data_nef_c30009_5i1x 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 30011 PDB 5I1X 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 4 CYS SG 1 19 CYS SG 1 11 CYS SG 1 24 CYS SG 1 18 CYS SG 1 31 CYS SG 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 1 SER start . . 2 A 2 GLU middle . . 3 A 3 ASP middle . . 4 A 4 CYS middle -HG . 5 A 5 LEU middle . . 6 A 6 GLY middle . false 7 A 7 TRP middle . . 8 A 8 ALA middle . . 9 A 9 SER middle . . 10 A 10 ARG middle . . 11 A 11 CYS middle -HG . 12 A 12 SER middle . . 13 A 13 PRO middle . false 14 A 14 LYS middle . . 15 A 15 ASN middle . . 16 A 16 ASP middle . . 17 A 17 LYS middle . . 18 A 18 CYS middle -HG . 19 A 19 CYS middle -HG . 20 A 20 PRO middle . false 21 A 21 ASN middle . . 22 A 22 TYR middle . . 23 A 23 LYS middle . . 24 A 24 CYS middle -HG . 25 A 25 SER middle . . 26 A 26 SER middle . . 27 A 27 LYS middle . . 28 A 28 ASP middle . . 29 A 29 LEU middle . . 30 A 30 TRP middle . . 31 A 31 CYS middle -HG . 32 A 32 LYS middle . . 33 A 33 TYR middle . . 34 A 34 LYS middle . . 35 A 35 ILE middle . . 36 A 36 TRP 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 SER HA H 1 4.154 0.004 A 1 SER HBx H 1 3.979 0.000 A 1 SER HBy H 1 3.979 0.000 A 1 SER C C 13 170.662 0.000 A 1 SER CA C 13 57.499 0.003 A 1 SER CB C 13 63.053 0.000 A 2 GLU H H 1 8.809 0.001 A 2 GLU HA H 1 4.431 0.001 A 2 GLU HBy H 1 2.128 0.010 A 2 GLU HBx H 1 1.949 0.003 A 2 GLU HGx H 1 2.293 0.000 A 2 GLU HGy H 1 2.293 0.000 A 2 GLU C C 13 175.847 0.000 A 2 GLU CA C 13 56.395 0.005 A 2 GLU CB C 13 30.430 0.000 A 2 GLU CG C 13 36.029 0.000 A 2 GLU N N 15 121.416 0.013 A 3 ASP H H 1 8.557 0.004 A 3 ASP HA H 1 4.686 0.002 A 3 ASP HBy H 1 2.732 0.007 A 3 ASP HBx H 1 2.589 0.006 A 3 ASP C C 13 175.519 0.000 A 3 ASP CA C 13 54.190 0.000 A 3 ASP CB C 13 41.044 0.023 A 3 ASP N N 15 122.670 0.031 A 4 CYS H H 1 8.167 0.003 A 4 CYS HA H 1 4.902 0.004 A 4 CYS HBx H 1 3.240 0.004 A 4 CYS HBy H 1 3.240 0.004 A 4 CYS C C 13 173.141 0.000 A 4 CYS CA C 13 54.173 0.000 A 4 CYS CB C 13 43.241 0.038 A 4 CYS N N 15 116.311 0.007 A 5 LEU H H 1 8.649 0.009 A 5 LEU HA H 1 4.410 0.003 A 5 LEU HBy H 1 1.764 0.010 A 5 LEU HBx H 1 1.470 0.009 A 5 LEU HDx% H 1 0.927 0.008 A 5 LEU HDy% H 1 0.831 0.006 A 5 LEU HG H 1 1.569 0.005 A 5 LEU C C 13 175.050 0.000 A 5 LEU CA C 13 54.436 0.018 A 5 LEU CB C 13 43.287 0.032 A 5 LEU CDy C 13 26.233 0.000 A 5 LEU CDx C 13 21.960 0.043 A 5 LEU CG C 13 26.267 0.078 A 5 LEU N N 15 120.935 0.015 A 6 GLY H H 1 8.292 0.003 A 6 GLY HAy H 1 3.954 0.004 A 6 GLY HAx H 1 3.609 0.001 A 6 GLY C C 13 172.888 0.000 A 6 GLY CA C 13 43.195 0.043 A 6 GLY N N 15 109.114 0.028 A 7 TRP H H 1 7.784 0.004 A 7 TRP HA H 1 3.333 0.005 A 7 TRP HBx H 1 2.902 0.004 A 7 TRP HBy H 1 2.902 0.004 A 7 TRP HD1 H 1 6.972 0.007 A 7 TRP HE1 H 1 10.227 0.012 A 7 TRP HE3 H 1 7.329 0.002 A 7 TRP HH2 H 1 7.199 0.001 A 7 TRP HZ2 H 1 7.531 0.004 A 7 TRP HZ3 H 1 6.911 0.006 A 7 TRP C C 13 176.734 0.000 A 7 TRP CA C 13 59.291 0.044 A 7 TRP CB C 13 28.433 0.061 A 7 TRP CD1 C 13 126.954 0.039 A 7 TRP CE3 C 13 121.248 0.016 A 7 TRP CH2 C 13 124.464 0.003 A 7 TRP CZ2 C 13 114.347 0.008 A 7 TRP CZ3 C 13 121.598 0.000 A 7 TRP N N 15 118.627 0.027 A 7 TRP NE1 N 15 129.510 0.004 A 8 ALA H H 1 8.214 0.004 A 8 ALA HA H 1 3.186 0.009 A 8 ALA HB% H 1 0.156 0.007 A 8 ALA C C 13 176.165 0.000 A 8 ALA CA C 13 53.582 0.063 A 8 ALA CB C 13 15.474 0.068 A 8 ALA N N 15 123.506 0.019 A 9 SER H H 1 7.734 0.004 A 9 SER HA H 1 4.301 0.001 A 9 SER HBx H 1 3.757 0.003 A 9 SER HBy H 1 3.757 0.003 A 9 SER C C 13 174.100 0.000 A 9 SER CA C 13 59.428 0.062 A 9 SER CB C 13 64.664 0.115 A 9 SER N N 15 115.657 0.025 A 10 ARG H H 1 8.561 0.004 A 10 ARG HA H 1 4.772 0.003 A 10 ARG HBx H 1 1.833 0.002 A 10 ARG HBy H 1 1.833 0.002 A 10 ARG HDy H 1 3.304 0.001 A 10 ARG HDx H 1 3.260 0.001 A 10 ARG HGy H 1 1.792 0.001 A 10 ARG HGx H 1 1.677 0.000 A 10 ARG C C 13 175.865 0.000 A 10 ARG CA C 13 56.385 0.000 A 10 ARG CB C 13 29.519 0.029 A 10 ARG CD C 13 42.753 0.000 A 10 ARG CG C 13 27.026 0.024 A 10 ARG N N 15 124.788 0.008 A 11 CYS H H 1 8.097 0.002 A 11 CYS HA H 1 4.808 0.005 A 11 CYS HBy H 1 3.099 0.004 A 11 CYS HBx H 1 2.867 0.007 A 11 CYS C C 13 171.660 0.000 A 11 CYS CA C 13 53.798 0.000 A 11 CYS CB C 13 45.601 0.076 A 11 CYS N N 15 119.587 0.008 A 12 SER H H 1 8.939 0.008 A 12 SER HA H 1 5.048 0.005 A 12 SER HBy H 1 3.809 0.000 A 12 SER HBx H 1 3.679 0.003 A 12 SER CA C 13 52.964 0.025 A 12 SER CB C 13 65.012 0.074 A 12 SER N N 15 114.807 0.029 A 13 PRO HA H 1 3.988 0.007 A 13 PRO HBy H 1 2.122 0.005 A 13 PRO HBx H 1 1.907 0.001 A 13 PRO HDy H 1 3.839 0.001 A 13 PRO HDx H 1 3.733 0.001 A 13 PRO HGy H 1 1.973 0.008 A 13 PRO HGx H 1 1.619 0.006 A 13 PRO C C 13 176.960 0.000 A 13 PRO CA C 13 64.334 0.027 A 13 PRO CB C 13 32.124 0.035 A 13 PRO CD C 13 51.279 0.026 A 13 PRO CG C 13 27.826 0.063 A 14 LYS H H 1 7.547 0.004 A 14 LYS HA H 1 4.157 0.005 A 14 LYS HBy H 1 1.779 0.003 A 14 LYS HBx H 1 1.596 0.009 A 14 LYS HDx H 1 1.604 0.000 A 14 LYS HDy H 1 1.604 0.000 A 14 LYS HEx H 1 2.944 0.006 A 14 LYS HEy H 1 2.944 0.006 A 14 LYS HGy H 1 1.384 0.004 A 14 LYS HGx H 1 1.319 0.001 A 14 LYS C C 13 176.142 0.000 A 14 LYS CA C 13 56.979 0.075 A 14 LYS CB C 13 32.513 0.058 A 14 LYS CD C 13 28.529 0.000 A 14 LYS CE C 13 42.067 0.000 A 14 LYS CG C 13 24.798 0.000 A 14 LYS N N 15 114.849 0.017 A 15 ASN H H 1 7.159 0.004 A 15 ASN HA H 1 4.693 0.001 A 15 ASN HBy H 1 2.665 0.007 A 15 ASN HBx H 1 2.557 0.003 A 15 ASN HD2y H 1 7.491 0.003 A 15 ASN HD2x H 1 6.819 0.001 A 15 ASN C C 13 173.566 0.000 A 15 ASN CA C 13 52.521 0.000 A 15 ASN CB C 13 38.098 0.093 A 15 ASN N N 15 118.201 0.019 A 15 ASN ND2 N 15 110.837 0.016 A 16 ASP H H 1 8.509 0.002 A 16 ASP HA H 1 4.343 0.002 A 16 ASP HBy H 1 3.014 0.002 A 16 ASP HBx H 1 2.488 0.003 A 16 ASP C C 13 177.377 0.000 A 16 ASP CA C 13 55.620 0.100 A 16 ASP CB C 13 41.408 0.066 A 16 ASP N N 15 124.159 0.021 A 17 LYS H H 1 8.068 0.003 A 17 LYS HA H 1 4.628 0.003 A 17 LYS HBy H 1 2.361 0.003 A 17 LYS HBx H 1 1.582 0.005 A 17 LYS HDx H 1 1.624 0.006 A 17 LYS HDy H 1 1.624 0.006 A 17 LYS HEx H 1 2.878 0.000 A 17 LYS HEy H 1 2.878 0.000 A 17 LYS HGy H 1 1.486 0.001 A 17 LYS HGx H 1 1.375 0.002 A 17 LYS C C 13 177.176 0.000 A 17 LYS CA C 13 54.318 0.000 A 17 LYS CB C 13 31.352 0.016 A 17 LYS CD C 13 28.874 0.000 A 17 LYS CE C 13 42.157 0.000 A 17 LYS CG C 13 24.413 0.023 A 17 LYS N N 15 127.999 0.021 A 18 CYS H H 1 9.373 0.002 A 18 CYS HA H 1 5.004 0.006 A 18 CYS HBx H 1 2.983 0.006 A 18 CYS HBy H 1 2.983 0.006 A 18 CYS C C 13 175.894 0.000 A 18 CYS CA C 13 57.006 0.037 A 18 CYS CB C 13 39.382 0.047 A 18 CYS N N 15 121.594 0.029 A 19 CYS H H 1 9.888 0.003 A 19 CYS HA H 1 4.794 0.001 A 19 CYS HBy H 1 3.599 0.008 A 19 CYS HBx H 1 2.567 0.007 A 19 CYS CA C 13 54.014 0.000 A 19 CYS CB C 13 38.504 0.039 A 19 CYS N N 15 123.013 0.012 A 20 PRO HA H 1 4.306 0.001 A 20 PRO HBy H 1 2.345 0.004 A 20 PRO HBx H 1 1.832 0.003 A 20 PRO HDy H 1 3.977 0.003 A 20 PRO HDx H 1 3.705 0.009 A 20 PRO HGy H 1 2.092 0.005 A 20 PRO HGx H 1 2.031 0.001 A 20 PRO C C 13 176.557 0.000 A 20 PRO CA C 13 65.634 0.011 A 20 PRO CB C 13 31.911 0.000 A 20 PRO CD C 13 50.852 0.081 A 20 PRO CG C 13 27.704 0.042 A 21 ASN H H 1 8.165 0.005 A 21 ASN HA H 1 4.370 0.009 A 21 ASN HBx H 1 2.517 0.002 A 21 ASN HBy H 1 2.517 0.002 A 21 ASN HD2y H 1 7.318 0.001 A 21 ASN HD2x H 1 6.810 0.010 A 21 ASN C C 13 173.630 0.000 A 21 ASN CA C 13 54.808 0.000 A 21 ASN CB C 13 37.200 0.000 A 21 ASN N N 15 113.181 0.032 A 21 ASN ND2 N 15 112.015 0.015 A 22 TYR H H 1 8.835 0.001 A 22 TYR HA H 1 5.341 0.006 A 22 TYR HBy H 1 3.058 0.002 A 22 TYR HBx H 1 2.913 0.007 A 22 TYR HDx H 1 6.795 0.008 A 22 TYR HDy H 1 6.795 0.008 A 22 TYR HEx H 1 6.717 0.008 A 22 TYR HEy H 1 6.717 0.008 A 22 TYR C C 13 173.668 0.000 A 22 TYR CA C 13 55.742 0.072 A 22 TYR CB C 13 42.036 0.055 A 22 TYR CD1 C 13 132.436 0.046 A 22 TYR CD2 C 13 132.436 0.046 A 22 TYR CE1 C 13 118.249 0.020 A 22 TYR CE2 C 13 118.249 0.020 A 22 TYR N N 15 119.029 0.027 A 23 LYS H H 1 9.100 0.007 A 23 LYS HA H 1 4.566 0.006 A 23 LYS HBx H 1 1.603 0.003 A 23 LYS HBy H 1 1.603 0.003 A 23 LYS HDx H 1 1.665 0.001 A 23 LYS HDy H 1 1.665 0.001 A 23 LYS HEx H 1 2.996 