data_nef_c18861_2m1f 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 1 ACE C 1 2 PHE N 1 2 PHE C 1 3 AIB N 1 3 AIB C 1 4 AIB N 1 4 AIB C 1 5 AIB N 1 5 AIB C 1 6 DIV N 1 6 DIV C 1 7 GLY N 1 8 LEU C 1 9 AIB N 1 9 AIB C 1 10 AIB N 1 10 AIB C 1 11 HYP N 1 11 HYP C 1 12 GLN N 1 12 GLN C 1 13 DIV N 1 13 DIV C 1 14 HYP N 1 14 HYP C 1 15 AIB N 1 15 AIB C 1 16 PRO N 1 16 PRO C 1 17 PHL N stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 ACE start . . 2 A 2 PHE middle . . 3 A 3 AIB middle . . 4 A 4 AIB middle . . 5 A 5 AIB middle . . 6 A 6 DIV middle . . 7 A 7 GLY middle . false 8 A 8 LEU middle . . 9 A 9 AIB middle . . 10 A 10 AIB middle . . 11 A 11 HYP middle . . 12 A 12 GLN middle . . 13 A 13 DIV middle . . 14 A 14 HYP middle . . 15 A 15 AIB middle . . 16 A 16 PRO middle . false 17 A 17 PHL 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 ACE H% H 1 2.105 0.02 A 1 ACE C C 13 176.007 0.1 A 1 ACE CH3 C 13 24.206 0.1 A 2 PHE H H 1 8.444 0.02 A 2 PHE HA H 1 4.284 0.02 A 2 PHE HB2 H 1 3.145 0.02 A 2 PHE HB3 H 1 3.077 0.02 A 2 PHE C C 13 174.710 0.1 A 2 PHE CA C 13 59.730 0.1 A 2 PHE CB C 13 39.004 0.1 A 2 PHE N N 15 126.457 0.1 A 3 AIB H H 1 8.417 0.02 A 3 AIB HB1% H 1 1.345 0.02 A 3 AIB HB2% H 1 1.390 0.02 A 3 AIB C C 13 178.508 0.1 A 3 AIB CA C 13 58.549 0.1 A 3 AIB CB1 C 13 25.521 0.1 A 3 AIB CB2 C 13 26.927 0.1 A 3 AIB N N 15 130.821 0.1 A 4 AIB H H 1 7.672 0.02 A 4 AIB HB1% H 1 1.436 0.02 A 4 AIB HB2% H 1 1.436 0.02 A 4 AIB C C 13 179.166 0.1 A 4 AIB CA C 13 58.463 0.1 A 4 AIB CB1 C 13 24.894 0.1 A 4 AIB CB2 C 13 27.554 0.1 A 4 AIB N N 15 126.759 0.1 A 5 AIB H H 1 7.935 0.02 A 5 AIB HB1% H 1 1.458 0.02 A 5 AIB HB2% H 1 1.458 0.02 A 5 AIB C C 13 178.556 0.1 A 5 AIB CA C 13 58.619 0.1 A 5 AIB CB1 C 13 25.098 0.1 A 5 AIB CB2 C 13 28.107 0.1 A 5 AIB N N 15 127.651 0.1 A 6 DIV H H 1 7.830 0.02 A 6 DIV HB11 H 1 2.235 0.02 A 6 DIV HB12 H 1 1.734 0.02 A 6 DIV HB2% H 1 1.368 0.02 A 6 DIV HG1% H 1 0.758 0.02 A 6 DIV C C 13 180.157 0.1 A 6 DIV CA C 13 61.178 0.1 A 6 DIV CB1 C 13 28.497 0.1 A 6 DIV CB2 C 13 24.071 0.1 A 6 DIV CG1 C 13 7.219 0.1 A 6 DIV N N 15 120.786 0.1 A 7 GLY H H 1 8.023 0.02 A 