data_nef_c30603_6oq9 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 6OQ9 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 GLY start . false 2 A 2 SER middle . . 3 A 3 VAL middle . . 4 A 4 GLU middle . . 5 A 5 LYS middle . . 6 A 6 LEU middle . . 7 A 7 THR middle . . 8 A 8 ALA middle . . 9 A 9 ASP middle . . 10 A 10 ALA middle . . 11 A 11 GLU middle . . 12 A 12 LEU middle . . 13 A 13 GLN middle . . 14 A 14 ARG middle . . 15 A 15 LEU middle . . 16 A 16 LYS middle . . 17 A 17 ASN middle . . 18 A 18 GLU middle . . 19 A 19 ARG middle . . 20 A 20 HIS middle . . 21 A 21 GLU middle . . 22 A 22 GLU middle . . 23 A 23 ALA middle . . 24 A 24 GLU middle . . 25 A 25 LEU middle . . 26 A 26 GLU middle . . 27 A 27 ARG middle . . 28 A 28 LEU middle . . 29 A 29 LYS middle . . 30 A 30 SER middle . . 31 A 31 GLU middle . . 32 A 32 ARG middle . . 33 A 33 HIS middle . . 34 A 34 ASP middle . . 35 A 35 HIS middle . . 36 A 36 ASP middle . . 37 A 37 LYS middle . . 38 A 38 LYS middle . . 39 A 39 GLU middle . . 40 A 40 ALA middle . . 41 A 41 GLU middle . . 42 A 42 ARG middle . . 43 A 43 LYS middle . . 44 A 44 ALA middle . . 45 A 45 LEU middle . . 46 A 46 GLU middle . . 47 A 47 ASP middle . . 48 A 48 LYS middle . . 49 A 49 LEU middle . . 50 A 50 ALA middle . . 51 A 51 ASP middle . . 52 A 52 TYR 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 SER HBx H 1 3.913 0.02 A 2 SER HBy H 1 3.913 0.02 A 2 SER CA C 13 58.361 0.20 A 2 SER CB C 13 63.803 0.20 A 3 VAL H H 1 8.218 0.02 A 3 VAL HA H 1 4.169 0.02 A 3 VAL HB H 1 2.141 0.02 A 3 VAL HGx% H 1 0.972 0.02 A 3 VAL HGy% H 1 0.972 0.02 A 3 VAL C C 13 176.373 0.20 A 3 VAL CA C 13 62.680 0.20 A 3 VAL CB C 13 32.353 0.20 A 3 VAL CGy C 13 20.900 0.20 A 3 VAL CGx C 13 20.600 0.20 A 3 VAL N N 15 122.267 0.20 A 4 GLU H H 1 8.420 0.02 A 4 GLU HA H 1 4.279 0.02 A 4 GLU HBy H 1 2.067 0.02 A 4 GLU HBx H 1 2.060 0.02 A 4 GLU HGx H 1 2.325 0.02 A 4 GLU HGy H 1 2.325 0.02 A 4 GLU C C 13 176.438 0.20 A 4 GLU CA C 13 56.805 0.20 A 4 GLU CB C 13 30.126 0.20 A 4 GLU CG C 13 36.216 0.20 A 4 GLU N N 15 125.081 0.20 A 5 LYS H H 1 7.987 0.02 A 5 LYS HA H 1 4.353 0.02 A 5 LYS HBx H 1 1.822 0.02 A 5 LYS HBy H 1 1.822 0.02 A 5 LYS HGx H 1 1.309 0.02 A 5 LYS HGy H 1 1.309 0.02 A 5 LYS C C 13 176.303 0.20 A 5 LYS CA C 13 56.130 0.20 A 5 LYS CB C 13 32.467 0.20 A 5 LYS CG C 13 24.100 0.20 A 5 LYS N N 15 122.686 0.20 A 6 LEU H H 1 8.143 0.02 A 6 LEU HA H 1 4.372 0.02 A 6 LEU HBx H 1 1.670 0.02 A 6 LEU HBy H 1 1.670 0.02 A 6 LEU HDx% H 1 0.929 0.02 A 6 LEU HDy% H 1 0.929 0.02 A 6 LEU HG H 1 1.670 0.02 A 6 LEU C C 13 176.115 0.20 A 6 LEU CA C 13 55.159 0.20 A 6 LEU CB C 13 42.143 0.20 A 6 LEU CDy C 13 23.400 0.20 A 6 LEU CDx C 13 23.135 0.20 A 6 LEU CG C 13 26.638 0.20 A 6 LEU N N 15 124.190 0.20 A 7 THR H H 1 7.670 0.02 A 7 THR C C 13 172.243 0.20 A 7 THR CA C 13 57.800 0.20 A 7 THR N N 15 110.380 0.20 A 8 ALA H H 1 8.660 0.02 A 8 ALA HA H 1 4.351 0.02 A 8 ALA HB% H 1 1.375 0.02 A 8 ALA C C 13 176.279 0.20 A 8 ALA CA C 13 52.911 0.20 A 8 ALA CB C 13 18.728 0.20 A 8 ALA N N 15 124.790 0.20 A 9 ASP H H 1 7.851 0.02 A 9 ASP HA H 1 4.207 0.02 A 9 ASP HBx H 1 2.654 0.02 A 9 ASP HBy H 1 2.654 0.02 A 9 ASP CA C 13 57.223 0.20 A 9 ASP CB C 13 42.109 0.20 A 9 ASP N N 15 117.351 0.20 A 10 ALA H H 1 8.007 0.02 A 10 ALA HA H 1 4.271 0.02 A 10 ALA HB% H 1 1.469 0.02 A 10 ALA C C 13 178.069 0.20 A 10 ALA CA C 13 52.911 0.20 A 10 ALA CB C 13 18.728 0.20 A 10 ALA N N 15 123.752 0.20 A 11 GLU H H 1 7.980 0.02 A 11 GLU HA H 1 4.062 0.02 A 11 GLU HBx H 1 2.220 0.02 A 11 GLU HBy H 1 2.220 0.02 A 11 GLU HGy H 1 2.295 0.02 A 11 GLU HGx H 1 2.290 0.02 A 11 GLU C C 13 176.711 0.20 A 11 GLU CA C 13 56.726 0.20 A 11 GLU CB C 13 29.907 0.20 A 11 GLU N N 15 119.225 0.20 A 12 LEU H H 1 7.704 0.02 A 12 LEU HA H 1 4.366 0.02 A 12 LEU HBx H 1 1.698 0.02 A 12 LEU HBy H 1 1.698 0.02 A 12 LEU HDx% H 