data_nef_c19503_2mdu 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 19504 BMRB 19505 PDB 1pin PDB 2kcf 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 ARG start . . 2 A 2 TRP middle . . 3 A 3 PHE middle . . 4 A 4 TYR middle . . 5 A 5 PHE middle . . 6 A 6 ASN middle . . 7 A 7 ARG middle . . 8 A 8 ILE middle . . 9 A 9 THR middle . . 10 A 10 GLY middle . false 11 A 11 LYS middle . . 12 A 12 ARG middle . . 13 A 13 GLN middle . . 14 A 14 PHE middle . . 15 A 15 GLU middle . . 16 A 16 ARG middle . . 17 A 17 PRO middle . false 18 A 18 LYS middle . . 19 A 19 GLY middle . false 20 A 20 LEU middle . . 21 A 21 VAL middle . . 22 A 22 LYS middle . . 23 A 23 GLY middle . false 24 A 24 TRP middle . . 25 A 25 GLU middle . . 26 A 26 LYS middle . . 27 A 27 ARG middle . . 28 A 28 TRP middle . . 29 A 29 ASP 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 ARG HA H 1 3.572 0.01 A 1 ARG HB2 H 1 1.860 0.01 A 1 ARG HB3 H 1 1.860 0.01 A 1 ARG HE H 1 7.403 0.01 A 1 ARG HGy H 1 1.745 0.01 A 1 ARG HGx H 1 1.610 0.01 A 2 TRP H H 1 8.666 0.02 A 2 TRP HA H 1 5.561 0.01 A 2 TRP HB2 H 1 3.154 0.01 A 2 TRP HB3 H 1 2.859 0.01 A 2 TRP HD1 H 1 7.535 0.01 A 2 TRP HE1 H 1 10.44 0.01 A 2 TRP HE3 H 1 7.640 0.01 A 2 TRP HH2 H 1 7.181 0.01 A 2 TRP HZ2 H 1 7.420 0.01 A 2 TRP HZ3 H 1 7.042 0.01 A 3 PHE H H 1 9.545 0.02 A 3 PHE HA H 1 4.970 0.01 A 3 PHE HB2 H 1 3.047 0.01 A 3 PHE HB3 H 1 2.727 0.01 A 3 PHE HDx H 1 7.055 0.01 A 3 PHE HDy H 1 7.055 0.01 A 3 PHE HEx H 1 7.002 0.01 A 3 PHE HEy H 1 7.002 0.01 A 3 PHE HZ H 1 7.104 0.01 A 4 TYR H H 1 9.247 0.02 A 4 TYR HA H 1 5.351 0.01 A 4 TYR HB2 H 1 2.943 0.01 A 4 TYR HB3 H 1 2.677 0.01 A 4 TYR HDx H 1 6.844 0.01 A 4 TYR HDy H 1 6.844 0.01 A 4 TYR HEx H 1 6.743 0.01 A 4 TYR HEy H 1 6.743 0.01 A 5 PHE H H 1 9.728 0.02 A 5 PHE HA H 1 5.669 0.01 A 5 PHE HB2 H 1 3.069 0.01 A 5 PHE HB3 H 1 2.777 0.01 A 5 PHE HDx H 1 7.005 0.01 A 5 PHE HDy H 1 7.005 0.01 A 5 PHE HEx H 1 7.219 0.01 A 5 PHE HEy H 1 7.219 0.01 A 5 PHE HZ H 1 7.316 0.01 A 6 ASN H H 1 8.374 0.02 A 6 ASN HA H 1 4.326 0.01 A 6 ASN HB2 H 1 2.132 0.01 A 6 ASN HB3 H 1 -0.51 0.01 A 6 ASN HD21 H 1 3.771 0.01 A 6 ASN HD22 H 1 6.583 0.01 A 7 ARG H H 1 8.391 0.02 A 7 ARG HA H 1 3.846 0.01 A 7 ARG HB2 H 1 1.819 0.01 A 7 ARG