data_nef_c30287_5vl6 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 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 5VL6 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 1 ASN start . . 2 A 2 VAL middle . . 3 A 3 HIS middle . . 4 A 4 THR middle . . 5 A 5 PHE middle . . 6 A 6 ARG middle . . 7 A 7 GLY middle . false 8 A 8 ASP middle . . 9 A 9 ASN middle . . 10 A 10 VAL middle . . 11 A 11 HIS middle . . 12 A 12 ASN middle . . 13 A 13 SER middle . . 14 A 14 SER middle . . 15 A 15 SER middle . . 16 A 16 SER middle . . 17 A 17 LEU end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 ASN H1 H 1 8.196 0.02 A 1 ASN HA H 1 4.568 0.02 A 1 ASN HB2 H 1 2.693 0.02 A 1 ASN HB3 H 1 2.567 0.02 A 1 ASN HD21 H 1 7.398 0.02 A 1 ASN HD22 H 1 6.663 0.02 A 2 VAL H H 1 7.854 0.02 A 2 VAL HA H 1 3.843 0.02 A 2 VAL HB H 1 1.902 0.02 A 2 VAL HGx% H 1 0.657 0.02 A 3 HIS H H 1 8.312 0.02 A 3 HIS HA H 1 4.545 0.02 A 3 HIS HB2 H 1 3.035 0.02 A 3 HIS HB3 H 1 3.114 0.02 A 3 HIS HD2 H 1 7.115 0.02 A 4 THR H H 1 7.759 0.02 A 4 THR HA H 1 4.135 0.02 A 4 THR HB H 1 4.014 0.02 A 4 THR HG2% H 1 0.973 0.02 A 5 PHE H H 1 7.937 0.02 A 5 PHE HA H 1 4.467 0.02 A 5 PHE HBx H 1 2.943 0.02 A 5 PHE HBy H 1 2.943 0.02 A 5 PHE HDx H 1 7.100 0.02 A 5 PHE HDy H 1 7.100 0.02 A 5 PHE HEx H 1 7.144 0.02 A 5 PHE HEy H 1 7.144 0.02 A 6 ARG H H 1 8.047 0.02 A 6 ARG HA H 1 4.104 0.02 A 6 ARG HB2 H 1 1.536 0.02 A 6 ARG HB3 H 1 1.684 0.02 A 6 ARG HDx H 1 2.986 0.02 A 6 ARG HDy H 1 2.986 0.02 A 6 ARG HGx H 1 1.413 0.02 A 6 ARG HGy H 1 1.413 0.02 A 6 ARG HH1x H 1 7.022 0.02 A 6 ARG HH1y H 1 7.022 0.02 A 7 GLY H H 1 7.481 0.02 A 7 GLY HAx H 1 3.705 0.02 A 7 GLY HAy H 1 3.705 0.02 A 8 ASP H H 1 8.029 0.02 A 8 ASP HA H 1 4.565 0.02 A 8 ASP HBx H 1 2.687 0.02 A 8 ASP HBy H 1 2.687 0.02 A 9 ASN H H 1 8.202 0.02 A 9 ASN HA H 1 4.566 0.02 A 9 ASN HB2 H 1 2.683 0.02 A 9 ASN HB3 H 1 2.588 0.02 A 9 ASN HD21 H 1 7.351 0.02 A 9 ASN HD22 H 1 6.638 0.02 A 10 VAL H H 1 7.737 0.02 A 10 VAL HA H 1 3.849 0.02 A 10 VAL HB H 1 1.883 0.02 A 10 VAL HGx% H 1 0.668 0.02 A 11 HIS H H 1 8.299 0.02 A 11 HIS HA H 1 4.541 0.02 A 11 HIS HB2 H 1 3.132 0.02 A 11 HIS HB3 H 1 3.011 0.02 