.0 . 2.96 143 131 A 37 GLU H A 37 GLU HBy 1.0 . 2.96 144 132 A 36 ALA HB% A 37 GLU H 1.0 . 3.97 145 133 A 19 ASN HBy A 10 TRP H 1.0 . 5.38 146 134 A 21 LYS HA A 10 TRP H 1.0 . 5.10 147 135 A 10 TRP H A 18 GLN HA 1.0 . 4.91 148 136 A 19 ASN H A 10 TRP H 1.0 . 4.06 149 137 A 10 TRP H A 9 ASP HA 1.0 . 3.24 150 138 A 9 ASP HBy A 10 TRP H 1.0 . 3.55 151 139 A 19 ASN HBx A 10 TRP H 1.0 . 4.88 152 140 A 24 GLU H A 25 LYS H 1.0 . 3.45 153 141 A 24 GLU HBy A 25 LYS H 1.0 . 3.54 154 142 A 24 GLU HBx A 25 LYS H 1.0 . 3.83 155 143 A 25 LYS H A 25 LYS HBx 1.0 . 3.61 156 143 A 25 LYS HBy A 25 LYS H 1.0 . 3.61 157 144 A 25 LYS H A 25 LYS HGx 1.0 . 3.96 158 144 A 25 LYS HGy A 25 LYS H 1.0 . 3.96 159 145 A 22 ARG H A 23 ARG HGy 1.0 . 5.50 160 146 A 22 ARG H A 9 ASP HA 1.0 . 5.50 161 147 A 22 ARG H A 22 ARG HGx 1.0 . 5.50 162 148 A 33 LYS H A 34 SER H 1.0 . 3.72 163 149 A 32 PRO HBy A 34 SER H 1.0 . 5.25 164 150 A 32 PRO HBx A 34 SER H 1.0 . 4.52 165 151 A 33 LYS HBy A 34 SER H 1.0 . 3.87 166 152 A 33 LYS HGx A 34 SER H 1.0 . 5.50 167 153 A 7 ASN HBy A 7 ASN HD2y 1.0 . 3.87 168 154 A 14 LYS HBx A 13 ASN HD2y 1.0 . 5.50 169 155 A 36 ALA HB% A 13 ASN HD2x 1.0 . 5.50 170 156 A 13 ASN HD2x A 36 ALA HA 1.0 . 4.91 171 157 A 13 ASN HD2y A 36 ALA HA 1.0 . 4.81 172 158 A 13 ASN HD2y A 13 ASN HBy 1.0 . 3.74 173 159 A 13 ASN HD2y A 14 LYS H 1.0 . 4.96 174 160 A 12 CYS HA A 13 ASN HD2x 1.0 . 5.50 175 161 A 28 LYS H A 30 GLY H 1.0 . 4.18 176 162 A 18 GLN HA A 18 GLN HE2y 1.0 . 5.50 177 163 A 26 CYS HBx A 30 GLY H 1.0 . 4.19 178 164 A 30 GLY H A 25 LYS HBx 1.0 . 5.45 179 164 A 25 LYS HBy A 30 GLY H 1.0 . 5.45 180 165 A 30 GLY H A 31 VAL HGx% 1.0 . 5.47 181 166 A 30 GLY H A 26 CYS HBy 1.0 . 3.47 182 167 A 30 GLY H A 29 CYS HBx 1.0 . 5.02 183 168 A 11 LEU HDy% A 18 GLN HE2y 1.0 . 5.37 184 169 A 18 GLN HBx A 18 GLN HE2y 1.0 . 5.17 185 170 A 18 GLN HBx A 18 GLN HE2x 1.0 . 5.49 186 171 A 16 GLY H A 15 CYS HBy 1.0 . 5.50 187 172 A 15 CYS H A 16 GLY H 1.0 . 5.50 188 173 A 30 GLY HAy A 25 LYS HBx 1.0 . 4.33 189 173 A 25 LYS HBy A 30 GLY HAy 1.0 . 4.33 190 174 A 11 LEU HDx% A 16 GLY HAy 1.0 . 