data_nef_c25818_2n7r 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 25817 PDB 2N7R 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 -7 MET start . . 2 A -6 ALA middle . . 3 A -5 HIS middle . . 4 A -4 HIS middle . . 5 A -3 HIS middle . . 6 A -2 HIS middle . . 7 A -1 HIS middle . . 8 A 0 HIS middle . . 9 A 1 ALA middle . . 10 A 2 SER middle . . 11 A 3 LYS middle . . 12 A 4 GLU middle . . 13 A 5 LEU middle . . 14 A 6 GLU middle . . 15 A 7 LEU middle . . 16 A 8 ILE middle . . 17 A 9 THR middle . . 18 A 10 LEU middle . . 19 A 11 THR middle . . 20 A 12 VAL middle . . 21 A 13 GLY middle . false 22 A 14 PHE middle . . 23 A 15 GLY middle . false 24 A 16 ILE middle . . 25 A 17 LEU middle . . 26 A 18 ILE middle . . 27 A 19 PHE middle . . 28 A 20 SER middle . . 29 A 21 LEU middle . . 30 A 22 ILE middle . . 31 A 23 VAL middle . . 32 A 24 THR middle . . 33 A 25 TYR middle . . 34 A 26 CYS middle . . 35 A 27 ILE middle . . 36 A 28 ASN middle . . 37 A 29 ALA middle . . 38 A 30 LYS middle . . 39 A 31 ALA middle . . 40 A 32 ASP middle . . 41 A 33 VAL middle . . 42 A 34 LEU middle . . 43 A 35 PHE middle . . 44 A 36 ILE middle . . 45 A 37 ALA middle . . 46 A 38 PRO middle . false 47 A 39 ARG middle . . 48 A 40 GLU middle . . 49 A 41 PRO middle . false 50 A 42 GLY middle . false 51 A 43 ALA middle . . 52 A 44 VAL middle . . 53 A 45 SER middle . . 54 A 46 TYR 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 ALA H H 1 8.384 0.020 A 1 ALA C C 13 177.401 0.300 A 1 ALA CA C 13 52.545 0.300 A 1 ALA CB C 13 19.447 0.300 A 1 ALA N N 15 124.807 0.300 A 2 SER H H 1 8.287 0.020 A 2 SER HA H 1 4.322 0.020 A 2 SER HBx H 1 3.994 0.020 A 2 SER HBy H 1 3.994 0.020 A 2 SER C C 13 175.102 0.300 A 2 SER CA C 13 58.862 0.300 A 2 SER CB C 13 63.783 0.300 A 2 SER N N 15 115.072 0.300 A 3 LYS H H 1 8.418 0.020 A 3 LYS HA H 1 4.223 0.020 A 3 LYS HBx H 1 1.801 0.020 A 3 LYS HBy H 1 1.801 0.020 A 3 LYS C C 13 177.259 0.300 A 3 LYS CA C 13 57.484 0.300 A 3 LYS CB C 13 32.230 0.300 A 3 LYS N N 15 122.944 0.300 A 4 GLU H H 1 8.583 0.020 A 4 GLU HA H 1 4.086 0.020 A 4 GLU HBx H 1 1.989 0.020 A 4 GLU HBy H 1 1.989 0.020 A 4 GLU C C 13 177.164 0.300 A 4 GLU CA C 13 58.874 0.300 A 4 GLU CB C 13 29.407 0.300 A 4 GLU N N 15 119.651 0.300 A 5 LEU H H 1 8.069 0.020 A 5 LEU HA H 1 4.169 0.020 A 5 LEU HBx H 1 1.626 0.020 A 5 LEU HBy H 1 1.695 0.020 A 5 LEU HDx% H 1 0.881 0.020 A 5 LEU HDy% H 1 0.881 0.020 A 5 LEU C C 13 178.517 0.300 A 5 LEU CA C 13 56.636 0.300 A 5 LEU CB C 13 41.930 0.300 A 5 LEU N N 15 119.754 0.300 A 6 GLU H H 1 8.367 0.020 A 6 GLU HA H 1 4.088 0.020 A 6 GLU C C 13 177.306 0.300 A 6 GLU CA C 13 59.008 0.300 A 6 GLU N N 15 121.615 0.300 A 7 LEU H H 1 8.215 0.020 A 7 LEU HBx H 1 1.648 0.020 A 7 LEU HBy H 1 1.825 0.020 A 7 LEU HDx% H 1 0.905 0.020 A 7 LEU HDy% H 1 0.905 0.020 A 7 LEU CA C 13 57.826 0.300 A 7 LEU N N 15 119.398 0.300 A 8 ILE H H 1 8.518 0.020 A 8 ILE CA C 13 65.302 