A 11 HIS HD2 H 1 7.136 0.02 A 12 ASN H H 1 8.165 0.02 A 12 ASN HA H 1 4.540 0.02 A 12 ASN HBx H 1 2.673 0.02 A 12 ASN HBy H 1 2.673 0.02 A 12 ASN HD21 H 1 7.419 0.02 A 12 ASN HD22 H 1 6.690 0.02 A 13 SER H H 1 8.232 0.02 A 13 SER HA H 1 4.355 0.02 A 13 SER HB2 H 1 3.732 0.02 A 13 SER HB3 H 1 3.809 0.02 A 14 SER H H 1 8.193 0.02 A 14 SER HA H 1 4.338 0.02 A 14 SER HB2 H 1 3.818 0.02 A 14 SER HB3 H 1 3.729 0.02 A 15 SER H H 1 8.074 0.02 A 15 SER HA H 1 4.326 0.02 A 15 SER HB2 H 1 3.715 0.02 A 15 SER HB3 H 1 3.792 0.02 A 16 SER H H 1 8.039 0.02 A 16 SER HA H 1 4.313 0.02 A 16 SER HB2 H 1 3.683 0.02 A 16 SER HB3 H 1 3.734 0.02 A 17 LEU H H 1 7.823 0.02 A 17 LEU HA H 1 4.161 0.02 A 17 LEU HBx H 1 1.487 0.02 A 17 LEU HBy H 1 1.487 0.02 A 17 LEU HD21 H 1 0.767 0.02 A 17 LEU HD22 H 1 0.712 0.02 A 17 LEU HD23 H 1 0.767 0.02 A 17 LEU HG H 1 1.487 0.02 stop_ save_ save_Discover_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode Discover_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 2 VAL H A 2 VAL HA 1.0 1.8 2.8 2 2 A 3 HIS H A 3 HIS HA 1.0 1.8 2.8 3 3 A 4 THR H A 4 THR HA 1.0 1.8 2.8 4 4 A 5 PHE H A 5 PHE HA 1.0 1.8 2.8 5 5 A 6 ARG H A 6 ARG HA 1.0 1.8 2.8 6 6 A 7 GLY H A 7 GLY HAx 1.0 1.8 3.8 7 6 A 7 GLY H A 7 GLY HAy 1.0 1.8 3.8 8 7 A 8 ASP H A 8 ASP HA 1.0 1.8 3.8 9 8 A 9 ASN H A 9 ASN HA 1.0 1.8 2.8 10 9 A 10 VAL H A 10 VAL HA 1.0 1.8 3.8 11 10 A 11 HIS H A 11 HIS HA 1.0 1.8 3.8 12 11 A 12 ASN H A 12 ASN HA 1.0 1.8 3.8 13 12 A 13 SER H A 13 SER HA 1.0 1.8 2.8 14 13 A 14 SER H A 14 SER HA 1.0 1.8 2.8 15 14 A 15 SER H A 15 SER HA 1.0 2.8 3.5 16 15 A 16 SER H A 16 SER HA 1.0 2.8 3.5 17 16 A 17 LEU H A 17 LEU HA 1.0 2.8 3.5 18 17 A 1 ASN HA A 1 ASN HB2 1.0 2.8 4.5 19 17 A 1 ASN HA A 1 ASN HB3 1.0 2.8 4.5 20 18 A 2 VAL H A 2 VAL HB 1.0 1.8 2.8 21 19 A 2 VAL H A 2 VAL HGx% 1.0 1.8 5.2 22 19 A 2 VAL H A 2 VAL HG21 1.0 1.8 5.2 23 20 A 2 VAL HA A 2 VAL HB 1.0 2.8 3.5 24 21 A 2 VAL HA A 2 VAL HGx% 1.0 2.8 5.9 25 21 A 2 VAL HA A 2 VAL HG21 1.0 2.8 5.9 26 22 A 3 HIS H A 3 HIS HB2 1.0 1.8 2.8 27 23 A 3 HIS H A 3 HIS HB3 1.0 1.8 2.8 28 24 A 3 HIS HA A 3 HIS HB2 1.0 2.8 3.5 29 25 A 3 HIS HA A 3 HIS HB3 1.0 2.8 3.5 30 26 