data_nef_c15259_2jpl 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 PDB 2JPJ PDB 2JPL 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 THR middle . . 3 A 3 TRP middle . . 4 A 4 ASP middle . . 5 A 5 ASP middle . . 6 A 6 ILE middle . . 7 A 7 GLY middle . false 8 A 8 GLN middle . . 9 A 9 GLY middle . false 10 A 10 ILE middle . . 11 A 11 GLY middle . false 12 A 12 ARG middle . . 13 A 13 VAL middle . . 14 A 14 ALA middle . . 15 A 15 TYR middle . . 16 A 16 TRP middle . . 17 A 17 VAL middle . . 18 A 18 GLY middle . false 19 A 19 LYS middle . . 20 A 20 ALA middle . . 21 A 21 LEU middle . . 22 A 22 GLY middle . false 23 A 23 ASN middle . . 24 A 24 LEU middle . . 25 A 25 SER middle . . 26 A 26 ASP middle . . 27 A 27 VAL middle . . 28 A 28 ASN middle . . 29 A 29 GLN middle . . 30 A 30 ALA middle . . 31 A 31 SER middle . . 32 A 32 ARG middle . . 33 A 33 ILE middle . . 34 A 34 ASN middle . . 35 A 35 ARG middle . . 36 A 36 LYS middle . . 37 A 37 LYS middle . . 38 A 38 LYS middle . . 39 A 39 HIS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY HAx H 1 4.738 0.010 A 1 GLY HAy H 1 4.738 0.010 A 2 THR H H 1 8.794 0.010 A 2 THR HA H 1 3.968 0.010 A 2 THR HB H 1 3.935 0.010 A 2 THR HG2% H 1 1.030 0.010 A 2 THR N N 15 118.097 0.100 A 3 TRP H H 1 8.799 0.010 A 3 TRP HA H 1 4.417 0.010 A 3 TRP HBx H 1 3.259 0.010 A 3 TRP HBy H 1 3.259 0.010 A 3 TRP HD1 H 1 7.330 0.010 A 3 TRP HE1 H 1 10.628 0.010 A 3 TRP HE3 H 1 7.464 0.010 A 3 TRP HH2 H 1 7.012 0.010 A 3 TRP HZ2 H 1 7.432 0.010 A 3 TRP HZ3 H 1 6.909 0.010 A 3 TRP N N 15 120.810 0.100 A 3 TRP NE1 N 15 130.290 0.100 A 4 ASP H H 1 8.200 0.010 A 4 ASP HA H 1 4.433 0.010 A 4 ASP HBx H 1 2.811 0.010 A 4 ASP HBy H 1 2.811 0.010 A 4 ASP N N 15 116.973 0.100 A 5 ASP H H 1 8.020 0.010 A 5 ASP HA H 1 4.450 0.010 A 5 ASP HBx H 1 3.088 0.010 A 5 ASP HBy H 1 3.088 0.010 A 5 ASP N N 15 118.189 0.100 A 6 ILE H H 1 8.106 0.010 A 6 ILE HA H 1 3.793 0.010 A 6 ILE HB H 1 1.978 0.010 A 6 ILE HD1% H 1 0.690 0.010 A 6 ILE HG1x H 1 1.689 0.010 A 6 ILE HG1y H 1 1.689 0.010 A 6 ILE HG2% H 1 0.875 0.010 A 6 ILE N N 15 120.020 0.100 A 7 GLY H H 1 8.467 0.010 A 7 GLY HA2 H 1 3.855 0.010 A 7 GLY HA3 H 1 3.611 0.010 A 7 GLY N N 15 107.561 0.100 A 8 GLN H H 1 8.206 0.010 A 8 GLN HA H 1 4.137 0.010 A 8 GLN HBx H 1 2.112 0.010 A 8 GLN HBy H 1 2.112 0.010 A 8 GLN HG2 H 1 2.360 0.010 A 8 GLN HG3 H 1 2.496 0.010 A 8 GLN N N 15 119.470 0.100 A 9 GLY H H 1 8.272 0.010 A 9 GLY HA2 H 1 3.928 0.010 A 9 GLY HA3 H 1 3.721 0.010 A 9 GLY N N 15 108.212 0.100 A 10 ILE H H 1 8.433 0.010 A 10 ILE HA H 1 3.769 0.010 A 10 ILE HB H 1 1.987 0.010 A 10 ILE HD1% H 1 0.834 0.010 A 10 ILE HG1x H 1 1.166 0.010 A 10 ILE HG1y H 1 1.166 0.010 A 10 ILE HG2% H 1 0.922 0.010 A 10 ILE N N 15 120.895 0.100 A 11 GLY H H 1 8.288 0.010 A 11 GLY HA2 H 1 3.947 0.010 A 11 GLY HA3 H 1 3.763 0.010 A 11 GLY N N 15 107.425 0.100 A 12 ARG H H 1 7.902 0.010 A 12 ARG HA H 1 4.179 0.010 A 12 ARG HBx H 1 2.008 0.010 A 12 ARG HBy H 1 2.008 0.010 A 12 ARG HDx H 1 3.161 0.010 A 12 ARG HDy H 1 3.161 0.010 A 12 ARG HE H 1 7.636 0.010 A 12 ARG HG2 H 1 1.817 0.010 A 12 ARG HG3 H 1 1.728 0.010 A 12 ARG N N 15 121.056 0.100 A 12 ARG NE N 15 83.769 0.100 A 13 VAL H H 1 7.952 0.010 A 13 VAL HA H 1 3.788 0.010 A 13 VAL HB H 1 2.296 0.010 A 13 VAL HGx% H 1 1.092 0.010 A 13 VAL HGy% H 1 0.956 0.010 A 13 VAL N N 15 118.823 0.100 A 14 ALA H H 1 8.649 0.010 A 14 ALA HA H 1 3.897 0.010 A 14 ALA HB% H 1 1.480 0.010 A 14 ALA N N 15 120.922 0.100 A 15 TYR H H 1 8.008 0.010 A 15 TYR HA H 1 4.072 0.010 A 15 TYR HBx H 1 3.077 0.010 A 15 TYR HBy H 1 3.077 0.010 A 15 TYR HDx H 1 6.557 0.010 A 15 TYR HDy H 1 6.557 0.010 A 15 TYR HEx H 1 6.282 0.010 A 15 TYR HEy H 1 6.282 0.010 A 15 TYR N N 15 117.954 0.100 A 16 TRP H H 1 7.900 0.010 A 16 TRP HA H 1 4.180 0.010 A 16 TRP HB2 H 1 3.406 0.010 A 16 TRP HB3 H 1 3.333 0.010 A 16 TRP HD1 H 1 7.385 0.010 A 16 TRP HE1 H 1 10.733 0.010 A 16 TRP HE3 H 1 7.488 0.010 A 16 TRP HH2 H 1 7.175 0.010 A 16 TRP HZ2 H 1 7.531 0.010 A 16 TRP HZ3 H 1 6.981 0.010 A 16 TRP N N 15 120.393 0.100 A 16 TRP NE1 N 15 129.666 0.100 A 17 VAL H H 1 8.809 0.010 A 17 VAL HA H 1 3.512 0.010 A 17 VAL HB H 1 2.159 0.010 A 17 VAL HGx% H 1 1.094 0.010 A 17 VAL HGy% H 1 0.887 0.010 A 17 VAL N N 15 119.371 0.100 A 18 GLY H H 1 8.412 0.010 A 18 GLY HA2 H 1 3.812 0.010 A 18 GLY HA3 H 1 3.612 0.010 A 18 GLY N N 15 106.142 0.100 A 19 LYS H H 1 8.133 0.010 A 19 LYS HA H 1 4.211 0.010 A 19 LYS HBx H 1 1.670 0.010 A 19 LYS HBy H 1 1.670 0.010 A 19 LYS HDx H 1 1.750 0.010 A 19 LYS HDy H 1 1.750 0.010 A 19 LYS HGx H 1 1.320 0.010 A 19 LYS HGy H 1 1.320 0.010 A 19 LYS N N 15 122.321 0.100 A 20 ALA H H 1 7.749 0.010 A 20 ALA HA H 1 3.913 0.010 A 20 ALA HB% H 1 1.664 0.010 A 20 ALA N N 15 121.056 0.100 A 21 LEU H H 1 8.258 0.010 A 21 LEU HA H 1 4.029 0.010 A 21 LEU HBx H 1 1.836 0.010 A 21 LEU HBy H 1 1.836 0.010 A 21 LEU HDx% H 1 0.826 0.010 A 21 LEU HDy% H 1 0.826 0.010 A 21 LEU HG H 1 1.488 0.010 A 21 LEU N N 15 115.814 0.100 A 22 GLY H H 1 7.924 0.010 A 22 GLY HAx H 1 3.858 0.010 A 22 GLY HAy H 1 3.858 0.010 A 22 GLY N N 15 105.736 0.100 A 23 ASN H H 1 7.839 0.010 A 23 ASN HA H 1 4.710 0.010 A 23 ASN HB2 H 1 2.820 0.010 A 23 ASN HB3 H 1 2.715 0.010 A 23 ASN HD21 H 1 7.584 0.010 A 23 ASN HD22 H 1 7.003 0.010 A 23 ASN N N 15 118.092 0.100 A 23 ASN ND2 N 15 112.878 0.100 A 24 LEU H H 1 7.927 0.010 A 24 LEU HA H 1 4.207 0.010 A 24 LEU HBx H 1 1.794 0.010 A 24 LEU HBy H 1 1.794 0.010 A 24 LEU HDx% H 1 0.866 0.010 A 24 LEU HDy% H 1 0.866 0.010 A 24 LEU HG H 1 1.604 0.010 A 24 LEU N N 15 120.503 0.100 A 25 SER H H 1 8.127 0.010 A 25 SER HA H 1 4.277 0.010 A 25 SER HBx H 1 3.863 0.010 A 25 SER HBy H 1 3.863 0.010 A 25 SER N N 15 113.867 0.100 A 26 ASP H H 1 8.225 0.010 A 26 ASP HA H 1 4.656 0.010 A 26 ASP HBx H 1 2.888 0.010 A 26 ASP HBy H 1 2.888 0.010 A 26 ASP N N 15 119.493 0.100 A 27 VAL H H 1 7.838 0.010 A 27 VAL HA H 1 3.967 0.010 A 27 VAL HB H 1 2.147 0.010 A 27 VAL HGx% H 1 0.961 0.010 A 27 VAL HGy% H 1 0.923 0.010 A 27 VAL N N 15 118.559 0.100 A 28 ASN H H 1 8.335 0.010 A 28 ASN HA H 1 4.598 0.010 A 28 ASN HB2 H 1 2.856 0.010 A 28 ASN HB3 H 1 2.785 0.010 A 28 ASN HD21 H 1 6.877 0.010 A 28 ASN HD22 H 1 7.644 0.010 A 28 ASN N N 15 120.376 0.100 A 28 ASN ND2 N 15 112.432 0.100 A 29 GLN H H 1 8.269 0.010 A 29 GLN HA H 1 4.160 0.010 A 29 GLN HB2 H 1 2.117 0.010 A 29 GLN HB3 H 1 1.974 0.010 A 29 GLN HE21 H 1 7.488 0.010 A 29 GLN HE22 H 1 6.822 0.010 A 29 GLN HGx H 1 2.351 0.010 A 29 GLN HGy H 1 2.351 0.010 A 29 GLN N N 15 119.888 0.100 A 29 GLN NE2 N 15 111.912 0.100 A 30 ALA H H 1 8.188 0.010 A 30 ALA HA H 1 4.176 0.010 A 30 ALA HB% H 1 1.390 0.010 A 30 ALA N N 15 122.938 0.100 A 31 SER H H 1 8.071 0.010 A 31 SER HA H 1 4.309 0.010 A 31 SER HB2 H 1 3.840 0.010 A 31 