data_nef_c36150_5z32 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 BMRB 36149 PDB 5Z32 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 VAL start . . 2 A 2 ALA middle . . 3 A 3 ARG middle . . 4 A 4 GLY middle . false 5 A 5 TRP middle . . 6 A 6 GLY middle . false 7 A 7 ARG middle . . 8 A 8 LYS middle . . 9 A 9 CYS middle . . 10 A 10 PRO middle . false 11 A 11 LEU middle . . 12 A 12 PHE middle . . 13 A 13 GLY middle . false 14 A 14 LYS middle . . 15 A 15 ASN middle . . 16 A 16 LYS middle . . 17 A 17 SER middle . . 18 A 18 ARG 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 2 ALA H H 1 8.664 0.006 A 2 ALA HA H 1 4.390 0.002 A 2 ALA HB% H 1 1.385 0.004 A 3 ARG H H 1 8.511 0.015 A 3 ARG HA H 1 4.255 0.002 A 3 ARG HBx H 1 1.743 0.000 A 3 ARG HBy H 1 1.743 0.000 A 3 ARG HDx H 1 3.158 0.000 A 3 ARG HDy H 1 3.158 0.000 A 3 ARG HGx H 1 1.601 0.000 A 3 ARG HGy H 1 1.601 0.000 A 4 GLY H H 1 8.457 0.016 A 4 GLY HAx H 1 3.908 0.000 A 4 GLY HAy H 1 3.908 0.000 A 5 TRP H H 1 8.103 0.015 A 5 TRP HA H 1 4.661 0.001 A 5 TRP HB2 H 1 3.349 0.001 A 5 TRP HB3 H 1 3.256 0.000 A 5 TRP HE3 H 1 7.628 0.000 A 5 TRP HH2 H 1 7.259 0.004 A 5 TRP HZ3 H 1 7.195 0.001 A 6 GLY H H 1 8.342 0.013 A 6 GLY HAx H 1 3.824 0.000 A 6 GLY HAy H 1 3.824 0.000 A 7 ARG H H 1 8.098 0.012 A 7 ARG HA H 1 4.270 0.001 A 7 ARG HB2 H 1 1.829 0.000 A 7 ARG HB3 H 1 1.716 0.001 A 7 ARG HGx H 1 1.598 0.001 A 7 ARG HGy H 1 1.598 0.001 A 8 LYS H H 1 8.453 0.014 A 8 LYS HA H 1 4.334 0.000 A 8 LYS HB2 H 1 1.821 0.000 A 8 LYS HB3 H 1 1.743 0.000 A 8 LYS HGx H 1 1.433 0.000 A 8 LYS HGy H 1 1.433 0.000 A 9 CYS H H 1 8.381 0.013 A 9 CYS HA H 1 4.747 0.001 A 9 CYS HBx H 1 2.878 0.000 A 9 CYS HBy H 1 2.878 0.000 A 10 PRO HA H 1 4.364 0.000 A 10 PRO HB2 H 1 2.204 0.117 A 10 PRO HB3 H 1 1.970 0.117 A 10 PRO HDx H 1 3.719 0.000 A 10 PRO HDy H 1 3.719 0.000 A 11 LEU H H 1 8.175 0.016 A 11 LEU HA H 1 4.267 0.002 A 11 LEU HBx H 1 1.529 0.007 A 11 LEU HBy H 1 1.529 0.007 A 11 LEU HDx% H 1 0.857 0.014 A 11 LEU HDy% H 1 0.857 0.014 A 11 LEU HG H 1 1.439 0.001 A 12 PHE H H 1 8.165 0.014 A 12 PHE HA H 1 4.640 0.003 A 12 PHE HB2 H 1 3.167 0.002 A 12 PHE HB3 H 1 3.040 0.002 A 12 PHE HE1 H 1 7.356 0.001 A 12 PHE HE2 H 1 7.356 