4.97 191 175 A 16 GLY HAx A 11 LEU HDx% 1.0 . 4.27 192 176 A 26 CYS H A 30 GLY HAx 1.0 . 5.50 193 177 A 30 GLY HAx A 25 LYS HBx 1.0 . 3.88 194 177 A 25 LYS HBy A 30 GLY HAx 1.0 . 3.88 195 178 A 11 LEU H A 11 LEU HBy 1.0 . 3.04 196 179 A 11 LEU HBy A 11 LEU HDx% 1.0 . 3.21 197 180 A 20 PHE HD% A 23 ARG HDx 1.0 . 4.78 198 180 A 23 ARG HDy A 20 PHE HD% 1.0 . 4.78 199 181 A 23 ARG HA A 23 ARG HDx 1.0 . 3.30 200 181 A 23 ARG HDy A 23 ARG HA 1.0 . 3.30 201 182 A 23 ARG HBx A 23 ARG HDx 1.0 . 3.38 202 182 A 23 ARG HDy A 23 ARG HBx 1.0 . 3.38 203 183 A 19 ASN HBx A 21 LYS H 1.0 . 5.50 204 184 A 22 ARG HA A 22 ARG HDx 1.0 . 3.05 205 185 A 22 ARG HDx A 22 ARG HBy 1.0 . 3.37 206 186 A 22 ARG HDx A 22 ARG HBx 1.0 . 3.47 207 187 A 22 ARG HGx A 22 ARG HDx 1.0 . 2.94 208 188 A 19 ASN HBy A 23 ARG HDx 1.0 . 4.20 209 188 A 23 ARG HDy A 19 ASN HBy 1.0 . 4.20 210 189 A 23 ARG HBx A 19 ASN HBy 1.0 . 3.73 211 190 A 19 ASN HBy A 23 ARG HGx 1.0 . 5.19 212 191 A 27 PHE HD% A 19 ASN HBx 1.0 . 4.87 213 192 A 23 ARG HBx A 19 ASN HBx 1.0 . 4.77 214 193 A 30 GLY HAx A 25 LYS HEx 1.0 . 4.29 215 193 A 30 GLY HAx A 25 LYS HEy 1.0 . 4.29 216 194 A 14 LYS HDx A 14 LYS HEx 1.0 . 3.01 217 194 A 14 LYS HDy A 14 LYS HEx 1.0 . 3.01 218 194 A 14 LYS HEy A 14 LYS HDx 1.0 . 3.01 219 194 A 14 LYS HDy A 14 LYS HEy 1.0 . 3.01 220 195 A 33 LYS HA A 33 LYS HEy 1.0 . 5.50 221 196 A 40 LEU HBy A 41 PRO HDx 1.0 . 5.50 222 197 A 40 LEU H A 40 LEU HBx 1.0 . 3.97 223 198 A 9 ASP HBy A 18 GLN HGx 1.0 . 4.21 224 199 A 9 ASP HBy A 9 ASP H 1.0 . 3.85 225 200 A 19 ASN H A 9 ASP HBx 1.0 . 5.35 226 201 A 10 TRP H A 9 ASP HBx 1.0 . 3.84 227 202 A 18 GLN HGx A 9 ASP HBx 1.0 . 4.23 228 203 A 21 LYS HBy A 9 ASP HBx 1.0 . 4.54 229 204 A 20 PHE H A 20 PHE HBy 1.0 . 3.56 230 205 A 20 PHE HBy A 23 ARG HGy 1.0 . 4.33 231 206 A 13 ASN H A 13 ASN HBx 1.0 . 4.20 232 207 A 13 ASN HD2y A 13 ASN HBx 1.0 . 4.05 233 208 A 36 ALA HA A 13 ASN HBx 1.0 . 4.54 234 209 A 27 PHE H A 27 PHE HBy 1.0 . 3.80 235 210 A 27 PHE HBx A 23 ARG HDx 1.0 . 3.94 236 210 A 23 ARG HDy A 27 PHE HBx 1.0 . 3.94 237 211 A 8 GLU HA A 8 GLU HGy 1.0 . 3.96 238 212 A 8 GLU HA A 8 GLU HGx 1.0 . 