data_nef_c34031_5lo2 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 5LO2 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 1 ACE C 1 2 PRO N 1 35 TYR C 1 36 NH2 N stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 0 ACE start . . 2 A 1 PRO middle -H false 3 A 2 PRO middle . false 4 A 3 THR middle . . 5 A 4 LYS middle . . 6 A 5 PRO middle . false 7 A 6 THR middle . . 8 A 7 LYS middle . . 9 A 8 PRO middle . false 10 A 9 GLY middle . false 11 A 10 ASP middle . . 12 A 11 ASN middle . . 13 A 12 ALA middle . . 14 A 13 THR middle . . 15 A 14 PRO middle . false 16 A 15 GLU middle . . 17 A 16 LYS middle . . 18 A 17 LEU middle . . 19 A 18 ALA middle . . 20 A 19 LYS middle . . 21 A 20 TYR middle . . 22 A 21 GLN middle . . 23 A 22 ALA middle . . 24 A 23 ASP middle . . 25 A 24 LEU middle . . 26 A 25 ALA middle . . 27 A 26 LYS middle . . 28 A 27 TYR middle . . 29 A 28 GLN middle . . 30 A 29 LYS middle . . 31 A 30 ASP middle . . 32 A 31 LEU middle . . 33 A 32 ALA middle . . 34 A 33 ASP middle . . 35 A 34 TYR middle -OXT . 36 A 35 NH2 end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 0 ACE H% H 1 2.095 0.001 A 0 ACE CH3 C 13 26.026 0.000 A 1 PRO HA H 1 3.396 0.003 A 1 PRO HBy H 1 1.889 0.000 A 1 PRO HBx H 1 1.708 0.000 A 1 PRO HGy H 1 1.935 0.006 A 1 PRO HGx H 1 1.880 0.005 A 1 PRO HDy H 1 3.568 0.003 A 1 PRO HDx H 1 3.504 0.003 A 1 PRO CA C 13 62.422 0.000 A 1 PRO CD C 13 53.212 0.007 A 2 PRO HA H 1 4.538 0.002 A 2 PRO HBy H 1 2.365 0.000 A 2 PRO HBx H 1 2.101 0.000 A 2 PRO HGy H 1 1.725 0.000 A 2 PRO HGx H 1 1.638 0.002 A 2 PRO HDy H 1 3.216 0.002 A 2 PRO HDx H 1 3.166 0.002 A 3 THR H H 1 8.869 0.001 A 3 THR HA H 1 4.279 0.004 A 3 THR HB H 1 3.926 0.001 A 3 THR HG2% H 1 1.132 0.002 A 3 THR CA C 13 63.880 0.000 A 3 THR CB C 13 71.911 0.000 A 3 THR CG2 C 13 23.571 0.000 A 3 THR N N 15 116.483 0.000 A 4 LYS H H 1 8.782 0.002 A 4 LYS HA H 1 3.074 0.004 A 4 LYS HBy H 1 1.461 0.000 A 4 LYS HBx H 1 1.264 0.000 A 4 LYS HGx H 1 1.215 0.001 A 4 LYS HGy H 1 1.550 0.000 A 4 LYS HDx H 1 0.711 0.006 A 4 LYS HDy H 1 1.269 0.006 A 4 LYS HE2 H 1 2.972 0.000 A 4 LYS HE3 H 1 2.972 0.000 A 4 LYS CA C 13 56.565 0.000 A 4 LYS CD C 13 26.452 0.000 A 4 LYS N N 15 129.223 0.000 A 5 PRO HA H 1 4.511 0.001 A 5 PRO HBy H 1 2.400 0.000 A 5 PRO HBx H 1 2.036 0.000 A 5 PRO HGy H 1 1.718 0.000 A 5 PRO HGx H 1 1.596 0.000 A 5 PRO HDx H 1 3.072 0.003 A 5 PRO HDy H 1 3.470 0.005 A 5 PRO CD C 13 52.338 0.000 A 6 THR H H 1 8.802 0.001 A 6 THR HA H 1 4.126 0.005 A 6 THR HB H 1 3.936 0.002 A 6 THR HG2% H 1 1.177 0.003 A 6 THR CA C 13 64.357 0.000 A 6 THR CG2 C 13 23.766 0.000 A 6 THR N N 15 117.999 0.000 A 7 LYS H H 1 8.727 0.001 A 7 LYS HA H 1 3.476 0.004 A 7 LYS HBx H 1 1.520 0.003 A 7 LYS HBy H 1 1.583 0.008 A 7 LYS HGy H 1 1.340 0.002 A 7 LYS HGx H 1 1.018 0.004 A 7 LYS HD2 H 1 1.569 0.000 A 7 LYS HD3 H 1 1.569 0.000 A 7 LYS HEy H 1 2.946 0.001 A 7 LYS HEx H 1 2.810 0.000 A 7 LYS CA C 13 56.994 0.000 A 7 LYS N N 15 128.051 0.000 A 8 PRO HA H 1 4.363 0.004 A 8 PRO HBy H 1 2.163 0.002 A 8 PRO HBx H 1 1.782 0.005 A 8 PRO HGx H 1 1.692 0.001 A 8 PRO HGy H 1 1.694 0.000 A 8 PRO HDy H 1 3.050 0.006 A 8 PRO HDx H 1 2.810 0.003 A 8 PRO CA C 13 64.618 0.000 A 8 PRO CD C 13 52.290 0.013 A 9 GLY H H 1 8.372 0.002 A 9 GLY HAy H 1 4.036 0.011 A 9 GLY HAx H 1 3.867 0.011 A 9 GLY CA C 13 46.268 0.022 A 9 GLY N N 15 106.627 0.000 A 10 ASP H H 1 8.543 0.002 A 10 ASP HA H 1 4.337 0.005 A 10 ASP HBy H 1 2.603 0.000 A 10 ASP HBx H 1 2.527 0.000 A 10 ASP CA C 13 58.105 0.000 A 10 ASP N N 15 117.579 0.000 A 11 ASN H H 1 8.642 0.002 A 11 ASN HA H 1 4.677 0.004 A 11 ASN HB2 H 1 2.860 0.001 A 11 ASN HB3 H 1 2.860 0.001 A 11 ASN HD21 H 1 7.729 0.002 A 11 ASN HD22 H 1 7.027 0.003 A 11 ASN CA C 13 54.784 0.000 A 11 ASN N N 15 114.637 0.000 A 11 ASN ND2 N 15 112.004 0.003 A 12 ALA H H 1 7.437 0.002 A 12 ALA HA H 1 4.297 0.004 A 12 ALA HB% H 1 1.397 0.003 A 12 ALA CA C 13 54.501 0.000 A 12 ALA CB C 13 21.949 0.000 A 12 ALA N N 15 120.776 0.000 A 13 THR H H 1 7.735 0.002 A 13 THR HA H 1 4.572 0.003 A 13 THR HB H 1 4.830 0.003 A 13 THR HG2% H 1 1.454 0.002 A 13 THR CB C 13 70.310 0.000 A 13 THR CG2 C 13 24.583 0.000 A 13 THR N N 15 110.025 0.000 A 14 PRO HA H 1 4.248 0.003 A 14 PRO HBy H 1 2.089 0.002 A 14 PRO HBx H 1 1.974 0.001 A 14 PRO HGx H 1 2.260 0.004 A 14 PRO HGy H 1 2.430 0.002 A 14 PRO HDy H 1 3.984 0.002 A 14 PRO HDx H 1 3.924 0.006 A 14 PRO CA C 13 67.781 0.000 A 14 PRO CD C 13 52.411 0.042 A 15 GLU H H 1 9.072 0.002 A 15 GLU HA H 1 4.162 0.002 A 15 GLU HBy H 1 2.137 0.004 A 15 GLU HBx H 1 1.970 0.002 A 15 GLU HGy H 1 2.399 0.002 A 15 GLU HGx H 1 2.330 0.004 A 15 GLU CG C 13 38.623 0.005 A 15 GLU N N 15 116.535 0.000 A 16 LYS H H 1 7.868 0.002 A 16 LYS HA H 1 4.175 0.000 A 16 LYS HBy H 1 2.069 0.000 A 16 LYS HBx H 1 1.832 0.000 A 16 LYS N N 15 120.854 0.000 A 17 LEU H H 1 8.415 0.003 A 17 LEU HA H 1 4.145 0.006 A 17 LEU HBy H 1 1.872 0.000 A 17 LEU HBx H 1 1.647 0.000 A 17 LEU HDx% H 1 0.865 0.001 A 17 LEU HDy% H 1 0.889 0.003 A 17 LEU N N 15 120.506 0.000 A 18 ALA H H 1 8.421 0.001 A 18 ALA HA H 1 4.250 0.001 A 18 ALA HB% H 1 1.515 0.000 A 18 ALA N N 15 121.147 0.000 A 19 LYS H H 1 8.015 0.002 A 19 LYS HA H 1 4.208 0.000 A 19 LYS HBy H 1 2.024 0.001 A 19 LYS HBx H 1 1.967 0.001 A 19 LYS N N 15 119.801 0.000 A 20 TYR H H 1 7.948 0.002 A 20 TYR HA H 1 4.563 0.001 A 