data_nef_c18043_2lld save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 3 CYS SG 1 30 CYS SG 1 16 CYS SG 1 36 CYS SG 1 20 CYS SG 1 38 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 ASP middle . . 5 A 5 LEU middle . . 6 A 6 LEU middle . . 7 A 7 SER middle . . 8 A 8 GLY middle . false 9 A 9 THR middle . . 10 A 10 GLY middle . false 11 A 11 VAL middle . . 12 A 12 LYS middle . . 13 A 13 HIS middle . . 14 A 14 SER middle . . 15 A 15 ALA middle . . 16 A 16 CYS middle -HG . 17 A 17 ALA middle . . 18 A 18 ALA middle . . 19 A 19 HIS middle . . 20 A 20 CYS middle -HG . 21 A 21 LEU middle . . 22 A 22 LEU middle . . 23 A 23 ARG middle . . 24 A 24 GLY middle . false 25 A 25 ASN middle . . 26 A 26 ARG middle . . 27 A 27 GLY middle . false 28 A 28 GLY middle . false 29 A 29 TYR middle . . 30 A 30 CYS middle -HG . 31 A 31 ASN middle . . 32 A 32 GLY middle . false 33 A 33 ARG middle . . 34 A 34 ALA middle . . 35 A 35 ILE middle . . 36 A 36 CYS middle -HG . 37 A 37 VAL middle . . 38 A 38 CYS middle -HG . 39 A 39 ARG middle . . 40 A 40 ASN 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 4.183 0.020 A 1 ALA HB% H 1 1.533 0.020 A 1 ALA CA C 13 51.764 0.3 A 1 ALA CB C 13 19.266 0.3 A 2 THR H H 1 8.533 0.020 A 2 THR HA H 1 4.818 0.020 A 2 THR HB H 1 4.047 0.020 A 2 THR HG2% H 1 1.095 0.020 A 2 THR CB C 13 69.477 0.3 A 2 THR CG2 C 13 22.245 0.3 A 3 CYS H H 1 8.336 0.020 A 3 CYS HA H 1 4.770 0.020 A 3 CYS HBy H 1 3.052 0.020 A 3 CYS HBx H 1 2.879 0.020 A 3 CYS CB C 13 41.532 0.3 A 4 ASP H H 1 8.225 0.020 A 4 ASP HA H 1 4.611 0.020 A 4 ASP HBy H 1 2.714 0.020 A 4 ASP HBx H 1 2.658 0.020 A 4 ASP CA C 13 54.122 0.3 A 4 ASP CB C 13 41.608 0.3 A 5 LEU H H 1 8.383 0.020 A 5 LEU HA H 1 4.296 0.020 A 5 LEU HB2 H 1 1.645 0.020 A 5 LEU HB3 H 1 1.645 0.020 A 5 LEU HDx% H 1 0.916 0.020 A 5 LEU HDy% H 1 0.855 0.020 A 5 LEU HG H 1 1.606 0.020 A 5 LEU CA C 13 55.677 0.3 A 5 LEU CB C 13 42.052 0.3 A 5 LEU CD1 C 13 24.921 0.3 A 5 LEU CD2 C 13 23.345 0.3 A 5 LEU CG C 13 26.952 0.3 A 6 LEU H H 1 8.297 0.020 A 6 LEU HA H 1 4.427 0.020 A 6 LEU HBy H 1 1.712 0.020 A 6 LEU HBx H 1 1.610 0.020 A 6 LEU HDx% H 1 0.917 0.020 A 6 LEU HDy% H 1 0.856 0.020 A 6 LEU CA C 13 55.017 0.3 A 6 LEU CB C 13 42.108 0.3 A 7 SER H H 1 8.176 0.020 A 7 SER HA H 1 4.455 0.020 A 7 SER HBy H 1 3.914 0.020 A 7 SER HBx H 1 3.884 0.020 A 7 SER CA C 13 58.540 0.3 A 7 SER CB C 13 63.927 0.3 A 8 GLY H H 1 8.489 0.020 A 8 GLY HAy H 1 4.103 0.020 A 8 GLY HAx H 1 4.053 0.020 A 8 GLY CA C 13 45.425 0.3 A 9 THR H H 1 8.212 0.020 A 9 THR HA H 1 4.362 0.020 A 9 THR HB H 1 4.313 0.020 A 9 THR HG2% H 1 1.234 0.020 A 9 THR CA C 13 62.238 0.3 A 9 THR CB C 13 69.659 0.3 A 9 THR CG2 C 13 21.517 0.3 A 10 GLY H H 1 8.517 0.020 A 10 GLY HAy H 1 4.044 0.020 A 10 GLY HAx H 1 3.985 0.020 A 10 GLY CA C 13 45.434 0.3 A 11 VAL H H 1 7.925 0.020 A 11 VAL HA H 1 4.116 0.020 A 11 VAL HB H 1 2.091 0.020 A 11 VAL HGx% H 1 0.914 0.020 A 11 VAL HGy% H 1 0.885 0.020 A 11 VAL CA C 13 62.530 0.3 A 11 VAL CB C 13 32.478 0.3 A 11 VAL CG1 C 13 20.514 0.3 A 11 VAL CG2 C 13 21.082 0.3 A 12 LYS H H 1 8.354 0.020 A 12 LYS HA H 1 4.269 0.020 A 12 LYS HB2 H 1 1.753 0.020 A 12 LYS HB3 H 1 1.753 0.020 A 12 LYS HD2 H 1 1.657 0.020 A 12 LYS HD3 H 1 1.657 0.020 A 12 LYS HE2 H 1 2.972 0.020 A 12 LYS HE3 H 1 2.972 0.020 A 12 LYS HGy H 1 1.392 0.020 A 12 LYS HGx H 1 1.304 0.020 A 12 LYS CA C 13 56.799 0.3 A 12 LYS CB C 13 32.843 0.3 A 12 LYS CD C 13 28.994 0.3 A 12 LYS CE C 13 42.107 0.3 A 12 LYS CG C 13 24.763 0.3 A 13 HIS H H 1 8.412 0.020 A 13 HIS HA H 1 4.781 0.020 A 13 HIS HBy H 1 3.362 0.020 A 13 HIS HBx H 1 3.177 0.020 A 13 HIS HD2 H 1 7.268 0.020 A 13 HIS HE1 H 1 8.457 0.020 A 13 HIS CB C 13 30.453 0.3 A 14 SER H H 1 8.260 0.020 A 14 SER HA H 1 4.444 0.020 A 14 SER HBy H 1 4.073 0.020 A 14 SER HBx H 1 3.974 0.020 A 14 SER CA C 13 59.475 0.3 A 14 SER CB C 13 63.530 0.3 A 15 ALA H H 1 8.648 0.020 A 15 ALA HA H 1 4.354 0.020 A 15 ALA HB% H 1 1.539 0.020 A 15 ALA CA C 13 54.484 0.3 A 15 ALA CB C 13 18.247 0.3 A 16 CYS H H 1 8.496 0.020 A 16 CYS HA H 1 4.501 0.020 A 16 CYS HBy H 1 3.113 0.020 A 16 CYS HBx H 1 2.572 0.020 A 16 CYS CA C 13 57.117 0.3 A 16 CYS CB C 13 35.801 0.3 A 17 ALA H H 1 8.445 0.020 A 17 ALA HA H 1 3.665 0.020 A 17 ALA HB% H 1 1.545 0.020 A 17 ALA CA C 13 56.211 0.3 A 17 ALA CB C 13 17.760 0.3 A 18 ALA H H 1 8.037 0.020 A 18 ALA HA H 1 4.082 0.020 A 18 ALA HB% H 1 1.503 0.020 A 18 ALA CA C 13 55.222 0.3 A 18 ALA CB C 13 18.143 0.3 A 19 HIS H H 1 8.124 0.020 A 19 HIS HA H 1 4.352 0.020 A 19 HIS HBy H 1 3.584 0.020 A 19 HIS HBx H 1 3.316 0.020 A 19 HIS HD2 H 1 7.089 0.020 A 19 HIS HE1 H 1 8.400 0.020 A 19 HIS CA C 13 58.878 0.3 A 19 HIS CB C 13 28.542 0.3 A 21 LEU H H 1 8.597 0.020 A 21 LEU HA H 1 4.442 0.020 A 21 LEU HBy H 1 1.812 0.020 A 21 LEU HBx H 1 1.644 0.020 A 21 LEU HDx% H 1 0.909 0.020 A 21 LEU HDy% H 1 0.866 0.020 A 21 LEU HG H 1 1.609 0.020 A 21 LEU CA C 13 57.822 0.3 A 21 LEU CB C 13 41.937 0.3 A 21 LEU CD1 C 13 23.634 0.3 A 21 LEU CD2 C 13 24.677 0.3 A 21 LEU CG C 13 26.953 0.3 A 22 LEU H H 1 7.717 0.020 A 22 LEU HA H 1 4.179 0.020 A 22 LEU HBy H 1 1.842 0.020 A 22 LEU HBx H 1 1.663 0.020 A 22 LEU HDx% H 1 0.945 0.020 A 22 LEU HDy% H 1 0.913 0.020 A 22 LEU HG H 1 1.782 0.020 A 22 LEU CA C 13 57.281 0.3 A 22 LEU CB C 13 41.854 0.3 A 22 LEU CD1 C 13 24.843 0.3 A 22 LEU CG C 13 26.850 0.3 A 23 ARG HA H 1 4.385 0.020 A 23 ARG HBy H 1 2.123 0.020 A 23 ARG HBx H 1 1.729 0.020 A 23 ARG HD2 H 1 3.066 0.020 A 23 ARG HD3 H 1 