7 GLY HA2 H 1 3.916 0.02 A 7 GLY HA3 H 1 3.916 0.02 A 7 GLY C C 13 175.244 0.1 A 7 GLY CA C 13 46.125 0.1 A 7 GLY N N 15 102.056 0.1 A 8 LEU H H 1 7.939 0.02 A 8 LEU HA H 1 4.254 0.02 A 8 LEU HBx H 1 1.671 0.02 A 8 LEU HBy H 1 1.809 0.02 A 8 LEU HDx% H 1 0.952 0.02 A 8 LEU HDy% H 1 0.921 0.02 A 8 LEU HG H 1 1.769 0.02 A 8 LEU C C 13 176.481 0.1 A 8 LEU CA C 13 56.275 0.1 A 8 LEU CB C 13 41.930 0.1 A 8 LEU CD1 C 13 24.348 0.1 A 8 LEU CD2 C 13 23.295 0.1 A 8 LEU CG C 13 26.433 0.1 A 8 LEU N N 15 120.995 0.1 A 9 AIB H H 1 7.464 0.02 A 9 AIB HB1% H 1 1.548 0.02 A 9 AIB HB2% H 1 1.464 0.02 A 9 AIB C C 13 178.713 0.1 A 9 AIB CA C 13 58.680 0.1 A 9 AIB CB1 C 13 24.919 0.1 A 9 AIB CB2 C 13 28.937 0.1 A 9 AIB N N 15 124.512 0.1 A 10 AIB H H 1 7.731 0.02 A 10 AIB HB1% H 1 1.504 0.02 A 10 AIB HB2% H 1 1.634 0.02 A 10 AIB CA C 13 59.146 0.1 A 10 AIB CB1 C 13 27.709 0.1 A 10 AIB CB2 C 13 25.228 0.1 A 10 AIB N N 15 127.758 0.1 A 11 HYP HA H 1 4.687 0.02 A 11 HYP HB2 H 1 2.049 0.02 A 11 HYP HB3 H 1 2.472 0.02 A 11 HYP HD22 H 1 3.730 0.02 A 11 HYP HD23 H 1 4.018 0.02 A 11 HYP HG H 1 4.643 0.02 A 11 HYP C C 13 176.757 0.1 A 11 HYP CA C 13 63.311 0.1 A 11 HYP CB C 13 38.383 0.1 A 11 HYP CD C 13 58.568 0.1 A 12 GLN H H 1 8.197 0.02 A 12 GLN HA H 1 4.466 0.02 A 12 GLN HB2 H 1 2.041 0.02 A 12 GLN HB3 H 1 2.419 0.02 A 12 GLN HE21 H 1 7.413 0.02 A 12 GLN HE22 H 1 6.672 0.02 A 12 GLN HG2 H 1 2.373 0.02 A 12 GLN HG3 H 1 2.373 0.02 A 12 GLN C C 13 174.245 0.1 A 12 GLN CA C 13 54.762 0.1 A 12 GLN CB C 13 28.845 0.1 A 12 GLN CG C 13 33.265 0.1 A 12 GLN N N 15 112.272 0.1 A 12 GLN NE2 N 15 110.061 0.1 A 13 DIV H H 1 7.414 0.02 A 13 DIV HB11 H 1 2.288 0.02 A 13 DIV HB12 H 1 1.922 0.02 A 13 DIV HB2% H 1 1.515 0.02 A 13 DIV HG1% H 1 0.844 0.02 A 13 DIV CA C 13 61.204 0.1 A 13 DIV CB1 C 13 30.221 0.1 A 13 DIV CB2 C 13 22.523 0.1 A 13 DIV CG1 C 13 7.203 0.1 A 13 DIV N N 15 125.447 0.1 A 14 HYP HA H 1 4.727 0.02 A 14 HYP HB2 H 1 1.953 0.02 A 14 HYP HB3 H 1 2.425 0.02 A 14 HYP HD22 H 1 3.544 0.02 A 14 HYP HD23 H 1 3.850 0.02 A 14 HYP HG H 1 4.534 0.02 A 14 HYP C C 13 177.173 0.1 A 14 HYP CA C 13 63.635 0.1 A 14 HYP CB C 13 38.826 