20 TYR HBx H 1 3.132 0.001 A 20 TYR HBy H 1 3.221 0.001 A 20 TYR HD1 H 1 7.157 0.001 A 20 TYR HD2 H 1 7.157 0.001 A 20 TYR HE1 H 1 6.813 0.000 A 20 TYR HE2 H 1 6.813 0.000 A 20 TYR CA C 13 61.731 0.000 A 20 TYR CD1 C 13 135.299 0.000 A 20 TYR CD2 C 13 135.299 0.000 A 20 TYR CE1 C 13 120.231 0.000 A 20 TYR CE2 C 13 120.231 0.000 A 20 TYR N N 15 117.805 0.000 A 21 GLN H H 1 8.105 0.002 A 21 GLN HA H 1 3.670 0.004 A 21 GLN HBy H 1 2.204 0.001 A 21 GLN HBx H 1 2.167 0.000 A 21 GLN HG2 H 1 2.621 0.003 A 21 GLN HG3 H 1 2.621 0.003 A 21 GLN HE21 H 1 7.749 0.001 A 21 GLN HE22 H 1 7.096 0.000 A 21 GLN CA C 13 60.802 0.000 A 21 GLN CG C 13 35.715 0.000 A 21 GLN N N 15 115.182 0.000 A 21 GLN NE2 N 15 110.989 0.021 A 22 ALA H H 1 7.928 0.000 A 22 ALA HA H 1 4.246 0.004 A 22 ALA HB% H 1 1.563 0.000 A 22 ALA N N 15 121.988 0.000 A 23 ASP H H 1 9.182 0.002 A 23 ASP HA H 1 4.418 0.002 A 23 ASP HBy H 1 2.856 0.000 A 23 ASP HBx H 1 2.448 0.004 A 23 ASP N N 15 121.151 0.000 A 24 LEU H H 1 9.211 0.001 A 24 LEU HA H 1 3.943 0.004 A 24 LEU HBy H 1 1.567 0.002 A 24 LEU HBx H 1 1.404 0.000 A 24 LEU HDx% H 1 0.974 0.002 A 24 LEU HDy% H 1 0.829 0.002 A 24 LEU CA C 13 59.899 0.000 A 24 LEU N N 15 123.853 0.000 A 25 ALA H H 1 7.771 0.002 A 25 ALA HA H 1 4.203 0.001 A 25 ALA HB% H 1 1.518 0.000 A 25 ALA N N 15 120.513 0.000 A 26 LYS H H 1 7.896 0.002 A 26 LYS HA H 1 4.114 0.000 A 26 LYS HBy H 1 2.002 0.004 A 26 LYS HBx H 1 1.930 0.002 A 26 LYS N N 15 118.682 0.000 A 27 TYR H H 1 8.260 0.002 A 27 TYR HA H 1 4.428 0.002 A 27 TYR HBy H 1 3.276 0.003 A 27 TYR HBx H 1 3.225 0.003 A 27 TYR HD1 H 1 7.033 0.004 A 27 TYR HD2 H 1 7.033 0.004 A 27 TYR HE1 H 1 6.629 0.003 A 27 TYR HE2 H 1 6.629 0.003 A 27 TYR CD1 C 13 135.496 0.000 A 27 TYR CD2 C 13 135.496 0.000 A 27 TYR CE1 C 13 119.793 0.000 A 27 TYR CE2 C 13 119.793 0.000 A 27 TYR N N 15 119.014 0.000 A 28 GLN H H 1 8.407 0.001 A 28 GLN HA H 1 3.616 0.004 A 28 GLN HBy H 1 2.193 0.000 A 28 GLN HBx H 1 2.044 0.000 A 28 GLN HGy H 1 2.701 0.005 A 28 GLN HGx H 1 2.576 0.002 A 28 GLN HE21 H 1 7.507 0.001 A 28 GLN HE22 H 1 7.028 0.000 A 28 GLN CA C 13 60.871 0.000 A 28 GLN N N 15 115.373 0.000 A 28 GLN NE2 N 15 109.304 0.001 A 29 LYS H H 1 7.601 0.002 A 29 LYS HA H 1 4.106 0.003 A 29 LYS HBy H 1 2.057 0.000 A 29 LYS HBx H 1 1.911 0.000 A 29 LYS N N 15 120.365 0.000 A 30 ASP H H 1 8.988 0.002 A 30 ASP HA H 1 4.327 0.000 A 30 ASP HBy H 1 2.744 0.000 A 30 ASP HBx H 1 2.510 0.001 A 30 ASP N N 15 119.696 0.000 A 31 LEU H H 1 8.986 0.002 A 31 LEU HA H 1 3.825 0.003 A 31 LEU HBy H 1 1.498 0.003 A 31 LEU HBx H 1 1.379 0.000 A 31 LEU HDx% H 1 0.964 0.002 A 31 LEU HDy% H 1 0.820 0.001 A 31 LEU CA C 13 59.772 0.000 A 31 LEU N N 15 121.186 0.000 A 32 ALA H H 1 7.584 0.003 A 32 ALA HA H 1 4.109 0.000 A 32 ALA HB% H 1 1.522 0.000 A 32 ALA N N 15 121.270 0.000 A 33 ASP H H 1 8.152 0.002 A 33 ASP HA H 1 4.424 0.001 A 33 ASP HB2 H 1 2.707 0.003 A 33 ASP HB3 H 1 2.707 0.003 A 33 ASP N N 15 116.230 0.000 A 34 TYR H H 1 7.957 0.003 A 34 TYR HA H 1 4.164 0.002 A 34 TYR HBx H 1 3.033 0.000 A 34 TYR HBy H 1 3.221 0.000 A 34 TYR HD1 H 1 7.162 0.001 A 34 TYR HD2 H 1 7.162 0.001 A 34 TYR HE1 H 1 6.766 0.002 A 34 TYR HE2 H 1 6.766 0.002 A 34 TYR CD1 C 13 135.304 0.000 A 34 TYR CD2 C 13 135.304 0.000 A 34 TYR CE1 C 13 120.077 0.000 A 34 TYR CE2 C 13 120.077 0.000 A 34 TYR N N 15 120.249 0.000 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 28 GLN H A 31 LEU H 1.0 1.9770 5.1590 2 1 A 28 GLN H A 30 ASP H 1.0 1.9770 5.1590 3 2 A 31 LEU H A 33 ASP H 1.0 1.9770 5.1630 4 2 A 30 ASP H A 33 ASP H 1.0 1.9770 5.1630 5 3 A 34 TYR H A 33 ASP HB3 1.0 1.8750 4.1270 6 3 A 34 TYR H A 33 ASP HB2 1.0 1.8750 4.1270 7 4 A 17 LEU HBy A 18 ALA H 1.0 1.6720 3.0900 8 4 A 17 LEU H A 17 LEU HBy 1.0 1.6720 3.0900 9 5 A 18 ALA H A 17 LEU HA 1.0 1.7520 3.4320 10 5 A 17 LEU H A 17 LEU HA 1.0 1.7520 3.4320 11 5 A 17 LEU H A 16 LYS HA 1.0 1.7520 3.4320 12 6 A 16 LYS HA A 16 LYS H 1.0 1.7360 3.3600 13 6 A 16 LYS H A 15 GLU HA 1.0 1.7360 3.3600 14 7 A 31 LEU H A 27 TYR HA 1.0 1.9010 4.3190 15 7 A 30 ASP H A 27 TYR HA 1.0 1.9010 4.3190 16 8 A 31 LEU H A 30 ASP HA 1.0 1.7690 3.5130 17 8 A 30 ASP H A 30 ASP HA 1.0 1.7690 3.5130 18 9 A 11 ASN H A 11 ASN HB3 1.0 1.8360 3.8720 19 9 A 11 ASN H A 11 ASN HB2 1.0 1.8360 3.8720 20 10 A 31 LEU H A 30 ASP HBx 1.0 1.8400 3.8980 21 10 A 30 ASP H A 30 ASP HBx 1.0 1.8400 3.8980 22 11 A 17 LEU H A 17 LEU HDy% 1.0 1.9490 4.7790 23 11 A 18 ALA H A 17 LEU HDy% 1.0 1.9490 4.7790 24 12 A 34 TYR H A 34 TYR HBy 1.0 1.6950 3.1810 25 12 A 20 TYR H A 20 TYR HBx 1.0 1.6950 3.1810 26 13 A 11 ASN HB3 A 11 ASN HD22 1.0 1.7010 3.2070 27 13 A 11 ASN HB2 A 11 ASN HD22 1.0 1.7010 3.2070 28 14 A 18 ALA H A 17 LEU HA 1.0 1.7520 3.4300 29 14 A 17 LEU H A 17 LEU HA 1.0 1.7520 3.4300 30 15 A 11 ASN HB2 A 11 ASN HD21 1.0 1.9830 5.2750 31 15 A 11 ASN HB3 A 11 ASN HD21 1.0 1.9830 5.2750 32 16 A 21 GLN H A 22 ALA H 1.0 1.7060 3.2280 33 16 A 20 TYR H A 21 GLN H 1.0 1.7060 3.2280 34 17 A 28 GLN HGy A 28 GLN HE22 1.0 1.9870 5.3850 35 17 A 28 GLN HGy A 27 TYR HD2 1.0 1.9870 5.3850 36 17 A 28 GLN HGy A 27 TYR HD1 1.0 1.9870 5.3850 37 18 A 5 PRO HDy A 5 PRO HGy 1.0 1.7650 3.4930 38 18 A 7 LYS HA A 7 LYS HBx 1.0 1.7650 3.4930 39 19 A 1 PRO HDx A 1 PRO HGy 1.0 1.9590 4.9010 40 19 A 1 PRO HDx A 1 PRO HBx 1.0 1.9590 4.9010 41 20 A 16 LYS HA A 19 LYS HBy 1.0 1.7390 3.3730 