3.066 0.020 A 23 ARG HE H 1 7.247 0.020 A 23 ARG HG2 H 1 1.580 0.020 A 23 ARG HG3 H 1 1.580 0.020 A 23 ARG CA C 13 55.301 0.3 A 23 ARG CB C 13 30.184 0.3 A 23 ARG CD C 13 43.059 0.3 A 23 ARG CG C 13 26.898 0.3 A 24 GLY H H 1 7.865 0.020 A 24 GLY HAy H 1 4.243 0.020 A 24 GLY HAx H 1 3.829 0.020 A 24 GLY CA C 13 45.456 0.3 A 25 ASN H H 1 7.874 0.020 A 25 ASN HA H 1 5.202 0.020 A 25 ASN HBy H 1 3.167 0.020 A 25 ASN HBx H 1 2.321 0.020 A 25 ASN CA C 13 52.809 0.3 A 25 ASN CB C 13 40.436 0.3 A 26 ARG H H 1 8.356 0.020 A 26 ARG HA H 1 4.337 0.020 A 26 ARG HBy H 1 1.929 0.020 A 26 ARG HBx H 1 1.757 0.020 A 26 ARG HD2 H 1 3.217 0.020 A 26 ARG HD3 H 1 3.217 0.020 A 26 ARG HE H 1 7.368 0.020 A 26 ARG HGy H 1 1.803 0.020 A 26 ARG HGx H 1 1.682 0.020 A 26 ARG CA C 13 57.017 0.3 A 26 ARG CB C 13 30.999 0.3 A 26 ARG CD C 13 43.273 0.3 A 26 ARG CG C 13 27.608 0.3 A 27 GLY H H 1 7.764 0.020 A 27 GLY HAy H 1 4.182 0.020 A 27 GLY HAx H 1 3.930 0.020 A 27 GLY CA C 13 44.832 0.3 A 28 GLY H H 1 8.290 0.020 A 28 GLY HAy H 1 4.770 0.020 A 28 GLY HAx H 1 4.212 0.020 A 28 GLY CA C 13 47.060 0.3 A 29 TYR H H 1 8.835 0.020 A 29 TYR HA H 1 4.788 0.020 A 29 TYR HBy H 1 2.919 0.020 A 29 TYR HBx H 1 2.806 0.020 A 29 TYR HD1 H 1 6.811 0.020 A 29 TYR HD2 H 1 6.811 0.020 A 29 TYR HE1 H 1 6.665 0.020 A 29 TYR HE2 H 1 6.665 0.020 A 29 TYR CB C 13 40.637 0.3 A 30 CYS HA H 1 5.108 0.020 A 30 CYS HBy H 1 3.026 0.020 A 30 CYS HBx H 1 2.895 0.020 A 30 CYS CA C 13 55.090 0.3 A 30 CYS CB C 13 42.702 0.3 A 31 ASN H H 1 8.859 0.020 A 31 ASN HA H 1 4.920 0.020 A 31 ASN HBy H 1 3.653 0.020 A 31 ASN HBx H 1 2.834 0.020 A 31 ASN HD21 H 1 7.632 0.020 A 31 ASN HD22 H 1 6.553 0.020 A 31 ASN CB C 13 38.657 0.3 A 32 GLY H H 1 8.638 0.020 A 32 GLY HAy H 1 4.033 0.020 A 32 GLY HAx H 1 3.956 0.020 A 32 GLY CA C 13 46.420 0.3 A 33 ARG H H 1 7.714 0.020 A 33 ARG HA H 1 4.461 0.020 A 33 ARG HBy H 1 2.102 0.020 A 33 ARG HBx H 1 1.652 0.020 A 33 ARG HD2 H 1 3.197 0.020 A 33 ARG HD3 H 1 3.197 0.020 A 33 ARG HE H 1 7.202 0.020 A 33 ARG HG2 H 1 1.598 0.020 A 33 ARG HG3 H 1 1.598 0.020 A 33 ARG CA C 13 54.995 0.3 A 33 ARG CB C 13 29.833 0.3 A 33 ARG CD C 13 43.239 0.3 A 33 ARG CG C 13 26.922 0.3 A 34 ALA H H 1 8.306 0.020 A 34 ALA HA H 1 3.809 0.020 A 34 ALA HB% H 1 1.412 0.020 A 34 ALA CA C 13 53.351 0.3 A 34 ALA CB C 13 16.450 0.3 A 35 ILE H H 1 7.512 0.020 A 35 ILE HA H 1 4.135 0.020 A 35 ILE HB H 1 1.678 0.020 A 35 ILE HD1% H 1 0.771 0.020 A 35 ILE HG1y H 1 1.381 0.020 A 35 ILE HG1x H 1 1.095 0.020 A 35 ILE HG2% H 1 0.776 0.020 A 35 ILE CA C 13 59.171 0.3 A 35 ILE CB C 13 38.867 0.3 A 35 ILE CD1 C 13 11.890 0.3 A 35 ILE CG1 C 13 26.998 0.3 A 35 ILE CG2 C 13 17.089 0.3 A 36 CYS H H 1 8.476 0.020 A 36 CYS HA H 1 4.694 0.020 A 36 CYS HBy H 1 2.888 0.020 A 36 CYS HBx H 1 2.572 0.020 A 36 CYS CB C 13 35.763 0.3 A 37 VAL H H 1 9.182 0.020 A 37 VAL HA H 1 3.984 0.020 A 37 VAL HB H 1 1.374 0.020 A 37 VAL HGx% H 1 0.856 0.020 A 37 VAL HGy% H 1 0.757 0.020 A 37 VAL CA C 13 61.534 0.3 A 37 VAL CG1 C 13 21.137 0.3 A 37 VAL CG2 C 13 20.858 0.3 A 38 CYS H H 1 8.620 0.020 A 38 CYS HA H 1 5.440 0.020 A 38 CYS HBy H 1 2.989 0.020 A 38 CYS HBx H 1 2.663 0.020 A 38 CYS CA C 13 52.075 0.3 A 38 CYS CB C 13 36.430 0.3 A 39 ARG H H 1 8.525 0.020 A 39 ARG HA H 1 4.620 0.020 A 39 ARG HBy H 1 1.867 0.020 A 39 ARG HBx H 1 1.663 0.020 A 39 ARG HD2 H 1 3.184 0.020 A 39 ARG HD3 H 1 3.184 0.020 A 39 ARG HE H 1 7.286 0.020 A 39 ARG HG2 H 1 1.593 0.020 A 39 ARG HG3 H 1 1.593 0.020 A 39 ARG CB C 13 32.575 0.3 A 39 ARG CD C 13 43.286 0.3 A 39 ARG CG C 13 26.912 0.3 A 40 ASN H H 1 8.405 0.020 A 40 ASN HA H 1 4.620 0.020 A 40 ASN HBy H 1 2.841 0.020 A 40 ASN HBx H 1 2.656 0.020 A 40 ASN HD21 H 1 7.567 0.020 A 40 ASN HD22 H 1 7.018 0.020 A 40 ASN CA C 13 55.130 0.3 A 40 ASN CB C 13 40.760 0.3 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin 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 13 HIS H A 13 HIS HBy 1.0 1.0 2.52 2 1 A 13 HIS H A 13 HIS HBx 1.0 1.0 2.52 3 2 A 22 LEU H A 23 ARG H 1.0 1.0 3.48 4 3 A 23 ARG H A 24 GLY H 1.0 1.0 3.33 5 4 A 22 LEU H A 21 LEU H 1.0 1.0 2.96 6 5 A 12 LYS H A 12 LYS HB2 1.0 1.0 3.59 7 5 A 12 LYS H A 12 LYS HB3 1.0 1.0 3.59 8 6 A 39 ARG H A 39 ARG HBy 1.0 1.0 2.96 9 6 A 39 ARG H A 39 ARG HBx 1.0 1.0 2.96 10 7 A 16 CYS HA A 17 ALA H 1.0 1.0 3.45 11 8 A 16 CYS HA A 16 CYS H 1.0 1.0 2.87 12 9 A 34 ALA H A 35 ILE H 1.0 1.0 2.55 13 10 A 39 ARG H A 39 ARG HA 1.0 1.0 2.93 14 11 A 32 GLY H A 33 ARG H 1.0 1.0 3.27 15 12 A 25 ASN HA A 26 ARG H 1.0 1.0 2.40 16 13 A 19 HIS H A 20 CYS H 1.0 1.0 2.65 17 14 A 30 CYS HA A 31 ASN H 1.0 1.0 2.40 18 15 A 28 GLY H A 27 GLY HAy 1.0 1.0 2.52 19 15 A 27 GLY HAx A 28 GLY H 1.0 1.0 2.52 20 16 A 15 ALA HA A 18 ALA H 1.0 1.0 3.36 21 17 A 29 TYR H A 28 GLY HAy 1.0 1.0 3.08 22 17 A 28 GLY HAx A 29 TYR H 1.0 1.0 3.08 23 18 A 29 TYR H A 37 VAL H 1.0 1.0 2.68 24 19 A 32 GLY H A 31 ASN HA 1.0 1.0 2.93 25 20 A 13 HIS HA A 14 SER H 1.0 1.0 3.33 26 21 A 11 VAL H A 10 GLY HAy 1.0 1.0 3.24 27 21 A 10 GLY HAx A 11 VAL H 1.0 1.0 3.24 28 22 A 37 VAL H A 37 VAL HB 1.0 1.0 2.59 29 23 A 35 ILE H A 35 ILE HB 1.0 1.0 2.62 30 24 A 16 CYS H A 15 ALA H 1.0 1.0 3.02 31 25 A 22 LEU H A 21 LEU HA 1.0 1.0 3.55 32 26 A 19 HIS H A 18 ALA HA 1.0 1.0 3.52 33 27 A 21 LEU H A 18 ALA HA 1.0 1.0 3.17 34 28 A 23 ARG H A 20 CYS HA 1.0 1.0 3.64 35 29 A 20 CYS H A 20 CYS HA 1.0 1.0 2.90 36 30 A 35 ILE H A 34 ALA HA 1.0 1.0 2.87 37 31 A 9 THR HA A 10 GLY H 1.0 1.0 2.40 38 32 A 28 GLY H A 27 GLY HAy 1.0 1.0 2.52 