data_nef_c19859_2mmm 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 2MMM stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly 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 26 GLY start . false 2 A 27 GLY middle . false 3 A 28 LEU middle . . 4 A 29 LYS middle . . 5 A 30 LYS middle . . 6 A 31 LEU middle . . 7 A 32 GLY middle . false 8 A 33 LYS middle . . 9 A 34 LYS middle . . 10 A 35 LEU middle . . 11 A 36 GLU middle . . 12 A 37 GLY middle . false 13 A 38 ALA middle . . 14 A 39 GLY middle . false 15 A 40 LYS middle . . 16 A 41 ARG middle . . 17 A 42 VAL middle . . 18 A 43 PHE middle . . 19 A 44 LYS middle . . 20 A 45 ALA middle . . 21 A 46 SER middle . . 22 A 47 GLU middle . . 23 A 48 LYS middle . . 24 A 49 ALA middle . . 25 A 50 LEU middle . . 26 A 51 PRO middle . false 27 A 52 VAL middle . . 28 A 53 VAL middle . . 29 A 54 VAL middle . . 30 A 55 GLY middle . false 31 A 56 ILE middle . . 32 A 57 LYS middle . . 33 A 58 ALA middle . . 34 A 59 ILE middle . . 35 A 60 GLY middle . false 36 A 61 LYS 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 26 GLY HAy H 1 3.981 0.02 A 27 GLY H H 1 8.669 0.02 A 27 GLY HAx H 1 4.073 0.02 A 27 GLY HAy H 1 4.151 0.02 A 27 GLY CA C 13 45.638 0.3 A 27 GLY N N 15 108.725 0.3 A 28 LEU H H 1 8.268 0.02 A 28 LEU HA H 1 4.337 0.02 A 28 LEU HBy H 1 1.786 0.02 A 28 LEU HBx H 1 1.719 0.02 A 28 LEU HDx% H 1 0.993 0.02 A 28 LEU HDy% H 1 0.939 0.02 A 28 LEU HG H 1 1.712 0.02 A 28 LEU CA C 13 56.827 0.3 A 28 LEU CB C 13 42.011 0.3 A 28 LEU N N 15 121.694 0.3 A 29 LYS H H 1 8.221 0.02 A 29 LYS HA H 1 4.159 0.02 A 29 LYS HBx H 1 1.931 0.02 A 29 LYS HBy H 1 2.007 0.02 A 29 LYS HDx H 1 1.805 0.02 A 29 LYS HEx H 1 3.016 0.02 A 29 LYS HGx H 1 1.501 0.02 A 29 LYS HGy H 1 1.629 0.02 A 29 LYS CA C 13 59.038 0.3 A 29 LYS N N 15 119.920 0.3 A 30 LYS H H 1 7.987 0.02 A 30 LYS HA H 1 4.138 0.02 A 30 LYS HBy H 1 1.960 0.02 A 30 LYS HBx H 1 1.909 0.02 A 30 LYS HDx H 1 1.788 0.02 A 30 LYS HEx H 1 3.061 0.02 A 30 LYS HGx H 1 1.487 0.02 A 30 LYS HGy H 1 1.629 0.02 A 30 LYS CA C 13 58.883 0.3 A 30 LYS N N 15 119.059 0.3 A 31 LEU H H 1 7.929 0.02 A 31 LEU HA H 1 4.212 0.02 A 31 LEU HBy H 1 1.900 0.02 A 31 LEU HBx H 1 1.870 0.02 A 31 LEU HDx% H 1 0.991 0.02 A 31 LEU HDy% H 1 0.940 0.02 A 31 LEU HG H 1 1.684 0.02 A 31 LEU CB C 13 41.829 0.3 A 31 LEU N N 15 120.964 0.3 A 32 GLY H H 1 8.431 0.02 A 32 GLY HAx H 1 3.818 0.02 A 32 GLY HAy H 1 3.953 0.02 A 32 GLY CA C 13 46.955 0.3 A 32 GLY N N 15 105.550 0.3 A 33 LYS H H 1 7.974 0.02 A 33 LYS HA H 1 4.258 0.02 A 33 LYS HBy H 1 2.043 0.02 A 33 LYS HBx H 1 2.008 0.02 A 33 LYS HEx H 1 3.019 0.02 A 33 LYS HGx H 1 1.616 0.02 A 33 LYS CA C 13 58.088 0.3 A 33 LYS N N 15 120.220 0.3 A 34 LYS H H 1 8.123 0.02 A 34 LYS HA H 1 4.213 0.02 A 34 LYS HBx H 1 2.060 0.02 A 34 LYS HBy H 1 2.118 0.02 A 34 LYS HDx H 1 1.527 0.02 A 34 LYS HEx H 1 3.018 0.02 A 34 LYS HGy H 1 1.757 0.02 A 34 LYS HGx H 1 1.667 0.02 A 34 LYS N N 15 121.616 0.3 A 35 LEU H H 1 8.464 0.02 A 35 LEU HA H 1 4.231 0.02 A 35 LEU HBy H 1 1.951 0.02 A 35 LEU HBx H 1 1.850 0.02 A 35 LEU HDx% H 1 0.920 0.02 A 35 LEU HDy% H 1 0.887 0.02 A 35 LEU HG H 1 1.591 0.02 A 35 LEU CB C 13 41.648 0.3 A 35 LEU N N 15 120.254 0.3 A 36 GLU H H 1 8.362 0.02 A 36 GLU HA H 1 4.128 0.02 A 36 GLU HBy H 1 2.255 0.02 A 36 GLU HBx H 1 2.200 0.02 A 36 GLU HGy H 1 2.503 0.02 A 36 GLU HGx H 1 2.264 0.02 A 36 GLU CA C 13 59.080 0.3 A 36 GLU CB C 13 29.912 0.3 A 37 GLY H H 1 8.223 0.02 A 37 GLY HAy H 1 4.002 0.02 A 37 GLY HAx H 1 3.977 0.02 A 37 GLY CA C 13 46.598 0.3 A 37 GLY N N 15 106.614 0.3 A 38 ALA H H 1 8.178 0.02 A 38 ALA HA H 1 4.234 0.02 A 38 ALA HB% H 1 1.565 0.02 A 38 ALA CA C 13 54.759 0.3 A 38 ALA CB C 13 17.768 0.3 A 39 GLY H H 1 8.451 0.02 A 39 GLY HAy H 1 3.951 0.02 A 39 GLY HAx H 1 3.867 0.02 A 39 GLY CA C 13 46.654 0.3 A 39 GLY N N 15 105.380 0.3 A 40 LYS H H 1 8.057 0.02 A 40 LYS HA H 1 4.227 0.02 A 40 LYS HBx H 1 2.004 0.02 A 40 LYS HDx H 1 1.749 