A 4 THR H A 4 THR HB 1.0 2.8 3.5 31 27 A 4 THR H A 4 THR HG2% 1.0 2.8 3.5 32 28 A 4 THR HA A 4 THR HB 1.0 1.8 3.8 33 29 A 4 THR HA A 4 THR HG2% 1.0 2.8 4.5 34 30 A 4 THR HB A 4 THR HG2% 1.0 1.8 3.8 35 31 A 5 PHE HA A 5 PHE HBx 1.0 1.8 3.8 36 31 A 5 PHE HA A 5 PHE HBy 1.0 1.8 3.8 37 32 A 5 PHE H A 5 PHE HBx 1.0 1.8 3.8 38 32 A 5 PHE H A 5 PHE HBy 1.0 1.8 3.8 39 33 A 6 ARG H A 6 ARG HB2 1.0 1.8 3.8 40 33 A 6 ARG H A 6 ARG HB3 1.0 1.8 3.8 41 34 A 6 ARG H A 6 ARG HGx 1.0 1.8 3.8 42 34 A 6 ARG H A 6 ARG HGy 1.0 1.8 3.8 43 35 A 6 ARG H A 6 ARG HDx 1.0 3.5 4.5 44 35 A 6 ARG H A 6 ARG HDy 1.0 3.5 4.5 45 36 A 6 ARG HA A 6 ARG HDx 1.0 3.5 4.5 46 36 A 6 ARG HA A 6 ARG HDy 1.0 3.5 4.5 47 37 A 6 ARG HA A 6 ARG HB2 1.0 2.8 4.5 48 37 A 6 ARG HA A 6 ARG HB3 1.0 2.8 4.5 49 38 A 6 ARG HA A 6 ARG HGx 1.0 2.8 4.5 50 38 A 6 ARG HA A 6 ARG HGy 1.0 2.8 4.5 51 39 A 6 ARG HB3 A 6 ARG HDx 1.0 2.8 5.5 52 39 A 6 ARG HB2 A 6 ARG HDx 1.0 2.8 5.5 53 39 A 6 ARG HDy A 6 ARG HB2 1.0 2.8 5.5 54 39 A 6 ARG HB3 A 6 ARG HDy 1.0 2.8 5.5 55 40 A 6 ARG HDx A 6 ARG HGx 1.0 1.8 3.8 56 40 A 6 ARG HDy A 6 ARG HGx 1.0 1.8 3.8 57 40 A 6 ARG HGy A 6 ARG HDx 1.0 1.8 3.8 58 40 A 6 ARG HGy A 6 ARG HDy 1.0 1.8 3.8 59 41 A 6 ARG HB2 A 6 ARG HGx 1.0 1.8 3.8 60 41 A 6 ARG HB3 A 6 ARG HGx 1.0 1.8 3.8 61 41 A 6 ARG HGy A 6 ARG HB2 1.0 1.8 3.8 62 41 A 6 ARG HB3 A 6 ARG HGy 1.0 1.8 3.8 63 42 A 6 ARG HDx A 6 ARG HH1% 1.0 1.8 6.2 64 42 A 6 ARG HDy A 6 ARG HH1% 1.0 1.8 6.2 65 42 A 6 ARG HH2% A 6 ARG HDx 1.0 1.8 6.2 66 42 A 6 ARG HDy A 6 ARG HH2% 1.0 1.8 6.2 67 43 A 8 ASP H A 8 ASP HBx 1.0 1.8 3.8 68 43 A 8 ASP H A 8 ASP HBy 1.0 1.8 3.8 69 44 A 8 ASP HA A 8 ASP HBx 1.0 1.8 3.8 70 44 A 8 ASP HA A 8 ASP HBy 1.0 1.8 3.8 71 45 A 9 ASN H A 9 ASN HB2 1.0 1.8 2.8 72 46 A 9 ASN H A 9 ASN HB3 1.0 2.8 5.5 73 47 A 9 ASN HA A 9 ASN HB2 1.0 1.8 2.8 74 48 A 9 ASN HA A 9 ASN HB3 1.0 2.8 3.5 75 49 A 9 ASN HA A 9 ASN HD22 1.0 1.8 2.8 76 50 A 9 ASN HB2 A 9 ASN HD22 1.0 1.8 2.8 77 51 A 9 ASN HB3 A 9 ASN HD22 1.0 2.8 3.5 78 52 A 10 VAL H A 10 VAL HB 1.0 2.8 3.5 79 53 A 10 VAL H A 10 VAL HGx% 1.0 1.8 5.2 80 53 A 10 VAL H A 10 VAL HG21 1.0 1.8 5.2 81 54 A 10 VAL HA A 10 VAL HB 1.0 1.8 5.2 82 55 A 