0.002 A 23 LYS HEy H 1 2.996 0.002 A 23 LYS HGy H 1 1.394 0.008 A 23 LYS HGx H 1 1.298 0.000 A 23 LYS C C 13 175.931 0.000 A 23 LYS CA C 13 54.961 0.015 A 23 LYS CB C 13 37.073 0.045 A 23 LYS CD C 13 29.309 0.011 A 23 LYS CE C 13 42.229 0.000 A 23 LYS CG C 13 24.858 0.002 A 23 LYS N N 15 118.345 0.032 A 24 CYS H H 1 10.415 0.006 A 24 CYS HA H 1 4.383 0.009 A 24 CYS HBx H 1 2.496 0.004 A 24 CYS HBy H 1 3.130 0.005 A 24 CYS C C 13 174.442 0.000 A 24 CYS CA C 13 56.790 0.027 A 24 CYS CB C 13 38.456 0.040 A 24 CYS N N 15 129.728 0.008 A 25 SER H H 1 7.762 0.005 A 25 SER HA H 1 4.439 0.003 A 25 SER HBx H 1 3.716 0.004 A 25 SER HBy H 1 3.936 0.010 A 25 SER C C 13 176.008 0.000 A 25 SER CA C 13 57.164 0.044 A 25 SER CB C 13 63.608 0.091 A 25 SER N N 15 124.172 0.025 A 26 SER H H 1 8.945 0.006 A 26 SER HA H 1 3.988 0.002 A 26 SER HBy H 1 3.916 0.001 A 26 SER HBx H 1 3.838 0.001 A 26 SER C C 13 174.166 0.000 A 26 SER CA C 13 61.181 0.023 A 26 SER CB C 13 62.709 0.045 A 26 SER N N 15 125.468 0.023 A 27 LYS H H 1 7.645 0.010 A 27 LYS HA H 1 4.183 0.003 A 27 LYS HBy H 1 1.639 0.007 A 27 LYS HBx H 1 1.498 0.001 A 27 LYS HDx H 1 1.554 0.000 A 27 LYS HDy H 1 1.554 0.000 A 27 LYS HEx H 1 2.930 0.000 A 27 LYS HEy H 1 2.930 0.000 A 27 LYS HGy H 1 1.310 0.000 A 27 LYS HGx H 1 1.238 0.001 A 27 LYS C C 13 176.882 0.000 A 27 LYS CA C 13 57.681 0.056 A 27 LYS CB C 13 33.562 0.032 A 27 LYS CD C 13 28.900 0.000 A 27 LYS CE C 13 41.993 0.000 A 27 LYS CG C 13 24.550 0.000 A 27 LYS N N 15 119.237 0.024 A 28 ASP H H 1 7.329 0.009 A 28 ASP HA H 1 4.413 0.007 A 28 ASP HBy H 1 1.686 0.015 A 28 ASP HBx H 1 1.413 0.012 A 28 ASP C C 13 174.746 0.000 A 28 ASP CA C 13 54.743 0.069 A 28 ASP CB C 13 41.719 0.053 A 28 ASP N N 15 114.522 0.013 A 29 LEU H H 1 8.053 0.003 A 29 LEU HA H 1 3.879 0.008 A 29 LEU HBy H 1 2.053 0.000 A 29 LEU HBx H 1 1.906 0.000 A 29 LEU HDx% H 1 0.880 0.006 A 29 LEU HDy% H 1 0.869 0.006 A 29 LEU HG H 1 1.311 0.001 A 29 LEU C C 13 176.075 0.000 A 29 LEU CA C 13 55.935 0.088 A 29 LEU CB C 13 37.259 0.000 A 29 LEU CDy C 13 25.565 0.000 A 29 LEU CDx C 13 23.560 0.021 A 29 LEU CG C 13 27.086 0.032 A 29 LEU N N 15 113.893 0.010 A 30 TRP H H 1 6.711 0.005 A 30 TRP HA H 1 5.586 0.002 A 30 TRP HBy H 1 2.913 0.000 A 30 TRP HBx H 1 2.415 0.005 A 30 TRP HD1 H 1 6.848 0.002 A 30 TRP HE1 H 1 10.108 0.003 A 30 TRP HE3 H 1 7.123 0.009 A 30 TRP HH2 H 1 7.151 0.004 A 30 TRP HZ2 H 1 7.367 0.005 A 30 TRP HZ3 H 1 6.722 0.011 A 30 TRP C C 13 177.923 0.000 A 30 TRP CA C 13 55.516 0.077 A 30 TRP CB C 13 31.705 0.076 A 30 TRP CD1 C 13 127.985 0.038 A 30 TRP CE3 C 13 122.069 0.000 A 30 TRP CH2 C 13 124.342 0.000 A 30 TRP CZ2 C 13 114.123 0.036 A 30 TRP CZ3 C 13 121.411 0.000 A 30 TRP N N 15 110.801 0.026 A 30 TRP NE1 N 15 129.321 0.021 A 31 CYS H H 1 8.261 0.007 A 31 CYS HA H 1 4.600 0.012 A 31 CYS HBy H 1 2.986 0.009 A 31 CYS HBx H 1 2.530 0.009 A 31 CYS C C 13 173.882 0.000 A 31 CYS CA C 13 55.065 0.000 A 31 CYS CB C 13 39.110 0.016 A 31 CYS N N 15 117.961 0.012 A 32 LYS H H 1 8.492 0.005 A 32 LYS HA H 1 4.885 0.004 A 32 LYS HBy H 1 1.992 0.001 A 32 LYS HBx H 1 1.762 0.006 A 32 LYS HDy H 1 1.530 0.001 A 32 LYS HDx H 1 1.421 0.006 A 32 LYS HEy H 1 2.465 0.006 A 32 LYS HEx H 1 2.334 0.005 A 32 LYS HGy H 1 1.216 0.005 A 32 LYS HGx H 1 1.010 0.001 A 32 LYS C C 13 176.275 0.000 A 32 LYS CA C 13 55.072 0.000 A 32 LYS CB C 13 35.700 0.000 A 32 LYS CD C 13 29.572 0.030 A 32 LYS CE C 13 41.751 0.004 A 32 LYS CG C 13 25.129 0.011 A 32 LYS N N 15 125.139 0.043 A 33 TYR H H 1 8.457 0.002 A 33 TYR HA H 1 4.482 0.007 A 33 TYR HBy H 1 3.130 0.006 A 33 TYR HBx H 1 2.898 0.010 A 33 TYR HDx H 1 7.101 0.007 A 33 TYR HDy H 1 7.101 0.007 A 33 TYR HEx H 1 6.620 0.002 A 33 TYR HEy H 1 6.620 0.002 A 33 TYR C C 13 176.789 0.000 A 33 TYR CA C 13 60.215 0.099 A 33 TYR CB C 13 38.515 0.061 A 33 TYR CD1 C 13 133.099 0.046 A 33 TYR CD2 C 13 133.099 0.046 A 33 TYR CE1 C 13 118.488 0.024 A 33 TYR CE2 C 13 118.488 0.024 A 33 TYR N N 15 120.544 0.026 A 34 LYS H H 1 8.298 0.005 A 34 LYS HA H 1 3.952 0.006 A 34 LYS HBy H 1 1.456 0.001 A 34 LYS HBx H 1 1.375 0.001 A 34 LYS HDy H 1 1.446 0.001 A 34 LYS HDx H 1 1.398 0.001 A 34 LYS HEy H 1 2.729 0.000 A 34 LYS HEx H 1 2.624 0.001 A 34 LYS HGx H 1 0.963 0.007 A 34 LYS HGy H 1 0.963 0.007 A 34 LYS C C 13 175.064 0.000 A 34 LYS CA C 13 57.323 0.044 A 34 LYS CB C 13 33.098 0.037 A 34 LYS CD C 13 29.583 0.000 A 34 LYS CE C 13 41.949 0.000 A 34 LYS CG C 13 25.229 0.015 A 34 LYS N N 15 124.857 0.011 A 35 ILE H H 1 7.799 0.007 A 35 ILE HA H 1 4.099 0.001 A 35 ILE HB H 1 1.768 0.004 A 35 ILE HD1% H 1 0.814 0.001 A 35 ILE HG1y H 1 1.347 0.001 A 35 ILE HG1x H 1 1.076 0.000 A 35 ILE HG2% H 1 0.811 0.001 A 35 ILE C C 13 174.942 0.000 A 35 ILE CA C 13 60.978 0.020 A 35 ILE CB C 13 38.730 0.007 A 35 ILE CD1 C 13 12.882 0.000 A 35 ILE CG1 C 13 27.072 0.062 A 35 ILE CG2 C 13 17.515 0.000 A 35 ILE N N 15 121.753 0.027 A 36 TRP H H 1 7.701 0.003 A 36 TRP HA H 1 4.463 0.001 A 36 TRP HBy H 1 3.299 0.000 A 36 TRP HBx H 1 3.140 0.002 A 36 TRP HD1 H 1 7.204 0.003 A 36 TRP HE1 H 1 10.057 0.003 A 36 TRP HE3 H 1 7.655 0.004 A 36 TRP HH2 H 1 7.150 0.000 A 36 TRP HZ2 H 1 7.471 0.002 A 36 TRP HZ3 H 1 7.133 0.011 A 36 TRP CA C 13 58.606 0.048 A 36 TRP CB C 13 30.261 0.021 A 36 TRP CD1 C 13 127.042 0.007 A 36 TRP CE3 C 13 122.131 0.000 A 36 TRP CH2 C 13 124.342 0.000 A 36 TRP CZ2 C 13 114.667 0.001 A 36 TRP CZ3 C 13 121.110 0.000 A 36 TRP N N 15 130.135 0.005 A 36 TRP NE1 N 15 128.753 0.009 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _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 SER HA A 1 SER HBx 1.0 . 2.57 2 1 A 1 SER HA A 1 SER HBy 1.0 . 2.57 3 2 A 5 LEU HA A 5 LEU HDx% 1.0 . 4.05 4 3 A 5 LEU HA A 5 LEU HDy% 1.0 . 3.19 5 4 A 5 LEU HDx% A 5 LEU HBy 1.0 . 3.91 6 5 A 5 LEU HDx% A 5 LEU HBx 1.0 . 3.94 7 6 A 5 LEU HDy% A 5 LEU HBx 1.0 . 3.88 8 7 A 9 SER HA A 9 SER HBx 1.0 . 2.94 9 7 A 9 SER HA A 9 SER HBy 1.0 . 2.94 10 8 A 10 ARG HBy A 10 ARG HGy 1.0 . 2.81 11 8 A 10 ARG HGy A 10 ARG HBx 1.0 . 2.81 12 9 A 10 ARG HBx A 10 ARG HGx 1.0 . 2.81 13 9 A 10 ARG HBy A 10 ARG HGx 1.0 . 2.81 14 10 A 17 LYS HA A 17 LYS HDx 1.0 . 4.56 15 10 A 17 LYS HA A 17 LYS HDy 1.0 . 4.56 16 11 A 23 LYS HA A 23 LYS HGy 1.0 . 4.16 17 12 A 23 LYS HA A 23 LYS HGx 1.0 . 4.16 18 13 A 23 LYS HA A 23 LYS HDx 1.0 . 3.26 19 13 A 23 LYS HA A 23 LYS HDy 1.0 . 3.26 20 14 A 23 LYS HBy A 23 LYS HDx 1.0 . 2.40 21 14 A 23 LYS HDy A 23 LYS HBx 1.0 . 2.40 22 14 A 23 LYS HDy A 23 LYS HBy 1.0 . 2.40 23 14 A 23 LYS HBx A 23 LYS HDx 1.0 . 2.40 24 15 A 23 LYS HBx A 23 LYS HEx 1.0 . 3.87 25 15 A 23 LYS HBy A 23 LYS HEx 1.0 . 3.87 26 15 A 23 LYS HEy A 23 LYS HBx 1.0 . 3.87 27 15 A 23 LYS HBy A 23 LYS HEy 1.0 . 3.87 28 16 A 27 LYS HA A 27 LYS HGy 1.0 . 3.94 29 17 A 27 LYS HA A 27 LYS HGx 1.0 . 3.94 30 18 A 27 LYS HA A 27 LYS HDx 1.0 . 3.45 31 18 A 27 LYS HA A 27 LYS HDy 1.0 . 3.45 32 19 A 27 LYS HBy A 27 LYS HDx 1.0 . 2.43 33 19 A 27 LYS HDy A 27 LYS HBy 1.0 . 2.43 34 20 A 27 LYS HBx A 27 LYS HDx 1.0 . 3.32 35 20 A 27 LYS HDy A 27 LYS HBx 1.0 . 3.32 36 21 A 27 LYS HBy A 27 LYS HEx 1.0 . 4.05 37 21 A 27 LYS HBy A 27 LYS HEy 1.0 . 4.05 38 22 A 29 LEU HA A 29 LEU HG 1.0 . 3.81 39 23 A 29 LEU HA A 29 LEU HDy% 1.0 . 3.03 40 24 A 29 LEU HDx% A 29 LEU HBy 1.0 . 3.85 41 25 A 29 LEU HDx% A 29 LEU HBx 1.0 . 3.85 42 26 A 29 LEU HDy% A 29 LEU HBy 1.0 . 3.84 43 27 A 29 LEU HDy% A 29 LEU HBx 1.0 . 3.84 44 28 A 34 LYS HA A 34 LYS HGx 1.0 . 3.34 45 28 A 34 LYS HA A 34 LYS HGy 1.0 . 3.34 46 29 A 35 ILE HA A 35 ILE HG1y 1.0 . 4.21 47 30 A 35 ILE HA A 35 ILE HG1x 1.0 . 4.21 48 31 A 35 ILE HA A 35 ILE HG2% 1.0 . 3.26 49 32 A 35 ILE HB A 35 ILE HD1% 1.0 . 3.64 50 33 A 35 ILE HG2% A 35 ILE HG1y 1.0 . 4.17 51 34 A 35 ILE HG2% A 35 ILE HG1x 1.0 . 4.17 52 35 A 5 LEU HBx A 18 CYS HA 1.0 . 4.25 53 36 A 7 TRP HE3 A 7 TRP HBx 1.0 . 4.15 54 36 A 7 TRP HBy A 7 TRP HE3 1.0 . 4.15 55 37 A 8 ALA HA A 30 TRP HE3 1.0 . 3.50 56 38 A 8 ALA HA A 30 TRP HBy 1.0 . 4.42 57 39 A 5 LEU HBy A 9 SER HBx 1.0 . 4.23 58 39 A 5 LEU HBy A 9 SER HBy 1.0 . 4.23 59 40 A 5 LEU HDy% A 9 SER HBx 1.0 . 3.72 60 40 A 5 LEU HDy% A 9 SER HBy 1.0 . 3.72 61 41 A 5 LEU HBx A 9 SER HBx 1.0 . 3.60 62 41 A 5 LEU HBx A 9 SER HBy 1.0 . 3.60 63 42 A 9 SER HA A 10 ARG HBx 1.0 . 