3.89 239 213 A 35 GLU HA A 35 GLU HGy 1.0 . 4.02 240 214 A 8 GLU H A 8 GLU HGx 1.0 . 5.50 241 215 A 8 GLU HBx A 8 GLU HGx 1.0 . 2.67 242 216 A 37 GLU HA A 37 GLU HGx 1.0 . 3.59 243 216 A 37 GLU HGy A 37 GLU HA 1.0 . 3.59 244 217 A 18 GLN HGx A 18 GLN H 1.0 . 5.36 245 218 A 18 GLN HGx A 18 GLN HBx 1.0 . 2.60 246 219 A 24 GLU HA A 24 GLU HGx 1.0 . 4.08 247 219 A 24 GLU HA A 24 GLU HGy 1.0 . 4.08 248 220 A 18 GLN H A 17 VAL HB 1.0 . 4.07 249 221 A 38 GLN HA A 38 GLN HGy 1.0 . 3.27 250 221 A 38 GLN HA A 38 GLN HGx 1.0 . 3.27 251 222 A 28 LYS HBy A 28 LYS H 1.0 . 3.70 252 223 A 28 LYS HBy A 29 CYS H 1.0 . 3.92 253 224 A 39 LYS H A 39 LYS HBy 1.0 . 3.86 254 225 A 24 GLU HA A 33 LYS HBy 1.0 . 4.59 255 226 A 33 LYS HBx A 33 LYS HEx 1.0 . 5.13 256 227 A 14 LYS HBx A 14 LYS H 1.0 . 3.36 257 228 A 14 LYS HBx A 14 LYS HGy 1.0 . 2.96 258 228 A 14 LYS HBx A 14 LYS HGx 1.0 . 2.96 259 229 A 14 LYS HBx A 31 VAL HGx% 1.0 . 3.85 260 230 A 33 LYS HBx A 10 TRP HZ2 1.0 . 5.29 261 231 A 33 LYS HBx A 24 GLU HA 1.0 . 4.57 262 232 A 32 PRO HBy A 25 LYS HGx 1.0 . 4.63 263 232 A 32 PRO HBy A 25 LYS HGy 1.0 . 4.63 264 233 A 21 LYS HBy A 21 LYS H 1.0 . 3.59 265 234 A 21 LYS HBy A 22 ARG H 1.0 . 5.43 266 235 A 33 LYS HBx A 36 ALA HB% 1.0 . 5.50 267 236 A 15 CYS H A 15 CYS HBy 1.0 . 4.17 268 237 A 31 VAL HB A 31 VAL H 1.0 . 3.32 269 238 A 15 CYS HBy A 17 VAL HGx% 1.0 . 4.50 270 239 A 15 CYS HBx A 17 VAL HGx% 1.0 . 4.31 271 240 A 31 VAL HB A 32 PRO HDx 1.0 . 4.17 272 241 A 29 CYS H A 29 CYS HBy 1.0 . 4.14 273 242 A 29 CYS H A 29 CYS HBx 1.0 . 3.78 274 243 A 29 CYS HBy A 29 CYS HA 1.0 . 3.00 275 244 A 29 CYS HBx A 28 LYS HGy 1.0 . 4.30 276 245 A 10 TRP HBy A 36 ALA HA 1.0 . 5.50 277 246 A 11 LEU H A 10 TRP HBx 1.0 . 3.88 278 247 A 10 TRP HBx A 37 GLU HGx 1.0 . 4.62 279 247 A 37 GLU HGy A 10 TRP HBx 1.0 . 4.62 280 248 A 12 CYS HBy A 16 GLY H 1.0 . 4.48 281 249 A 12 CYS HBy A 17 VAL HGx% 1.0 . 4.19 282 250 A 12 CYS HBx A 12 CYS H 1.0 . 3.34 283 251 A 12 CYS HBx A 10 TRP HZ3 1.0 . 4.47 284 252 A 12 CYS HBx A 17 VAL HGx% 1.0 . 4.24 285 253 A 9 ASP H A 8 GLU HBx 1.0 . 