1 0.915 0.02 A 12 LEU HDy% H 1 0.915 0.02 A 12 LEU HG H 1 1.698 0.02 A 12 LEU C C 13 176.469 0.20 A 12 LEU CA C 13 55.186 0.20 A 12 LEU CB C 13 42.410 0.20 A 12 LEU CDx C 13 22.976 0.20 A 12 LEU CDy C 13 22.976 0.20 A 12 LEU CG C 13 26.459 0.20 A 12 LEU N N 15 122.560 0.20 A 13 GLN H H 1 7.632 0.02 A 13 GLN HA H 1 4.153 0.02 A 13 GLN HBx H 1 2.254 0.02 A 13 GLN HBy H 1 2.254 0.02 A 13 GLN HGx H 1 2.254 0.02 A 13 GLN HGy H 1 2.254 0.02 A 13 GLN C C 13 179.186 0.20 A 13 GLN CA C 13 57.976 0.20 A 13 GLN CB C 13 31.079 0.20 A 13 GLN N N 15 126.443 0.20 A 14 ARG H H 1 7.831 0.02 A 14 ARG HA H 1 4.060 0.02 A 14 ARG HBx H 1 2.124 0.02 A 14 ARG HBy H 1 2.124 0.02 A 14 ARG C C 13 179.587 0.20 A 14 ARG CA C 13 59.627 0.20 A 14 ARG CB C 13 29.599 0.20 A 14 ARG N N 15 120.409 0.20 A 15 LEU H H 1 8.405 0.02 A 15 LEU HA H 1 4.366 0.02 A 15 LEU HBx H 1 1.698 0.02 A 15 LEU HBy H 1 1.698 0.02 A 15 LEU HDx% H 1 0.815 0.02 A 15 LEU HDy% H 1 0.815 0.02 A 15 LEU C C 13 180.617 0.20 A 15 LEU CA C 13 58.148 0.20 A 15 LEU CB C 13 41.479 0.20 A 15 LEU N N 15 121.415 0.20 A 16 LYS H H 1 8.334 0.02 A 16 LYS HA H 1 3.437 0.02 A 16 LYS C C 13 178.035 0.20 A 16 LYS CA C 13 60.142 0.20 A 16 LYS CB C 13 30.178 0.20 A 16 LYS N N 15 123.825 0.20 A 17 ASN H H 1 8.073 0.02 A 17 ASN HA H 1 4.339 0.02 A 17 ASN HBx H 1 1.790 0.02 A 17 ASN HBy H 1 1.873 0.02 A 17 ASN CA C 13 56.322 0.20 A 17 ASN CB C 13 37.428 0.20 A 17 ASN N N 15 118.293 0.20 A 18 GLU H H 1 8.221 0.02 A 18 GLU CA C 13 58.369 0.20 A 18 GLU CB C 13 29.808 0.20 A 18 GLU N N 15 124.463 0.20 A 19 ARG H H 1 7.861 0.02 A 19 ARG HA H 1 4.336 0.02 A 19 ARG HDx H 1 2.786 0.02 A 19 ARG HDy H 1 2.786 0.02 A 19 ARG C C 13 178.302 0.20 A 19 ARG CA C 13 59.900 0.20 A 19 ARG N N 15 119.674 0.20 A 20 HIS H H 1 8.480 0.02 A 20 HIS HA H 1 4.572 0.02 A 20 HIS HBx H 1 3.325 0.02 A 20 HIS HBy H 1 3.325 0.02 A 20 HIS C C 13 178.337 0.20 A 20 HIS CA C 13 59.805 0.20 A 20 HIS CB C 13 30.347 0.20 A 20 HIS N N 15 120.883 0.20 A 21 GLU H H 1 8.534 0.02 A 21 GLU HA H 1 4.489 0.02 A 21 GLU HGx H 1 2.522 0.02 A 21 GLU HGy H 1 2.522 0.02 A 21 GLU C C 13 178.592 0.20 A 21 GLU CA C 13 60.184 0.20 A 21 GLU CB C 13 30.197 0.20 A 21 GLU N N 15 124.659 0.20 A 22 GLU H H 1 8.445 0.02 A 22 GLU C C 13 179.662 0.20 A 22 GLU CA C 13 59.651 0.20 A 22 GLU CB C 13 29.023 0.20 A 22 GLU N N 15 118.225 0.20 A 23 ALA H H 1 8.044 0.02 A 23 ALA HA H 1 4.273 0.02 A 23 ALA HB% H 1 1.626 0.02 A 23 ALA C C 13 180.616 0.20 A 23 ALA CA C 13 55.042 0.20 A 23 ALA CB C 13 18.243 0.20 A 23 ALA N N 15 122.433 0.20 A 24 GLU H H 1 7.944 0.02 A 24 GLU HA H 1 4.331 0.02 A 24 GLU HBx H 1 2.030 0.02 A 24 GLU HBy H 1 2.030 0.02 A 24 GLU HGx H 1 2.434 0.02 A 24 GLU HGy H 1 2.434 0.02 A 24 GLU C C 13 178.687 0.20 A 24 GLU CA C 13 59.141 0.20 A 24 GLU CB C 13 29.047 0.20 A 24 GLU N N 15 121.804 0.20 A 25 LEU H H 1 8.277 0.02 A 25 LEU HA H 1 3.837 0.02 A 25 LEU HBx H 1 1.600 0.02 A 25 LEU HBy H 1 1.600 0.02 A 25 LEU HG H 1 1.600 0.02 A 25 LEU C C 13 178.253 0.20 A 25 LEU CA C 13 58.505 0.20 A 25 LEU CB C 13 41.211 0.20 A 25 LEU N N 15 120.272 0.20 A 26 GLU H H 1 7.662 0.02 A 26 GLU C C 13 178.203 0.20 A 26 GLU CA C 13 58.553 0.20 A 26 GLU CB C 13 28.147 0.20 A 26 GLU N N 15 117.747 0.20 A 27 ARG H H 1 8.061 0.02 A 27 ARG HA H 1 4.099 0.02 A 27 ARG HBx H 1 2.134 0.02 A 27 ARG HBy H 1 2.134 0.02 A 27 ARG C C 13 179.667 0.20 A 27 ARG CA C 13 59.479 0.20 A 27 ARG CB C 13 29.829 0.20 A 27 ARG N N 15 119.777 0.20 A 28 LEU H H 1 8.437 0.02 A 28 LEU HA H 1 4.019 0.02 A 28 LEU HBx H 1 1.795 0.02 A 28 LEU HBy H 1 1.795 0.02 A 28 LEU HDx% H 1 0.726 0.02 A 28 LEU HDy% H 1 0.726 0.02 A 28 LEU HG H 1 1.437 0.02 A 28 LEU C C 13 180.582 0.20 A 28 LEU CA C 13 58.243 0.20 A 28 LEU CB C 13 41.619 0.20 A 28 LEU N N 15 122.205 0.20 A 29 LYS H H 1 8.510 0.02 A 29 LYS HA H 1 3.491 0.02 A 29 LYS C C 13 178.495 0.20 A 29 LYS CA