data_nef_c17583_2lbz 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 18 LEU C 1 19 DSG N 1 19 DSG C 1 20 LEU N 1 27 ALA C 1 28 DSN N 1 28 DSN C 1 29 THR N 1 13 CYS SG 1 19 DSG CA 1 4 CYS SG 1 28 DSN CA 1 21 VAL C 1 22 2TL N 1 22 2TL C 1 23 ALA N 1 24 ALA C 1 25 2TL N 1 25 2TL C 1 26 GLY N 1 10 CYS SG 1 22 2TL CA 1 7 CYS SG 1 25 2TL CA 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 ASP start . . 2 A 2 TRP middle . . 3 A 3 THR middle . . 4 A 4 CYS middle -HG . 5 A 5 TRP middle . . 6 A 6 SER middle . . 7 A 7 CYS middle -HG . 8 A 8 LEU middle . . 9 A 9 VAL middle . . 10 A 10 CYS middle -HG . 11 A 11 ALA middle . . 12 A 12 ALA middle . . 13 A 13 CYS middle -HG . 14 A 14 SER middle . . 15 A 15 VAL middle . . 16 A 16 GLU middle . . 17 A 17 LEU middle . . 18 A 18 LEU middle . . 19 A 19 DSG middle . . 20 A 20 LEU middle . . 21 A 21 VAL middle . . 22 A 22 2TL middle . . 23 A 23 ALA middle . . 24 A 24 ALA middle . . 25 A 25 2TL middle . . 26 A 26 GLY middle . false 27 A 27 ALA middle . . 28 A 28 DSN middle . . 29 A 29 THR middle . . 30 A 30 ALA middle . . 31 A 31 SER 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 ASP HA H 1 4.275 0.03 A 1 ASP HBx H 1 2.997 0.03 A 1 ASP HBy H 1 3.065 0.03 A 1 ASP CA C 13 52.447 0.3 A 1 ASP CB C 13 37.737 0.3 A 2 TRP H H 1 8.943 0.03 A 2 TRP HA H 1 4.415 0.03 A 2 TRP HBx H 1 3.184 0.03 A 2 TRP HBy H 1 3.294 0.03 A 2 TRP C C 13 173.011 0.3 A 2 TRP CA C 13 59.562 0.3 A 2 TRP CB C 13 29.040 0.3 A 2 TRP N N 15 124.885 0.3 A 3 THR H H 1 7.416 0.03 A 3 THR HA H 1 3.862 0.03 A 3 THR HB H 1 4.013 0.03 A 3 THR HG2% H 1 0.742 0.03 A 3 THR C C 13 176.563 0.3 A 3 THR CA C 13 63.637 0.3 A 3 THR CB C 13 68.670 0.3 A 3 THR CG2 C 13 20.786 0.3 A 3 THR N N 15 110.912 0.3 A 4 CYS H H 1 7.753 0.03 A 4 CYS HA H 1 4.117 0.03 A 4 CYS HBx H 1 2.633 0.03 A 4 CYS HBy H 1 3.247 0.03 A 4 CYS C C 13 176.371 0.3 A 4 CYS CA C 13 57.770 0.3 A 4 CYS CB C 13 33.484 0.3 A 4 CYS N N 15 117.936 0.3 A 5 TRP H H 1 7.800 0.03 A 5 TRP HA H 1 4.240 0.03 A 5 TRP HBx H 1 3.153 0.03 A 5 TRP HBy H 1 3.239 0.03 A 5 TRP HE3 H 1 7.508 0.03 A 5 TRP HZ3 H 1 6.884 0.03 A 5 TRP C C 13 175.831 0.3 A 5 TRP CA C 13 60.127 0.3 A 5 TRP CB C 13 28.589 0.3 A 5 TRP N N 15 118.457 0.3 A 6 SER H H 1 7.829 0.03 A 6 SER HA H 1 4.048 0.03 A 6 SER HBx H 1 3.709 0.03 A 6 SER HBy H 1 3.709 0.03 A 6 SER C C 13 177.970 0.3 A 6 SER CA C 13 61.815 0.3 A 6 SER CB C 13 62.648 0.3 A 6 SER N N 15 114.289 0.3 A 7 CYS H H 1 7.198 0.03 A 7 CYS HA H 1 4.022 0.03 A 7 CYS HBx H 1 2.877 0.03 A 7 CYS HBy H 1 3.614 0.03 A 7 CYS C C 13 174.951 0.3 A 7 CYS CA C 13 57.336 0.3 A 