0.300 A 8 ILE N N 15 120.843 0.300 A 9 THR H H 1 7.782 0.020 A 9 THR CA C 13 67.586 0.300 A 9 THR N N 15 115.829 0.300 A 10 LEU H H 1 8.086 0.020 A 10 LEU HA H 1 3.954 0.020 A 10 LEU HBx H 1 1.608 0.020 A 10 LEU HBy H 1 1.825 0.020 A 10 LEU C C 13 177.875 0.300 A 10 LEU CA C 13 58.484 0.300 A 10 LEU CB C 13 41.962 0.300 A 10 LEU N N 15 119.886 0.300 A 11 THR H H 1 8.033 0.020 A 11 THR HA H 1 4.220 0.020 A 11 THR HB H 1 3.805 0.020 A 11 THR HG2% H 1 1.161 0.020 A 11 THR CA C 13 67.939 0.300 A 11 THR N N 15 114.351 0.300 A 12 VAL H H 1 8.263 0.020 A 12 VAL HA H 1 3.568 0.020 A 12 VAL C C 13 177.733 0.300 A 12 VAL CA C 13 67.141 0.300 A 12 VAL N N 15 120.398 0.300 A 13 GLY H H 1 8.563 0.020 A 13 GLY HAx H 1 3.575 0.020 A 13 GLY HAy H 1 3.575 0.020 A 13 GLY C C 13 174.414 0.300 A 13 GLY CA C 13 47.836 0.300 A 13 GLY N N 15 106.524 0.300 A 14 PHE H H 1 8.678 0.020 A 14 PHE HA H 1 4.210 0.020 A 14 PHE HBy H 1 3.198 0.020 A 14 PHE HBx H 1 3.113 0.020 A 14 PHE C C 13 177.591 0.300 A 14 PHE CA C 13 61.702 0.300 A 14 PHE CB C 13 38.916 0.300 A 14 PHE N N 15 120.589 0.300 A 15 GLY H H 1 8.582 0.020 A 15 GLY HAx H 1 3.540 0.020 A 15 GLY HAy H 1 3.540 0.020 A 15 GLY C C 13 174.533 0.300 A 15 GLY CA C 13 47.707 0.300 A 15 GLY N N 15 106.691 0.300 A 16 ILE H H 1 8.599 0.020 A 16 ILE HA H 1 3.640 0.020 A 16 ILE HB H 1 2.002 0.020 A 16 ILE HD11 H 1 0.742 0.020 A 16 ILE HD12 H 1 0.742 0.020 A 16 ILE HD13 H 1 0.742 0.020 A 16 ILE HG1x H 1 1.267 0.020 A 16 ILE HG1y H 1 1.267 0.020 A 16 ILE HG21 H 1 0.839 0.020 A 16 ILE HG22 H 1 0.839 0.020 A 16 ILE HG23 H 1 0.839 0.020 A 16 ILE C C 13 178.658 0.300 A 16 ILE CA C 13 65.430 0.300 A 16 ILE CB C 13 37.188 0.300 A 16 ILE N N 15 120.894 0.300 A 17 LEU H H 1 8.206 0.020 A 17 LEU HA H 1 3.960 0.020 A 17 LEU HBx H 1 1.635 0.020 A 17 LEU HBy H 1 1.858 0.020 A 17 LEU HDx% H 1 0.800 0.020 A 17 LEU HDy% H 1 0.800 0.020 A 17 LEU C C 13 178.207 0.300 A 17 LEU CA C 13 58.861 0.300 A 17 LEU CB C 13 41.613 0.300 A 17 LEU N N 15 123.149 0.300 A 18 ILE H H 1 8.455 0.020 A 18 ILE HA H 1 3.562 0.020 A 18 ILE HB H 1 1.830 0.020 A 18 ILE HD11 H 1 0.734 0.020 A 18 ILE HD12 H 1 0.734 0.020 A 18 ILE HD13 H 1 0.734 0.020 A 18 ILE HG1x H 1 0.986 0.020 A 18 ILE HG1y H 1 1.279 0.020 A 18 ILE HG21 H 1 0.787 0.020 A 18 ILE HG22 H 1 0.787 0.020 A 18 ILE HG23 H 1 0.787 0.020 A 18 ILE C C 13 177.738 0.300 A 18 ILE CA C 13 64.569 0.300 A 18 ILE CB C 13 36.512 0.300 A 18 ILE N N 15 117.975 0.300 A 19 PHE H H 1 8.609 0.020 A 19 PHE HA H 1 4.069 0.020 A 19 PHE HBx H 1 3.107 0.020 A 19 PHE HBy H 1 3.107 0.020 A 19 PHE C C 13 177.069 0.300 A 19 PHE CA C 13 61.951 0.300 A 19 PHE CB C 13 39.118 0.300 A 19 PHE N N 15 119.303 0.300 A 20 SER H H 1 8.571 0.020 A 20 SER HA H 1 4.010 0.020 A 20 SER HBx H 1 3.663 0.020 A 20 SER HBy H 1 3.663 0.020 A 20 SER C C 13 176.951 0.300 A 20 SER CA C 13 63.441 0.300 A 20 SER N N 15 114.834 0.300 A 21 LEU H H 1 8.193 0.020 A 21 LEU