5.09 64 42 A 9 SER HA A 10 ARG HBy 1.0 . 5.09 65 43 A 5 LEU HDx% A 11 CYS HBx 1.0 . 3.80 66 44 A 5 LEU HDx% A 11 CYS HBy 1.0 . 3.91 67 45 A 19 CYS HA A 20 PRO HDy 1.0 . 3.66 68 46 A 19 CYS HA A 20 PRO HDx 1.0 . 3.36 69 47 A 20 PRO HDy A 19 CYS HBx 1.0 . 4.14 70 48 A 12 SER HA A 13 PRO HGx 1.0 . 4.75 71 49 A 12 SER HA A 13 PRO HDx 1.0 . 3.10 72 50 A 12 SER HA A 13 PRO HDy 1.0 . 3.10 73 51 A 29 LEU HDy% A 13 PRO HDy 1.0 . 3.64 74 52 A 29 LEU HDy% A 13 PRO HDx 1.0 . 3.64 75 53 A 29 LEU HDy% A 13 PRO HGy 1.0 . 4.97 76 54 A 16 ASP HA A 17 LYS H 1.0 . 2.78 77 55 A 5 LEU HDx% A 17 LYS HBy 1.0 . 4.51 78 56 A 5 LEU HDx% A 17 LYS HBx 1.0 . 4.51 79 57 A 18 CYS HA A 19 CYS H 1.0 . 3.38 80 58 A 5 LEU HBy A 18 CYS HA 1.0 . 3.09 81 59 A 20 PRO HA A 21 ASN H 1.0 . 3.40 82 60 A 22 TYR HA A 33 TYR HA 1.0 . 3.64 83 61 A 22 TYR HA A 35 ILE H 1.0 . 5.22 84 62 A 22 TYR HA A 22 TYR HD% 1.0 . 3.61 85 63 A 22 TYR HBy A 23 LYS H 1.0 . 4.44 86 64 A 23 LYS H A 22 TYR HBx 1.0 . 4.16 87 65 A 23 LYS HBy A 34 LYS HGx 1.0 . 4.20 88 65 A 23 LYS HBx A 34 LYS HGx 1.0 . 4.20 89 65 A 34 LYS HGy A 23 LYS HBx 1.0 . 4.20 90 65 A 23 LYS HBy A 34 LYS HGy 1.0 . 4.20 91 66 A 25 SER HBx A 32 LYS HDx 1.0 . 4.58 92 67 A 25 SER HBx A 32 LYS HGx 1.0 . 4.31 93 68 A 27 LYS HBy A 25 SER HA 1.0 . 4.67 94 69 A 13 PRO HGx A 26 SER HA 1.0 . 4.20 95 70 A 29 LEU HDy% A 26 SER HA 1.0 . 3.54 96 71 A 27 LYS HA A 29 LEU H 1.0 . 4.26 97 72 A 29 LEU HDy% A 12 SER HA 1.0 . 4.29 98 73 A 29 LEU HA A 28 ASP H 1.0 . 4.59 99 74 A 11 CYS H A 30 TRP HA 1.0 . 3.45 100 75 A 30 TRP HE3 A 30 TRP HA 1.0 . 4.81 101 76 A 30 TRP HA A 10 ARG HA 1.0 . 3.17 102 77 A 30 TRP HA A 25 SER HBy 1.0 . 5.22 103 78 A 30 TRP HA A 10 ARG HBx 1.0 . 4.40 104 78 A 10 ARG HBy A 30 TRP HA 1.0 . 4.40 105 79 A 33 TYR HA A 33 TYR HD% 1.0 . 4.08 106 80 A 34 LYS HA A 23 LYS HBx 1.0 . 3.81 107 80 A 23 LYS HBy A 34 LYS HA 1.0 . 3.81 108 81 A 36 TRP H A 36 TRP HBy 1.0 . 3.96 109 82 A 14 LYS HA A 14 LYS HGy 1.0 . 3.93 110 83 A 14 LYS HA A 14 LYS HGx 1.0 . 3.93 111 84 A 10 ARG HA A 30 TRP HBx 1.0 . 4.59 112 85 A 19 CYS HA A 4 CYS HBx 1.0 . 3.55 113 85 A 19 CYS HA A 4 CYS HBy 1.0 . 3.55 114 86 A 20 PRO HDx A 19 CYS HBx 1.0 . 4.67 115 87 A 20 PRO HDy A 19 CYS HBy 1.0 . 3.90 116 88 A 20 PRO HDx A 19 CYS HBy 1.0 . 4.82 117 89 A 19 CYS H A 4 CYS HBx 1.0 . 4.84 118 89 A 19 CYS H A 4 CYS HBy 1.0 . 4.84 119 90 A 22 TYR HBy A 18 CYS HBx 1.0 . 3.90 120 90 A 22 TYR HBy A 18 CYS HBy 1.0 . 3.90 121 91 A 22 TYR HBy A 31 CYS HBx 1.0 . 4.29 122 92 A 22 TYR HBx A 31 CYS HBx 1.0 . 3.12 123 93 A 19 CYS HA A 18 CYS HBx 1.0 . 4.73 124 93 A 19 CYS HA A 18 CYS HBy 1.0 . 4.73 125 94 A 22 TYR HA A 31 CYS HBx 1.0 . 5.50 126 95 A 5 LEU HBy A 18 CYS HBx 1.0 . 4.61 127 95 A 5 LEU HBy A 18 CYS HBy 1.0 . 4.61 128 96 A 30 TRP HA A 24 CYS HA 1.0 . 5.33 129 97 A 30 TRP HBy A 10 ARG HA 1.0 . 5.00 130 98 A 30 TRP HBy A 8 ALA HB% 1.0 . 5.50 131 99 A 30 TRP HBx A 31 CYS H 1.0 . 4.73 132 100 A 25 SER HBx A 32 LYS HDy 1.0 . 4.58 133 101 A 25 SER HBx A 30 TRP H 1.0 . 4.91 134 102 A 25 SER HBy A 24 CYS HA 1.0 . 4.56 135 103 A 32 LYS HGx A 25 SER HBy 1.0 . 4.67 136 104 A 27 LYS HBy A 25 SER HBy 1.0 . 5.50 137 105 A 25 SER HBy A 28 ASP HBy 1.0 . 5.50 138 106 A 25 SER HBx A 28 ASP HBy 1.0 . 5.28 139 107 A 27 LYS HA A 26 SER HBy 1.0 . 4.56 140 108 A 27 LYS HA A 26 SER HBx 1.0 . 5.24 141 109 A 26 SER HBx A 27 LYS H 1.0 . 4.73 142 110 A 27 LYS HBy A 26 SER HBy 1.0 . 5.35 143 111 A 13 PRO HGy A 26 SER HBx 1.0 . 4.87 144 112 A 26 SER HBx A 13 PRO HBx 1.0 . 4.97 145 113 A 13 PRO HGx A 26 SER HBx 1.0 . 4.98 146 114 A 13 PRO HGx A 26 SER HBy 1.0 . 4.97 147 115 A 26 SER HBy A 13 PRO HBx 1.0 . 5.08 148 116 A 7 TRP HA A 22 TYR HE% 1.0 . 4.59 149 117 A 7 TRP HA A 7 TRP HD1 1.0 . 4.45 150 118 A 7 TRP HE3 A 7 TRP HA 1.0 . 4.78 151 119 A 20 PRO HDx A 4 CYS HBx 1.0 . 4.43 152 119 A 20 PRO HDx A 4 CYS HBy 1.0 . 4.43 153 120 A 20 PRO HDy A 4 CYS HBx 1.0 . 4.72 154 120 A 20 PRO HDy A 4 CYS HBy 1.0 . 4.72 155 121 A 24 CYS HA A 32 LYS H 1.0 . 4.02 156 122 A 26 SER HA A 13 PRO HBx 1.0 . 4.34 157 123 A 26 SER HA A 26 SER HBx 1.0 . 2.85 158 124 A 26 SER HA A 29 LEU H 1.0 . 4.94 159 125 A 5 LEU HDx% A 17 LYS HEx 1.0 . 5.08 160 125 A 5 LEU HDx% A 17 LYS HEy 1.0 . 5.08 161 126 A 5 LEU HDx% A 9 SER HBx 1.0 . 4.43 162 126 A 5 LEU HDx% A 9 SER HBy 1.0 . 4.43 163 127 A 5 LEU HDx% A 11 CYS HA 1.0 . 4.62 164 128 A 5 LEU HDy% A 18 CYS HA 1.0 . 4.97 165 129 A 29 LEU HDy% A 13 PRO HGx 1.0 . 4.63 166 130 A 5 LEU HG A 9 SER HBx 1.0 . 5.00 167 130 A 9 SER HBy A 5 LEU HG 1.0 . 5.00 168 131 A 31 CYS HBx A 24 CYS H 1.0 . 5.08 169 132 A 3 ASP H A 3 ASP HBy 1.0 . 3.96 170 133 A 3 ASP H A 3 ASP HBx 1.0 . 3.96 171 134 A 4 CYS H A 4 CYS HBx 1.0 . 3.23 172 134 A 4 CYS HBy A 4 CYS H 1.0 . 3.23 173 135 A 5 LEU HBy A 5 LEU H 1.0 . 3.23 174 136 A 5 LEU HBx A 5 LEU H 1.0 . 3.91 175 137 A 5 LEU HG A 5 LEU H 1.0 . 3.00 176 138 A 5 LEU HDx% A 5 LEU H 1.0 . 4.13 177 139 A 5 LEU HDy% A 5 LEU H 1.0 . 4.03 178 140 A 7 TRP H A 7 TRP HBx 1.0 . 2.71 179 140 A 7 TRP HBy A 7 TRP H 1.0 . 2.71 180 141 A 8 ALA HB% A 8 ALA H 1.0 . 3.64 181 142 A 9 SER H A 9 SER HBx 1.0 . 2.76 182 142 A 9 SER HBy A 9 SER H 1.0 . 2.76 183 143 A 10 ARG H A 10 ARG HDy 1.0 . 5.09 184 144 A 10 ARG H A 10 ARG HDx 1.0 . 5.09 185 145 A 10 ARG H A 10 ARG HBx 1.0 . 2.70 186 145 A 10 ARG HBy A 10 ARG H 1.0 . 2.70 187 146 A 11 CYS HBx A 11 CYS H 1.0 . 3.73 188 147 A 12 SER H A 12 SER HBy 1.0 . 3.66 189 148 A 12 SER H A 12 SER HBx 1.0 . 3.66 190 149 A 14 LYS H A 14 LYS HEx 1.0 . 5.50 191 149 A 14 LYS H A 14 LYS HEy 1.0 . 5.50 192 150 A 15 ASN H A 15 ASN HBy 1.0 . 3.84 193 151 A 15 ASN H A 15 ASN HBx 1.0 . 3.84 194 152 A 16 ASP H A 16 ASP HBy 1.0 . 3.06 195 153 A 16 ASP H A 16 ASP HBx 1.0 . 3.06 196 154 A 17 LYS H A 17 LYS HBy 1.0 . 3.87 197 155 A 17 LYS H A 17 LYS HBx 1.0 . 3.87 198 156 A 17 LYS H A 17 LYS HGy 1.0 . 4.60 199 157 A 17 LYS H A 17 LYS HGx 1.0 . 4.60 200 158 A 17 LYS H A 17 LYS HDx 1.0 . 3.63 201 158 A 17 LYS HDy A 17 LYS H 1.0 . 3.63 202 159 A 18 CYS H A 18 CYS HBx 1.0 . 3.00 203 159 A 18 CYS HBy A 18 CYS H 1.0 . 3.00 204 160 A 21 ASN H A 21 ASN HA 1.0 . 2.94 205 161 A 21 ASN H A 21 ASN HBx 1.0 . 3.48 206 161 A 21 ASN H A 21 ASN HBy 1.0 . 3.48 207 162 A 22 TYR HBy A 22 TYR H 1.0 . 3.85 208 163 A 22 TYR HBx A 22 TYR H 1.0 . 4.09 209 164 A 23 LYS H A 23 LYS HGy 1.0 . 5.25 210 165 A 23 LYS H A 23 LYS HGx 1.0 . 5.25 211 166 A 23 LYS H A 23 LYS HBx 1.0 . 3.18 212 166 A 23 LYS HBy A 23 LYS H 1.0 . 3.18 213 167 A 23 LYS H A 23 LYS HDx 1.0 . 4.48 214 167 A 23 LYS HDy A 23 LYS H 1.0 . 4.48 215 168 A 23 LYS H A 31 CYS HBx 1.0 . 4.03 216 169 A 24 CYS H A 24 CYS HBx 1.0 . 3.37 217 170 A 24 CYS H A 24 CYS HBy 1.0 . 3.37 218 171 A 25 SER HBy A 25 SER H 1.0 . 2.96 219 172 A 25 SER HBx A 25 SER H 1.0 . 3.17 220 173 A 26 SER HBx A 26 SER H 1.0 . 3.75 221 174 A 26 SER HBy A 26 SER H 1.0 . 3.71 222 175 A 27 LYS HBy A 27 LYS H 1.0 . 3.27 223 176 A 27 LYS HBx A 27 LYS H 1.0 . 3.56 224 177 A 27 LYS H A 27 LYS HDx 1.0 . 3.67 225 177 A 27 LYS HDy A 27 LYS H 1.0 . 3.67 226 178 A 28 ASP H A 28 ASP HBy 1.0 . 3.34 227 179 A 28 ASP H A 28 ASP HBx 1.0 . 3.50 228 180 A 29 LEU HA A 29 LEU H 1.0 . 2.76 229 181 A 29 LEU HG A 29 LEU H 1.0 . 3.66 230 182 A 29 LEU HDy% A 29 LEU H 1.0 . 3.27 231 183 A 31 CYS H A 31 CYS HBy 1.0 . 4.14 232 184 A 32 LYS H A 32 LYS HBy 1.0 . 4.12 233 185 A 32 LYS H A 32 LYS HBx 1.0 . 4.12 234 186 A 32 LYS HGx A 32 LYS H 1.0 . 4.65 235 187 A 32 LYS H A 32 LYS HGy 1.0 . 4.71 236 188 A 33 TYR H A 33 TYR HBy 1.0 . 3.81 237 189 A 33 TYR H A 33 TYR HBx 1.0 . 3.81 238 190 A 34 LYS H A 34 LYS HBy 1.0 . 3.35 239 191 A 34 LYS H A 34 LYS HBx 1.0 . 3.35 240 192 A 34 LYS H A 34 LYS HGx 1.0 . 3.94 241 192 A 34 LYS HGy A 34 LYS H 1.0 . 3.94 242 193 A 35 ILE HB A 35 ILE H 1.0 . 3.62 243 194 A 35 ILE H A 34 LYS HBx 1.0 . 4.13 244 195 A 35 ILE H A 35 ILE HG1y 1.0 . 4.11 245 196 A 35 ILE H A 35 ILE HG1x 1.0 . 4.11 246 197 A 36 TRP H A 36 TRP HBx 1.0 . 3.96 247 198 A 33 TYR HD% A 33 TYR H 1.0 . 4.68 248 199 A 3 ASP H A 2 GLU HBy 1.0 . 4.73 249 200 A 3 ASP H A 2 GLU HBx 1.0 . 4.73 250 201 A 3 ASP H A 2 GLU HA 1.0 . 2.94 251 202 A 4 CYS H A 3 ASP HA 1.0 . 3.02 252 203 A 3 ASP H A 4 CYS H 1.0 . 4.15 253 204 A 19 CYS H A 5 LEU H 1.0 . 4.09 254 205 A 7 TRP H A 8 ALA H 1.0 . 