7 CYS CB C 13 32.286 0.3 A 7 CYS N N 15 117.111 0.3 A 8 LEU H H 1 7.801 0.03 A 8 LEU HA H 1 4.033 0.03 A 8 LEU HBx H 1 1.539 0.03 A 8 LEU HBy H 1 1.847 0.03 A 8 LEU HDx% H 1 0.999 0.03 A 8 LEU HDy% H 1 0.924 0.03 A 8 LEU HG H 1 1.928 0.03 A 8 LEU C C 13 174.628 0.3 A 8 LEU CA C 13 57.653 0.3 A 8 LEU CB C 13 42.110 0.3 A 8 LEU CDy C 13 24.639 0.3 A 8 LEU CDx C 13 23.213 0.3 A 8 LEU CG C 13 27.545 0.3 A 8 LEU N N 15 119.586 0.3 A 9 VAL H H 1 7.743 0.03 A 9 VAL HA H 1 3.769 0.03 A 9 VAL HB H 1 2.176 0.03 A 9 VAL HGx% H 1 1.042 0.03 A 9 VAL HGy% H 1 1.001 0.03 A 9 VAL C C 13 178.641 0.3 A 9 VAL CA C 13 64.704 0.3 A 9 VAL CB C 13 31.587 0.3 A 9 VAL CGy C 13 20.829 0.3 A 9 VAL CGx C 13 19.763 0.3 A 9 VAL N N 15 115.037 0.3 A 10 CYS H H 1 7.243 0.03 A 10 CYS HA H 1 4.039 0.03 A 10 CYS HBx H 1 2.801 0.03 A 10 CYS HBy H 1 3.671 0.03 A 10 CYS C C 13 176.537 0.3 A 10 CYS CA C 13 56.917 0.3 A 10 CYS CB C 13 31.993 0.3 A 10 CYS N N 15 117.287 0.3 A 11 ALA H H 1 7.878 0.03 A 11 ALA HA H 1 3.984 0.03 A 11 ALA HB% H 1 1.417 0.03 A 11 ALA C C 13 174.565 0.3 A 11 ALA CA C 13 54.187 0.3 A 11 ALA CB C 13 17.635 0.3 A 11 ALA N N 15 120.225 0.3 A 12 ALA H H 1 7.761 0.03 A 12 ALA HA H 1 4.115 0.03 A 12 ALA HB% H 1 1.404 0.03 A 12 ALA C C 13 177.085 0.3 A 12 ALA CA C 13 53.016 0.3 A 12 ALA CB C 13 17.868 0.3 A 12 ALA N N 15 116.658 0.3 A 13 CYS H H 1 7.216 0.03 A 13 CYS HA H 1 4.213 0.03 A 13 CYS HBx H 1 3.012 0.03 A 13 CYS HBy H 1 3.484 0.03 A 13 CYS C C 13 177.660 0.3 A 13 CYS CA C 13 55.902 0.3 A 13 CYS CB C 13 32.403 0.3 A 13 CYS N N 15 116.103 0.3 A 14 SER HA H 1 4.082 0.03 A 14 SER HBx H 1 3.772 0.03 A 14 SER HBy H 1 3.831 0.03 A 14 SER CA C 13 58.706 0.3 A 14 SER CB C 13 63.625 0.3 A 15 VAL H H 1 7.892 0.03 A 15 VAL HA H 1 4.002 0.03 A 15 VAL HB H 1 2.068 0.03 A 15 VAL HGx% H 1 0.923 0.03 A 15 VAL HGy% H 1 0.891 0.03 A 15 VAL C C 13 174.575 0.3 A 15 VAL CA C 13 63.652 0.3 A 15 VAL CB C 13 32.404 0.3 A 15 VAL CGy C 13 20.965 0.3 A 15 VAL CGx C 13 19.950 0.3 A 15 VAL N N 15 116.083 0.3 A 16 GLU H H 1 7.943 0.03 A 16 GLU HA H 1 4.292 0.03 A 16 GLU HBx H 1 1.909 0.03 A 16 GLU HBy H 1 2.245 0.03 A 16 GLU HGx H 1 2.434 0.03 A 16 GLU HGy H 1 2.434 0.03 A 16 GLU C C 13 175.097 0.3 A 16 GLU CA C 13 55.540 0.3 A 16 GLU CB C 13 27.546 0.3 A 16 GLU CG C 13 32.090 0.3 A 16 GLU N N 15 118.503 0.3 A 17 LEU H H 1 7.757 0.03 A 17 LEU HA H 1 4.071 0.03 A 17 LEU HBx H 1 1.453 0.03 A 17 LEU HBy H 1 1.720 0.03 A 17 LEU HDx% H 1 0.825 0.03 A 17 LEU HDy% H 1 0.772 0.03 A 17 LEU HG H 1 1.612 0.03 A 17 LEU CA C 13 57.730 0.3 A 17 LEU CB C 13 42.156 0.3 A 17 LEU CDy C 13 24.726 