10 VAL HA A 10 VAL HGx% 1.0 2.8 5.9 83 55 A 10 VAL HA A 10 VAL HG21 1.0 2.8 5.9 84 56 A 11 HIS H A 11 HIS HB2 1.0 2.8 5.9 85 57 A 11 HIS H A 11 HIS HB3 1.0 2.8 5.9 86 58 A 11 HIS HA A 11 HIS HB2 1.0 2.8 3.5 87 59 A 11 HIS HA A 11 HIS HB3 1.0 2.8 3.5 88 60 A 11 HIS HB2 A 11 HIS HD2 1.0 1.8 2.8 89 61 A 11 HIS HB3 A 11 HIS HD2 1.0 1.8 2.8 90 62 A 12 ASN H A 12 ASN HBx 1.0 2.8 4.5 91 62 A 12 ASN H A 12 ASN HBy 1.0 2.8 4.5 92 63 A 12 ASN HA A 12 ASN HBx 1.0 2.8 4.5 93 63 A 12 ASN HA A 12 ASN HBy 1.0 2.8 4.5 94 64 A 12 ASN HA A 12 ASN HD22 1.0 2.8 3.5 95 65 A 13 SER HA A 13 SER HB2 1.0 1.8 2.8 96 66 A 13 SER HA A 13 SER HB3 1.0 2.8 5.5 97 67 A 13 SER H A 13 SER HB2 1.0 2.8 5.5 98 68 A 13 SER H A 13 SER HB3 1.0 2.8 3.5 99 69 A 14 SER HA A 14 SER HB2 1.0 2.8 3.5 100 70 A 14 SER HA A 14 SER HB3 1.0 2.8 3.5 101 71 A 14 SER HB2 A 14 SER HB3 1.0 1.8 2.8 102 72 A 14 SER H A 14 SER HB2 1.0 2.8 3.5 103 73 A 14 SER H A 14 SER HB3 1.0 2.8 3.5 104 74 A 15 SER HA A 15 SER HB2 1.0 2.8 3.5 105 75 A 15 SER HA A 15 SER HB3 1.0 2.8 3.5 106 76 A 15 SER HB2 A 15 SER HB3 1.0 1.8 2.8 107 77 A 15 SER H A 15 SER HB2 1.0 2.8 3.5 108 78 A 15 SER H A 15 SER HB3 1.0 3.5 4.5 109 79 A 16 SER HA A 16 SER HB2 1.0 2.8 3.5 110 80 A 16 SER HA A 16 SER HB3 1.0 2.8 3.5 111 81 A 16 SER HB2 A 16 SER HB3 1.0 1.8 2.8 112 82 A 16 SER H A 16 SER HB2 1.0 2.8 3.5 113 83 A 16 SER H A 16 SER HB3 1.0 2.8 3.5 114 84 A 17 LEU H A 17 LEU HBx 1.0 2.8 4.5 115 84 A 17 LEU H A 17 LEU HBy 1.0 2.8 4.5 116 85 A 17 LEU H A 17 LEU HG 1.0 2.8 3.5 117 86 A 17 LEU H A 17 LEU HD11 1.0 2.8 5.9 118 86 A 17 LEU H A 17 LEU HD21 1.0 2.8 5.9 119 87 A 17 LEU HA A 17 LEU HBx 1.0 1.8 3.8 120 87 A 17 LEU HA A 17 LEU HBy 1.0 1.8 3.8 121 88 A 17 LEU HA A 17 LEU HG 1.0 1.8 3.8 122 89 A 17 LEU HA A 17 LEU HD11 1.0 2.8 5.9 123 89 A 17 LEU HA A 17 LEU HD21 1.0 2.8 5.9 124 90 A 17 LEU HG A 17 LEU HBx 1.0 2.8 4.5 125 90 A 17 LEU HBy A 17 LEU HG 1.0 2.8 4.5 126 91 A 17 LEU HBy A 17 LEU HD11 1.0 2.8 6.9 127 91 A 17 LEU HBx A 17 LEU HD11 1.0 2.8 6.9 128 91 A 17 LEU HD21 A 17 LEU HBx 1.0 2.8 6.9 129 91 A 17 LEU HBy A 17 LEU HD21 1.0 2.8 6.9 130 92 A 17 LEU HG A 17 LEU HD11 1.0 1.8 2.8 131 92 A 17 LEU HG