HA H 1 4.052 0.020 A 21 LEU HBy H 1 1.991 0.020 A 21 LEU HBx H 1 1.883 0.020 A 21 LEU HDx% H 1 0.787 0.020 A 21 LEU HDy% H 1 0.787 0.020 A 21 LEU HG H 1 1.445 0.020 A 21 LEU C C 13 178.041 0.300 A 21 LEU CA C 13 58.331 0.300 A 21 LEU CB C 13 41.771 0.300 A 21 LEU N N 15 124.956 0.300 A 22 ILE H H 1 8.131 0.020 A 22 ILE HA H 1 3.602 0.020 A 22 ILE HB H 1 1.930 0.020 A 22 ILE HD11 H 1 0.585 0.020 A 22 ILE HD12 H 1 0.585 0.020 A 22 ILE HD13 H 1 0.585 0.020 A 22 ILE HG21 H 1 0.740 0.020 A 22 ILE HG22 H 1 0.740 0.020 A 22 ILE HG23 H 1 0.740 0.020 A 22 ILE C C 13 178.539 0.300 A 22 ILE CA C 13 65.963 0.300 A 22 ILE CB C 13 37.864 0.300 A 22 ILE N N 15 119.365 0.300 A 23 VAL H H 1 8.440 0.020 A 23 VAL HA H 1 3.342 0.020 A 23 VAL HB H 1 1.927 0.020 A 23 VAL HGx% H 1 0.593 0.020 A 23 VAL HGy% H 1 0.789 0.020 A 23 VAL C C 13 177.330 0.300 A 23 VAL CA C 13 67.683 0.300 A 23 VAL CB C 13 31.371 0.300 A 23 VAL N N 15 119.397 0.300 A 24 THR H H 1 7.969 0.020 A 24 THR HA H 1 4.172 0.020 A 24 THR HB H 1 3.657 0.020 A 24 THR HG2% H 1 1.097 0.020 A 24 THR C C 13 176.382 0.300 A 24 THR CA C 13 68.010 0.300 A 24 THR N N 15 114.854 0.300 A 25 TYR H H 1 8.364 0.020 A 25 TYR HA H 1 4.010 0.020 A 25 TYR HBy H 1 3.248 0.020 A 25 TYR HBx H 1 3.027 0.020 A 25 TYR C C 13 177.425 0.300 A 25 TYR CA C 13 62.436 0.300 A 25 TYR CB C 13 38.766 0.300 A 25 TYR N N 15 121.421 0.300 A 26 CYS H H 1 8.323 0.020 A 26 CYS HA H 1 3.939 0.020 A 26 CYS HBy H 1 3.087 0.020 A 26 CYS HBx H 1 2.666 0.020 A 26 CYS C C 13 176.335 0.300 A 26 CYS CA C 13 64.243 0.300 A 26 CYS CB C 13 27.470 0.300 A 26 CYS N N 15 116.170 0.300 A 27 ILE H H 1 8.259 0.020 A 27 ILE HA H 1 3.796 0.020 A 27 ILE HB H 1 1.921 0.020 A 27 ILE HD11 H 1 0.763 0.020 A 27 ILE HD12 H 1 0.763 0.020 A 27 ILE HD13 H 1 0.763 0.020 A 27 ILE HG1x H 1 1.148 0.020 A 27 ILE HG1y H 1 1.640 0.020 A 27 ILE HG21 H 1 0.877 0.020 A 27 ILE HG22 H 1 0.877 0.020 A 27 ILE HG23 H 1 0.877 0.020 A 27 ILE C C 13 176.737 0.300 A 27 ILE CA C 13 64.107 0.300 A 27 ILE CB C 13 37.875 0.300 A 27 ILE N N 15 116.693 0.300 A 28 ASN H H 1 7.853 0.020 A 28 ASN HA H 1 4.429 0.020 A 28 ASN HBy H 1 2.670 0.020 A 28 ASN HBx H 1 2.572 0.020 A 28 ASN HD2x H 1 6.735 0.020 A 28 ASN HD2y H 1 7.571 0.020 A 28 ASN C C 13 175.766 0.300 A 28 ASN CA C 13 55.852 0.300 A 28 ASN CB C 13 39.764 0.300 A 28 ASN N N 15 117.531 0.300 A 28 ASN ND2 N 15 111.960 0.300 A 29 ALA H H 1 8.050 0.020 A 29 ALA HA H 1 4.118 0.020 A 29 ALA HB% H 1 1.163 0.020 A 29 ALA C C 13 177.638 0.300 A 29 ALA CA C 13 53.303 0.300 A 29 ALA CB C 13 18.985 0.300 A 29 ALA N N 15 120.505 0.300 A 30 LYS H H 1 7.771 0.020 A 30 LYS HA H 1 4.327 0.020 A 30 LYS HBy H 1 1.931 0.020 A 30 LYS HBx H 1 1.774 0.020 A 30 LYS C C 13 176.192 0.300 A 30 LYS CA C 13 55.493 0.300 A 30 LYS CB C 13 31.831 0.300 A 30 LYS N N 15 116.476 0.300 A 31 ALA H H 1 7.924 0.020 A 31 ALA HA H 1 4.129 0.020 A 31 ALA HB% H 1 1.426 0.020 A 31 ALA C C 13 