0.1 A 14 HYP CD C 13 58.705 0.1 A 15 AIB H H 1 7.969 0.02 A 15 AIB HB1% H 1 1.473 0.02 A 15 AIB HB2% H 1 1.546 0.02 A 15 AIB CA C 13 58.636 0.1 A 15 AIB CB1 C 13 26.874 0.1 A 15 AIB CB2 C 13 25.103 0.1 A 15 AIB N N 15 129.139 0.1 A 16 PRO HA H 1 4.339 0.02 A 16 PRO HB2 H 1 0.892 0.02 A 16 PRO HB3 H 1 1.919 0.02 A 16 PRO HD2 H 1 3.808 0.02 A 16 PRO HD3 H 1 3.725 0.02 A 16 PRO HG2 H 1 1.425 0.02 A 16 PRO HG3 H 1 1.578 0.02 A 16 PRO C C 13 175.130 0.1 A 16 PRO CA C 13 64.330 0.1 A 16 PRO CB C 13 30.613 0.1 A 16 PRO CD C 13 50.384 0.1 A 16 PRO CG C 13 26.994 0.1 A 17 PHL H H 1 7.147 0.02 A 17 PHL H2 H 1 3.711 0.02 A 17 PHL HA H 1 4.185 0.02 A 17 PHL HB2 H 1 2.635 0.02 A 17 PHL HB3 H 1 3.105 0.02 A 17 PHL C C 13 66.318 0.1 A 17 PHL CA C 13 55.354 0.1 A 17 PHL CB C 13 38.905 0.1 A 17 PHL N N 15 118.335 0.1 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin 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 16 PRO HB3 A 17 PHL H 1.0 . 4.86 2 2 A 17 PHL H A 17 PHL HB2 1.0 . 3.16 3 3 A 17 PHL H A 16 PRO HB2 1.0 . 4.24 4 4 A 17 PHL H A 16 PRO HG2 1.0 . 4.35 5 5 A 17 PHL H A 17 PHL HB3 1.0 . 3.76 6 6 A 17 PHL H A 16 PRO HD2 1.0 . 3.53 7 7 A 17 PHL H A 14 HYP HA 1.0 . 4.47 8 8 A 6 DIV H A 6 DIV HB11 1.0 . 3.56 9 9 A 6 DIV H A 2 PHE HA 1.0 . 4.59 10 10 A 6 DIV H A 4 ABA H 1.0 . 3.29 11 11 A 6 DIV H A 7 GLY H 1.0 . 3.12 12 12 A 6 DIV H A 7 GLY HA2 1.0 . 4.62 13 12 A 6 DIV H A 7 GLY HA3 1.0 . 4.62 14 13 A 6 DIV H A 6 DIV HB12 1.0 . 3.85 15 14 A 6 DIV H A 5 ABA H 1.0 . 2.85 16 15 A 6 DIV H A 5 ABA H 1.0 . 3.11 17 16 A 15 ABA H A 15 ABA HBx 1.0 . 3.16 18 16 A 15 ABA H A 15 ABA HBy 1.0 . 3.16 19 17 A 15 ABA H A 12 GLN HA 1.0 . 4.34 20 18 A 15 ABA H A 16 PRO HD3 1.0 . 3.28 21 19 A 15 ABA H A 13 DIV HB11 1.0 . 7.00 22 20 A 15 ABA H A 14 HYP HD23 1.0 . 4.39 23 21 A 16 PRO HD2 A 15 ABA H 1.0 . 3.41 24 22 A 15 ABA H A 14 HYP HB2 1.0 . 3.77 25 23 A 15 ABA H A 14 HYP HD22 1.0 . 3.52 26 24 A 15 ABA H A 13 DIV HB12 1.0 . 4.29 27 25 A 13 DIV H A 10 ABA HBx 1.0 . 2.67 28 25 A 10 ABA HBy A 13 DIV H 1.0 . 2.67 29 26 A 13 DIV HB11 A 13 DIV H 1.0 . 3.90 30 27 A 13 DIV H A 11 HYP HA 1.0 . 4.45 31 28 A 13 DIV H A 12 GLN HB2 1.0 . 