0.02 A 40 LYS HDy H 1 1.777 0.02 A 40 LYS HEx H 1 3.010 0.02 A 40 LYS HGx H 1 1.525 0.02 A 40 LYS HGy H 1 1.567 0.02 A 40 LYS N N 15 120.181 0.3 A 41 ARG H H 1 7.890 0.02 A 41 ARG HA H 1 4.168 0.02 A 41 ARG HBy H 1 2.069 0.02 A 41 ARG HBx H 1 2.006 0.02 A 41 ARG HDy H 1 3.282 0.02 A 41 ARG HDx H 1 3.238 0.02 A 41 ARG HE H 1 7.278 0.02 A 41 ARG HGy H 1 1.911 0.02 A 41 ARG HGx H 1 1.701 0.02 A 41 ARG CA C 13 59.171 0.3 A 41 ARG CB C 13 29.998 0.3 A 41 ARG N N 15 118.876 0.3 A 42 VAL H H 1 8.117 0.02 A 42 VAL HA H 1 3.793 0.02 A 42 VAL HB H 1 2.178 0.02 A 42 VAL HGx% H 1 1.062 0.02 A 42 VAL HGy% H 1 0.909 0.02 A 42 VAL CA C 13 65.612 0.3 A 42 VAL CB C 13 31.999 0.3 A 43 PHE H H 1 8.361 0.02 A 43 PHE HA H 1 4.352 0.02 A 43 PHE HBy H 1 3.295 0.02 A 43 PHE HBx H 1 3.238 0.02 A 43 PHE HD1 H 1 7.268 0.02 A 43 PHE HD2 H 1 7.268 0.02 A 43 PHE HE1 H 1 7.332 0.02 A 43 PHE HE2 H 1 7.332 0.02 A 43 PHE CA C 13 60.722 0.3 A 43 PHE CB C 13 38.916 0.3 A 44 LYS H H 1 8.369 0.02 A 44 LYS HA H 1 4.192 0.02 A 44 LYS HBx H 1 2.003 0.02 A 44 LYS HDx H 1 1.620 0.02 A 44 LYS HEx H 1 3.039 0.02 A 44 LYS HGy H 1 1.816 0.02 A 44 LYS HGx H 1 1.656 0.02 A 44 LYS CA C 13 58.092 0.3 A 44 LYS N N 15 119.689 0.3 A 45 ALA H H 1 8.306 0.02 A 45 ALA HA H 1 4.214 0.02 A 45 ALA HB% H 1 1.562 0.02 A 45 ALA CA C 13 54.508 0.3 A 45 ALA CB C 13 18.043 0.3 A 45 ALA N N 15 121.950 0.3 A 46 SER H H 1 8.118 0.02 A 46 SER HA H 1 4.308 0.02 A 46 SER HBy H 1 4.066 0.02 A 46 SER HBx H 1 3.947 0.02 A 46 SER CA C 13 60.546 0.3 A 46 SER CB C 13 63.181 0.3 A 47 GLU H H 1 8.028 0.02 A 47 GLU HA H 1 4.066 0.02 A 47 GLU HBx H 1 2.115 0.02 A 47 GLU HGy H 1 2.379 0.02 A 47 GLU HGx H 1 2.266 0.02 A 47 GLU CA C 13 58.571 0.3 A 47 GLU CB C 13 29.675 0.3 A 47 GLU N N 15 121.720 0.3 A 48 LYS H H 1 7.791 0.02 A 48 LYS HA H 1 4.263 0.02 A 48 LYS HBx H 1 1.929 0.02 A 48 LYS HEx H 1 3.033 0.02 A 48 LYS CA C 13 57.335 0.3 A 48 LYS CB C 13 32.549 0.3 A 48 LYS N N 15 117.349 0.3 A 49 ALA H H 1 7.807 0.02 A 49 ALA HA H 1 4.405 0.02 A 49 ALA HB% H 1 1.490 0.02 A 49 ALA CA C 13 52.635 0.3 A 49 ALA CB C 13 18.796 0.3 A 49 ALA N N 15 120.142 0.3 A 50 LEU H H 1 7.830 0.02 A 50 LEU HA H 1 4.343 0.02 A 50 LEU HBy H 1 1.823 0.02 A 50 LEU HBx H 1 1.740 0.02 A 50 LEU HDx% H 1 0.978 0.02 A 50 LEU HDy% H 1 0.941 0.02 A 50 LEU CA C 13 58.666 0.3 A 50 LEU CB C 13 40.193 0.3 A 50 LEU N N 15 119.907 0.3 A 51 PRO HA H 1 4.301 0.02 A 51 PRO HBy H 1 2.353 0.02 A 51 PRO HBx H 1 1.842 0.02 A 51 PRO HDy H 1 3.766 0.02 A 51 PRO HDx H 1 3.695 0.02 A 51 PRO HGy H 1 2.140 0.02 A 51 PRO HGx H 1 2.010 0.02 A 51 PRO CA C 13 65.614 0.3 A 51 PRO CB C 13 31.216 0.3 A 52 VAL H H 1 7.422 0.02 A 52 VAL HA H 1 3.828 0.02 A 52 VAL HB H 1 2.353 0.02 A 52 VAL HGx% H 1 1.066 0.02 A 52 VAL HGy% H 1 1.006 0.02 A 52 VAL CA C 13 65.316 0.3 A 52 VAL CB C 13 32.030 0.3 A 52 VAL N N 15 117.297 0.3 A 53 VAL H H 1 7.798 0.02 A 53 VAL HA H 1 3.714 0.02 A 53 VAL HB H 1 2.240 0.02 A 53 VAL HGx% H 1 1.060 0.02 A 53 VAL HGy% H 1 0.980 0.02 A 53 VAL CA C 13 66.044 0.3 A 53 VAL CB C 13 32.077 0.3 A 53 VAL N N 15 119.267 0.3 A 54 VAL H H 1 8.360 0.02 A 54 VAL HA H 1 3.714 0.02 A 54 VAL HB H 1 2.100 0.02 A 54 VAL HGx% H 1 1.049 0.02 A 54 VAL HGy% H 1 0.967 0.02 A 54 VAL CA C 13 66.044 0.3 A 54 VAL CB C 13 31.952 0.3 A 55 GLY H H 1 7.761 0.02 A 55 GLY HAx H 1 3.875 0.02 A 55 GLY HAy H 1 3.932 0.02 A 55 GLY CA C 13 46.577 0.3 A 55 GLY N N 15 106.780 0.3 A 56 ILE H H 1 8.180 0.02 A 56 ILE HA H 1 3.943 0.02 A 56 ILE HB H 1 2.026 0.02 A 56 ILE HD1% H 1 0.880 0.02 A 56 ILE HG1y H 1 1.786 0.02 A 56 ILE HG1x H 1 1.211 0.02 A 56 ILE HG2% H 1 0.960 0.02 A 56 ILE CB C 13 38.235 0.3 A 57 LYS H H 1 8.213 0.02 A 57 LYS HA H 1 4.200 0.02 A 57 LYS HBy H 1 1.999 0.02 A 57 LYS HBx H 1 1.929 0.02 A 57 LYS HDx H 1 1.726 0.02 A 57 LYS HEy H 1 3.031 0.02 A 57 LYS HEx H 1 2.972 0.02 A 57 LYS HGy H 1 1.637 0.02 A 57 LYS HGx H 1 1.577 0.02 A 57 LYS CA C 13 57.864 0.3 A 57 LYS CB C 13 32.033 0.3 A 57 LYS N N 