0.3 A 17 LEU CDx C 13 22.840 0.3 A 17 LEU CG C 13 26.731 0.3 A 17 LEU N N 15 117.302 0.3 A 18 LEU H H 1 8.389 0.03 A 18 LEU HA H 1 3.909 0.03 A 18 LEU HBx H 1 1.592 0.03 A 18 LEU HBy H 1 1.607 0.03 A 18 LEU HDx% H 1 0.886 0.03 A 18 LEU HDy% H 1 0.826 0.03 A 18 LEU HG H 1 1.670 0.03 A 18 LEU C C 13 177.907 0.3 A 18 LEU CA C 13 58.231 0.3 A 18 LEU CB C 13 40.987 0.3 A 18 LEU CDy C 13 23.799 0.3 A 18 LEU CDx C 13 23.604 0.3 A 18 LEU CG C 13 27.089 0.3 A 18 LEU N N 15 121.981 0.3 A 19 DSG H H 1 8.283 0.03 A 19 DSG HBy H 1 3.231 0.03 A 19 DSG HBx H 1 3.128 0.03 A 19 DSG HD2y H 1 7.787 0.03 A 19 DSG HD2x H 1 6.864 0.03 A 19 DSG C C 13 177.664 0.3 A 19 DSG CA C 13 67.093 0.3 A 19 DSG CB C 13 41.150 0.3 A 19 DSG N N 15 119.193 0.3 A 19 DSG ND2 N 15 113.270 0.3 A 20 LEU HA H 1 4.033 0.03 A 20 LEU HBx H 1 1.383 0.03 A 20 LEU HBy H 1 1.840 0.03 A 20 LEU HDx% H 1 0.871 0.03 A 20 LEU HDy% H 1 0.834 0.03 A 20 LEU HG H 1 1.837 0.03 A 20 LEU CA C 13 57.803 0.3 A 20 LEU CB C 13 41.855 0.3 A 20 LEU CDy C 13 25.430 0.3 A 20 LEU CDx C 13 22.027 0.3 A 20 LEU CG C 13 27.011 0.3 A 21 VAL H H 1 7.706 0.03 A 21 VAL HA H 1 3.733 0.03 A 21 VAL HB H 1 2.947 0.03 A 21 VAL HGx% H 1 1.075 0.03 A 21 VAL HGy% H 1 1.003 0.03 A 21 VAL C C 13 178.619 0.3 A 21 VAL CA C 13 65.516 0.3 A 21 VAL CB C 13 31.690 0.3 A 21 VAL CGy C 13 20.844 0.3 A 21 VAL CGx C 13 20.727 0.3 A 21 VAL N N 15 117.016 0.3 A 22 2TL H H 1 8.374 0.03 A 22 2TL HB H 1 4.804 0.03 A 22 2TL HG2% H 1 1.162 0.03 A 22 2TL C C 13 176.519 0.3 A 22 2TL CA C 13 72.363 0.3 A 22 2TL CB C 13 71.531 0.3 A 22 2TL CG2 C 13 18.909 0.3 A 22 2TL N N 15 123.631 0.3 A 23 ALA H H 1 8.252 0.03 A 23 ALA HA H 1 4.058 0.03 A 23 ALA HB% H 1 1.435 0.03 A 23 ALA C C 13 175.083 0.3 A 23 ALA CA C 13 54.754 0.3 A 23 ALA CB C 13 18.184 0.3 A 23 ALA N N 15 123.960 0.3 A 24 ALA H H 1 7.771 0.03 A 24 ALA HA H 1 3.939 0.03 A 24 ALA HB% H 1 1.445 0.03 A 24 ALA C C 13 178.065 0.3 A 24 ALA CA C 13 55.239 0.3 A 24 ALA CB C 13 18.032 0.3 A 24 ALA N N 15 120.520 0.3 A 25 2TL H H 1 8.548 0.03 A 25 2TL HB H 1 4.875 0.03 A 25 2TL C C 13 177.783 0.3 A 25 2TL CA C 13 72.429 0.3 A 25 2TL CB C 13 70.907 0.3 A 25 2TL CG2 C 13 18.320 0.3 A 25 2TL N N 15 120.364 0.3 A 26 GLY H H 1 8.150 0.03 A 26 GLY HAx H 1 3.724 0.03 A 26 GLY HAy H 1 3.912 0.03 A 26 GLY C C 13 175.448 0.3 A 26 GLY CA C 13 46.345 0.3 A 26 GLY N N 15 108.183 0.3 A 27 ALA H H 1 7.720 0.03 A 27 ALA HA H 1 3.928 0.03 A 27 ALA HB% H 1 1.423 0.03 A 27 ALA C C 13 174.036 0.3 A 27 ALA CA C 13 55.600 0.3 A 27 ALA CB C 13 17.893 0.3 A 27 ALA N N 15 124.798 0.3 A 28 DSN H H 1 8.066 0.03 A 28 