4.45 255 206 A 8 ALA H A 9 SER H 1.0 . 3.38 256 207 A 9 SER H A 10 ARG H 1.0 . 4.78 257 208 A 11 CYS H A 12 SER H 1.0 . 4.81 258 209 A 8 ALA H A 30 TRP HZ3 1.0 . 5.50 259 210 A 22 TYR HE% A 7 TRP H 1.0 . 4.36 260 211 A 12 SER HA A 14 LYS H 1.0 . 4.52 261 212 A 11 CYS HA A 12 SER H 1.0 . 3.52 262 213 A 11 CYS H A 10 ARG HA 1.0 . 3.12 263 214 A 5 LEU H A 4 CYS HA 1.0 . 3.15 264 215 A 5 LEU HA A 6 GLY H 1.0 . 2.70 265 216 A 9 SER HA A 10 ARG H 1.0 . 2.65 266 217 A 10 ARG H A 9 SER HBx 1.0 . 3.27 267 217 A 9 SER HBy A 10 ARG H 1.0 . 3.27 268 218 A 16 ASP HA A 12 SER H 1.0 . 4.53 269 219 A 7 TRP H A 6 GLY HAx 1.0 . 3.19 270 220 A 7 TRP H A 6 GLY HAy 1.0 . 3.19 271 221 A 8 ALA H A 9 SER HBx 1.0 . 4.76 272 221 A 9 SER HBy A 8 ALA H 1.0 . 4.76 273 222 A 29 LEU HA A 11 CYS H 1.0 . 4.79 274 223 A 11 CYS HBy A 12 SER H 1.0 . 3.13 275 224 A 11 CYS HBx A 12 SER H 1.0 . 4.17 276 225 A 8 ALA H A 7 TRP HBx 1.0 . 4.14 277 225 A 7 TRP HBy A 8 ALA H 1.0 . 4.14 278 226 A 5 LEU H A 18 CYS HBx 1.0 . 4.95 279 226 A 18 CYS HBy A 5 LEU H 1.0 . 4.95 280 227 A 5 LEU H A 4 CYS HBx 1.0 . 3.01 281 227 A 4 CYS HBy A 5 LEU H 1.0 . 3.01 282 228 A 7 TRP HA A 8 ALA H 1.0 . 3.50 283 229 A 7 TRP HA A 9 SER H 1.0 . 4.55 284 230 A 4 CYS H A 3 ASP HBy 1.0 . 4.59 285 231 A 4 CYS H A 3 ASP HBx 1.0 . 4.59 286 232 A 11 CYS H A 10 ARG HBx 1.0 . 3.31 287 232 A 10 ARG HBy A 11 CYS H 1.0 . 3.31 288 233 A 5 LEU HBy A 6 GLY H 1.0 . 4.36 289 234 A 5 LEU HBx A 6 GLY H 1.0 . 3.90 290 235 A 5 LEU HDy% A 6 GLY H 1.0 . 3.80 291 236 A 8 ALA HB% A 9 SER H 1.0 . 3.89 292 237 A 29 LEU HDx% A 11 CYS H 1.0 . 5.47 293 238 A 29 LEU HDy% A 11 CYS H 1.0 . 5.50 294 239 A 5 LEU HDx% A 12 SER H 1.0 . 5.23 295 240 A 24 CYS H A 25 SER H 1.0 . 4.85 296 241 A 15 ASN H A 16 ASP H 1.0 . 3.50 297 242 A 17 LYS H A 18 CYS H 1.0 . 3.30 298 243 A 21 ASN H A 22 TYR H 1.0 . 3.21 299 244 A 23 LYS H A 32 LYS H 1.0 . 3.52 300 245 A 25 SER H A 26 SER H 1.0 . 4.65 301 246 A 27 LYS H A 26 SER H 1.0 . 3.31 302 247 A 14 LYS H A 15 ASN H 1.0 . 2.81 303 248 A 28 ASP H A 27 LYS H 1.0 . 3.08 304 249 A 30 TRP H A 25 SER H 1.0 . 3.62 305 250 A 22 TYR HD% A 22 TYR H 1.0 . 3.92 306 251 A 22 TYR HA A 23 LYS H 1.0 . 2.98 307 252 A 16 ASP H A 15 ASN HA 1.0 . 2.94 308 253 A 16 ASP H A 13 PRO HA 1.0 . 4.79 309 254 A 34 LYS HA A 23 LYS H 1.0 . 5.04 310 255 A 23 LYS HA A 24 CYS H 1.0 . 2.95 311 256 A 25 SER H A 31 CYS HA 1.0 . 4.21 312 257 A 25 SER HA A 26 SER H 1.0 . 2.72 313 258 A 25 SER HA A 27 LYS H 1.0 . 4.32 314 259 A 24 CYS HA A 25 SER H 1.0 . 2.81 315 260 A 25 SER HBx A 27 LYS H 1.0 . 4.69 316 261 A 26 SER HBy A 27 LYS H 1.0 . 4.57 317 262 A 20 PRO HDx A 21 ASN H 1.0 . 5.50 318 263 A 25 SER H A 24 CYS HBx 1.0 . 4.81 319 264 A 25 SER H A 24 CYS HBy 1.0 . 4.81 320 265 A 27 LYS HBy A 26 SER H 1.0 . 4.91 321 266 A 22 TYR H A 21 ASN HBx 1.0 . 4.20 322 266 A 21 ASN HBy A 22 TYR H 1.0 . 4.20 323 267 A 23 LYS H A 31 CYS HBy 1.0 . 5.38 324 268 A 21 ASN H A 20 PRO HBy 1.0 . 4.29 325 269 A 21 ASN H A 20 PRO HGy 1.0 . 4.32 326 270 A 21 ASN H A 20 PRO HBx 1.0 . 4.29 327 271 A 18 CYS H A 17 LYS HBy 1.0 . 4.93 328 272 A 5 LEU HBy A 18 CYS H 1.0 . 4.84 329 273 A 18 CYS H A 17 LYS HBx 1.0 . 4.93 330 274 A 15 ASN H A 14 LYS HBy 1.0 . 4.25 331 275 A 15 ASN H A 14 LYS HBx 1.0 . 4.25 332 276 A 16 ASP H A 17 LYS HDx 1.0 . 4.55 333 276 A 17 LYS HDy A 16 ASP H 1.0 . 4.55 334 277 A 15 ASN H A 14 LYS HEx 1.0 . 5.21 335 277 A 14 LYS HEy A 15 ASN H 1.0 . 5.21 336 278 A 24 CYS H A 23 LYS HBx 1.0 . 4.00 337 278 A 23 LYS HBy A 24 CYS H 1.0 . 4.00 338 279 A 23 LYS H A 34 LYS HGx 1.0 . 4.47 339 279 A 34 LYS HGy A 23 LYS H 1.0 . 4.47 340 280 A 5 LEU HDx% A 18 CYS H 1.0 . 4.40 341 281 A 5 LEU HDx% A 17 LYS H 1.0 . 4.17 342 282 A 23 LYS H A 34 LYS H 1.0 . 4.37 343 283 A 35 ILE H A 34 LYS H 1.0 . 4.13 344 284 A 31 CYS H A 9 SER H 1.0 . 3.82 345 285 A 30 TRP HE3 A 31 CYS H 1.0 . 4.57 346 286 A 31 CYS H A 32 LYS H 1.0 . 4.52 347 287 A 31 CYS H A 30 TRP H 1.0 . 4.61 348 288 A 29 LEU H A 28 ASP H 1.0 . 2.99 349 289 A 29 LEU H A 27 LYS H 1.0 . 4.52 350 290 A 28 ASP H A 30 TRP H 1.0 . 4.44 351 291 A 33 TYR HD% A 34 LYS H 1.0 . 4.52 352 292 A 29 LEU H A 30 TRP H 1.0 . 3.43 353 293 A 22 TYR HD% A 32 LYS H 1.0 . 5.50 354 294 A 30 TRP HA A 31 CYS H 1.0 . 2.88 355 295 A 22 TYR HA A 34 LYS H 1.0 . 3.33 356 296 A 33 TYR HA A 34 LYS H 1.0 . 2.91 357 297 A 35 ILE HA A 36 TRP H 1.0 . 2.86 358 298 A 34 LYS HA A 35 ILE H 1.0 . 3.46 359 299 A 34 LYS H A 33 TYR HBy 1.0 . 4.37 360 300 A 34 LYS H A 33 TYR HBx 1.0 . 4.37 361 301 A 32 LYS H A 31 CYS HA 1.0 . 2.97 362 302 A 24 CYS HA A 31 CYS H 1.0 . 4.60 363 303 A 29 LEU HA A 30 TRP H 1.0 . 3.40 364 304 A 25 SER HBy A 30 TRP H 1.0 . 3.41 365 305 A 25 SER HBx A 28 ASP H 1.0 . 4.54 366 306 A 28 ASP H A 25 SER HBy 1.0 . 3.64 367 307 A 29 LEU H A 25 SER HBy 1.0 . 4.19 368 308 A 35 ILE H A 34 LYS HBy 1.0 . 4.13 369 309 A 30 TRP H A 28 ASP HBx 1.0 . 4.15 370 310 A 30 TRP H A 28 ASP HBy 1.0 . 4.47 371 311 A 27 LYS HBy A 29 LEU H 1.0 . 4.86 372 312 A 29 LEU H A 28 ASP HBy 1.0 . 5.04 373 313 A 27 LYS HBx A 28 ASP H 1.0 . 3.27 374 314 A 29 LEU H A 28 ASP HBx 1.0 . 4.29 375 315 A 29 LEU HDy% A 30 TRP H 1.0 . 4.76 376 316 A 35 ILE HG2% A 36 TRP H 1.0 . 3.79 377 317 A 35 ILE HB A 36 TRP H 1.0 . 4.09 378 318 A 18 CYS HA A 5 LEU H 1.0 . 3.67 379 319 A 7 TRP H A 6 GLY H 1.0 . 4.62 380 320 A 5 LEU H A 6 GLY H 1.0 . 4.62 381 321 A 6 GLY H A 9 SER HBx 1.0 . 4.00 382 321 A 9 SER HBy A 6 GLY H 1.0 . 4.00 383 322 A 28 ASP HBy A 30 TRP HE1 1.0 . 3.93 384 323 A 32 LYS HGy A 30 TRP HE1 1.0 . 4.55 385 324 A 17 LYS H A 16 ASP H 1.0 . 4.39 386 325 A 32 LYS H A 25 SER H 1.0 . 4.14 387 326 A 11 CYS HBy A 18 CYS H 1.0 . 5.42 388 327 A 32 LYS HGx A 25 SER H 1.0 . 4.59 389 328 A 29 LEU HDy% A 28 ASP H 1.0 . 5.18 390 329 A 27 LYS HBy A 28 ASP H 1.0 . 3.55 391 330 A 32 LYS HGx A 28 ASP H 1.0 . 5.50 392 331 A 15 ASN H A 14 LYS HGy 1.0 . 5.04 393 332 A 15 ASN H A 14 LYS HGx 1.0 . 5.04 394 333 A 14 LYS H A 14 LYS HGy 1.0 . 3.97 395 334 A 14 LYS H A 14 LYS HGx 1.0 . 3.97 396 335 A 13 PRO HGy A 14 LYS H 1.0 . 3.62 397 336 A 30 TRP HBy A 31 CYS H 1.0 . 3.26 398 337 A 31 CYS HBx A 31 CYS H 1.0 . 3.69 399 338 A 31 CYS HBx A 32 LYS H 1.0 . 4.23 400 339 A 9 SER H A 31 CYS HBy 1.0 . 4.20 401 340 A 32 LYS H A 31 CYS HBy 1.0 . 4.60 402 341 A 22 TYR HD% A 23 LYS H 1.0 . 4.27 403 342 A 31 CYS H A 9 SER HBx 1.0 . 4.60 404 342 A 9 SER HBy A 31 CYS H 1.0 . 4.60 405 343 A 30 TRP H A 32 LYS H 1.0 . 5.50 406 344 A 24 CYS H A 23 LYS HEx 1.0 . 4.57 407 344 A 23 LYS HEy A 24 CYS H 1.0 . 4.57 408 345 A 19 CYS HBx A 19 CYS H 1.0 . 4.02 409 346 A 5 LEU HBy A 19 CYS H 1.0 . 4.99 410 347 A 19 CYS H A 18 CYS HBx 1.0 . 4.23 411 347 A 19 CYS H A 18 CYS HBy 1.0 . 4.23 412 348 A 19 CYS H A 22 TYR HD% 1.0 . 5.24 413 349 A 5 LEU H A 18 CYS H 1.0 . 5.26 414 350 A 19 CYS H A 18 CYS H 1.0 . 4.89 415 351 A 17 LYS H A 12 SER H 1.0 . 4.93 416 352 A 5 LEU HDx% A 19 CYS H 1.0 . 5.50 417 353 A 20 PRO HDy A 19 CYS H 1.0 . 5.33 418 354 A 24 CYS HA A 30 TRP H 1.0 . 5.35 419 355 A 30 TRP H A 28 ASP HA 1.0 . 5.50 420 356 A 35 ILE HG2% A 35 ILE H 1.0 . 4.22 421 357 A 35 ILE HD1% A 35 ILE H 1.0 . 4.54 422 358 A 22 TYR HD% A 19 CYS HBy 1.0 . 3.93 423 359 A 33 TYR HA A 22 TYR HD% 1.0 . 3.93 424 360 A 22 TYR HD% A 18 CYS HBx 1.0 . 3.61 425 360 A 22 TYR HD% A 18 CYS HBy 1.0 . 3.61 426 361 A 19 CYS HBx A 22 TYR HD% 1.0 . 3.53 427 362 A 19 CYS HBy A 22 TYR HE% 1.0 . 4.40 428 363 A 30 TRP HBx A 30 TRP HD1 1.0 . 3.84 429 364 A 28 ASP HBx A 30 TRP HD1 1.0 . 4.35 430 365 A 28 ASP HBy A 30 TRP HD1 1.0 . 3.90 431 366 A 7 TRP HD1 A 7 TRP HBx 1.0 . 3.69 432 366 A 7 TRP HBy A 7 TRP HD1 1.0 . 3.69 433 367 A 8 ALA HB% A 7 TRP HD1 1.0 . 4.47 434 368 A 7 TRP HE3 A 22 TYR HE% 1.0 . 4.64 435 369 A 7 TRP HD1 A 7 TRP H 1.0 . 4.82 436 370 A 22 TYR HE% A 7 TRP HBx 1.0 . 3.47 437 370 A 7 TRP HBy A 22 TYR HE% 1.0 . 3.47 438 371 A 33 TYR HA A 22 TYR HE% 1.0 . 4.49 439 372 A 19 CYS HBx A 22 TYR HE% 1.0 . 4.19 440 373 A 3 ASP H A 2 GLU HBy 1.0 . 4.15 441 373 A 3 ASP H A 2 GLU HBx 1.0 . 4.15 442 374 A 3 ASP H A 3 ASP HBy 1.0 . 3.21 443 374 A 3 ASP H A 3 ASP HBx 1.0 . 3.21 444 375 A 4 CYS H A 3 ASP HBy 1.0 . 3.86 445 375 A 4 CYS H A 3 ASP HBx 1.0 . 3.86 446 376 A 4 CYS HBy A 17 LYS HBx 1.0 . 5.08 447 376 A 4 CYS HBx A 17 LYS HBx 1.0 . 