3.67 32 29 A 14 HYP HD23 A 13 DIV H 1.0 . 3.00 33 30 A 14 HYP HD22 A 13 DIV H 1.0 . 3.31 34 31 A 13 DIV HB12 A 13 DIV H 1.0 . 3.90 35 32 A 13 DIV H A 12 GLN H 1.0 . 2.62 36 33 A 6 DIV HB11 A 7 GLY H 1.0 . 4.80 37 34 A 7 GLY H A 4 ABA H 1.0 . 3.61 38 35 A 7 GLY H A 8 LEU H 1.0 . 3.42 39 36 A 7 GLY H A 7 GLY HA2 1.0 . 2.92 40 36 A 7 GLY H A 7 GLY HA3 1.0 . 2.92 41 37 A 7 GLY H A 6 DIV HB12 1.0 . 5.23 42 38 A 7 GLY H A 5 ABA H 1.0 . 4.29 43 39 A 9 ABA H A 11 HYP HD23 1.0 . 4.75 44 40 A 6 DIV HB11 A 9 ABA H 1.0 . 4.07 45 41 A 9 ABA H A 8 LEU HDy% 1.0 . 4.51 46 42 A 9 ABA H A 11 HYP HD22 1.0 . 5.69 47 43 A 7 GLY H A 9 ABA H 1.0 . 5.05 48 44 A 9 ABA H A 8 LEU HDx% 1.0 . 5.01 49 45 A 9 ABA H A 7 GLY HA2 1.0 . 4.49 50 45 A 7 GLY HA3 A 9 ABA H 1.0 . 4.49 51 46 A 6 DIV HB12 A 9 ABA H 1.0 . 5.13 52 47 A 9 ABA H A 9 ABA HBx 1.0 . 3.20 53 47 A 9 ABA H A 9 ABA HBy 1.0 . 3.20 54 48 A 9 ABA H A 8 LEU HA 1.0 . 3.29 55 49 A 9 ABA H A 10 ABA H 1.0 . 3.08 56 50 A 12 GLN HB3 A 12 GLN HE21 1.0 . 4.63 57 51 A 12 GLN HB2 A 12 GLN HE21 1.0 . 5.33 58 52 A 12 GLN HE21 A 9 ABA HBx 1.0 . 4.75 59 52 A 9 ABA HBy A 12 GLN HE21 1.0 . 4.75 60 53 A 6 DIV HB11 A 8 LEU H 1.0 . 4.28 61 54 A 8 LEU H A 8 LEU HDy% 1.0 . 3.96 62 55 A 8 LEU H A 8 LEU HBx 1.0 . 3.22 63 56 A 8 LEU H A 9 ABA H 1.0 . 2.89 64 57 A 8 LEU H A 8 LEU HDx% 1.0 . 4.16 65 58 A 8 LEU H A 7 GLY HA2 1.0 . 3.45 66 58 A 7 GLY HA3 A 8 LEU H 1.0 . 3.45 67 59 A 8 LEU H A 10 ABA H 1.0 . 6.22 68 60 A 2 PHE HA A 4 ABA H 1.0 . 4.59 69 61 A 4 ABA H A 2 PHE HB2 1.0 . 5.94 70 62 A 4 ABA H A 1 ACE CH3 1.0 . 4.40 71 63 A 4 ABA H A 2 PHE HB3 1.0 . 4.88 72 64 A 4 ABA H A 3 ABA HBx 1.0 . 3.79 73 64 A 4 ABA H A 3 ABA HBy 1.0 . 3.79 74 65 A 5 ABA H A 4 ABA H 1.0 . 2.86 75 66 A 4 ABA H A 3 ABA H 1.0 . 2.87 76 67 A 2 PHE HB2 A 2 PHE H 1.0 . 2.96 77 68 A 1 ACE CH3 A 2 PHE H 1.0 . 2.90 78 69 A 2 PHE HB3 A 2 PHE H 1.0 . 3.35 79 70 A 2 PHE HA A 5 ABA H 1.0 . 4.05 80 71 A 5 ABA H A 4 ABA H 1.0 . 2.56 81 72 A 5 ABA H A 3 ABA HBx 1.0 . 4.79 82 72 A 5 ABA H A 3 ABA HBy 1.0 . 4.79 83 73 A 5 ABA H A 3 ABA H 1.0 . 4.01 84 74 A 11 HYP HD23 A 10 ABA H 1.0 . 2.96 85 75 A 6 DIV HB11 A 10 ABA H 1.0 . 