39 32 A 27 GLY HAx A 28 GLY H 1.0 1.0 2.52 40 33 A 29 TYR H A 29 TYR HBy 1.0 1.0 3.89 41 33 A 29 TYR H A 29 TYR HBx 1.0 1.0 3.89 42 34 A 28 GLY H A 17 ALA HA 1.0 1.0 3.02 43 35 A 18 ALA H A 17 ALA HA 1.0 1.0 3.48 44 36 A 11 VAL H A 11 VAL HB 1.0 1.0 2.55 45 37 A 39 ARG H A 39 ARG HBy 1.0 1.0 2.96 46 37 A 39 ARG H A 39 ARG HBx 1.0 1.0 2.96 47 38 A 16 CYS H A 16 CYS HBy 1.0 1.0 2.77 48 38 A 16 CYS H A 16 CYS HBx 1.0 1.0 2.77 49 39 A 35 ILE HA A 36 CYS H 1.0 1.0 2.40 50 40 A 29 TYR H A 28 GLY HAy 1.0 1.0 3.08 51 40 A 28 GLY HAx A 29 TYR H 1.0 1.0 3.08 52 41 A 33 ARG H A 33 ARG HA 1.0 1.0 2.86 53 42 A 17 ALA H A 18 ALA H 1.0 1.0 2.71 54 43 A 37 VAL H A 38 CYS H 1.0 1.0 3.95 55 44 A 14 SER H A 15 ALA H 1.0 1.0 3.36 56 45 A 13 HIS H A 14 SER H 1.0 1.0 3.02 57 46 A 31 ASN H A 30 CYS HBy 1.0 1.0 3.95 58 46 A 31 ASN H A 30 CYS HBx 1.0 1.0 3.95 59 47 A 17 ALA H A 16 CYS HBy 1.0 1.0 2.87 60 47 A 17 ALA H A 16 CYS HBx 1.0 1.0 2.87 61 48 A 23 ARG H A 23 ARG HG2 1.0 1.0 3.98 62 48 A 23 ARG H A 23 ARG HG3 1.0 1.0 3.98 63 49 A 26 ARG HE A 40 ASN HD22 1.0 1.0 4.17 64 49 A 26 ARG HE A 40 ASN HD21 1.0 1.0 4.17 65 50 A 35 ILE H A 35 ILE HG1x 1.0 1.0 5.00 66 50 A 35 ILE H A 35 ILE HG1y 1.0 1.0 5.00 67 51 A 33 ARG HE A 33 ARG HBy 1.0 1.0 6.38 68 51 A 33 ARG HBx A 33 ARG HE 1.0 1.0 6.38 69 52 A 40 ASN H A 40 ASN HD22 1.0 1.0 5.50 70 52 A 40 ASN HD21 A 40 ASN H 1.0 1.0 5.50 71 53 A 39 ARG H A 39 ARG HG2 1.0 1.0 4.31 72 53 A 39 ARG H A 39 ARG HG3 1.0 1.0 4.31 73 54 A 23 ARG H A 23 ARG HG2 1.0 1.0 3.98 74 54 A 23 ARG H A 23 ARG HG3 1.0 1.0 3.98 75 55 A 39 ARG H A 39 ARG HD2 1.0 1.0 5.20 76 55 A 39 ARG H A 39 ARG HD3 1.0 1.0 5.20 77 56 A 29 TYR H A 29 TYR HD% 1.0 1.0 6.17 78 57 A 35 ILE H A 35 ILE HG1x 1.0 1.0 5.00 79 57 A 35 ILE H A 35 ILE HG1y 1.0 1.0 5.00 80 58 A 33 ARG H A 33 ARG HG2 1.0 1.0 3.17 81 58 A 33 ARG H A 33 ARG HG3 1.0 1.0 3.17 82 59 A 13 HIS H A 13 HIS HD2 1.0 1.0 4.35 83 59 A 13 HIS H A 13 HIS HD1 1.0 1.0 4.35 84 60 A 19 HIS HD2 A 19 HIS HBy 1.0 1.0 3.02 85 60 A 19 HIS HD1 A 19 HIS HBy 1.0 1.0 3.02 86 60 A 19 HIS HBx A 19 HIS HD2 1.0 1.0 3.02 87 60 A 19 HIS HBx A 19 HIS HD1 1.0 1.0 3.02 88 61 A 11 VAL H A 11 VAL HGx% 1.0 1.0 4.60 89 61 A 11 VAL H A 11 VAL HGy% 1.0 1.0 4.60 90 62 A 15 ALA H A 15 ALA HB% 1.0 1.0 3.42 91 63 A 17 ALA H A 17 ALA HB% 1.0 1.0 3.42 92 64 A 35 ILE H A 35 ILE HG1y 1.0 1.0 6.27 93 64 A 35 ILE H A 35 ILE HG2% 1.0 1.0 6.27 94 64 A 35 ILE H A 35 ILE HG1x 1.0 1.0 6.27 95 65 A 36 CYS H A 35 ILE HG1y 1.0 1.0 3.60 96 65 A 36 CYS H A 35 ILE HG2% 1.0 1.0 3.60 97 65 A 36 CYS H A 35 ILE HG1x 1.0 1.0 3.60 98 66 A 19 HIS H A 18 ALA HB% 1.0 1.0 4.04 99 67 A 18 ALA H A 18 ALA HB% 1.0 1.0 3.42 100 68 A 34 ALA H A 34 ALA HB% 1.0 1.0 3.51 101 69 A 5 LEU H A 5 LEU HDx% 1.0 1.0 6.52 102 69 A 5 LEU H A 5 LEU HDy% 1.0 1.0 6.52 103 70 A 35 ILE H A 35 ILE HD1% 1.0 1.0 5.90 104 71 A 38 CYS H A 38 CYS HBy 1.0 1.0 3.64 105 71 A 38 CYS H A 38 CYS HBx 1.0 1.0 3.64 106 72 A 39 ARG H A 38 CYS HBy 1.0 1.0 3.95 107 72 A 39 ARG H A 38 CYS HBx 1.0 1.0 3.95 108 73 A 2 THR H A 2 THR HB 1.0 1.0 3.67 109 74 A 34 ALA H A 33 ARG H 1.0 1.0 2.40 110 75 A 8 GLY H A 9 THR H 1.0 1.0 4.23 111 76 A 10 GLY H A 9 THR H 1.0 1.0 4.60 112 77 A 36 CYS H A 36 CYS HBy 1.0 1.0 2.59 113 77 A 36 CYS H A 36 CYS HBx 1.0 1.0 2.59 114 78 A 3 CYS H A 3 CYS HBy 1.0 1.0 3.70 115 78 A 3 CYS H A 3 CYS HBx 1.0 1.0 3.70 116 79 A 32 GLY H A 32 GLY HAy 1.0 1.0 2.87 117 79 A 32 GLY H A 32 GLY HAx 1.0 1.0 2.87 118 80 A 9 THR H A 8 GLY HAy 1.0 1.0 2.99 119 80 A 9 THR H A 8 GLY HAx 1.0 1.0 2.99 120 81 A 26 ARG HA A 26 ARG HBy 1.0 1.0 2.46 121 81 A 26 ARG HA A 26 ARG HBx 1.0 1.0 2.46 122 82 A 26 ARG H A 26 ARG HBy 1.0 1.0 3.02 123 82 A 26 ARG H A 26 ARG HBx 1.0 1.0 3.02 124 83 A 10 GLY H A 10 GLY HAy 1.0 1.0 2.87 125 83 A 10 GLY HAx A 10 GLY H 1.0 1.0 2.87 126 84 A 11 VAL H A 10 GLY HAy 1.0 1.0 3.24 127 84 A 10 GLY HAx A 11 VAL H 1.0 1.0 3.24 128 85 A 18 ALA H A 18 ALA HA 1.0 1.0 2.87 129 86 A 5 LEU H A 4 ASP HA 1.0 1.0 2.40 130 87 A 19 HIS H A 19 HIS HBy 1.0 1.0 2.43 131 87 A 19 HIS H A 19 HIS HBx 1.0 1.0 2.43 132 88 A 19 HIS HA A 19 HIS HBy 1.0 1.0 2.55 133 88 A 19 HIS HBx A 19 HIS HA 1.0 1.0 2.55 134 89 A 12 LYS H A 12 LYS HA 1.0 1.0 2.90 135 90 A 13 HIS H A 12 LYS HA 1.0 1.0 2.40 136 91 A 29 TYR H A 29 TYR HBy 1.0 1.0 3.89 137 91 A 29 TYR H A 29 TYR HBx 1.0 1.0 3.89 138 92 A 24 GLY H A 24 GLY HAy 1.0 1.0 2.90 139 92 A 24 GLY H A 24 GLY HAx 1.0 1.0 2.90 140 93 A 26 ARG H A 26 ARG HA 1.0 1.0 2.83 141 94 A 14 SER H A 14 SER HBy 1.0 1.0 3.30 142 94 A 14 SER H A 14 SER HBx 1.0 1.0 3.30 143 95 A 26 ARG H A 26 ARG HBy 1.0 1.0 3.21 144 95 A 26 ARG H A 26 ARG HBx 1.0 1.0 3.21 145 96 A 31 ASN H A 30 CYS HBy 1.0 1.0 3.95 146 96 A 31 ASN H A 30 CYS HBx 1.0 1.0 3.95 147 97 A 8 GLY H A 7 SER HA 1.0 1.0 3.14 148 98 A 14 SER H A 13 HIS HBy 1.0 1.0 3.89 149 98 A 13 HIS HBx A 14 SER H 1.0 1.0 3.89 150 99 A 13 HIS H A 13 HIS HBy 1.0 1.0 3.21 151 99 A 13 HIS H A 13 HIS HBx 1.0 1.0 3.21 152 100 A 12 LYS H A 11 VAL HB 1.0 1.0 3.05 153 101 A 11 VAL HB A 11 VAL HA 1.0 1.0 2.99 154 102 A 6 LEU H A 6 LEU HBy 1.0 1.0 2.80 155 102 A 6 LEU H A 6 LEU HBx 1.0 1.0 2.80 156 103 A 7 SER H A 6 LEU HBy 1.0 1.0 3.45 157 103 A 6 LEU HBx A 7 SER H 1.0 1.0 3.45 158 104 A 9 THR H A 9 THR HB 1.0 1.0 2.87 159 105 A 10 GLY H A 9 THR HB 1.0 1.0 2.99 160 106 A 38 CYS H A 38 CYS HBy 1.0 1.0 3.64 161 106 A 38 CYS H A 38 CYS HBx 1.0 1.0 3.64 162 107 A 39 ARG H A 38 CYS HBy 1.0 1.0 3.95 163 107 A 39 ARG H A 38 CYS HBx 1.0 1.0 3.95 164 108 A 37 VAL H A 36 