5.08 448 376 A 17 LYS HBy A 4 CYS HBx 1.0 . 5.08 449 376 A 4 CYS HBy A 17 LYS HBy 1.0 . 5.08 450 377 A 5 LEU H A 17 LYS HBx 1.0 . 4.29 451 377 A 5 LEU H A 17 LYS HBy 1.0 . 4.29 452 378 A 5 LEU HG A 17 LYS HBx 1.0 . 4.88 453 378 A 5 LEU HG A 17 LYS HBy 1.0 . 4.88 454 379 A 5 LEU HDx% A 17 LYS HBx 1.0 . 3.86 455 379 A 5 LEU HDx% A 17 LYS HBy 1.0 . 3.86 456 380 A 7 TRP H A 6 GLY HAy 1.0 . 2.76 457 380 A 7 TRP H A 6 GLY HAx 1.0 . 2.76 458 381 A 22 TYR HE% A 6 GLY HAy 1.0 . 4.90 459 381 A 22 TYR HE% A 6 GLY HAx 1.0 . 4.90 460 382 A 9 SER HA A 10 ARG HGx 1.0 . 5.28 461 382 A 9 SER HA A 10 ARG HGy 1.0 . 5.28 462 383 A 10 ARG H A 10 ARG HGx 1.0 . 2.74 463 383 A 10 ARG H A 10 ARG HGy 1.0 . 2.74 464 384 A 10 ARG H A 10 ARG HDx 1.0 . 4.38 465 384 A 10 ARG H A 10 ARG HDy 1.0 . 4.38 466 385 A 10 ARG HBx A 10 ARG HGx 1.0 . 2.37 467 385 A 10 ARG HBy A 10 ARG HGx 1.0 . 2.37 468 385 A 10 ARG HGy A 10 ARG HBx 1.0 . 2.37 469 385 A 10 ARG HBy A 10 ARG HGy 1.0 . 2.37 470 386 A 11 CYS H A 10 ARG HDx 1.0 . 3.98 471 386 A 11 CYS H A 10 ARG HDy 1.0 . 3.98 472 387 A 30 TRP HA A 10 ARG HDx 1.0 . 5.34 473 387 A 30 TRP HA A 10 ARG HDy 1.0 . 5.34 474 388 A 12 SER H A 12 SER HBx 1.0 . 3.14 475 388 A 12 SER H A 12 SER HBy 1.0 . 3.14 476 389 A 14 LYS H A 12 SER HBx 1.0 . 4.42 477 389 A 14 LYS H A 12 SER HBy 1.0 . 4.42 478 390 A 15 ASN H A 12 SER HBx 1.0 . 3.61 479 390 A 15 ASN H A 12 SER HBy 1.0 . 3.61 480 391 A 13 PRO HA A 16 ASP HBy 1.0 . 4.08 481 391 A 13 PRO HA A 16 ASP HBx 1.0 . 4.08 482 392 A 13 PRO HA A 24 CYS HBx 1.0 . 3.94 483 392 A 13 PRO HA A 24 CYS HBy 1.0 . 3.94 484 393 A 14 LYS H A 14 LYS HBx 1.0 . 2.89 485 393 A 14 LYS H A 14 LYS HBy 1.0 . 2.89 486 394 A 15 ASN H A 14 LYS HBx 1.0 . 3.71 487 394 A 15 ASN H A 14 LYS HBy 1.0 . 3.71 488 395 A 15 ASN H A 14 LYS HGx 1.0 . 4.23 489 395 A 15 ASN H A 14 LYS HGy 1.0 . 4.23 490 396 A 15 ASN H A 15 ASN HBy 1.0 . 3.35 491 396 A 15 ASN H A 15 ASN HBx 1.0 . 3.35 492 397 A 16 ASP H A 16 ASP HBy 1.0 . 2.57 493 397 A 16 ASP H A 16 ASP HBx 1.0 . 2.57 494 398 A 18 CYS H A 16 ASP HBy 1.0 . 4.87 495 398 A 18 CYS H A 16 ASP HBx 1.0 . 4.87 496 399 A 17 LYS H A 17 LYS HBx 1.0 . 3.13 497 399 A 17 LYS H A 17 LYS HBy 1.0 . 3.13 498 400 A 17 LYS H A 17 LYS HGx 1.0 . 3.77 499 400 A 17 LYS H A 17 LYS HGy 1.0 . 3.77 500 401 A 17 LYS HA A 17 LYS HGx 1.0 . 3.74 501 401 A 17 LYS HA A 17 LYS HGy 1.0 . 3.74 502 402 A 17 LYS HBy A 17 LYS HDx 1.0 . 2.36 503 402 A 17 LYS HBx A 17 LYS HDx 1.0 . 2.36 504 402 A 17 LYS HDy A 17 LYS HBx 1.0 . 2.36 505 402 A 17 LYS HDy A 17 LYS HBy 1.0 . 2.36 506 403 A 18 CYS H A 17 LYS HBx 1.0 . 4.28 507 403 A 18 CYS H A 17 LYS HBy 1.0 . 4.28 508 404 A 18 CYS H A 17 LYS HGx 1.0 . 4.71 509 404 A 18 CYS H A 17 LYS HGy 1.0 . 4.71 510 405 A 19 CYS HBx A 20 PRO HBy 1.0 . 5.27 511 405 A 19 CYS HBx A 20 PRO HBx 1.0 . 5.27 512 406 A 21 ASN H A 20 PRO HBy 1.0 . 3.76 513 406 A 21 ASN H A 20 PRO HBx 1.0 . 3.76 514 407 A 21 ASN H A 21 ASN HD2x 1.0 . 4.13 515 407 A 21 ASN H A 21 ASN HD2y 1.0 . 4.13 516 408 A 23 LYS H A 23 LYS HGx 1.0 . 4.50 517 408 A 23 LYS H A 23 LYS HGy 1.0 . 4.50 518 409 A 23 LYS HA A 23 LYS HGx 1.0 . 3.36 519 409 A 23 LYS HA A 23 LYS HGy 1.0 . 3.36 520 410 A 24 CYS H A 23 LYS HGx 1.0 . 3.80 521 410 A 24 CYS H A 23 LYS HGy 1.0 . 3.80 522 411 A 23 LYS HGy A 34 LYS HGx 1.0 . 4.16 523 411 A 23 LYS HGx A 34 LYS HGx 1.0 . 4.16 524 411 A 34 LYS HGy A 23 LYS HGx 1.0 . 4.16 525 411 A 34 LYS HGy A 23 LYS HGy 1.0 . 4.16 526 412 A 25 SER H A 24 CYS HBx 1.0 . 4.10 527 412 A 25 SER H A 24 CYS HBy 1.0 . 4.10 528 413 A 32 LYS H A 24 CYS HBx 1.0 . 5.34 529 413 A 32 LYS H A 24 CYS HBy 1.0 . 5.34 530 414 A 25 SER H A 32 LYS HDx 1.0 . 4.85 531 414 A 25 SER H A 32 LYS HDy 1.0 . 4.85 532 415 A 25 SER HBx A 32 LYS HDx 1.0 . 3.83 533 415 A 25 SER HBx A 32 LYS HDy 1.0 . 3.83 534 416 A 25 SER HBx A 32 LYS HEy 1.0 . 4.56 535 416 A 25 SER HBx A 32 LYS HEx 1.0 . 4.56 536 417 A 25 SER HBy A 32 LYS HDx 1.0 . 4.07 537 417 A 25 SER HBy A 32 LYS HDy 1.0 . 4.07 538 418 A 27 LYS H A 27 LYS HGx 1.0 . 3.80 539 418 A 27 LYS H A 27 LYS HGy 1.0 . 3.80 540 419 A 27 LYS HA A 27 LYS HGx 1.0 . 3.37 541 419 A 27 LYS HA A 27 LYS HGy 1.0 . 3.37 542 420 A 28 ASP H A 27 LYS HGx 1.0 . 5.21 543 420 A 28 ASP H A 27 LYS HGy 1.0 . 5.21 544 421 A 29 LEU HDx% A 29 LEU HBy 1.0 . 3.22 545 421 A 29 LEU HDx% A 29 LEU HBx 1.0 . 3.22 546 422 A 29 LEU HDy% A 29 LEU HBy 1.0 . 3.24 547 422 A 29 LEU HDy% A 29 LEU HBx 1.0 . 3.24 548 423 A 30 TRP HE1 A 32 LYS HDx 1.0 . 4.16 549 423 A 30 TRP HE1 A 32 LYS HDy 1.0 . 4.16 550 424 A 30 TRP HE1 A 32 LYS HEy 1.0 . 4.69 551 424 A 30 TRP HE1 A 32 LYS HEx 1.0 . 4.69 552 425 A 30 TRP HZ2 A 32 LYS HEy 1.0 . 4.85 553 425 A 32 LYS HEx A 30 TRP HZ2 1.0 . 4.85 554 426 A 32 LYS H A 32 LYS HBx 1.0 . 3.54 555 426 A 32 LYS H A 32 LYS HBy 1.0 . 3.54 556 427 A 33 TYR H A 32 LYS HBx 1.0 . 3.33 557 427 A 33 TYR H A 32 LYS HBy 1.0 . 3.33 558 428 A 33 TYR H A 33 TYR HBx 1.0 . 3.21 559 428 A 33 TYR H A 33 TYR HBy 1.0 . 3.21 560 429 A 34 LYS H A 33 TYR HBx 1.0 . 3.67 561 429 A 34 LYS H A 33 TYR HBy 1.0 . 3.67 562 430 A 35 ILE H A 33 TYR HBx 1.0 . 4.53 563 430 A 35 ILE H A 33 TYR HBy 1.0 . 4.53 564 431 A 35 ILE HG2% A 33 TYR HBx 1.0 . 5.34 565 431 A 35 ILE HG2% A 33 TYR HBy 1.0 . 5.34 566 432 A 35 ILE H A 34 LYS HBx 1.0 . 3.57 567 432 A 35 ILE H A 34 LYS HBy 1.0 . 3.57 568 433 A 35 ILE H A 35 ILE HG1x 1.0 . 3.50 569 433 A 35 ILE H A 35 ILE HG1y 1.0 . 3.50 570 434 A 35 ILE HA A 35 ILE HG1x 1.0 . 3.65 571 434 A 35 ILE HA A 35 ILE HG1y 1.0 . 3.65 572 435 A 35 ILE HG2% A 36 TRP HBy 1.0 . 5.34 573 435 A 35 ILE HG2% A 36 TRP HBx 1.0 . 5.34 574 436 A 36 TRP H A 35 ILE HG1x 1.0 . 5.13 575 436 A 36 TRP H A 35 ILE HG1y 1.0 . 5.13 576 437 A 36 TRP H A 36 TRP HBy 1.0 . 3.19 577 437 A 36 TRP H A 36 TRP HBx 1.0 . 3.19 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 undefined _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 4 CYS SG A 19 CYS SG 1.0 . 1.96 2 2 A 4 CYS SG A 19 CYS CB 1.0 . 2.90 3 3 A 19 CYS SG A 4 CYS CB 1.0 . 2.90 4 4 A 11 CYS SG A 24 CYS SG 1.0 . 1.96 5 5 A 11 CYS SG A 24 CYS CB 1.0 . 2.90 6 6 A 24 CYS SG A 11 CYS CB 1.0 . 2.90 7 7 A 18 CYS SG A 31 CYS SG 1.0 . 1.96 8 8 A 18 CYS SG A 31 CYS CB 1.0 . 2.90 9 9 A 31 CYS SG A 18 CYS CB 1.0 . 2.90 10 10 A 4 CYS SG A 19 CYS SG 1.0 . 2.10 11 11 A 4 CYS SG A 19 CYS CB 1.0 . 3.50 12 12 A 19 CYS SG A 4 CYS CB 1.0 . 3.50 13 13 A 11 CYS SG A 24 CYS SG 1.0 . 2.10 14 14 A 11 CYS SG A 24 CYS CB 1.0 . 3.50 15 15 A 24 CYS SG A 11 CYS CB 1.0 . 3.50 16 16 A 18 CYS SG A 31 CYS SG 1.0 . 2.10 17 17 A 18 CYS SG A 31 CYS CB 1.0 . 3.50 18 18 A 31 CYS SG A 18 CYS CB 1.0 . 3.50 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 SER N A 1 SER CA A 1 SER C A 2 GLU N 1.0 -75.0 185.0 PSI 2 2 A 1 SER N A 1 SER CA A 1 SER C A 2 GLU N 1.0 25.0 55.0 PSI 3 3 A 1 SER N A 1 SER CA A 1 SER C A 2 GLU N 1.0 105.0 185.0 PSI 4 4 A 1 SER C A 2 GLU N A 2 GLU CA A 2 GLU C 1.0 -175.0 75.0 PHI 5 5 A 1 SER C A 2 GLU N A 2 GLU CA A 2 GLU C 1.0 -255.0 -25.0 PHI 6 6 A 1 SER C A 2 GLU N A 2 GLU CA A 2 GLU C 1.0 -135.0 75.0 PHI 7 7 A 2 GLU N A 2 GLU CA A 2 GLU C A 3 ASP N 1.0 -75.0 185.0 PSI 8 8 A 2 GLU N A 2 GLU CA A 2 GLU C A 3 ASP N 1.0 25.0 55.0 PSI 9 9 A 2 GLU N A 2 GLU CA A 2 GLU C A 3 ASP N 1.0 105.0 185.0 PSI 10 10 A 2 GLU C A 3 ASP N A 3 ASP CA A 3 ASP C 1.0 -175.0 75.0 PHI 11 11 A 2 GLU C A 3 ASP N A 3 ASP CA A 3 ASP C 1.0 -255.0 -25.0 PHI 12 12 A 2 GLU C A 3 ASP N A 3 ASP CA A 3 ASP C 1.0 -135.0 75.0 PHI 13 13 A 3 ASP N A 3 ASP CA A 3 ASP C A 4 CYS N 1.0 -75.0 185.0 PSI 14 14 A 3 ASP N A 3 ASP CA A 3 ASP C A 4 CYS N 1.0 25.0 55.0 PSI 15 15 A 3 ASP N A 3 ASP CA A 3 ASP C A 4 CYS N 1.0 105.0 185.0 PSI 16 16 A 3 ASP C A 4 CYS N A 4 CYS CA A 4 CYS C 1.0 -175.0 75.0 PHI 17 17 A 3 ASP C A 4 CYS N A 4 CYS CA A 4 CYS C 1.0 -255.0 -25.0 PHI 18 18 A 3 ASP C A 4 CYS N A 4 CYS CA A 4 CYS C 1.0 -135.0 75.0 PHI 19 19 A 4 CYS N A 4 CYS CA A 4 CYS C A 5 LEU N 1.0 -75.0 185.0 PSI 20 20 A 4 CYS N A 4 CYS CA A 4 CYS C A 5 LEU N 1.0 25.0 55.0 PSI 21 21 A 4 CYS N A 4 CYS CA A 4 CYS C A 5 LEU N 1.0 105.0 185.0 PSI 22 22 A 4 CYS C A 5 LEU N A 5 LEU CA A 5 LEU C 1.0 -175.0 75.0 PHI 23 23 A 4 CYS C A 5 LEU N A 5 LEU CA A 5 LEU C 1.0 -255.0 -25.0 PHI 24 24 A 4 CYS C A 5 LEU N A 5 LEU CA A 5 LEU C 1.0 -135.0 75.0 PHI 25 25 A 5 LEU N A 5 