DSN HBy H 1 4.336 0.03 A 28 DSN HBx H 1 3.930 0.03 A 28 DSN C C 13 178.135 0.3 A 28 DSN CA C 13 72.672 0.3 A 28 DSN CB C 13 65.273 0.3 A 28 DSN N N 15 116.425 0.3 A 29 THR H H 1 7.783 0.03 A 29 THR HA H 1 3.766 0.03 A 29 THR HB H 1 3.890 0.03 A 29 THR HG2% H 1 0.138 0.03 A 29 THR C C 13 172.773 0.3 A 29 THR CA C 13 63.882 0.3 A 29 THR CB C 13 69.129 0.3 A 29 THR CG2 C 13 20.505 0.3 A 29 THR N N 15 112.945 0.3 A 30 ALA H H 1 7.469 0.03 A 30 ALA HA H 1 4.246 0.03 A 30 ALA HB% H 1 1.319 0.03 A 30 ALA C C 13 173.587 0.3 A 30 ALA CA C 13 52.160 0.3 A 30 ALA CB C 13 18.791 0.3 A 30 ALA N N 15 122.010 0.3 A 31 SER H H 1 7.475 0.03 A 31 SER HA H 1 4.387 0.03 A 31 SER HBx H 1 3.705 0.03 A 31 SER HBy H 1 3.829 0.03 A 31 SER C C 13 175.964 0.3 A 31 SER CA C 13 57.415 0.3 A 31 SER CB C 13 64.222 0.3 A 31 SER N N 15 111.395 0.3 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 25 2TL HB A 27 ALA H 1.0 . 4.27 2 2 A 27 ALA H A 27 ALA HB% 1.0 . 2.91 3 3 A 27 ALA H A 30 ALA HB% 1.0 . 5.03 4 4 A 22 2TL H A 23 ALA H 1.0 . 3.72 5 5 A 23 ALA H A 10 CYS HBy 1.0 . 3.94 6 6 A 23 ALA H A 23 ALA HB% 1.0 . 3.39 7 7 A 22 2TL H A 21 VAL H 1.0 . 3.79 8 8 A 22 2TL H A 20 LEU HA 1.0 . 4.73 9 9 A 22 2TL H A 10 CYS HBy 1.0 . 4.10 10 10 A 17 LEU H A 18 LEU H 1.0 . 4.21 11 11 A 27 ALA HA A 30 ALA H 1.0 . 4.10 12 12 A 30 ALA HB% A 30 ALA H 1.0 . 3.09 13 13 A 30 ALA H A 29 THR HG2% 1.0 . 4.70 14 14 A 23 ALA H A 24 ALA H 1.0 . 3.41 15 15 A 10 CYS H A 11 ALA H 1.0 . 3.22 16 16 A 24 ALA H A 22 2TL HB 1.0 . 4.48 17 17 A 23 ALA HA A 25 2TL H 1.0 . 3.96 18 18 A 11 ALA H A 8 LEU HA 1.0 . 3.89 19 19 A 25 2TL H A 7 CYS HBy 1.0 . 3.20 20 20 A 24 ALA H A 21 VAL HA 1.0 . 4.40 21 21 A 10 CYS HBy A 24 ALA H 1.0 . 4.90 22 22 A 11 ALA H A 9 VAL HA 1.0 . 4.11 23 23 A 25 2TL H A 7 CYS HBx 1.0 . 4.36 24 24 A 11 ALA H A 10 CYS HBx 1.0 . 4.03 25 25 A 25 2TL H A 24 ALA HB% 1.0 . 3.49 26 26 A 24 ALA H A 24 ALA HB% 1.0 . 2.79 27 27 A 11 ALA H A 11 ALA HB% 1.0 . 2.88 28 28 A 7 CYS H A 8 LEU H 1.0 . 3.32 29 29 A 8 LEU H A 26 GLY HAx 1.0 . 5.46 30 30 A 7 CYS HBy A 8 LEU H 1.0 . 4.65 31 31 A 7 CYS HBx A 8 LEU H 1.0 . 4.34 32 32 A 8 LEU H A 8 LEU HBx 1.0 . 3.66 33 33 A 8 LEU H A 8 LEU HBy 1.0 . 3.66 34 34 A 8 LEU H A 9 VAL HGx% 1.0 . 4.84 35 35 A 17 LEU H A 16 GLU H 1.0 . 4.66 36 36 A 5 TRP H A 5 TRP HE3 1.0 . 4.00 37 37 A 7 CYS H A 5 TRP H 1.0 . 4.31 38 38 A 5 TRP H A 5 TRP HZ3 1.0 . 4.94 39 39 A 5 TRP H A 3 THR HB 1.0 . 4.74 40 40 A 5 TRP H A 4 CYS HBx 1.0 . 4.31 41 41 A 16 GLU H A 16 GLU HGx 1.0 . 4.68 42 41 A 16 GLU H A 16 GLU HGy 1.0 . 4.68 43 42 A 16 GLU H A 16 GLU HBx 1.0 . 