42 20 A 15 GLU HA A 15 GLU HBy 1.0 1.7390 3.3730 43 21 A 29 LYS HBy A 29 LYS HA 1.0 1.6080 2.8520 44 21 A 26 LYS HBy A 26 LYS HA 1.0 1.6080 2.8520 45 22 A 25 ALA HA A 28 GLN HBx 1.0 1.7160 3.2660 46 22 A 16 LYS HA A 19 LYS HBx 1.0 1.7160 3.2660 47 23 A 15 GLU HBy A 14 PRO HDx 1.0 1.9890 5.4030 48 23 A 14 PRO HBy A 14 PRO HDx 1.0 1.9890 5.4030 49 24 A 31 LEU HDx% A 31 LEU HBy 1.0 1.8960 4.2860 50 24 A 24 LEU HBx A 24 LEU HDx% 1.0 1.8960 4.2860 51 25 A 30 ASP H A 29 LYS H 1.0 1.7140 3.2580 52 25 A 31 LEU H A 32 ALA H 1.0 1.7140 3.2580 53 26 A 20 TYR H A 20 TYR HD1 1.0 1.8900 4.2300 54 26 A 20 TYR H A 20 TYR HD2 1.0 1.8900 4.2300 55 26 A 34 TYR H A 34 TYR HD2 1.0 1.8900 4.2300 56 26 A 34 TYR H A 34 TYR HD1 1.0 1.8900 4.2300 57 27 A 12 ALA H A 13 THR H 1.0 1.9980 5.7860 58 27 A 11 ASN HD22 A 12 ALA H 1.0 1.9980 5.7860 59 28 A 31 LEU H A 29 LYS HA 1.0 1.8610 4.0270 60 28 A 30 ASP H A 29 LYS HA 1.0 1.8610 4.0270 61 28 A 30 ASP H A 26 LYS HA 1.0 1.8610 4.0270 62 29 A 31 LEU H A 33 ASP HB3 1.0 1.9520 4.8100 63 29 A 30 ASP H A 33 ASP HB3 1.0 1.9520 4.8100 64 29 A 31 LEU H A 33 ASP HB2 1.0 1.9520 4.8100 65 29 A 30 ASP H A 33 ASP HB2 1.0 1.9520 4.8100 66 29 A 31 LEU H A 28 GLN HGy 1.0 1.9520 4.8100 67 30 A 21 GLN HE21 A 21 GLN HG2 1.0 1.9930 5.5390 68 30 A 21 GLN HG3 A 21 GLN HE21 1.0 1.9930 5.5390 69 31 A 18 ALA H A 18 ALA HA 1.0 1.6960 3.1860 70 31 A 17 LEU H A 14 PRO HA 1.0 1.6960 3.1860 71 32 A 22 ALA H A 19 LYS HA 1.0 1.8550 3.9910 72 32 A 20 TYR H A 19 LYS HA 1.0 1.8550 3.9910 73 33 A 34 TYR H A 34 TYR HA 1.0 1.8020 3.6800 74 33 A 17 LEU HA A 20 TYR H 1.0 1.8020 3.6800 75 34 A 32 ALA H A 32 ALA HA 1.0 1.6630 3.0530 76 34 A 29 LYS HA A 29 LYS H 1.0 1.6630 3.0530 77 35 A 27 TYR HD1 A 24 LEU HA 1.0 1.9630 4.9510 78 35 A 27 TYR HD2 A 24 LEU HA 1.0 1.9630 4.9510 79 35 A 27 TYR HD2 A 3 THR HB 1.0 1.9630 4.9510 80 35 A 27 TYR HD1 A 3 THR HB 1.0 1.9630 4.9510 81 36 A 20 TYR HD2 A 5 PRO HA 1.0 2.7200 5.2840 82 36 A 1 PRO HDx A 34 TYR HD2 1.0 2.7200 5.2840 83 36 A 7 LYS HA A 20 TYR HD1 1.0 2.7200 5.2840 84 36 A 1 PRO HDx A 34 TYR HD1 1.0 2.7200 5.2840 85 36 A 7 LYS HA A 20 TYR HD2 1.0 2.7200 5.2840 86 36 A 20 TYR HD1 A 5 PRO HA 1.0 2.7200 5.2840 87 37 A 34 TYR HBy A 34 TYR HD1 1.0 1.6220 2.9020 88 37 A 34 TYR HBy A 34 TYR HD2 1.0 1.6220 2.9020 89 37 A 20 TYR HBx A 20 TYR HD2 1.0 1.6220 2.9020 90 37 A 20 TYR HBx A 20 TYR HD1 1.0 1.6220 2.9020 91 38 A 11 ASN HB3 A 12 ALA H 1.0 1.9810 5.2450 92 38 A 11 ASN HB2 A 12 ALA H 1.0 1.9810 5.2450 93 39 A 33 ASP H A 33 ASP HB3 1.0 1.7110 3.2490 94 39 A 33 ASP H A 33 ASP HB2 1.0 1.7110 3.2490 95 40 A 29 LYS H A 29 LYS HBx 1.0 1.7120 3.2520 96 40 A 28 GLN HBx A 29 LYS H 1.0 1.7120 3.2520 97 41 A 1 PRO HGy A 34 TYR HE1 1.0 2.4100 4.8960 98 41 A 1 PRO HGy A 34 TYR HE2 1.0 2.4100 4.8960 99 41 A 1 PRO HBx A 34 TYR HE2 1.0 2.4100 4.8960 100 41 A 1 PRO HBx A 34 TYR HE1 1.0 2.4100 4.8960 101 42 A 27 TYR H A 26 LYS HGx 1.0 1.9560 4.8460 102 42 A 27 TYR H A 25 ALA HB% 1.0 1.9560 4.8460 103 42 A 27 TYR H A 26 LYS HGy 1.0 1.9560 4.8460 104 43 A 34 TYR H A 32 ALA HB% 1.0 1.9300 4.5700 105 43 A 22 ALA H A 18 ALA HB% 1.0 1.9300 4.5700 106 43 A 20 TYR H A 19 LYS HGx 1.0 1.9300 4.5700 107 43 A 20 TYR H A 19 LYS HGy 1.0 1.9300 4.5700 108 43 A 20 TYR H A 18 ALA HB% 1.0 1.9300 4.5700 109 44 A 31 LEU H A 31 LEU HBx 1.0 1.9050 4.3510 110 44 A 31 LEU H A 32 ALA HB% 1.0 1.9050 4.3510 111 45 A 28 GLN H A 31 LEU HBy 1.0 1.9460 4.7300 112 45 A 17 LEU H A 12 ALA HB% 1.0 1.9460 4.7300 113 46 A 29 LYS H A 24 LEU HDy% 1.0 1.9540 4.8260 114 46 A 32 ALA H A 31 LEU HDy% 1.0 1.9540 4.8260 115 47 A 17 LEU H A 17 LEU HDx% 1.0 1.9250 4.5250 116 47 A 18 ALA H A 17 LEU HDx% 1.0 1.9250 4.5250 117 48 A 21 GLN HG2 A 21 GLN HE22 1.0 1.7420 3.3860 118 48 A 21 GLN HG3 A 21 GLN HE22 1.0 1.7420 3.3860 119 49 A 21 GLN HG3 A 21 GLN HA 1.0 1.7720 3.5260 120 49 A 21 GLN HG2 A 21 GLN HA 1.0 1.7720 3.5260 121 50 A 11 ASN HB3 A 11 ASN HA 1.0 1.6420 2.9760 122 50 A 11 ASN HB2 A 11 ASN HA 1.0 1.6420 2.9760 123 51 A 33 ASP HB3 A 33 ASP HA 1.0 1.7290 3.3270 124 51 A 33 ASP HB2 A 33 ASP HA 1.0 1.7290 3.3270 125 52 A 33 ASP HB3 A 30 ASP HA 1.0 1.8040 3.6900 126 52 A 33 ASP HB2 A 30 ASP HA 1.0 1.8040 3.6900 127 53 A 21 GLN HBy A 22 ALA HA 1.0 1.9910 5.5010 128 53 A 18 ALA HA A 21 GLN HBy 1.0 1.9910 5.5010 129 54 A 25 ALA HA A 25 ALA HB% 1.0 1.5170 2.5490 130 54 A 19 LYS HA A 19 LYS HGy 1.0 1.5170 2.5490 131 55 A 16 LYS HA A 19 LYS HGy 1.0 1.9240 4.1020 132 55 A 16 LYS HA A 18 ALA HB% 1.0 1.9240 4.1020 133 55 A 15 GLU HA A 18 ALA HB% 1.0 1.9240 4.1020 134 55 A 16 LYS HA A 19 LYS HGx 1.0 1.9240 4.1020 135 56 A 24 LEU HDx% A 28 GLN HA 1.0 1.9980 5.7560 136 56 A 31 LEU HDx% A 28 GLN HA 1.0 1.9980 5.7560 137 57 A 32 ALA HB% A 33 ASP HA 1.0 1.8950 4.2710 138 57 A 26 LYS HGx A 23 ASP HA 1.0 1.8950 4.2710 139 57 A 27 TYR HA A 26 LYS HGx 1.0 1.8950 4.2710 140 57 A 25 ALA HB% A 23 ASP HA 1.0 1.8950 4.2710 141 58 A 13 THR HA A 16 LYS HBx 1.0 1.9930 6.4990 142 58 A 14 PRO HGx A 13 THR HA 1.0 1.9930 6.4990 143 59 A 19 LYS HBy A 20 TYR HA 1.0 1.9990 6.2410 144 59 A 15 GLU HBy A 13 THR HA 1.0 1.9990 6.2410 145 59 A 14 PRO HBy A 13 THR HA 1.0 1.9990 6.2410 146 60 A 27 TYR HA A 26 LYS HBy 1.0 1.9490 4.7770 147 60 A 26 LYS HBy A 23 ASP HA 1.0 1.9490 4.7770 148 61 A 24 LEU HDy% A 27 TYR HBx 1.0 1.8330 3.8530 149 61 A 34 TYR HBy A 31 LEU HDy% 1.0 1.8330 3.8530 150 62 A 22 ALA H