A 17 LEU HD21 1.0 1.8 2.8 132 93 A 2 VAL H A 3 HIS H 1.0 1.8 2.8 133 94 A 3 HIS H A 4 THR H 1.0 1.8 2.8 134 95 A 4 THR H A 5 PHE H 1.0 1.8 2.8 135 96 A 5 PHE H A 6 ARG H 1.0 1.8 2.8 136 97 A 6 ARG H A 7 GLY H 1.0 1.8 2.8 137 98 A 7 GLY H A 8 ASP H 1.0 1.8 2.8 138 99 A 8 ASP H A 9 ASN H 1.0 1.8 2.8 139 100 A 9 ASN H A 10 VAL H 1.0 2.8 3.5 140 101 A 10 VAL H A 11 HIS H 1.0 1.8 2.8 141 102 A 11 HIS H A 12 ASN H 1.0 2.8 3.5 142 103 A 12 ASN H A 13 SER H 1.0 1.8 2.8 143 104 A 13 SER H A 14 SER H 1.0 1.8 2.8 144 105 A 14 SER H A 15 SER H 1.0 2.8 3.5 145 106 A 15 SER H A 16 SER H 1.0 2.8 3.5 146 107 A 16 SER H A 17 LEU H 1.0 1.8 2.8 147 108 A 1 ASN HA A 2 VAL H 1.0 2.8 3.5 148 109 A 2 VAL HA A 3 HIS H 1.0 2.8 3.5 149 110 A 3 HIS HA A 4 THR H 1.0 2.8 3.5 150 111 A 4 THR HA A 5 PHE H 1.0 2.8 3.5 151 112 A 5 PHE HA A 6 ARG H 1.0 2.8 3.5 152 113 A 6 ARG HA A 7 GLY H 1.0 1.8 2.8 153 114 A 8 ASP H A 7 GLY HAx 1.0 2.8 4.5 154 114 A 7 GLY HAy A 8 ASP H 1.0 2.8 4.5 155 115 A 8 ASP HA A 9 ASN H 1.0 2.8 3.5 156 116 A 9 ASN HA A 10 VAL H 1.0 2.8 3.5 157 117 A 10 VAL HA A 11 HIS H 1.0 1.8 3.8 158 118 A 11 HIS HA A 12 ASN H 1.0 2.8 3.5 159 119 A 13 SER HA A 14 SER H 1.0 1.8 3.8 160 120 A 14 SER HA A 15 SER H 1.0 2.8 3.5 161 121 A 15 SER HA A 16 SER H 1.0 2.8 3.5 162 122 A 16 SER HA A 17 LEU H 1.0 2.8 3.5 163 123 A 2 VAL H A 1 ASN HB2 1.0 2.8 4.5 164 123 A 2 VAL H A 1 ASN HB3 1.0 2.8 4.5 165 124 A 3 HIS H A 2 VAL HB 1.0 1.8 2.8 166 125 A 3 HIS H A 2 VAL HGx% 1.0 1.8 5.2 167 125 A 3 HIS H A 2 VAL HG21 1.0 1.8 5.2 168 126 A 4 THR H A 3 HIS HB2 1.0 3.5 5.5 169 127 A 4 THR H A 3 HIS HB3 1.0 2.8 3.5 170 128 A 5 PHE H A 4 THR HB 1.0 3.5 5.5 171 129 A 5 PHE H A 4 THR HG2% 1.0 3.5 5.5 172 129 A 5 PHE H A 4 THR HG1 1.0 3.5 5.5 173 130 A 6 ARG H A 5 PHE HBx 1.0 2.8 4.5 174 130 A 6 ARG H A 5 PHE HBy 1.0 2.8 4.5 175 131 A 7 GLY H A 6 ARG HB2 1.0 2.8 4.5 176 131 A 7 GLY H A 6 ARG HB3 1.0 2.8 4.5 177 132 A 7 GLY H A 6 ARG HGx 1.0 3.5 4.5 178 132 A 7 GLY H A 6 ARG HGy 1.0 3.5 4.5 179 133 A 9 ASN H A 8 ASP HBx 1.0 2.8 5.5 180 133 A 9 ASN H A 8 ASP HBy 1.0 2.8 5.5 181 134 A 10 VAL H A 9 ASN HB2 1.0 3.5 5.5 182 135 A 10 VAL H A 9 ASN HB3 1.0 3.5 5.5 