C 13 60.568 0.20 A 29 LYS CB C 13 30.200 0.20 A 29 LYS N N 15 123.535 0.20 A 30 SER H H 1 7.883 0.02 A 30 SER HA H 1 4.081 0.02 A 30 SER HBx H 1 4.081 0.02 A 30 SER HBy H 1 4.081 0.02 A 30 SER C C 13 177.016 0.20 A 30 SER CA C 13 61.803 0.20 A 30 SER CB C 13 62.671 0.20 A 30 SER N N 15 114.921 0.20 A 31 GLU H H 1 7.857 0.02 A 31 GLU HA H 1 4.279 0.02 A 31 GLU HBx H 1 2.067 0.02 A 31 GLU HBy H 1 2.067 0.02 A 31 GLU HGx H 1 2.325 0.02 A 31 GLU HGy H 1 2.325 0.02 A 31 GLU C C 13 177.957 0.20 A 31 GLU CA C 13 59.303 0.20 A 31 GLU CB C 13 29.800 0.20 A 31 GLU CG C 13 36.216 0.20 A 31 GLU N N 15 121.529 0.20 A 32 ARG H H 1 7.987 0.02 A 32 ARG HA H 1 4.137 0.02 A 32 ARG C C 13 178.873 0.20 A 32 ARG CA C 13 59.448 0.20 A 32 ARG CB C 13 30.320 0.20 A 32 ARG CD C 13 43.300 0.20 A 32 ARG N N 15 122.686 0.20 A 33 HIS H H 1 7.851 0.02 A 33 HIS HA H 1 4.300 0.02 A 33 HIS HBx H 1 2.954 0.02 A 33 HIS HBy H 1 2.954 0.02 A 33 HIS C C 13 178.581 0.20 A 33 HIS CA C 13 56.918 0.20 A 33 HIS CB C 13 29.723 0.20 A 33 HIS N N 15 117.351 0.20 A 34 ASP H H 1 8.090 0.02 A 34 ASP HA H 1 4.638 0.02 A 34 ASP HBx H 1 2.788 0.02 A 34 ASP HBy H 1 2.788 0.02 A 34 ASP C C 13 177.231 0.20 A 34 ASP CA C 13 55.926 0.20 A 34 ASP CB C 13 40.660 0.20 A 34 ASP N N 15 121.344 0.20 A 35 HIS H H 1 8.047 0.02 A 35 HIS HA H 1 4.630 0.02 A 35 HIS HBx H 1 3.386 0.02 A 35 HIS HBy H 1 3.386 0.02 A 35 HIS C C 13 175.555 0.20 A 35 HIS CA C 13 57.297 0.20 A 35 HIS CB C 13 29.658 0.20 A 35 HIS N N 15 118.983 0.20 A 36 ASP H H 1 7.940 0.02 A 36 ASP HA H 1 4.229 0.02 A 36 ASP HBx H 1 2.794 0.02 A 36 ASP HBy H 1 2.794 0.02 A 36 ASP C C 13 176.380 0.20 A 36 ASP CA C 13 55.015 0.20 A 36 ASP CB C 13 40.998 0.20 A 36 ASP N N 15 120.223 0.20 A 37 LYS H H 1 7.929 0.02 A 37 LYS HA H 1 4.336 0.02 A 37 LYS HBx H 1 1.891 0.02 A 37 LYS HBy H 1 1.891 0.02 A 37 LYS HDx H 1 1.506 0.02 A 37 LYS HDy H 1 1.506 0.02 A 37 LYS HGx H 1 1.506 0.02 A 37 LYS HGy H 1 1.506 0.02 A 37 LYS C C 13 176.640 0.20 A 37 LYS CA C 13 56.644 0.20 A 37 LYS CB C 13 32.586 0.20 A 37 LYS CG C 13 24.368 0.20 A 37 LYS N N 15 121.315 0.20 A 38 LYS H H 1 8.175 0.02 A 38 LYS HA H 1 4.359 0.02 A 38 LYS HBx H 1 1.844 0.02 A 38 LYS HBy H 1 1.844 0.02 A 38 LYS HDx H 1 1.440 0.02 A 38 LYS HDy H 1 1.440 0.02 A 38 LYS HEy H 1 3.020 0.02 A 38 LYS HGx H 1 1.443 0.02 A 38 LYS HGy H 1 1.443 0.02 A 38 LYS C C 13 176.700 0.20 A 38 LYS CA C 13 56.310 0.20 A 38 LYS CB C 13 32.793 0.20 A 38 LYS CG C 13 24.240 0.20 A 38 LYS N N 15 122.973 0.20 A 39 GLU H H 1 8.301 0.02 A 39 GLU HA H 1 4.330 0.02 A 39 GLU HBx H 1 2.048 0.02 A 39 GLU HBy H 1 2.048 0.02 A 39 GLU HGx H 1 2.324 0.02 A 39 GLU HGy H 1 2.324 0.02 A 39 GLU C C 13 176.027 0.20 A 39 GLU CA C 13 56.599 0.20 A 39 GLU CB C 13 30.100 0.20 A 39 GLU CG C 13 36.088 0.20 A 39 GLU N N 15 122.354 0.20 A 40 ALA H H 1 8.108 0.02 A 40 ALA HA H 1 4.369 0.02 A 40 ALA HB% H 1 1.427 0.02 A 40 ALA C C 13 176.562 0.20 A 40 ALA CA C 13 52.422 0.20 A 40 ALA CB C 13 19.284 0.20 A 40 ALA N N 15 125.271 0.20 A 41 GLU H H 1 7.793 0.02 A 41 GLU HGx H 1 2.332 0.02 A 41 GLU HGy H 1 2.332 0.02 A 41 GLU C C 13 177.946 0.20 A 41 GLU CA C 13 57.940 0.20 A 41 GLU CB C 13 29.815 0.20 A 41 GLU N N 15 125.874 0.20 A 42 ARG H H 1 7.975 0.02 A 42 ARG HA H 1 4.273 0.02 A 42 ARG HBx H 1 2.013 0.02 A 42 ARG HBy H 1 2.013 0.02 A 42 ARG HDx H 1 2.678 0.02 A 42 ARG HDy H 1 2.678 0.02 A 42 ARG HGx H 1 2.263 0.02 A 42 ARG HGy H 1 2.263 0.02 A 42 ARG C C 13 176.093 0.20 A 42 ARG CA C 13 57.046 0.20 A 42 ARG CB C 13 29.70 0.20 A 42 ARG CD C 13 43.300 0.20 A 42 ARG CG C 13 27.300 0.20 A 42 ARG N N 15 123.138 0.20 A 43 LYS H H 1 8.042 0.02 A 43 LYS HA H 1 4.163 0.02 A 43 LYS HBx H 1 1.874 0.02 A 43 LYS HBy H 1 1.874 0.02 A 43 LYS HDx H 1 1.527 0.02 A 43 LYS HDy H 1 1.527 0.02 A 43 LYS HGx H 1 1.430 0.02 A 43 LYS HGy H 1 1.527 0.02 A 43 LYS C C 13 177.482 0.20 A 43 LYS CA C 