SER HB3 H 1 3.905 0.010 A 31 SER N N 15 113.393 0.100 A 32 ARG H H 1 8.132 0.010 A 32 ARG HA H 1 4.215 0.010 A 32 ARG HBx H 1 1.863 0.010 A 32 ARG HBy H 1 1.863 0.010 A 32 ARG HDx H 1 3.148 0.010 A 32 ARG HDy H 1 3.148 0.010 A 32 ARG HE H 1 7.289 0.010 A 32 ARG HGx H 1 1.628 0.010 A 32 ARG HGy H 1 1.628 0.010 A 32 ARG N N 15 121.679 0.100 A 32 ARG NE N 15 84.418 0.100 A 33 ILE H H 1 7.812 0.010 A 33 ILE HA H 1 4.013 0.010 A 33 ILE HB H 1 1.830 0.010 A 33 ILE HD1% H 1 0.832 0.010 A 33 ILE HG1x H 1 1.664 0.010 A 33 ILE HG1y H 1 1.664 0.010 A 33 ILE HG2% H 1 1.142 0.010 A 33 ILE N N 15 118.969 0.100 A 34 ASN H H 1 8.279 0.010 A 34 ASN HA H 1 4.651 0.010 A 34 ASN HB2 H 1 2.809 0.010 A 34 ASN HB3 H 1 2.703 0.010 A 34 ASN HD21 H 1 7.587 0.010 A 34 ASN HD22 H 1 6.875 0.010 A 34 ASN N N 15 121.552 0.100 A 34 ASN ND2 N 15 112.400 0.100 A 35 ARG H H 1 8.185 0.010 A 35 ARG HA H 1 4.243 0.010 A 35 ARG HBx H 1 1.736 0.010 A 35 ARG HBy H 1 1.736 0.010 A 35 ARG HGx H 1 1.384 0.010 A 35 ARG HGy H 1 1.384 0.010 A 35 ARG N N 15 121.452 0.100 A 35 ARG NE N 15 84.418 0.100 A 36 LYS H H 1 8.239 0.010 A 36 LYS HA H 1 4.238 0.010 A 36 LYS HB2 H 1 1.725 0.010 A 36 LYS HB3 H 1 1.725 0.010 A 36 LYS HD2 H 1 1.836 0.010 A 36 LYS HD3 H 1 1.836 0.010 A 36 LYS HE2 H 1 3.140 0.010 A 36 LYS HE3 H 1 3.140 0.010 A 36 LYS HG2 H 1 1.609 0.010 A 36 LYS HG3 H 1 1.609 0.010 A 36 LYS N N 15 121.679 0.100 A 37 LYS H H 1 8.239 0.010 A 37 LYS HA H 1 4.238 0.010 A 37 LYS HB2 H 1 1.725 0.010 A 37 LYS HB3 H 1 1.725 0.010 A 37 LYS HD2 H 1 1.836 0.010 A 37 LYS HD3 H 1 1.836 0.010 A 37 LYS HE2 H 1 3.140 0.010 A 37 LYS HE3 H 1 3.140 0.010 A 37 LYS HG2 H 1 1.609 0.010 A 37 LYS HG3 H 1 1.609 0.010 A 37 LYS N N 15 121.679 0.100 A 38 LYS H H 1 8.239 0.010 A 38 LYS HA H 1 4.238 0.010 A 38 LYS HB2 H 1 1.725 0.010 A 38 LYS HB3 H 1 1.725 0.010 A 38 LYS HD2 H 1 1.836 0.010 A 38 LYS HD3 H 1 1.836 0.010 A 38 LYS HE2 H 1 3.140 0.010 A 38 LYS HE3 H 1 3.140 0.010 A 38 LYS HG2 H 1 1.609 0.010 A 38 LYS HG3 H 1 1.609 0.010 A 38 LYS N N 15 121.679 0.100 A 39 HIS H H 1 8.254 0.010 A 39 HIS HA H 1 4.508 0.010 A 39 HIS HB2 H 1 3.197 0.010 A 39 HIS HB3 H 1 3.092 0.010 A 39 HIS N N 15 122.706 0.100 stop_ save_ save_assigned_chem_shift_list_2 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_2 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 THR H H 1 8.04 0.01 A 2 THR HA H 1 4.267 0.02 A 2 THR HB H 1 4.208 0.02 A 2 THR HG2% H 1 1.244 0.02 A 2 THR N N 15 111.883 0.2 A 3 TRP H H 1 7.613 0.01 A 3 TRP HA H 1 4.612 0.02 A 3 TRP HBx H 1 3.367 0.02 A 3 TRP HBy H 1 3.367 0.02 A 3 TRP HD1 H 1 7.174 0.02 A 3 TRP HE1 H 1 9.462 0.02 A 3 TRP HE3 H 1 7.631 0.02 A 3 TRP HH2 H 1 7.272 0.02 A 3 TRP HZ2 H 1 7.48 0.02 A 3 TRP HZ3 H 1 7.202 0.02 A 3 TRP N N 15 118.963 0.2 A 3 TRP NE1 N 15 126.499 0.2 A 4 ASP H H 1 7.533 0.01 A 4 ASP HA H 1 4.595 0.02 A 4 ASP HB2 H 1 2.757 0.02 A 4 ASP HB3 H 1 2.643 0.02 A 4 ASP N N 15 116.083 0.2 A 5 ASP H H 1 7.8 0.01 A 5 ASP HA H 1 4.647 0.02 A 5 ASP HBx H 1 2.981 0.02 A 5 ASP HBy H 1 2.981 0.02 A 5 ASP N N 15 117.813 0.2 A 6 ILE H H 1 7.753 0.01 A 6 ILE HA H 1 4.041 0.02 A 6 ILE HB H 1 1.989 0.02 A 6 ILE HD1% H 1 1.002 0.02 A 6 ILE HG1x H 1 1.293 0.02 A 6 ILE HG1y H 1 1.293 0.02 A 6 ILE N N 15 119.511 0.2 A 7 GLY H H 1 8.128 0.01 A 7 GLY HAx H 1 3.88 0.02 A 7 GLY HAy H 1 3.88 0.02 A 7 GLY N N 15 107.173 0.2 A 8 GLN H H 1 7.91 0.01 A 8 GLN HA H 1 4.287 0.02 A 8 GLN HB2 H 1 2.227 0.02 A 8 GLN HB3 H 1 2.172 0.02 A 8 GLN HG2 H 1 2.521 0.02 A 8 GLN HG3 H 1 2.452 0.02 A 8 GLN N N 15 117.838 0.2 A 9 GLY H H 1 8.029 0.01 A 9 GLY HAx H 1 4.003 0.02 A 9 GLY HAy H 1 4.003 0.02 A 9 GLY N N 15 107.161 0.2 A 10 ILE H H 1 7.714 0.01 A 10 ILE HA H 1 4.27 0.02 A 10 ILE HB H 1 2.028 0.02 A 10 ILE HG1x H 1 1.742 0.02 A 10 ILE HG1y H 1 1.742 0.02 A 10 ILE N N 15 119.009 0.2 A 11 GLY H H 1 8.188 0.01 A 11 GLY HAx H 1 3.91 0.02 A 11 GLY HAy H 1 3.91 0.02 A 11 GLY N N 15 106.247 0.2 A 12 ARG H H 1 8.062 0.01 A 12 ARG HA H 1 4.026 0.02 A 12 ARG HBx H 1 1.986 0.02 A 12 ARG HBy H 1 1.986 0.02 A 12 ARG N N 15 121.229 0.2 A 13 VAL H H 1 7.707 0.01 A 13 VAL HA H 1 3.962 0.02 A 13 VAL HB H 1 2.359 0.02 A 13 VAL HGx% H 1 1.109 0.02 A 13 VAL HGy% H 1 1.109 0.02 A 13 VAL N N 15 119.009 0.2 A 14 ALA H H 1 8.451 0.01 A 14 ALA HA H 1 4.12 0.02 A 14 ALA HB% H 1 1.556 0.02 A 14 ALA N N 15 120.108 0.2 A 15 TYR H H 1 8.029 0.01 A 15 TYR HA H 1 4.139 0.02 A 15 TYR HBx H 1 3.168 0.02 A 15 TYR HBy H 1 3.168 0.02 A 15 TYR HDx H 1 6.648 0.02 A 15 TYR HDy H 1 6.648 0.02 A 15 TYR HEx H 1 6.449 0.02 A 15 TYR HEy H 1 6.449 0.02 A 15 TYR N N 15 117.85 0.2 A 16 TRP H H 1 8.031 0.01 A 16 TRP HA H 1 4.369 0.02 A 16 TRP HB2 H 1 3.575 0.02 A 16 TRP HB3 H 1 3.507 0.02 A 16 TRP HD1 H 1 7.447 0.02 A 16 TRP HE1 H 1 9.396 0.02 A 16 TRP HE3 H 1 7.73 0.02 A 16 TRP HH2 H 1 7.3 0.02 A 16 TRP HZ2 H 1 7.51 0.02 A 16 TRP HZ3 H 1 7.181 0.02 A 16 TRP N N 15 120.111 0.2 A 16 TRP NE1 N 15 124.582 0.2 A 17 VAL H H 1 8.966 0.01 A 17 VAL HA H 1 3.716 0.02 A 17 VAL HB H 1 2.183 0.02 A 17 VAL HGx% H 1 1.021 0.02 A 17 VAL HGy% H 1 1.203 0.02 A 17 VAL N N 15 120.639 0.2 A 18 GLY H H 1 8.202 0.01 A 18 GLY HAx H 1 3.83 0.02 A 18 GLY HAy H 1 3.83 0.02 A 18 GLY N N 15 104.907 0.2 A 19 LYS H H 1 7.833 0.01 A 19 LYS HA H 1 4.042 0.02 A 19 LYS HBx H 1 1.837 0.02 A 19 LYS HBy H 1 1.837 0.02 A 19 LYS HGx H 1 1.291 0.02 A 19 LYS HGy H 1 1.291 0.02 A 19 LYS N N 15 121.241 0.2 A 20 ALA H H 1 8.25 0.01 A 20 ALA HA H 1 4.135 0.02 A 20 ALA HB% H 1 1.535 0.02 A 20 ALA N N 15 123.47 0.2 A 21 LEU H H 1 8.747 0.01 A 21 LEU HA H 1 4.23 0.02 A 21 LEU HBx H 1 1.932 0.02 A 21 LEU HBy H 1 1.932 0.02 A 21 LEU HDx% H 1 0.926 0.02 A 21 LEU HDy% H 1 0.926 0.02 A 21 LEU HG H 1 1.57 0.02 A 21 LEU N N 15 117.62 0.2 A 22 GLY H H 1 8.348 0.01 A 22 GLY HAx H 1 3.87 0.02 A 22 GLY HAy H 1 3.87 0.02 A 22 GLY N N 15 108.306 0.2 A 23 ASN H H 1 8.21 0.01 A 23 ASN HA H 1 4.616 0.02 A 23 ASN HB2 H 1 3.05 0.02 A 23 ASN HB3 H 1 2.847 0.02 A 23 ASN HD21 H 1 7.049 0.02 A 23 ASN HD22 H 1 6.296 0.02 A 23 ASN N N 15 120.106 0.2 A 23 ASN ND2 N 15 107.446 0.2 A 24 LEU H H 1 8.433 0.01 A 24 LEU HA H 1 4.192 0.02 A 24 LEU HBx H 1 1.906 0.02 A 24 LEU HBy H 1 1.906 0.02 A 24 LEU HDx% H 1 0.978 0.02 A 24 LEU HDy% H 1 0.978 0.02 A 24 LEU HG H 1 1.561 0.02 A 24 LEU N N 15 119.979 0.2 A 25 SER H H 1 8.439 0.01 A 25 SER HA H 1 4.268 0.02 A 25 SER HBx H 1 4.081 0.02 A 25 SER HBy H 1 4.081 0.02 A 25 SER N N 15 114.516 0.2 A 26 ASP H H 1 8.159 0.01 A 26 ASP HA H 1 4.618 0.02 A 26 ASP HB2 H 1 3.325 0.02 A 26 ASP HB3 H 1 2.997 0.02 A 26 ASP N N 15 121.164 0.2 A 27 VAL H H 1 8.362 0.01 A 27 VAL HA H 1 3.802 0.02 A 27 VAL HB H 1 2.29 0.02 A 27 VAL HGx% H 1 1.041 0.02 A 27 VAL HGy% H 1 1.167 0.02 A 27 VAL N N 15 120.084 0.2 A 28 ASN H H 1 8.475 0.01 A 28 ASN HA H 1 4.455 0.02 A 28 ASN HB2 H 1 