LEU CA A 5 LEU C A 6 GLY N 1.0 -75.0 185.0 PSI 26 26 A 5 LEU N A 5 LEU CA A 5 LEU C A 6 GLY N 1.0 25.0 55.0 PSI 27 27 A 5 LEU N A 5 LEU CA A 5 LEU C A 6 GLY N 1.0 105.0 185.0 PSI 28 28 A 6 GLY C A 7 TRP N A 7 TRP CA A 7 TRP C 1.0 -175.0 75.0 PHI 29 29 A 6 GLY C A 7 TRP N A 7 TRP CA A 7 TRP C 1.0 -255.0 -25.0 PHI 30 30 A 6 GLY C A 7 TRP N A 7 TRP CA A 7 TRP C 1.0 -135.0 75.0 PHI 31 31 A 7 TRP N A 7 TRP CA A 7 TRP C A 8 ALA N 1.0 -75.0 185.0 PSI 32 32 A 7 TRP N A 7 TRP CA A 7 TRP C A 8 ALA N 1.0 25.0 55.0 PSI 33 33 A 7 TRP N A 7 TRP CA A 7 TRP C A 8 ALA N 1.0 105.0 185.0 PSI 34 34 A 7 TRP C A 8 ALA N A 8 ALA CA A 8 ALA C 1.0 -175.0 75.0 PHI 35 35 A 7 TRP C A 8 ALA N A 8 ALA CA A 8 ALA C 1.0 -255.0 -25.0 PHI 36 36 A 7 TRP C A 8 ALA N A 8 ALA CA A 8 ALA C 1.0 -135.0 75.0 PHI 37 37 A 8 ALA N A 8 ALA CA A 8 ALA C A 9 SER N 1.0 -75.0 185.0 PSI 38 38 A 8 ALA N A 8 ALA CA A 8 ALA C A 9 SER N 1.0 25.0 55.0 PSI 39 39 A 8 ALA N A 8 ALA CA A 8 ALA C A 9 SER N 1.0 105.0 185.0 PSI 40 40 A 8 ALA C A 9 SER N A 9 SER CA A 9 SER C 1.0 -175.0 75.0 PHI 41 41 A 8 ALA C A 9 SER N A 9 SER CA A 9 SER C 1.0 -255.0 -25.0 PHI 42 42 A 8 ALA C A 9 SER N A 9 SER CA A 9 SER C 1.0 -135.0 75.0 PHI 43 43 A 9 SER N A 9 SER CA A 9 SER C A 10 ARG N 1.0 -75.0 185.0 PSI 44 44 A 9 SER N A 9 SER CA A 9 SER C A 10 ARG N 1.0 25.0 55.0 PSI 45 45 A 9 SER N A 9 SER CA A 9 SER C A 10 ARG N 1.0 105.0 185.0 PSI 46 46 A 9 SER C A 10 ARG N A 10 ARG CA A 10 ARG C 1.0 -175.0 75.0 PHI 47 47 A 9 SER C A 10 ARG N A 10 ARG CA A 10 ARG C 1.0 -255.0 -25.0 PHI 48 48 A 9 SER C A 10 ARG N A 10 ARG CA A 10 ARG C 1.0 -135.0 75.0 PHI 49 49 A 10 ARG N A 10 ARG CA A 10 ARG C A 11 CYS N 1.0 -75.0 185.0 PSI 50 50 A 10 ARG N A 10 ARG CA A 10 ARG C A 11 CYS N 1.0 25.0 55.0 PSI 51 51 A 10 ARG N A 10 ARG CA A 10 ARG C A 11 CYS N 1.0 105.0 185.0 PSI 52 52 A 10 ARG C A 11 CYS N A 11 CYS CA A 11 CYS C 1.0 -175.0 75.0 PHI 53 53 A 10 ARG C A 11 CYS N A 11 CYS CA A 11 CYS C 1.0 -255.0 -25.0 PHI 54 54 A 10 ARG C A 11 CYS N A 11 CYS CA A 11 CYS C 1.0 -135.0 75.0 PHI 55 55 A 11 CYS N A 11 CYS CA A 11 CYS C A 12 SER N 1.0 -75.0 185.0 PSI 56 56 A 11 CYS N A 11 CYS CA A 11 CYS C A 12 SER N 1.0 25.0 55.0 PSI 57 57 A 11 CYS N A 11 CYS CA A 11 CYS C A 12 SER N 1.0 105.0 185.0 PSI 58 58 A 13 PRO C A 14 LYS N A 14 LYS CA A 14 LYS C 1.0 -175.0 75.0 PHI 59 59 A 13 PRO C A 14 LYS N A 14 LYS CA A 14 LYS C 1.0 -255.0 -25.0 PHI 60 60 A 13 PRO C A 14 LYS N A 14 LYS CA A 14 LYS C 1.0 -135.0 75.0 PHI 61 61 A 14 LYS N A 14 LYS CA A 14 LYS C A 15 ASN N 1.0 -75.0 185.0 PSI 62 62 A 14 LYS N A 14 LYS CA A 14 LYS C A 15 ASN N 1.0 25.0 55.0 PSI 63 63 A 14 LYS N A 14 LYS CA A 14 LYS C A 15 ASN N 1.0 105.0 185.0 PSI 64 64 A 14 LYS C A 15 ASN N A 15 ASN CA A 15 ASN C 1.0 -175.0 75.0 PHI 65 65 A 14 LYS C A 15 ASN N A 15 ASN CA A 15 ASN C 1.0 -255.0 -25.0 PHI 66 66 A 14 LYS C A 15 ASN N A 15 ASN CA A 15 ASN C 1.0 -135.0 75.0 PHI 67 67 A 15 ASN N A 15 ASN CA A 15 ASN C A 16 ASP N 1.0 -75.0 185.0 PSI 68 68 A 15 ASN N A 15 ASN CA A 15 ASN C A 16 ASP N 1.0 25.0 55.0 PSI 69 69 A 15 ASN N A 15 ASN CA A 15 ASN C A 16 ASP N 1.0 105.0 185.0 PSI 70 70 A 15 ASN C A 16 ASP N A 16 ASP CA A 16 ASP C 1.0 -175.0 75.0 PHI 71 71 A 15 ASN C A 16 ASP N A 16 ASP CA A 16 ASP C 1.0 -255.0 -25.0 PHI 72 72 A 15 ASN C A 16 ASP N A 16 ASP CA A 16 ASP C 1.0 -135.0 75.0 PHI 73 73 A 16 ASP N A 16 ASP CA A 16 ASP C A 17 LYS N 1.0 -75.0 185.0 PSI 74 74 A 16 ASP N A 16 ASP CA A 16 ASP C A 17 LYS N 1.0 25.0 55.0 PSI 75 75 A 16 ASP N A 16 ASP CA A 16 ASP C A 17 LYS N 1.0 105.0 185.0 PSI 76 76 A 16 ASP C A 17 LYS N A 17 LYS CA A 17 LYS C 1.0 -175.0 75.0 PHI 77 77 A 16 ASP C A 17 LYS N A 17 LYS CA A 17 LYS C 1.0 -255.0 -25.0 PHI 78 78 A 16 ASP C A 17 LYS N A 17 LYS CA A 17 LYS C 1.0 -135.0 75.0 PHI 79 79 A 17 LYS N A 17 LYS CA A 17 LYS C A 18 CYS N 1.0 -75.0 185.0 PSI 80 80 A 17 LYS N A 17 LYS CA A 17 LYS C A 18 CYS N 1.0 25.0 55.0 PSI 81 81 A 17 LYS N A 17 LYS CA A 17 LYS C A 18 CYS N 1.0 105.0 185.0 PSI 82 82 A 17 LYS C A 18 CYS N A 18 CYS CA A 18 CYS C 1.0 -175.0 75.0 PHI 83 83 A 17 LYS C A 18 CYS N A 18 CYS CA A 18 CYS C 1.0 -255.0 -25.0 PHI 84 84 A 17 LYS C A 18 CYS N A 18 CYS CA A 18 CYS C 1.0 -135.0 75.0 PHI 85 85 A 18 CYS N A 18 CYS CA A 18 CYS C A 19 CYS N 1.0 -75.0 185.0 PSI 86 86 A 18 CYS N A 18 CYS CA A 18 CYS C A 19 CYS N 1.0 25.0 55.0 PSI 87 87 A 18 CYS N A 18 CYS CA A 18 CYS C A 19 CYS N 1.0 105.0 185.0 PSI 88 88 A 20 PRO C A 21 ASN N A 21 ASN CA A 21 ASN C 1.0 -175.0 75.0 PHI 89 89 A 20 PRO C A 21 ASN N A 21 ASN CA A 21 ASN C 1.0 -255.0 -25.0 PHI 90 90 A 20 PRO C A 21 ASN N A 21 ASN CA A 21 ASN C 1.0 -135.0 75.0 PHI 91 91 A 21 ASN N A 21 ASN CA A 21 ASN C A 22 TYR N 1.0 -75.0 185.0 PSI 92 92 A 21 ASN N A 21 ASN CA A 21 ASN C A 22 TYR N 1.0 25.0 55.0 PSI 93 93 A 21 ASN N A 21 ASN CA A 21 ASN C A 22 TYR N 1.0 105.0 185.0 PSI 94 94 A 21 ASN C A 22 TYR N A 22 TYR CA A 22 TYR C 1.0 -175.0 75.0 PHI 95 95 A 21 ASN C A 22 TYR N A 22 TYR CA A 22 TYR C 1.0 -255.0 -25.0 PHI 96 96 A 21 ASN C A 22 TYR N A 22 TYR CA A 22 TYR C 1.0 -135.0 75.0 PHI 97 97 A 22 TYR N A 22 TYR CA A 22 TYR C A 23 LYS N 1.0 -75.0 185.0 PSI 98 98 A 22 TYR N A 22 TYR CA A 22 TYR C A 23 LYS N 1.0 25.0 55.0 PSI 99 99 A 22 TYR N A 22 TYR CA A 22 TYR C A 23 LYS N 1.0 105.0 185.0 PSI 100 100 A 22 TYR C A 23 LYS N A 23 LYS CA A 23 LYS C 1.0 -175.0 75.0 PHI 101 101 A 22 TYR C A 23 LYS N A 23 LYS CA A 23 LYS C 1.0 -255.0 -25.0 PHI 102 102 A 22 TYR C A 23 LYS N A 23 LYS CA A 23 LYS C 1.0 -135.0 75.0 PHI 103 103 A 23 LYS N A 23 LYS CA A 23 LYS C A 24 CYS N 1.0 -75.0 185.0 PSI 104 104 A 23 LYS N A 23 LYS CA A 23 LYS C A 24 CYS N 1.0 25.0 55.0 PSI 105 105 A 23 LYS N A 23 LYS CA A 23 LYS C A 24 CYS N 1.0 105.0 185.0 PSI 106 106 A 23 LYS C A 24 CYS N A 24 CYS CA A 24 CYS C 1.0 -175.0 75.0 PHI 107 107 A 23 LYS C A 24 CYS N A 24 CYS CA A 24 CYS C 1.0 -255.0 -25.0 PHI 108 108 A 23 LYS C A 24 CYS N A 24 CYS CA A 24 CYS C 1.0 -135.0 75.0 PHI 109 109 A 24 CYS N A 24 CYS CA A 24 CYS C A 25 SER N 1.0 -75.0 185.0 PSI 110 110 A 24 CYS N A 24 CYS CA A 24 CYS C A 25 SER N 1.0 25.0 55.0 PSI 111 111 A 24 CYS N A 24 CYS CA A 24 CYS C A 25 SER N 1.0 105.0 185.0 PSI 112 112 A 24 CYS C A 25 SER N A 25 SER CA A 25 SER C 1.0 -175.0 75.0 PHI 113 113 A 24 CYS C A 25 SER N A 25 SER CA A 25 SER C 1.0 -255.0 -25.0 PHI 114 114 A 24 CYS C A 25 SER N A 25 SER CA A 25 SER C 1.0 -135.0 75.0 PHI 115 115 A 25 SER N A 25 SER CA A 25 SER C A 26 SER N 1.0 -75.0 185.0 PSI 116 116 A 25 SER N A 25 SER CA A 25 SER C A 26 SER N 1.0 25.0 55.0 PSI 117 117 A 25 SER N A 25 SER CA A 25 SER C A 26 SER N 1.0 105.0 185.0 PSI 118 118 A 25 SER C A 26 SER N A 26 SER CA A 26 SER C 1.0 -175.0 75.0 PHI 119 119 A 25 SER C A 26 SER N A 26 SER CA A 26 SER C 1.0 -255.0 -25.0 PHI 120 120 A 25 SER C A 26 SER N A 26 SER CA A 26 SER C 1.0 -135.0 75.0 PHI 121 121 A 26 SER N A 26 SER CA A 26 SER C A 27 LYS N 1.0 -75.0 185.0 PSI 122 122 A 26 SER N A 26 SER CA A 26 SER C A 27 LYS N 1.0 25.0 55.0 PSI 123 123 A 26 SER N A 26 SER CA A 26 SER C A 27 LYS N 1.0 105.0 185.0 PSI 124 124 A 26 SER C A 27 LYS N A 27 LYS CA A 27 LYS C 1.0 -175.0 75.0 PHI 125 125 A 26 SER C A 27 LYS N A 27 LYS CA A 27 LYS C 1.0 -255.0 -25.0 PHI 126 126 A 26 SER C A 27 LYS N A 27 LYS CA A 27 LYS C 1.0 -135.0 75.0 PHI 127 127 A 27 LYS N A 27 LYS CA A 27 LYS C A 28 ASP N 1.0 -75.0 185.0 PSI 128 128 A 27 LYS N A 27 LYS CA A 27 LYS C A 28 ASP N 1.0 25.0 55.0 PSI 129 129 A 27 LYS N A 27 LYS CA A 27 LYS C A 28 ASP N 1.0 105.0 185.0 PSI 130 130 A 27 LYS C A 28 ASP N A 28 ASP CA A 28 ASP C 1.0 -175.0 75.0 PHI 131 131 A 27 LYS C A 28 ASP N A 28 ASP CA A 28 ASP C 1.0 -255.0 -25.0 PHI 132 132 A 27 LYS C A 28 ASP N A 28 ASP CA A 28 ASP C 1.0 -135.0 75.0 PHI 133 133 A 28 ASP N A 28 ASP CA A 28 ASP C A 29 LEU N 1.0 -75.0 185.0 PSI 134 134 A 28 ASP N A 28 ASP CA A 28 ASP C A 29 LEU N 1.0 25.0 55.0 PSI 135 135 A 28 ASP N A 28 ASP CA A 28 ASP C A 29 LEU N 1.0 105.0 185.0 PSI 136 136 A 28 ASP C A 29 LEU N A 29 LEU CA A 29 LEU C 1.0 -175.0 75.0 PHI 137 137 A 28 ASP C A 29 LEU N A 29 LEU CA A 29 LEU C 1.0 -255.0 -25.0 PHI 138 138 A 28 ASP C A 29 LEU N A 29 LEU CA A 29 LEU C 1.0 -135.0 75.0 PHI 139 139 A 29 LEU N A 29 LEU CA A 29 LEU C A 30 TRP N 1.0 -75.0 185.0 PSI 140 140 A 29 LEU N A 29 LEU CA A 29 LEU C A 30 