A 21 GLN HG2 1.0 1.9990 5.8210 151 62 A 22 ALA H A 21 GLN HG3 1.0 1.9990 5.8210 152 62 A 20 TYR H A 21 GLN HG3 1.0 1.9990 5.8210 153 63 A 21 GLN HG3 A 21 GLN HBx 1.0 1.7010 3.2070 154 63 A 21 GLN HG2 A 21 GLN HBx 1.0 1.7010 3.2070 155 64 A 21 GLN HG2 A 21 GLN HBy 1.0 1.7300 3.3280 156 64 A 21 GLN HG3 A 21 GLN HBy 1.0 1.7300 3.3280 157 65 A 21 GLN HG2 A 18 ALA HA 1.0 1.9060 4.3600 158 65 A 21 GLN HG3 A 18 ALA HA 1.0 1.9060 4.3600 159 66 A 7 LYS HA A 7 LYS HBx 1.0 1.8340 3.8640 160 66 A 7 LYS HA A 7 LYS HD3 1.0 1.8340 3.8640 161 67 A 33 ASP HB3 A 32 ALA HB% 1.0 1.9620 4.9260 162 67 A 28 GLN HGy A 25 ALA HB% 1.0 1.9620 4.9260 163 67 A 33 ASP HB2 A 32 ALA HB% 1.0 1.9620 4.9260 164 68 A 7 LYS HEx A 7 LYS HD2 1.0 1.7230 3.2990 165 68 A 7 LYS HD3 A 7 LYS HEx 1.0 1.7230 3.2990 166 69 A 34 TYR HBy A 34 TYR HE1 1.0 1.9350 4.6150 167 69 A 34 TYR HBy A 34 TYR HE2 1.0 1.9350 4.6150 168 69 A 34 TYR HE2 A 2 PRO HDy 1.0 1.9350 4.6150 169 69 A 34 TYR HE1 A 2 PRO HDy 1.0 1.9350 4.6150 170 70 A 34 TYR HE2 A 2 PRO HGx 1.0 1.9980 6.2460 171 70 A 34 TYR HE1 A 2 PRO HGx 1.0 1.9980 6.2460 172 70 A 34 TYR HE2 A 1 PRO HBy 1.0 1.9980 6.2460 173 70 A 34 TYR HE1 A 1 PRO HBy 1.0 1.9980 6.2460 174 71 A 27 TYR HBx A 27 TYR HE1 1.0 1.9720 5.0700 175 71 A 27 TYR HBx A 27 TYR HE2 1.0 1.9720 5.0700 176 71 A 2 PRO HDy A 27 TYR HE2 1.0 1.9720 5.0700 177 71 A 2 PRO HDy A 27 TYR HE1 1.0 1.9720 5.0700 178 72 A 1 PRO HGy A 34 TYR HD1 1.0 1.9610 4.9150 179 72 A 1 PRO HGy A 34 TYR HD2 1.0 1.9610 4.9150 180 72 A 1 PRO HBx A 34 TYR HD2 1.0 1.9610 4.9150 181 72 A 1 PRO HBx A 34 TYR HD1 1.0 1.9610 4.9150 182 73 A 31 LEU H A 31 LEU HBx 1.0 1.8930 4.2590 183 73 A 30 ASP H A 29 LYS HGx 1.0 1.8930 4.2590 184 73 A 31 LEU H A 32 ALA HB% 1.0 1.8930 4.2590 185 74 A 26 LYS HGx A 26 LYS HBx 1.0 1.7420 3.3840 186 74 A 26 LYS HGy A 26 LYS HBx 1.0 1.7420 3.3840 187 74 A 19 LYS HBx A 19 LYS HGy 1.0 1.7420 3.3840 188 74 A 19 LYS HBx A 19 LYS HGx 1.0 1.7420 3.3840 189 75 A 26 LYS HBy A 26 LYS HGy 1.0 1.7680 3.5060 190 75 A 29 LYS HBy A 29 LYS HGx 1.0 1.7680 3.5060 191 75 A 29 LYS HBy A 29 LYS HGy 1.0 1.7680 3.5060 192 76 A 29 LYS HA A 29 LYS HBx 1.0 1.7460 3.4060 193 76 A 26 LYS HA A 29 LYS HBx 1.0 1.7460 3.4060 194 77 A 25 ALA HA A 28 GLN HBx 1.0 1.7900 3.6220 195 77 A 19 LYS HBx A 19 LYS HA 1.0 1.7900 3.6220 196 78 A 32 ALA HA A 32 ALA HB% 1.0 1.4730 2.4210 197 78 A 29 LYS HA A 29 LYS HGy 1.0 1.4730 2.4210 198 78 A 26 LYS HA A 26 LYS HGy 1.0 1.4730 2.4210 199 79 A 10 ASP HBy A 10 ASP HA 1.0 1.8580 4.0060 200 79 A 30 ASP HA A 30 ASP HBx 1.0 1.8580 4.0060 201 80 A 22 ALA H A 23 ASP H 1.0 1.7120 3.2520 202 81 A 16 LYS H A 15 GLU H 1.0 1.7640 3.4840 203 82 A 24 LEU H A 25 ALA H 1.0 1.7560 3.4520 204 83 A 30 ASP H A 29 LYS H 1.0 1.7050 3.2250 205 84 A 11 ASN H A 12 ALA H 1.0 1.8250 3.8090 206 85 A 27 TYR H A 26 LYS H 1.0 1.7550 3.4450 207 86 A 33 ASP H A 32 ALA H 1.0 1.7170 3.2750 208 87 A 18 ALA H A 19 LYS H 1.0 1.7060 3.2240 209 88 A 17 LEU H A 16 LYS H 1.0 1.6970 3.1870 210 89 A 28 GLN H A 29 LYS H 1.0 1.7620 3.4820 211 90 A 31 LEU H A 32 ALA H 1.0 1.6850 3.1410 212 91 A 28 GLN H A 27 TYR HD2 1.0 1.9700 5.0360 213 91 A 28 GLN H A 27 TYR HD1 1.0 1.9700 5.0360 214 92 A 20 TYR HD1 A 24 LEU HDy% 1.0 2.9550 5.0850 215 92 A 20 TYR HD2 A 24 LEU HDy% 1.0 2.9550 5.0850 216 93 A 29 LYS H A 28 GLN HBy 1.0 1.9330 4.6030 217 94 A 29 LYS HBy A 29 LYS H 1.0 1.7640 3.4860 218 95 A 32 ALA H A 32 ALA HA 1.0 1.6540 3.0180 219 96 A 34 TYR HBy A 34 TYR HD2 1.0 1.6940 3.1780 220 96 A 34 TYR HBy A 34 TYR HD1 1.0 1.6940 3.1780 221 97 A 20 TYR H A 20 TYR HBx 1.0 1.6750 3.1030 222 98 A 21 GLN H A 20 TYR HBy 1.0 1.8350 3.8670 223 99 A 20 TYR H A 20 TYR HBy 1.0 1.7350 3.3550 224 100 A 34 TYR H A 34 TYR HBx 1.0 1.7570 3.4510 225 101 A 13 THR H A 13 THR HA 1.0 1.7680 3.5080 226 102 A 13 THR H A 12 ALA HA 1.0 1.5680 2.7140 227 103 A 19 LYS HBx A 19 LYS H 1.0 1.7280 3.3220 228 104 A 19 LYS HBy A 19 LYS H 1.0 1.7280 3.3220 229 105 A 26 LYS HBx A 26 LYS H 1.0 1.7350 3.3530 230 106 A 26 LYS HBy A 26 LYS H 1.0 1.7660 3.4960 231 107 A 13 THR H A 16 LYS HBx 1.0 1.9000 4.3100 232 108 A 28 GLN H A 28 GLN HBy 1.0 1.9000 4.3120 233 109 A 17 LEU H A 16 LYS HBy 1.0 1.8770 4.1370 234 110 A 10 ASP H A 9 GLY HAy 1.0 1.8020 3.6820 235 111 A 9 GLY H A 9 GLY HAx 1.0 1.7340 3.3520 236 112 A 27 TYR H A 27 TYR HBy 1.0 1.7630 3.4850 237 113 A 9 GLY H A 8 PRO HA 1.0 1.5820 2.7600 238 114 A 18 ALA H A 18 ALA HA 1.0 1.6840 3.1380 239 115 A 27 TYR HA A 27 TYR H 1.0 1.7950 3.6450 240 116 A 33 ASP H A 33 ASP HA 1.0 1.7570 3.4530 241 117 A 26 LYS HA A 26 LYS H 1.0 1.7610 3.4770 242 118 A 22 ALA H A 22 ALA HA 1.0 1.7280 3.3200 243 119 A 34 TYR H A 34 TYR HA 1.0 1.8050 3.6990 244 120 A 3 THR H A 2 PRO HA 1.0 1.5860 2.7760 245 121 A 5 PRO HA A 6 THR H 1.0 1.5580 2.6820 246 122 A 4 LYS H A 3 THR HA 1.0 1.5500 2.6560 247 123 A 15 GLU HA A 15 GLU H 1.0 1.7420 3.3860 248 124 A 7 LYS H A 6 THR HA 1.0 2.1500 3.4540 249 125 A 15 GLU H A 13 THR HB 1.0 1.7870 3.6030 250 126 A 11 ASN H A 11 ASN HA 1.0 1.8030 3.6850 251 127 A 23 ASP HA A 23 ASP H 1.0 1.8020 3.6800 252 128 A 11 ASN H A 10 ASP HA 1.0 1.8510 3.9670 253 129 A 10 ASP HA A 10 ASP H 1.0 1.8410 3.9030 254 130 A 22 ALA HA A 23 ASP H 1.0 1.9230 4.5070 255 131 A 6 THR H A 6 THR HB 1.0 1.6940 3.1760 256 132 A 3 THR HB A 3 THR H 1.0 1.7450 3.3970 257 133 A 14 PRO HDx A 15 GLU H 1.0 1.8740 4.1240 258 