15 120.181 0.3 A 58 ALA H H 1 8.259 0.02 A 58 ALA HA H 1 4.262 0.02 A 58 ALA HB% H 1 1.539 0.02 A 58 ALA CA C 13 53.751 0.3 A 58 ALA CB C 13 18.539 0.3 A 58 ALA N N 15 121.446 0.3 A 59 ILE H H 1 7.711 0.02 A 59 ILE HA H 1 4.144 0.02 A 59 ILE HB H 1 2.073 0.02 A 59 ILE HD1% H 1 0.940 0.02 A 59 ILE HG1x H 1 1.347 0.02 A 59 ILE HG1y H 1 1.699 0.02 A 59 ILE HG2% H 1 1.002 0.02 A 59 ILE CA C 13 62.549 0.3 A 59 ILE CB C 13 38.403 0.3 A 59 ILE N N 15 116.123 0.3 A 60 GLY H H 1 8.169 0.02 A 60 GLY HAx H 1 3.959 0.02 A 60 GLY HAy H 1 4.055 0.02 A 60 GLY CA C 13 45.577 0.3 A 60 GLY N N 15 110.484 0.3 A 61 LYS H H 1 7.637 0.02 A 61 LYS HA H 1 4.288 0.02 A 61 LYS HBy H 1 1.951 0.02 A 61 LYS HBx H 1 1.815 0.02 A 61 LYS HEx H 1 3.055 0.02 A 61 LYS HGy H 1 1.727 0.02 A 61 LYS HGx H 1 1.453 0.02 A 61 LYS CA C 13 57.055 0.3 A 61 LYS CB C 13 33.647 0.3 A 61 LYS N N 15 125.126 0.3 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 27 GLY H A 26 GLY HAx 1.0 1.8 4.5 2 1 A 26 GLY HAy A 27 GLY H 1.0 1.8 4.5 3 2 A 28 LEU H A 26 GLY HAx 1.0 1.8 4.4 4 3 A 27 GLY HAy A 30 LYS HBy 1.0 1.8 3.6 5 4 A 28 LEU H A 27 GLY HAy 1.0 1.8 3.6 6 5 A 27 GLY H A 28 LEU H 1.0 1.8 4.4 7 6 A 27 GLY HAy A 30 LYS HBx 1.0 1.8 3.6 8 7 A 27 GLY HAy A 30 LYS H 1.0 1.8 4.8 9 8 A 28 LEU H A 27 GLY HAx 1.0 1.8 3.6 10 9 A 29 LYS H A 28 LEU HBy 1.0 1.8 3.6 11 10 A 29 LYS H A 28 LEU HDx% 1.0 1.8 5.4 12 11 A 28 LEU H A 30 LYS H 1.0 1.8 4.4 13 12 A 28 LEU H A 31 LEU H 1.0 1.8 4.8 14 13 A 29 LYS H A 28 LEU HBx 1.0 1.8 3.6 15 14 A 29 LYS H A 28 LEU HA 1.0 1.8 3.6 16 15 A 31 LEU H A 28 LEU HA 1.0 1.8 3.6 17 16 A 30 LYS H A 28 LEU HDx% 1.0 1.8 5.8 18 17 A 28 LEU H A 29 LYS H 1.0 1.8 4.4 19 18 A 30 LYS H A 28 LEU HDy% 1.0 1.8 5.8 20 19 A 28 LEU HA A 32 GLY H 1.0 1.8 4.4 21 20 A 29 LYS H A 28 LEU HDy% 1.0 1.8 5.4 22 21 A 28 LEU HA A 31 LEU HBx 1.0 1.8 3.6 23 22 A 29 LYS H A 31 LEU H 1.0 1.8 4.4 24 23 A 30 LYS H A 29 LYS HA 1.0 1.8 4.4 25 24 A 30 LYS H A 29 LYS H 1.0 1.8 2.8 26 25 A 32 GLY H A 29 LYS HA 1.0 1.8 3.6 27 26 A 31 LEU H A 30 LYS HA 1.0 1.8 3.6 28 27 A 31 LEU H A 30 LYS HBx 1.0 1.8 5.3 29 27 A 31 LEU H A 30 LYS HBy 1.0 1.8 5.3 30 28 A 30 LYS H A 31 LEU H 1.0 1.8 4.4 31 29 A 32 GLY H A 31 LEU HDy% 1.0 1.8 5.4 32 30 A 31 LEU H A 32 GLY H 1.0 1.8 2.8 33 31 A 32 GLY H A 31 LEU HBx 1.0 1.8 4.5 34 31 A 32 GLY H A 31 LEU HBy 1.0 1.8 4.5 35 32 A 32 GLY H A 31 LEU HDx% 1.0 1.8 5.4 36 33 A 32 GLY H A 31 LEU HA 1.0 1.8 3.6 37 34 A 31 LEU H A 34 LYS H 1.0 1.8 4.8 38 35 A 31 LEU HDx% A 35 LEU H 1.0 1.8 5.8 39 36 A 36 GLU H A 32 GLY HAx 1.0 1.8 5.3 40 36 A 32 GLY HAy A 36 GLU H 1.0 1.8 5.3 41 37 A 33 LYS H A 32 GLY HAx 1.0 1.8 3.6 42 38 A 32 GLY H A 33 LYS H 1.0 1.8 2.8 43 39 A 32 GLY HAy A 33 LYS H 1.0 1.8 3.6 44 40 A 35 LEU H A 32 GLY HAx 1.0 1.8 5.3 45 40 A 35 LEU H A 32 GLY HAy 1.0 1.8 5.3 46 41 A 32 GLY H A 34 LYS H 1.0 1.8 4.4 47 42 A 32 GLY HAx A 35 LEU HBx 1.0 1.8 6.2 48 42 A 32 GLY HAy A 35 LEU HBx 1.0 1.8 6.2 49 42 A 35 LEU HBy A 32 GLY HAx 1.0 1.8 6.2 50 42 A 32 GLY HAy A 35 LEU HBy 1.0 1.8 6.2 51 43 A 33 LYS HA A 36 GLU HBy 1.0 1.8 3.6 52 44 A 33 LYS HA A 36 GLU HGx 1.0 1.8 4.4 53 45 A 36 GLU H A 33 LYS HA 1.0 1.8 4.4 54 46 A 34 LYS H A 33 LYS HA 1.0 1.8 4.4 55 47 A 33 LYS HA A 36 GLU HGy 1.0 1.8 5.3 56 47 A 33 LYS HA A 36 GLU HGx 1.0 1.8 5.3 57 48 A 33 LYS HA A 36 GLU HBx 1.0 1.8 3.6 58 49 A 35 LEU H A 33 LYS H 1.0 1.8 4.8 59 50 A 34 LYS H A 33 LYS H 1.0 1.8 2.8 60 51 A 35 LEU H A 34 LYS HDy 1.0 1.8 4.8 61 52 A 35 LEU H A 34 LYS HGx 1.0 1.8 4.4 62 53 A 35 LEU H A 34 LYS HBx 1.0 1.8 3.6 63 54 A 35 LEU H A 34 LYS HBy 1.0 1.8 3.6 64 55 A 35 LEU H A 34 LYS HGy 1.0 1.8 4.4 65 56 A 34 LYS H A 35 LEU H 1.0 1.8 2.8 66 57 A 36 GLU H A 35 LEU HDx% 1.0 1.8 5.8 67 58 A 35 LEU H A 37 GLY H 1.0 1.8 4.8 68 59 A 36 GLU H A 35 LEU HA 1.0 1.8 4.4 69 60 A 36 GLU H A 35 LEU HDy% 1.0 1.8 5.8 70 61 A 36 GLU HA A 35 LEU HDy% 1.0 1.8 5.8 71 62 A 36 GLU H A 35 LEU HBx 1.0 1.8 3.6 72 63 A 35 LEU H A 36 GLU H 1.0 1.8 2.8 73 64 A 