4.48 86 76 A 12 GLN HB2 A 10 ABA H 1.0 . 5.43 87 77 A 11 HYP HD22 A 10 ABA H 1.0 . 3.31 88 78 A 10 ABA H A 11 HYP HB2 1.0 . 5.52 89 79 A 10 ABA H A 7 GLY HA2 1.0 . 4.32 90 79 A 7 GLY HA3 A 10 ABA H 1.0 . 4.32 91 80 A 6 DIV HB12 A 10 ABA H 1.0 . 4.98 92 81 A 10 ABA H A 8 LEU HBy 1.0 . 5.78 93 82 A 10 ABA H A 11 HYP HG 1.0 . 4.42 94 83 A 8 LEU HA A 10 ABA H 1.0 . 4.03 95 84 A 12 GLN H A 10 ABA H 1.0 . 4.86 96 85 A 10 ABA H A 8 LEU HG 1.0 . 6.01 97 86 A 12 GLN H A 11 HYP HD23 1.0 . 4.03 98 87 A 12 GLN HB2 A 12 GLN H 1.0 . 3.25 99 88 A 12 GLN H A 11 HYP HD22 1.0 . 3.61 100 89 A 14 HYP HD23 A 12 GLN H 1.0 . 4.59 101 90 A 12 GLN H A 12 GLN HE21 1.0 . 4.33 102 91 A 12 GLN H A 11 HYP HB2 1.0 . 4.09 103 92 A 12 GLN H A 11 HYP HG 1.0 . 4.29 104 93 A 14 HYP HD22 A 12 GLN H 1.0 . 5.21 105 94 A 12 GLN H A 12 GLN HE22 1.0 . 5.80 106 95 A 2 PHE HB2 A 3 ABA H 1.0 . 3.77 107 96 A 1 ACE CH3 A 3 ABA H 1.0 . 4.25 108 97 A 4 ABA H A 3 ABA H 1.0 . 5.21 109 98 A 2 PHE HB3 A 3 ABA H 1.0 . 3.45 110 99 A 3 ABA H A 3 ABA HBx 1.0 . 2.83 111 99 A 3 ABA HBy A 3 ABA H 1.0 . 2.83 112 100 A 6 DIV H A 3 ABA HBx 1.0 . 0.00 113 100 A 6 DIV H A 3 ABA HBy 1.0 . 0.00 114 101 A 9 ABA H A 8 LEU HBx 1.0 . 0.00 115 102 A 9 ABA H A 10 ABA HBx 1.0 . 0.00 116 102 A 10 ABA HBy A 9 ABA H 1.0 . 0.00 117 103 A 12 GLN H A 10 ABA HBx 1.0 . 3.39 118 103 A 10 ABA HBy A 12 GLN H 1.0 . 3.39 119 104 A 13 DIV H A 12 GLN HG2 1.0 . 3.73 120 104 A 13 DIV H A 12 GLN HG3 1.0 . 3.73 121 105 A 13 DIV H A 12 GLN HB3 1.0 . 0.00 122 106 A 8 LEU H A 4 ABA H 1.0 . 0.00 123 107 A 5 ABA H A 8 LEU H 1.0 . 0.00 124 108 A 8 LEU H A 8 LEU HG 1.0 . 2.67 125 109 A 8 LEU H A 8 LEU HBy 1.0 . 0.00 126 110 A 12 GLN H A 12 GLN HG2 1.0 . 3.13 127 110 A 12 GLN H A 12 GLN HG3 1.0 . 3.13 128 111 A 12 GLN H A 12 GLN HB3 1.0 . 0.00 129 112 A 12 GLN H A 11 HYP HB3 1.0 . 0.00 130 113 A 9 ABA H A 8 LEU HG 1.0 . 3.62 131 114 A 9 ABA H A 8 LEU HBy 1.0 . 0.00 132 115 A 10 ABA H A 10 ABA HBx 1.0 . 2.53 133 115 A 10 ABA HBy A 10 ABA H 1.0 . 2.53 134 116 A 10 ABA H A 9 ABA HBx 1.0 . 0.00 135 116 A 9 ABA HBy A 10 ABA H 1.0 . 0.00 136 117 A 9 ABA H A 10 ABA H 1.0 . 2.85 137 118 A 13 DIV H A 10 ABA H 1.0 . 