4.06 44 43 A 16 GLU H A 15 VAL HB 1.0 . 4.29 45 44 A 16 GLU H A 16 GLU HBy 1.0 . 4.06 46 45 A 29 THR HG2% A 5 TRP H 1.0 . 4.64 47 46 A 3 THR HB A 4 CYS H 1.0 . 3.93 48 47 A 4 CYS H A 4 CYS HBy 1.0 . 4.04 49 48 A 4 CYS HBx A 4 CYS H 1.0 . 3.36 50 49 A 4 CYS H A 3 THR HG2% 1.0 . 4.99 51 50 A 11 ALA H A 12 ALA H 1.0 . 3.17 52 51 A 10 CYS H A 9 VAL H 1.0 . 3.06 53 52 A 7 CYS H A 6 SER H 1.0 . 2.91 54 53 A 7 CYS H A 5 TRP HA 1.0 . 4.31 55 54 A 9 VAL HA A 12 ALA H 1.0 . 4.78 56 55 A 10 CYS HBy A 10 CYS H 1.0 . 3.60 57 56 A 7 CYS HBy A 7 CYS H 1.0 . 3.77 58 57 A 7 CYS H A 4 CYS HBy 1.0 . 5.50 59 58 A 10 CYS H A 10 CYS HBx 1.0 . 2.92 60 59 A 7 CYS HBx A 7 CYS H 1.0 . 2.88 61 60 A 10 CYS H A 9 VAL HB 1.0 . 4.31 62 61 A 12 ALA H A 12 ALA HB% 1.0 . 3.01 63 62 A 10 CYS H A 11 ALA HB% 1.0 . 4.25 64 63 A 10 CYS H A 9 VAL HGx% 1.0 . 3.61 65 64 A 12 ALA H A 13 CYS H 1.0 . 3.45 66 65 A 30 ALA H A 28 DSN H 1.0 . 4.25 67 66 A 25 2TL HB A 28 DSN H 1.0 . 4.17 68 67 A 28 DSN H A 28 DSN HBx 1.0 . 4.20 69 68 A 28 DSN H A 4 CYS HA 1.0 . 4.92 70 69 A 28 DSN H A 28 DSN HBy 1.0 . 4.20 71 70 A 20 LEU HA A 13 CYS H 1.0 . 4.34 72 71 A 26 GLY HAx A 28 DSN H 1.0 . 4.21 73 72 A 4 CYS HBy A 28 DSN H 1.0 . 3.27 74 73 A 4 CYS HBx A 28 DSN H 1.0 . 4.46 75 74 A 27 ALA HB% A 28 DSN H 1.0 . 3.39 76 75 A 12 ALA HB% A 13 CYS H 1.0 . 3.97 77 76 A 29 THR HG2% A 28 DSN H 1.0 . 4.45 78 77 A 9 VAL H A 9 VAL HB 1.0 . 3.08 79 78 A 9 VAL H A 8 LEU HBx 1.0 . 4.53 80 79 A 9 VAL H A 8 LEU HBy 1.0 . 4.53 81 80 A 11 ALA HB% A 9 VAL H 1.0 . 5.14 82 81 A 9 VAL HGx% A 9 VAL H 1.0 . 3.02 83 82 A 30 ALA H A 29 THR H 1.0 . 3.10 84 83 A 28 DSN HBx A 29 THR H 1.0 . 5.08 85 84 A 27 ALA HA A 29 THR H 1.0 . 4.66 86 85 A 28 DSN HBy A 29 THR H 1.0 . 5.08 87 86 A 4 CYS HBy A 29 THR H 1.0 . 3.48 88 87 A 4 CYS HBx A 29 THR H 1.0 . 3.81 89 88 A 27 ALA HB% A 29 THR H 1.0 . 4.82 90 89 A 29 THR HG2% A 29 THR H 1.0 . 3.36 91 90 A 30 ALA HB% A 31 SER H 1.0 . 4.36 92 91 A 24 ALA H A 26 GLY H 1.0 . 4.38 93 92 A 7 CYS H A 26 GLY H 1.0 . 5.50 94 93 A 23 ALA HA A 26 GLY H 1.0 . 4.05 95 94 A 7 CYS HBy A 26 GLY H 1.0 . 3.36 96 95 A 7 CYS HBx A 26 GLY H 1.0 . 3.50 97 96 A 23 ALA HB% A 26 GLY H 1.0 . 4.29 98 97 A 23 ALA H A 21 VAL HA 1.0 . 5.01 99 98 A 5 TRP H A 3 THR HA 1.0 . 4.99 100 99 A 6 SER H A 3 THR HA 1.0 . 5.50 101 100 A 6 SER H A 6 SER HBx 1.0 . 3.90 102 100 A 6 SER H A 6 SER HBy 1.0 . 3.90 103 101 A 3 THR H A 6 SER HBx 1.0 . 5.10 104 101 A 6 SER HBy A 3 THR H 1.0 . 5.10 105 102 A 7 CYS H A 6 SER HBx 1.0 . 5.08 106 102 A 7 CYS H A 6 SER HBy 1.0 . 5.08 107 103 A 9 VAL H A 6 SER HA 1.0 . 4.88 108 104 A 23 ALA H A 20 LEU HA 1.0 . 