36 GLU HA A 35 LEU HDx% 1.0 1.8 5.8 74 65 A 36 GLU H A 35 LEU HBy 1.0 1.8 3.6 75 66 A 37 GLY H A 36 GLU HA 1.0 1.8 3.6 76 67 A 36 GLU HA A 40 LYS H 1.0 1.8 4.8 77 68 A 37 GLY H A 36 GLU HBx 1.0 1.8 3.6 78 69 A 37 GLY H A 36 GLU HGy 1.0 1.8 5.7 79 69 A 36 GLU HGx A 37 GLY H 1.0 1.8 5.7 80 70 A 36 GLU H A 37 GLY H 1.0 1.8 2.8 81 71 A 37 GLY H A 36 GLU HBy 1.0 1.8 3.6 82 72 A 36 GLU HA A 39 GLY H 1.0 1.8 3.6 83 73 A 36 GLU H A 38 ALA H 1.0 1.8 4.4 84 74 A 40 LYS H A 37 GLY HAx 1.0 1.8 4.8 85 75 A 40 LYS H A 37 GLY HAy 1.0 1.8 4.8 86 76 A 37 GLY H A 38 ALA H 1.0 1.8 4.4 87 77 A 37 GLY H A 39 GLY H 1.0 1.8 4.8 88 78 A 39 GLY H A 38 ALA H 1.0 1.8 2.8 89 79 A 39 GLY H A 38 ALA HA 1.0 1.8 4.4 90 80 A 39 GLY H A 38 ALA HB% 1.0 1.8 4.6 91 81 A 40 LYS H A 39 GLY H 1.0 1.8 2.8 92 82 A 40 LYS H A 39 GLY HAy 1.0 1.8 4.4 93 83 A 40 LYS H A 39 GLY HAx 1.0 1.8 4.4 94 84 A 39 GLY H A 42 VAL HGy% 1.0 1.8 7.1 95 84 A 39 GLY H A 42 VAL HGx% 1.0 1.8 7.1 96 85 A 39 GLY H A 42 VAL HB 1.0 1.8 4.8 97 86 A 43 PHE HD% A 39 GLY HAy 1.0 1.8 8.1 98 86 A 43 PHE HE% A 39 GLY HAy 1.0 1.8 8.1 99 86 A 39 GLY HAx A 43 PHE HD% 1.0 1.8 8.1 100 86 A 39 GLY HAx A 43 PHE HE% 1.0 1.8 8.1 101 87 A 42 VAL HB A 39 GLY HAy 1.0 1.8 4.4 102 88 A 42 VAL HB A 39 GLY HAx 1.0 1.8 4.4 103 89 A 39 GLY H A 41 ARG H 1.0 1.8 4.8 104 90 A 40 LYS HA A 43 PHE HBy 1.0 1.8 4.4 105 91 A 43 PHE HE% A 40 LYS HGy 1.0 1.8 7.7 106 91 A 43 PHE HD% A 40 LYS HGy 1.0 1.8 7.7 107 91 A 43 PHE HD% A 40 LYS HGx 1.0 1.8 7.7 108 91 A 43 PHE HE% A 40 LYS HGx 1.0 1.8 7.7 109 92 A 43 PHE HD% A 40 LYS HBx 1.0 1.8 6.9 110 93 A 43 PHE HE% A 40 LYS HA 1.0 1.8 6.5 111 94 A 43 PHE HD% A 40 LYS HA 1.0 1.8 6.5 112 95 A 40 LYS H A 43 PHE H 1.0 1.8 4.8 113 96 A 43 PHE HE% A 40 LYS HBy 1.0 1.8 6.9 114 97 A 43 PHE HD% A 40 LYS HBy 1.0 1.8 6.9 115 98 A 41 ARG H A 40 LYS HGx 1.0 1.8 4.8 116 99 A 40 LYS HA A 43 PHE HBx 1.0 1.8 4.4 117 100 A 43 PHE HE% A 40 LYS HBx 1.0 1.8 6.9 118 101 A 40 LYS H A 41 ARG H 1.0 1.8 2.8 119 102 A 41 ARG H A 40 LYS HGy 1.0 1.8 4.8 120 103 A 41 ARG H A 40 LYS HA 1.0 1.8 4.4 121 104 A 42 VAL HB A 41 ARG HDy 1.0 1.8 4.8 122 105 A 43 PHE HE% A 41 ARG HBy 1.0 1.8 7.7 123 105 A 43 PHE HD% A 41 ARG HBy 1.0 1.8 7.7 124 105 A 43 PHE HE% A 41 ARG HBx 1.0 1.8 7.7 125 105 A 43 PHE HD% A 41 ARG HBx 1.0 1.8 7.7 126 106 A 41 ARG H A 43 PHE H 1.0 1.8 4.8 127 107 A 41 ARG HA A 42 VAL H 1.0 1.8 4.4 128 108 A 42 VAL HGy% A 41 ARG HDx 1.0 1.8 5.4 129 109 A 41 ARG HDx A 45 ALA HB% 1.0 1.8 5.8 130 110 A 42 VAL HB A 41 ARG HDx 1.0 1.8 4.8 131 111 A 42 VAL HGy% A 41 ARG HDy 1.0 1.8 5.4 132 112 A 42 VAL HGx% A 41 ARG HDx 1.0 1.8 5.4 133 113 A 41 ARG HDx A 42 VAL HA 1.0 1.8 4.8 134 114 A 41 ARG H A 42 VAL H 1.0 1.8 2.8 135 115 A 41 ARG HDy A 42 VAL HA 1.0 1.8 4.8 136 116 A 41 ARG HDy A 45 ALA HB% 1.0 1.8 5.8 137 117 A 42 VAL HGx% A 41 ARG HDy 1.0 1.8 5.4 138 118 A 42 VAL HGx% A 43 PHE HD% 1.0 1.8 7.9 139 119 A 42 VAL HGy% A 43 PHE HD% 1.0 1.8 7.9 140 120 A 45 ALA HB% A 42 VAL HA 1.0 1.8 4.6 141 121 A 42 VAL HGx% A 45 ALA H 1.0 1.8 5.8 142 122 A 42 VAL HGy% A 45 ALA H 1.0 1.8 5.8 143 123 A 42 VAL HB A 43 PHE HD% 1.0 1.8 6.9 144 124 A 42 VAL HGx% A 45 ALA HB% 1.0 1.8 6.4 145 125 A 42 VAL HB A 45 ALA HB% 1.0 1.8 5.4 146 126 A 42 VAL HGy% A 46 SER HBx 1.0 1.8 8.0 147 126 A 42 VAL HGx% A 46 SER HBx 1.0 1.8 8.0 148 126 A 42 VAL HGx% A 46 SER HBy 1.0 1.8 8.0 149 126 A 42 VAL HGy% A 46 SER HBy 1.0 1.8 8.0 150 127 A 43 PHE HD% A 42 VAL HA 1.0 1.8 6.9 151 128 A 42 VAL HA A 45 ALA H 1.0 1.8 4.4 152 129 A 43 PHE H A 42 VAL HA 1.0 1.8 3.6 153 130 A 43 PHE H A 42 VAL H 1.0 1.8 2.8 154 131 A 43 PHE HA A 46 SER HBx 1.0 1.8 4.5 155 131 A 46 SER HBy A 43 PHE HA 1.0 1.8 4.5 156 132 A 43 PHE HD% A 44 LYS HBy 1.0 1.8 7.7 157 132 A 43 PHE HE% A 44 LYS HBy 1.0 1.8 7.7 158 132 A 43 PHE HE% A 44 LYS HBx 1.0 1.8 7.7 159 132 A 43 PHE HD% A 44 LYS HBx 1.0 1.8 7.7 160 133 A 43 PHE HE% A 47 GLU HBy 1.0 1.8 6.5 161 134 A 43 PHE HE% A 47 GLU HGy 1.0 1.8 6.9 162 135 A 43 PHE