13 57.737 0.20 A 43 LYS CB C 13 32.361 0.20 A 43 LYS CE C 13 42.000 0.20 A 43 LYS N N 15 121.276 0.20 A 44 ALA H H 1 7.861 0.02 A 44 ALA HA H 1 4.307 0.02 A 44 ALA HB% H 1 1.485 0.02 A 44 ALA C C 13 178.709 0.20 A 44 ALA CA C 13 53.474 0.20 A 44 ALA CB C 13 18.478 0.20 A 44 ALA N N 15 122.929 0.20 A 45 LEU H H 1 7.734 0.02 A 45 LEU HA H 1 4.303 0.02 A 45 LEU HBx H 1 1.678 0.02 A 45 LEU HBy H 1 1.678 0.02 A 45 LEU HDx% H 1 0.938 0.02 A 45 LEU HDy% H 1 0.938 0.02 A 45 LEU HG H 1 1.678 0.02 A 45 LEU C C 13 177.501 0.20 A 45 LEU CA C 13 55.945 0.20 A 45 LEU CB C 13 41.810 0.20 A 45 LEU CDx C 13 23.628 0.20 A 45 LEU CDy C 13 26.600 0.20 A 45 LEU CG C 13 27.000 0.20 A 45 LEU N N 15 119.753 0.20 A 46 GLU H H 1 8.556 0.02 A 46 GLU HA H 1 4.273 0.02 A 46 GLU HBx H 1 1.873 0.02 A 46 GLU HBy H 1 1.873 0.02 A 46 GLU C C 13 178.845 0.20 A 46 GLU CA C 13 59.050 0.20 A 46 GLU CB C 13 32.260 0.20 A 46 GLU N N 15 120.873 0.20 A 47 ASP H H 1 8.162 0.02 A 47 ASP HA H 1 4.310 0.02 A 47 ASP HBx H 1 2.805 0.02 A 47 ASP HBy H 1 2.805 0.02 A 47 ASP C C 13 177.563 0.20 A 47 ASP CA C 13 55.013 0.20 A 47 ASP CB C 13 40.952 0.20 A 47 ASP N N 15 121.202 0.20 A 48 LYS H H 1 7.912 0.02 A 48 LYS HA H 1 4.322 0.02 A 48 LYS HBx H 1 1.814 0.02 A 48 LYS HBy H 1 1.814 0.02 A 48 LYS HDx H 1 1.880 0.02 A 48 LYS HDy H 1 1.880 0.02 A 48 LYS HGx H 1 1.286 0.02 A 48 LYS HGy H 1 1.286 0.02 A 48 LYS C C 13 176.395 0.20 A 48 LYS CA C 13 56.127 0.20 A 48 LYS CB C 13 32.531 0.20 A 48 LYS CD C 13 26.508 0.20 A 48 LYS CG C 13 23.875 0.20 A 48 LYS N N 15 121.545 0.20 A 49 LEU H H 1 8.107 0.02 A 49 LEU HA H 1 4.350 0.02 A 49 LEU HBx H 1 1.646 0.02 A 49 LEU HBy H 1 1.646 0.02 A 49 LEU HDx% H 1 0.938 0.02 A 49 LEU HDy% H 1 0.938 0.02 A 49 LEU HG H 1 1.646 0.02 A 49 LEU C C 13 176.934 0.20 A 49 LEU CA C 13 55.127 0.20 A 49 LEU CB C 13 42.118 0.20 A 49 LEU CDx C 13 23.301 0.20 A 49 LEU CDy C 13 23.301 0.20 A 49 LEU CG C 13 26.666 0.20 A 49 LEU N N 15 123.640 0.20 A 50 ALA H H 1 8.031 0.02 A 50 ALA HA H 1 4.312 0.02 A 50 ALA HB% H 1 1.330 0.02 A 50 ALA C C 13 176.892 0.20 A 50 ALA CA C 13 52.224 0.20 A 50 ALA CB C 13 19.270 0.20 A 50 ALA N N 15 124.802 0.20 A 51 ASP H H 1 8.029 0.02 A 51 ASP HA H 1 4.573 0.02 A 51 ASP HBx H 1 2.601 0.02 A 51 ASP HBy H 1 2.601 0.02 A 51 ASP C C 13 174.767 0.20 A 51 ASP CA C 13 54.386 0.20 A 51 ASP CB C 13 41.144 0.20 A 51 ASP N N 15 120.302 0.20 A 52 TYR H H 1 7.389 0.02 A 52 TYR C C 13 180.300 0.20 A 52 TYR CA C 13 58.970 0.20 A 52 TYR CB C 13 39.460 0.20 A 52 TYR N N 15 124.755 0.20 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _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 28 LEU HA A 31 GLU HBy 1.0 2.5 5.0 2 2 A 28 LEU HA A 31 GLU HBx 1.0 2.5 5.0 3 3 A 5 LYS H A 4 GLU H 1.0 2.0 3.0 4 4 A 5 LYS H A 6 LEU H 1.0 2.0 3.0 5 5 A 8 ALA H A 7 THR H 1.0 2.0 3.0 6 6 A 10 ALA H A 9 ASP H 1.0 2.0 3.0 7 7 A 10 ALA H A 11 GLU H 1.0 2.0 3.0 8 8 A 11 GLU H A 12 LEU H 1.0 2.0 3.0 9 9 A 17 ASN H A 16 LYS H 1.0 2.0 3.0 10 10 A 20 HIS H A 19 ARG H 1.0 2.0 3.0 11 11 A 20 HIS H A 21 GLU H 1.0 2.0 3.0 12 12 A 21 GLU H A 22 GLU H 1.0 2.0 3.0 13 13 A 22 GLU H A 23 ALA H 1.0 2.0 3.0 14 14 A 23 ALA H A 24 GLU H 1.0 2.0 3.0 15 15 A 24 GLU H A 25 LEU H 1.0 2.0 3.0 16 16 A 38 LYS H A 37 LYS H 1.0 2.0 3.0 17 17 A 42 ARG H A 41 GLU H 1.0 2.0 3.0 18 18 A 42 ARG H A 43 LYS H 1.0 2.0 3.0 19 19 A 43 LYS H A 44 ALA H 1.0 2.0 3.0 20 20 A 46 GLU H A 45 LEU H 1.0 2.0 3.0 21 21 A 50 ALA H A 49 LEU H 1.0 2.0 3.0 22 22 A 8 ALA H A 9 ASP H 1.0 2.0 3.0 23 23 A 12 LEU H A 13 GLN H 1.0 2.0 3.0 24 24 A 13 GLN H A 14 ARG H 1.0 2.0 3.0 25 25 A 25 LEU H A 26 GLU H 1.0 2.0 3.0 26 26 A 26 GLU H A 27 ARG H 1.0 2.0 3.0 27 27 A 37 LYS H A 36 ASP H 1.0 2.0 3.0 28 28 A 44 ALA H A 45 LEU H 1.0 2.0 3.0 29 29 A 46 GLU H A 47 ASP H 1.0 2.0 3.0 30 30 A 47 ASP H A 48 LYS H 1.0 2.0 3.0 31 31 A 7 THR H A 9 ASP H 1.0 3.5 5.0 32 32 