3.056 0.02 A 28 ASN HB3 H 1 2.856 0.02 A 28 ASN HD21 H 1 7.453 0.02 A 28 ASN HD22 H 1 6.299 0.02 A 28 ASN N N 15 119.6 0.2 A 28 ASN ND2 N 15 108.229 0.2 A 29 GLN H H 1 8.39 0.01 A 29 GLN HA H 1 4.202 0.02 A 29 GLN HB2 H 1 2.528 0.02 A 29 GLN HB3 H 1 2.309 0.02 A 29 GLN HE21 H 1 6.852 0.02 A 29 GLN HE22 H 1 6.287 0.02 A 29 GLN N N 15 118.975 0.2 A 29 GLN NE2 N 15 106.577 0.2 A 30 ALA H H 1 8.699 0.01 A 30 ALA HA H 1 4.115 0.02 A 30 ALA HB% H 1 1.572 0.02 A 30 ALA N N 15 121.352 0.2 A 31 SER H H 1 8.439 0.01 A 31 SER HA H 1 4.269 0.02 A 31 SER HBx H 1 4.051 0.02 A 31 SER HBy H 1 4.051 0.02 A 31 SER N N 15 112.789 0.2 A 32 ARG H H 1 7.786 0.01 A 32 ARG HA H 1 4.122 0.02 A 32 ARG HB2 H 1 2.077 0.02 A 32 ARG HB3 H 1 1.989 0.02 A 32 ARG HDx H 1 3.25 0.02 A 32 ARG HDy H 1 3.25 0.02 A 32 ARG N N 15 121.801 0.2 A 33 ILE H H 1 8.217 0.01 A 33 ILE HA H 1 3.786 0.02 A 33 ILE HB H 1 2.002 0.02 A 33 ILE HG1x H 1 1.221 0.02 A 33 ILE HG1y H 1 1.221 0.02 A 33 ILE HG2% H 1 0.962 0.02 A 33 ILE N N 15 119.411 0.2 A 34 ASN H H 1 8.334 0.01 A 34 ASN HA H 1 4.49 0.02 A 34 ASN HB2 H 1 2.975 0.02 A 34 ASN HB3 H 1 2.78 0.02 A 34 ASN HD21 H 1 7.336 0.02 A 34 ASN HD22 H 1 6.403 0.02 A 34 ASN N N 15 116.76 0.2 A 34 ASN ND2 N 15 108.402 0.2 A 35 ARG H H 1 7.95 0.01 A 35 ARG HA H 1 4.188 0.02 A 35 ARG HBx H 1 2.036 0.02 A 35 ARG HBy H 1 2.036 0.02 A 35 ARG N N 15 117.85 0.2 A 36 LYS H H 1 7.808 0.01 A 36 LYS HA H 1 4.262 0.02 A 36 LYS HBx H 1 1.932 0.02 A 36 LYS HBy H 1 1.932 0.02 A 36 LYS HDx H 1 1.752 0.02 A 36 LYS HDy H 1 1.752 0.02 A 36 LYS HEx H 1 2.998 0.02 A 36 LYS HEy H 1 2.998 0.02 A 36 LYS HGx H 1 1.5 0.02 A 36 LYS HGy H 1 1.5 0.02 A 36 LYS N N 15 117.958 0.2 A 37 LYS H H 1 8.095 0.01 A 37 LYS HA H 1 4.215 0.02 A 37 LYS HB2 H 1 1.685 0.02 A 37 LYS HB3 H 1 1.685 0.02 A 37 LYS HD2 H 1 1.95 0.02 A 37 LYS HD3 H 1 1.95 0.02 A 37 LYS HE2 H 1 3.011 0.02 A 37 LYS HE3 H 1 3.011 0.02 A 37 LYS HG2 H 1 1.508 0.02 A 37 LYS HG3 H 1 1.508 0.02 A 37 LYS N N 15 117.826 0.2 A 38 LYS H H 1 8.095 0.01 A 38 LYS HA H 1 4.215 0.02 A 38 LYS HB2 H 1 1.685 0.02 A 38 LYS HB3 H 1 1.685 0.02 A 38 LYS HD2 H 1 1.95 0.02 A 38 LYS HD3 H 1 1.95 0.02 A 38 LYS HE2 H 1 3.011 0.02 A 38 LYS HE3 H 1 3.011 0.02 A 38 LYS HG2 H 1 1.508 0.02 A 38 LYS HG3 H 1 1.508 0.02 A 38 LYS N N 15 117.826 0.2 A 39 HIS H H 1 7.952 0.01 A 39 HIS HA H 1 4.7 0.02 A 39 HIS HB2 H 1 3.455 0.02 A 39 HIS HB3 H 1 3.283 0.02 A 39 HIS HD2 H 1 7.295 0.02 A 39 HIS HE1 H 1 8.453 0.02 A 39 HIS N N 15 116.169 0.2 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 2 THR H A 2 THR HG2% 1.0 . 4.52 2 2 A 2 THR H A 5 ASP HBx 1.0 . 5.66 3 2 A 2 THR H A 5 ASP HBy 1.0 . 5.66 4 3 A 2 THR H A 3 TRP HBx 1.0 . 4.50 5 3 A 2 THR H A 3 TRP HBy 1.0 . 4.50 6 4 A 2 THR H A 2 THR HA 1.0 . 3.99 7 5 A 2 THR H A 3 TRP HA 1.0 . 6.32 8 6 A 2 THR H A 3 TRP H 1.0 . 4.83 9 7 A 3 TRP H A 6 ILE HD1% 1.0 . 4.45 10 8 A 2 THR HG2% A 3 TRP H 1.0 . 5.88 11 9 A 3 TRP H A 3 TRP HBx 1.0 . 4.13 12 9 A 3 TRP HBy A 3 TRP H 1.0 . 4.13 13 10 A 2 THR HA A 3 TRP H 1.0 . 3.89 14 11 A 3 TRP HA A 3 TRP H 1.0 . 3.92 15 12 A 3 TRP H A 3 TRP HD1 1.0 . 5.60 16 13 A 3 TRP HE1 A 3 TRP HBx 1.0 . 6.50 17 13 A 3 TRP HBy A 3 TRP HE1 1.0 . 6.50 18 14 A 3 TRP HD1 A 3 TRP HE1 1.0 . 3.85 19 15 A 3 TRP HE1 A 3 TRP HZ2 1.0 . 4.72 20 16 A 6 ILE HD1% A 4 ASP H 1.0 . 4.97 21 17 A 4 ASP H A 4 ASP HB3 1.0 . 4.30 22 18 A 4 ASP H A 4 ASP HB2 1.0 . 4.17 23 19 A 4 ASP H A 3 TRP HBx 1.0 . 4.99 24 19 A 3 TRP HBy A 4 ASP H 1.0 . 4.99 25 20 A 4 ASP H A 2 THR HB 1.0 . 5.37 26 21 A 4 ASP H A 4 ASP HA 1.0 . 3.62 27 22 A 4 ASP H A 5 ASP H 1.0 . 4.50 28 23 A 6 ILE HD1% A 5 ASP H 1.0 . 4.18 29 24 A 5 ASP H A 6 ILE HG1x 1.0 . 4.46 30 24 A 5 ASP H A 6 ILE HG1y 1.0 . 4.46 31 25 A 5 ASP H A 8 GLN HB2 1.0 . 6.50 32 25 A 5 ASP H A 8 GLN HB3 1.0 . 6.50 33 26 A 4 ASP HB3 A 5 ASP H 1.0 . 5.17 34 27 A 4 ASP HB2 A 5 ASP H 1.0 . 4.91 35 28 A 5 ASP H A 5 ASP HBx 1.0 . 4.10 36 28 A 5 ASP HBy A 5 ASP H 1.0 . 4.10 37 29 A 5 ASP H A 6 ILE HA 1.0 . 5.60 38 30 A 5 ASP H A 5 ASP HA 1.0 . 3.91 39 31 A 6 ILE HD1% A 6 ILE H 1.0 . 4.34 40 32 A 6 ILE H A 6 ILE HG1x 1.0 . 5.36 41 32 A 6 ILE HG1y A 6 ILE H 1.0 . 5.36 42 33 A 6 ILE H A 6 ILE HB 1.0 . 3.77 43 34 A 6 ILE H A 5 ASP HBx 1.0 . 4.87 44 34 A 5 ASP HBy A 6 ILE H 1.0 . 4.87 45 35 A 6 ILE HA A 6 ILE H 1.0 . 3.91 46 36 A 5 ASP HA A 6 ILE H 1.0 . 4.18 47 37 A 6 ILE H A 8 GLN H 1.0 . 5.36 48 38 A 6 ILE H A 7 GLY H 1.0 . 4.71 49 39 A 6 ILE HD1% A 7 GLY H 1.0 . 4.82 50 40 A 7 GLY H A 6 ILE HG1x 1.0 . 4.27 51 40 A 6 ILE HG1y A 7 GLY H 1.0 . 4.27 52 41 A 6 ILE HB A 7 GLY H 1.0 . 4.31 53 42 A 8 GLN HB3 A 7 GLY H 1.0 . 5.93 54 43 A 7 GLY H A 8 GLN HB2 1.0 . 5.93 55 44 A 7 GLY H A 8 GLN HG3 1.0 . 4.57 56 44 A 7 GLY H A 8 GLN HG2 1.0 . 4.57 57 45 A 7 GLY H A 8 GLN HG3 1.0 . 5.32 58 46 A 7 GLY H A 8 GLN HG2 1.0 . 5.32 59 47 A 7 GLY H A 7 GLY HAx 1.0 . 3.82 60 47 A 7 GLY H A 7 GLY HAy 1.0 . 3.82 61 48 A 6 ILE HA A 7 GLY H 1.0 . 4.17 62 49 A 7 GLY H A 8 GLN HA 1.0 . 5.84 63 50 A 4 ASP HA A 7 GLY H 1.0 . 5.19 64 51 A 6 ILE HD1% A 8 GLN H 1.0 . 6.29 65 52 A 8 GLN HB3 A 8 GLN H 1.0 . 4.18 66 53 A 8 GLN H A 8 GLN HB2 1.0 . 4.18 67 54 A 8 GLN H A 8 GLN HG3 1.0 . 5.27 68 55 A 8 GLN H A 8 GLN HG2 1.0 . 5.27 69 56 A 8 GLN H A 5 ASP HBx 1.0 . 5.64 70 56 A 5 ASP HBy A 8 GLN H 1.0 . 5.64 71 57 A 8 GLN H A 7 GLY HAx 1.0 . 4.42 72 57 A 8 GLN H A 7 GLY HAy 1.0 . 4.42 73 58 A 6 ILE HA A 8 GLN H 1.0 . 4.85 74 59 A 8 GLN H A 8 GLN HA 1.0 . 3.85 75 60 A 5 ASP HA A 8 GLN H 1.0 . 4.93 76 61 A 8 GLN H A 9 GLY H 1.0 . 4.30 77 62 A 8 GLN H A 7 GLY H 1.0 . 4.55 78 63 A 6 ILE HD1% A 9 GLY H 1.0 . 6.34 79 64 A 6 ILE HB A 9 GLY H 1.0 . 5.53 80 65 A 8 GLN HB3 A 9 GLY H 1.0 . 4.41 81 66 A 9 GLY H A 8 GLN HB2 1.0 . 4.41 82 67 A 9 GLY H A 8 GLN HG3 1.0 . 4.92 83 68 A 9 GLY H A 8 GLN HG3 1.0 . 4.23 84 68 A 8 GLN HG2 A 9 GLY H 1.0 . 4.23 85 69 A 8 GLN HG2 A 9 GLY H 1.0 . 4.92 86 70 A 9 GLY H A 9 GLY HAx 1.0 . 3.80 87 70 A 9 GLY H A 9 GLY HAy 1.0 . 3.80 88 71 A 8 GLN HA A 9 GLY H 1.0 . 4.32 89 72 A 10 ILE H A 10 ILE HG1x 1.0 . 5.92 90 72 A 10 ILE H A 10 ILE HG1y 1.0 . 5.92 91 73 A 10 ILE H A 10 ILE HB 1.0 . 3.74 92 74 A 10 ILE H A 11 GLY H 1.0 . 4.80 93 75 A 11 GLY H A 14 ALA HB% 1.0 . 6.06 94 76 A 11 GLY H A 10 ILE HG1x 1.0 . 4.67 95 76 A 10 ILE HG1y A 11 GLY H 1.0 . 4.67 96 77 A 11 GLY H A 12 ARG HBx 1.0 . 5.05 97 77 A 11 GLY H A 12 ARG HBy 1.0 . 5.05 98 78 A 11 GLY H A 11 GLY HAx 1.0 . 3.89 99 78 A 11 GLY H A 11 GLY HAy 1.0 . 3.89 100 79 A 8 GLN HA A 11 GLY H 1.0 . 5.12 101 80 A 12 ARG H A 12 ARG HBx 1.0 . 4.31 102 80 A 12 ARG HBy A 12 ARG H 1.0 . 4.31 103 81 A 12 ARG H A 13 VAL HB 1.0 . 5.76 104 82 A 12 ARG H A 11 GLY HAx 1.0 . 5.05 105 82 A 11 GLY HAy A 12 ARG H 1.0 . 5.05 106 83 A 12 ARG H A 12 ARG HA 1.0 . 3.66 107 84 A 10 ILE H A 12 ARG H 1.0 . 5.88 108 85 A 11 GLY H A 12 ARG H 1.0 . 