HB3 H 1 1.822 0.01 A 7 ARG HDy H 1 3.337 0.01 A 7 ARG HDx H 1 3.203 0.01 A 7 ARG HE H 1 7.602 0.01 A 7 ARG HGy H 1 1.725 0.01 A 7 ARG HGx H 1 1.620 0.01 A 8 ILE H H 1 8.067 0.02 A 8 ILE HA H 1 3.835 0.01 A 8 ILE HB H 1 2.013 0.01 A 8 ILE HD1% H 1 0.766 0.01 A 8 ILE HG1y H 1 1.466 0.01 A 8 ILE HG1x H 1 1.079 0.01 A 8 ILE HG2% H 1 0.796 0.01 A 9 THR H H 1 7.709 0.02 A 9 THR HA H 1 4.174 0.01 A 9 THR HB H 1 4.223 0.01 A 9 THR HG2% H 1 1.013 0.01 A 10 GLY H H 1 8.311 0.02 A 10 GLY HA2 H 1 4.023 0.01 A 10 GLY HA3 H 1 3.535 0.01 A 11 LYS H H 1 7.005 0.02 A 11 LYS HA H 1 4.294 0.01 A 11 LYS HBy H 1 1.848 0.01 A 11 LYS HBx H 1 1.523 0.01 A 11 LYS HDx H 1 1.742 0.01 A 11 LYS HDy H 1 1.742 0.01 A 11 LYS HEx H 1 3.056 0.01 A 11 LYS HEy H 1 3.056 0.01 A 11 LYS HGy H 1 1.448 0.01 A 11 LYS HGx H 1 1.393 0.01 A 12 ARG H H 1 8.517 0.02 A 12 ARG HA H 1 6.152 0.01 A 12 ARG HB2 H 1 1.970 0.01 A 12 ARG HB3 H 1 1.856 0.01 A 12 ARG HDy H 1 2.876 0.01 A 12 ARG HDx H 1 2.856 0.01 A 12 ARG HE H 1 6.651 0.01 A 12 ARG HGy H 1 1.802 0.01 A 12 ARG HGx H 1 1.608 0.01 A 13 GLN H H 1 9.431 0.02 A 13 GLN HA H 1 4.842 0.01 A 13 GLN HB2 H 1 2.147 0.01 A 13 GLN HB3 H 1 2.116 0.01 A 13 GLN HE2y H 1 7.256 0.01 A 13 GLN HE2x H 1 6.550 0.01 A 13 GLN HG2 H 1 2.486 0.01 A 13 GLN HG3 H 1 2.421 0.01 A 14 PHE H H 1 9.110 0.02 A 14 PHE HA H 1 4.911 0.01 A 14 PHE HBy H 1 3.446 0.01 A 14 PHE HBx H 1 2.991 0.01 A 14 PHE HDx H 1 7.583 0.01 A 14 PHE HDy H 1 7.583 0.01 A 14 PHE HEx H 1 7.274 0.01 A 14 PHE HEy H 1 7.274 0.01 A 14 PHE HZ H 1 7.191 0.01 A 15 GLU H H 1 8.138 0.02 A 15 GLU HA H 1 4.371 0.01 A 15 GLU HB2 H 1 1.881 0.01 A 15 GLU HB3 H 1 1.869 0.01 A 15 GLU HG2 H 1 2.297 0.01 A 15 GLU HG3 H 1 2.257 0.01 A 16 ARG H H 1 8.549 0.02 A 16 ARG HA H 1 2.901 0.01 A 16 ARG HB2 H 1 1.429 0.01 A 16 ARG HB3 H 1 1.408 0.01 A 16 ARG HGx H 1 1.128 0.01 A 16 ARG HGy H 1 1.128 0.01 A 17 PRO HA H 1 3.787 0.01 A 17 PRO HB2 H 1 1.076 0.01 A 17 PRO HB3 H 1 0.988 0.01 A 17 PRO HD2 H 1 2.280 0.01 A 17 PRO HD3 H 1 2.351 0.01 A 17 PRO HG2 H 1 0.551 0.01 A 17 PRO HG3 H 1 0.012 0.01 A 18 LYS H H 1 8.296 0.02 A 18 LYS HA H 1 4.177 0.01 A 18 LYS HBy H 1 1.749 0.01 A 18 LYS HBx H 1 1.650 0.01 A 18 LYS HDx H 1 1.618 0.01 A 18 LYS HDy H 1 1.618 0.01 A 18 LYS HEx