A 20 HIS H A 22 GLU H 1.0 3.5 5.0 33 33 A 36 ASP H A 34 ASP H 1.0 3.5 5.0 34 34 A 37 LYS H A 39 GLU H 1.0 3.5 5.0 35 35 A 45 LEU H A 47 ASP H 1.0 3.5 5.0 36 36 A 2 SER HA A 2 SER H 1.0 2.0 3.0 37 37 A 4 GLU H A 4 GLU HA 1.0 2.0 3.0 38 38 A 7 THR H A 7 THR HA 1.0 2.0 3.0 39 39 A 12 LEU H A 12 LEU HA 1.0 2.0 3.0 40 40 A 13 GLN H A 13 GLN HA 1.0 2.0 3.0 41 41 A 15 LEU HA A 15 LEU H 1.0 2.0 3.0 42 42 A 16 LYS H A 16 LYS HA 1.0 2.0 3.0 43 43 A 18 GLU HA A 18 GLU H 1.0 2.0 3.0 44 44 A 19 ARG H A 19 ARG HA 1.0 2.0 3.0 45 45 A 24 GLU H A 24 GLU HA 1.0 2.0 3.0 46 46 A 34 ASP H A 34 ASP HA 1.0 2.0 3.0 47 47 A 43 LYS H A 43 LYS HA 1.0 2.0 3.0 48 48 A 45 LEU H A 45 LEU HA 1.0 2.0 3.0 49 49 A 46 GLU H A 46 GLU HA 1.0 2.0 3.0 50 50 A 49 LEU H A 49 LEU HA 1.0 2.0 3.0 51 51 A 50 ALA H A 50 ALA HA 1.0 2.0 3.0 52 52 A 3 VAL H A 3 VAL HA 1.0 2.0 3.0 53 53 A 8 ALA H A 8 ALA HA 1.0 2.0 3.0 54 54 A 9 ASP H A 9 ASP HA 1.0 2.0 3.0 55 55 A 10 ALA H A 10 ALA HA 1.0 2.0 3.0 56 56 A 14 ARG H A 14 ARG HA 1.0 2.0 3.0 57 57 A 17 ASN H A 17 ASN HA 1.0 2.0 3.0 58 58 A 20 HIS H A 20 HIS HA 1.0 2.0 3.0 59 59 A 21 GLU H A 21 GLU HA 1.0 2.0 3.0 60 60 A 22 GLU H A 22 GLU HA 1.0 2.0 3.0 61 61 A 23 ALA H A 23 ALA HA 1.0 2.0 3.0 62 62 A 25 LEU H A 25 LEU HA 1.0 2.0 3.0 63 63 A 26 GLU H A 26 GLU HA 1.0 2.0 3.0 64 64 A 27 ARG H A 27 ARG HA 1.0 2.0 3.0 65 65 A 28 LEU HA A 28 LEU H 1.0 2.0 3.0 66 66 A 30 SER H A 30 SER HA 1.0 2.0 3.0 67 67 A 35 HIS H A 35 HIS HA 1.0 2.0 3.0 68 68 A 36 ASP H A 36 ASP HA 1.0 2.0 3.0 69 69 A 37 LYS H A 37 LYS HA 1.0 2.0 3.0 70 70 A 38 LYS H A 38 LYS HA 1.0 2.0 3.0 71 71 A 39 GLU H A 39 GLU HA 1.0 2.0 3.0 72 72 A 40 ALA H A 40 ALA HA 1.0 2.0 3.0 73 73 A 41 GLU H A 41 GLU HA 1.0 2.0 3.0 74 74 A 42 ARG H A 42 ARG HA 1.0 2.0 3.0 75 75 A 44 ALA H A 44 ALA HA 1.0 2.0 3.0 76 76 A 47 ASP H A 47 ASP HA 1.0 2.0 3.0 77 77 A 51 ASP H A 51 ASP HA 1.0 2.0 3.0 78 78 A 52 TYR H A 52 TYR HA 1.0 2.0 3.0 79 79 A 4 GLU H A 3 VAL HA 1.0 3.0 4.0 80 80 A 5 LYS H A 4 GLU HA 1.0 3.0 4.0 81 81 A 7 THR H A 6 LEU HA 1.0 3.0 4.0 82 82 A 8 ALA H A 7 THR HA 1.0 3.0 4.0 83 83 A 19 ARG H A 18 GLU HA 1.0 3.0 4.0 84 84 A 27 ARG HA A 28 LEU H 1.0 3.0 4.0 85 85 A 28 LEU HA A 29 LYS H 1.0 3.0 4.0 86 86 A 34 ASP HA A 35 HIS H 1.0 3.0 4.0 87 87 A 46 GLU H A 45 LEU HA 1.0 3.0 4.0 88 88 A 48 LYS H A 47 ASP HA 1.0 3.0 4.0 89 89 A 49 LEU H A 48 LYS HA 1.0 3.0 4.0 90 90 A 50 ALA H A 49 LEU HA 1.0 3.0 4.0 91 91 A 10 ALA H A 9 ASP HA 1.0 3.0 4.0 92 92 A 13 GLN H A 12 LEU HA 1.0 3.0 4.0 93 93 A 20 HIS H A 19 ARG HA 1.0 3.0 4.0 94 94 A 23 ALA H A 22 GLU HA 1.0 3.0 4.0 95 95 A 24 GLU H A 23 ALA HA 1.0 3.0 4.0 96 96 A 6 LEU H A 5 LYS HA 1.0 3.0 4.0 97 97 A 16 LYS H A 15 LEU HA 1.0 3.0 4.0 98 98 A 25 LEU H A 24 GLU HA 1.0 3.0 4.0 99 99 A 41 GLU H A 40 ALA HA 1.0 3.0 4.0 100 100 A 47 ASP H A 46 GLU HA 1.0 3.0 4.0 101 101 A 6 LEU H A 4 GLU HA 1.0 3.4 5.4 102 102 A 13 GLN HA A 15 LEU H 1.0 3.4 5.4 103 103 A 4 GLU H A 2 SER HA 1.0 3.4 5.4 104 104 A 47 ASP H A 45 LEU HA 1.0 3.4 5.4 105 105 A 9 ASP H A 7 THR HA 1.0 3.4 5.4 106 106 A 11 GLU H A 9 ASP HA 1.0 3.4 5.4 107 107 A 16 LYS H A 14 ARG HA 1.0 3.4 5.4 108 108 A 16 LYS HA A 18 GLU H 1.0 3.4 5.4 109 109 A 22 GLU H A 20 HIS HA 1.0 3.4 5.4 110 110 A 27 ARG HA A 29 LYS H 1.0 3.4 5.4 111 111 A 38 LYS H A 36 ASP HA 1.0 3.4 5.4 112 112 A 45 LEU H A 43 LYS HA 1.0 3.4 5.4 113 113 A 7 THR H A 4 GLU HA 1.0 3.0 4.0 114 114 A 10 ALA H A 7 THR HA 1.0 3.0 4.0 115 115 A 37 LYS H A 34 ASP HA 1.0 3.0 4.0 116 116 A 38 LYS H A 35 HIS HA 1.0 3.0 4.0 117 117 A 12 LEU H A 9 ASP HA 1.0 3.0 4.0 118 118 A 13 GLN H A 10 ALA HA 1.0 3.0 4.0 119 119 A 23 ALA H A 20 HIS HA 1.0 3.0 4.0 120 120 A 25 LEU H A 22 GLU HA 1.0 3.0 4.0 121 121 A 26 GLU H A 23 ALA HA 1.0 3.0 4.0 122 122 A 47 ASP H A 44 ALA HA 1.0 3.0 4.0 123 123 A 48 LYS H A 45 LEU HA 1.0 3.0 4.0 124 124 A 4 GLU H A 4 GLU HBy 1.0 2.5 5.0 125 124 A 4 GLU