4.60 109 86 A 13 VAL H A 15 TYR HBx 1.0 . 5.60 110 86 A 13 VAL H A 15 TYR HBy 1.0 . 5.60 111 87 A 13 VAL H A 13 VAL HA 1.0 . 3.78 112 88 A 13 VAL H A 16 TRP H 1.0 . 5.76 113 89 A 14 ALA HB% A 14 ALA H 1.0 . 4.52 114 90 A 13 VAL HB A 14 ALA H 1.0 . 4.31 115 91 A 14 ALA H A 15 TYR HBx 1.0 . 5.89 116 91 A 15 TYR HBy A 14 ALA H 1.0 . 5.89 117 92 A 13 VAL HA A 14 ALA H 1.0 . 4.59 118 93 A 14 ALA H A 14 ALA HA 1.0 . 4.03 119 94 A 13 VAL H A 14 ALA H 1.0 . 4.73 120 95 A 14 ALA H A 15 TYR H 1.0 . 5.04 121 96 A 14 ALA HB% A 15 TYR H 1.0 . 5.10 122 97 A 15 TYR H A 15 TYR HBx 1.0 . 3.76 123 97 A 15 TYR HBy A 15 TYR H 1.0 . 3.76 124 98 A 13 VAL HA A 15 TYR H 1.0 . 4.77 125 99 A 15 TYR H A 15 TYR HA 1.0 . 3.99 126 100 A 15 TYR H A 15 TYR HD% 1.0 . 6.11 127 101 A 16 TRP H A 19 LYS HBx 1.0 . 6.43 128 101 A 16 TRP H A 19 LYS HBy 1.0 . 6.43 129 102 A 16 TRP H A 17 VAL HB 1.0 . 5.40 130 103 A 16 TRP H A 15 TYR HBx 1.0 . 4.27 131 103 A 15 TYR HBy A 16 TRP H 1.0 . 4.27 132 104 A 16 TRP H A 16 TRP HB3 1.0 . 4.28 133 105 A 16 TRP H A 16 TRP HB2 1.0 . 4.41 134 106 A 16 TRP H A 17 VAL HA 1.0 . 5.47 135 107 A 13 VAL HA A 16 TRP H 1.0 . 4.70 136 108 A 16 TRP H A 15 TYR HA 1.0 . 4.78 137 109 A 16 TRP H A 16 TRP HA 1.0 . 4.30 138 110 A 16 TRP H A 15 TYR HE% 1.0 . 4.41 139 111 A 16 TRP H A 15 TYR HD% 1.0 . 6.45 140 112 A 16 TRP H A 16 TRP HD1 1.0 . 5.49 141 113 A 16 TRP H A 16 TRP HE3 1.0 . 5.77 142 114 A 16 TRP H A 17 VAL H 1.0 . 4.61 143 115 A 17 VAL H A 17 VAL HGx% 1.0 . 4.33 144 116 A 13 VAL HB A 17 VAL H 1.0 . 5.97 145 117 A 16 TRP HB3 A 17 VAL H 1.0 . 4.70 146 118 A 13 VAL HA A 17 VAL H 1.0 . 4.96 147 119 A 14 ALA HA A 17 VAL H 1.0 . 4.55 148 120 A 14 ALA H A 17 VAL H 1.0 . 5.86 149 121 A 18 GLY H A 17 VAL HGx% 1.0 . 5.27 150 122 A 18 GLY H A 17 VAL HGy% 1.0 . 5.41 151 123 A 18 GLY H A 21 LEU HBx 1.0 . 6.10 152 123 A 18 GLY H A 21 LEU HBy 1.0 . 6.10 153 124 A 17 VAL HB A 18 GLY H 1.0 . 4.55 154 125 A 18 GLY H A 15 TYR HBx 1.0 . 5.39 155 125 A 15 TYR HBy A 18 GLY H 1.0 . 5.39 156 126 A 16 TRP HB2 A 18 GLY H 1.0 . 6.32 157 127 A 18 GLY H A 18 GLY HAx 1.0 . 4.29 158 127 A 18 GLY H A 18 GLY HAy 1.0 . 4.29 159 128 A 15 TYR HA A 18 GLY H 1.0 . 4.78 160 129 A 16 TRP HA A 18 GLY H 1.0 . 6.25 161 130 A 15 TYR H A 18 GLY H 1.0 . 5.83 162 131 A 18 GLY H A 21 LEU H 1.0 . 4.81 163 132 A 17 VAL H A 18 GLY H 1.0 . 4.74 164 133 A 19 LYS H A 20 ALA HB% 1.0 . 5.60 165 134 A 19 LYS H A 19 LYS HBx 1.0 . 4.44 166 134 A 19 LYS HBy A 19 LYS H 1.0 . 4.44 167 135 A 17 VAL HB A 19 LYS H 1.0 . 6.32 168 136 A 19 LYS H A 15 TYR HBx 1.0 . 5.30 169 136 A 15 TYR HBy A 19 LYS H 1.0 . 5.30 170 137 A 16 TRP HB2 A 19 LYS H 1.0 . 6.27 171 138 A 17 VAL HA A 19 LYS H 1.0 . 5.60 172 139 A 19 LYS H A 18 GLY HAx 1.0 . 5.10 173 139 A 18 GLY HAy A 19 LYS H 1.0 . 5.10 174 140 A 19 LYS H A 19 LYS HA 1.0 . 4.11 175 141 A 16 TRP HA A 19 LYS H 1.0 . 4.96 176 142 A 16 TRP H A 19 LYS H 1.0 . 5.97 177 143 A 18 GLY H A 19 LYS H 1.0 . 4.55 178 144 A 17 VAL H A 19 LYS H 1.0 . 6.26 179 145 A 20 ALA H A 21 LEU HDx% 1.0 . 4.16 180 145 A 20 ALA H A 21 LEU HDy% 1.0 . 4.16 181 146 A 20 ALA H A 17 VAL HGy% 1.0 . 4.85 182 146 A 20 ALA H A 17 VAL HGx% 1.0 . 4.85 183 147 A 20 ALA HB% A 20 ALA H 1.0 . 4.40 184 148 A 20 ALA H A 19 LYS HBx 1.0 . 4.90 185 148 A 19 LYS HBy A 20 ALA H 1.0 . 4.90 186 149 A 17 VAL HB A 20 ALA H 1.0 . 5.50 187 150 A 20 ALA H A 23 ASN HB3 1.0 . 6.20 188 151 A 20 ALA H A 23 ASN HB2 1.0 . 6.08 189 152 A 17 VAL HA A 20 ALA H 1.0 . 4.90 190 153 A 20 ALA H A 22 GLY HAx 1.0 . 6.37 191 153 A 20 ALA H A 22 GLY HAy 1.0 . 6.37 192 154 A 19 LYS HA A 20 ALA H 1.0 . 5.12 193 155 A 20 ALA H A 20 ALA HA 1.0 . 4.11 194 156 A 16 TRP HA A 20 ALA H 1.0 . 5.54 195 157 A 20 ALA H A 23 ASN HA 1.0 . 5.08 196 158 A 19 LYS H A 20 ALA H 1.0 . 4.98 197 159 A 17 VAL H A 20 ALA H 1.0 . 6.35 198 160 A 21 LEU H A 21 LEU HDx% 1.0 . 5.32 199 160 A 21 LEU H A 21 LEU HDy% 1.0 . 5.32 200 161 A 21 LEU H A 17 VAL HGy% 1.0 . 5.03 201 161 A 21 LEU H A 17 VAL HGx% 1.0 . 5.03 202 162 A 21 LEU H A 20 ALA HB% 1.0 . 4.82 203 163 A 21 LEU H A 21 LEU HBx 1.0 . 4.42 204 163 A 21 LEU HBy A 21 LEU H 1.0 . 4.42 205 164 A 17 VAL HB A 21 LEU H 1.0 . 4.90 206 165 A 21 LEU H A 23 ASN HB3 1.0 . 5.34 207 165 A 21 LEU H A 23 ASN HB2 1.0 . 5.34 208 166 A 17 VAL HA A 21 LEU H 1.0 . 5.45 209 167 A 21 LEU H A 22 GLY HAx 1.0 . 5.79 210 167 A 21 LEU H A 22 GLY HAy 1.0 . 5.79 211 168 A 21 LEU H A 20 ALA HA 1.0 . 5.33 212 169 A 21 LEU H A 21 LEU HA 1.0 . 4.34 213 170 A 21 LEU H A 19 LYS H 1.0 . 6.44 214 171 A 21 LEU H A 20 ALA H 1.0 . 5.11 215 172 A 21 LEU H A 22 GLY H 1.0 . 5.24 216 173 A 22 GLY H A 21 LEU HDx% 1.0 . 4.03 217 173 A 21 LEU HDy% A 22 GLY H 1.0 . 4.03 218 174 A 22 GLY H A 21 LEU HG 1.0 . 5.46 219 175 A 22 GLY H A 21 LEU HBx 1.0 . 5.21 220 175 A 21 LEU HBy A 22 GLY H 1.0 . 5.21 221 176 A 22 GLY H A 23 ASN HB3 1.0 . 6.39 222 177 A 22 GLY H A 26 ASP HB3 1.0 . 6.39 223 178 A 23 ASN HB2 A 22 GLY H 1.0 . 6.12 224 179 A 22 GLY H A 22 GLY HAx 1.0 . 4.19 225 179 A 22 GLY HAy A 22 GLY H 1.0 . 4.19 226 180 A 19 LYS HA A 22 GLY H 1.0 . 4.82 227 181 A 21 LEU HA A 22 GLY H 1.0 . 4.85 228 182 A 23 ASN HA A 22 GLY H 1.0 . 5.94 229 183 A 23 ASN H A 23 ASN HB3 1.0 . 4.18 230 184 A 23 ASN HB2 A 23 ASN H 1.0 . 4.02 231 185 A 23 ASN H A 26 ASP HB2 1.0 . 5.71 232 186 A 23 ASN H A 22 GLY HAx 1.0 . 4.78 233 186 A 22 GLY HAy A 23 ASN H 1.0 . 4.78 234 187 A 20 ALA HA A 23 ASN H 1.0 . 4.58 235 188 A 23 ASN HA A 23 ASN H 1.0 . 4.02 236 189 A 22 GLY H A 23 ASN H 1.0 . 4.93 237 190 A 23 ASN HD21 A 23 ASN HD22 1.0 . 2.82 238 191 A 24 LEU H A 24 LEU HG 1.0 . 4.37 239 192 A 24 LEU H A 24 LEU HBx 1.0 . 4.63 240 192 A 24 LEU H A 24 LEU HBy 1.0 . 4.63 241 193 A 24 LEU H A 23 ASN HB3 1.0 . 4.66 242 194 A 23 ASN HB2 A 24 LEU H 1.0 . 4.56 243 195 A 26 ASP HB2 A 24 LEU H 1.0 . 6.09 244 196 A 24 LEU H A 24 LEU HA 1.0 . 3.98 245 197 A 23 ASN HA A 24 LEU H 1.0 . 4.86 246 198 A 23 ASN H A 24 LEU H 1.0 . 4.93 247 199 A 24 LEU HG A 25 SER H 1.0 . 5.03 248 200 A 25 SER H A 24 LEU HBx 1.0 . 5.16 249 200 A 24 LEU HBy A 25 SER H 1.0 . 5.16 250 201 A 25 SER H A 23 ASN HB3 1.0 . 6.50 251 202 A 23 ASN HB2 A 25 SER H 1.0 . 5.36 252 203 A 26 ASP HB2 A 25 SER H 1.0 . 6.33 253 204 A 25 SER H A 22 GLY HAx 1.0 . 5.73 254 204 A 22 GLY HAy A 25 SER H 1.0 . 5.73 255 205 A 25 SER H A 25 SER HBx 1.0 . 4.84 256 205 A 25 SER H A 25 SER HBy 1.0 . 4.84 257 206 A 25 SER H A 25 SER HA 1.0 . 4.23 258 207 A 25 SER H A 26 ASP HA 1.0 . 5.40 259 208 A 26 ASP H A 27 VAL HGy% 1.0 . 3.85 260 208 A 26 ASP H A 27 VAL HGx% 1.0 . 3.85 261 209 A 26 ASP H A 27 VAL HB 1.0 . 5.44 262 210 A 26 ASP HB3 A 26 ASP H 1.0 . 4.46 263 211 A 26 ASP HB2 A 26 ASP H 1.0 . 4.33 264 212 A 26 ASP H A 22 GLY HAx 1.0 . 5.96 265 212 A 22 GLY HAy A 26 ASP H 1.0 . 5.96 266 213 A 26 ASP H A 25 SER HBx 1.0 . 