5.22 109 105 A 7 CYS H A 4 CYS HA 1.0 . 4.86 110 106 A 16 GLU H A 13 CYS HA 1.0 . 4.96 111 107 A 13 CYS HA A 15 VAL H 1.0 . 5.20 112 108 A 12 ALA H A 13 CYS HA 1.0 . 5.11 113 109 A 26 GLY H A 24 ALA HA 1.0 . 4.94 114 110 A 13 CYS H A 11 ALA HA 1.0 . 5.25 115 111 A 1 ASP HA A 2 TRP H 1.0 . 3.54 116 112 A 26 GLY HAx A 29 THR H 1.0 . 5.22 117 113 A 22 2TL H A 10 CYS HBx 1.0 . 4.83 118 114 A 23 ALA H A 10 CYS HBx 1.0 . 4.39 119 115 A 18 LEU H A 18 LEU HG 1.0 . 4.59 120 116 A 8 LEU H A 8 LEU HG 1.0 . 4.63 121 117 A 17 LEU H A 17 LEU HG 1.0 . 4.74 122 118 A 15 VAL H A 15 VAL HGx% 1.0 . 5.06 123 119 A 15 VAL H A 15 VAL HGy% 1.0 . 5.06 124 120 A 3 THR HG2% A 3 THR H 1.0 . 3.90 125 121 A 23 ALA HB% A 21 VAL HA 1.0 . 4.93 126 122 A 21 VAL HA A 24 ALA HB% 1.0 . 5.24 127 123 A 21 VAL HA A 21 VAL HGx% 1.0 . 3.69 128 124 A 21 VAL HA A 21 VAL HGy% 1.0 . 3.69 129 125 A 4 CYS HBy A 29 THR HA 1.0 . 4.49 130 126 A 4 CYS HBx A 29 THR HA 1.0 . 4.51 131 127 A 9 VAL HA A 12 ALA HB% 1.0 . 4.20 132 128 A 15 VAL HA A 15 VAL HGx% 1.0 . 3.95 133 129 A 15 VAL HA A 15 VAL HGy% 1.0 . 3.95 134 130 A 3 THR HG2% A 3 THR HA 1.0 . 3.63 135 131 A 29 THR HG2% A 29 THR HA 1.0 . 3.69 136 132 A 26 GLY HAx A 4 CYS HA 1.0 . 4.49 137 133 A 10 CYS HBx A 7 CYS HA 1.0 . 3.84 138 134 A 8 LEU HA A 8 LEU HG 1.0 . 4.09 139 135 A 17 LEU HA A 20 LEU HBx 1.0 . 4.29 140 136 A 18 LEU HA A 18 LEU HDx% 1.0 . 4.36 141 137 A 18 LEU HA A 18 LEU HDy% 1.0 . 4.36 142 138 A 8 LEU HA A 8 LEU HDy% 1.0 . 4.07 143 139 A 8 LEU HA A 8 LEU HDx% 1.0 . 4.07 144 140 A 23 ALA HA A 26 GLY HAy 1.0 . 4.71 145 141 A 23 ALA HA A 7 CYS HBx 1.0 . 5.05 146 142 A 23 ALA HA A 10 CYS HBx 1.0 . 4.10 147 143 A 16 GLU HA A 16 GLU HGx 1.0 . 3.98 148 143 A 16 GLU HGy A 16 GLU HA 1.0 . 3.98 149 144 A 30 ALA HB% A 27 ALA HA 1.0 . 4.14 150 145 A 13 CYS HA A 12 ALA HA 1.0 . 4.76 151 146 A 9 VAL HA A 12 ALA HA 1.0 . 5.50 152 147 A 8 LEU HA A 26 GLY HAy 1.0 . 5.50 153 148 A 7 CYS HBy A 26 GLY HAy 1.0 . 4.57 154 149 A 4 CYS HBy A 26 GLY HAy 1.0 . 5.26 155 150 A 29 THR HG2% A 26 GLY HAx 1.0 . 4.56 156 151 A 17 LEU HG A 20 LEU HBx 1.0 . 5.28 157 152 A 20 LEU HBx A 20 LEU HDx% 1.0 . 3.82 158 153 A 20 LEU HBy A 20 LEU HDx% 1.0 . 3.73 159 154 A 23 ALA HA A 7 CYS HBy 1.0 . 3.48 160 155 A 26 GLY HAx A 4 CYS HBy 1.0 . 3.93 161 156 A 7 CYS HBx A 26 GLY HAx 1.0 . 4.31 162 157 A 20 LEU HBx A 13 CYS HBx 1.0 . 4.41 163 158 A 20 LEU HBx A 13 CYS HBy 1.0 . 4.41 164 159 A 29 THR HG2% A 4 CYS HBy 1.0 . 3.82 165 160 A 29 THR HG2% A 4 CYS HBx 1.0 . 3.93 166 161 A 10 CYS HBy A 23 ALA HA 1.0 . 3.86 167 162 A 9 VAL HB A 8 LEU HG 1.0 . 