0.001 A 12 PHE HZ H 1 7.310 0.000 A 13 GLY H H 1 8.361 0.010 A 13 GLY HAx H 1 3.908 0.001 A 13 GLY HAy H 1 3.908 0.001 A 14 LYS H H 1 8.232 0.020 A 14 LYS HA H 1 4.312 0.000 A 14 LYS HB2 H 1 1.843 0.000 A 14 LYS HB3 H 1 1.751 0.000 A 14 LYS HGx H 1 1.434 0.000 A 14 LYS HGy H 1 1.434 0.000 A 15 ASN H H 1 8.508 0.010 A 15 ASN HA H 1 4.683 0.000 A 15 ASN HB2 H 1 2.851 0.001 A 15 ASN HB3 H 1 2.776 0.002 A 16 LYS H H 1 8.321 0.014 A 16 LYS HA H 1 4.359 0.000 A 16 LYS HB2 H 1 1.875 0.000 A 16 LYS HB3 H 1 1.763 0.000 A 16 LYS HGx H 1 1.437 0.000 A 16 LYS HGy H 1 1.437 0.000 A 17 SER H H 1 8.404 0.009 A 17 SER HA H 1 4.439 0.000 A 17 SER HBx H 1 3.889 0.000 A 17 SER HBy H 1 3.889 0.000 A 18 ARG H H 1 7.995 0.017 A 18 ARG HA H 1 4.177 0.000 A 18 ARG HB2 H 1 1.860 0.000 A 18 ARG HB3 H 1 1.738 0.000 A 18 ARG HGx H 1 1.621 0.000 A 18 ARG HGy H 1 1.621 0.000 stop_ save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _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 1 VAL HA A 2 ALA H 1.0 . 3.3 2 2 A 2 ALA H A 2 ALA HB% 1.0 . 3.5 3 3 A 2 ALA HA A 3 ARG H 1.0 . 4.0 4 4 A 2 ALA HB% A 3 ARG H 1.0 . 4.5 5 5 A 2 ALA HB% A 4 GLY H 1.0 . 4.5 6 6 A 3 ARG H A 3 ARG HBx 1.0 . 3.6 7 6 A 3 ARG H A 3 ARG HBy 1.0 . 3.6 8 7 A 3 ARG H A 3 ARG HGx 1.0 . 3.9 9 7 A 3 ARG H A 3 ARG HGy 1.0 . 3.9 10 8 A 3 ARG H A 3 ARG HDx 1.0 . 4.2 11 8 A 3 ARG H A 3 ARG HDy 1.0 . 4.2 12 9 A 4 GLY H A 3 ARG HA 1.0 . 3.6 13 10 A 4 GLY H A 3 ARG HBx 1.0 . 3.8 14 10 A 4 GLY H A 3 ARG HBy 1.0 . 3.8 15 11 A 4 GLY H A 3 ARG HGx 1.0 . 4.2 16 11 A 4 GLY H A 3 ARG HGy 1.0 . 4.2 17 12 A 4 GLY H A 3 ARG HDx 1.0 . 4.5 18 12 A 4 GLY H A 3 ARG HDy 1.0 . 4.5 19 13 A 5 TRP H A 4 GLY HAx 1.0 . 4.0 20 13 A 4 GLY HAy A 5 TRP H 1.0 . 4.0 21 14 A 5 TRP H A 5 TRP HB2 1.0 . 3.5 22 15 A 5 TRP H A 5 TRP HB3 1.0 . 3.5 23 16 A 5 TRP HA A 6 GLY H 1.0 . 3.8 24 17 A 5 TRP HB2 A 6 GLY H 1.0 . 3.9 25 18 A 5 TRP HB3 A 6 GLY H 1.0 . 4.0 26 19 A 5 TRP HA A 8 LYS H 1.0 . 5.0 27 20 A 7 ARG H A 6 GLY HAx 1.0 . 3.5 28 20 A 6 GLY HAy A 7 ARG H 1.0 . 3.5 29 21 A 8 LYS H A 6 GLY HAx 1.0 . 4.8 30 21 A 8 LYS H A 6 GLY HAy 1.0 . 4.8 31 22 A 7 ARG H A 7 ARG HB2 1.0 . 3.5 32 23 A 7 ARG H A 7 ARG HB3 1.0 . 3.6 33 24 A 7 ARG H A 7 ARG HGx 1.0 . 