134 A 7 LYS HA A 7 LYS H 1.0 1.8190 3.7790 259 135 A 28 GLN H A 27 TYR HBy 1.0 1.8250 3.8110 260 136 A 4 LYS H A 4 LYS HA 1.0 1.8530 3.9750 261 137 A 23 ASP H A 23 ASP HBx 1.0 1.7840 3.5880 262 138 A 20 TYR H A 20 TYR HA 1.0 1.8200 3.7800 263 139 A 30 ASP H A 30 ASP HBy 1.0 1.7710 3.5210 264 140 A 15 GLU H A 15 GLU HBx 1.0 1.7950 3.6450 265 141 A 30 ASP H A 29 LYS HBx 1.0 1.7990 3.6630 266 142 A 15 GLU HBy A 15 GLU H 1.0 1.7200 3.2840 267 143 A 24 LEU H A 24 LEU HBy 1.0 1.7450 3.3990 268 144 A 31 LEU H A 31 LEU HBx 1.0 1.8750 4.1210 269 145 A 4 LYS H A 4 LYS HBx 1.0 1.7970 3.6550 270 146 A 4 LYS H A 4 LYS HBy 1.0 1.7880 3.6100 271 147 A 24 LEU HDx% A 24 LEU H 1.0 1.8850 4.1930 272 148 A 31 LEU H A 31 LEU HDx% 1.0 1.8870 4.2130 273 149 A 7 LYS H A 7 LYS HBy 1.0 1.8950 4.2710 274 150 A 10 ASP HBy A 10 ASP H 1.0 1.7630 3.4830 275 151 A 10 ASP H A 10 ASP HBx 1.0 1.8410 3.9050 276 152 A 28 GLN H A 28 GLN HGx 1.0 1.9730 5.0850 277 153 A 11 ASN H A 11 ASN HB2 1.0 1.8520 3.9700 278 154 A 20 TYR HBx A 21 GLN H 1.0 1.9840 5.2960 279 155 A 21 GLN H A 21 GLN HBy 1.0 1.9330 4.6030 280 156 A 28 GLN H A 27 TYR HBx 1.0 1.9760 5.1380 281 157 A 28 GLN H A 28 GLN HA 1.0 1.7890 3.6110 282 158 A 27 TYR H A 27 TYR HBx 1.0 1.7450 3.3990 283 159 A 21 GLN H A 21 GLN HA 1.0 1.7900 3.6200 284 160 A 3 THR H A 3 THR HA 1.0 1.8670 4.0710 285 161 A 6 THR H A 6 THR HA 1.0 1.7810 3.5710 286 162 A 7 LYS H A 6 THR HB 1.0 1.8870 4.2110 287 163 A 10 ASP H A 9 GLY HAx 1.0 1.7960 3.6480 288 164 A 9 GLY HAy A 9 GLY H 1.0 1.8000 3.6680 289 165 A 19 LYS HA A 19 LYS H 1.0 1.7490 3.4150 290 166 A 25 ALA HA A 25 ALA H 1.0 1.7560 3.4480 291 167 A 29 LYS HA A 29 LYS H 1.0 1.7060 3.2260 292 168 A 27 TYR HD2 A 28 GLN HA 1.0 1.9520 4.8120 293 168 A 27 TYR HD1 A 28 GLN HA 1.0 1.9520 4.8120 294 169 A 4 LYS H A 4 LYS HGx 1.0 1.9150 4.4290 295 170 A 14 PRO HDx A 13 THR HB 1.0 1.7060 3.2280 296 171 A 13 THR HB A 14 PRO HDy 1.0 1.8990 4.3010 297 172 A 13 THR HA A 14 PRO HDy 1.0 1.5560 2.6760 298 173 A 14 PRO HDx A 13 THR HA 1.0 1.7730 3.5290 299 174 A 20 TYR HBx A 20 TYR HA 1.0 1.7470 3.4050 300 175 A 20 TYR HA A 20 TYR HBy 1.0 1.9330 4.6010 301 176 A 20 TYR HA A 23 ASP HBx 1.0 1.8900 4.2380 302 177 A 6 THR HA A 6 THR HG2% 1.0 1.6990 3.1950 303 178 A 8 PRO HDx A 8 PRO HDy 1.0 1.5350 2.6070 304 179 A 5 PRO HDy A 5 PRO HDx 1.0 1.4650 2.3990 305 180 A 34 TYR HBy A 34 TYR HA 1.0 1.6880 3.1540 306 181 A 15 GLU HA A 15 GLU HGy 1.0 1.8480 3.9500 307 182 A 17 LEU HA A 20 TYR HBy 1.0 1.8150 3.7530 308 183 A 24 LEU HA A 27 TYR HBy 1.0 1.8280 3.8280 309 184 A 24 LEU HA A 27 TYR HBx 1.0 1.7940 3.6380 310 185 A 34 TYR HBy A 31 LEU HA 1.0 2.1860 4.5000 311 186 A 34 TYR HBx A 31 LEU HA 1.0 1.8850 4.1970 312 187 A 14 PRO HDx A 14 PRO HGy 1.0 1.8980 4.2960 313 188 A 33 ASP H A 34 TYR H 1.0 1.7480 3.4120 314 189 A 25 ALA H A 26 LYS H 1.0 1.7590 3.4610 315 190 A 28 GLN HGx A 28 GLN HE21 1.0 1.9480 4.7540 316 191 A 28 GLN HE22 A 28 GLN HGx 1.0 1.9810 5.2350 317 192 A 8 PRO HA A 8 PRO HBy 1.0 1.8020 3.6800 318 193 A 8 PRO HDx A 8 PRO HGy 1.0 1.8730 4.1110 319 194 A 7 LYS HA A 8 PRO HDx 1.0 1.7000 3.2020 320 195 A 8 PRO HDx A 8 PRO HBy 1.0 1.9400 4.6740 321 196 A 6 THR H A 5 PRO HBy 1.0 1.9960 5.6560 322 197 A 6 THR H A 5 PRO HBx 1.0 1.9620 4.9360 323 198 A 3 THR H A 2 PRO HBy 1.0 1.9470 4.7550 324 199 A 7 LYS HA A 7 LYS HGy 1.0 1.8740 4.1200 325 200 A 7 LYS HA A 7 LYS HBy 1.0 1.8010 3.6730 326 201 A 14 PRO HGx A 14 PRO HGy 1.0 1.5930 2.7990 327 202 A 28 GLN HBx A 28 GLN HBy 1.0 1.5630 2.6970 328 203 A 27 TYR HA A 27 TYR HBy 1.0 1.9120 4.4160 329 204 A 28 GLN HGy A 28 GLN HA 1.0 1.8870 4.2130 330 205 A 28 GLN HA A 28 GLN HGx 1.0 1.8680 4.0760 331 206 A 14 PRO HA A 14 PRO HBx 1.0 1.7600 3.4680 332 207 A 14 PRO HGx A 14 PRO HDy 1.0 1.8880 4.2160 333 208 A 28 GLN HBx A 28 GLN HA 1.0 1.8250 3.8090 334 209 A 21 GLN HA A 21 GLN HBy 1.0 1.7100 3.2460 335 210 A 28 GLN HA A 28 GLN HBy 1.0 1.7930 3.6310 336 211 A 4 LYS HA A 4 LYS HDx 1.0 2.2200 4.7820 337 212 A 31 LEU HBx A 28 GLN HA 1.0 1.9590 4.8970 338 213 A 24 LEU HA A 24 LEU H 1.0 1.8170 3.7630 339 214 A 21 GLN HA A 24 LEU H 1.0 1.9160 4.4460 340 215 A 29 LYS H A 28 GLN HA 1.0 1.9620 4.9380 341 216 A 19 LYS HBy A 19 LYS HA 1.0 1.6730 3.0930 342 217 A 19 LYS HA A 22 ALA HB% 1.0 1.7040 3.2200 343 218 A 5 PRO HA A 5 PRO HBx 1.0 1.7890 3.6110 344 219 A 12 ALA HB% A 16 LYS HBx 1.0 1.9590 4.8950 345 220 A 31 LEU HBx A 31 LEU HA 1.0 1.8510 3.9670 346 221 A 18 ALA HA A 21 GLN HBx 1.0 1.8070 3.7090 347 222 A 15 GLU HA A 15 GLU HGx 1.0 1.7800 3.5660 348 223 A 17 LEU HBy A 14 PRO HA 1.0 1.7980 3.6620 349 224 A 14 PRO HA A 14 PRO HGx 1.0 1.9650 4.9710 350 225 A 31 LEU H A 28 GLN HA 1.0 1.9580 4.8800 351 226 A 34 TYR H A 31 LEU HA 1.0 1.9180 4.4620 352 227 A 24 LEU HA A 24 LEU HBy 1.0 1.8880 4.2240 353 228 A 15 GLU HBy A 15 GLU HGx 1.0 1.8600 4.0200 354 229 A 16 LYS HBx A 16 LYS HBy 1.0 1.5610 2.6930 355 230 A 20 TYR HBx A 20 TYR HBy 1.0 1.5240 2.5720 356 231 A 4 LYS HDx A 4 LYS HDy 1.0 1.6790 3.1170 357 232 A 4 LYS HGx A 4 LYS HDx 1.0 1.7340 3.3460 358 233 A 4 LYS HBx A 4 LYS HBy 1.0 1.6030 2.8330 359 234 A 4 LYS HBx A 4 LYS HGx 1.0 1.8230 3.7950 360 235 A 16 LYS HA A 16 LYS HBy 1.0 1.7890 3.6150 361 236 A 6 THR HA A 6 THR HB 1.0 1.6320 2.9360 362 237 A 3 THR HB A 3 THR HA 1.0 1.8050 3.6930 363 238 A 28 GLN H A 27 TYR H 1.0 1.8310 3.8390 364 239 A 27 TYR HE2 A 4 