HD% A 47 GLU HBy 1.0 1.8 6.5 163 136 A 43 PHE HD% A 47 GLU HGy 1.0 1.8 6.9 164 137 A 43 PHE HD% A 47 GLU HGx 1.0 1.8 6.9 165 138 A 43 PHE HE% A 44 LYS HEx 1.0 1.8 8.1 166 138 A 43 PHE HD% A 44 LYS HEx 1.0 1.8 8.1 167 138 A 43 PHE HD% A 44 LYS HEy 1.0 1.8 8.1 168 138 A 43 PHE HE% A 44 LYS HEy 1.0 1.8 8.1 169 139 A 43 PHE HD% A 47 GLU HA 1.0 1.8 6.9 170 140 A 43 PHE HD% A 46 SER H 1.0 1.8 6.9 171 141 A 43 PHE HD% A 44 LYS HGx 1.0 1.8 7.7 172 141 A 43 PHE HE% A 44 LYS HGx 1.0 1.8 7.7 173 141 A 43 PHE HD% A 44 LYS HGy 1.0 1.8 7.7 174 141 A 43 PHE HE% A 44 LYS HGy 1.0 1.8 7.7 175 142 A 43 PHE HE% A 47 GLU HGx 1.0 1.8 6.9 176 143 A 43 PHE HA A 46 SER H 1.0 1.8 3.6 177 144 A 43 PHE HD% A 44 LYS H 1.0 1.8 6.5 178 145 A 43 PHE HBy A 44 LYS H 1.0 1.8 4.8 179 146 A 43 PHE HBx A 44 LYS H 1.0 1.8 4.8 180 147 A 43 PHE HD% A 45 ALA H 1.0 1.8 6.9 181 148 A 43 PHE HA A 46 SER HBx 1.0 1.8 3.6 182 149 A 45 ALA H A 43 PHE HA 1.0 1.8 4.4 183 150 A 44 LYS H A 47 GLU H 1.0 1.8 4.8 184 151 A 47 GLU H A 44 LYS HA 1.0 1.8 4.4 185 152 A 45 ALA H A 44 LYS HBy 1.0 1.8 5.3 186 152 A 45 ALA H A 44 LYS HBx 1.0 1.8 5.3 187 153 A 45 ALA H A 44 LYS H 1.0 1.8 3.6 188 154 A 45 ALA H A 44 LYS HGx 1.0 1.8 5.3 189 154 A 45 ALA H A 44 LYS HGy 1.0 1.8 5.3 190 155 A 45 ALA H A 44 LYS HBx 1.0 1.8 3.6 191 156 A 45 ALA H A 44 LYS HBy 1.0 1.8 3.6 192 157 A 45 ALA H A 44 LYS HA 1.0 1.8 4.4 193 158 A 47 GLU HGy A 44 LYS HA 1.0 1.8 4.4 194 159 A 47 GLU HGx A 44 LYS HA 1.0 1.8 4.4 195 160 A 45 ALA H A 48 LYS H 1.0 1.8 4.8 196 161 A 45 ALA H A 47 GLU H 1.0 1.8 4.4 197 162 A 45 ALA HB% A 46 SER H 1.0 1.8 4.6 198 163 A 45 ALA H A 46 SER H 1.0 1.8 2.8 199 164 A 46 SER HA A 49 ALA HB% 1.0 1.8 5.4 200 165 A 49 ALA H A 46 SER HBx 1.0 1.8 5.3 201 165 A 46 SER HBy A 49 ALA H 1.0 1.8 5.3 202 166 A 46 SER HA A 49 ALA H 1.0 1.8 4.4 203 167 A 46 SER H A 48 LYS H 1.0 1.8 4.4 204 168 A 46 SER H A 47 GLU H 1.0 1.8 3.6 205 169 A 47 GLU H A 46 SER HA 1.0 1.8 3.6 206 170 A 47 GLU H A 46 SER HBx 1.0 1.8 5.3 207 170 A 46 SER HBy A 47 GLU H 1.0 1.8 5.3 208 171 A 47 GLU HA A 50 LEU HBy 1.0 1.8 3.6 209 172 A 47 GLU HA A 50 LEU HBx 1.0 1.8 3.6 210 173 A 47 GLU HA A 50 LEU H 1.0 1.8 3.6 211 174 A 48 LYS H A 47 GLU HBy 1.0 1.8 4.5 212 174 A 48 LYS H A 47 GLU HBx 1.0 1.8 4.5 213 175 A 47 GLU H A 48 LYS H 1.0 1.8 2.8 214 176 A 47 GLU HA A 48 LYS H 1.0 1.8 3.6 215 177 A 48 LYS HA A 51 PRO HDx 1.0 1.8 4.4 216 178 A 48 LYS HA A 51 PRO HDy 1.0 1.8 4.4 217 179 A 49 ALA HB% A 52 VAL H 1.0 1.8 5.4 218 180 A 52 VAL H A 49 ALA HA 1.0 1.8 4.4 219 181 A 49 ALA HB% A 50 LEU H 1.0 1.8 5.4 220 182 A 50 LEU H A 49 ALA HA 1.0 1.8 4.4 221 183 A 49 ALA HB% A 52 VAL HGy% 1.0 1.8 6.8 222 184 A 49 ALA HB% A 51 PRO HDx 1.0 1.8 5.8 223 185 A 49 ALA HB% A 53 VAL HB 1.0 1.8 5.8 224 186 A 49 ALA HB% A 53 VAL HGy% 1.0 1.8 6.8 225 187 A 49 ALA HB% A 53 VAL HGx% 1.0 1.8 6.8 226 188 A 49 ALA HB% A 52 VAL HGx% 1.0 1.8 6.8 227 189 A 49 ALA HB% A 51 PRO HDy 1.0 1.8 5.8 228 190 A 49 ALA HB% A 52 VAL HA 1.0 1.8 5.8 229 191 A 49 ALA HA A 52 VAL HGy% 1.0 1.8 5.4 230 192 A 49 ALA HA A 52 VAL HGx% 1.0 1.8 4.6 231 193 A 51 PRO HDx A 49 ALA HA 1.0 1.8 4.8 232 194 A 51 PRO HDy A 49 ALA HA 1.0 1.8 4.8 233 195 A 49 ALA HA A 52 VAL HB 1.0 1.8 4.4 234 196 A 49 ALA HA A 52 VAL HGy% 1.0 1.8 7.1 235 196 A 49 ALA HA A 52 VAL HGx% 1.0 1.8 7.1 236 197 A 53 VAL HB A 50 LEU HA 1.0 1.8 3.6 237 198 A 50 LEU HA A 53 VAL H 1.0 1.8 3.6 238 199 A 50 LEU HBx A 51 PRO HDy 1.0 1.8 4.4 239 200 A 50 LEU HBx A 51 PRO HDx 1.0 1.8 4.4 240 201 A 50 LEU HBy A 51 PRO HDy 1.0 1.8 4.4 241 202 A 50 LEU HBy A 51 PRO HDx 1.0 1.8 4.4 242 203 A 50 LEU H A 51 PRO HDy 1.0 1.8 3.6 243 204 A 50 LEU H A 51 PRO HDx 1.0 1.8 3.6 244 205 A 50 LEU H A 52 VAL H 1.0 1.8 4.8 245 206 A 50 LEU H A 51 PRO HGy 1.0 1.8 4.8 246 207 A 50 LEU H A 51 PRO HGx 1.0 1.8 4.8 247 208 A 50 LEU H A 53 VAL HB 1.0 1.8 4.8 248 209 A 51 PRO HDy A 50 LEU HDy% 1.0 1.8 5.4 249 210 A 51 PRO HDx A 50 LEU HDy% 1.0 1.8 5.4 250 211 A 53 VAL HGy% A 50 