TRP N 1.0 25.0 55.0 PSI 141 141 A 29 LEU N A 29 LEU CA A 29 LEU C A 30 TRP N 1.0 105.0 185.0 PSI 142 142 A 29 LEU C A 30 TRP N A 30 TRP CA A 30 TRP C 1.0 -175.0 75.0 PHI 143 143 A 29 LEU C A 30 TRP N A 30 TRP CA A 30 TRP C 1.0 -255.0 -25.0 PHI 144 144 A 29 LEU C A 30 TRP N A 30 TRP CA A 30 TRP C 1.0 -135.0 75.0 PHI 145 145 A 30 TRP N A 30 TRP CA A 30 TRP C A 31 CYS N 1.0 -75.0 185.0 PSI 146 146 A 30 TRP N A 30 TRP CA A 30 TRP C A 31 CYS N 1.0 25.0 55.0 PSI 147 147 A 30 TRP N A 30 TRP CA A 30 TRP C A 31 CYS N 1.0 105.0 185.0 PSI 148 148 A 30 TRP C A 31 CYS N A 31 CYS CA A 31 CYS C 1.0 -175.0 75.0 PHI 149 149 A 30 TRP C A 31 CYS N A 31 CYS CA A 31 CYS C 1.0 -255.0 -25.0 PHI 150 150 A 30 TRP C A 31 CYS N A 31 CYS CA A 31 CYS C 1.0 -135.0 75.0 PHI 151 151 A 31 CYS N A 31 CYS CA A 31 CYS C A 32 LYS N 1.0 -75.0 185.0 PSI 152 152 A 31 CYS N A 31 CYS CA A 31 CYS C A 32 LYS N 1.0 25.0 55.0 PSI 153 153 A 31 CYS N A 31 CYS CA A 31 CYS C A 32 LYS N 1.0 105.0 185.0 PSI 154 154 A 31 CYS C A 32 LYS N A 32 LYS CA A 32 LYS C 1.0 -175.0 75.0 PHI 155 155 A 31 CYS C A 32 LYS N A 32 LYS CA A 32 LYS C 1.0 -255.0 -25.0 PHI 156 156 A 31 CYS C A 32 LYS N A 32 LYS CA A 32 LYS C 1.0 -135.0 75.0 PHI 157 157 A 32 LYS N A 32 LYS CA A 32 LYS C A 33 TYR N 1.0 -75.0 185.0 PSI 158 158 A 32 LYS N A 32 LYS CA A 32 LYS C A 33 TYR N 1.0 25.0 55.0 PSI 159 159 A 32 LYS N A 32 LYS CA A 32 LYS C A 33 TYR N 1.0 105.0 185.0 PSI 160 160 A 32 LYS C A 33 TYR N A 33 TYR CA A 33 TYR C 1.0 -175.0 75.0 PHI 161 161 A 32 LYS C A 33 TYR N A 33 TYR CA A 33 TYR C 1.0 -255.0 -25.0 PHI 162 162 A 32 LYS C A 33 TYR N A 33 TYR CA A 33 TYR C 1.0 -135.0 75.0 PHI 163 163 A 33 TYR N A 33 TYR CA A 33 TYR C A 34 LYS N 1.0 -75.0 185.0 PSI 164 164 A 33 TYR N A 33 TYR CA A 33 TYR C A 34 LYS N 1.0 25.0 55.0 PSI 165 165 A 33 TYR N A 33 TYR CA A 33 TYR C A 34 LYS N 1.0 105.0 185.0 PSI 166 166 A 33 TYR C A 34 LYS N A 34 LYS CA A 34 LYS C 1.0 -175.0 75.0 PHI 167 167 A 33 TYR C A 34 LYS N A 34 LYS CA A 34 LYS C 1.0 -255.0 -25.0 PHI 168 168 A 33 TYR C A 34 LYS N A 34 LYS CA A 34 LYS C 1.0 -135.0 75.0 PHI 169 169 A 34 LYS N A 34 LYS CA A 34 LYS C A 35 ILE N 1.0 -75.0 185.0 PSI 170 170 A 34 LYS N A 34 LYS CA A 34 LYS C A 35 ILE N 1.0 25.0 55.0 PSI 171 171 A 34 LYS N A 34 LYS CA A 34 LYS C A 35 ILE N 1.0 105.0 185.0 PSI 172 172 A 34 LYS C A 35 ILE N A 35 ILE CA A 35 ILE C 1.0 -175.0 75.0 PHI 173 173 A 34 LYS C A 35 ILE N A 35 ILE CA A 35 ILE C 1.0 -255.0 -25.0 PHI 174 174 A 34 LYS C A 35 ILE N A 35 ILE CA A 35 ILE C 1.0 -135.0 75.0 PHI 175 175 A 35 ILE N A 35 ILE CA A 35 ILE C A 36 TRP N 1.0 -75.0 185.0 PSI 176 176 A 35 ILE N A 35 ILE CA A 35 ILE C A 36 TRP N 1.0 25.0 55.0 PSI 177 177 A 35 ILE N A 35 ILE CA A 35 ILE C A 36 TRP N 1.0 105.0 185.0 PSI 178 178 A 35 ILE C A 36 TRP N A 36 TRP CA A 36 TRP C 1.0 -175.0 75.0 PHI 179 179 A 35 ILE C A 36 TRP N A 36 TRP CA A 36 TRP C 1.0 -255.0 -25.0 PHI 180 180 A 35 ILE C A 36 TRP N A 36 TRP CA A 36 TRP C 1.0 -135.0 75.0 PHI 181 181 A 1 SER N A 1 SER CA A 1 SER CB A 1 SER OG 1.0 -90.0 210.0 CHI1 182 182 A 1 SER N A 1 SER CA A 1 SER CB A 1 SER OG 1.0 -330.0 -30.0 CHI1 183 183 A 1 SER N A 1 SER CA A 1 SER CB A 1 SER OG 1.0 -210.0 90.0 CHI1 184 184 A 2 GLU N A 2 GLU CA A 2 GLU CB A 2 GLU CG 1.0 -90.0 210.0 CHI1 185 185 A 2 GLU N A 2 GLU CA A 2 GLU CB A 2 GLU CG 1.0 -330.0 -30.0 CHI1 186 186 A 2 GLU N A 2 GLU CA A 2 GLU CB A 2 GLU CG 1.0 -210.0 90.0 CHI1 187 187 A 2 GLU CA A 2 GLU CB A 2 GLU CG A 2 GLU CD 1.0 -90.0 210.0 CHI2 188 188 A 2 GLU CA A 2 GLU CB A 2 GLU CG A 2 GLU CD 1.0 -330.0 -30.0 CHI2 189 189 A 2 GLU CA A 2 GLU CB A 2 GLU CG A 2 GLU CD 1.0 -210.0 90.0 CHI2 190 190 A 3 ASP N A 3 ASP CA A 3 ASP CB A 3 ASP CG 1.0 -90.0 210.0 CHI1 191 191 A 3 ASP N A 3 ASP CA A 3 ASP CB A 3 ASP CG 1.0 -330.0 -30.0 CHI1 192 192 A 3 ASP N A 3 ASP CA A 3 ASP CB A 3 ASP CG 1.0 -210.0 90.0 CHI1 193 193 A 4 CYS N A 4 CYS CA A 4 CYS CB A 4 CYS SG 1.0 -90.0 210.0 CHI1 194 194 A 4 CYS N A 4 CYS CA A 4 CYS CB A 4 CYS SG 1.0 -330.0 -30.0 CHI1 195 195 A 4 CYS N A 4 CYS CA A 4 CYS CB A 4 CYS SG 1.0 -210.0 90.0 CHI1 196 196 A 5 LEU N A 5 LEU CA A 5 LEU CB A 5 LEU CG 1.0 -90.0 210.0 CHI1 197 197 A 5 LEU N A 5 LEU CA A 5 LEU CB A 5 LEU CG 1.0 -330.0 -30.0 CHI1 198 198 A 5 LEU N A 5 LEU CA A 5 LEU CB A 5 LEU CG 1.0 -210.0 90.0 CHI1 199 199 A 5 LEU CA A 5 LEU CB A 5 LEU CG A 5 LEU CD1 1.0 -90.0 210.0 CHI2 200 200 A 5 LEU CA A 5 LEU CB A 5 LEU CG A 5 LEU CD1 1.0 -330.0 -30.0 CHI2 201 201 A 5 LEU CA A 5 LEU CB A 5 LEU CG A 5 LEU CD1 1.0 -210.0 90.0 CHI2 202 202 A 7 TRP N A 7 TRP CA A 7 TRP CB A 7 TRP CG 1.0 -90.0 210.0 CHI1 203 203 A 7 TRP N A 7 TRP CA A 7 TRP CB A 7 TRP CG 1.0 -330.0 -30.0 CHI1 204 204 A 7 TRP N A 7 TRP CA A 7 TRP CB A 7 TRP CG 1.0 -210.0 90.0 CHI1 205 205 A 9 SER N A 9 SER CA A 9 SER CB A 9 SER OG 1.0 -90.0 210.0 CHI1 206 206 A 9 SER N A 9 SER CA A 9 SER CB A 9 SER OG 1.0 -330.0 -30.0 CHI1 207 207 A 9 SER N A 9 SER CA A 9 SER CB A 9 SER OG 1.0 -210.0 90.0 CHI1 208 208 A 10 ARG N A 10 ARG CA A 10 ARG CB A 10 ARG CG 1.0 -90.0 210.0 CHI1 209 209 A 10 ARG N A 10 ARG CA A 10 ARG CB A 10 ARG CG 1.0 -330.0 -30.0 CHI1 210 210 A 10 ARG N A 10 ARG CA A 10 ARG CB A 10 ARG CG 1.0 -210.0 90.0 CHI1 211 211 A 10 ARG CA A 10 ARG CB A 10 ARG CG A 10 ARG CD 1.0 -90.0 210.0 CHI2 212 212 A 10 ARG CA A 10 ARG CB A 10 ARG CG A 10 ARG CD 1.0 -330.0 -30.0 CHI2 213 213 A 10 ARG CA A 10 ARG CB A 10 ARG CG A 10 ARG CD 1.0 -210.0 90.0 CHI2 214 214 A 10 ARG CB A 10 ARG CG A 10 ARG CD A 10 ARG NE 1.0 -90.0 210.0 CHI3 215 215 A 10 ARG CB A 10 ARG CG A 10 ARG CD A 10 ARG NE 1.0 -330.0 -30.0 CHI3 216 216 A 10 ARG CB A 10 ARG CG A 10 ARG CD A 10 ARG NE 1.0 -210.0 90.0 CHI3 217 217 A 11 CYS N A 11 CYS CA A 11 CYS CB A 11 CYS SG 1.0 -90.0 210.0 CHI1 218 218 A 11 CYS N A 11 CYS CA A 11 CYS CB A 11 CYS SG 1.0 -330.0 -30.0 CHI1 219 219 A 11 CYS N A 11 CYS CA A 11 CYS CB A 11 CYS SG 1.0 -210.0 90.0 CHI1 220 220 A 12 SER N A 12 SER CA A 12 SER CB A 12 SER OG 1.0 -90.0 210.0 CHI1 221 221 A 12 SER N A 12 SER CA A 12 SER CB A 12 SER OG 1.0 -330.0 -30.0 CHI1 222 222 A 12 SER N A 12 SER CA A 12 SER CB A 12 SER OG 1.0 -210.0 90.0 CHI1 223 223 A 14 LYS N A 14 LYS CA A 14 LYS CB A 14 LYS CG 1.0 -90.0 210.0 CHI1 224 224 A 14 LYS N A 14 LYS CA A 14 LYS CB A 14 LYS CG 1.0 -330.0 -30.0 CHI1 225 225 A 14 LYS N A 14 LYS CA A 14 LYS CB A 14 LYS CG 1.0 -210.0 90.0 CHI1 226 226 A 14 LYS CA A 14 LYS CB A 14 LYS CG A 14 LYS CD 1.0 -90.0 210.0 CHI2 227 227 A 14 LYS CA A 14 LYS CB A 14 LYS CG A 14 LYS CD 1.0 -330.0 -30.0 CHI2 228 228 A 14 LYS CA A 14 LYS CB A 14 LYS CG A 14 LYS CD 1.0 -210.0 90.0 CHI2 229 229 A 14 LYS CB A 14 LYS CG A 14 LYS CD A 14 LYS CE 1.0 -90.0 210.0 CHI3 230 230 A 14 LYS CB A 14 LYS CG A 14 LYS CD A 14 LYS CE 1.0 -330.0 -30.0 CHI3 231 231 A 14 LYS CB A 14 LYS CG A 14 LYS CD A 14 LYS CE 1.0 -210.0 90.0 CHI3 232 232 A 14 LYS CG A 14 LYS CD A 14 LYS CE A 14 LYS NZ 1.0 -90.0 210.0 CHI4 233 233 A 14 LYS CG A 14 LYS CD A 14 LYS CE A 14 LYS NZ 1.0 -330.0 -30.0 CHI4 234 234 A 14 LYS CG A 14 LYS CD A 14 LYS CE A 14 LYS NZ 1.0 -210.0 90.0 CHI4 235 235 A 15 ASN N A 15 ASN CA A 15 ASN CB A 15 ASN CG 1.0 -90.0 210.0 CHI1 236 236 A 15 ASN N A 15 ASN CA A 15 ASN CB A 15 ASN CG 1.0 -330.0 -30.0 CHI1 237 237 A 15 ASN N A 15 ASN CA A 15 ASN CB A 15 ASN CG 1.0 -210.0 90.0 CHI1 238 238 A 16 ASP N A 16 ASP CA A 16 ASP CB A 16 ASP CG 1.0 -90.0 210.0 CHI1 239 239 A 16 ASP N A 16 ASP CA A 16 ASP CB A 16 ASP CG 1.0 -330.0 -30.0 CHI1 240 240 A 16 ASP N A 16 ASP CA A 16 ASP CB A 16 ASP CG 1.0 -210.0 90.0 CHI1 241 241 A 17 LYS N A 17 LYS CA A 17 LYS CB A 17 LYS CG 1.0 -90.0 210.0 CHI1 242 242 A 17 LYS N A 17 LYS CA A 17 LYS CB A 17 LYS CG 1.0 -330.0 -30.0 CHI1 243 243 A 17 LYS N A 17 LYS CA A 17 LYS CB A 17 LYS CG 1.0 -210.0 90.0 CHI1 244 244 A 17 LYS CA A 17 LYS CB A 17 LYS CG A 17 LYS CD 1.0 -90.0 210.0 CHI2 245 245 A 17 LYS CA A 17 LYS CB A 17 LYS CG A 17 LYS CD 1.0 -330.0 -30.0 CHI2 246 246 A 17 LYS CA A 17 LYS CB A 17 LYS CG A 17 LYS CD 1.0 -210.0 90.0 CHI2 247 247 A 17 LYS CB A 17 LYS CG A 17 LYS CD A 17 LYS CE 1.0 -90.0 210.0 CHI3 248 248 A 17 LYS CB A 17 LYS CG A 17 LYS CD A 17 LYS CE 1.0 -330.0 -30.0 CHI3 249 249 A 17 LYS CB A 17 LYS CG A 17 LYS CD A 17 LYS CE 1.0 -210.0 90.0 CHI3 250 250 A 17 LYS CG A 17 LYS CD A 17 LYS