177.401 0.300 A 31 ALA CA C 13 53.738 0.300 A 31 ALA CB C 13 19.262 0.300 A 31 ALA N N 15 122.457 0.300 A 32 ASP H H 1 8.401 0.020 A 32 ASP HA H 1 4.425 0.020 A 32 ASP HBy H 1 2.665 0.020 A 32 ASP HBx H 1 2.596 0.020 A 32 ASP C C 13 176.690 0.300 A 32 ASP CA C 13 55.303 0.300 A 32 ASP CB C 13 40.220 0.300 A 32 ASP N N 15 116.883 0.300 A 33 VAL H H 1 7.665 0.020 A 33 VAL HA H 1 4.082 0.020 A 33 VAL HB H 1 2.142 0.020 A 33 VAL HGx% H 1 0.906 0.020 A 33 VAL HGy% H 1 0.906 0.020 A 33 VAL C C 13 175.552 0.300 A 33 VAL CA C 13 62.761 0.300 A 33 VAL CB C 13 32.406 0.300 A 33 VAL N N 15 116.175 0.300 A 34 LEU H H 1 7.795 0.020 A 34 LEU HA H 1 4.140 0.020 A 34 LEU HBx H 1 1.222 0.020 A 34 LEU HBy H 1 1.463 0.020 A 34 LEU HDx% H 1 0.778 0.020 A 34 LEU HDy% H 1 0.893 0.020 A 34 LEU C C 13 176.382 0.300 A 34 LEU CA C 13 55.664 0.300 A 34 LEU CB C 13 42.486 0.300 A 34 LEU N N 15 120.012 0.300 A 35 PHE H H 1 7.793 0.020 A 35 PHE HA H 1 4.595 0.020 A 35 PHE HBy H 1 3.158 0.020 A 35 PHE HBx H 1 3.030 0.020 A 35 PHE HDx H 1 7.253 0.020 A 35 PHE HDy H 1 7.253 0.020 A 35 PHE C C 13 174.960 0.300 A 35 PHE CA C 13 57.734 0.300 A 35 PHE CB C 13 39.289 0.300 A 35 PHE N N 15 116.572 0.300 A 36 ILE H H 1 7.686 0.020 A 36 ILE HA H 1 4.108 0.020 A 36 ILE HB H 1 1.806 0.020 A 36 ILE HD11 H 1 0.827 0.020 A 36 ILE HD12 H 1 0.827 0.020 A 36 ILE HD13 H 1 0.827 0.020 A 36 ILE HG1y H 1 1.388 0.020 A 36 ILE HG1x H 1 1.094 0.020 A 36 ILE C C 13 174.975 0.300 A 36 ILE CA C 13 60.863 0.300 A 36 ILE CB C 13 39.010 0.300 A 36 ILE N N 15 119.136 0.300 A 37 ALA H H 1 8.169 0.020 A 37 ALA HA H 1 4.513 0.020 A 37 ALA HB% H 1 1.315 0.020 A 37 ALA CA C 13 50.437 0.300 A 37 ALA CB C 13 18.317 0.300 A 37 ALA N N 15 127.555 0.300 A 38 PRO HA H 1 4.385 0.020 A 38 PRO HBy H 1 2.242 0.020 A 38 PRO HBx H 1 1.841 0.020 A 38 PRO C C 13 176.643 0.300 A 38 PRO CA C 13 62.998 0.300 A 38 PRO CB C 13 31.849 0.300 A 39 ARG H H 1 8.311 0.020 A 39 ARG HA H 1 4.277 0.020 A 39 ARG HBx H 1 1.709 0.020 A 39 ARG HBy H 1 1.709 0.020 A 39 ARG HGx H 1 1.627 0.020 A 39 ARG HGy H 1 1.627 0.020 A 39 ARG C C 13 176.026 0.300 A 39 ARG CA C 13 55.808 0.300 A 39 ARG CB C 13 31.178 0.300 A 39 ARG N N 15 121.037 0.300 A 40 GLU H H 1 8.346 0.020 A 40 GLU HA H 1 4.284 0.020 A 40 GLU HBx H 1 1.849 0.020 A 40 GLU HBy H 1 1.849 0.020 A 40 GLU HGy H 1 2.223 0.020 A 40 GLU HGx H 1 2.010 0.020 A 40 GLU CA C 13 54.336 0.300 A 40 GLU CB C 13 29.606 0.300 A 40 GLU N N 15 122.834 0.300 A 41 PRO HA H 1 4.332 0.020 A 41 PRO HBy H 1 2.252 0.020 A 41 PRO HBx H 1 1.916 0.020 A 41 PRO C C 13 177.496 0.300 A 41 PRO CA C 13 63.793 0.300 A 41 PRO CB C 13 31.794 0.300 A 42 GLY H H 1 8.412 0.020 A 42 GLY HAx H 1 3.896 0.020 A 42 GLY HAy H 1 3.896 0.020 A 42 GLY C C 13 173.808 0.300 A 42 GLY CA C 13 45.233 0.300 A 42 GLY N N 15 108.890 0.300 A 43 ALA H H 1 7.929 0.020 A 43 ALA HA H 1 4.297 0.020 A 43 ALA HB% H 1 1.339 0.020 A 43 ALA C C 13 177.567 0.300 A 43 