5.48 267 213 A 25 SER HBy A 26 ASP H 1.0 . 5.48 268 214 A 25 SER HA A 26 ASP H 1.0 . 5.37 269 215 A 26 ASP HA A 26 ASP H 1.0 . 3.97 270 216 A 26 ASP H A 27 VAL H 1.0 . 4.93 271 217 A 25 SER H A 26 ASP H 1.0 . 4.93 272 218 A 27 VAL HGx% A 27 VAL H 1.0 . 4.67 273 219 A 27 VAL H A 27 VAL HGy% 1.0 . 3.85 274 220 A 27 VAL H A 30 ALA HB% 1.0 . 6.33 275 221 A 27 VAL HB A 27 VAL H 1.0 . 4.10 276 222 A 26 ASP HB3 A 27 VAL H 1.0 . 4.76 277 223 A 26 ASP HB2 A 27 VAL H 1.0 . 4.80 278 224 A 27 VAL H A 27 VAL HA 1.0 . 4.15 279 225 A 26 ASP HA A 27 VAL H 1.0 . 4.64 280 226 A 27 VAL HGx% A 28 ASN H 1.0 . 5.16 281 227 A 28 ASN H A 27 VAL HGy% 1.0 . 5.25 282 228 A 27 VAL HB A 28 ASN H 1.0 . 4.42 283 229 A 28 ASN H A 28 ASN HB3 1.0 . 4.32 284 230 A 28 ASN H A 28 ASN HB2 1.0 . 4.10 285 231 A 27 VAL HA A 28 ASN H 1.0 . 5.04 286 232 A 25 SER HA A 28 ASN H 1.0 . 5.71 287 233 A 28 ASN H A 28 ASN HA 1.0 . 4.20 288 234 A 27 VAL H A 28 ASN H 1.0 . 4.47 289 235 A 27 VAL HB A 28 ASN HD22 1.0 . 6.50 290 236 A 28 ASN HD21 A 28 ASN HB3 1.0 . 5.13 291 237 A 28 ASN HD21 A 28 ASN HB2 1.0 . 4.76 292 238 A 24 LEU HA A 28 ASN HD21 1.0 . 6.29 293 239 A 28 ASN HA A 28 ASN HD21 1.0 . 5.89 294 240 A 28 ASN H A 28 ASN HD21 1.0 . 6.42 295 241 A 27 VAL HB A 28 ASN HD21 1.0 . 6.00 296 242 A 28 ASN HD22 A 28 ASN HB3 1.0 . 5.95 297 243 A 28 ASN HD22 A 28 ASN HB2 1.0 . 5.03 298 244 A 24 LEU HA A 28 ASN HD22 1.0 . 6.49 299 245 A 25 SER HA A 28 ASN HD21 1.0 . 5.50 300 246 A 28 ASN HA A 28 ASN HD22 1.0 . 6.50 301 247 A 28 ASN HD22 A 28 ASN HD21 1.0 . 2.58 302 248 A 30 ALA HB% A 29 GLN H 1.0 . 6.46 303 249 A 29 GLN H A 29 GLN HB3 1.0 . 4.03 304 250 A 29 GLN H A 29 GLN HB2 1.0 . 4.69 305 251 A 29 GLN H A 28 ASN HB3 1.0 . 5.00 306 252 A 29 GLN H A 28 ASN HB2 1.0 . 4.95 307 253 A 29 GLN H A 29 GLN HA 1.0 . 4.23 308 254 A 28 ASN HA A 29 GLN H 1.0 . 5.20 309 255 A 26 ASP HA A 29 GLN H 1.0 . 4.98 310 256 A 29 GLN HE21 A 33 ILE HG2% 1.0 . 6.50 311 257 A 30 ALA HB% A 29 GLN HE21 1.0 . 6.50 312 258 A 29 GLN HE21 A 33 ILE HB 1.0 . 6.50 313 259 A 29 GLN HE21 A 29 GLN HB2 1.0 . 6.50 314 259 A 29 GLN HE21 A 29 GLN HB3 1.0 . 6.50 315 260 A 29 GLN HE21 A 29 GLN HB2 1.0 . 5.24 316 261 A 27 VAL HA A 29 GLN HE21 1.0 . 6.50 317 262 A 29 GLN HE21 A 30 ALA HA 1.0 . 6.50 318 263 A 29 GLN HA A 29 GLN HE21 1.0 . 4.08 319 264 A 26 ASP HA A 29 GLN HE21 1.0 . 6.50 320 265 A 33 ILE HG2% A 29 GLN HE22 1.0 . 6.50 321 266 A 30 ALA HB% A 29 GLN HE22 1.0 . 6.50 322 267 A 33 ILE HB A 29 GLN HE22 1.0 . 6.50 323 268 A 29 GLN HE22 A 29 GLN HB2 1.0 . 6.50 324 268 A 29 GLN HB3 A 29 GLN HE22 1.0 . 6.50 325 269 A 29 GLN HE22 A 29 GLN HB2 1.0 . 5.66 326 270 A 30 ALA HA A 29 GLN HE22 1.0 . 6.50 327 271 A 29 GLN HA A 29 GLN HE22 1.0 . 4.96 328 272 A 26 ASP HA A 29 GLN HE22 1.0 . 6.50 329 273 A 29 GLN HE21 A 29 GLN HE22 1.0 . 2.76 330 274 A 30 ALA HB% A 30 ALA H 1.0 . 4.45 331 275 A 30 ALA H A 29 GLN HB2 1.0 . 5.43 332 276 A 30 ALA H A 28 ASN HB2 1.0 . 6.50 333 277 A 26 ASP HB3 A 30 ALA H 1.0 . 5.97 334 278 A 27 VAL HA A 30 ALA H 1.0 . 4.94 335 279 A 30 ALA HA A 30 ALA H 1.0 . 4.06 336 280 A 30 ALA H A 31 SER HA 1.0 . 5.69 337 281 A 28 ASN HA A 30 ALA H 1.0 . 6.13 338 282 A 26 ASP HA A 30 ALA H 1.0 . 5.19 339 283 A 30 ALA H A 33 ILE H 1.0 . 6.40 340 284 A 29 GLN H A 30 ALA H 1.0 . 4.67 341 285 A 27 VAL HGx% A 31 SER H 1.0 . 6.37 342 286 A 30 ALA HB% A 31 SER H 1.0 . 4.97 343 287 A 31 SER H A 32 ARG HB3 1.0 . 5.50 344 288 A 29 GLN HB3 A 31 SER H 1.0 . 5.62 345 289 A 31 SER H A 32 ARG HDx 1.0 . 5.12 346 289 A 31 SER H A 32 ARG HDy 1.0 . 5.12 347 290 A 27 VAL HA A 31 SER H 1.0 . 6.00 348 291 A 31 SER HA A 31 SER H 1.0 . 4.08 349 292 A 28 ASN HA A 31 SER H 1.0 . 5.09 350 293 A 33 ILE H A 31 SER H 1.0 . 6.12 351 294 A 30 ALA H A 31 SER H 1.0 . 4.99 352 295 A 33 ILE HG2% A 32 ARG H 1.0 . 5.75 353 296 A 32 ARG H A 32 ARG HB3 1.0 . 4.02 354 297 A 32 ARG H A 32 ARG HB2 1.0 . 4.35 355 298 A 29 GLN HB3 A 32 ARG H 1.0 . 6.07 356 299 A 32 ARG H A 32 ARG HDx 1.0 . 3.45 357 299 A 32 ARG HDy A 32 ARG H 1.0 . 3.45 358 300 A 32 ARG H A 33 ILE HA 1.0 . 6.03 359 301 A 32 ARG H A 32 ARG HA 1.0 . 4.09 360 302 A 31 SER HA A 32 ARG H 1.0 . 4.95 361 303 A 28 ASN HA A 32 ARG H 1.0 . 5.83 362 304 A 31 SER H A 32 ARG H 1.0 . 5.13 363 305 A 33 ILE HG2% A 33 ILE H 1.0 . 4.56 364 306 A 33 ILE HB A 33 ILE H 1.0 . 3.91 365 307 A 33 ILE H A 32 ARG HDx 1.0 . 4.13 366 307 A 33 ILE H A 32 ARG HDy 1.0 . 4.13 367 308 A 33 ILE H A 33 ILE HA 1.0 . 4.32 368 309 A 33 ILE H A 32 ARG HA 1.0 . 4.55 369 310 A 33 ILE H A 34 ASN HA 1.0 . 6.38 370 311 A 33 ILE H A 32 ARG H 1.0 . 5.11 371 312 A 33 ILE HG2% A 34 ASN H 1.0 . 5.00 372 313 A 30 ALA HB% A 34 ASN H 1.0 . 6.37 373 314 A 34 ASN H A 34 ASN HB3 1.0 . 4.37 374 315 A 34 ASN H A 34 ASN HB2 1.0 . 4.09 375 316 A 34 ASN H A 32 ARG HDx 1.0 . 4.62 376 316 A 32 ARG HDy A 34 ASN H 1.0 . 4.62 377 317 A 33 ILE HA A 34 ASN H 1.0 . 4.94 378 318 A 32 ARG HA A 34 ASN H 1.0 . 4.80 379 319 A 31 SER HA A 34 ASN H 1.0 . 4.96 380 320 A 34 ASN HA A 34 ASN H 1.0 . 4.13 381 321 A 33 ILE H A 34 ASN H 1.0 . 5.03 382 322 A 31 SER H A 34 ASN H 1.0 . 6.08 383 323 A 33 ILE HG2% A 34 ASN HD21 1.0 . 6.50 384 324 A 30 ALA HB% A 34 ASN HD21 1.0 . 5.03 385 325 A 33 ILE HB A 34 ASN HD21 1.0 . 6.00 386 326 A 34 ASN HB3 A 34 ASN HD21 1.0 . 4.71 387 327 A 34 ASN HB2 A 34 ASN HD21 1.0 . 4.34 388 328 A 34 ASN HD21 A 32 ARG HDx 1.0 . 6.50 389 328 A 32 ARG HDy A 34 ASN HD21 1.0 . 6.50 390 329 A 33 ILE HA A 34 ASN HD21 1.0 . 6.50 391 330 A 32 ARG HA A 34 ASN HD21 1.0 . 6.10 392 331 A 31 SER HA A 34 ASN HD21 1.0 . 5.96 393 332 A 34 ASN HA A 34 ASN HD21 1.0 . 5.79 394 333 A 33 ILE HG2% A 34 ASN HD22 1.0 . 6.50 395 334 A 30 ALA HB% A 34 ASN HD22 1.0 . 4.89 396 335 A 33 ILE HB A 34 ASN HD22 1.0 . 6.00 397 336 A 34 ASN HB3 A 34 ASN HD22 1.0 . 5.17 398 337 A 34 ASN HB2 A 34 ASN HD22 1.0 . 4.70 399 338 A 32 ARG HA A 34 ASN HD22 1.0 . 6.47 400 339 A 31 SER HA A 34 ASN HD22 1.0 . 6.47 401 340 A 34 ASN HA A 34 ASN HD22 1.0 . 6.12 402 341 A 34 ASN HD21 A 34 ASN HD22 1.0 . 2.59 403 342 A 34 ASN HD22 A 35 ARG H 1.0 . 6.00 404 343 A 35 ARG H A 36 LYS HBx 1.0 . 5.50 405 343 A 35 ARG H A 36 LYS HBy 1.0 . 5.50 406 344 A 35 ARG H A 35 ARG HBx 1.0 . 4.15 407 344 A 35 ARG H A 35 ARG HBy 1.0 . 4.15 408 345 A 34 ASN HB3 A 35 ARG H 1.0 . 4.94 409 346 A 34 ASN HB2 A 35 ARG H 1.0 . 4.62 410 347 A 35 ARG H A 32 ARG HDx 1.0 . 6.32 411 347 A 32 ARG HDy A 35 ARG H 1.0 . 6.32 412 348 A 35 ARG H A 35 ARG HA 1.0 . 3.92 413 349 A 34 ASN HA A 35 ARG H 1.0 . 4.72 414 350 A 34 ASN H A 35 ARG H 1.0 . 5.01 415 351 A 36 LYS H A 36 LYS HA 1.0 . 3.57 416 352 A 34 ASN HA A 36 LYS H 1.0 . 5.43 417 353 A 35 ARG H A 36 LYS H 1.0 . 4.31 418 354 A 36 LYS H A 37 LYS H 1.0 . 4.43 419 355 A 33 ILE HG2% A 37 LYS H 1.0 . 6.13 420 356 A 37 LYS H A 37 LYS HB2 1.0 . 4.84 421 356 A 37 LYS H A 37 LYS HB3 1.0 . 