0.00 138 119 A 17 PHL H A 16 PRO HG3 1.0 . 3.75 139 120 A 17 PHL H A 15 ABA HBx 1.0 . 0.00 140 120 A 17 PHL H A 15 ABA HBy 1.0 . 0.00 141 121 A 17 PHL H A 17 PHL HCx 1.0 . 3.01 142 121 A 17 PHL H A 17 PHL HCy 1.0 . 3.01 143 122 A 17 PHL H A 16 PRO HD3 1.0 . 0.00 144 123 A 2 PHE H A 3 ABA HBx 1.0 . 4.16 145 123 A 3 ABA HBy A 2 PHE H 1.0 . 4.16 146 124 A 4 ABA H A 2 PHE H 1.0 . 4.26 147 125 A 5 ABA H A 2 PHE H 1.0 . 0.00 148 126 A 15 ABA H A 14 HYP HB3 1.0 . 4.21 149 127 A 15 ABA H A 12 GLN HB3 1.0 . 0.00 150 128 A 12 GLN HA A 12 GLN HG2 1.0 . 4.07 151 128 A 12 GLN HA A 12 GLN HG3 1.0 . 4.07 152 129 A 14 HYP HB2 A 15 ABA HBx 1.0 . 3.49 153 129 A 15 ABA HBy A 14 HYP HB2 1.0 . 3.49 154 130 A 8 LEU HDx% A 8 LEU HBy 1.0 . 3.66 155 131 A 16 PRO HB2 A 16 PRO HD2 1.0 . 4.63 156 132 A 16 PRO HG2 A 16 PRO HD2 1.0 . 4.23 157 133 A 16 PRO HB3 A 16 PRO HD2 1.0 . 4.61 158 134 A 16 PRO HB3 A 16 PRO HD3 1.0 . 4.59 159 135 A 16 PRO HG2 A 16 PRO HD3 1.0 . 4.15 160 136 A 14 HYP HB2 A 14 HYP HD22 1.0 . 4.19 161 137 A 11 HYP HD22 A 9 ABA HBy 1.0 . 3.05 162 137 A 11 HYP HD22 A 9 ABA HBx 1.0 . 3.05 163 138 A 17 PHL HB2 A 17 PHL HCx 1.0 . 3.45 164 138 A 17 PHL HB2 A 17 PHL HCy 1.0 . 3.45 165 139 A 17 PHL HB3 A 17 PHL HCx 1.0 . 3.35 166 139 A 17 PHL HB3 A 17 PHL HCy 1.0 . 3.35 167 140 A 14 HYP HD22 A 14 HYP HG 1.0 . 3.78 168 141 A 11 HYP HD23 A 11 HYP HG 1.0 . 4.14 169 142 A 8 LEU HDy% A 8 LEU HBx 1.0 . 3.26 170 143 A 8 LEU HDy% A 8 LEU HA 1.0 . 2.88 171 144 A 8 LEU HDx% A 8 LEU HBx 1.0 . 3.38 172 145 A 8 LEU HDx% A 8 LEU HA 1.0 . 3.53 173 146 A 11 HYP HD22 A 11 HYP HG 1.0 . 3.67 174 147 A 14 HYP HD23 A 14 HYP HG 1.0 . 4.08 175 148 A 11 HYP HD22 A 11 HYP HB2 1.0 . 4.10 stop_ save_ save_DYANA/DIANA_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_5 _nef_distance_restraint_list.restraint_origin hbond _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 5 ABA H A 1 ACE O 1.0 . 2.3 2 2 A 1 ACE O A 5 ABA N 1.0 . 3.3 3 3 A 6 DIV H A 2 PHE O 1.0 . 2.5 4 4 A 2 PHE O A 6 DIV N 1.0 . 3.5 5 5 A 6 DIV H A 3 ABA O 1.0 . 2.5 6 6 A 6 DIV N A 3 ABA O 1.0 . 3.5 7 7 A 7 GLY H A 4 ABA O 1.0 . 2.3 8 8 A 4 ABA O A 7 GLY N 1.0 . 