CYS HA 1.0 1.0 2.40 165 109 A 32 GLY H A 32 GLY HAy 1.0 1.0 2.87 166 109 A 32 GLY H A 32 GLY HAx 1.0 1.0 2.87 167 110 A 9 THR H A 8 GLY HAy 1.0 1.0 2.99 168 110 A 9 THR H A 8 GLY HAx 1.0 1.0 2.99 169 111 A 5 LEU H A 4 ASP HBy 1.0 1.0 5.50 170 111 A 5 LEU H A 4 ASP HBx 1.0 1.0 5.50 171 112 A 4 ASP H A 4 ASP HBy 1.0 1.0 2.86 172 112 A 4 ASP HBx A 4 ASP H 1.0 1.0 2.86 173 113 A 7 SER H A 4 ASP HBy 1.0 1.0 5.50 174 113 A 7 SER H A 4 ASP HBx 1.0 1.0 5.50 175 114 A 16 CYS H A 16 CYS HBy 1.0 1.0 2.59 176 114 A 16 CYS H A 16 CYS HBx 1.0 1.0 2.59 177 115 A 16 CYS H A 15 ALA HA 1.0 1.0 3.52 178 116 A 15 ALA HA A 15 ALA H 1.0 1.0 2.71 179 117 A 10 GLY H A 10 GLY HAy 1.0 1.0 2.87 180 117 A 10 GLY HAx A 10 GLY H 1.0 1.0 2.87 181 118 A 19 HIS H A 19 HIS HBy 1.0 1.0 2.55 182 118 A 19 HIS H A 19 HIS HBx 1.0 1.0 2.55 183 119 A 24 GLY H A 24 GLY HAy 1.0 1.0 2.90 184 119 A 24 GLY H A 24 GLY HAx 1.0 1.0 2.90 185 120 A 15 ALA H A 14 SER HA 1.0 1.0 3.36 186 121 A 7 SER H A 7 SER HBy 1.0 1.0 3.64 187 121 A 7 SER H A 7 SER HBx 1.0 1.0 3.64 188 122 A 8 GLY H A 7 SER HBy 1.0 1.0 3.95 189 122 A 8 GLY H A 7 SER HBx 1.0 1.0 3.95 190 123 A 21 LEU H A 21 LEU HBy 1.0 1.0 3.52 191 123 A 21 LEU H A 21 LEU HBx 1.0 1.0 3.52 192 124 A 8 GLY H A 7 SER H 1.0 1.0 3.48 193 125 A 13 HIS H A 13 HIS HA 1.0 1.0 2.83 194 126 A 35 ILE H A 31 ASN H 1.0 1.0 3.42 195 127 A 12 LYS H A 11 VAL HA 1.0 1.0 3.52 196 128 A 11 VAL H A 11 VAL HA 1.0 1.0 2.87 197 129 A 6 LEU H A 6 LEU HA 1.0 1.0 2.90 198 130 A 7 SER H A 6 LEU HA 1.0 1.0 3.52 199 131 A 34 ALA H A 34 ALA HA 1.0 1.0 2.40 200 132 A 39 ARG H A 38 CYS HA 1.0 1.0 2.40 201 133 A 34 ALA H A 33 ARG HA 1.0 1.0 3.05 202 134 A 36 CYS H A 36 CYS HBy 1.0 1.0 2.59 203 134 A 36 CYS H A 36 CYS HBx 1.0 1.0 2.59 204 135 A 3 CYS H A 3 CYS HBy 1.0 1.0 3.70 205 135 A 3 CYS H A 3 CYS HBx 1.0 1.0 3.70 206 136 A 5 LEU H A 4 ASP HBy 1.0 1.0 3.21 207 136 A 5 LEU H A 4 ASP HBx 1.0 1.0 3.21 208 137 A 4 ASP H A 4 ASP HBy 1.0 1.0 3.24 209 137 A 4 ASP HBx A 4 ASP H 1.0 1.0 3.24 210 138 A 7 SER H A 4 ASP HBy 1.0 1.0 4.20 211 138 A 7 SER H A 4 ASP HBx 1.0 1.0 4.20 212 139 A 16 CYS HA A 19 HIS H 1.0 1.0 3.36 213 140 A 16 CYS HA A 18 ALA H 1.0 1.0 4.45 214 141 A 29 TYR H A 29 TYR HA 1.0 1.0 2.87 215 142 A 19 HIS H A 19 HIS HA 1.0 1.0 2.74 216 143 A 14 SER H A 14 SER HBy 1.0 1.0 3.30 217 143 A 14 SER H A 14 SER HBx 1.0 1.0 3.30 218 144 A 6 LEU H A 5 LEU HA 1.0 1.0 2.55 219 145 A 7 SER H A 5 LEU HA 1.0 1.0 4.17 220 146 A 21 LEU H A 21 LEU HBy 1.0 1.0 3.52 221 146 A 21 LEU H A 21 LEU HBx 1.0 1.0 3.52 222 147 A 7 SER H A 7 SER HBy 1.0 1.0 3.64 223 147 A 7 SER H A 7 SER HBx 1.0 1.0 3.64 224 148 A 8 GLY H A 7 SER HBy 1.0 1.0 3.95 225 148 A 8 GLY H A 7 SER HBx 1.0 1.0 3.95 226 149 A 14 SER H A 13 HIS HBy 1.0 1.0 3.67 227 149 A 13 HIS HBx A 14 SER H 1.0 1.0 3.67 228 150 A 35 ILE HB A 36 CYS H 1.0 1.0 3.83 229 151 A 12 LYS H A 11 VAL H 1.0 1.0 3.24 230 152 A 11 VAL H A 10 GLY H 1.0 1.0 2.83 231 153 A 38 CYS H A 37 VAL HA 1.0 1.0 2.80 232 154 A 40 ASN H A 40 ASN HA 1.0 1.0 2.71 233 155 A 6 LEU H A 6 LEU HBy 1.0 1.0 2.80 234 155 A 6 LEU H A 6 LEU HBx 1.0 1.0 2.80 235 156 A 7 SER H A 6 LEU HBy 1.0 1.0 2.96 236 156 A 6 LEU HBx A 7 SER H 1.0 1.0 2.96 237 157 A 32 GLY H A 31 ASN HBy 1.0 1.0 3.36 238 157 A 32 GLY H A 31 ASN HBx 1.0 1.0 3.36 239 158 A 31 ASN H A 35 ILE HB 1.0 1.0 4.11 240 159 A 32 GLY H A 31 ASN HBy 1.0 1.0 3.36 241 159 A 32 GLY H A 31 ASN HBx 1.0 1.0 3.36 242 160 A 39 ARG H A 27 GLY H 1.0 1.0 3.24 243 161 A 31 ASN H A 37 VAL H 1.0 1.0 4.38 244 162 A 18 ALA H A 14 SER HA 1.0 1.0 4.48 245 163 A 11 VAL H A 9 THR HB 1.0 1.0 5.50 246 164 A 11 VAL H A 9 THR HA 1.0 1.0 4.20 247 165 A 21 LEU HA A 25 ASN H 1.0 1.0 3.55 248 166 A 24 GLY H A 23 ARG HA 1.0 1.0 3.48 249 167 A 11 VAL HA A 12 LYS HB2 1.0 1.0 5.26 250 167 A 12 LYS HB3 A 11 VAL HA 1.0 1.0 5.26 251 168 A 30 CYS HA A 37 VAL H 1.0 1.0 3.55 252 169 A 31 ASN H A 36 CYS HA 1.0 1.0 4.04 253 170 A 18 ALA H A 19 HIS HBy 1.0 1.0 4.63 254 170 A 18 ALA H A 19 HIS HBx 1.0 1.0 4.63 255 171 A 25 ASN H A 23 ARG HA 1.0 1.0 4.82 256 172 A 12 LYS HA A 12 LYS HGy 1.0 1.0 3.64 257 172 A 12 LYS HA A 12 LYS HGx 1.0 1.0 3.64 258 173 A 12 LYS H A 12 LYS HGy 1.0 1.0 3.70 259 173 A 12 LYS H A 12 LYS HGx 1.0 1.0 3.70 260 174 A 23 ARG HE A 23 ARG HBy 1.0 1.0 4.88 261 174 A 23 ARG HBx A 23 ARG HE 1.0 1.0 4.88 262 175 A 26 ARG HE A 26 ARG HBy 1.0 1.0 5.31 263 175 A 26 ARG HE A 26 ARG HBx 1.0 1.0 5.31 264 176 A 23 ARG HA A 23 ARG HD2 1.0 1.0 5.48 265 176 A 23 ARG HA A 23 ARG HD3 1.0 1.0 5.48 266 177 A 5 LEU H A 5 LEU HG 1.0 1.0 2.40 267 178 A 19 HIS HD2 A 19 HIS HBy 1.0 1.0 3.95 268 178 A 19 HIS HBx A 19 HIS HD2 1.0 1.0 3.95 269 178 A 19 HIS HBx A 19 HIS HD1 1.0 1.0 3.95 270 178 A 19 HIS HD1 A 19 HIS HBy 1.0 1.0 3.95 271 179 A 26 ARG HE A 26 ARG HBy 1.0 1.0 5.41 272 179 A 26 ARG HE A 26 ARG HBx 1.0 1.0 5.41 273 180 A 21 LEU H A 21 LEU HG 1.0 1.0 2.83 274 181 A 13 HIS HD1 A 13 HIS HBy 1.0 1.0 3.95 275 181 A 13 HIS HBx A 13 HIS HD2 1.0 1.0 3.95 276 181 A 13 HIS HBx A 13 HIS HD1 1.0 1.0 3.95 277 181 A 13 HIS HD2 A 13 HIS HBy 1.0 1.0 3.95 278 182 A 34 ALA H A 33 ARG HD2 1.0 1.0 6.38 279 182 A 34 ALA H A 33 ARG HD3 1.0 1.0 6.38 280 183 A 33 ARG HA A 33 ARG HD2 1.0 1.0 6.38 281 183 A 33 ARG HA A 33 ARG HD3 1.0 1.0 6.38 282 184 A 12 LYS HA A 12 LYS HGy 1.0 1.0 3.64 283 184 A 12 LYS HA A 12 LYS HGx 1.0 1.0 3.64 284 185 A 12 LYS H A 12 LYS HGy 1.0 1.0 3.70 285 185 A 12 LYS H A 12 LYS HGx 1.0 1.0 3.70 286 186 A 23 ARG HE A 23 ARG HBy 1.0 1.0 4.88 287 186 A 23 ARG