5.50 168 163 A 10 CYS HBy A 23 ALA HB% 1.0 . 4.82 169 164 A 10 CYS HBx A 11 ALA HB% 1.0 . 5.27 170 165 A 23 ALA HB% A 10 CYS HBx 1.0 . 5.50 171 166 A 20 LEU HBx A 20 LEU HDy% 1.0 . 3.82 172 167 A 20 LEU HBy A 20 LEU HDy% 1.0 . 3.73 173 168 A 7 CYS H A 5 TRP HBx 1.0 . 5.34 174 168 A 7 CYS H A 5 TRP HBy 1.0 . 5.34 175 169 A 6 SER HA A 8 LEU HDy% 1.0 . 5.01 176 169 A 6 SER HA A 8 LEU HDx% 1.0 . 5.01 177 170 A 7 CYS H A 8 LEU HBy 1.0 . 5.00 178 170 A 7 CYS H A 8 LEU HBx 1.0 . 5.00 179 171 A 8 LEU H A 8 LEU HBy 1.0 . 2.87 180 171 A 8 LEU H A 8 LEU HBx 1.0 . 2.87 181 172 A 8 LEU H A 8 LEU HDy% 1.0 . 4.43 182 172 A 8 LEU H A 8 LEU HDx% 1.0 . 4.43 183 173 A 9 VAL H A 8 LEU HBy 1.0 . 3.74 184 173 A 9 VAL H A 8 LEU HBx 1.0 . 3.74 185 174 A 9 VAL HA A 8 LEU HDy% 1.0 . 3.44 186 174 A 9 VAL HA A 8 LEU HDx% 1.0 . 3.44 187 175 A 9 VAL HB A 8 LEU HDy% 1.0 . 3.23 188 175 A 9 VAL HB A 8 LEU HDx% 1.0 . 3.23 189 176 A 11 ALA HA A 20 LEU HDy% 1.0 . 4.62 190 176 A 11 ALA HA A 20 LEU HDx% 1.0 . 4.62 191 177 A 13 CYS H A 13 CYS HBy 1.0 . 3.08 192 177 A 13 CYS H A 13 CYS HBx 1.0 . 3.08 193 178 A 13 CYS H A 20 LEU HDy% 1.0 . 4.60 194 178 A 13 CYS H A 20 LEU HDx% 1.0 . 4.60 195 179 A 17 LEU HA A 13 CYS HBy 1.0 . 4.49 196 179 A 17 LEU HA A 13 CYS HBx 1.0 . 4.49 197 180 A 19 DSG H A 13 CYS HBy 1.0 . 3.80 198 180 A 13 CYS HBx A 19 DSG H 1.0 . 3.80 199 181 A 20 LEU HA A 13 CYS HBy 1.0 . 3.97 200 181 A 20 LEU HA A 13 CYS HBx 1.0 . 3.97 201 182 A 20 LEU HBx A 13 CYS HBy 1.0 . 3.88 202 182 A 20 LEU HBx A 13 CYS HBx 1.0 . 3.88 203 183 A 20 LEU HG A 13 CYS HBy 1.0 . 4.88 204 183 A 13 CYS HBx A 20 LEU HG 1.0 . 4.88 205 184 A 13 CYS HBx A 20 LEU HDy% 1.0 . 3.80 206 184 A 13 CYS HBy A 20 LEU HDy% 1.0 . 3.80 207 184 A 20 LEU HDx% A 13 CYS HBy 1.0 . 3.80 208 184 A 20 LEU HDx% A 13 CYS HBx 1.0 . 3.80 209 185 A 15 VAL H A 15 VAL HGy% 1.0 . 3.90 210 185 A 15 VAL H A 15 VAL HGx% 1.0 . 3.90 211 186 A 15 VAL HB A 16 GLU HBy 1.0 . 4.50 212 186 A 15 VAL HB A 16 GLU HBx 1.0 . 4.50 213 187 A 16 GLU H A 15 VAL HGy% 1.0 . 4.51 214 187 A 16 GLU H A 15 VAL HGx% 1.0 . 4.51 215 188 A 17 LEU HA A 17 LEU HDx% 1.0 . 3.95 216 188 A 17 LEU HA A 17 LEU HDy% 1.0 . 3.95 217 189 A 17 LEU HA A 20 LEU HDy% 1.0 . 3.73 218 189 A 17 LEU HA A 20 LEU HDx% 1.0 . 3.73 219 190 A 17 LEU HBx A 18 LEU HBx 1.0 . 5.03 220 190 A 17 LEU HBy A 18 LEU HBx 1.0 . 5.03 221 190 A 18 LEU HBy A 17 LEU HBx 1.0 . 5.03 222 190 A 17 LEU HBy A 18 LEU HBy 1.0 . 5.03 223 191 A 20 LEU HBx A 17 LEU HBx 1.0 . 4.81 224 191 A 20 LEU HBx A 17 LEU HBy 1.0 . 4.81 225 192 A 20 LEU HBy A 17 LEU HBx 1.0 . 5.34 226 192 A 20 LEU HBy A 17 LEU HBy 1.0 . 