H A 4 GLU HBx 1.0 2.5 5.0 126 125 A 6 LEU H A 6 LEU HBx 1.0 2.5 5.0 127 125 A 6 LEU H A 6 LEU HBy 1.0 2.5 5.0 128 126 A 7 THR H A 7 THR HB 1.0 2.5 5.0 129 127 A 8 ALA H A 8 ALA HB% 1.0 2.5 5.0 130 128 A 15 LEU H A 15 LEU HBy 1.0 2.5 5.0 131 129 A 15 LEU H A 15 LEU HBx 1.0 2.5 5.0 132 130 A 21 GLU H A 21 GLU HBx 1.0 2.5 5.0 133 130 A 21 GLU H A 21 GLU HBy 1.0 2.5 5.0 134 131 A 28 LEU H A 28 LEU HBy 1.0 2.5 5.0 135 132 A 28 LEU H A 28 LEU HBx 1.0 2.5 5.0 136 133 A 34 ASP H A 34 ASP HBx 1.0 2.5 5.0 137 133 A 34 ASP H A 34 ASP HBy 1.0 2.5 5.0 138 134 A 42 ARG H A 42 ARG HBx 1.0 2.5 5.0 139 134 A 42 ARG H A 42 ARG HBy 1.0 2.5 5.0 140 135 A 45 LEU H A 45 LEU HBy 1.0 2.5 5.0 141 136 A 45 LEU H A 45 LEU HBx 1.0 2.5 5.0 142 137 A 48 LYS H A 48 LYS HBx 1.0 2.5 5.0 143 137 A 48 LYS H A 48 LYS HBy 1.0 2.5 5.0 144 138 A 49 LEU H A 49 LEU HBx 1.0 2.5 5.0 145 138 A 49 LEU H A 49 LEU HBy 1.0 2.5 5.0 146 139 A 9 ASP H A 9 ASP HBx 1.0 2.5 5.0 147 139 A 9 ASP H A 9 ASP HBy 1.0 2.5 5.0 148 140 A 10 ALA H A 10 ALA HB% 1.0 2.5 5.0 149 141 A 11 GLU H A 11 GLU HBx 1.0 2.5 5.0 150 141 A 11 GLU H A 11 GLU HBy 1.0 2.5 5.0 151 142 A 12 LEU H A 12 LEU HBx 1.0 2.5 5.0 152 142 A 12 LEU H A 12 LEU HBy 1.0 2.5 5.0 153 143 A 13 GLN H A 13 GLN HBx 1.0 2.5 5.0 154 143 A 13 GLN H A 13 GLN HBy 1.0 2.5 5.0 155 144 A 14 ARG H A 14 ARG HBx 1.0 2.5 5.0 156 144 A 14 ARG H A 14 ARG HBy 1.0 2.5 5.0 157 145 A 16 LYS H A 16 LYS HBx 1.0 2.5 5.0 158 145 A 16 LYS H A 16 LYS HBy 1.0 2.5 5.0 159 146 A 17 ASN H A 17 ASN HBx 1.0 2.5 5.0 160 146 A 17 ASN H A 17 ASN HBy 1.0 2.5 5.0 161 147 A 19 ARG H A 19 ARG HBx 1.0 2.5 5.0 162 147 A 19 ARG H A 19 ARG HBy 1.0 2.5 5.0 163 148 A 20 HIS H A 20 HIS HBx 1.0 2.5 5.0 164 148 A 20 HIS H A 20 HIS HBy 1.0 2.5 5.0 165 149 A 22 GLU H A 22 GLU HBx 1.0 2.5 5.0 166 149 A 22 GLU H A 22 GLU HBy 1.0 2.5 5.0 167 150 A 23 ALA H A 23 ALA HB% 1.0 2.5 5.0 168 151 A 24 GLU H A 24 GLU HBx 1.0 2.5 5.0 169 151 A 24 GLU H A 24 GLU HBy 1.0 2.5 5.0 170 152 A 27 ARG H A 27 ARG HBx 1.0 2.5 5.0 171 152 A 27 ARG H A 27 ARG HBy 1.0 2.5 5.0 172 153 A 28 LEU H A 28 LEU HBy 1.0 2.5 5.0 173 153 A 28 LEU H A 28 LEU HBx 1.0 2.5 5.0 174 154 A 29 LYS H A 29 LYS HBx 1.0 2.5 5.0 175 154 A 29 LYS H A 29 LYS HBy 1.0 2.5 5.0 176 155 A 30 SER H A 30 SER HBx 1.0 2.5 5.0 177 155 A 30 SER H A 30 SER HBy 1.0 2.5 5.0 178 156 A 35 HIS H A 35 HIS HBx 1.0 2.5 5.0 179 156 A 35 HIS H A 35 HIS HBy 1.0 2.5 5.0 180 157 A 36 ASP H A 36 ASP HBx 1.0 2.5 5.0 181 157 A 36 ASP H A 36 ASP HBy 1.0 2.5 5.0 182 158 A 37 LYS H A 37 LYS HBx 1.0 2.5 5.0 183 158 A 37 LYS H A 37 LYS HBy 1.0 2.5 5.0 184 159 A 38 LYS H A 38 LYS HBx 1.0 2.5 5.0 185 159 A 38 LYS H A 38 LYS HBy 1.0 2.5 5.0 186 160 A 39 GLU H A 39 GLU HBx 1.0 2.5 5.0 187 160 A 39 GLU H A 39 GLU HBy 1.0 2.5 5.0 188 161 A 40 ALA H A 40 ALA HB% 1.0 2.5 5.0 189 162 A 41 GLU H A 41 GLU HBx 1.0 2.5 5.0 190 162 A 41 GLU H A 41 GLU HBy 1.0 2.5 5.0 191 163 A 44 ALA H A 44 ALA HB% 1.0 2.5 5.0 192 164 A 43 LYS H A 43 LYS HBx 1.0 2.5 5.0 193 164 A 43 LYS H A 43 LYS HBy 1.0 2.5 5.0 194 165 A 46 GLU H A 46 GLU HBx 1.0 2.5 5.0 195 165 A 46 GLU H A 46 GLU HBy 1.0 2.5 5.0 196 166 A 47 ASP H A 47 ASP HBx 1.0 2.5 5.0 197 166 A 47 ASP H A 47 ASP HBy 1.0 2.5 5.0 198 167 A 16 LYS H A 15 LEU HBy 1.0 2.5 5.0 199 168 A 16 LYS H A 15 LEU HBx 1.0 2.5 5.0 200 169 A 19 ARG H A 18 GLU HBy 1.0 2.5 5.0 201 170 A 19 ARG H A 18 GLU HBx 1.0 2.5 5.0 202 171 A 29 LYS H A 28 LEU HBy 1.0 2.5 5.0 203 172 A 29 LYS H A 28 LEU HBx 1.0 2.5 5.0 204 173 A 34 ASP H A 33 HIS HBx 1.0 2.5 5.0 205 174 A 34 ASP H A 33 HIS HBy 1.0 2.5 5.0 206 175 A 46 GLU H A 45 LEU HBy 1.0 2.5 5.0 207 176 A 46 GLU H A 45 LEU HBx 1.0 2.5 5.0 208 177 A 7 THR H A 6 LEU HBx 1.0 2.5 5.0 209 177 A 7 THR H A 6 LEU HBy 1.0 2.5 5.0 210 178 A 8 ALA H A 7 THR HB 1.0 2.5 5.0 211 179 A 9 ASP H A 8 ALA HB% 1.0 2.5 5.0 212 180 A 10 ALA H A 9 ASP HBx 1.0 2.5 5.0 