ALA CA C 13 52.486 0.300 A 43 ALA CB C 13 19.425 0.300 A 43 ALA N N 15 123.534 0.300 A 44 VAL H H 1 7.985 0.020 A 44 VAL HA H 1 4.118 0.020 A 44 VAL HB H 1 1.971 0.020 A 44 VAL HGx% H 1 0.584 0.020 A 44 VAL HGy% H 1 0.824 0.020 A 44 VAL C C 13 175.647 0.300 A 44 VAL CA C 13 62.060 0.300 A 44 VAL CB C 13 32.901 0.300 A 44 VAL N N 15 118.351 0.300 A 45 SER H H 1 8.081 0.020 A 45 SER HA H 1 4.394 0.020 A 45 SER HBx H 1 3.753 0.020 A 45 SER HBy H 1 3.753 0.020 A 45 SER C C 13 172.840 0.300 A 45 SER CA C 13 57.993 0.300 A 45 SER CB C 13 64.261 0.300 A 45 SER N N 15 119.089 0.300 A 46 TYR H H 1 7.628 0.020 A 46 TYR CA C 13 59.319 0.300 A 46 TYR CB C 13 39.456 0.300 A 46 TYR N N 15 126.703 0.300 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type . save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 25 TYR HBy A 26 CYS H 1.0 1.8 4.11 2 2 A 26 CYS H A 27 ILE H 1.0 1.8 3.36 3 3 A 26 CYS H A 26 CYS HBy 1.0 1.8 3.94 4 4 A 26 CYS H A 25 TYR HBx 1.0 1.8 4.11 5 5 A 26 CYS H A 22 ILE HA 1.0 1.8 4.57 6 6 A 26 CYS H A 26 CYS HBx 1.0 1.8 3.94 7 7 A 32 ASP HA A 34 LEU H 1.0 1.8 4.42 8 8 A 34 LEU H A 34 LEU HBy 1.0 1.8 3.63 9 9 A 34 LEU H A 34 LEU HDy% 1.0 1.8 4.28 10 10 A 34 LEU H A 33 VAL HGx% 1.0 1.8 4.04 11 10 A 34 LEU H A 33 VAL HGy% 1.0 1.8 4.04 12 11 A 34 LEU H A 34 LEU HDx% 1.0 1.8 4.28 13 12 A 34 LEU H A 34 LEU HBx 1.0 1.8 3.63 14 13 A 34 LEU H A 33 VAL HB 1.0 1.8 4.00 15 14 A 19 PHE H A 20 SER H 1.0 1.8 3.09 16 15 A 19 PHE H A 18 ILE H 1.0 1.8 3.87 17 16 A 19 PHE H A 17 LEU HA 1.0 1.8 4.34 18 17 A 19 PHE H A 18 ILE HD11 1.0 2.8 4.92 19 18 A 19 PHE H A 18 ILE HB 1.0 1.8 3.68 20 19 A 19 PHE H A 19 PHE HBx 1.0 1.8 3.20 21 19 A 19 PHE H A 19 PHE HBy 1.0 1.8 3.20 22 20 A 19 PHE H A 16 ILE HA 1.0 1.8 4.19 23 21 A 43 ALA H A 43 ALA HB% 1.0 1.8 3.43 24 22 A 27 ILE H A 27 ILE HG21 1.0 1.8 3.92 25 23 A 27 ILE H A 27 ILE HG1y 1.0 1.8 4.22 26 24 A 27 ILE H A 25 TYR H 1.0 1.8 3.85 27 25 A 27 ILE H A 27 ILE HG1x 1.0 1.8 4.22 28 26 A 27 ILE H A 27 ILE HB 1.0 1.8 3.75 29 27 A 27 ILE H A 27 ILE HD11 1.0 1.8 3.97 30 28 A 16 ILE H A 16 ILE HG21 1.0 1.8 3.70 31 29 A 16 ILE H A 16 ILE HB 1.0 1.8 3.57 32 30 A 16 ILE H A 17 LEU H 1.0 1.8 3.89 33 31 A 16 ILE H A 16 ILE HD11 1.0 1.8 3.80 34 32 A 16 ILE H A 13 GLY HAx 1.0 1.8 4.50 35 32 A 16 ILE H A 13 GLY HAy 1.0 1.8 4.50 36 33 A 16 ILE H A 16 ILE HG1x 1.0 1.8 4.40 37 33 A 16 ILE H A 16 ILE HG1y 1.0 1.8 4.40 38 34 A 44 VAL H A 44 VAL HGy% 1.0 1.8 4.28 39 35 A 43 ALA HB% A 44 VAL H 1.0 1.8 4.08 40 36 A 44 VAL H A 44 VAL HB 1.0 1.8 3.88 41 37 A 44 VAL H A 44 VAL HGx% 1.0 1.8 4.28 42 38 A 44 VAL H A 43 ALA HA 1.0 1.8 3.45 43 39 A 24 THR HG2% A 28 ASN HD2x 1.0 1.8 4.02 44 40 A 28 ASN HD2x A 28 ASN H 1.0 1.8 4.66 45 41 A 28 ASN HD2x A 28 ASN HA 1.0 1.8 4.62 46 42 A 16 ILE H A 15 GLY H 1.0 1.8 2.75 47 43 A 15 GLY H A 14 PHE HBy 1.0 1.8 4.48 48 44 A 15 GLY H A 14 PHE HBx 1.0 1.8 4.48 49 45 A 15 GLY H A 13 GLY H 1.0 1.8 3.39 50 46 A 