HBx A 23 ARG HE 1.0 1.0 4.88 288 187 A 39 ARG HE A 39 ARG HBy 1.0 1.0 5.41 289 187 A 39 ARG HBx A 39 ARG HE 1.0 1.0 5.41 290 188 A 23 ARG HA A 23 ARG HE 1.0 1.0 5.38 291 189 A 13 HIS HA A 13 HIS HD2 1.0 1.0 5.13 292 189 A 13 HIS HA A 13 HIS HD1 1.0 1.0 5.13 293 190 A 33 ARG HA A 33 ARG HE 1.0 1.0 5.50 294 191 A 26 ARG H A 26 ARG HGy 1.0 1.0 4.88 295 191 A 26 ARG H A 26 ARG HGx 1.0 1.0 4.88 296 192 A 19 HIS H A 19 HIS HD2 1.0 1.0 5.50 297 192 A 19 HIS H A 19 HIS HD1 1.0 1.0 5.50 298 193 A 12 LYS H A 12 LYS HE2 1.0 1.0 6.38 299 193 A 12 LYS H A 12 LYS HE3 1.0 1.0 6.38 300 194 A 39 ARG HE A 39 ARG HBy 1.0 1.0 5.41 301 194 A 39 ARG HBx A 39 ARG HE 1.0 1.0 5.41 302 195 A 19 HIS HA A 19 HIS HE1 1.0 1.0 5.50 303 196 A 19 HIS HA A 19 HIS HD2 1.0 1.0 3.98 304 196 A 19 HIS HD1 A 19 HIS HA 1.0 1.0 3.98 305 197 A 26 ARG HA A 26 ARG HD2 1.0 1.0 5.36 306 197 A 26 ARG HA A 26 ARG HD3 1.0 1.0 5.36 307 198 A 26 ARG H A 26 ARG HD2 1.0 1.0 5.76 308 198 A 26 ARG H A 26 ARG HD3 1.0 1.0 5.76 309 199 A 26 ARG H A 26 ARG HGy 1.0 1.0 4.88 310 199 A 26 ARG H A 26 ARG HGx 1.0 1.0 4.88 311 200 A 12 LYS HA A 12 LYS HD2 1.0 1.0 6.38 312 200 A 12 LYS HA A 12 LYS HD3 1.0 1.0 6.38 313 201 A 12 LYS H A 12 LYS HD2 1.0 1.0 6.20 314 201 A 12 LYS H A 12 LYS HD3 1.0 1.0 6.20 315 202 A 13 HIS HD1 A 13 HIS HBy 1.0 1.0 3.05 316 202 A 13 HIS HBx A 13 HIS HD2 1.0 1.0 3.05 317 202 A 13 HIS HBx A 13 HIS HD1 1.0 1.0 3.05 318 202 A 13 HIS HD2 A 13 HIS HBy 1.0 1.0 3.05 319 203 A 40 ASN HA A 40 ASN HD22 1.0 1.0 5.50 320 203 A 40 ASN HD21 A 40 ASN HA 1.0 1.0 5.50 321 204 A 33 ARG H A 33 ARG HG2 1.0 1.0 3.17 322 204 A 33 ARG H A 33 ARG HG3 1.0 1.0 3.17 323 205 A 19 HIS HE1 A 23 ARG HD2 1.0 1.0 6.20 324 205 A 23 ARG HD3 A 19 HIS HE1 1.0 1.0 6.20 325 206 A 31 ASN HBx A 31 ASN HD21 1.0 1.0 3.33 326 206 A 31 ASN HBy A 31 ASN HD21 1.0 1.0 3.33 327 206 A 31 ASN HD22 A 31 ASN HBy 1.0 1.0 3.33 328 206 A 31 ASN HBx A 31 ASN HD22 1.0 1.0 3.33 329 207 A 37 VAL HB A 31 ASN HD21 1.0 1.0 5.50 330 207 A 37 VAL HB A 31 ASN HD22 1.0 1.0 5.50 331 208 A 23 ARG HG3 A 19 HIS HD1 1.0 1.0 6.38 332 208 A 19 HIS HD1 A 23 ARG HG2 1.0 1.0 6.38 333 208 A 19 HIS HD2 A 23 ARG HG2 1.0 1.0 6.38 334 208 A 23 ARG HG3 A 19 HIS HD2 1.0 1.0 6.38 335 209 A 16 CYS HA A 19 HIS HD2 1.0 1.0 5.28 336 209 A 16 CYS HA A 19 HIS HD1 1.0 1.0 5.28 337 210 A 19 HIS HD2 A 36 CYS HBy 1.0 1.0 5.50 338 210 A 19 HIS HD1 A 36 CYS HBy 1.0 1.0 5.50 339 210 A 36 CYS HBx A 19 HIS HD2 1.0 1.0 5.50 340 210 A 19 HIS HD1 A 36 CYS HBx 1.0 1.0 5.50 341 211 A 31 ASN HA A 29 TYR HE% 1.0 1.0 5.99 342 212 A 29 TYR HA A 29 TYR HE% 1.0 1.0 6.70 343 213 A 31 ASN HA A 29 TYR HD% 1.0 1.0 6.79 344 214 A 29 TYR HD% A 29 TYR HA 1.0 1.0 7.23 345 215 A 29 TYR HE% A 39 ARG HD2 1.0 1.0 8.52 346 215 A 39 ARG HD3 A 29 TYR HE% 1.0 1.0 8.52 347 216 A 29 TYR HD% A 39 ARG HD2 1.0 1.0 8.51 348 216 A 39 ARG HD3 A 29 TYR HD% 1.0 1.0 8.51 349 217 A 29 TYR HD% A 39 ARG HG2 1.0 1.0 7.95 350 217 A 39 ARG HG3 A 29 TYR HD% 1.0 1.0 7.95 351 218 A 29 TYR HE% A 39 ARG HG2 1.0 1.0 7.74 352 218 A 39 ARG HG3 A 29 TYR HE% 1.0 1.0 7.74 353 219 A 35 ILE HB A 31 ASN HD21 1.0 1.0 3.52 354 219 A 35 ILE HB A 31 ASN HD22 1.0 1.0 3.52 355 220 A 19 HIS HD2 A 36 CYS HBy 1.0 1.0 5.50 356 220 A 19 HIS HD1 A 36 CYS HBy 1.0 1.0 5.50 357 220 A 36 CYS HBx A 19 HIS HD2 1.0 1.0 5.50 358 220 A 19 HIS HD1 A 36 CYS HBx 1.0 1.0 5.50 359 221 A 18 ALA HA A 21 LEU HG 1.0 1.0 3.27 360 222 A 12 LYS HB2 A 12 LYS HE2 1.0 1.0 7.26 361 222 A 12 LYS HE3 A 12 LYS HB2 1.0 1.0 7.26 362 222 A 12 LYS HB3 A 12 LYS HE3 1.0 1.0 7.26 363 222 A 12 LYS HB3 A 12 LYS HE2 1.0 1.0 7.26 364 223 A 31 ASN HBx A 31 ASN HD21 1.0 1.0 3.33 365 223 A 31 ASN HBy A 31 ASN HD21 1.0 1.0 3.33 366 223 A 31 ASN HD22 A 31 ASN HBy 1.0 1.0 3.33 367 223 A 31 ASN HBx A 31 ASN HD22 1.0 1.0 3.33 368 224 A 22 LEU H A 22 LEU HG 1.0 1.0 3.14 369 225 A 13 HIS HD2 A 12 LYS HB2 1.0 1.0 6.38 370 225 A 13 HIS HD1 A 12 LYS HB2 1.0 1.0 6.38 371 225 A 12 LYS HB3 A 13 HIS HD2 1.0 1.0 6.38 372 225 A 12 LYS HB3 A 13 HIS HD1 1.0 1.0 6.38 373 226 A 16 CYS H A 15 ALA HB% 1.0 1.0 3.67 374 227 A 38 CYS H A 37 VAL HGx% 1.0 1.0 5.99 375 227 A 38 CYS H A 37 VAL HGy% 1.0 1.0 5.99 376 228 A 37 VAL HA A 37 VAL HGx% 1.0 1.0 4.10 377 228 A 37 VAL HA A 37 VAL HGy% 1.0 1.0 4.10 378 229 A 6 LEU H A 6 LEU HDx% 1.0 1.0 5.28 379 229 A 6 LEU H A 6 LEU HDy% 1.0 1.0 5.28 380 230 A 22 LEU HA A 22 LEU HDx% 1.0 1.0 5.28 381 230 A 22 LEU HA A 22 LEU HDy% 1.0 1.0 5.28 382 231 A 9 THR H A 9 THR HG2% 1.0 1.0 4.07 383 231 A 9 THR H A 9 THR HG1 1.0 1.0 4.07 384 232 A 9 THR HA A 9 THR HG2% 1.0 1.0 3.91 385 232 A 9 THR HA A 9 THR HG1 1.0 1.0 3.91 386 233 A 37 VAL HA A 37 VAL HGx% 1.0 1.0 4.10 387 233 A 37 VAL HA A 37 VAL HGy% 1.0 1.0 4.10 388 234 A 21 LEU HA A 21 LEU HDx% 1.0 1.0 5.03 389 234 A 21 LEU HA A 21 LEU HDy% 1.0 1.0 5.03 390 235 A 5 LEU HA A 5 LEU HDx% 1.0 1.0 5.12 391 235 A 5 LEU HDy% A 5 LEU HA 1.0 1.0 5.12 392 236 A 34 ALA H A 35 ILE HD1% 1.0 1.0 6.52 393 237 A 35 ILE HA A 35 ILE HD1% 1.0 1.0 4.23 394 238 A 36 CYS H A 35 ILE HD1% 1.0 1.0 4.75 395 239 A 35 ILE HB A 35 ILE HD1% 1.0 1.0 3.42 396 240 A 11 VAL HA A 11 VAL HGx% 1.0 1.0 4.16 397 240 A 11 VAL HGy% A 11 VAL HA 1.0 1.0 4.16 398 241 A 6 LEU H A 6 LEU HDx% 1.0 1.0 5.28 399 241 A 6 LEU H A 6 LEU HDy% 1.0 1.0 5.28 400 242 A 21 LEU HA A 21 LEU HDx% 1.0 1.0 5.03 401 242 A 21 LEU HA A 21 LEU HDy% 1.0 1.0 5.03 402 243 A 5 LEU H A 5 LEU HDx% 1.0 1.0 6.52 403 243 A 5 LEU H A 5 LEU HDy% 1.0 1.0 6.52 404 244 A 5 LEU HA A 5 LEU HDx% 1.0 1.0 5.12 405 244 