3.9 34 24 A 7 ARG H A 7 ARG HGy 1.0 . 3.9 35 25 A 8 LYS H A 7 ARG HA 1.0 . 3.6 36 26 A 8 LYS H A 7 ARG HB3 1.0 . 3.8 37 26 A 8 LYS H A 7 ARG HB2 1.0 . 3.8 38 27 A 8 LYS H A 7 ARG HGx 1.0 . 4.2 39 27 A 8 LYS H A 7 ARG HGy 1.0 . 4.2 40 28 A 8 LYS H A 8 LYS HB2 1.0 . 3.5 41 29 A 8 LYS H A 8 LYS HB3 1.0 . 3.5 42 30 A 8 LYS H A 8 LYS HGx 1.0 . 3.8 43 30 A 8 LYS H A 8 LYS HGy 1.0 . 3.8 44 31 A 8 LYS HA A 9 CYS H 1.0 . 3.6 45 32 A 8 LYS HB2 A 9 CYS H 1.0 . 3.8 46 33 A 8 LYS HB3 A 9 CYS H 1.0 . 3.9 47 34 A 9 CYS H A 8 LYS HGx 1.0 . 4.2 48 34 A 8 LYS HGy A 9 CYS H 1.0 . 4.2 49 35 A 9 CYS H A 9 CYS HBx 1.0 . 3.5 50 35 A 9 CYS H A 9 CYS HBy 1.0 . 3.5 51 36 A 9 CYS HA A 11 LEU H 1.0 . 4.8 52 37 A 11 LEU H A 10 PRO HA 1.0 . 3.6 53 38 A 11 LEU H A 10 PRO HB2 1.0 . 3.7 54 39 A 11 LEU H A 10 PRO HB3 1.0 . 3.8 55 40 A 11 LEU H A 10 PRO HDx 1.0 . 4.2 56 40 A 11 LEU H A 10 PRO HDy 1.0 . 4.2 57 41 A 11 LEU H A 11 LEU HBx 1.0 . 3.5 58 41 A 11 LEU H A 11 LEU HBy 1.0 . 3.5 59 42 A 11 LEU H A 11 LEU HG 1.0 . 3.8 60 43 A 11 LEU H A 11 LEU HDx% 1.0 . 4.2 61 43 A 11 LEU H A 11 LEU HDy% 1.0 . 4.2 62 44 A 11 LEU HA A 12 PHE H 1.0 . 3.3 63 45 A 12 PHE H A 11 LEU HBx 1.0 . 3.6 64 45 A 11 LEU HBy A 12 PHE H 1.0 . 3.6 65 46 A 11 LEU HG A 12 PHE H 1.0 . 4.1 66 47 A 12 PHE H A 11 LEU HDx% 1.0 . 4.5 67 47 A 11 LEU HDy% A 12 PHE H 1.0 . 4.5 68 48 A 12 PHE H A 12 PHE HB2 1.0 . 3.6 69 49 A 12 PHE H A 12 PHE HB3 1.0 . 3.7 70 50 A 12 PHE HA A 13 GLY H 1.0 . 3.6 71 51 A 12 PHE HB2 A 13 GLY H 1.0 . 3.7 72 52 A 12 PHE HB3 A 13 GLY H 1.0 . 3.8 73 53 A 12 PHE HA A 14 LYS H 1.0 . 4.5 74 54 A 14 LYS H A 13 GLY HAx 1.0 . 3.6 75 54 A 14 LYS H A 13 GLY HAy 1.0 . 3.6 76 55 A 15 ASN H A 13 GLY HAx 1.0 . 4.5 77 55 A 13 GLY HAy A 15 ASN H 1.0 . 4.5 78 56 A 14 LYS H A 14 LYS HB2 1.0 . 3.6 79 57 A 14 LYS H A 14 LYS HB3 1.0 . 3.7 80 58 A 14 LYS H A 14 LYS HGx 1.0 . 4.0 81 58 A 14 LYS H A 14 LYS HGy 1.0 . 4.0 82 59 A 15 ASN H A 14 LYS HA 1.0 . 3.5 83 60 A 15 ASN H A 14 LYS HB2 1.0 . 3.7 84 61 A 15 ASN H A 15 ASN HB2 1.0 . 3.6 85 62 A 15 ASN H A 15 ASN HB3 1.0 . 3.7 86 63 A 15 ASN HA A 16 LYS H 1.0 . 3.6 87 64 A 16 LYS H A 15 ASN HB2 1.0 . 3.7 88 65 A 16 LYS H A 15 ASN HB3 1.0 . 3.8 89 66 A 16 LYS H A 16 LYS HB2 1.0 . 