CE A 17 LYS NZ 1.0 -90.0 210.0 CHI4 251 251 A 17 LYS CG A 17 LYS CD A 17 LYS CE A 17 LYS NZ 1.0 -330.0 -30.0 CHI4 252 252 A 17 LYS CG A 17 LYS CD A 17 LYS CE A 17 LYS NZ 1.0 -210.0 90.0 CHI4 253 253 A 18 CYS N A 18 CYS CA A 18 CYS CB A 18 CYS SG 1.0 -90.0 210.0 CHI1 254 254 A 18 CYS N A 18 CYS CA A 18 CYS CB A 18 CYS SG 1.0 -330.0 -30.0 CHI1 255 255 A 18 CYS N A 18 CYS CA A 18 CYS CB A 18 CYS SG 1.0 -210.0 90.0 CHI1 256 256 A 19 CYS N A 19 CYS CA A 19 CYS CB A 19 CYS SG 1.0 -90.0 210.0 CHI1 257 257 A 19 CYS N A 19 CYS CA A 19 CYS CB A 19 CYS SG 1.0 -330.0 -30.0 CHI1 258 258 A 19 CYS N A 19 CYS CA A 19 CYS CB A 19 CYS SG 1.0 -210.0 90.0 CHI1 259 259 A 21 ASN N A 21 ASN CA A 21 ASN CB A 21 ASN CG 1.0 -90.0 210.0 CHI1 260 260 A 21 ASN N A 21 ASN CA A 21 ASN CB A 21 ASN CG 1.0 -330.0 -30.0 CHI1 261 261 A 21 ASN N A 21 ASN CA A 21 ASN CB A 21 ASN CG 1.0 -210.0 90.0 CHI1 262 262 A 22 TYR N A 22 TYR CA A 22 TYR CB A 22 TYR CG 1.0 -90.0 210.0 CHI1 263 263 A 22 TYR N A 22 TYR CA A 22 TYR CB A 22 TYR CG 1.0 -330.0 -30.0 CHI1 264 264 A 22 TYR N A 22 TYR CA A 22 TYR CB A 22 TYR CG 1.0 -210.0 90.0 CHI1 265 265 A 23 LYS N A 23 LYS CA A 23 LYS CB A 23 LYS CG 1.0 -90.0 210.0 CHI1 266 266 A 23 LYS N A 23 LYS CA A 23 LYS CB A 23 LYS CG 1.0 -330.0 -30.0 CHI1 267 267 A 23 LYS N A 23 LYS CA A 23 LYS CB A 23 LYS CG 1.0 -210.0 90.0 CHI1 268 268 A 23 LYS CA A 23 LYS CB A 23 LYS CG A 23 LYS CD 1.0 -90.0 210.0 CHI2 269 269 A 23 LYS CA A 23 LYS CB A 23 LYS CG A 23 LYS CD 1.0 -330.0 -30.0 CHI2 270 270 A 23 LYS CA A 23 LYS CB A 23 LYS CG A 23 LYS CD 1.0 -210.0 90.0 CHI2 271 271 A 23 LYS CB A 23 LYS CG A 23 LYS CD A 23 LYS CE 1.0 -90.0 210.0 CHI3 272 272 A 23 LYS CB A 23 LYS CG A 23 LYS CD A 23 LYS CE 1.0 -330.0 -30.0 CHI3 273 273 A 23 LYS CB A 23 LYS CG A 23 LYS CD A 23 LYS CE 1.0 -210.0 90.0 CHI3 274 274 A 23 LYS CG A 23 LYS CD A 23 LYS CE A 23 LYS NZ 1.0 -90.0 210.0 CHI4 275 275 A 23 LYS CG A 23 LYS CD A 23 LYS CE A 23 LYS NZ 1.0 -330.0 -30.0 CHI4 276 276 A 23 LYS CG A 23 LYS CD A 23 LYS CE A 23 LYS NZ 1.0 -210.0 90.0 CHI4 277 277 A 24 CYS N A 24 CYS CA A 24 CYS CB A 24 CYS SG 1.0 -90.0 210.0 CHI1 278 278 A 24 CYS N A 24 CYS CA A 24 CYS CB A 24 CYS SG 1.0 -330.0 -30.0 CHI1 279 279 A 24 CYS N A 24 CYS CA A 24 CYS CB A 24 CYS SG 1.0 -210.0 90.0 CHI1 280 280 A 25 SER N A 25 SER CA A 25 SER CB A 25 SER OG 1.0 -90.0 210.0 CHI1 281 281 A 25 SER N A 25 SER CA A 25 SER CB A 25 SER OG 1.0 -330.0 -30.0 CHI1 282 282 A 25 SER N A 25 SER CA A 25 SER CB A 25 SER OG 1.0 -210.0 90.0 CHI1 283 283 A 26 SER N A 26 SER CA A 26 SER CB A 26 SER OG 1.0 -90.0 210.0 CHI1 284 284 A 26 SER N A 26 SER CA A 26 SER CB A 26 SER OG 1.0 -330.0 -30.0 CHI1 285 285 A 26 SER N A 26 SER CA A 26 SER CB A 26 SER OG 1.0 -210.0 90.0 CHI1 286 286 A 27 LYS N A 27 LYS CA A 27 LYS CB A 27 LYS CG 1.0 -90.0 210.0 CHI1 287 287 A 27 LYS N A 27 LYS CA A 27 LYS CB A 27 LYS CG 1.0 -330.0 -30.0 CHI1 288 288 A 27 LYS N A 27 LYS CA A 27 LYS CB A 27 LYS CG 1.0 -210.0 90.0 CHI1 289 289 A 27 LYS CA A 27 LYS CB A 27 LYS CG A 27 LYS CD 1.0 -90.0 210.0 CHI2 290 290 A 27 LYS CA A 27 LYS CB A 27 LYS CG A 27 LYS CD 1.0 -330.0 -30.0 CHI2 291 291 A 27 LYS CA A 27 LYS CB A 27 LYS CG A 27 LYS CD 1.0 -210.0 90.0 CHI2 292 292 A 27 LYS CB A 27 LYS CG A 27 LYS CD A 27 LYS CE 1.0 -90.0 210.0 CHI3 293 293 A 27 LYS CB A 27 LYS CG A 27 LYS CD A 27 LYS CE 1.0 -330.0 -30.0 CHI3 294 294 A 27 LYS CB A 27 LYS CG A 27 LYS CD A 27 LYS CE 1.0 -210.0 90.0 CHI3 295 295 A 27 LYS CG A 27 LYS CD A 27 LYS CE A 27 LYS NZ 1.0 -90.0 210.0 CHI4 296 296 A 27 LYS CG A 27 LYS CD A 27 LYS CE A 27 LYS NZ 1.0 -330.0 -30.0 CHI4 297 297 A 27 LYS CG A 27 LYS CD A 27 LYS CE A 27 LYS NZ 1.0 -210.0 90.0 CHI4 298 298 A 28 ASP N A 28 ASP CA A 28 ASP CB A 28 ASP CG 1.0 -90.0 210.0 CHI1 299 299 A 28 ASP N A 28 ASP CA A 28 ASP CB A 28 ASP CG 1.0 -330.0 -30.0 CHI1 300 300 A 28 ASP N A 28 ASP CA A 28 ASP CB A 28 ASP CG 1.0 -210.0 90.0 CHI1 301 301 A 29 LEU N A 29 LEU CA A 29 LEU CB A 29 LEU CG 1.0 -90.0 210.0 CHI1 302 302 A 29 LEU N A 29 LEU CA A 29 LEU CB A 29 LEU CG 1.0 -330.0 -30.0 CHI1 303 303 A 29 LEU N A 29 LEU CA A 29 LEU CB A 29 LEU CG 1.0 -210.0 90.0 CHI1 304 304 A 29 LEU CA A 29 LEU CB A 29 LEU CG A 29 LEU CD1 1.0 -90.0 210.0 CHI2 305 305 A 29 LEU CA A 29 LEU CB A 29 LEU CG A 29 LEU CD1 1.0 -330.0 -30.0 CHI2 306 306 A 29 LEU CA A 29 LEU CB A 29 LEU CG A 29 LEU CD1 1.0 -210.0 90.0 CHI2 307 307 A 30 TRP N A 30 TRP CA A 30 TRP CB A 30 TRP CG 1.0 -90.0 210.0 CHI1 308 308 A 30 TRP N A 30 TRP CA A 30 TRP CB A 30 TRP CG 1.0 -330.0 -30.0 CHI1 309 309 A 30 TRP N A 30 TRP CA A 30 TRP CB A 30 TRP CG 1.0 -210.0 90.0 CHI1 310 310 A 31 CYS N A 31 CYS CA A 31 CYS CB A 31 CYS SG 1.0 -90.0 210.0 CHI1 311 311 A 31 CYS N A 31 CYS CA A 31 CYS CB A 31 CYS SG 1.0 -330.0 -30.0 CHI1 312 312 A 31 CYS N A 31 CYS CA A 31 CYS CB A 31 CYS SG 1.0 -210.0 90.0 CHI1 313 313 A 32 LYS N A 32 LYS CA A 32 LYS CB A 32 LYS CG 1.0 -90.0 210.0 CHI1 314 314 A 32 LYS N A 32 LYS CA A 32 LYS CB A 32 LYS CG 1.0 -330.0 -30.0 CHI1 315 315 A 32 LYS N A 32 LYS CA A 32 LYS CB A 32 LYS CG 1.0 -210.0 90.0 CHI1 316 316 A 32 LYS CA A 32 LYS CB A 32 LYS CG A 32 LYS CD 1.0 -90.0 210.0 CHI2 317 317 A 32 LYS CA A 32 LYS CB A 32 LYS CG A 32 LYS CD 1.0 -330.0 -30.0 CHI2 318 318 A 32 LYS CA A 32 LYS CB A 32 LYS CG A 32 LYS CD 1.0 -210.0 90.0 CHI2 319 319 A 32 LYS CB A 32 LYS CG A 32 LYS CD A 32 LYS CE 1.0 -90.0 210.0 CHI3 320 320 A 32 LYS CB A 32 LYS CG A 32 LYS CD A 32 LYS CE 1.0 -330.0 -30.0 CHI3 321 321 A 32 LYS CB A 32 LYS CG A 32 LYS CD A 32 LYS CE 1.0 -210.0 90.0 CHI3 322 322 A 32 LYS CG A 32 LYS CD A 32 LYS CE A 32 LYS NZ 1.0 -90.0 210.0 CHI4 323 323 A 32 LYS CG A 32 LYS CD A 32 LYS CE A 32 LYS NZ 1.0 -330.0 -30.0 CHI4 324 324 A 32 LYS CG A 32 LYS CD A 32 LYS CE A 32 LYS NZ 1.0 -210.0 90.0 CHI4 325 325 A 33 TYR N A 33 TYR CA A 33 TYR CB A 33 TYR CG 1.0 -90.0 210.0 CHI1 326 326 A 33 TYR N A 33 TYR CA A 33 TYR CB A 33 TYR CG 1.0 -330.0 -30.0 CHI1 327 327 A 33 TYR N A 33 TYR CA A 33 TYR CB A 33 TYR CG 1.0 -210.0 90.0 CHI1 328 328 A 34 LYS N A 34 LYS CA A 34 LYS CB A 34 LYS CG 1.0 -90.0 210.0 CHI1 329 329 A 34 LYS N A 34 LYS CA A 34 LYS CB A 34 LYS CG 1.0 -330.0 -30.0 CHI1 330 330 A 34 LYS N A 34 LYS CA A 34 LYS CB A 34 LYS CG 1.0 -210.0 90.0 CHI1 331 331 A 34 LYS CA A 34 LYS CB A 34 LYS CG A 34 LYS CD 1.0 -90.0 210.0 CHI2 332 332 A 34 LYS CA A 34 LYS CB A 34 LYS CG A 34 LYS CD 1.0 -330.0 -30.0 CHI2 333 333 A 34 LYS CA A 34 LYS CB A 34 LYS CG A 34 LYS CD 1.0 -210.0 90.0 CHI2 334 334 A 34 LYS CB A 34 LYS CG A 34 LYS CD A 34 LYS CE 1.0 -90.0 210.0 CHI3 335 335 A 34 LYS CB A 34 LYS CG A 34 LYS CD A 34 LYS CE 1.0 -330.0 -30.0 CHI3 336 336 A 34 LYS CB A 34 LYS CG A 34 LYS CD A 34 LYS CE 1.0 -210.0 90.0 CHI3 337 337 A 34 LYS CG A 34 LYS CD A 34 LYS CE A 34 LYS NZ 1.0 -90.0 210.0 CHI4 338 338 A 34 LYS CG A 34 LYS CD A 34 LYS CE A 34 LYS NZ 1.0 -330.0 -30.0 CHI4 339 339 A 34 LYS CG A 34 LYS CD A 34 LYS CE A 34 LYS NZ 1.0 -210.0 90.0 CHI4 340 340 A 35 ILE N A 35 ILE CA A 35 ILE CB A 35 ILE CG1 1.0 -90.0 210.0 CHI1 341 341 A 35 ILE N A 35 ILE CA A 35 ILE CB A 35 ILE CG1 1.0 -330.0 -30.0 CHI1 342 342 A 35 ILE N A 35 ILE CA A 35 ILE CB A 35 ILE CG1 1.0 -210.0 90.0 CHI1 343 343 A 35 ILE CA A 35 ILE CB A 35 ILE CG1 A 35 ILE CD1 1.0 -90.0 210.0 CHI21 344 344 A 35 ILE CA A 35 ILE CB A 35 ILE CG1 A 35 ILE CD1 1.0 -330.0 -30.0 CHI21 345 345 A 35 ILE CA A 35 ILE CB A 35 ILE CG1 A 35 ILE CD1 1.0 -210.0 90.0 CHI21 346 346 A 36 TRP N A 36 TRP CA A 36 TRP CB A 36 TRP CG 1.0 -90.0 210.0 CHI1 347 347 A 36 TRP N A 36 TRP CA A 36 TRP CB A 36 TRP CG 1.0 -330.0 -30.0 CHI1 348 348 A 36 TRP N A 36 TRP CA A 36 TRP CB A 36 TRP CG 1.0 -210.0 90.0 CHI1 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.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.folding 1 ppm 1H 15 'not observed' 2 ppm 13C 72 'not observed' 3 ppm 1H 12 'not observed' stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.folding 1 ppm 1H 15 'not observed' 2 ppm 13C 26 'not observed' 3 ppm 1H 12 'not observed' stop_ save_ save_spectral_peak_list_3 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_3 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.folding 1 ppm 1H 15 'not observed' 2 ppm 15N 26 'not observed' 3 ppm 1H 12 'not observed' stop_ save_