LEU HA 1.0 1.8 7.1 251 211 A 53 VAL HGx% A 50 LEU HA 1.0 1.8 7.1 252 212 A 53 VAL HGx% A 50 LEU HA 1.0 1.8 4.6 253 213 A 50 LEU HBx A 54 VAL HGx% 1.0 1.8 4.6 254 214 A 50 LEU HBy A 54 VAL HGx% 1.0 1.8 4.6 255 215 A 51 PRO HDy A 50 LEU HA 1.0 1.8 3.6 256 216 A 51 PRO HDx A 50 LEU HA 1.0 1.8 3.6 257 217 A 51 PRO HA A 54 VAL H 1.0 1.8 4.8 258 218 A 52 VAL H A 51 PRO HA 1.0 1.8 3.6 259 219 A 52 VAL H A 51 PRO HGy 1.0 1.8 4.8 260 220 A 52 VAL H A 51 PRO HGx 1.0 1.8 4.8 261 221 A 51 PRO HDx A 52 VAL H 1.0 1.8 4.8 262 222 A 51 PRO HDy A 52 VAL H 1.0 1.8 4.8 263 223 A 51 PRO HDx A 53 VAL H 1.0 1.8 4.8 264 224 A 51 PRO HA A 54 VAL HGy% 1.0 1.8 5.4 265 225 A 54 VAL HGx% A 51 PRO HA 1.0 1.8 5.4 266 226 A 51 PRO HA A 54 VAL HB 1.0 1.8 4.8 267 227 A 51 PRO HA A 55 GLY H 1.0 1.8 4.4 268 228 A 52 VAL H A 54 VAL H 1.0 1.8 4.8 269 229 A 52 VAL H A 53 VAL H 1.0 1.8 2.8 270 230 A 52 VAL HB A 53 VAL H 1.0 1.8 3.6 271 231 A 52 VAL H A 53 VAL HB 1.0 1.8 4.8 272 232 A 52 VAL HA A 53 VAL H 1.0 1.8 3.6 273 233 A 52 VAL HA A 56 ILE HD1% 1.0 1.8 5.4 274 234 A 52 VAL HB A 56 ILE HD1% 1.0 1.8 5.8 275 235 A 52 VAL HA A 56 ILE H 1.0 1.8 4.8 276 236 A 52 VAL HA A 55 GLY H 1.0 1.8 3.6 277 237 A 53 VAL H A 54 VAL H 1.0 1.8 2.8 278 238 A 53 VAL HA A 56 ILE HB 1.0 1.8 4.4 279 239 A 53 VAL HA A 56 ILE HG1x 1.0 1.8 4.4 280 240 A 56 ILE HD1% A 53 VAL HA 1.0 1.8 4.6 281 241 A 54 VAL H A 55 GLY H 1.0 1.8 2.8 282 242 A 54 VAL HA A 57 LYS HEy 1.0 1.8 4.8 283 243 A 54 VAL HA A 57 LYS HEx 1.0 1.8 4.8 284 244 A 54 VAL HA A 57 LYS HGx 1.0 1.8 4.4 285 245 A 54 VAL HA A 57 LYS HBy 1.0 1.8 3.6 286 246 A 54 VAL HGy% A 58 ALA HB% 1.0 1.8 6.4 287 247 A 54 VAL HGx% A 58 ALA HB% 1.0 1.8 6.4 288 248 A 54 VAL HA A 57 LYS HBx 1.0 1.8 3.6 289 249 A 54 VAL HA A 58 ALA H 1.0 1.8 3.6 290 250 A 54 VAL HA A 57 LYS H 1.0 1.8 3.6 291 251 A 56 ILE H A 54 VAL HA 1.0 1.8 3.6 292 252 A 54 VAL HGy% A 55 GLY H 1.0 1.8 5.8 293 252 A 54 VAL HGx% A 55 GLY H 1.0 1.8 5.8 294 253 A 54 VAL HB A 55 GLY H 1.0 1.8 3.6 295 254 A 55 GLY H A 54 VAL HA 1.0 1.8 3.6 296 255 A 55 GLY H A 57 LYS H 1.0 1.8 4.8 297 256 A 58 ALA HB% A 55 GLY HAy 1.0 1.8 5.4 298 257 A 58 ALA HB% A 55 GLY HAx 1.0 1.8 5.4 299 258 A 58 ALA H A 55 GLY HAy 1.0 1.8 4.4 300 259 A 58 ALA H A 55 GLY HAx 1.0 1.8 4.4 301 260 A 55 GLY H A 56 ILE H 1.0 1.8 2.8 302 261 A 56 ILE H A 55 GLY HAx 1.0 1.8 5.3 303 261 A 56 ILE H A 55 GLY HAy 1.0 1.8 5.3 304 262 A 56 ILE HA A 59 ILE HG1x 1.0 1.8 4.4 305 263 A 56 ILE HA A 59 ILE H 1.0 1.8 4.4 306 264 A 56 ILE HA A 59 ILE HB 1.0 1.8 4.4 307 265 A 56 ILE HA A 59 ILE HD1% 1.0 1.8 5.4 308 266 A 56 ILE HA A 59 ILE HG2% 1.0 1.8 5.4 309 267 A 56 ILE HA A 59 ILE HG1y 1.0 1.8 4.4 310 268 A 56 ILE HD1% A 58 ALA H 1.0 1.8 5.8 311 269 A 56 ILE HD1% A 57 LYS H 1.0 1.8 4.6 312 270 A 57 LYS H A 56 ILE HG1x 1.0 1.8 5.3 313 270 A 57 LYS H A 56 ILE HG1y 1.0 1.8 5.3 314 271 A 57 LYS H A 56 ILE HA 1.0 1.8 4.4 315 272 A 59 ILE H A 57 LYS HA 1.0 1.8 4.8 316 273 A 57 LYS H A 59 ILE H 1.0 1.8 4.8 317 274 A 58 ALA H A 57 LYS HGx 1.0 1.8 5.7 318 274 A 58 ALA H A 57 LYS HGy 1.0 1.8 5.7 319 275 A 57 LYS HBy A 58 ALA H 1.0 1.8 3.6 320 276 A 57 LYS HBx A 58 ALA H 1.0 1.8 3.6 321 277 A 57 LYS HA A 61 LYS H 1.0 1.8 3.6 322 278 A 58 ALA H A 57 LYS HA 1.0 1.8 3.6 323 279 A 58 ALA HA A 60 GLY H 1.0 1.8 4.8 324 280 A 58 ALA HB% A 61 LYS H 1.0 1.8 5.8 325 281 A 58 ALA HB% A 59 ILE HG2% 1.0 1.8 6.4 326 282 A 58 ALA HB% A 59 ILE H 1.0 1.8 3.8 327 283 A 59 ILE H A 58 ALA HA 1.0 1.8 3.6 328 284 A 58 ALA H A 59 ILE H 1.0 1.8 2.8 329 285 A 59 ILE HD1% A 61 LYS H 1.0 1.8 5.8 330 286 A 59 ILE HG2% A 61 LYS H 1.0 1.8 5.8 331 287 A 61 LYS H A 59 ILE HA 1.0 1.8 4.4 332 288 A 59 ILE HD1% A 60 GLY H 1.0 1.8 5.8 333 289 A 59 ILE HG2% A 60 GLY H 1.0 1.8 4.6 334 290 A 59 ILE HG1y A 60 GLY H 1.0 1.8 4.4 335 291 A 59 ILE HG1x A 60 GLY H 1.0 1.8 4.4 336 292 A 59 ILE HB A 60 GLY H 1.0 1.8 3.6 337 293 A 60 GLY H A 59 ILE HA 1.0 1.8 3.6 338 294 A 59 ILE H A 60 GLY H 1.0 1.8 2.8 339 295 A 