3.6 90 67 A 16 LYS H A 16 LYS HB3 1.0 . 3.7 91 68 A 16 LYS H A 16 LYS HGx 1.0 . 4.0 92 68 A 16 LYS H A 16 LYS HGy 1.0 . 4.0 93 69 A 16 LYS HA A 17 SER H 1.0 . 3.6 94 70 A 16 LYS HB2 A 17 SER H 1.0 . 3.7 95 71 A 16 LYS HB3 A 17 SER H 1.0 . 3.8 96 72 A 17 SER H A 16 LYS HGx 1.0 . 4.0 97 72 A 16 LYS HGy A 17 SER H 1.0 . 4.0 98 73 A 17 SER H A 17 SER HBx 1.0 . 3.6 99 73 A 17 SER H A 17 SER HBy 1.0 . 3.6 100 74 A 17 SER HA A 18 ARG H 1.0 . 3.6 101 75 A 18 ARG H A 17 SER HBx 1.0 . 3.7 102 75 A 17 SER HBy A 18 ARG H 1.0 . 3.7 103 76 A 18 ARG H A 18 ARG HB2 1.0 . 3.6 104 77 A 18 ARG H A 18 ARG HB3 1.0 . 3.7 105 78 A 18 ARG H A 18 ARG HGx 1.0 . 4.0 106 78 A 18 ARG H A 18 ARG HGy 1.0 . 4.0 107 79 A 2 ALA H A 3 ARG H 1.0 . 3.5 108 80 A 2 ALA H A 4 GLY H 1.0 . 3.5 109 81 A 4 GLY H A 5 TRP H 1.0 . 3.5 110 82 A 5 TRP H A 6 GLY H 1.0 . 3.5 111 83 A 6 GLY H A 7 ARG H 1.0 . 3.5 112 84 A 8 LYS H A 7 ARG H 1.0 . 3.5 113 85 A 8 LYS H A 9 CYS H 1.0 . 3.5 114 86 A 12 PHE H A 13 GLY H 1.0 . 3.5 115 87 A 13 GLY H A 14 LYS H 1.0 . 3.5 116 88 A 14 LYS H A 15 ASN H 1.0 . 3.5 117 89 A 15 ASN H A 16 LYS H 1.0 . 3.5 118 90 A 16 LYS H A 17 SER H 1.0 . 3.5 119 91 A 17 SER H A 18 ARG H 1.0 . 3.5 120 92 A 2 ALA HB% A 5 TRP HE3 1.0 . 5.0 121 93 A 5 TRP HE3 A 14 LYS HB3 1.0 . 5.0 122 93 A 5 TRP HE3 A 14 LYS HB2 1.0 . 5.0 123 94 A 5 TRP HE3 A 15 ASN HB3 1.0 . 5.0 124 94 A 5 TRP HE3 A 15 ASN HB2 1.0 . 5.0 125 95 A 5 TRP HB3 A 5 TRP HE3 1.0 . 4.3 126 96 A 5 TRP HB2 A 5 TRP HE3 1.0 . 4.0 127 97 A 5 TRP HE3 A 6 GLY HAx 1.0 . 5.0 128 97 A 6 GLY HAy A 5 TRP HE3 1.0 . 5.0 129 98 A 5 TRP HA A 5 TRP HE3 1.0 . 4.0 130 99 A 5 TRP HE3 A 13 GLY HAx 1.0 . 5.0 131 99 A 13 GLY HAy A 5 TRP HE3 1.0 . 5.0 132 100 A 12 PHE HE% A 11 LEU HDx% 1.0 . 4.5 133 100 A 11 LEU HDy% A 12 PHE HE% 1.0 . 4.5 134 101 A 12 PHE HB3 A 12 PHE HE% 1.0 . 4.0 135 102 A 12 PHE HB2 A 12 PHE HE% 1.0 . 4.3 136 103 A 12 PHE HE% A 17 SER HBx 1.0 . 5.0 137 103 A 17 SER HBy A 12 PHE HE% 1.0 . 5.0 138 104 A 12 PHE HA A 12 PHE HE% 1.0 . 4.0 139 105 A 12 PHE HB3 A 5 TRP HH2 1.0 . 5.0 140 106 A 12 PHE HB2 A 5 TRP HH2 1.0 . 5.2 141 107 A 12 PHE HA A 5 TRP HH2 1.0 . 5.0 142 108 A 12 PHE HZ A 11 LEU HDx% 1.0 . 4.5 143 108 A 11 LEU HDy% A 12 PHE HZ 1.0 . 4.5 144 109 A 5 TRP HH2 A 13 GLY HAx 1.0 . 