213 180 A 10 ALA H A 9 ASP HBy 1.0 2.5 5.0 214 181 A 12 LEU H A 11 GLU HBx 1.0 2.5 5.0 215 181 A 12 LEU H A 11 GLU HBy 1.0 2.5 5.0 216 182 A 15 LEU H A 14 ARG HBx 1.0 2.5 5.0 217 182 A 15 LEU H A 14 ARG HBy 1.0 2.5 5.0 218 183 A 17 ASN H A 16 LYS HBx 1.0 2.5 5.0 219 183 A 17 ASN H A 16 LYS HBy 1.0 2.5 5.0 220 184 A 21 GLU H A 20 HIS HBx 1.0 2.5 5.0 221 184 A 21 GLU H A 20 HIS HBy 1.0 2.5 5.0 222 185 A 22 GLU H A 21 GLU HBx 1.0 2.5 5.0 223 185 A 22 GLU H A 21 GLU HBy 1.0 2.5 5.0 224 186 A 23 ALA H A 22 GLU HBx 1.0 2.5 5.0 225 186 A 23 ALA H A 22 GLU HBy 1.0 2.5 5.0 226 187 A 24 GLU H A 23 ALA HB% 1.0 2.5 5.0 227 188 A 25 LEU H A 24 GLU HBx 1.0 2.5 5.0 228 188 A 25 LEU H A 24 GLU HBy 1.0 2.5 5.0 229 189 A 28 LEU H A 27 ARG HBx 1.0 2.5 5.0 230 189 A 28 LEU H A 27 ARG HBy 1.0 2.5 5.0 231 190 A 35 HIS H A 34 ASP HBx 1.0 2.5 5.0 232 190 A 35 HIS H A 34 ASP HBy 1.0 2.5 5.0 233 191 A 37 LYS H A 36 ASP HBx 1.0 2.5 5.0 234 191 A 37 LYS H A 36 ASP HBy 1.0 2.5 5.0 235 192 A 38 LYS H A 37 LYS HBx 1.0 2.5 5.0 236 192 A 38 LYS H A 37 LYS HBy 1.0 2.5 5.0 237 193 A 39 GLU H A 38 LYS HBx 1.0 2.5 5.0 238 193 A 39 GLU H A 38 LYS HBy 1.0 2.5 5.0 239 194 A 42 ARG H A 41 GLU HBx 1.0 2.5 5.0 240 194 A 42 ARG H A 41 GLU HBy 1.0 2.5 5.0 241 195 A 43 LYS H A 42 ARG HBx 1.0 2.5 5.0 242 195 A 43 LYS H A 42 ARG HBy 1.0 2.5 5.0 243 196 A 45 LEU H A 44 ALA HB% 1.0 2.5 5.0 244 197 A 49 LEU H A 48 LYS HBx 1.0 2.5 5.0 245 197 A 49 LEU H A 48 LYS HBy 1.0 2.5 5.0 246 198 A 5 LYS H A 4 GLU HBy 1.0 2.5 5.0 247 198 A 5 LYS H A 4 GLU HBx 1.0 2.5 5.0 248 199 A 11 GLU H A 11 GLU HGy 1.0 2.5 5.0 249 199 A 11 GLU H A 11 GLU HGx 1.0 2.5 5.0 250 200 A 12 LEU H A 12 LEU HG 1.0 2.5 5.0 251 201 A 15 LEU H A 15 LEU HG 1.0 2.5 5.0 252 202 A 22 GLU H A 22 GLU HGx 1.0 2.5 5.0 253 202 A 22 GLU H A 22 GLU HGy 1.0 2.5 5.0 254 203 A 26 GLU H A 26 GLU HGx 1.0 2.5 5.0 255 203 A 26 GLU H A 26 GLU HGy 1.0 2.5 5.0 256 204 A 39 GLU H A 39 GLU HGx 1.0 2.5 5.0 257 204 A 39 GLU H A 39 GLU HGy 1.0 2.5 5.0 258 205 A 10 ALA H A 12 LEU HDx% 1.0 2.5 5.0 259 206 A 10 ALA H A 12 LEU HDy% 1.0 2.5 5.0 260 207 A 15 LEU H A 15 LEU HDx% 1.0 2.5 5.0 261 208 A 25 LEU H A 25 LEU HD11 1.0 2.5 5.0 262 209 A 25 LEU H A 25 LEU HD21 1.0 2.5 5.0 263 210 A 28 LEU H A 28 LEU HDx% 1.0 2.5 5.0 264 211 A 29 LYS H A 29 LYS HDx 1.0 2.5 5.0 265 211 A 29 LYS H A 29 LYS HDy 1.0 2.5 5.0 266 212 A 49 LEU H A 49 LEU HDx% 1.0 2.5 4.5 267 213 A 49 LEU H A 49 LEU HDy% 1.0 2.5 4.5 268 214 A 16 LYS H A 15 LEU HG 1.0 3.0 4.0 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _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 6 LEU C A 7 THR N A 7 THR CA A 7 THR C 1.0 -145.7 -89.5 PHI 2 2 A 7 THR N A 7 THR CA A 7 THR C A 8 ALA N 1.0 109.4 181.0 PSI 3 3 A 8 ALA C A 9 ASP N A 9 ASP CA A 9 ASP C 1.0 -81.5 -41.5 PHI 4 4 A 9 ASP N A 9 ASP CA A 9 ASP C A 10 ALA N 1.0 -56.4 -16.4 PSI 5 5 A 9 ASP C A 10 ALA N A 10 ALA CA A 10 ALA C 1.0 -86.9 -46.9 PHI 6 6 A 10 ALA N A 10 ALA CA A 10 ALA C A 11 GLU N 1.0 -55.5 -15.5 PSI 7 7 A 10 ALA C A 11 GLU N A 11 GLU CA A 11 GLU C 1.0 -87.9 -47.9 PHI 8 8 A 11 GLU N A 11 GLU CA A 11 GLU C A 12 LEU N 1.0 -59.4 -19.4 PSI 9 9 A 11 GLU C A 12 LEU N A 12 LEU CA A 12 LEU C 1.0 -89.5 -49.5 PHI 10 10 A 12 LEU N A 12 LEU CA A 12 LEU C A 13 GLN N 1.0 -56.4 -16.4 PSI 11 11 A 12 LEU C A 13 GLN N A 13 GLN CA A 13 GLN C 1.0 -85.9 -45.9 PHI 12 12 A 13 GLN N A 13 GLN CA A 13 GLN C A 14 ARG N 1.0 -61.4 -21.4 PSI 13 13 A 13 GLN C A 14 ARG N A 14 ARG CA A 14 ARG C 1.0 -85.8 -45.8 PHI 14 14 A 14 ARG N A 14 ARG CA A 14 ARG C A 15 LEU N 1.0 -59.2 -19.2 PSI 15 15 A 14 ARG C A 15 LEU N A 15 LEU CA A 15 LEU C 1.0 -84.9 -44.9 PHI 16 16 A 15 LEU N A 15 LEU CA A 15 LEU C A 16 LYS N 1.0 -60.8 -20.8 PSI 17 17 A 15 LEU C A 16 LYS N A 16 LYS CA A 16 LYS C 1.0 -84.4 -44.4 PHI 18 18 A 16 LYS N A 16 LYS CA A 16 LYS C A 17 ASN N 1.0 -59.8 -19.8 PSI 19 19 A 16 LYS C A 17 