4.84 422 357 A 33 ILE HA A 37 LYS H 1.0 . 5.49 423 358 A 37 LYS H A 37 LYS HA 1.0 . 3.72 424 359 A 34 ASN HA A 37 LYS H 1.0 . 4.86 425 360 A 35 ARG H A 37 LYS H 1.0 . 4.75 426 361 A 39 HIS H A 39 HIS HB3 1.0 . 4.28 427 362 A 39 HIS H A 39 HIS HB2 1.0 . 4.53 428 363 A 39 HIS H A 39 HIS HA 1.0 . 3.58 429 364 A 39 HIS H A 39 HIS HD2 1.0 . 5.02 430 365 A 36 LYS H A 39 HIS H 1.0 . 6.00 431 366 A 2 THR H A 3 TRP HD1 1.0 . 4.47 432 367 A 7 GLY H A 9 GLY H 1.0 . 4.13 433 368 A 10 ILE H A 14 ALA HB% 1.0 . 3.86 434 369 A 24 LEU H A 27 VAL HGy% 1.0 . 3.93 435 369 A 24 LEU H A 27 VAL HGx% 1.0 . 3.93 436 370 A 28 ASN H A 27 VAL HGy% 1.0 . 4.18 437 370 A 27 VAL HGx% A 28 ASN H 1.0 . 4.18 438 371 A 24 LEU H A 24 LEU HDx% 1.0 . 3.41 439 371 A 24 LEU H A 24 LEU HDy% 1.0 . 3.41 440 372 A 25 SER H A 27 VAL HGy% 1.0 . 4.19 441 372 A 25 SER H A 27 VAL HGx% 1.0 . 4.19 442 373 A 25 SER H A 27 VAL HB 1.0 . 5.27 443 374 A 24 LEU HA A 27 VAL H 1.0 . 4.10 444 375 A 26 ASP H A 28 ASN H 1.0 . 4.65 445 376 A 28 ASN HD21 A 24 LEU HDx% 1.0 . 6.50 446 376 A 28 ASN HD21 A 24 LEU HDy% 1.0 . 6.50 447 377 A 28 ASN HD22 A 24 LEU HDx% 1.0 . 6.50 448 377 A 28 ASN HD22 A 24 LEU HDy% 1.0 . 6.50 449 378 A 29 GLN HE21 A 33 ILE HG1x 1.0 . 4.63 450 378 A 29 GLN HE21 A 33 ILE HG1y 1.0 . 4.63 451 379 A 29 GLN HE22 A 33 ILE HG1x 1.0 . 4.90 452 379 A 29 GLN HE22 A 33 ILE HG1y 1.0 . 4.90 453 380 A 31 SER H A 31 SER HBx 1.0 . 2.99 454 380 A 31 SER H A 31 SER HBy 1.0 . 2.99 455 381 A 32 ARG H A 33 ILE HG1x 1.0 . 5.50 456 381 A 32 ARG H A 33 ILE HG1y 1.0 . 5.50 457 382 A 33 ILE H A 33 ILE HG1x 1.0 . 3.82 458 382 A 33 ILE H A 33 ILE HG1y 1.0 . 3.82 459 383 A 34 ASN H A 33 ILE HG1x 1.0 . 4.74 460 383 A 34 ASN H A 33 ILE HG1y 1.0 . 4.74 461 384 A 35 ARG H A 36 LYS HDx 1.0 . 3.98 462 384 A 35 ARG H A 36 LYS HDy 1.0 . 3.98 463 385 A 36 LYS H A 36 LYS HDx 1.0 . 3.11 464 385 A 36 LYS H A 36 LYS HDy 1.0 . 3.11 465 386 A 36 LYS H A 36 LYS HBx 1.0 . 2.46 466 386 A 36 LYS HBy A 36 LYS H 1.0 . 2.46 467 387 A 37 LYS H A 37 LYS HG2 1.0 . 3.38 468 387 A 37 LYS H A 37 LYS HG3 1.0 . 3.38 469 388 A 37 LYS H A 37 LYS HD2 1.0 . 2.98 470 388 A 37 LYS H A 37 LYS HD3 1.0 . 2.98 471 389 A 37 LYS H A 37 LYS HE2 1.0 . 4.39 472 389 A 37 LYS H A 37 LYS HE3 1.0 . 4.39 473 390 A 39 HIS H A 36 LYS HGx 1.0 . 4.11 474 390 A 39 HIS H A 36 LYS HGy 1.0 . 4.11 475 391 A 39 HIS H A 36 LYS HBx 1.0 . 3.49 476 391 A 36 LYS HBy A 39 HIS H 1.0 . 3.49 477 392 A 13 VAL H A 15 TYR H 1.0 . 5.76 478 393 A 24 LEU HA A 26 ASP H 1.0 . 5.00 479 394 A 23 ASN HD21 A 25 SER HA 1.0 . 6.00 480 395 A 30 ALA H A 29 GLN HB2 1.0 . 3.52 481 395 A 29 GLN HB3 A 30 ALA H 1.0 . 3.52 482 396 A 33 ILE HB A 34 ASN H 1.0 . 3.64 483 397 A 13 VAL HB A 13 VAL H 1.0 . 2.75 484 398 A 15 TYR HD% A 16 TRP HA 1.0 . 4.61 485 399 A 15 TYR HA A 15 TYR HD% 1.0 . 3.82 486 400 A 6 ILE HD1% A 2 THR HB 1.0 . 5.50 487 401 A 24 LEU HA A 27 VAL HGy% 1.0 . 4.46 488 402 A 24 LEU HA A 27 VAL HGy% 1.0 . 3.87 489 402 A 24 LEU HA A 27 VAL HGx% 1.0 . 3.87 490 403 A 2 THR HA A 2 THR HG1 1.0 . 3.85 491 404 A 14 ALA HB% A 10 ILE HA 1.0 . 4.39 492 405 A 36 LYS HA A 36 LYS HDx 1.0 . 4.90 493 405 A 36 LYS HA A 36 LYS HDy 1.0 . 4.90 494 406 A 36 LYS HA A 36 LYS HGx 1.0 . 3.90 495 406 A 36 LYS HA A 36 LYS HGy 1.0 . 3.90 496 407 A 20 ALA HA A 21 LEU HDx% 1.0 . 4.64 497 407 A 21 LEU HDy% A 20 ALA HA 1.0 . 4.64 498 408 A 33 ILE HG2% A 30 ALA HA 1.0 . 4.48 499 409 A 14 ALA HA A 17 VAL HGy% 1.0 . 4.48 500 409 A 14 ALA HA A 17 VAL HGx% 1.0 . 4.48 501 410 A 14 ALA HA A 13 VAL HGx% 1.0 . 4.87 502 410 A 14 ALA HA A 13 VAL HGy% 1.0 . 4.87 503 411 A 6 ILE HD1% A 6 ILE HA 1.0 . 3.95 504 412 A 6 ILE HA A 6 ILE HG1x 1.0 . 4.08 505 412 A 6 ILE HG1y A 6 ILE HA 1.0 . 4.08 506 413 A 14 ALA HA A 17 VAL HB 1.0 . 4.62 507 414 A 2 THR HA A 5 ASP HBx 1.0 . 4.47 508 414 A 5 ASP HBy A 2 THR HA 1.0 . 4.47 509 415 A 20 ALA HA A 23 ASN HB3 1.0 . 4.59 510 415 A 20 ALA HA A 23 ASN HB2 1.0 . 4.59 511 416 A 20 ALA HA A 23 ASN HB2 1.0 . 6.00 512 417 A 20 ALA HA A 23 ASN HB3 1.0 . 6.00 513 418 A 25 SER HA A 28 ASN HB3 1.0 . 4.45 514 418 A 25 SER HA A 28 ASN HB2 1.0 . 4.45 515 419 A 25 SER HA A 28 ASN HB2 1.0 . 6.00 516 420 A 31 SER HA A 34 ASN HB2 1.0 . 5.50 517 421 A 26 ASP HA A 29 GLN HB2 1.0 . 4.71 518 421 A 26 ASP HA A 29 GLN HB3 1.0 . 4.71 519 422 A 13 VAL HB A 12 ARG HA 1.0 . 5.50 520 423 A 32 ARG HDy A 36 LYS HBx 1.0 . 4.08 521 423 A 32 ARG HDx A 36 LYS HBx 1.0 . 4.08 522 423 A 36 LYS HBy A 32 ARG HDx 1.0 . 4.08 523 423 A 32 ARG HDy A 36 LYS HBy 1.0 . 4.08 524 424 A 37 LYS HB3 A 37 LYS HE2 1.0 . 4.38 525 424 A 37 LYS HB2 A 37 LYS HE2 1.0 . 4.38 526 424 A 37 LYS HE3 A 37 LYS HB2 1.0 . 4.38 527 424 A 37 LYS HB3 A 37 LYS HE3 1.0 . 4.38 528 425 A 30 ALA HB% A 27 VAL HA 1.0 . 3.73 529 426 A 17 VAL HA A 20 ALA HB% 1.0 . 3.85 530 427 A 25 SER HA A 24 LEU HBx 1.0 . 4.41 531 427 A 24 LEU HBy A 25 SER HA 1.0 . 4.41 532 428 A 35 ARG HA A 36 LYS HDx 1.0 . 4.29 533 428 A 35 ARG HA A 36 LYS HDy 1.0 . 4.29 534 429 A 20 ALA HB% A 21 LEU HA 1.0 . 4.47 535 430 A 21 LEU HA A 21 LEU HDx% 1.0 . 3.52 536 430 A 21 LEU HDy% A 21 LEU HA 1.0 . 3.52 537 431 A 24 LEU HA A 24 LEU HDx% 1.0 . 3.83 538 431 A 24 LEU HA A 24 LEU HDy% 1.0 . 3.83 539 432 A 13 VAL HA A 13 VAL HGx% 1.0 . 3.62 540 432 A 13 VAL HA A 13 VAL HGy% 1.0 . 3.62 541 433 A 27 VAL HGx% A 27 VAL HA 1.0 . 3.71 542 434 A 27 VAL HA A 27 VAL HGy% 1.0 . 3.71 543 435 A 24 LEU HA A 27 VAL HGx% 1.0 . 4.46 544 436 A 33 ILE HG2% A 33 ILE HA 1.0 . 4.23 545 437 A 32 ARG HDx A 32 ARG HGx 1.0 . 3.67 546 437 A 32 ARG HDy A 32 ARG HGx 1.0 . 3.67 547 437 A 32 ARG HGy A 32 ARG HDx 1.0 . 3.67 548 437 A 32 ARG HDy A 32 ARG HGy 1.0 . 3.67 549 438 A 32 ARG HB2 A 32 ARG HGx 1.0 . 3.50 550 438 A 32 ARG HB3 A 32 ARG HGx 1.0 . 3.50 551 438 A 32 ARG HGy A 32 ARG HB3 1.0 . 3.50 552 438 A 32 ARG HGy A 32 ARG HB2 1.0 . 3.50 553 439 A 34 ASN HB2 A 36 LYS HBx 1.0 . 6.50 554 439 A 34 ASN HB2 A 36 LYS HBy 1.0 . 6.50 555 440 A 32 ARG HDy A 36 LYS HDx 1.0 . 4.59 556 440 A 32 ARG HDx A 36 LYS HDx 1.0 . 4.59 557 440 A 36 LYS HDy A 32 ARG HDx 1.0 . 4.59 558 440 A 32 ARG HDy A 36 LYS HDy 1.0 . 4.59 559 441 A 35 ARG HBx A 36 LYS HBx 1.0 . 4.19 560 441 A 35 ARG HBy A 36 LYS HBx 1.0 . 4.19 561 441 A 36 LYS HBy A 35 ARG HBx 1.0 . 4.19 562 441 A 36 LYS HBy A 35 ARG HBy 1.0 . 4.19 563 442 A 30 ALA HB% A 33 ILE HB 1.0 . 4.84 564 443 A 37 LYS HB2 A 37 LYS HD2 1.0 . 3.47 565 443 A 37 LYS HB3 A 37 LYS HD2 1.0 . 3.47 566 443 A 37 LYS HD3 A 37 LYS HB2 1.0 . 3.47 567 443 A 37 LYS HB3 A 37 LYS HD3 1.0 . 3.47 568 444 A 36 LYS HBx A 36 LYS HDx 1.0 . 3.13 569 444 A 36 LYS HBy A 36 LYS HDx 1.0 . 3.13 570 444 A 36 LYS HDy A 36 LYS HBx 1.0 . 3.13 571 444 A 36 LYS HBy A 36 LYS HDy 1.0 . 3.13 572 445 A 35 ARG HBx A 36 LYS HDx 1.0 . 4.01 573 445 A 35 ARG HBy A 36 LYS HDx 1.0 . 4.01 574 445 A 36 LYS HDy A 35 ARG HBx 1.0 . 