data_nef_c25813_2n7n 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 BMRB 25814 BMRB 25820 PDB 2N7N stop_ 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 NLE N 1 2 NLE C 1 3 ASP N 1 5 PRO C 1 6 DPN N 1 6 DPN C 1 7 ARG N 1 9 LYS C 1 10 NH2 N 1 3 ASP CG 1 9 LYS NZ 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 3 ACE start . . 2 A 4 NLE middle . . 3 A 5 ASP middle . . 4 A 6 PRO middle . false 5 A 7 PRO middle . true 6 A 8 DPN middle . . 7 A 9 ARG middle . . 8 A 10 TRP middle . . 9 A 11 LYS middle . . 10 A 12 NH2 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 3 ACE H% H 1 1.862 0.000 A 4 NLE H H 1 7.876 0.000 A 4 NLE HA H 1 5.030 0.000 A 4 NLE HBx H 1 1.482 0.000 A 4 NLE HBy H 1 1.540 0.000 A 4 NLE HDx H 1 0.816 0.000 A 4 NLE HDy H 1 0.816 0.000 A 4 NLE HE% H 1 0.491 0.001 A 4 NLE HGx H 1 1.140 0.004 A 4 NLE HGy H 1 1.140 0.004 A 5 ASP H H 1 8.826 0.000 A 5 ASP HA H 1 5.506 0.000 A 5 ASP HBx H 1 2.414 0.000 A 5 ASP HBy H 1 2.775 0.001 A 6 PRO HA H 1 4.098 0.000 A 6 PRO HBx H 1 1.984 0.000 A 6 PRO HBy H 1 2.234 0.000 A 6 PRO HDx H 1 3.819 0.000 A 6 PRO HDy H 1 3.981 0.000 A 6 PRO HGx H 1 1.870 0.001 A 6 PRO HGy H 1 2.009 0.000 A 7 PRO HA H 1 4.329 0.000 A 7 PRO HBx H 1 2.034 0.001 A 7 PRO HBy H 1 2.426 0.000 A 7 PRO HDx H 1 3.262 0.000 A 7 PRO HDy H 1 3.485 0.000 A 7 PRO HGx H 1 1.536 0.000 A 7 PRO HGy H 1 1.970 0.001 A 8 DPN H H 1 8.716 0.000 A 8 DPN HA H 1 4.731 0.000 A 8 DPN HBx H 1 2.776 0.000 A 8 DPN HBy H 1 2.858 0.000 A 8 DPN HDx H 1 6.937 0.000 A 8 DPN HDy H 1 6.937 0.000 A 8 DPN HEx H 1 6.978 0.000 A 8 DPN HEy H 1 6.978 0.000 A 9 ARG H H 1 8.506 0.000 A 9 ARG HA H 1 4.723 0.000 A 9 ARG HBx H 1 1.677 0.000 A 9 ARG HBy H 1 1.874 0.000 A 9 ARG HDx H 1 3.242 0.000 A 9 ARG HDy H 1 3.242 0.000 A 9 ARG HE H 1 7.352 0.000 A 9 ARG HGx H 1 1.464 0.000 A 9 ARG HGy H 1 1.559 0.000 A 10 TRP H H 1 9.085 0.000 A 10 TRP HA H 1 5.187 0.000 A 10 TRP HBx H 1 3.122 0.000 A 10 TRP HBy H 1 3.381 0.000 A 10 TRP HD1 H 1 7.256 0.000 A 10 TRP HE1 H 1 10.678 0.000 A 10 TRP HE3 H 1 7.661 0.000 A 10 TRP HH2 H 1 7.051 0.000 A 10 TRP HZ2 H 1 7.467 0.000 A 10 TRP HZ3 H 1 6.933 0.000 A 11 LYS H H 1 8.679 0.000 A 11 LYS HA H 1 4.111 0.000 A 11 LYS HBx H 1 1.495 0.000 A 11 LYS HBy H 1 1.685 0.000 A 11 LYS HDx H 1 1.469 0.000 A 11 LYS HDy H 1 1.469 0.000 A 11 LYS HEx H 1 2.966 0.000 A 11 LYS HEy H 1 3.387 0.000 A 11 LYS HGx H 1 1.151 0.000 A 11 LYS HGy H 1 1.260 0.000 A 11 LYS HZ1 H 1 7.914 0.000 A 11 LYS HZ2 H 1 7.914 0.000 A 11 LYS HZ3 H 1 7.914 0.000 A 12 NH2 HNx H 1 6.201 0.000 A 12 NH2 HNy H 1 7.089 0.001 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 5 ASP H A 4 NLE HA 1.0 . 2.62 2 2 A 4 NLE HA A 10 TRP HA 1.0 . 3.17 3 3 A 4 NLE HA A 10 TRP HE3 1.0 . 4.38 4 4 A 11 LYS H A 4 NLE HA 1.0 . 3.45 5 5 A 4 NLE HBx A 5 ASP H 1.0 . 3.73 6 6 A 4 NLE HBy A 5 ASP H 1.0 . 3.73 7 7 A 5 ASP H A 5 ASP HBx 1.0 . 3.39 8 8 A 5 ASP H A 5 ASP HBy 1.0 . 3.39 9 9 A 5 ASP H A 5 ASP HBy 1.0 . 