5.0 145 109 A 13 GLY HAy A 5 TRP HH2 1.0 . 5.0 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 VAL C A 2 ALA N A 2 ALA CA A 2 ALA C 1.0 -120.0 -30.0 PHI 2 2 A 2 ALA N A 2 ALA CA A 2 ALA C A 3 ARG N 1.0 -120.0 120.0 PSI 3 3 A 2 ALA C A 3 ARG N A 3 ARG CA A 3 ARG C 1.0 -120.0 -30.0 PHI 4 4 A 3 ARG N A 3 ARG CA A 3 ARG C A 4 GLY N 1.0 -120.0 120.0 PSI 5 5 A 3 ARG C A 4 GLY N A 4 GLY CA A 4 GLY C 1.0 -120.0 -30.0 PHI 6 6 A 4 GLY N A 4 GLY CA A 4 GLY C A 5 TRP N 1.0 -120.0 120.0 PSI 7 7 A 4 GLY C A 5 TRP N A 5 TRP CA A 5 TRP C 1.0 -120.0 -30.0 PHI 8 8 A 5 TRP N A 5 TRP CA A 5 TRP C A 6 GLY N 1.0 -120.0 120.0 PSI 9 9 A 5 TRP C A 6 GLY N A 6 GLY CA A 6 GLY C 1.0 -120.0 -30.0 PHI 10 10 A 6 GLY N A 6 GLY CA A 6 GLY C A 7 ARG N 1.0 -120.0 120.0 PSI 11 11 A 6 GLY C A 7 ARG N A 7 ARG CA A 7 ARG C 1.0 -120.0 -30.0 PHI 12 12 A 7 ARG N A 7 ARG CA A 7 ARG C A 8 LYS N 1.0 -120.0 120.0 PSI 13 13 A 7 ARG C A 8 LYS N A 8 LYS CA A 8 LYS C 1.0 -120.0 -30.0 PHI 14 14 A 8 LYS N A 8 LYS CA A 8 LYS C A 9 CYS N 1.0 -120.0 120.0 PSI 15 15 A 8 LYS C A 9 CYS N A 9 CYS CA A 9 CYS C 1.0 -120.0 -30.0 PHI 16 16 A 9 CYS N A 9 CYS CA A 9 CYS C A 10 PRO N 1.0 -120.0 120.0 PSI 17 17 A 10 PRO C A 11 LEU N A 11 LEU CA A 11 LEU C 1.0 -120.0 -30.0 PHI 18 18 A 11 LEU N A 11 LEU CA A 11 LEU C A 12 PHE N 1.0 -120.0 120.0 PSI 19 19 A 11 LEU C A 12 PHE N A 12 PHE CA A 12 PHE C 1.0 -120.0 -30.0 PHI 20 20 A 12 PHE N A 12 PHE CA A 12 PHE C A 13 GLY N 1.0 -120.0 120.0 PSI 21 21 A 12 PHE C A 13 GLY N A 13 GLY CA A 13 GLY C 1.0 -120.0 -30.0 PHI 22 22 A 13 GLY N A 13 GLY CA A 13 GLY C A 14 LYS N 1.0 -120.0 120.0 PSI 23 23 A 13 GLY C A 14 LYS N A 14 LYS CA A 14 LYS C 1.0 -120.0 -30.0 PHI 24 24 A 14 LYS N A 14 LYS CA A 14 LYS C A 15 ASN N 1.0 -120.0 120.0 PSI 25 25 A 14 LYS C A 15 ASN N A 15 ASN CA A 15 ASN C 1.0 -120.0 -30.0 PHI 26 26 A 15 ASN N A 15 ASN CA A 15 ASN C A 16 LYS N 1.0 -120.0 120.0 PSI 27 27 A 15 ASN C A 16 LYS N A 16 LYS CA A 16 LYS C 1.0 -120.0 -30.0 PHI 28 28 A 16 LYS N A 16 LYS CA A 16 LYS C A 17 SER N 1.0 -120.0 120.0 PSI 29 29 A 16 LYS C A 17 SER N A 17 SER CA A 17 SER C 1.0 -120.0 -30.0 PHI 30 30 A 17 SER N A 17 SER CA A 17 SER C A 18 ARG N 1.0 -120.0 120.0 PSI stop_ save_