LYS H 1.0 1.9430 4.7090 365 239 A 27 TYR HE1 A 4 LYS H 1.0 1.9430 4.7090 366 240 A 21 GLN H A 20 TYR HD2 1.0 1.9610 4.9150 367 240 A 21 GLN H A 20 TYR HD1 1.0 1.9610 4.9150 368 241 A 20 TYR H A 19 LYS H 1.0 1.8960 4.2780 369 242 A 27 TYR HD2 A 27 TYR H 1.0 1.9710 5.0710 370 242 A 27 TYR HD1 A 27 TYR H 1.0 1.9710 5.0710 371 243 A 21 GLN HE21 A 21 GLN HE22 1.0 1.2660 1.8880 372 244 A 11 ASN HD22 A 11 ASN HD21 1.0 1.3260 2.0300 373 245 A 28 GLN HE22 A 28 GLN HE21 1.0 1.2750 1.9090 374 246 A 27 TYR HD2 A 27 TYR HE1 1.0 1.4750 2.4270 375 246 A 27 TYR HD1 A 27 TYR HE2 1.0 1.4750 2.4270 376 246 A 27 TYR HD1 A 27 TYR HE1 1.0 1.4750 2.4270 377 246 A 27 TYR HD2 A 27 TYR HE2 1.0 1.4750 2.4270 378 247 A 34 TYR HD2 A 34 TYR HE1 1.0 1.4220 2.2760 379 247 A 34 TYR HD2 A 34 TYR HE2 1.0 1.4220 2.2760 380 247 A 34 TYR HD1 A 34 TYR HE2 1.0 1.4220 2.2760 381 247 A 34 TYR HD1 A 34 TYR HE1 1.0 1.4220 2.2760 382 248 A 31 LEU H A 31 LEU HA 1.0 1.8230 3.7990 383 249 A 5 PRO HA A 5 PRO HBy 1.0 1.7420 3.3820 384 250 A 13 THR HA A 13 THR HG2% 1.0 1.4970 2.4910 385 251 A 2 PRO HDy A 1 PRO HA 1.0 1.6740 3.0960 386 252 A 28 GLN HGy A 28 GLN HE22 1.0 1.9980 5.7980 387 253 A 28 GLN HGy A 28 GLN HE21 1.0 1.8800 4.1660 388 254 A 2 PRO HA A 2 PRO HBy 1.0 1.9090 4.3810 389 255 A 1 PRO HDx A 1 PRO HGy 1.0 1.9560 4.8520 390 256 A 1 PRO HGy A 1 PRO HDy 1.0 1.7940 3.6420 391 257 A 1 PRO HBx A 1 PRO HA 1.0 1.7130 3.2570 392 258 A 1 PRO HDx A 1 PRO HGx 1.0 1.8330 3.8510 393 259 A 1 PRO HDy A 1 PRO HGx 1.0 1.9090 4.3890 394 260 A 17 LEU H A 17 LEU HBx 1.0 2.1100 3.6420 395 261 A 18 ALA H A 18 ALA HB% 1.0 1.5220 2.5680 396 262 A 17 LEU H A 17 LEU HDy% 1.0 1.9110 4.4010 397 263 A 17 LEU H A 17 LEU HDx% 1.0 1.8880 4.2120 398 264 A 23 ASP HA A 26 LYS H 1.0 1.9200 4.4720 399 265 A 27 TYR HA A 27 TYR HD2 1.0 1.7940 3.6380 400 265 A 27 TYR HA A 27 TYR HD1 1.0 1.7940 3.6380 401 266 A 33 ASP H A 30 ASP HA 1.0 1.9180 4.4640 402 267 A 12 ALA H A 12 ALA HA 1.0 1.7740 3.5340 403 268 A 21 GLN H A 18 ALA HA 1.0 1.8740 4.1200 404 269 A 22 ALA HA A 25 ALA H 1.0 1.8870 4.2110 405 270 A 16 LYS HA A 19 LYS H 1.0 1.8380 3.8820 406 271 A 34 TYR HD2 A 34 TYR HA 1.0 1.7530 3.4350 407 271 A 34 TYR HD1 A 34 TYR HA 1.0 1.7530 3.4350 408 272 A 33 ASP H A 32 ALA HA 1.0 1.8770 4.1410 409 273 A 24 LEU HA A 27 TYR H 1.0 1.8840 4.1840 410 274 A 34 TYR HD2 A 1 PRO HA 1.0 1.8800 4.1540 411 274 A 34 TYR HD1 A 1 PRO HA 1.0 1.8800 4.1540 412 275 A 34 TYR HE2 A 1 PRO HA 1.0 1.8560 4.0020 413 275 A 34 TYR HE1 A 1 PRO HA 1.0 1.8560 4.0020 414 276 A 27 TYR HD2 A 27 TYR HBy 1.0 1.7520 3.4320 415 276 A 27 TYR HD1 A 27 TYR HBy 1.0 1.7520 3.4320 416 277 A 27 TYR HD2 A 27 TYR HBx 1.0 1.7130 3.2530 417 277 A 27 TYR HD1 A 27 TYR HBx 1.0 1.7130 3.2530 418 278 A 20 TYR HD2 A 20 TYR HBy 1.0 1.7680 3.5080 419 278 A 20 TYR HD1 A 20 TYR HBy 1.0 1.7680 3.5080 420 279 A 27 TYR HD2 A 4 LYS HA 1.0 1.7700 3.5180 421 279 A 27 TYR HD1 A 4 LYS HA 1.0 1.7700 3.5180 422 280 A 27 TYR HE2 A 4 LYS HA 1.0 1.8820 4.1760 423 280 A 27 TYR HE1 A 4 LYS HA 1.0 1.8820 4.1760 424 281 A 34 TYR HD2 A 34 TYR HBx 1.0 1.6740 3.0980 425 281 A 34 TYR HD1 A 34 TYR HBx 1.0 1.6740 3.0980 426 282 A 28 GLN H A 28 GLN HGy 1.0 1.7890 3.6150 427 283 A 21 GLN H A 21 GLN HG3 1.0 1.7140 3.2580 428 284 A 20 TYR HD2 A 21 GLN HG3 1.0 1.9340 4.6120 429 284 A 20 TYR HD1 A 21 GLN HG3 1.0 1.9340 4.6120 430 285 A 30 ASP H A 30 ASP HBx 1.0 1.8120 3.7320 431 286 A 15 GLU H A 14 PRO HBx 1.0 1.8490 3.9570 432 287 A 22 ALA H A 21 GLN HBx 1.0 1.8690 4.0850 433 288 A 21 GLN H A 21 GLN HBx 1.0 1.7460 3.4060 434 289 A 22 ALA H A 21 GLN HBy 1.0 1.9760 5.1420 435 290 A 16 LYS H A 15 GLU HBx 1.0 1.9980 5.7460 436 291 A 27 TYR HE2 A 2 PRO HBy 1.0 1.8590 4.0170 437 291 A 27 TYR HE1 A 2 PRO HBy 1.0 1.8590 4.0170 438 292 A 27 TYR HD2 A 2 PRO HBy 1.0 1.7350 3.3510 439 292 A 27 TYR HD1 A 2 PRO HBy 1.0 1.7350 3.3510 440 293 A 16 LYS H A 16 LYS HBx 1.0 2.0210 3.5910 441 294 A 28 GLN H A 28 GLN HBx 1.0 1.7190 3.2830 442 295 A 20 TYR HD2 A 5 PRO HBx 1.0 1.8380 3.8880 443 295 A 20 TYR HD1 A 5 PRO HBx 1.0 1.8380 3.8880 444 296 A 20 TYR H A 19 LYS HBx 1.0 1.8370 3.8770 445 297 A 27 TYR H A 26 LYS HBx 1.0 1.8490 3.9510 446 298 A 30 ASP H A 29 LYS HBy 1.0 1.9730 5.0850 447 299 A 16 LYS H A 16 LYS HBy 1.0 1.8090 3.7210 448 300 A 2 PRO HGx A 27 TYR HE2 1.0 1.9040 4.3440 449 300 A 2 PRO HGx A 27 TYR HE1 1.0 1.9040 4.3440 450 301 A 20 TYR HD2 A 5 PRO HGx 1.0 1.9480 4.7640 451 301 A 20 TYR HD1 A 5 PRO HGx 1.0 1.9480 4.7640 452 302 A 7 LYS HBx A 7 LYS H 1.0 1.7060 3.2260 453 303 A 25 ALA H A 24 LEU HBy 1.0 1.9670 3.7010 454 304 A 23 ASP H A 22 ALA HB% 1.0 1.6580 3.0340 455 305 A 22 ALA H A 22 ALA HB% 1.0 1.4650 2.3950 456 306 A 33 ASP H A 32 ALA HB% 1.0 1.6170 2.8790 457 307 A 32 ALA H A 32 ALA HB% 1.0 1.5400 2.6240 458 308 A 25 ALA HB% A 26 LYS H 1.0 1.6980 3.1940 459 309 A 25 ALA HB% A 25 ALA H 1.0 1.4780 2.4360 460 310 A 18 ALA HB% A 19 LYS H 1.0 1.6980 3.1940 461 311 A 13 THR H A 13 THR HG2% 1.0 1.5090 2.5270 462 312 A 12 ALA H A 12 ALA HB% 1.0 1.4730 2.4210 463 313 A 13 THR H A 12 ALA HB% 1.0 1.6600 3.0400 464 314 A 6 THR H A 6 THR HG2% 1.0 2.0280 3.6220 465 315 A 7 LYS H A 6 THR HG2% 1.0 2.2050 3.4410 466 316 A 3 THR H A 3 THR HG2% 1.0 1.9430 4.7170 467 317 A 4 LYS H A 3 THR HG2% 1.0 1.6380 2.9580 468 318 A 24 LEU HDy% A 24 LEU H 1.0 1.8910 4.2450 469 319 A 28 GLN H A 24 LEU HDy% 1.0 1.8780 