15 GLY H A 12 VAL HA 1.0 1.8 3.69 51 47 A 20 SER H A 21 LEU H 1.0 1.8 4.06 52 48 A 20 SER H A 17 LEU HA 1.0 1.8 3.87 53 49 A 20 SER H A 22 ILE H 1.0 1.8 4.30 54 50 A 20 SER H A 19 PHE HBx 1.0 1.8 3.55 55 50 A 20 SER H A 19 PHE HBy 1.0 1.8 3.55 56 51 A 20 SER H A 16 ILE HA 1.0 1.8 4.31 57 52 A 19 PHE H A 21 LEU H 1.0 1.8 4.39 58 53 A 21 LEU H A 20 SER HBx 1.0 1.8 4.28 59 53 A 21 LEU H A 20 SER HBy 1.0 1.8 4.28 60 54 A 21 LEU H A 21 LEU HG 1.0 1.8 4.09 61 55 A 21 LEU H A 18 ILE HA 1.0 1.8 4.24 62 56 A 21 LEU H A 23 VAL H 1.0 1.8 4.16 63 57 A 21 LEU H A 21 LEU HBx 1.0 1.8 3.71 64 58 A 17 LEU HA A 21 LEU H 1.0 1.8 3.93 65 59 A 21 LEU H A 22 ILE H 1.0 1.8 3.47 66 60 A 21 LEU H A 21 LEU HDx% 1.0 1.8 3.40 67 60 A 21 LEU H A 21 LEU HDy% 1.0 1.8 3.40 68 61 A 21 LEU H A 21 LEU HBy 1.0 1.8 3.71 69 62 A 7 LEU H A 7 LEU HBx 1.0 1.8 4.12 70 63 A 7 LEU H A 3 LYS HA 1.0 1.8 4.66 71 64 A 7 LEU H A 7 LEU HDx% 1.0 1.8 4.26 72 64 A 7 LEU H A 7 LEU HDy% 1.0 1.8 4.26 73 65 A 7 LEU H A 4 GLU HA 1.0 1.8 4.51 74 66 A 7 LEU H A 8 ILE H 1.0 1.8 5.50 75 67 A 7 LEU H A 7 LEU HBy 1.0 1.8 4.12 76 68 A 29 ALA HA A 31 ALA H 1.0 1.8 4.01 77 69 A 31 ALA H A 31 ALA HB% 1.0 1.8 3.09 78 70 A 32 ASP HA A 33 VAL H 1.0 1.8 3.22 79 71 A 34 LEU H A 33 VAL H 1.0 1.8 3.11 80 72 A 33 VAL H A 32 ASP HBx 1.0 1.8 4.34 81 73 A 33 VAL H A 33 VAL HGx% 1.0 1.8 2.95 82 73 A 33 VAL HGy% A 33 VAL H 1.0 1.8 2.95 83 74 A 33 VAL H A 32 ASP HBy 1.0 1.8 4.34 84 75 A 33 VAL HB A 33 VAL H 1.0 1.8 3.42 85 76 A 28 ASN H A 25 TYR HA 1.0 1.8 4.32 86 77 A 26 CYS H A 28 ASN H 1.0 1.8 4.89 87 78 A 27 ILE H A 28 ASN H 1.0 1.8 3.89 88 79 A 27 ILE HG21 A 28 ASN H 1.0 1.8 4.16 89 80 A 28 ASN H A 28 ASN HBx 1.0 1.8 3.75 90 81 A 28 ASN H A 28 ASN HBy 1.0 1.8 3.75 91 82 A 28 ASN H A 29 ALA H 1.0 1.8 3.72 92 83 A 27 ILE HB A 28 ASN H 1.0 1.8 3.95 93 84 A 27 ILE HD11 A 28 ASN H 1.0 1.8 4.48 94 85 A 19 PHE H A 17 LEU H 1.0 1.8 4.07 95 86 A 17 LEU H A 15 GLY HAx 1.0 1.8 4.11 96 86 A 17 LEU H A 15 GLY HAy 1.0 1.8 4.11 97 87 A 17 LEU H A 15 GLY H 1.0 2.8 3.85 98 88 A 17 LEU H A 17 LEU HDx% 1.0 1.8 4.07 99 88 A 17 LEU H A 17 LEU HDy% 1.0 1.8 4.07 100 89 A 16 ILE HB A 17 LEU H 1.0 1.8 3.74 101 90 A 17 LEU H A 16 ILE HD11 1.0 1.8 4.34 102 91 A 18 ILE H A 17 LEU H 1.0 1.8 3.77 103 92 A 17 LEU H A 14 PHE HA 1.0 1.8 4.08 104 93 A 17 LEU H A 17 LEU HBx 1.0 1.8 3.49 105 94 A 17 LEU H A 17 LEU HBy 1.0 1.8 3.49 106 95 A 17 LEU H A 16 ILE HG1x 1.0 1.8 4.40 107 95 A 17 LEU H A 16 ILE HG1y 1.0 1.8 4.40 108 96 A 35 PHE H A 35 PHE HBx 1.0 1.8 3.48 109 97 A 35 PHE H A 34 LEU HBy 1.0 1.8 3.67 110 98 A 35 PHE H A 34 LEU HA 1.0 1.8 3.15 111 99 A 35 PHE H A 34 LEU HDy% 1.0 1.8 4.02 112 100 A 35 PHE H A 35 PHE HBy 1.0 1.8 3.48 113 101 A 35 PHE H A 36 ILE H 1.0 1.8 3.29 114 102 A 35 PHE H A 34 LEU HDx% 1.0 1.8 4.02 115 103 A 35 PHE H A 34 LEU HBx 1.0 1.8 3.67 116 104 A 35 PHE H A 35 PHE HD% 1.0 1.8 3.87 117 105 A 16 ILE H A 14 PHE H 1.0 1.8 3.73 118 106 A 15 