4.01 575 445 A 35 ARG HBy A 36 LYS HDy 1.0 . 4.01 576 446 A 14 ALA HB% A 10 ILE HG1x 1.0 . 6.00 577 446 A 10 ILE HG1y A 14 ALA HB% 1.0 . 6.00 578 447 A 21 LEU HBx A 21 LEU HDx% 1.0 . 3.14 579 447 A 21 LEU HBy A 21 LEU HDx% 1.0 . 3.14 580 447 A 21 LEU HDy% A 21 LEU HBx 1.0 . 3.14 581 447 A 21 LEU HBy A 21 LEU HDy% 1.0 . 3.14 582 448 A 6 ILE HD1% A 6 ILE HB 1.0 . 3.80 583 449 A 33 ILE HG2% A 36 LYS HDx 1.0 . 6.00 584 449 A 33 ILE HG2% A 36 LYS HDy 1.0 . 6.00 585 450 A 29 GLN HA A 32 ARG HDx 1.0 . 4.27 586 450 A 29 GLN HA A 32 ARG HDy 1.0 . 4.27 587 451 A 30 ALA HA A 32 ARG HDx 1.0 . 4.56 588 451 A 30 ALA HA A 32 ARG HDy 1.0 . 4.56 589 452 A 32 ARG HA A 32 ARG HDx 1.0 . 4.94 590 452 A 32 ARG HDy A 32 ARG HA 1.0 . 4.94 591 453 A 16 TRP HA A 17 VAL H 1.0 . 3.75 592 454 A 29 GLN HB3 A 30 ALA H 1.0 . 2.86 593 455 A 4 ASP HA A 5 ASP H 1.0 . 4.01 594 456 A 24 LEU HA A 25 SER H 1.0 . 3.67 595 457 A 34 ASN H A 34 ASN HD22 1.0 . 4.97 596 458 A 34 ASN H A 34 ASN HD21 1.0 . 4.51 597 459 A 28 ASN H A 28 ASN HD22 1.0 . 5.38 598 460 A 17 VAL HB A 17 VAL HA 1.0 . 3.73 599 461 A 32 ARG HA A 32 ARG HB2 1.0 . 3.11 600 462 A 12 ARG HA A 12 ARG HBx 1.0 . 4.21 601 462 A 12 ARG HBy A 12 ARG HA 1.0 . 4.21 602 463 A 29 GLN HA A 29 GLN HB2 1.0 . 3.83 603 464 A 29 GLN HA A 29 GLN HB3 1.0 . 3.17 604 465 A 35 ARG HA A 35 ARG HBx 1.0 . 3.71 605 465 A 35 ARG HBy A 35 ARG HA 1.0 . 3.71 606 466 A 15 TYR HA A 15 TYR HBx 1.0 . 4.33 607 466 A 15 TYR HBy A 15 TYR HA 1.0 . 4.33 608 467 A 25 SER HA A 28 ASN HB3 1.0 . 4.00 609 468 A 25 SER HA A 25 SER HBx 1.0 . 3.87 610 468 A 25 SER HBy A 25 SER HA 1.0 . 3.87 611 469 A 31 SER HA A 31 SER HBx 1.0 . 3.87 612 469 A 31 SER HA A 31 SER HBy 1.0 . 3.87 613 470 A 2 THR HA A 2 THR HB 1.0 . 2.62 614 471 A 21 LEU HA A 21 LEU HBx 1.0 . 3.90 615 471 A 21 LEU HBy A 21 LEU HA 1.0 . 3.90 616 472 A 19 LYS HA A 19 LYS HBx 1.0 . 4.74 617 472 A 19 LYS HBy A 19 LYS HA 1.0 . 4.74 618 473 A 6 ILE HA A 6 ILE HB 1.0 . 2.96 619 474 A 26 ASP HB2 A 26 ASP HA 1.0 . 2.68 620 475 A 26 ASP HB3 A 26 ASP HA 1.0 . 2.90 621 476 A 34 ASN HA A 34 ASN HB2 1.0 . 3.33 622 477 A 34 ASN HA A 34 ASN HB3 1.0 . 3.27 623 478 A 39 HIS HB2 A 39 HIS HA 1.0 . 3.17 624 479 A 39 HIS HB3 A 39 HIS HA 1.0 . 3.21 625 480 A 5 ASP HA A 5 ASP HBx 1.0 . 4.12 626 480 A 5 ASP HBy A 5 ASP HA 1.0 . 4.12 627 481 A 36 LYS HA A 36 LYS HBx 1.0 . 3.90 628 481 A 36 LYS HBy A 36 LYS HA 1.0 . 3.90 629 482 A 36 LYS HA A 35 ARG HBx 1.0 . 4.58 630 482 A 35 ARG HBy A 36 LYS HA 1.0 . 4.58 631 483 A 33 ILE HB A 33 ILE HA 1.0 . 3.64 632 484 A 33 ILE HB A 30 ALA HA 1.0 . 2.86 633 485 A 28 ASN HA A 28 ASN HB2 1.0 . 3.55 634 486 A 28 ASN HA A 28 ASN HB3 1.0 . 3.30 635 487 A 13 VAL HB A 13 VAL HA 1.0 . 3.58 636 488 A 3 TRP HA A 3 TRP HBx 1.0 . 3.90 637 488 A 3 TRP HBy A 3 TRP HA 1.0 . 3.90 638 489 A 4 ASP HB2 A 4 ASP HA 1.0 . 3.27 639 490 A 4 ASP HB3 A 4 ASP HA 1.0 . 3.17 640 491 A 37 LYS HA A 37 LYS HB2 1.0 . 4.64 641 491 A 37 LYS HB3 A 37 LYS HA 1.0 . 4.64 642 492 A 32 ARG HA A 32 ARG HB3 1.0 . 2.86 643 493 A 8 GLN HB3 A 8 GLN HA 1.0 . 3.21 644 494 A 8 GLN HA A 8 GLN HB2 1.0 . 3.21 645 495 A 27 VAL HB A 27 VAL HA 1.0 . 3.58 646 496 A 24 LEU HA A 27 VAL HB 1.0 . 3.17 647 497 A 16 TRP HB3 A 16 TRP HA 1.0 . 3.58 648 498 A 16 TRP HB2 A 16 TRP HA 1.0 . 3.55 649 499 A 23 ASN HA A 23 ASN HB2 1.0 . 3.61 650 500 A 23 ASN HA A 23 ASN HB3 1.0 . 3.24 651 501 A 24 LEU HA A 24 LEU HBx 1.0 . 3.90 652 501 A 24 LEU HBy A 24 LEU HA 1.0 . 3.90 653 502 A 10 ILE HB A 10 ILE HA 1.0 . 3.30 654 503 A 29 GLN HB3 A 29 GLN HB2 1.0 . 3.79 655 504 A 37 LYS HA A 37 LYS HG2 1.0 . 5.08 656 504 A 37 LYS HA A 37 LYS HG3 1.0 . 5.08 657 505 A 21 LEU HA A 21 LEU HG 1.0 . 3.52 658 506 A 26 ASP HB3 A 26 ASP HB2 1.0 . 3.86 659 507 A 34 ASN HB3 A 34 ASN HB2 1.0 . 2.93 660 508 A 39 HIS HB3 A 39 HIS HB2 1.0 . 2.40 661 509 A 36 LYS HBx A 36 LYS HGx 1.0 . 7.26 662 509 A 36 LYS HBy A 36 LYS HGx 1.0 . 7.26 663 509 A 36 LYS HGy A 36 LYS HBx 1.0 . 7.26 664 509 A 36 LYS HBy A 36 LYS HGy 1.0 . 7.26 665 510 A 33 ILE HB A 32 ARG HDx 1.0 . 4.68 666 510 A 33 ILE HB A 32 ARG HDy 1.0 . 4.68 667 511 A 28 ASN HB2 A 28 ASN HB3 1.0 . 2.62 668 512 A 4 ASP HB3 A 4 ASP HB2 1.0 . 2.52 669 513 A 37 LYS HD3 A 37 LYS HG2 1.0 . 7.27 670 513 A 37 LYS HD2 A 37 LYS HG2 1.0 . 7.27 671 513 A 37 LYS HG3 A 37 LYS HD2 1.0 . 7.27 672 513 A 37 LYS HG3 A 37 LYS HD3 1.0 . 7.27 673 514 A 37 LYS HA A 37 LYS HD2 1.0 . 4.62 674 514 A 37 LYS HA A 37 LYS HD3 1.0 . 4.62 675 515 A 32 ARG HDy A 32 ARG HB3 1.0 . 4.68 676 515 A 32 ARG HB3 A 32 ARG HDx 1.0 . 4.68 677 516 A 8 GLN HG2 A 8 GLN HB2 1.0 . 3.98 678 517 A 8 GLN HB3 A 8 GLN HG2 1.0 . 3.98 679 518 A 8 GLN HG2 A 8 GLN HA 1.0 . 4.79 680 519 A 8 GLN HB2 A 8 GLN HG3 1.0 . 3.92 681 520 A 8 GLN HB3 A 8 GLN HG3 1.0 . 3.92 682 521 A 8 GLN HA A 8 GLN HG3 1.0 . 4.63 683 522 A 16 TRP HB3 A 16 TRP HB2 1.0 . 3.48 684 523 A 21 LEU HG A 21 LEU HBx 1.0 . 4.49 685 523 A 21 LEU HBy A 21 LEU HG 1.0 . 4.49 686 524 A 2 THR HB A 2 THR HG1 1.0 . 3.55 687 525 A 15 TYR HD% A 15 TYR HBx 1.0 . 7.76 688 525 A 15 TYR HBy A 15 TYR HD% 1.0 . 7.76 689 526 A 15 TYR HD% A 15 TYR HE% 1.0 . 7.06 690 527 A 15 TYR HE% A 15 TYR HBx 1.0 . 8.51 691 527 A 15 TYR HBy A 15 TYR HE% 1.0 . 8.51 692 528 A 23 ASN HB2 A 23 ASN HB3 1.0 . 2.62 693 529 A 24 LEU HG A 24 LEU HA 1.0 . 3.52 694 530 A 24 LEU HG A 24 LEU HBx 1.0 . 4.49 695 530 A 24 LEU HG A 24 LEU HBy 1.0 . 4.49 696 531 A 10 ILE HB A 10 ILE HG1x 1.0 . 4.55 697 531 A 10 ILE HG1y A 10 ILE HB 1.0 . 4.55 698 532 A 10 ILE HA A 10 ILE HG1x 1.0 . 5.88 699 532 A 10 ILE HG1y A 10 ILE HA 1.0 . 5.88 700 533 A 36 LYS HDx A 36 LYS HEx 1.0 . 5.75 701 533 A 36 LYS HDy A 36 LYS HEx 1.0 . 5.75 702 533 A 36 LYS HEy A 36 LYS HDx 1.0 . 5.75 703 533 A 36 LYS HDy A 36 LYS HEy 1.0 . 5.75 704 534 A 36 LYS HA A 36 LYS HEx 1.0 . 6.23 705 534 A 36 LYS HA A 36 LYS HEy 1.0 . 6.23 706 535 A 36 LYS HDy A 36 LYS HGx 1.0 . 5.75 707 535 A 36 LYS HDx A 36 LYS HGx 1.0 . 5.75 708 535 A 36 LYS HGy A 36 LYS HDx 1.0 . 5.75 709 535 A 36 LYS HDy A 36 LYS HGy 1.0 . 5.75 710 536 A 20 ALA HB% A 20 ALA HA 1.0 . 3.70 711 537 A 14 ALA HB% A 14 ALA HA 1.0 . 3.70 712 538 A 20 ALA HB% A 21 LEU HBx 1.0 . 6.69 713 538 A 21 LEU HBy A 20 ALA HB% 1.0 . 6.69 714 539 A 30 ALA HB% A 31 SER HA 1.0 . 5.25 715 540 A 17 VAL HB A 17 VAL HGx% 1.0 . 4.47 716 541 A 17 VAL HA A 17 VAL HGx% 1.0 . 4.57 717 542 A 33 ILE HG2% A 33 ILE HB 1.0 . 4.35 718 543 A 13 VAL HB A 13 VAL HGx% 1.0 . 5.83 719 543 A 13 VAL HB A 13 VAL HGy% 1.0 . 5.83 720 544 A 30 ALA HB% A 30 ALA HA 1.0 . 3.70 721 545 A 27 VAL HB A 27 VAL HGy% 1.0 . 4.69 722 546 A 27 VAL HGx% A 27 VAL HB 1.0 . 4.10 723 547 A 20 ALA HB% A 21 LEU HDx% 1.0 . 8.24 724 547 A 20 ALA HB% A 21 LEU HDy% 1.0 . 8.24 725 548 A 21 LEU HG A 21 LEU HDx% 1.0 . 6.02 726 548 A 21 LEU HDy% A 21 LEU HG 1.0 . 