4.1480 470 320 A 24 LEU HDy% A 25 ALA H 1.0 2.1010 4.5230 471 321 A 24 LEU HDy% A 28 GLN HE21 1.0 2.4680 4.2720 472 322 A 27 TYR HD1 A 31 LEU HDy% 1.0 2.2860 3.4740 473 322 A 27 TYR HD2 A 31 LEU HDy% 1.0 2.2860 3.4740 474 323 A 31 LEU H A 31 LEU HDy% 1.0 2.3390 4.3910 475 324 A 31 LEU HDy% A 27 TYR HE1 1.0 2.2644 3.3556 476 324 A 31 LEU HDy% A 27 TYR HE2 1.0 2.2644 3.3556 477 325 A 17 LEU H A 17 LEU HA 1.0 1.7580 3.4560 478 326 A 13 THR HA A 13 THR HB 1.0 1.8030 3.6910 479 327 A 1 PRO HA A 2 PRO HDx 1.0 1.6880 3.1520 480 328 A 34 TYR HA A 34 TYR HBx 1.0 1.9090 4.3830 481 329 A 27 TYR HA A 27 TYR HBx 1.0 1.8050 3.6970 482 330 A 8 PRO HA A 8 PRO HBx 1.0 1.7210 3.2890 483 331 A 14 PRO HBy A 14 PRO HA 1.0 1.7770 3.5550 484 332 A 16 LYS HA A 19 LYS HBx 1.0 1.8030 3.6850 485 333 A 26 LYS HBy A 26 LYS HA 1.0 1.6400 2.9660 486 334 A 14 PRO HA A 17 LEU HBx 1.0 1.8890 4.2250 487 335 A 18 ALA HA A 18 ALA HB% 1.0 1.3910 2.1950 488 336 A 17 LEU HA A 17 LEU HBx 1.0 1.7750 3.5390 489 337 A 26 LYS HA A 26 LYS HGx 1.0 2.3130 3.3410 490 337 A 26 LYS HA A 26 LYS HGy 1.0 2.3130 3.3410 491 338 A 15 GLU H A 14 PRO HDy 1.0 1.9990 5.7850 492 339 A 3 THR H A 2 PRO HBx 1.0 1.9940 5.5760 493 340 A 15 GLU H A 15 GLU HGx 1.0 1.9790 6.8330 494 341 A 14 PRO HDy A 14 PRO HGy 1.0 1.7590 3.4650 495 342 A 14 PRO HDy A 13 THR HG2% 1.0 1.9310 4.5910 496 343 A 14 PRO HDx A 13 THR HG2% 1.0 1.9110 4.3990 497 344 A 6 THR HB A 6 THR HG2% 1.0 1.4340 2.3120 498 345 A 3 THR HB A 3 THR HG2% 1.0 1.4610 2.3870 499 346 A 24 LEU HA A 24 LEU HDy% 1.0 1.4950 2.4850 500 347 A 31 LEU HDy% A 31 LEU HA 1.0 1.9719 3.6340 501 348 A 31 LEU HDy% A 28 GLN HA 1.0 2.2590 4.4230 502 349 A 24 LEU HDx% A 21 GLN HA 1.0 1.9220 4.4920 503 350 A 31 LEU HDx% A 31 LEU HA 1.0 1.7250 3.3050 504 351 A 1 PRO HBy A 1 PRO HA 1.0 1.8920 4.2480 505 352 A 7 LYS HA A 7 LYS HBx 1.0 1.8410 3.9050 506 353 A 21 GLN HA A 24 LEU HBy 1.0 1.7680 3.5060 507 354 A 3 THR HA A 3 THR HG2% 1.0 1.5630 2.6970 508 355 A 17 LEU HDy% A 14 PRO HA 1.0 1.6610 3.0450 509 356 A 17 LEU HA A 17 LEU HDy% 1.0 1.8660 4.0640 510 357 A 17 LEU HA A 17 LEU HDx% 1.0 1.5140 2.5440 511 358 A 22 ALA HA A 22 ALA HB% 1.0 1.4390 2.3230 512 359 A 13 THR HB A 13 THR HG2% 1.0 1.4810 2.4450 513 360 A 13 THR HA A 14 PRO HGy 1.0 1.9940 6.4780 514 361 A 8 PRO HA A 8 PRO HGy 1.0 1.9250 4.5290 515 362 A 12 ALA HA A 13 THR HG2% 1.0 1.9550 4.8410 516 363 A 12 ALA HB% A 12 ALA HA 1.0 1.4940 2.4820 517 364 A 14 PRO HBy A 14 PRO HGy 1.0 1.7130 3.2570 518 365 A 28 GLN HGy A 24 LEU HDy% 1.0 1.7360 3.3600 519 366 A 24 LEU HDy% A 28 GLN HGx 1.0 1.9520 4.8120 520 367 A 14 PRO HBy A 14 PRO HDx 1.0 1.9970 5.7310 521 368 A 14 PRO HBy A 14 PRO HDy 1.0 1.9970 6.2970 522 369 A 12 ALA H A 11 ASN HA 1.0 1.7990 3.6610 523 370 A 20 TYR HD2 A 20 TYR HA 1.0 1.8280 3.8300 524 370 A 20 TYR HD1 A 20 TYR HA 1.0 1.8280 3.8300 525 371 A 13 THR H A 16 LYS HBy 1.0 2.8740 5.1120 526 372 A 11 ASN HD21 A 8 PRO HBy 1.0 2.5620 5.5400 527 373 A 22 ALA H A 21 GLN HA 1.0 1.9430 4.7110 528 374 A 21 GLN HA A 25 ALA H 1.0 1.9810 5.2390 529 375 A 32 ALA H A 31 LEU HA 1.0 1.9550 4.8450 530 376 A 21 GLN HA A 21 GLN HBx 1.0 1.8660 4.0600 531 377 A 23 ASP HA A 23 ASP HBy 1.0 1.8770 4.1390 532 378 A 23 ASP HA A 26 LYS HBx 1.0 1.8780 4.1400 533 379 A 15 GLU HA A 14 PRO HBx 1.0 1.9610 4.9170 534 380 A 14 PRO HDy A 14 PRO HBx 1.0 1.9990 5.8290 535 381 A 14 PRO HDx A 14 PRO HBx 1.0 1.9440 4.7160 536 382 A 15 GLU HBy A 15 GLU HBx 1.0 1.5140 2.5400 537 383 A 8 PRO HBy A 8 PRO HBx 1.0 1.5760 2.7400 538 384 A 8 PRO HGy A 8 PRO HGx 1.0 1.6270 2.9150 539 385 A 2 PRO HBy A 2 PRO HBx 1.0 1.6040 2.8380 540 386 A 28 GLN HGy A 28 GLN HBx 1.0 1.8580 4.0080 541 387 A 28 GLN HBx A 28 GLN HGx 1.0 1.8820 4.1680 542 388 A 14 PRO HGy A 14 PRO HBx 1.0 1.9230 4.5050 543 389 A 28 GLN HGy A 28 GLN HBy 1.0 1.9670 4.9950 544 390 A 34 TYR HBy A 34 TYR HBx 1.0 1.6670 3.0670 545 391 A 24 LEU HDx% A 24 LEU HA 1.0 1.8130 3.7410 546 392 A 4 LYS HA A 4 LYS HGx 1.0 1.9550 4.8530 547 393 A 5 PRO HBy A 5 PRO HBx 1.0 1.6120 2.8640 548 394 A 14 PRO HBy A 14 PRO HBx 1.0 1.5250 2.5770 549 395 A 17 LEU HBy A 17 LEU HA 1.0 1.9280 4.5480 550 396 A 2 PRO HDx A 2 PRO HGy 1.0 1.8460 3.9340 551 397 A 31 LEU HDy% A 2 PRO HDx 1.0 2.8500 4.9600 552 398 A 7 LYS H A 7 LYS HGx 1.0 1.9220 4.4920 553 399 A 7 LYS H A 7 LYS HGy 1.0 1.9920 6.5280 554 400 A 5 PRO HDy A 5 PRO HGx 1.0 1.9180 4.4600 555 401 A 7 LYS HGy A 7 LYS HGx 1.0 1.5870 2.7790 556 402 A 7 LYS HEx A 7 LYS HGy 1.0 1.8840 4.1920 557 403 A 7 LYS HEx A 7 LYS HGx 1.0 1.8760 4.1380 558 404 A 7 LYS HA A 7 LYS HGx 1.0 1.9190 4.4730 559 405 A 7 LYS HGy A 7 LYS HEy 1.0 1.9730 5.1010 560 406 A 7 LYS HGx A 7 LYS HEy 1.0 1.9970 6.3270 561 407 A 4 LYS HA A 4 LYS HBy 1.0 1.9230 4.5070 562 408 A 34 TYR HE2 A 34 TYR HBx 1.0 1.9750 5.1350 563 408 A 34 TYR HE1 A 34 TYR HBx 1.0 1.9750 5.1350 564 409 A 34 TYR HE2 A 1 PRO HGx 1.0 1.9990 5.8650 565 409 A 34 TYR HE1 A 1 PRO HGx 1.0 1.9990 5.8650 566 410 A 27 TYR HE2 A 3 THR HA 1.0 1.9850 5.3230 567 410 A 27 TYR HE1 A 3 THR HA 1.0 1.9850 5.3230 568 411 A 34 TYR HA A 34 TYR HE2 1.0 1.9900 5.4320 569 411 A 34 TYR HA A 34 TYR HE1 1.0 1.9900 5.4320 570 412 A 27 TYR HD2 A 5 PRO HDy 1.0 1.9510 4.7950 571 412 A 27 TYR HD1 A 5 PRO HDy 1.0 1.9510 4.7950 572 413 A 24 LEU HDx% A 25 ALA H 1.0 1.9690 4.1810 573 414 A 31 LEU HDx% A 32 ALA H 1.0 1.9430 4.6990 574 415 A 27 TYR