61 LYS H A 60 GLY HAy 1.0 1.8 3.6 340 296 A 61 LYS H A 60 GLY HAx 1.0 1.8 3.6 341 297 A 61 LYS H A 60 GLY H 1.0 1.8 2.8 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _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 27 GLY H A 27 GLY HAx 1.0 1.8 4.4 2 2 A 27 GLY H A 27 GLY HAy 1.0 1.8 4.4 3 3 A 28 LEU H A 28 LEU HDx% 1.0 1.8 5.4 4 4 A 28 LEU H A 28 LEU HBx 1.0 1.8 5.3 5 4 A 28 LEU H A 28 LEU HBy 1.0 1.8 5.3 6 5 A 28 LEU H A 28 LEU HDy% 1.0 1.8 5.4 7 6 A 30 LYS H A 30 LYS HBx 1.0 1.8 5.3 8 6 A 30 LYS H A 30 LYS HBy 1.0 1.8 5.3 9 7 A 30 LYS H A 30 LYS HGx 1.0 1.8 5.3 10 7 A 30 LYS H A 30 LYS HGy 1.0 1.8 5.3 11 8 A 30 LYS H A 30 LYS HDx 1.0 1.8 5.3 12 8 A 30 LYS H A 30 LYS HDy 1.0 1.8 5.3 13 9 A 31 LEU H A 31 LEU HG 1.0 1.8 4.4 14 10 A 31 LEU H A 31 LEU HDx% 1.0 1.8 5.4 15 11 A 31 LEU H A 31 LEU HDy% 1.0 1.8 5.4 16 12 A 31 LEU H A 31 LEU HBx 1.0 1.8 5.3 17 12 A 31 LEU H A 31 LEU HBy 1.0 1.8 5.3 18 13 A 32 GLY H A 32 GLY HAx 1.0 1.8 4.4 19 14 A 32 GLY H A 32 GLY HAy 1.0 1.8 4.4 20 15 A 33 LYS H A 33 LYS HBy 1.0 1.8 5.3 21 15 A 33 LYS H A 33 LYS HBx 1.0 1.8 5.3 22 16 A 34 LYS H A 34 LYS HGy 1.0 1.8 4.4 23 17 A 34 LYS H A 34 LYS HGx 1.0 1.8 4.4 24 18 A 34 LYS H A 34 LYS HBx 1.0 1.8 3.6 25 19 A 34 LYS H A 34 LYS HBy 1.0 1.8 3.6 26 20 A 35 LEU H A 35 LEU HBy 1.0 1.8 4.4 27 21 A 35 LEU H A 35 LEU HBx 1.0 1.8 4.4 28 22 A 35 LEU H A 35 LEU HDy% 1.0 1.8 6.7 29 22 A 35 LEU H A 35 LEU HDx% 1.0 1.8 6.7 30 23 A 36 GLU H A 36 GLU HGy 1.0 1.8 5.3 31 23 A 36 GLU H A 36 GLU HGx 1.0 1.8 5.3 32 24 A 36 GLU H A 36 GLU HBx 1.0 1.8 4.5 33 24 A 36 GLU H A 36 GLU HBy 1.0 1.8 4.5 34 25 A 39 GLY H A 39 GLY HAx 1.0 1.8 4.4 35 26 A 39 GLY H A 39 GLY HAy 1.0 1.8 4.4 36 27 A 40 LYS H A 40 LYS HBy 1.0 1.8 5.3 37 27 A 40 LYS H A 40 LYS HBx 1.0 1.8 5.3 38 28 A 40 LYS H A 40 LYS HGy 1.0 1.8 5.3 39 28 A 40 LYS H A 40 LYS HGx 1.0 1.8 5.3 40 29 A 40 LYS H A 40 LYS HDx 1.0 1.8 5.3 41 29 A 40 LYS H A 40 LYS HDy 1.0 1.8 5.3 42 30 A 41 ARG H A 41 ARG HBy 1.0 1.8 4.4 43 31 A 41 ARG H A 41 ARG HBx 1.0 1.8 4.4 44 32 A 42 VAL HGy% A 42 VAL H 1.0 1.8 5.4 45 33 A 42 VAL HGx% A 42 VAL H 1.0 1.8 5.4 46 34 A 42 VAL HB A 42 VAL H 1.0 1.8 4.4 47 35 A 43 PHE HBy A 43 PHE H 1.0 1.8 3.6 48 36 A 43 PHE H A 43 PHE HBx 1.0 1.8 3.6 49 37 A 43 PHE HE% A 43 PHE HBy 1.0 1.8 6.9 50 38 A 43 PHE HE% A 43 PHE HBx 1.0 1.8 6.9 51 39 A 43 PHE HD% A 43 PHE HBy 1.0 1.8 6.5 52 40 A 43 PHE HD% A 43 PHE HBx 1.0 1.8 6.5 53 41 A 44 LYS H A 44 LYS HGx 1.0 1.8 4.4 54 42 A 44 LYS HGy A 44 LYS H 1.0 1.8 4.4 55 43 A 44 LYS H A 44 LYS HBy 1.0 1.8 5.3 56 43 A 44 LYS HBx A 44 LYS H 1.0 1.8 5.3 57 44 A 45 ALA HB% A 45 ALA H 1.0 1.8 5.4 58 45 A 47 GLU HGy A 47 GLU H 1.0 1.8 4.4 59 46 A 47 GLU HGx A 47 GLU H 1.0 1.8 4.4 60 47 A 47 GLU H A 47 GLU HBy 1.0 1.8 4.5 61 47 A 47 GLU H A 47 GLU HBx 1.0 1.8 4.5 62 48 A 48 LYS H A 48 LYS HBx 1.0 1.8 5.3 63 48 A 48 LYS H A 48 LYS HBy 1.0 1.8 5.3 64 49 A 49 ALA HB% A 49 ALA H 1.0 1.8 4.6 65 50 A 50 LEU HBx A 50 LEU H 1.0 1.8 4.4 66 51 A 50 LEU HBy A 50 LEU H 1.0 1.8 4.4 67 52 A 50 LEU H A 50 LEU HDy% 1.0 1.8 6.6 68 52 A 50 LEU H A 50 LEU HDx% 1.0 1.8 6.6 69 53 A 52 VAL H A 52 VAL HGy% 1.0 1.8 5.4 70 54 A 52 VAL H A 52 VAL HGx% 1.0 1.8 5.4 71 55 A 52 VAL H A 52 VAL HB 1.0 1.8 4.4 72 56 A 53 VAL HGy% A 53 VAL H 1.0 1.8 5.4 73 57 A 53 VAL HGx% A 53 VAL H 1.0 1.8 5.4 74 58 A 53 VAL HB A 53 VAL H 1.0 1.8 4.4 75 59 A 54 VAL H A 54 VAL HGy% 1.0 1.8 5.4 76 60 A 54 VAL H A 54 VAL HB 1.0 1.8 4.4 77 61 A 54 VAL HGx% A 54 VAL H 1.0 1.8 5.4 78 62 A 55 GLY H A 55 GLY HAx 1.0 1.8 4.4 79 63 A 55 GLY H A 55 GLY HAy 1.0 1.8 4.4 80 64 A 56 ILE H A 56 ILE HG1x 1.0 1.8 5.3 81 64 A 56 ILE H A 56 ILE HG1y 1.0 1.8 5.3 82 65 A 56 ILE HD1% A 56 ILE H 1.0 1.8 5.4 83 66 A 58 ALA HB% A 58 ALA H 1.0 1.8 5.4 84 67 A 59 ILE H A 59 ILE HD1% 1.0 1.8 5.4 85 68 A 59 ILE H A 59 ILE HG2% 1.0 1.8 5.4 86 69 A 59 ILE H A 59 ILE HG1y 1.0 1.8 4.4 87 70 A 59 ILE HG1x A 59 ILE H 1.0 1.8 4.4 88 71 A 59 ILE H A 59 ILE HB 1.0 1.8 4.4 89 72 