A 5 LEU HDy% A 5 LEU HA 1.0 1.0 5.12 406 245 A 11 VAL HA A 11 VAL HGx% 1.0 1.0 4.16 407 245 A 11 VAL HGy% A 11 VAL HA 1.0 1.0 4.16 408 246 A 11 VAL H A 11 VAL HGx% 1.0 1.0 4.60 409 246 A 11 VAL H A 11 VAL HGy% 1.0 1.0 4.60 410 247 A 22 LEU HA A 22 LEU HDx% 1.0 1.0 5.28 411 247 A 22 LEU HA A 22 LEU HDy% 1.0 1.0 5.28 412 248 A 7 SER H A 6 LEU HDx% 1.0 1.0 5.84 413 248 A 7 SER H A 6 LEU HDy% 1.0 1.0 5.84 414 249 A 7 SER H A 6 LEU HDx% 1.0 1.0 5.84 415 249 A 7 SER H A 6 LEU HDy% 1.0 1.0 5.84 416 250 A 18 ALA H A 17 ALA HB% 1.0 1.0 3.98 417 251 A 28 GLY H A 17 ALA HB% 1.0 1.0 3.91 418 252 A 38 CYS H A 37 VAL HGx% 1.0 1.0 5.99 419 252 A 38 CYS H A 37 VAL HGy% 1.0 1.0 5.99 420 253 A 10 GLY H A 9 THR HG2% 1.0 1.0 5.25 421 253 A 10 GLY H A 9 THR HG1 1.0 1.0 5.25 422 254 A 16 CYS H A 2 THR HG2% 1.0 1.0 6.52 423 254 A 16 CYS H A 2 THR HG1 1.0 1.0 6.52 424 255 A 10 GLY H A 5 LEU HDx% 1.0 1.0 6.52 425 255 A 10 GLY H A 5 LEU HDy% 1.0 1.0 6.52 426 256 A 10 GLY H A 5 LEU HDx% 1.0 1.0 6.52 427 256 A 10 GLY H A 5 LEU HDy% 1.0 1.0 6.52 428 257 A 12 LYS H A 11 VAL HGx% 1.0 1.0 4.78 429 257 A 12 LYS H A 11 VAL HGy% 1.0 1.0 4.78 430 258 A 12 LYS H A 11 VAL HGx% 1.0 1.0 4.78 431 258 A 12 LYS H A 11 VAL HGy% 1.0 1.0 4.78 432 259 A 29 TYR HE% A 37 VAL HGx% 1.0 1.0 7.54 433 259 A 29 TYR HE% A 37 VAL HGy% 1.0 1.0 7.54 434 260 A 29 TYR HE% A 37 VAL HGx% 1.0 1.0 7.54 435 260 A 29 TYR HE% A 37 VAL HGy% 1.0 1.0 7.54 436 261 A 29 TYR HD% A 37 VAL HGx% 1.0 1.0 8.65 437 261 A 29 TYR HD% A 37 VAL HGy% 1.0 1.0 8.65 438 262 A 29 TYR HD% A 37 VAL HGx% 1.0 1.0 8.65 439 262 A 29 TYR HD% A 37 VAL HGy% 1.0 1.0 8.65 440 263 A 35 ILE HD1% A 31 ASN HD21 1.0 1.0 5.34 441 263 A 35 ILE HD1% A 31 ASN HD22 1.0 1.0 5.34 442 264 A 17 ALA HB% A 14 SER HA 1.0 1.0 4.88 443 265 A 16 CYS HA A 2 THR HG2% 1.0 1.0 6.52 444 265 A 16 CYS HA A 2 THR HG1 1.0 1.0 6.52 445 266 A 35 ILE HD1% A 33 ARG HD2 1.0 1.0 6.66 446 266 A 35 ILE HD1% A 33 ARG HD3 1.0 1.0 6.66 447 267 A 2 THR HG1 A 6 LEU HBy 1.0 1.0 5.68 448 267 A 2 THR HG2% A 6 LEU HBy 1.0 1.0 5.68 449 267 A 6 LEU HBx A 2 THR HG2% 1.0 1.0 5.68 450 267 A 6 LEU HBx A 2 THR HG1 1.0 1.0 5.68 451 268 A 34 ALA HB% A 3 CYS HBy 1.0 1.0 5.40 452 268 A 34 ALA HB% A 3 CYS HBx 1.0 1.0 5.40 453 269 A 34 ALA HB% A 3 CYS HBy 1.0 1.0 5.40 454 269 A 34 ALA HB% A 3 CYS HBx 1.0 1.0 5.40 455 270 A 15 ALA HA A 18 ALA HB% 1.0 1.0 4.04 456 271 A 1 ALA HB% A 2 THR HG2% 1.0 1.0 6.33 457 271 A 2 THR HG1 A 1 ALA HB% 1.0 1.0 6.33 458 272 A 34 ALA HB% A 4 ASP HA 1.0 1.0 5.43 459 273 A 35 ILE HD1% A 1 ALA HB% 1.0 1.0 7.54 460 274 A 3 CYS SG A 30 CYS SG 1.0 1.0 2.10 461 275 A 3 CYS SG A 30 CYS CB 1.0 1.0 3.10 462 276 A 30 CYS SG A 3 CYS CB 1.0 1.0 3.10 463 277 A 16 CYS SG A 36 CYS SG 1.0 1.0 2.10 464 278 A 16 CYS SG A 36 CYS CB 1.0 1.0 3.10 465 279 A 36 CYS SG A 16 CYS CB 1.0 1.0 3.10 466 280 A 20 CYS SG A 38 CYS SG 1.0 1.0 2.10 467 281 A 20 CYS SG A 38 CYS CB 1.0 1.0 3.10 468 282 A 38 CYS SG A 20 CYS CB 1.0 1.0 3.10 469 283 A 1 ALA HB% A 37 VAL HGx% 1.0 1.0 7.39 470 283 A 37 VAL HGy% A 1 ALA HB% 1.0 1.0 7.39 471 284 A 2 THR HB A 36 CYS HBx 1.0 1.0 5.34 472 284 A 2 THR HB A 36 CYS HBy 1.0 1.0 5.34 473 285 A 3 CYS H A 3 CYS HBx 1.0 1.0 3.15 474 285 A 3 CYS H A 3 CYS HBy 1.0 1.0 3.15 475 286 A 3 CYS HBx A 4 ASP H 1.0 1.0 4.38 476 286 A 4 ASP H A 3 CYS HBy 1.0 1.0 4.38 477 287 A 16 CYS H A 3 CYS HBx 1.0 1.0 5.34 478 287 A 16 CYS H A 3 CYS HBy 1.0 1.0 5.34 479 288 A 34 ALA H A 3 CYS HBx 1.0 1.0 4.26 480 288 A 34 ALA H A 3 CYS HBy 1.0 1.0 4.26 481 289 A 5 LEU H A 5 LEU HDx% 1.0 1.0 5.73 482 289 A 5 LEU H A 5 LEU HDy% 1.0 1.0 5.73 483 290 A 5 LEU HA A 5 LEU HDx% 1.0 1.0 3.72 484 290 A 5 LEU HDy% A 5 LEU HA 1.0 1.0 3.72 485 291 A 8 GLY H A 7 SER HBx 1.0 1.0 3.46 486 291 A 8 GLY H A 7 SER HBy 1.0 1.0 3.46 487 292 A 8 GLY H A 11 VAL HGx% 1.0 1.0 6.42 488 292 A 11 VAL HGy% A 8 GLY H 1.0 1.0 6.42 489 293 A 9 THR H A 11 VAL HGx% 1.0 1.0 6.42 490 293 A 11 VAL HGy% A 9 THR H 1.0 1.0 6.42 491 294 A 10 GLY H A 10 GLY HAy 1.0 1.0 2.46 492 294 A 10 GLY HAx A 10 GLY H 1.0 1.0 2.46 493 295 A 11 VAL H A 11 VAL HGx% 1.0 1.0 3.56 494 295 A 11 VAL H A 11 VAL HGy% 1.0 1.0 3.56 495 296 A 12 LYS H A 11 VAL HGx% 1.0 1.0 4.17 496 296 A 12 LYS H A 11 VAL HGy% 1.0 1.0 4.17 497 297 A 13 HIS H A 11 VAL HGx% 1.0 1.0 6.42 498 297 A 13 HIS H A 11 VAL HGy% 1.0 1.0 6.42 499 298 A 13 HIS HD1 A 11 VAL HGx% 1.0 1.0 6.42 500 298 A 13 HIS HD2 A 11 VAL HGx% 1.0 1.0 6.42 501 298 A 11 VAL HGy% A 13 HIS HD2 1.0 1.0 6.42 502 298 A 13 HIS HD1 A 11 VAL HGy% 1.0 1.0 6.42 503 299 A 12 LYS H A 12 LYS HGx 1.0 1.0 3.08 504 299 A 12 LYS H A 12 LYS HGy 1.0 1.0 3.08 505 300 A 12 LYS HA A 12 LYS HGx 1.0 1.0 3.07 506 300 A 12 LYS HA A 12 LYS HGy 1.0 1.0 3.07 507 301 A 15 ALA H A 14 SER HBx 1.0 1.0 3.20 508 301 A 15 ALA H A 14 SER HBy 1.0 1.0 3.20 509 302 A 17 ALA HB% A 21 LEU HDx% 1.0 1.0 7.10 510 302 A 17 ALA HB% A 21 LEU HDy% 1.0 1.0 7.10 511 303 A 17 ALA HB% A 27 GLY HAy 1.0 1.0 4.99 512 303 A 27 GLY HAx A 17 ALA HB% 1.0 1.0 4.99 513 304 A 18 ALA HA A 21 LEU HBx 1.0 1.0 2.46 514 304 A 18 ALA HA A 21 LEU HBy 1.0 1.0 2.46 515 305 A 18 ALA HA A 21 LEU HDx% 1.0 1.0 4.32 516 305 A 18 ALA HA A 21 LEU HDy% 1.0 1.0 4.32 517 306 A 18 ALA HB% A 21 LEU HDx% 1.0 1.0 7.39 518 306 A 18 ALA HB% A 21 LEU HDy% 1.0 1.0 7.39 519 307 A 20 CYS H A 20 CYS HBx 1.0 1.0 2.96 520 307 A 20 CYS H A 20 CYS HBy 1.0 1.0 2.96 521 308 A 21 LEU H A 20 CYS HBx 1.0 1.0 3.40 522 308 A 21 LEU H A 20 CYS HBy 1.0 1.0 3.40 523 309 A 21 LEU H A 21 LEU HBx 1.0 1.0 2.72 524 309 A 21 LEU