2.89 10 9 A 5 ASP H A 5 ASP HBx 1.0 . 2.89 11 10 A 11 LYS H A 5 ASP H 1.0 . 4.23 12 11 A 5 ASP H A 11 LYS HZ% 1.0 . 4.97 13 12 A 5 ASP HA A 6 PRO HDx 1.0 . 3.39 14 13 A 5 ASP HA A 6 PRO HDy 1.0 . 3.39 15 14 A 5 ASP HA A 6 PRO HDy 1.0 . 2.93 16 14 A 5 ASP HA A 6 PRO HDx 1.0 . 2.93 17 15 A 11 LYS HZ% A 5 ASP HA 1.0 . 5.13 18 16 A 5 ASP HBx A 11 LYS HZ% 1.0 . 3.70 19 17 A 11 LYS HZ% A 5 ASP HBy 1.0 . 3.70 20 18 A 5 ASP HBy A 6 PRO HDy 1.0 . 3.79 21 18 A 5 ASP HBx A 6 PRO HDy 1.0 . 3.79 22 18 A 6 PRO HDx A 5 ASP HBy 1.0 . 3.79 23 18 A 5 ASP HBx A 6 PRO HDx 1.0 . 3.79 24 19 A 11 LYS HZ% A 5 ASP HBy 1.0 . 3.00 25 19 A 5 ASP HBx A 11 LYS HZ% 1.0 . 3.00 26 20 A 6 PRO HA A 7 PRO HA 1.0 . 2.49 27 21 A 6 PRO HA A 9 ARG H 1.0 . 4.17 28 22 A 9 ARG H A 9 ARG HBx 1.0 . 3.58 29 23 A 9 ARG H A 9 ARG HBy 1.0 . 3.58 30 24 A 9 ARG H A 9 ARG HBy 1.0 . 3.01 31 24 A 9 ARG H A 9 ARG HBx 1.0 . 3.01 32 25 A 9 ARG H A 9 ARG HGx 1.0 . 4.88 33 26 A 9 ARG H A 9 ARG HGy 1.0 . 4.88 34 27 A 9 ARG H A 10 TRP H 1.0 . 4.32 35 28 A 10 TRP H A 9 ARG HA 1.0 . 2.62 36 29 A 9 ARG HBx A 10 TRP H 1.0 . 3.95 37 30 A 10 TRP H A 9 ARG HBy 1.0 . 3.95 38 31 A 10 TRP H A 9 ARG HBy 1.0 . 3.23 39 31 A 9 ARG HBx A 10 TRP H 1.0 . 3.23 40 32 A 10 TRP H A 10 TRP HBx 1.0 . 3.08 41 33 A 10 TRP H A 10 TRP HBy 1.0 . 3.08 42 34 A 10 TRP H A 10 TRP HD1 1.0 . 4.32 43 35 A 10 TRP HE3 A 10 TRP H 1.0 . 5.50 44 36 A 11 LYS H A 10 TRP H 1.0 . 4.35 45 37 A 10 TRP HA A 10 TRP HD1 1.0 . 4.85 46 38 A 10 TRP HA A 10 TRP HE3 1.0 . 2.93 47 39 A 11 LYS H A 10 TRP HA 1.0 . 2.65 48 40 A 10 TRP HD1 A 10 TRP HBx 1.0 . 3.52 49 41 A 10 TRP HE3 A 10 TRP HBx 1.0 . 4.01 50 42 A 11 LYS H A 10 TRP HBx 1.0 . 4.11 51 43 A 10 TRP HD1 A 10 TRP HBy 1.0 . 3.52 52 44 A 10 TRP HE3 A 10 TRP HBy 1.0 . 4.01 53 45 A 11 LYS H A 10 TRP HBy 1.0 . 4.11 54 46 A 10 TRP HE3 A 10 TRP HBy 1.0 . 3.46 55 46 A 10 TRP HE3 A 10 TRP HBx 1.0 . 3.46 56 47 A 11 LYS H A 10 TRP HBy 1.0 . 3.54 57 47 A 11 LYS H A 10 TRP HBx 1.0 . 3.54 58 48 A 11 LYS H A 10 TRP HD1 1.0 . 5.50 59 49 A 11 LYS H A 10 TRP HE3 1.0 . 4.11 60 50 A 11 LYS H A 11 LYS HBx 1.0 . 3.52 61 51 A 11 LYS H A 11 LYS HBy 1.0 . 3.52 62 52 A 11 LYS H A 11 LYS HBy 1.0 . 2.99 63 52 A 11 LYS H A 11 LYS HBx 1.0 . 2.99 64 53 A 11 LYS H A 11 LYS HGx 1.0 . 4.32 65 54 A 11 LYS H A 11 LYS HGy 1.0 . 4.32 66 55 A 11 LYS H A 11 LYS HGx 1.0 . 3.73 67 55 A 11 LYS H A 11 LYS HGy 1.0 . 3.73 68 56 A 11 LYS H A 11 LYS HDx 1.0 . 6.00 69 56 A 11 LYS H A 11 LYS HDy 1.0 . 6.00 70 57 A 11 LYS HA A 11 LYS HGx 1.0 . 3.66 71 57 A 11 LYS HGy A 11 LYS HA 1.0 . 3.66 72 58 A 11 LYS HA A 11 LYS HDx 1.0 . 5.07 73 58 A 11 LYS HDy A 11 LYS HA 1.0 . 5.07 74 59 A 11 LYS HBy A 11 LYS HGx 1.0 . 2.29 75 59 A 11 LYS HBx A 11 LYS HGx 1.0 . 2.29 76 59 A 11 LYS HGy A 11 LYS HBy 1.0 . 2.29 77 59 A 11 LYS HBx A 11 LYS HGy 1.0 . 2.29 78 60 A 11 LYS HZ% A 11 LYS HGx 1.0 . 4.66 79 61 A 11 LYS HZ% A 11 LYS HGy 1.0 . 4.66 80 62 A 11 LYS HZ% A 11 LYS HGx 1.0 . 4.08 81 62 A 11 LYS HZ% A 11 LYS HGy 1.0 . 4.08 stop_ save_