GLY H A 14 PHE H 1.0 1.8 3.73 119 107 A 14 PHE H A 14 PHE HBy 1.0 1.8 3.47 120 108 A 14 PHE H A 13 GLY HAx 1.0 1.8 3.46 121 108 A 13 GLY HAy A 14 PHE H 1.0 1.8 3.46 122 109 A 14 PHE H A 11 THR HA 1.0 1.8 4.05 123 110 A 14 PHE H A 12 VAL H 1.0 1.8 5.16 124 111 A 14 PHE H A 14 PHE HBx 1.0 1.8 3.47 125 112 A 13 GLY H A 14 PHE H 1.0 1.8 3.81 126 113 A 14 PHE H A 10 LEU HA 1.0 1.8 4.26 127 114 A 23 VAL H A 23 VAL HB 1.0 1.8 3.85 128 115 A 23 VAL H A 23 VAL HGy% 1.0 1.8 3.71 129 116 A 23 VAL H A 20 SER HA 1.0 1.8 5.00 130 117 A 23 VAL H A 22 ILE HB 1.0 1.8 3.85 131 118 A 25 TYR H A 23 VAL H 1.0 1.8 3.76 132 119 A 23 VAL H A 23 VAL HGx% 1.0 1.8 3.71 133 120 A 23 VAL H A 19 PHE HA 1.0 1.8 4.83 134 121 A 18 ILE H A 16 ILE H 1.0 1.8 4.23 135 122 A 18 ILE H A 18 ILE HG21 1.0 1.8 4.23 136 123 A 18 ILE H A 15 GLY HAx 1.0 1.8 4.26 137 123 A 18 ILE H A 15 GLY HAy 1.0 1.8 4.26 138 124 A 18 ILE H A 18 ILE HG1x 1.0 1.8 4.05 139 125 A 20 SER H A 18 ILE H 1.0 1.8 4.23 140 126 A 18 ILE H A 18 ILE HD11 1.0 1.8 4.25 141 127 A 18 ILE H A 18 ILE HB 1.0 1.8 3.75 142 128 A 18 ILE H A 17 LEU HBx 1.0 1.8 4.24 143 129 A 18 ILE H A 18 ILE HG1y 1.0 1.8 4.05 144 130 A 18 ILE H A 17 LEU HBy 1.0 1.8 4.24 145 131 A 2 SER HA A 5 LEU H 1.0 1.8 4.60 146 132 A 5 LEU H A 5 LEU HBx 1.0 1.8 3.92 147 133 A 5 LEU H A 5 LEU HBy 1.0 1.8 3.92 148 134 A 5 LEU H A 6 GLU H 1.0 1.8 4.34 149 135 A 5 LEU H A 5 LEU HDx% 1.0 1.8 3.83 150 135 A 5 LEU H A 5 LEU HDy% 1.0 1.8 3.83 151 136 A 5 LEU H A 4 GLU HBx 1.0 1.8 3.89 152 136 A 5 LEU H A 4 GLU HBy 1.0 1.8 3.89 153 137 A 11 THR H A 11 THR HB 1.0 1.8 3.97 154 138 A 11 THR H A 10 LEU HBx 1.0 1.8 4.51 155 139 A 11 THR H A 11 THR HG2% 1.0 1.8 4.25 156 140 A 12 VAL H A 11 THR H 1.0 1.8 4.47 157 141 A 13 GLY H A 11 THR H 1.0 1.8 4.87 158 142 A 11 THR H A 10 LEU HBy 1.0 1.8 4.51 159 143 A 36 ILE H A 36 ILE HD11 1.0 1.8 3.69 160 144 A 36 ILE H A 36 ILE HB 1.0 1.8 3.31 161 145 A 36 ILE H A 35 PHE HBx 1.0 1.8 4.06 162 146 A 36 ILE H A 36 ILE HG1x 1.0 1.8 3.80 163 147 A 36 ILE H A 35 PHE HBy 1.0 1.8 4.06 164 148 A 36 ILE H A 36 ILE HG1y 1.0 1.8 3.80 165 149 A 36 ILE H A 35 PHE HA 1.0 1.8 3.09 166 150 A 36 ILE H A 37 ALA H 1.0 1.8 3.56 167 151 A 34 LEU H A 32 ASP H 1.0 1.8 4.29 168 152 A 32 ASP H A 32 ASP HBx 1.0 1.8 3.59 169 153 A 31 ALA H A 32 ASP H 1.0 1.8 3.98 170 154 A 33 VAL H A 32 ASP H 1.0 1.8 3.51 171 155 A 32 ASP H A 31 ALA HA 1.0 1.8 3.28 172 156 A 32 ASP H A 32 ASP HBy 1.0 1.8 3.59 173 157 A 31 ALA HB% A 32 ASP H 1.0 1.8 3.29 174 158 A 6 GLU H A 3 LYS H 1.0 1.8 4.81 175 159 A 29 ALA HB% A 30 LYS H 1.0 1.8 3.70 176 160 A 29 ALA HA A 30 LYS H 1.0 1.8 3.45 177 161 A 31 ALA H A 30 LYS H 1.0 1.8 3.62 178 162 A 30 LYS H A 30 LYS HBx 1.0 1.8 3.89 179 163 A 30 LYS H A 30 LYS HBy 1.0 1.8 3.89 180 164 A 29 ALA H A 29 ALA HB% 1.0 1.8 3.13 181 165 A 27 ILE H A 29 ALA H 1.0 1.8 4.94 182 166 A 29 ALA H A 28 ASN HBx 1.0 1.8 4.11 183 167 A 29 ALA H A 28 ASN HBy 1.0 1.8 4.11 