183 136 A 11 HIS H A 10 VAL HB 1.0 3.5 5.5 184 137 A 11 HIS H A 10 VAL HGx% 1.0 2.8 5.9 185 137 A 11 HIS H A 10 VAL HG21 1.0 2.8 5.9 186 138 A 12 ASN H A 11 HIS HB2 1.0 3.5 5.5 187 139 A 12 ASN H A 11 HIS HB3 1.0 3.5 5.5 188 140 A 13 SER H A 12 ASN HBx 1.0 2.8 4.5 189 140 A 13 SER H A 12 ASN HBy 1.0 2.8 4.5 190 141 A 14 SER H A 13 SER HB2 1.0 3.5 5.5 191 142 A 14 SER H A 13 SER HB3 1.0 3.5 5.5 192 143 A 15 SER H A 14 SER HB2 1.0 3.5 5.5 193 144 A 15 SER H A 14 SER HB3 1.0 3.5 5.5 194 145 A 16 SER H A 15 SER HB2 1.0 3.5 5.5 195 146 A 16 SER H A 15 SER HB3 1.0 2.8 3.5 196 147 A 17 LEU H A 16 SER HB2 1.0 2.8 3.5 197 148 A 17 LEU H A 16 SER HB3 1.0 2.8 3.5 198 149 A 5 PHE HA A 6 ARG HGx 1.0 3.5 4.5 199 149 A 5 PHE HA A 6 ARG HGy 1.0 3.5 4.5 200 150 A 3 HIS HA A 2 VAL HGx% 1.0 3.5 5.9 201 150 A 3 HIS HA A 2 VAL HG21 1.0 3.5 5.9 202 151 A 1 ASN HA A 3 HIS H 1.0 3.5 4.5 203 152 A 2 VAL HA A 4 THR H 1.0 3.5 4.5 204 153 A 3 HIS HA A 5 PHE H 1.0 3.5 5.5 205 154 A 4 THR HA A 6 ARG H 1.0 3.5 4.5 206 155 A 5 PHE HA A 7 GLY H 1.0 3.5 4.5 207 156 A 6 ARG HA A 8 ASP H 1.0 3.5 4.5 208 157 A 9 ASN H A 7 GLY HAx 1.0 3.5 4.5 209 157 A 7 GLY HAy A 9 ASN H 1.0 3.5 4.5 210 158 A 8 ASP HA A 10 VAL H 1.0 3.5 4.5 211 159 A 9 ASN HA A 11 HIS H 1.0 3.5 4.5 212 160 A 10 VAL HA A 12 ASN H 1.0 3.5 4.5 213 161 A 11 HIS HA A 13 SER H 1.0 3.5 4.5 214 162 A 12 ASN HA A 14 SER H 1.0 3.5 5.5 215 163 A 13 SER HA A 15 SER H 1.0 3.5 4.5 216 164 A 14 SER HA A 16 SER H 1.0 3.5 5.5 217 165 A 15 SER HA A 17 LEU H 1.0 3.5 5.5 218 166 A 1 ASN HA A 4 THR H 1.0 3.5 5.5 219 167 A 2 VAL HA A 5 PHE H 1.0 3.5 5.5 220 168 A 3 HIS HA A 6 ARG H 1.0 3.5 5.5 221 169 A 4 THR HA A 7 GLY H 1.0 3.5 5.5 222 170 A 5 PHE HA A 8 ASP H 1.0 3.5 5.5 223 171 A 6 ARG HA A 9 ASN H 1.0 3.5 5.5 224 172 A 10 VAL H A 7 GLY HAx 1.0 3.5 4.5 225 172 A 7 GLY HAy A 10 VAL H 1.0 3.5 4.5 226 173 A 8 ASP HA A 11 HIS H 1.0 3.5 5.5 227 174 A 9 ASN HA A 12 ASN H 1.0 3.5 5.5 228 175 A 10 VAL HA A 13 SER H 1.0 3.5 4.5 229 176 A 11 HIS HA A 14 SER H 1.0 3.5 5.5 230 177 A 12 ASN HA A 15 SER H 1.0 3.5 4.5 231 178 A 13 SER HA A 16 SER H 1.0 3.5 4.5 232 179 A 14 SER HA A 17 LEU H 1.0 3.5 4.5 233 180 A 3 HIS