5.34 227 193 A 18 LEU H A 17 LEU HDx% 1.0 . 5.30 228 193 A 18 LEU H A 17 LEU HDy% 1.0 . 5.30 229 194 A 17 LEU HDy% A 20 LEU HDy% 1.0 . 2.99 230 194 A 17 LEU HDx% A 20 LEU HDy% 1.0 . 2.99 231 194 A 20 LEU HDx% A 17 LEU HDx% 1.0 . 2.99 232 194 A 20 LEU HDx% A 17 LEU HDy% 1.0 . 2.99 233 195 A 18 LEU H A 18 LEU HBx 1.0 . 3.66 234 195 A 18 LEU H A 18 LEU HBy 1.0 . 3.66 235 196 A 18 LEU H A 18 LEU HDy% 1.0 . 5.44 236 196 A 18 LEU H A 18 LEU HDx% 1.0 . 5.44 237 197 A 18 LEU HA A 18 LEU HDy% 1.0 . 3.79 238 197 A 18 LEU HA A 18 LEU HDx% 1.0 . 3.79 239 198 A 19 DSG H A 18 LEU HBx 1.0 . 4.27 240 198 A 19 DSG H A 18 LEU HBy 1.0 . 4.27 241 199 A 20 LEU HA A 20 LEU HDy% 1.0 . 3.41 242 199 A 20 LEU HA A 20 LEU HDx% 1.0 . 3.41 243 200 A 21 VAL H A 21 VAL HGy% 1.0 . 3.92 244 200 A 21 VAL H A 21 VAL HGx% 1.0 . 3.92 stop_ save_ save_DYANA/DIANA_distance_constraints_7 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_7 _nef_distance_restraint_list.restraint_origin undefined _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 4 CYS SG A 28 DSN CA 1.0 . 1.6 2 2 A 7 CYS SG A 25 2TL CA 1.0 . 1.6 3 3 A 10 CYS SG A 22 2TL CA 1.0 . 1.6 4 4 A 13 CYS SG A 19 DSG CA 1.0 . 1.6 5 5 A 4 CYS SG A 28 DSN CA 1.0 . 2.0 6 6 A 7 CYS SG A 25 2TL CA 1.0 . 2.0 7 7 A 10 CYS SG A 22 2TL CA 1.0 . 2.0 8 8 A 13 CYS SG A 19 DSG CA 1.0 . 2.0 stop_ save_ save_DYANA/DIANA_dihedral_6 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_6 _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 5 TRP C A 6 SER N A 6 SER CA A 6 SER C 1.0 -90.7 -50.7 PHI 2 2 A 6 SER N A 6 SER CA A 6 SER C A 7 CYS N 1.0 -56.0 -16.0 PSI 3 3 A 8 LEU C A 9 VAL N A 9 VAL CA A 9 VAL C 1.0 -103.2 -49.0 PHI 4 4 A 9 VAL N A 9 VAL CA A 9 VAL C A 10 CYS N 1.0 -53.0 0.8 PSI 5 5 A 14 SER C A 15 VAL N A 15 VAL CA A 15 VAL C 1.0 -120.5 -64.1 PHI 6 6 A 15 VAL N A 15 VAL CA A 15 VAL C A 16 GLU N 1.0 -18.5 22.4 PSI 7 7 A 17 LEU C A 18 LEU N A 18 LEU CA A 18 LEU C 1.0 -85.7 -45.7 PHI 8 8 A 18 LEU N A 18 LEU CA A 18 LEU C A 19 DSG N 1.0 -60.9 -20.9 PSI 9 9 A 19 DSG C A 20 LEU N A 20 LEU CA A 20 LEU C 1.0 -85.6 -45.6 PHI 10 10 A 20 LEU N A 20 LEU CA A 20 LEU C A 21 VAL N 1.0 -57.8 -17.8 PSI 11 11 A 20 LEU C A 21 VAL N A 21 VAL CA A 21 VAL C 1.0 -88.1 -48.1 PHI 12 12 A 21 VAL N A 21 VAL CA A 21 VAL C A 22 2TL N 1.0 -54.6 -14.6 PSI 13 13 A 22 2TL C A 23 ALA N A 23 ALA CA A 23 ALA C 1.0 -83.5 -43.5 PHI 14 14 A 23 ALA N A 23 ALA CA A 23 ALA C A 24 ALA N 1.0 -59.0 -19.0 PSI 15 15 A 23 ALA C A 24 ALA N A 24 ALA CA A 24 ALA C 1.0 -87.7 -47.7 PHI 16 16 A 24 ALA N A 24 ALA CA A 24 ALA C A 25 2TL N 1.0 -56.8 -16.8 PSI stop_ save_