6.02 727 549 A 5 ASP HA A 7 GLY H 1.0 . 5.50 728 550 A 6 ILE HA A 9 GLY H 1.0 . 5.50 729 551 A 6 ILE HA A 10 ILE H 1.0 . 5.50 730 552 A 8 GLN HA A 10 ILE H 1.0 . 5.50 731 553 A 16 TRP H A 14 ALA HA 1.0 . 5.50 732 554 A 14 ALA HA A 18 GLY H 1.0 . 5.50 733 555 A 15 TYR HA A 17 VAL H 1.0 . 5.50 734 556 A 15 TYR HA A 19 LYS H 1.0 . 5.50 735 557 A 21 LEU H A 19 LYS HA 1.0 . 5.50 736 558 A 20 ALA HA A 22 GLY H 1.0 . 5.50 737 559 A 24 LEU HA A 28 ASN H 1.0 . 5.50 738 560 A 25 SER HA A 29 GLN H 1.0 . 5.50 739 561 A 26 ASP HA A 28 ASN H 1.0 . 5.50 740 562 A 31 SER HA A 33 ILE H 1.0 . 5.50 741 563 A 31 SER HA A 35 ARG H 1.0 . 5.50 742 564 A 3 TRP H A 4 ASP H 1.0 . 4.30 743 565 A 5 ASP H A 6 ILE H 1.0 . 4.30 744 566 A 9 GLY H A 10 ILE H 1.0 . 4.30 745 567 A 12 ARG H A 13 VAL H 1.0 . 4.30 746 568 A 16 TRP H A 15 TYR H 1.0 . 4.30 747 569 A 28 ASN H A 29 GLN H 1.0 . 4.30 748 570 A 28 ASN H A 29 GLN H 1.0 . 4.30 749 571 A 37 LYS H A 38 LYS H 1.0 . 4.30 750 572 A 39 HIS H A 38 LYS H 1.0 . 4.30 751 573 A 11 GLY H A 10 ILE HA 1.0 . 4.80 752 574 A 12 ARG HA A 14 ALA H 1.0 . 4.80 753 575 A 14 ALA HA A 15 TYR H 1.0 . 4.80 754 576 A 17 VAL HA A 18 GLY H 1.0 . 4.80 755 577 A 29 GLN HA A 30 ALA H 1.0 . 4.80 756 578 A 30 ALA HA A 31 SER H 1.0 . 4.80 757 579 A 35 ARG HA A 36 LYS H 1.0 . 4.80 758 580 A 36 LYS HA A 37 LYS H 1.0 . 4.80 759 581 A 37 LYS HA A 38 LYS H 1.0 . 4.80 760 582 A 39 HIS H A 38 LYS HA 1.0 . 4.80 761 583 A 3 TRP H A 2 THR HB 1.0 . 5.10 762 584 A 10 ILE HB A 11 GLY H 1.0 . 5.10 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 hbond _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 6 ILE H A 2 THR O 1.0 . 2.0 2 2 A 2 THR O A 6 ILE N 1.0 . 3.0 3 3 A 7 GLY H A 3 TRP O 1.0 . 2.0 4 4 A 3 TRP O A 7 GLY N 1.0 . 3.0 5 5 A 8 GLN H A 4 ASP O 1.0 . 2.0 6 6 A 4 ASP O A 8 GLN N 1.0 . 3.0 7 7 A 17 VAL H A 13 VAL O 1.0 . 2.0 8 8 A 13 VAL O A 17 VAL N 1.0 . 3.0 9 9 A 18 GLY H A 14 ALA O 1.0 . 2.0 10 10 A 14 ALA O A 18 GLY N 1.0 . 3.0 11 11 A 19 LYS H A 15 TYR O 1.0 . 2.0 12 12 A 15 TYR O A 19 LYS N 1.0 . 3.0 13 13 A 20 ALA H A 16 TRP O 1.0 . 2.0 14 14 A 16 TRP O A 20 ALA N 1.0 . 3.0 15 15 A 21 LEU H A 17 VAL O 1.0 . 2.0 16 16 A 17 VAL O A 21 LEU N 1.0 . 3.0 17 17 A 30 ALA H A 26 ASP O 1.0 . 2.0 18 18 A 26 ASP O A 30 ALA N 1.0 . 3.0 19 19 A 31 SER H A 27 VAL O 1.0 . 2.0 20 20 A 27 VAL O A 31 SER N 1.0 . 3.0 21 21 A 32 ARG H A 28 ASN O 1.0 . 2.0 22 22 A 28 ASN O A 32 ARG N 1.0 . 3.0 23 23 A 33 ILE H A 29 GLN O 1.0 . 2.0 24 24 A 29 GLN O A 33 ILE N 1.0 . 3.0 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 hbond _nef_distance_restraint_list.potential_type lower-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 6 ILE H A 2 THR O 1.0 1.8 . 2 2 A 2 THR O A 6 ILE N 1.0 2.7 . 3 3 A 7 GLY H A 3 TRP O 1.0 1.8 . 4 4 A 3 TRP O A 7 GLY N 1.0 2.7 . 5 5 A 8 GLN H A 4 ASP O 1.0 1.8 . 6 6 A 4 ASP O A 8 GLN N 1.0 2.7 . 7 7 A 17 VAL H A 13 VAL O 1.0 1.8 . 8 8 A 13 VAL O A 17 VAL N 1.0 2.7 . 9 9 A 18 GLY H A 14 ALA O 1.0 1.8 . 10 10 A 14 ALA O A 18 GLY N 1.0 2.7 . 11 11 A 19 LYS H A 15 TYR O 1.0 1.8 . 12 12 A 15 TYR O A 19 LYS N 1.0 2.7 . 13 13 A 20 ALA H A 16 TRP O 1.0 1.8 . 14 14 A 16 TRP O A 20 ALA N 1.0 2.7 . 15 15 A 21 LEU H A 17 VAL O 1.0 1.8 . 16 16 A 17 VAL O A 21 LEU N 1.0 2.7 . 17 17 A 30 ALA H A 26 ASP O 1.0 1.8 . 18 18 A 26 ASP O A 30 ALA N 1.0 2.7 . 19 19 A 31 SER H A 27 VAL O 1.0 1.8 . 20 20 A 27 VAL O A 31 SER N 1.0 2.7 . 21 21 A 32 ARG H A 28 ASN O 1.0 1.8 . 22 22 A 28 ASN O A 32 ARG N 1.0 2.7 . 23 23 A 33 ILE H A 29 GLN O 1.0 1.8 . 24 24 A 29 GLN O A 33 ILE N 1.0 2.7 . stop_ save_ save_DYANA/DIANA_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_5 _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 GLY C A 2 THR N A 2 THR CA A 2 THR C 1.0 -90.0 -42.0 PHI 2 2 A 2 THR N A 2 THR CA A 2 THR C A 3 TRP N 1.0 -58.0 -26.0 PSI 3 3 A 2 THR C A 3 TRP N A 3 TRP CA A 3 TRP C 1.0 -105.0 -49.0 PHI 4 4 A 3 TRP N A 3 TRP CA A 3 TRP C A 4 ASP N 1.0 -65.0 3.0 PSI 5 5 A 3 TRP C A 4 ASP N A 4 ASP CA A 4 ASP C 1.0 -93.0 -49.0 PHI 6 6 A 4 ASP N A 4 ASP CA A 4 ASP C A 5 ASP N 1.0 -75.0 5.0 PSI 7 7 A 7 GLY C A 8 GLN N A 8 GLN CA A 8 GLN C 1.0 -121.0 -49.0 PHI 8 8 A 8 GLN N A 8 GLN CA A 8 GLN C A 9 GLY N 1.0 -63.0 29.0 PSI 9 9 A 12 ARG C A 13 VAL N A 13 VAL CA A 13 VAL C 1.0 -81.0 -49.0 PHI 10 10 A 13 VAL N A 13 VAL CA A 13 VAL C A 14 ALA N 1.0 -52.0 -28.0 PSI 11 11 A 13 VAL C A 14 ALA N A 14 ALA CA A 14 ALA C 1.0 -80.0 -48.0 PHI 12 12 A 14 ALA N A 14 ALA CA A 14 ALA C A 15 TYR N 1.0 -65.0 -1.0 PSI 13 13 A 14 ALA C A 15 TYR N A 15 TYR CA A 15 TYR C 1.0 -74.0 -54.0 PHI 14 14 A 15 TYR N A 15 TYR CA A 15 TYR C A 16 TRP N 1.0 -59.0 -23.0 PSI 15 15 A 15 TYR C A 16 TRP N A 16 TRP CA A 16 TRP C 1.0 -75.0 -59.0 PHI 16 16 A 16 TRP N A 16 TRP CA A 16 TRP C A 17 VAL N 1.0 -55.0 -27.0 PSI 17 17 A 16 TRP C A 17 VAL N A 17 VAL CA A 17 VAL C 1.0 -77.0 -53.0 PHI 18 18 A 17 VAL N A 17 VAL CA A 17 VAL C A 18 GLY N 1.0 -51.0 -27.0 PSI 19 19 A 17 VAL C A 18 GLY N A 18 GLY CA A 18 GLY C 1.0 -81.0 -49.0 PHI 20 20 A 18 GLY N A 18 GLY CA A 18 GLY C A 19 LYS N 1.0 -59.0 -15.0 PSI 21 21 A 19 LYS C A 20 ALA N A 20 ALA CA A 20 ALA C 1.0 -99.0 -39.0 PHI 22 22 A 20 ALA N A 20 ALA CA A 20 ALA C A 21 LEU N 1.0 -81.0 15.0 PSI 23 23 A 24 LEU C A 25 SER N A 25 SER CA A 25 SER C 1.0 -115.0 -23.0 PHI 24 24 A 25 SER N A 25 SER CA A 25 SER C A 26 ASP N 1.0 -78.0 10.0 PSI 25 25 A 25 SER C A 26 ASP N A 26 ASP CA A 26 ASP C 1.0 -77.0 -53.0 PHI 26 26 A 26 ASP N A 26 ASP CA A 26 ASP C A 27 VAL N 1.0 -55.0 -23.0 PSI 27 27 A 26 ASP C A 27 VAL N A 27 VAL CA A 27 VAL C 1.0 -82.0 -50.0 PHI 28 28 A 27 VAL N A 27 VAL CA A 27 VAL C A 28 ASN N 1.0 -48.0 -32.0 PSI 29 29 A 27 VAL C A 28 ASN N A 28 ASN CA A 28 ASN C 1.0 -75.0 -51.0 PHI 30 30 A 28 ASN N A 28 ASN CA A 28 ASN C A 29 GLN N 1.0 -43.0 -31.0 PSI 31 31 A 28 ASN C A 29 GLN N A 29 GLN CA A 29 GLN C 1.0 -77.0 -57.0 PHI 32 32 A 29 GLN N A 29 GLN CA A 29 GLN C A 30 ALA N 1.0 -61.0 -17.0 PSI 33 33 A 29 GLN C A 30 ALA N A 30 ALA CA A 30 ALA C 1.0 -74.0 -50.0 PHI 34 34 A 30 ALA N A 30 ALA CA A 30 ALA C A 31 SER N 1.0 -63.0 -11.0 PSI 35 35 A 30 ALA C A 31 SER N A 31 SER CA A 31 SER C 1.0 -90.0 -46.0 PHI 36 36 A 31 SER N A 31 SER CA A 31 SER C A 32 ARG N 1.0 -64.0 0.0 PSI 37 37 A 31 SER C A 32 ARG N A 32 ARG CA A 32 ARG C 1.0 -78.0 -54.0 PHI 38 38 A 32 ARG N A 32 ARG CA A 32 ARG C A 33 ILE N 1.0 -55.0 -27.0 PSI 39 39 A 32 ARG C A 33 ILE N A 33 ILE CA A 33 ILE C 1.0 -75.0 -55.0 PHI 40 40 A 33 ILE N A 33 ILE CA A 33 ILE C A 34 ASN N 1.0 -51.0 -27.0 PSI 41 41 A 33 ILE C A 34 ASN N A 34 ASN CA A 34 ASN C 1.0 -79.0 -47.0 PHI 42 42 A 34 ASN N A 34 ASN CA A 34 ASN C A 35 ARG N 1.0 -49.0 -29.0 PSI 43 43 A 34 ASN C A 35 ARG N A 35 ARG CA A 35 ARG C 1.0 -80.0 -48.0 PHI 44 44 A 35 ARG N A 35 ARG CA A 35 ARG C A 36 LYS N 1.0 -58.0 -14.0 PSI stop_ save_