H A 24 LEU HDy% 1.0 1.9640 4.9540 575 416 A 4 LYS H A 4 LYS HDx 1.0 1.9350 7.5050 576 417 A 27 TYR HE2 A 4 LYS HDx 1.0 2.7360 5.4340 577 417 A 27 TYR HE1 A 4 LYS HDx 1.0 2.7360 5.4340 578 418 A 34 TYR H A 33 ASP HA 1.0 1.9540 4.8320 579 419 A 13 THR HA A 15 GLU H 1.0 1.9880 5.3760 580 420 A 18 ALA HA A 19 LYS H 1.0 1.9240 4.5160 581 421 A 27 TYR HD2 A 2 PRO HBx 1.0 1.9840 5.3080 582 421 A 27 TYR HD1 A 2 PRO HBx 1.0 1.9840 5.3080 583 422 A 14 PRO HDx A 14 PRO HGx 1.0 1.8210 3.7890 584 423 A 17 LEU HBy A 17 LEU HDy% 1.0 1.6170 2.8810 585 424 A 17 LEU HBy A 17 LEU HDx% 1.0 1.8610 4.0270 586 425 A 31 LEU HDy% A 2 PRO HGx 1.0 2.6570 4.0310 587 426 A 17 LEU HDy% A 17 LEU HBx 1.0 1.5280 2.5840 588 427 A 17 LEU HDx% A 17 LEU HBx 1.0 1.4940 2.4820 589 428 A 31 LEU HBx A 31 LEU HDy% 1.0 1.7450 3.3950 590 429 A 24 LEU HDy% A 24 LEU HBy 1.0 1.6810 3.1250 591 430 A 24 LEU HDx% A 24 LEU HBy 1.0 1.5540 2.6660 592 431 A 31 LEU HDx% A 31 LEU HBx 1.0 1.6050 2.8410 593 432 A 5 PRO HDx A 5 PRO HGx 1.0 1.6720 3.0860 594 433 A 4 LYS HA A 4 LYS HGy 1.0 2.5220 4.0960 595 434 A 5 PRO HGy A 5 PRO HDx 1.0 1.9300 4.5720 596 435 A 2 PRO HDy A 2 PRO HGx 1.0 1.8060 3.6980 597 436 A 2 PRO HGx A 2 PRO HDx 1.0 1.8380 3.8820 598 437 A 2 PRO HDy A 2 PRO HGy 1.0 1.8440 3.9220 599 438 A 31 LEU HA A 2 PRO HGy 1.0 1.9380 4.6480 600 439 A 31 LEU HBy A 31 LEU HA 1.0 1.8950 4.2710 601 440 A 23 ASP H A 23 ASP HBy 1.0 1.9280 4.5540 602 441 A 14 PRO HA A 14 PRO HGy 1.0 1.8870 4.2130 603 442 A 12 ALA HB% A 8 PRO HBy 1.0 3.9000 6.1000 604 443 A 26 LYS HA A 26 LYS HBx 1.0 1.8890 4.2230 605 444 A 15 GLU HA A 15 GLU HBx 1.0 1.7580 3.4600 606 445 A 10 ASP HA A 10 ASP HBx 1.0 1.7550 3.4410 607 446 A 20 TYR HA A 23 ASP H 1.0 1.9520 4.8120 608 447 A 26 LYS HBy A 27 TYR H 1.0 1.9960 5.6300 609 448 A 2 PRO HA A 2 PRO HBx 1.0 1.7390 3.3730 610 449 A 28 GLN H A 25 ALA HA 1.0 1.9050 4.3550 611 450 A 8 PRO HDy A 8 PRO HGx 1.0 1.9850 5.3190 612 451 A 9 GLY H A 8 PRO HBy 1.0 1.9450 4.7390 613 452 A 12 ALA HB% A 9 GLY H 1.0 2.8720 5.1100 614 453 A 9 GLY H A 8 PRO HBx 1.0 1.9810 5.2370 615 454 A 34 TYR HE2 A 1 PRO HDy 1.0 2.6810 4.9370 616 454 A 34 TYR HE1 A 1 PRO HDy 1.0 2.6810 4.9370 617 455 A 17 LEU HDy% A 21 GLN HE22 1.0 3.2660 4.8880 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 3 THR C A 4 LYS N A 4 LYS CA A 4 LYS C 1.0 -110.0 -32.56 PHI 2 2 A 4 LYS N A 4 LYS CA A 4 LYS C A 5 PRO N 1.0 100.0 190.02 PSI 3 3 A 5 PRO C A 6 THR N A 6 THR CA A 6 THR C 1.0 -80.0 -30.50 PHI 4 4 A 6 THR N A 6 THR CA A 6 THR C A 7 LYS N 1.0 -50.0 0.04 PSI 5 5 A 6 THR C A 7 LYS N A 7 LYS CA A 7 LYS C 1.0 -100.0 -47.48 PHI 6 6 A 7 LYS N A 7 LYS CA A 7 LYS C A 8 PRO N 1.0 100.0 201.82 PSI 7 7 A 7 LYS C A 8 PRO N A 8 PRO CA A 8 PRO C 1.0 -90.0 -21.20 PHI 8 8 A 14 PRO C A 15 GLU N A 15 GLU CA A 15 GLU C 1.0 -90.0 -23.50 PHI 9 9 A 15 GLU N A 15 GLU CA A 15 GLU C A 16 LYS N 1.0 -70.0 -0.46 PSI 10 10 A 15 GLU C A 16 LYS N A 16 LYS CA A 16 LYS C 1.0 -90.0 -42.22 PHI 11 11 A 16 LYS N A 16 LYS CA A 16 LYS C A 17 LEU N 1.0 -70.0 0.50 PSI 12 12 A 16 LYS C A 17 LEU N A 17 LEU CA A 17 LEU C 1.0 -90.0 -38.40 PHI 13 13 A 17 LEU N A 17 LEU CA A 17 LEU C A 18 ALA N 1.0 -70.0 -1.36 PSI 14 14 A 17 LEU C A 18 ALA N A 18 ALA CA A 18 ALA C 1.0 -90.0 -38.38 PHI 15 15 A 18 ALA N A 18 ALA CA A 18 ALA C A 19 LYS N 1.0 -60.0 -12.68 PSI 16 16 A 18 ALA C A 19 LYS N A 19 LYS CA A 19 LYS C 1.0 -80.0 -49.90 PHI 17 17 A 19 LYS N A 19 LYS CA A 19 LYS C A 20 TYR N 1.0 -70.0 -19.78 PSI 18 18 A 19 LYS C A 20 TYR N A 20 TYR CA A 20 TYR C 1.0 -80.0 -41.94 PHI 19 19 A 20 TYR N A 20 TYR CA A 20 TYR C A 21 GLN N 1.0 -70.0 -23.80 PSI 20 20 A 20 TYR C A 21 GLN N A 21 GLN CA A 21 GLN C 1.0 -80.0 -43.26 PHI 21 21 A 21 GLN N A 21 GLN CA A 21 GLN C A 22 ALA N 1.0 -70.0 -17.78 PSI 22 22 A 21 GLN C A 22 ALA N A 22 ALA CA A 22 ALA C 1.0 -90.0 -39.96 PHI 23 23 A 22 ALA N A 22 ALA CA A 22 ALA C A 23 ASP N 1.0 -60.0 -12.60 PSI 24 24 A 22 ALA C A 23 ASP N A 23 ASP CA A 23 ASP C 1.0 -90.0 -39.70 PHI 25 25 A 23 ASP N A 23 ASP CA A 23 ASP C A 24 LEU N 1.0 -70.0 -16.94 PSI 26 26 A 23 ASP C A 24 LEU N A 24 LEU CA A 24 LEU C 1.0 -90.0 -39.32 PHI 27 27 A 24 LEU N A 24 LEU CA A 24 LEU C A 25 ALA N 1.0 -70.0 -11.48 PSI 28 28 A 24 LEU C A 25 ALA N A 25 ALA CA A 25 ALA C 1.0 -90.0 -38.76 PHI 29 29 A 25 ALA N A 25 ALA CA A 25 ALA C A 26 LYS N 1.0 -60.0 -17.62 PSI 30 30 A 25 ALA C A 26 LYS N A 26 LYS CA A 26 LYS C 1.0 -80.0 -49.92 PHI 31 31 A 26 LYS N A 26 LYS CA A 26 LYS C A 27 TYR N 1.0 -70.0 -19.82 PSI 32 32 A 26 LYS C A 27 TYR N A 27 TYR CA A 27 TYR C 1.0 -80.0 -48.12 PHI 33 33 A 27 TYR N A 27 TYR CA A 27 TYR C A 28 GLN N 1.0 -70.0 -20.04 PSI 34 34 A 27 TYR C A 28 GLN N A 28 GLN CA A 28 GLN C 1.0 -80.0 -30.44 PHI 35 35 A 28 GLN N A 28 GLN CA A 28 GLN C A 29 LYS N 1.0 -60.0 -29.48 PSI 36 36 A 28 GLN C A 29 LYS N A 29 LYS CA A 29 LYS C 1.0 -90.0 -40.18 PHI 37 37 A 29 LYS N A 29 LYS CA A 29 LYS C A 30 ASP N 1.0 -70.0 -14.30 PSI 38 38 A 29 LYS C A 30 ASP N A 30 ASP CA A 30 ASP C 1.0 -90.0 -39.94 PHI 39 39 A 30 ASP N A 30 ASP CA A 30 ASP C A 31 LEU N 1.0 -60.0 -20.66 PSI 40 40 A 30 ASP C A 31 LEU N A 31 LEU CA A 31 LEU C 1.0 -90.0 -39.94 PHI 41 41 A 31 LEU N A 31 LEU CA A 31 LEU C A 32 ALA N 1.0 -70.0 -19.60 PSI 42 42 A 31 LEU C A 32 ALA N A 32 ALA CA A 32 ALA C 1.0 -90.0 -39.36 PHI 43 43 A 32 ALA N A 32 ALA CA A 32 ALA C A 33 ASP N 1.0 -70.0 -13.10 PSI stop_ save_