A 61 LYS H A 61 LYS HGx 1.0 1.8 4.8 90 73 A 61 LYS H A 61 LYS HGy 1.0 1.8 4.8 91 74 A 61 LYS H A 61 LYS HBx 1.0 1.8 4.4 92 75 A 61 LYS H A 61 LYS HBy 1.0 1.8 4.4 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 27 GLY C A 28 LEU N A 28 LEU CA A 28 LEU C 1.0 -85.0 -45.0 PHI 2 2 A 28 LEU N A 28 LEU CA A 28 LEU C A 29 LYS N 1.0 -61.0 -21.0 PSI 3 3 A 28 LEU C A 29 LYS N A 29 LYS CA A 29 LYS C 1.0 -83.0 -43.0 PHI 4 4 A 29 LYS N A 29 LYS CA A 29 LYS C A 30 LYS N 1.0 -64.0 -24.0 PSI 5 5 A 29 LYS C A 30 LYS N A 30 LYS CA A 30 LYS C 1.0 -83.0 -43.0 PHI 6 6 A 30 LYS N A 30 LYS CA A 30 LYS C A 31 LEU N 1.0 -63.0 -23.0 PSI 7 7 A 30 LYS C A 31 LEU N A 31 LEU CA A 31 LEU C 1.0 -82.0 -42.0 PHI 8 8 A 31 LEU N A 31 LEU CA A 31 LEU C A 32 GLY N 1.0 -66.0 -26.0 PSI 9 9 A 32 GLY C A 33 LYS N A 33 LYS CA A 33 LYS C 1.0 -109.0 -33.0 PHI 10 10 A 33 LYS N A 33 LYS CA A 33 LYS C A 34 LYS N 1.0 -59.0 -19.0 PSI 11 11 A 33 LYS C A 34 LYS N A 34 LYS CA A 34 LYS C 1.0 -82.0 -42.0 PHI 12 12 A 34 LYS N A 34 LYS CA A 34 LYS C A 35 LEU N 1.0 -64.0 -24.0 PSI 13 13 A 34 LYS C A 35 LEU N A 35 LEU CA A 35 LEU C 1.0 -81.0 -41.0 PHI 14 14 A 35 LEU N A 35 LEU CA A 35 LEU C A 36 GLU N 1.0 -64.0 -24.0 PSI 15 15 A 35 LEU C A 36 GLU N A 36 GLU CA A 36 GLU C 1.0 -82.0 -42.0 PHI 16 16 A 36 GLU N A 36 GLU CA A 36 GLU C A 37 GLY N 1.0 -63.0 -23.0 PSI 17 17 A 36 GLU C A 37 GLY N A 37 GLY CA A 37 GLY C 1.0 -81.0 -41.0 PHI 18 18 A 37 GLY N A 37 GLY CA A 37 GLY C A 38 ALA N 1.0 -62.0 -22.0 PSI 19 19 A 37 GLY C A 38 ALA N A 38 ALA CA A 38 ALA C 1.0 -84.0 -44.0 PHI 20 20 A 38 ALA N A 38 ALA CA A 38 ALA C A 39 GLY N 1.0 -63.0 -23.0 PSI 21 21 A 38 ALA C A 39 GLY N A 39 GLY CA A 39 GLY C 1.0 -80.0 -40.0 PHI 22 22 A 39 GLY N A 39 GLY CA A 39 GLY C A 40 LYS N 1.0 -62.0 -22.0 PSI 23 23 A 39 GLY C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 -84.0 -44.0 PHI 24 24 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 ARG N 1.0 -63.0 -23.0 PSI 25 25 A 40 LYS C A 41 ARG N A 41 ARG CA A 41 ARG C 1.0 -81.0 -41.0 PHI 26 26 A 41 ARG N A 41 ARG CA A 41 ARG C A 42 VAL N 1.0 -60.0 -20.0 PSI 27 27 A 41 ARG C A 42 VAL N A 42 VAL CA A 42 VAL C 1.0 -87.0 -47.0 PHI 28 28 A 42 VAL N A 42 VAL CA A 42 VAL C A 43 PHE N 1.0 -63.0 -23.0 PSI 29 29 A 42 VAL C A 43 PHE N A 43 PHE CA A 43 PHE C 1.0 -84.0 -44.0 PHI 30 30 A 43 PHE N A 43 PHE CA A 43 PHE C A 44 LYS N 1.0 -67.0 -23.0 PSI 31 31 A 43 PHE C A 44 LYS N A 44 LYS CA A 44 LYS C 1.0 -82.0 -42.0 PHI 32 32 A 44 LYS N A 44 LYS CA A 44 LYS C A 45 ALA N 1.0 -63.0 -23.0 PSI 33 33 A 44 LYS C A 45 ALA N A 45 ALA CA A 45 ALA C 1.0 -82.0 -42.0 PHI 34 34 A 45 ALA N A 45 ALA CA A 45 ALA C A 46 SER N 1.0 -59.0 -19.0 PSI 35 35 A 45 ALA C A 46 SER N A 46 SER CA A 46 SER C 1.0 -85.0 -45.0 PHI 36 36 A 46 SER N A 46 SER CA A 46 SER C A 47 GLU N 1.0 -60.0 -20.0 PSI 37 37 A 46 SER C A 47 GLU N A 47 GLU CA A 47 GLU C 1.0 -85.0 -45.0 PHI 38 38 A 47 GLU N A 47 GLU CA A 47 GLU C A 48 LYS N 1.0 -59.0 -19.0 PSI 39 39 A 47 GLU C A 48 LYS N A 48 LYS CA A 48 LYS C 1.0 -88.0 -48.0 PHI 40 40 A 48 LYS N A 48 LYS CA A 48 LYS C A 49 ALA N 1.0 -58.0 2.0 PSI 41 41 A 53 VAL C A 54 VAL N A 54 VAL CA A 54 VAL C 1.0 -82.0 -42.0 PHI 42 42 A 54 VAL N A 54 VAL CA A 54 VAL C A 55 GLY N 1.0 -62.0 -22.0 PSI 43 43 A 54 VAL C A 55 GLY N A 55 GLY CA A 55 GLY C 1.0 -85.0 -45.0 PHI 44 44 A 55 GLY N A 55 GLY CA A 55 GLY C A 56 ILE N 1.0 -58.0 -18.0 PSI 45 45 A 55 GLY C A 56 ILE N A 56 ILE CA A 56 ILE C 1.0 -97.0 -49.0 PHI 46 46 A 56 ILE N A 56 ILE CA A 56 ILE C A 57 LYS N 1.0 -62.0 -14.0 PSI 47 47 A 56 ILE C A 57 LYS N A 57 LYS CA A 57 LYS C 1.0 -86.0 -46.0 PHI 48 48 A 57 LYS N A 57 LYS CA A 57 LYS C A 58 ALA N 1.0 -61.0 -21.0 PSI 49 49 A 57 LYS C A 58 ALA N A 58 ALA CA A 58 ALA C 1.0 -87.0 -47.0 PHI 50 50 A 58 ALA N A 58 ALA CA A 58 ALA C A 59 ILE N 1.0 -62.0 -22.0 PSI 51 51 A 58 ALA C A 59 ILE N A 59 ILE CA A 59 ILE C 1.0 -109.0 -53.0 PHI 52 52 A 59 ILE N A 59 ILE CA A 59 ILE C A 60 GLY N 1.0 -62.0 6.0 PSI stop_ save_