3.3 9 9 A 8 LEU H A 5 ABA O 1.0 . 2.3 10 10 A 5 ABA O A 8 LEU N 1.0 . 3.3 11 11 A 9 ABA H A 6 DIV O 1.0 . 2.3 12 12 A 6 DIV O A 9 ABA N 1.0 . 3.3 13 13 A 10 ABA H A 6 DIV O 1.0 . 2.5 14 14 A 6 DIV O A 10 ABA N 1.0 . 3.5 15 15 A 10 ABA H A 7 GLY O 1.0 . 2.5 16 16 A 10 ABA N A 7 GLY O 1.0 . 3.5 17 17 A 12 GLN H A 9 ABA O 1.0 . 2.3 18 18 A 9 ABA O A 12 GLN N 1.0 . 3.3 19 19 A 13 DIV H A 10 ABA O 1.0 . 2.3 20 20 A 10 ABA O A 13 DIV N 1.0 . 3.3 21 21 A 15 ABA H A 12 GLN O 1.0 . 2.3 22 22 A 12 GLN O A 15 ABA N 1.0 . 3.3 23 23 A 17 PHL H A 14 HYP O 1.0 . 2.3 24 24 A 14 HYP O A 17 PHL N 1.0 . 3.3 25 25 A 5 ABA H A 1 ACE O 1.0 . 1.8 26 26 A 1 ACE O A 5 ABA N 1.0 . 2.7 27 27 A 6 DIV H A 2 PHE O 1.0 . 1.8 28 28 A 2 PHE O A 6 DIV N 1.0 . 2.7 29 29 A 6 DIV H A 3 ABA O 1.0 . 1.8 30 30 A 6 DIV N A 3 ABA O 1.0 . 2.7 31 31 A 7 GLY H A 4 ABA O 1.0 . 1.8 32 32 A 4 ABA O A 7 GLY N 1.0 . 2.7 33 33 A 8 LEU H A 5 ABA O 1.0 . 1.8 34 34 A 5 ABA O A 8 LEU N 1.0 . 2.7 35 35 A 9 ABA H A 6 DIV O 1.0 . 1.8 36 36 A 6 DIV O A 9 ABA N 1.0 . 2.7 37 37 A 10 ABA H A 6 DIV O 1.0 . 1.8 38 38 A 6 DIV O A 10 ABA N 1.0 . 2.7 39 39 A 10 ABA H A 7 GLY O 1.0 . 1.8 40 40 A 10 ABA N A 7 GLY O 1.0 . 2.7 41 41 A 12 GLN H A 9 ABA O 1.0 . 1.8 42 42 A 9 ABA O A 12 GLN N 1.0 . 2.7 43 43 A 13 DIV H A 10 ABA O 1.0 . 1.8 44 44 A 10 ABA O A 13 DIV N 1.0 . 2.7 45 45 A 15 ABA H A 12 GLN O 1.0 . 1.8 46 46 A 12 GLN O A 15 ABA N 1.0 . 2.7 47 47 A 17 PHL H A 14 HYP O 1.0 . 1.8 48 48 A 14 HYP O A 17 PHL N 1.0 . 2.7 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_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 ACE C A 2 PHE N A 2 PHE CA A 2 PHE C 1.0 -80.0 -40.0 PHI 2 2 A 7 GLY C A 8 LEU N A 8 LEU CA A 8 LEU C 1.0 -110.0 -50.0 PHI 3 3 A 11 HYP C A 12 GLN N A 12 GLN CA A 12 GLN C 1.0 -140.0 -80.0 PHI stop_ save_ save_DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_4 _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 8 LEU N A 8 LEU CA A 8 LEU CB A 8 LEU CG 1.0 -90.0 90.0 CHI1 2 2 A 2 PHE N A 2 PHE CA A 2 PHE CB A 2 PHE CG 1.0 150.0 210.0 CHI1 3 3 A 12 GLN N A 12 GLN CA A 12 GLN CB A 12 GLN CG 1.0 -90.0 -30.0 CHI1 stop_ save_