4.91 286 254 A 10 TRP HBy A 37 GLU HGx 1.0 . 4.29 287 254 A 37 GLU HGy A 10 TRP HBy 1.0 . 4.29 288 255 A 23 ARG HBx A 20 PHE H 1.0 . 4.25 289 256 A 26 CYS HBy A 31 VAL H 1.0 . 3.63 290 257 A 26 CYS HBy A 31 VAL HGx% 1.0 . 5.25 291 258 A 26 CYS HBy A 31 VAL HB 1.0 . 5.30 292 259 A 35 GLU H A 35 GLU HBx 1.0 . 4.02 293 260 A 31 VAL HGy% A 35 GLU HBx 1.0 . 4.23 294 261 A 33 LYS HGy A 37 GLU HBx 1.0 . 4.72 295 261 A 37 GLU HBy A 33 LYS HGy 1.0 . 4.72 296 262 A 33 LYS HGx A 37 GLU HBx 1.0 . 4.87 297 262 A 33 LYS HGx A 37 GLU HBy 1.0 . 4.87 298 263 A 20 PHE HD% A 22 ARG HBx 1.0 . 4.49 299 264 A 18 GLN HBx A 18 GLN H 1.0 . 3.49 300 265 A 38 GLN H A 38 GLN HBy 1.0 . 3.96 301 266 A 19 ASN H A 18 GLN HBy 1.0 . 5.50 302 267 A 21 LYS HBy A 21 LYS HDx 1.0 . 3.30 303 267 A 21 LYS HBy A 21 LYS HDy 1.0 . 3.30 304 268 A 9 ASP HA A 21 LYS HDx 1.0 . 5.34 305 268 A 9 ASP HA A 21 LYS HDy 1.0 . 5.34 306 269 A 23 ARG HBx A 23 ARG HGy 1.0 . 2.91 307 270 A 23 ARG HA A 23 ARG HGx 1.0 . 4.22 308 271 A 31 VAL HA A 32 PRO HGy 1.0 . 5.00 309 272 A 40 LEU H A 40 LEU HG 1.0 . 5.19 310 273 A 11 LEU H A 11 LEU HG 1.0 . 4.45 311 274 A 27 PHE HBx A 28 LYS HGx 1.0 . 4.56 312 275 A 28 LYS HGy A 28 LYS HA 1.0 . 4.04 313 276 A 28 LYS HGx A 28 LYS HA 1.0 . 4.10 314 277 A 25 LYS HA A 32 PRO HA 1.0 . 2.79 315 278 A 14 LYS H A 14 LYS HGy 1.0 . 5.49 316 278 A 14 LYS H A 14 LYS HGx 1.0 . 5.49 317 279 A 14 LYS HDx A 14 LYS HGy 1.0 . 2.62 318 279 A 14 LYS HDy A 14 LYS HGy 1.0 . 2.62 319 279 A 14 LYS HGx A 14 LYS HDx 1.0 . 2.62 320 279 A 14 LYS HDy A 14 LYS HGx 1.0 . 2.62 321 280 A 11 LEU HDy% A 11 LEU HA 1.0 . 3.92 322 281 A 11 LEU HDy% A 18 GLN HA 1.0 . 4.13 323 282 A 11 LEU HBy A 11 LEU HDy% 1.0 . 3.52 324 283 A 32 PRO HA A 25 LYS HGx 1.0 . 3.42 325 283 A 32 PRO HA A 25 LYS HGy 1.0 . 3.42 326 284 A 32 PRO HA A 33 LYS H 1.0 . 2.80 327 285 A 32 PRO HA A 25 LYS HBx 1.0 . 3.77 328 285 A 32 PRO HA A 25 LYS HBy 1.0 . 3.77 329 286 A 32 PRO HBx A 34 SER HBy 1.0 . 5.50 330 287 A 34 SER H A 34 SER HBy 1.0 . 3.71 331 288 A 34 SER H A 34 SER HBx 1.0 . 3.75 332 289 A 32 PRO HBx A 34 SER HBx 1.0 . 4.80 333 290 A 31 VAL HA A 25 LYS HGx 1.0 . 