HA A 7 GLY H 1.0 3.5 5.5 234 181 A 4 THR HA A 8 ASP H 1.0 3.5 4.5 235 182 A 8 ASP HA A 12 ASN H 1.0 3.5 4.5 236 183 A 9 ASN HA A 13 SER H 1.0 3.5 4.5 237 184 A 10 VAL HA A 14 SER H 1.0 3.5 4.5 238 185 A 11 HIS HA A 15 SER H 1.0 3.5 4.5 239 186 A 5 PHE HA A 2 VAL HB 1.0 3.5 6.5 240 187 A 8 ASP HA A 5 PHE HBx 1.0 3.5 6.5 241 187 A 8 ASP HA A 5 PHE HBy 1.0 3.5 6.5 242 188 A 11 HIS HA A 8 ASP HBx 1.0 3.5 6.5 243 188 A 11 HIS HA A 8 ASP HBy 1.0 3.5 6.5 244 189 A 13 SER HA A 10 VAL HB 1.0 3.5 6.5 245 190 A 15 SER HA A 12 ASN HBx 1.0 3.5 6.5 246 190 A 15 SER HA A 12 ASN HBy 1.0 3.5 6.5 stop_ save_ save_Discover_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode Discover_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _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 14 SER H A 10 VAL O 1.0 1.8 2.5 2 2 A 17 LEU H A 13 SER O 1.0 1.8 2.5 stop_ save_ save_Discover_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode Discover_dihedral_5 _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 ASN CA A 1 ASN C A 2 VAL N A 2 VAL CA 1.0 178.0 180.0 OMEGA 2 2 A 2 VAL CA A 2 VAL C A 3 HIS N A 3 HIS CA 1.0 178.0 180.0 OMEGA 3 3 A 3 HIS CA A 3 HIS C A 4 THR N A 4 THR CA 1.0 178.0 180.0 OMEGA 4 4 A 4 THR CA A 4 THR C A 5 PHE N A 5 PHE CA 1.0 178.0 180.0 OMEGA 5 5 A 5 PHE CA A 5 PHE C A 6 ARG N A 6 ARG CA 1.0 178.0 180.0 OMEGA 6 6 A 6 ARG CA A 6 ARG C A 7 GLY N A 7 GLY CA 1.0 178.0 180.0 OMEGA 7 7 A 7 GLY CA A 7 GLY C A 8 ASP N A 8 ASP CA 1.0 178.0 180.0 OMEGA 8 8 A 8 ASP CA A 8 ASP C A 9 ASN N A 9 ASN CA 1.0 178.0 180.0 OMEGA 9 9 A 9 ASN CA A 9 ASN C A 10 VAL N A 10 VAL CA 1.0 178.0 180.0 OMEGA 10 10 A 10 VAL CA A 10 VAL C A 11 HIS N A 11 HIS CA 1.0 178.0 180.0 OMEGA 11 11 A 11 HIS CA A 11 HIS C A 12 ASN N A 12 ASN CA 1.0 178.0 180.0 OMEGA 12 12 A 12 ASN CA A 12 ASN C A 13 SER N A 13 SER CA 1.0 178.0 180.0 OMEGA 13 13 A 13 SER CA A 13 SER C A 14 SER N A 14 SER CA 1.0 178.0 180.0 OMEGA 14 14 A 14 SER CA A 14 SER C A 15 SER N A 15 SER CA 1.0 178.0 180.0 OMEGA 15 15 A 15 SER CA A 15 SER C A 16 SER N A 16 SER CA 1.0 178.0 180.0 OMEGA 16 16 A 16 SER CA A 16 SER C A 17 LEU N A 17 LEU CA 1.0 178.0 180.0 OMEGA stop_ save_