H A 21 LEU HBy 1.0 1.0 2.72 525 310 A 21 LEU H A 21 LEU HDx% 1.0 1.0 6.42 526 310 A 21 LEU H A 21 LEU HDy% 1.0 1.0 6.42 527 311 A 21 LEU HA A 21 LEU HDx% 1.0 1.0 4.08 528 311 A 21 LEU HA A 21 LEU HDy% 1.0 1.0 4.08 529 312 A 21 LEU HBy A 27 GLY HAy 1.0 1.0 3.73 530 312 A 21 LEU HBx A 27 GLY HAy 1.0 1.0 3.73 531 312 A 27 GLY HAx A 21 LEU HBx 1.0 1.0 3.73 532 312 A 27 GLY HAx A 21 LEU HBy 1.0 1.0 3.73 533 313 A 26 ARG HA A 21 LEU HDx% 1.0 1.0 4.67 534 313 A 26 ARG HA A 21 LEU HDy% 1.0 1.0 4.67 535 314 A 22 LEU H A 22 LEU HBy 1.0 1.0 2.76 536 314 A 22 LEU H A 22 LEU HBx 1.0 1.0 2.76 537 315 A 22 LEU HA A 22 LEU HDx% 1.0 1.0 4.14 538 315 A 22 LEU HA A 22 LEU HDy% 1.0 1.0 4.14 539 316 A 23 ARG H A 23 ARG HG3 1.0 1.0 3.10 540 316 A 23 ARG H A 23 ARG HG2 1.0 1.0 3.10 541 317 A 23 ARG HA A 23 ARG HBx 1.0 1.0 2.53 542 317 A 23 ARG HA A 23 ARG HBy 1.0 1.0 2.53 543 318 A 23 ARG HBx A 23 ARG HE 1.0 1.0 4.19 544 318 A 23 ARG HE A 23 ARG HBy 1.0 1.0 4.19 545 319 A 24 GLY H A 24 GLY HAy 1.0 1.0 2.29 546 319 A 24 GLY H A 24 GLY HAx 1.0 1.0 2.29 547 320 A 25 ASN H A 25 ASN HBy 1.0 1.0 2.90 548 320 A 25 ASN H A 25 ASN HBx 1.0 1.0 2.90 549 321 A 26 ARG H A 25 ASN HBy 1.0 1.0 2.66 550 321 A 26 ARG H A 25 ASN HBx 1.0 1.0 2.66 551 322 A 26 ARG H A 26 ARG HGx 1.0 1.0 4.11 552 322 A 26 ARG H A 26 ARG HGy 1.0 1.0 4.11 553 323 A 26 ARG HA A 26 ARG HGx 1.0 1.0 3.40 554 323 A 26 ARG HA A 26 ARG HGy 1.0 1.0 3.40 555 324 A 29 TYR H A 28 GLY HAy 1.0 1.0 2.52 556 324 A 28 GLY HAx A 29 TYR H 1.0 1.0 2.52 557 325 A 38 CYS HA A 28 GLY HAy 1.0 1.0 3.67 558 325 A 28 GLY HAx A 38 CYS HA 1.0 1.0 3.67 559 326 A 29 TYR H A 29 TYR HBx 1.0 1.0 3.37 560 326 A 29 TYR H A 29 TYR HBy 1.0 1.0 3.37 561 327 A 29 TYR HD% A 37 VAL HGx% 1.0 1.0 7.57 562 327 A 29 TYR HD% A 37 VAL HGy% 1.0 1.0 7.57 563 328 A 31 ASN HBx A 29 TYR HE% 1.0 1.0 5.85 564 328 A 29 TYR HE% A 31 ASN HBy 1.0 1.0 5.85 565 329 A 29 TYR HE% A 37 VAL HGx% 1.0 1.0 6.23 566 329 A 29 TYR HE% A 37 VAL HGy% 1.0 1.0 6.23 567 330 A 39 ARG HBx A 29 TYR HE% 1.0 1.0 6.70 568 330 A 29 TYR HE% A 39 ARG HBy 1.0 1.0 6.70 569 331 A 31 ASN H A 30 CYS HBx 1.0 1.0 3.12 570 331 A 31 ASN H A 30 CYS HBy 1.0 1.0 3.12 571 332 A 31 ASN H A 31 ASN HBx 1.0 1.0 2.89 572 332 A 31 ASN H A 31 ASN HBy 1.0 1.0 2.89 573 333 A 31 ASN H A 37 VAL HGx% 1.0 1.0 4.50 574 333 A 31 ASN H A 37 VAL HGy% 1.0 1.0 4.50 575 334 A 31 ASN HBx A 31 ASN HD21 1.0 1.0 2.73 576 334 A 31 ASN HBy A 31 ASN HD21 1.0 1.0 2.73 577 334 A 31 ASN HBx A 31 ASN HD22 1.0 1.0 2.73 578 334 A 31 ASN HD22 A 31 ASN HBy 1.0 1.0 2.73 579 335 A 32 GLY H A 31 ASN HBx 1.0 1.0 2.92 580 335 A 32 GLY H A 31 ASN HBy 1.0 1.0 2.92 581 336 A 31 ASN HBx A 37 VAL HGx% 1.0 1.0 4.08 582 336 A 31 ASN HBy A 37 VAL HGx% 1.0 1.0 4.08 583 336 A 31 ASN HBx A 37 VAL HGy% 1.0 1.0 4.08 584 336 A 37 VAL HGy% A 31 ASN HBy 1.0 1.0 4.08 585 337 A 31 ASN HD21 A 37 VAL HGx% 1.0 1.0 3.66 586 337 A 31 ASN HD22 A 37 VAL HGx% 1.0 1.0 3.66 587 337 A 37 VAL HGy% A 31 ASN HD21 1.0 1.0 3.66 588 337 A 31 ASN HD22 A 37 VAL HGy% 1.0 1.0 3.66 589 338 A 32 GLY H A 32 GLY HAy 1.0 1.0 2.28 590 338 A 32 GLY H A 32 GLY HAx 1.0 1.0 2.28 591 339 A 33 ARG H A 32 GLY HAy 1.0 1.0 3.08 592 339 A 33 ARG H A 32 GLY HAx 1.0 1.0 3.08 593 340 A 33 ARG H A 33 ARG HBy 1.0 1.0 3.57 594 340 A 33 ARG H A 33 ARG HBx 1.0 1.0 3.57 595 341 A 33 ARG HA A 33 ARG HBy 1.0 1.0 2.60 596 341 A 33 ARG HA A 33 ARG HBx 1.0 1.0 2.60 597 342 A 33 ARG HG3 A 35 ILE HD1% 1.0 1.0 4.50 598 342 A 35 ILE HD1% A 33 ARG HG2 1.0 1.0 4.50 599 343 A 35 ILE H A 35 ILE HG1y 1.0 1.0 4.40 600 343 A 35 ILE H A 35 ILE HG2% 1.0 1.0 4.40 601 343 A 35 ILE H A 35 ILE HG1x 1.0 1.0 4.40 602 344 A 35 ILE HA A 35 ILE HG1y 1.0 1.0 2.58 603 344 A 35 ILE HA A 35 ILE HG2% 1.0 1.0 2.58 604 344 A 35 ILE HA A 35 ILE HG1x 1.0 1.0 2.58 605 345 A 36 CYS H A 35 ILE HG1y 1.0 1.0 5.34 606 345 A 36 CYS H A 35 ILE HG2% 1.0 1.0 5.34 607 345 A 36 CYS H A 35 ILE HG1x 1.0 1.0 5.34 608 346 A 37 VAL H A 36 CYS HBx 1.0 1.0 3.88 609 346 A 37 VAL H A 36 CYS HBy 1.0 1.0 3.88 610 347 A 37 VAL H A 37 VAL HGx% 1.0 1.0 3.74 611 347 A 37 VAL H A 37 VAL HGy% 1.0 1.0 3.74 612 348 A 38 CYS H A 37 VAL HGx% 1.0 1.0 4.58 613 348 A 38 CYS H A 37 VAL HGy% 1.0 1.0 4.58 614 349 A 38 CYS H A 38 CYS HBx 1.0 1.0 3.07 615 349 A 38 CYS H A 38 CYS HBy 1.0 1.0 3.07 616 350 A 39 ARG H A 38 CYS HBx 1.0 1.0 3.43 617 350 A 39 ARG H A 38 CYS HBy 1.0 1.0 3.43 618 351 A 39 ARG H A 39 ARG HBx 1.0 1.0 2.54 619 351 A 39 ARG H A 39 ARG HBy 1.0 1.0 2.54 620 352 A 39 ARG HBx A 39 ARG HE 1.0 1.0 4.76 621 352 A 39 ARG HE A 39 ARG HBy 1.0 1.0 4.76 622 353 A 40 ASN H A 40 ASN HBy 1.0 1.0 2.57 623 353 A 40 ASN H A 40 ASN HBx 1.0 1.0 2.57 624 354 A 40 ASN HBy A 40 ASN HD22 1.0 1.0 3.00 625 354 A 40 ASN HBx A 40 ASN HD22 1.0 1.0 3.00 626 354 A 40 ASN HD21 A 40 ASN HBy 1.0 1.0 3.00 627 354 A 40 ASN HD21 A 40 ASN HBx 1.0 1.0 3.00 628 355 A 40 ASN HBy A 40 ASN HD22 1.0 1.0 3.00 629 355 A 40 ASN HBx A 40 ASN HD22 1.0 1.0 3.00 630 355 A 40 ASN HD21 A 40 ASN HBy 1.0 1.0 3.00 631 355 A 40 ASN HD21 A 40 ASN HBx 1.0 1.0 3.00 stop_ save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_2 _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 -139.0 -79.0 PHI 2 2 A 2 THR N A 2 THR CA A 2 THR C A 3 CYS N 1.0 123.0 183.0 PSI 3 3 A 2 THR C A 3 CYS N A 3 CYS CA A 3 CYS C 1.0 -109.0 -47.0 PHI 4 4 A 3 CYS N A 3 CYS CA A 3 CYS C A 4 ASP N 1.0 -39.0 23.0 PSI 5 5 A 8 GLY C A 9 THR N A 9 THR CA A 9 THR C 1.0 -109.0 -49.0 PHI 6 6 A 9 THR N A 9 THR CA A 9 THR C A 10 GLY N 1.0 155.0 171.0 