5.50 334 290 A 25 LYS HGy A 31 VAL HA 1.0 . 5.50 335 291 A 25 LYS HEx A 25 LYS HGx 1.0 . 3.72 336 291 A 25 LYS HEy A 25 LYS HGx 1.0 . 3.72 337 291 A 25 LYS HGy A 25 LYS HEx 1.0 . 3.72 338 291 A 25 LYS HGy A 25 LYS HEy 1.0 . 3.72 339 292 A 25 LYS HBx A 25 LYS HGx 1.0 . 2.87 340 292 A 25 LYS HBy A 25 LYS HGx 1.0 . 2.87 341 292 A 25 LYS HGy A 25 LYS HBx 1.0 . 2.87 342 292 A 25 LYS HBy A 25 LYS HGy 1.0 . 2.87 343 293 A 21 LYS H A 21 LYS HGy 1.0 . 4.49 344 294 A 31 VAL HGx% A 14 LYS HEx 1.0 . 4.25 345 294 A 31 VAL HGx% A 14 LYS HEy 1.0 . 4.25 346 295 A 31 VAL H A 31 VAL HGx% 1.0 . 3.21 347 296 A 31 VAL HGx% A 32 PRO HDx 1.0 . 4.61 348 297 A 31 VAL HGx% A 14 LYS HGy 1.0 . 4.06 349 297 A 31 VAL HGx% A 14 LYS HGx 1.0 . 4.06 350 298 A 34 SER H A 33 LYS HGy 1.0 . 4.94 351 299 A 31 VAL HA A 32 PRO HDy 1.0 . 2.69 352 300 A 31 VAL HGx% A 31 VAL HA 1.0 . 3.04 353 301 A 33 LYS H A 33 LYS HGy 1.0 . 5.18 354 302 A 40 LEU H A 40 LEU HDx% 1.0 . 5.25 355 302 A 40 LEU H A 40 LEU HDy% 1.0 . 5.25 356 303 A 17 VAL HA A 17 VAL HGx% 1.0 . 3.96 357 304 A 17 VAL H A 17 VAL HGx% 1.0 . 4.63 358 305 A 28 LYS H A 17 VAL HGx% 1.0 . 5.50 359 306 A 17 VAL HGy% A 12 CYS HA 1.0 . 5.50 360 307 A 17 VAL HGy% A 12 CYS HBy 1.0 . 4.78 361 308 A 17 VAL HGy% A 27 PHE HZ 1.0 . 3.98 362 309 A 17 VAL HGy% A 17 VAL HA 1.0 . 3.44 363 310 A 17 VAL HGy% A 12 CYS HBx 1.0 . 5.50 364 311 A 27 PHE HBx A 27 PHE HA 1.0 . 3.00 365 312 A 27 PHE HBy A 27 PHE HA 1.0 . 2.80 366 313 A 10 TRP HZ3 A 12 CYS HA 1.0 . 3.59 367 314 A 36 ALA HB% A 12 CYS HA 1.0 . 4.50 368 315 A 31 VAL H A 31 VAL HGy% 1.0 . 3.94 369 316 A 31 VAL HGy% A 31 VAL HA 1.0 . 3.39 370 317 A 31 VAL HGy% A 32 PRO HGx 1.0 . 3.98 371 318 A 31 VAL HGy% A 14 LYS HEx 1.0 . 4.46 372 318 A 31 VAL HGy% A 14 LYS HEy 1.0 . 4.46 373 319 A 13 ASN H A 12 CYS HA 1.0 . 2.99 374 320 A 15 CYS H A 12 CYS HA 1.0 . 5.30 375 321 A 27 PHE H A 26 CYS HA 1.0 . 2.87 376 322 A 27 PHE HD% A 26 CYS HA 1.0 . 3.97 377 323 A 34 SER HBx A 34 SER HA 1.0 . 2.84 378 324 A 33 LYS HEx A 34 SER HA 1.0 . 4.32 379 325 A 26 CYS HA A 25 LYS HBx 1.0 . 5.50 380 325 A 25 LYS HBy A 26 CYS HA 1.0 . 