ASN N A 17 ASN CA A 17 ASN C 1.0 -86.0 -46.0 PHI 20 20 A 17 ASN N A 17 ASN CA A 17 ASN C A 18 GLU N 1.0 -59.1 -19.1 PSI 21 21 A 17 ASN C A 18 GLU N A 18 GLU CA A 18 GLU C 1.0 -85.3 -45.3 PHI 22 22 A 18 GLU N A 18 GLU CA A 18 GLU C A 19 ARG N 1.0 -59.9 -19.9 PSI 23 23 A 18 GLU C A 19 ARG N A 19 ARG CA A 19 ARG C 1.0 -84.1 -44.1 PHI 24 24 A 19 ARG N A 19 ARG CA A 19 ARG C A 20 HIS N 1.0 -63.0 -23.0 PSI 25 25 A 19 ARG C A 20 HIS N A 20 HIS CA A 20 HIS C 1.0 -83.8 -43.8 PHI 26 26 A 20 HIS N A 20 HIS CA A 20 HIS C A 21 GLU N 1.0 -63.0 -23.0 PSI 27 27 A 20 HIS C A 21 GLU N A 21 GLU CA A 21 GLU C 1.0 -83.6 -43.6 PHI 28 28 A 21 GLU N A 21 GLU CA A 21 GLU C A 22 GLU N 1.0 -63.2 -23.2 PSI 29 29 A 21 GLU C A 22 GLU N A 22 GLU CA A 22 GLU C 1.0 -84.5 -44.5 PHI 30 30 A 22 GLU N A 22 GLU CA A 22 GLU C A 23 ALA N 1.0 -60.0 -20.0 PSI 31 31 A 22 GLU C A 23 ALA N A 23 ALA CA A 23 ALA C 1.0 -86.3 -46.3 PHI 32 32 A 23 ALA N A 23 ALA CA A 23 ALA C A 24 GLU N 1.0 -59.1 -19.1 PSI 33 33 A 23 ALA C A 24 GLU N A 24 GLU CA A 24 GLU C 1.0 -86.4 -46.4 PHI 34 34 A 24 GLU N A 24 GLU CA A 24 GLU C A 25 LEU N 1.0 -60.2 -20.2 PSI 35 35 A 24 GLU C A 25 LEU N A 25 LEU CA A 25 LEU C 1.0 -81.8 -41.8 PHI 36 36 A 25 LEU N A 25 LEU CA A 25 LEU C A 26 GLU N 1.0 -61.8 -21.8 PSI 37 37 A 25 LEU C A 26 GLU N A 26 GLU CA A 26 GLU C 1.0 -85.3 -45.3 PHI 38 38 A 26 GLU N A 26 GLU CA A 26 GLU C A 27 ARG N 1.0 -59.5 -19.5 PSI 39 39 A 26 GLU C A 27 ARG N A 27 ARG CA A 27 ARG C 1.0 -85.4 -45.4 PHI 40 40 A 27 ARG N A 27 ARG CA A 27 ARG C A 28 LEU N 1.0 -61.9 -21.9 PSI 41 41 A 27 ARG C A 28 LEU N A 28 LEU CA A 28 LEU C 1.0 -84.9 -44.9 PHI 42 42 A 28 LEU N A 28 LEU CA A 28 LEU C A 29 LYS N 1.0 -62.3 -22.3 PSI 43 43 A 28 LEU C A 29 LYS N A 29 LYS CA A 29 LYS C 1.0 -84.5 -44.5 PHI 44 44 A 29 LYS N A 29 LYS CA A 29 LYS C A 30 SER N 1.0 -59.9 -19.9 PSI 45 45 A 29 LYS C A 30 SER N A 30 SER CA A 30 SER C 1.0 -84.5 -44.5 PHI 46 46 A 30 SER N A 30 SER CA A 30 SER C A 31 GLU N 1.0 -60.1 -20.1 PSI 47 47 A 30 SER C A 31 GLU N A 31 GLU CA A 31 GLU C 1.0 -86.5 -46.5 PHI 48 48 A 31 GLU N A 31 GLU CA A 31 GLU C A 32 ARG N 1.0 -58.8 -18.8 PSI 49 49 A 31 GLU C A 32 ARG N A 32 ARG CA A 32 ARG C 1.0 -84.9 -44.9 PHI 50 50 A 32 ARG N A 32 ARG CA A 32 ARG C A 33 HIS N 1.0 -62.5 -22.5 PSI 51 51 A 32 ARG C A 33 HIS N A 33 HIS CA A 33 HIS C 1.0 -88.7 -48.7 PHI 52 52 A 33 HIS N A 33 HIS CA A 33 HIS C A 34 ASP N 1.0 -55.4 -15.4 PSI 53 53 A 33 HIS C A 34 ASP N A 34 ASP CA A 34 ASP C 1.0 -88.5 -48.5 PHI 54 54 A 34 ASP N A 34 ASP CA A 34 ASP C A 35 HIS N 1.0 -53.7 -11.9 PSI 55 55 A 34 ASP C A 35 HIS N A 35 HIS CA A 35 HIS C 1.0 -91.0 -51.0 PHI 56 56 A 35 HIS N A 35 HIS CA A 35 HIS C A 36 ASP N 1.0 -44.9 -4.9 PSI 57 57 A 35 HIS C A 36 ASP N A 36 ASP CA A 36 ASP C 1.0 -97.4 -57.4 PHI 58 58 A 36 ASP N A 36 ASP CA A 36 ASP C A 37 LYS N 1.0 -40.0 6.0 PSI 59 59 A 41 GLU C A 42 ARG N A 42 ARG CA A 42 ARG C 1.0 -169.7 -125.7 PHI 60 60 A 42 ARG N A 42 ARG CA A 42 ARG C A 43 LYS N 1.0 130.5 187.1 PSI 61 61 A 42 ARG C A 43 LYS N A 43 LYS CA A 43 LYS C 1.0 -84.2 -44.2 PHI 62 62 A 43 LYS N A 43 LYS CA A 43 LYS C A 44 ALA N 1.0 -53.1 -13.1 PSI 63 63 A 43 LYS C A 44 ALA N A 44 ALA CA A 44 ALA C 1.0 -83.1 -43.1 PHI 64 64 A 44 ALA N A 44 ALA CA A 44 ALA C A 45 LEU N 1.0 -60.2 -20.2 PSI 65 65 A 44 ALA C A 45 LEU N A 45 LEU CA A 45 LEU C 1.0 -89.9 -49.9 PHI 66 66 A 45 LEU N A 45 LEU CA A 45 LEU C A 46 GLU N 1.0 -58.2 -18.2 PSI 67 67 A 45 LEU C A 46 GLU N A 46 GLU CA A 46 GLU C 1.0 -84.8 -44.8 PHI 68 68 A 46 GLU N A 46 GLU CA A 46 GLU C A 47 ASP N 1.0 -58.2 -18.2 PSI 69 69 A 46 GLU C A 47 ASP N A 47 ASP CA A 47 ASP C 1.0 -90.3 -50.3 PHI 70 70 A 47 ASP N A 47 ASP CA A 47 ASP C A 48 LYS N 1.0 -43.3 -3.3 PSI stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 2 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 ppm . . 11 . . . . 2 ppm . . 24 . . . . stop_ save_