H 1 2.942 0.01 A 18 LYS HEy H 1 2.942 0.01 A 18 LYS HGy H 1 1.412 0.01 A 18 LYS HGx H 1 1.330 0.01 A 19 GLY H H 1 8.443 0.02 A 19 GLY HAy H 1 3.979 0.01 A 19 GLY HAx H 1 3.822 0.01 A 20 LEU H H 1 8.552 0.02 A 20 LEU HA H 1 4.409 0.01 A 20 LEU HBx H 1 1.670 0.01 A 20 LEU HBy H 1 1.670 0.01 A 20 LEU HDx% H 1 0.951 0.01 A 20 LEU HDy% H 1 0.886 0.01 A 20 LEU HG H 1 1.620 0.01 A 21 VAL H H 1 8.018 0.02 A 21 VAL HA H 1 4.282 0.01 A 21 VAL HB H 1 2.285 0.01 A 21 VAL HGx% H 1 0.963 0.01 A 21 VAL HGy% H 1 0.963 0.01 A 22 LYS H H 1 8.371 0.02 A 22 LYS HA H 1 4.349 0.01 A 22 LYS HBx H 1 1.830 0.01 A 22 LYS HBy H 1 1.830 0.01 A 22 LYS HDx H 1 1.681 0.01 A 22 LYS HDy H 1 1.681 0.01 A 22 LYS HGy H 1 1.523 0.01 A 22 LYS HGx H 1 1.428 0.01 A 23 GLY H H 1 8.919 0.02 A 23 GLY HA2 H 1 4.141 0.01 A 23 GLY HA3 H 1 3.631 0.01 A 24 TRP H H 1 8.079 0.02 A 24 TRP HA H 1 5.125 0.01 A 24 TRP HB2 H 1 3.384 0.01 A 24 TRP HB3 H 1 3.044 0.01 A 24 TRP HD1 H 1 7.204 0.01 A 24 TRP HE1 H 1 10.28 0.01 A 24 TRP HE3 H 1 7.431 0.01 A 24 TRP HH2 H 1 6.946 0.01 A 24 TRP HZ2 H 1 7.441 0.01 A 24 TRP HZ3 H 1 7.001 0.01 A 25 GLU H H 1 9.756 0.02 A 25 GLU HA H 1 4.912 0.01 A 25 GLU HB2 H 1 2.545 0.01 A 25 GLU HB3 H 1 2.127 0.01 A 25 GLU HGx H 1 2.242 0.01 A 25 GLU HGy H 1 2.242 0.01 A 26 LYS H H 1 8.893 0.02 A 26 LYS HA H 1 4.624 0.01 A 26 LYS HB2 H 1 1.663 0.01 A 26 LYS HB3 H 1 1.441 0.01 A 26 LYS HDy H 1 1.205 0.01 A 26 LYS HDx H 1 1.130 0.01 A 26 LYS HE2 H 1 2.082 0.01 A 26 LYS HE3 H 1 2.003 0.01 A 26 LYS HG2 H 1 1.022 0.01 A 26 LYS HG3 H 1 0.779 0.01 A 27 ARG H H 1 9.102 0.02 A 27 ARG HA H 1 4.722 0.01 A 27 ARG HB2 H 1 1.451 0.01 A 27 ARG HB3 H 1 0.388 0.01 A 27 ARG HDy H 1 2.997 0.01 A 27 ARG HDx H 1 2.737 0.01 A 27 ARG HE H 1 7.409 0.01 A 27 ARG HG2 H 1 1.502 0.01 A 27 ARG HG3 H 1 1.383 0.01 A 28 TRP H H 1 8.426 0.02 A 28 TRP HA H 1 4.963 0.01 A 28 TRP HB2 H 1 2.856 0.01 A 28 TRP HB3 H 1 2.414 0.01 A 28 TRP HD1 H 1 6.947 0.01 A 28 TRP HE1 H 1 10.04 0.01 A 28 TRP HE3 H 1 5.643 0.01 A 28 TRP HH2 H 1 7.068 0.01 A 28 TRP HZ2 H 1 7.389 0.01 A 28 TRP HZ3 H 1 6.407 0.01 A 29 ASP H H 1 8.259 0.02 A 29 ASP HA H 1 4.346 0.01 A 29 ASP HBy H 1 2.651 0.01 A 29 ASP HBx H 1 2.553 0.01 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 save_