5.50 381 326 A 33 LYS HGy A 34 SER HA 1.0 . 5.24 382 327 A 21 LYS HA A 21 LYS HBx 1.0 . 2.78 383 328 A 36 ALA HB% A 36 ALA H 1.0 . 3.30 384 329 A 10 TRP HZ3 A 36 ALA HB% 1.0 . 4.39 385 330 A 36 ALA HB% A 10 TRP HBx 1.0 . 4.22 386 331 A 36 ALA HB% A 37 GLU HGx 1.0 . 3.97 387 331 A 36 ALA HB% A 37 GLU HGy 1.0 . 3.97 388 332 A 36 ALA HB% A 31 VAL HGy% 1.0 . 3.61 389 333 A 33 LYS HGx A 33 LYS HA 1.0 . 3.78 390 334 A 36 ALA HB% A 33 LYS HA 1.0 . 4.28 391 335 A 33 LYS HA A 34 SER H 1.0 . 3.48 392 336 A 10 TRP HZ3 A 33 LYS HA 1.0 . 5.00 393 337 A 14 LYS HA A 14 LYS HGy 1.0 . 4.20 394 337 A 14 LYS HA A 14 LYS HGx 1.0 . 4.20 395 338 A 23 ARG HA A 25 LYS H 1.0 . 4.70 396 339 A 27 PHE HD% A 28 LYS HA 1.0 . 5.00 397 340 A 28 LYS HBx A 28 LYS HA 1.0 . 3.00 398 341 A 23 ARG HBx A 23 ARG HA 1.0 . 2.99 399 342 A 24 GLU HA A 24 GLU HBy 1.0 . 2.90 400 343 A 21 LYS H A 20 PHE HA 1.0 . 2.80 401 344 A 20 PHE HD% A 20 PHE HA 1.0 . 3.36 402 345 A 37 GLU HA A 38 GLN H 1.0 . 3.35 403 346 A 22 ARG HA A 22 ARG HBy 1.0 . 2.95 404 347 A 22 ARG HGx A 22 ARG HA 1.0 . 3.42 405 348 A 9 ASP H A 8 GLU HA 1.0 . 3.26 406 349 A 39 LYS HA A 39 LYS HGy 1.0 . 3.90 407 350 A 19 ASN H A 18 GLN HA 1.0 . 2.84 408 351 A 18 GLN HGx A 18 GLN HA 1.0 . 3.53 409 352 A 17 VAL HGy% A 18 GLN HA 1.0 . 4.01 410 353 A 21 LYS H A 9 ASP HA 1.0 . 3.57 411 354 A 36 ALA HB% A 10 TRP HA 1.0 . 4.70 412 355 A 25 LYS HA A 33 LYS H 1.0 . 3.12 413 356 A 25 LYS HA A 25 LYS HGx 1.0 . 3.70 414 356 A 25 LYS HA A 25 LYS HGy 1.0 . 3.70 415 357 A 11 LEU H A 10 TRP HA 1.0 . 2.75 416 358 A 10 TRP HBy A 10 TRP HA 1.0 . 2.93 417 359 A 10 TRP HBx A 10 TRP HA 1.0 . 2.93 418 360 A 25 LYS HA A 25 LYS HBx 1.0 . 3.01 419 360 A 25 LYS HA A 25 LYS HBy 1.0 . 3.01 420 361 A 12 CYS H A 11 LEU HA 1.0 . 2.81 421 362 A 11 LEU HDx% A 11 LEU HA 1.0 . 3.58 422 363 A 40 LEU HA A 40 LEU HDx% 1.0 . 4.02 423 363 A 40 LEU HDy% A 40 LEU HA 1.0 . 4.02 424 364 A 31 VAL HGy% A 36 ALA HA 1.0 . 4.74 425 365 A 20 PHE H A 19 ASN HA 1.0 . 2.88 426 366 A 23 ARG HGx A 19 ASN HA 1.0 . 5.11 427 367 A 27 PHE HD% A 19 ASN HA 1.0 . 4.84 428 368 A 27 PHE H A 19 ASN HA 1.0 . 