PSI 7 7 A 13 HIS C A 14 SER N A 14 SER CA A 14 SER C 1.0 -89.0 -45.0 PHI 8 8 A 14 SER N A 14 SER CA A 14 SER C A 15 ALA N 1.0 -63.0 -5.0 PSI 9 9 A 14 SER C A 15 ALA N A 15 ALA CA A 15 ALA C 1.0 -75.0 -45.0 PHI 10 10 A 15 ALA N A 15 ALA CA A 15 ALA C A 16 CYS N 1.0 -73.0 -11.0 PSI 11 11 A 15 ALA C A 16 CYS N A 16 CYS CA A 16 CYS C 1.0 -97.0 -45.0 PHI 12 12 A 16 CYS N A 16 CYS CA A 16 CYS C A 17 ALA N 1.0 -65.0 -25.0 PSI 13 13 A 16 CYS C A 17 ALA N A 17 ALA CA A 17 ALA C 1.0 -95.0 -45.0 PHI 14 14 A 17 ALA N A 17 ALA CA A 17 ALA C A 18 ALA N 1.0 -71.0 -11.0 PSI 15 15 A 17 ALA C A 18 ALA N A 18 ALA CA A 18 ALA C 1.0 -93.0 -45.0 PHI 16 16 A 18 ALA N A 18 ALA CA A 18 ALA C A 19 HIS N 1.0 -73.0 -11.0 PSI 17 17 A 18 ALA C A 19 HIS N A 19 HIS CA A 19 HIS C 1.0 -85.0 -45.0 PHI 18 18 A 19 HIS N A 19 HIS CA A 19 HIS C A 20 CYS N 1.0 -65.0 -11.0 PSI 19 19 A 19 HIS C A 20 CYS N A 20 CYS CA A 20 CYS C 1.0 -95.0 -45.0 PHI 20 20 A 20 CYS N A 20 CYS CA A 20 CYS C A 21 LEU N 1.0 -71.0 -11.0 PSI 21 21 A 20 CYS C A 21 LEU N A 21 LEU CA A 21 LEU C 1.0 -95.0 -45.0 PHI 22 22 A 21 LEU N A 21 LEU CA A 21 LEU C A 22 LEU N 1.0 -67.0 -7.0 PSI 23 23 A 21 LEU C A 22 LEU N A 22 LEU CA A 22 LEU C 1.0 -99.0 -45.0 PHI 24 24 A 22 LEU N A 22 LEU CA A 22 LEU C A 23 ARG N 1.0 -63.0 -1.0 PSI 25 25 A 22 LEU C A 23 ARG N A 23 ARG CA A 23 ARG C 1.0 -119.0 -57.0 PHI 26 26 A 23 ARG N A 23 ARG CA A 23 ARG C A 24 GLY N 1.0 -37.0 23.0 PSI 27 27 A 24 GLY C A 25 ASN N A 25 ASN CA A 25 ASN C 1.0 -127.0 -65.0 PHI 28 28 A 25 ASN N A 25 ASN CA A 25 ASN C A 26 ARG N 1.0 145.0 165.0 PSI 29 29 A 28 GLY C A 29 TYR N A 29 TYR CA A 29 TYR C 1.0 -137.0 -77.0 PHI 30 30 A 29 TYR N A 29 TYR CA A 29 TYR C A 30 CYS N 1.0 101.0 161.0 PSI 31 31 A 29 TYR C A 30 CYS N A 30 CYS CA A 30 CYS C 1.0 -125.0 -65.0 PHI 32 32 A 30 CYS N A 30 CYS CA A 30 CYS C A 31 ASN N 1.0 125.0 165.0 PSI 33 33 A 34 ALA C A 35 ILE N A 35 ILE CA A 35 ILE C 1.0 -135.0 -81.0 PHI 34 34 A 35 ILE N A 35 ILE CA A 35 ILE C A 36 CYS N 1.0 135.0 165.0 PSI 35 35 A 35 ILE C A 36 CYS N A 36 CYS CA A 36 CYS C 1.0 -105.0 -51.0 PHI 36 36 A 36 CYS N A 36 CYS CA A 36 CYS C A 37 VAL N 1.0 125.0 147.0 PSI 37 37 A 36 CYS C A 37 VAL N A 37 VAL CA A 37 VAL C 1.0 -135.0 -95.0 PHI 38 38 A 37 VAL N A 37 VAL CA A 37 VAL C A 38 CYS N 1.0 101.0 115.0 PSI 39 39 A 37 VAL C A 38 CYS N A 38 CYS CA A 38 CYS C 1.0 -129.0 -67.0 PHI 40 40 A 38 CYS N A 38 CYS CA A 38 CYS C A 39 ARG N 1.0 115.0 151.0 PSI 41 41 A 38 CYS C A 39 ARG N A 39 ARG CA A 39 ARG C 1.0 -143.0 -83.0 PHI 42 42 A 39 ARG N A 39 ARG CA A 39 ARG C A 40 ASN N 1.0 113.0 175.0 PSI 43 43 A 1 ALA N A 1 ALA CA A 1 ALA C A 2 THR N 1.0 -85.0 205.0 PSI 44 44 A 3 CYS C A 4 ASP N A 4 ASP CA A 4 ASP C 1.0 -155.0 -45.0 PHI 45 45 A 4 ASP N A 4 ASP CA A 4 ASP C A 5 LEU N 1.0 135.0 185.0 PSI 46 46 A 4 ASP C A 5 LEU N A 5 LEU CA A 5 LEU C 1.0 -315.0 -45.0 PHI 47 47 A 4 ASP C A 5 LEU N A 5 LEU CA A 5 LEU C 1.0 -175.0 65.0 PHI 48 48 A 5 LEU N A 5 LEU CA A 5 LEU C A 6 LEU N 1.0 45.0 195.0 PSI 49 49 A 5 LEU C A 6 LEU N A 6 LEU CA A 6 LEU C 1.0 -135.0 -45.0 PHI 50 50 A 6 LEU N A 6 LEU CA A 6 LEU C A 7 SER N 1.0 -85.0 -25.0 PSI 51 51 A 6 LEU C A 7 SER N A 7 SER CA A 7 SER C 1.0 -145.0 -75.0 PHI 52 52 A 7 SER N A 7 SER CA A 7 SER C A 8 GLY N 1.0 -5.0 15.0 PSI 53 53 A 7 SER C A 8 GLY N A 8 GLY CA A 8 GLY C 1.0 -295.0 -65.0 PHI 54 54 A 8 GLY N A 8 GLY CA A 8 GLY C A 9 THR N 1.0 -235.0 -125.0 PSI 55 55 A 9 THR C A 10 GLY N A 10 GLY CA A 10 GLY C 1.0 -295.0 -65.0 PHI 56 56 A 9 THR C A 10 GLY N A 10 GLY CA A 10 GLY C 1.0 -135.0 135.0 PHI 57 57 A 10 GLY N A 10 GLY CA A 10 GLY C A 11 VAL N 1.0 -15.0 15.0 PSI 58 58 A 10 GLY C A 11 VAL N A 11 VAL CA A 11 VAL C 1.0 -135.0 -45.0 PHI 59 59 A 11 VAL N A 11 VAL CA A 11 VAL C A 12 LYS N 1.0 -85.0 -15.0 PSI 60 60 A 11 VAL C A 12 LYS N A 12 LYS CA A 12 LYS C 1.0 -315.0 -45.0 PHI 61 61 A 11 VAL C A 12 LYS N A 12 LYS CA A 12 LYS C 1.0 -155.0 75.0 PHI 62 62 A 12 LYS N A 12 LYS CA A 12 LYS C A 13 HIS N 1.0 55.0 185.0 PSI 63 63 A 12 LYS C A 13 HIS N A 13 HIS CA A 13 HIS C 1.0 -125.0 -45.0 PHI 64 64 A 13 HIS N A 13 HIS CA A 13 HIS C A 14 SER N 1.0 -45.0 5.0 PSI 65 65 A 23 ARG C A 24 GLY N A 24 GLY CA A 24 GLY C 1.0 -315.0 -45.0 PHI 66 66 A 23 ARG C A 24 GLY N A 24 GLY CA A 24 GLY C 1.0 -145.0 145.0 PHI 67 67 A 25 ASN C A 26 ARG N A 26 ARG CA A 26 ARG C 1.0 -145.0 -45.0 PHI 68 68 A 26 ARG N A 26 ARG CA A 26 ARG C A 27 GLY N 1.0 -85.0 175.0 PSI 69 69 A 26 ARG C A 27 GLY N A 27 GLY CA A 27 GLY C 1.0 -315.0 -45.0 PHI 70 70 A 27 GLY N A 27 GLY CA A 27 GLY C A 28 GLY N 1.0 -195.0 -165.0 PSI 71 71 A 27 GLY C A 28 GLY N A 28 GLY CA A 28 GLY C 1.0 -315.0 -45.0 PHI 72 72 A 28 GLY N A 28 GLY CA A 28 GLY C A 29 TYR N 1.0 -245.0 -115.0 PSI 73 73 A 30 CYS C A 31 ASN N A 31 ASN CA A 31 ASN C 1.0 -155.0 -45.0 PHI 74 74 A 31 ASN N A 31 ASN CA A 31 ASN C A 32 GLY N 1.0 -205.0 -155.0 PSI 75 75 A 31 ASN C A 32 GLY N A 32 GLY CA A 32 GLY C 1.0 -315.0 -45.0 PHI 76 76 A 31 ASN C A 32 GLY N A 32 GLY CA A 32 GLY C 1.0 -145.0 145.0 PHI 77 77 A 32 GLY N A 32 GLY CA A 32 GLY C A 33 ARG N 1.0 -115.0 115.0 PSI 78 78 A 32 GLY C A 33 ARG N A 33 ARG CA A 33 ARG C 1.0 -185.0 -95.0 PHI 79 79 A 33 ARG N A 33 ARG CA A 33 ARG C A 34 ALA N 1.0 5.0 65.0 PSI 80 80 A 33 ARG C A 34 ALA N A 34 ALA CA A 34 ALA C 1.0 55.0 75.0 PHI 81 81 A 34 ALA N A 34 ALA CA A 34 ALA C A 35 ILE N 1.0 25.0 55.0 PSI 82 82 A 39 ARG C A 40 ASN N A 40 ASN CA A 40 ASN C 1.0 -145.0 -45.0 PHI 83 83 A 39 ARG C A 40 ASN N A 40 ASN CA A 40 ASN C 1.0 -105.0 225.0 PHI stop_ save_