4.67 429 369 A 31 VAL HGy% A 32 PRO HDy 1.0 . 3.80 430 370 A 32 PRO HDx A 31 VAL HA 1.0 . 2.97 431 371 A 31 VAL HGy% A 32 PRO HDx 1.0 . 3.42 432 372 A 41 PRO HDy A 40 LEU HDx% 1.0 . 5.50 433 372 A 40 LEU HDy% A 41 PRO HDy 1.0 . 5.50 434 373 A 40 LEU HA A 41 PRO HDy 1.0 . 3.24 435 374 A 41 PRO HDx A 40 LEU HA 1.0 . 3.27 436 375 A 41 PRO HDx A 40 LEU HBx 1.0 . 3.86 437 376 A 27 PHE H A 27 PHE HE% 1.0 . 5.27 438 377 A 17 VAL HGx% A 27 PHE HE% 1.0 . 4.03 439 378 A 20 PHE HD% A 22 ARG HGx 1.0 . 5.06 440 379 A 17 VAL HGx% A 27 PHE HZ 1.0 . 3.99 441 380 A 10 TRP H A 10 TRP HD1 1.0 . 3.83 442 381 A 9 ASP HA A 10 TRP HD1 1.0 . 4.16 443 382 A 21 LYS HA A 10 TRP HD1 1.0 . 3.15 444 383 A 10 TRP HBx A 10 TRP HD1 1.0 . 3.62 445 384 A 10 TRP HH2 A 25 LYS HA 1.0 . 4.40 446 385 A 10 TRP HH2 A 26 CYS HA 1.0 . 3.94 447 386 A 10 TRP HH2 A 26 CYS HBx 1.0 . 3.77 448 387 A 36 ALA HB% A 10 TRP HH2 1.0 . 4.29 449 388 A 10 TRP HH2 A 12 CYS HA 1.0 . 5.19 450 389 A 36 ALA HB% A 10 TRP HE3 1.0 . 5.34 451 390 A 10 TRP HE3 A 12 CYS HA 1.0 . 3.89 452 391 A 10 TRP HE3 A 10 TRP HBy 1.0 . 3.80 453 392 A 10 TRP HE3 A 37 GLU HGx 1.0 . 5.50 454 392 A 37 GLU HGy A 10 TRP HE3 1.0 . 5.50 455 393 A 25 LYS H A 10 TRP HZ2 1.0 . 4.64 456 394 A 25 LYS HA A 10 TRP HZ2 1.0 . 4.65 457 395 A 10 TRP HZ2 A 26 CYS HA 1.0 . 4.31 458 396 A 23 ARG HBx A 10 TRP HZ2 1.0 . 3.73 459 397 A 19 ASN HBy A 10 TRP HZ2 1.0 . 5.50 460 398 A 33 LYS HA A 10 TRP HZ2 1.0 . 5.12 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 . 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 12 CYS HBx A 15 CYS H 1.0 . 3.05 2 2 A 12 CYS HBx A 15 CYS HA 1.0 . 4.99 3 3 A 12 CYS HBx A 15 CYS HBy 1.0 . 4.99 4 4 A 12 CYS HBx A 26 CYS HBx 1.0 . 4.99 5 5 A 15 CYS H A 29 CYS H 1.0 . 4.99 6 6 A 15 CYS H A 29 CYS HBy 1.0 . 4.52 7 7 A 29 CYS HBy A 15 CYS HA 1.0 . 4.93 8 8 A 29 CYS H A 15 CYS HBy 1.0 . 4.49 9 9 A 15 CYS HBy A 29 CYS HA 1.0 . 4.99 10 10 A 15 CYS HBy A 29 CYS HBy 1.0 . 3.03 11 11 A 29 CYS H A 26 CYS HA 1.0 . 4.98 12 12 A 29 CYS H A 26 CYS HBx 1.0 . 3.31 13 13 A 26 CYS HBx A 29 CYS HA 1.0 . 4.95 14 14 A 26 CYS HBx A 29 CYS HBy 1.0 . 4.95 stop_ save_