184 168 A 29 ALA H A 26 CYS HA 1.0 1.8 4.42 185 169 A 29 ALA H A 30 LYS H 1.0 1.8 3.76 186 170 A 22 ILE H A 22 ILE HG21 1.0 1.8 4.10 187 171 A 22 ILE H A 21 LEU HG 1.0 1.8 4.27 188 172 A 22 ILE H A 23 VAL H 1.0 1.8 4.03 189 173 A 22 ILE H A 22 ILE HD11 1.0 1.8 4.52 190 174 A 22 ILE H A 20 SER HA 1.0 1.8 4.15 191 175 A 22 ILE H A 21 LEU HBx 1.0 1.8 3.78 192 176 A 22 ILE H A 22 ILE HB 1.0 1.8 3.97 193 177 A 22 ILE H A 21 LEU HDx% 1.0 1.8 3.86 194 177 A 22 ILE H A 21 LEU HDy% 1.0 1.8 3.86 195 178 A 22 ILE H A 19 PHE HA 1.0 1.8 4.08 196 179 A 22 ILE H A 21 LEU HBy 1.0 1.8 3.78 197 180 A 26 CYS H A 25 TYR H 1.0 1.8 3.23 198 181 A 25 TYR HBy A 25 TYR H 1.0 1.8 3.90 199 182 A 25 TYR H A 24 THR HG2% 1.0 1.8 4.35 200 183 A 25 TYR H A 24 THR HB 1.0 1.8 4.49 201 184 A 25 TYR H A 21 LEU HA 1.0 1.8 4.16 202 185 A 25 TYR HBx A 25 TYR H 1.0 1.8 3.90 203 186 A 22 ILE HA A 25 TYR H 1.0 1.8 4.49 204 187 A 25 TYR H A 24 THR H 1.0 1.8 4.25 205 188 A 39 ARG H A 39 ARG HBx 1.0 1.8 3.44 206 188 A 39 ARG H A 39 ARG HBy 1.0 1.8 3.44 207 189 A 39 ARG H A 38 PRO HA 1.0 1.8 2.77 208 190 A 39 ARG H A 38 PRO HBy 1.0 1.8 3.83 209 191 A 39 ARG H A 39 ARG HGx 1.0 1.8 3.70 210 191 A 39 ARG H A 39 ARG HGy 1.0 1.8 3.70 211 192 A 39 ARG H A 38 PRO HBx 1.0 1.8 3.83 212 193 A 4 GLU H A 3 LYS HBx 1.0 1.8 4.39 213 193 A 3 LYS HBy A 4 GLU H 1.0 1.8 4.39 214 194 A 5 LEU H A 4 GLU H 1.0 1.8 4.47 215 195 A 4 GLU H A 4 GLU HBx 1.0 1.8 4.07 216 195 A 4 GLU HBy A 4 GLU H 1.0 1.8 4.07 217 196 A 24 THR HG2% A 28 ASN HD2y 1.0 1.8 4.02 218 197 A 28 ASN H A 28 ASN HD2y 1.0 1.8 4.66 219 198 A 28 ASN HA A 28 ASN HD2y 1.0 1.8 4.62 220 199 A 3 LYS HA A 6 GLU H 1.0 1.8 4.43 221 200 A 7 LEU H A 6 GLU H 1.0 1.8 4.40 222 201 A 13 GLY H A 12 VAL H 1.0 1.8 4.55 223 202 A 13 GLY H A 10 LEU HA 1.0 1.8 4.68 224 203 A 26 CYS H A 24 THR H 1.0 1.8 4.83 225 204 A 24 THR HG2% A 24 THR H 1.0 1.8 4.09 226 205 A 24 THR HB A 24 THR H 1.0 1.8 3.90 227 206 A 23 VAL HB A 24 THR H 1.0 1.8 4.00 228 207 A 23 VAL H A 24 THR H 1.0 1.8 4.07 229 208 A 24 THR H A 23 VAL HGy% 1.0 1.8 4.27 230 209 A 21 LEU HA A 24 THR H 1.0 1.8 4.68 231 210 A 20 SER HA A 24 THR H 1.0 1.8 4.45 232 211 A 22 ILE H A 24 THR H 1.0 1.8 5.09 233 212 A 24 THR H A 23 VAL HGx% 1.0 1.8 4.27 234 213 A 9 THR H A 10 LEU H 1.0 1.8 4.69 235 214 A 11 THR H A 10 LEU H 1.0 1.8 3.47 236 215 A 46 TYR H A 45 SER HBx 1.0 1.8 3.69 237 215 A 45 SER HBy A 46 TYR H 1.0 1.8 3.69 238 216 A 40 GLU H A 39 ARG HBx 1.0 1.8 3.98 239 216 A 39 ARG HBy A 40 GLU H 1.0 1.8 3.98 240 217 A 40 GLU H A 40 GLU HBx 1.0 1.8 3.08 241 217 A 40 GLU H A 40 GLU HBy 1.0 1.8 3.08 242 218 A 40 GLU H A 40 GLU HGx 1.0 1.8 3.83 243 219 A 40 GLU H A 39 ARG HA 1.0 1.8 3.17 244 220 A 40 GLU H A 39 ARG HGx 1.0 1.8 4.24 245 220 A 39 ARG HGy A 40 GLU H 1.0 1.8 4.24 246 221 A 40 GLU H A 40 GLU HGy 1.0 1.8 3.83 247 222 A 36 ILE HD11 A 37 ALA H 1.0 1.8 3.77 248 223 A 36 ILE HB A 37 ALA H 1.0 1.8 3.75 249 224 A 37 ALA H A 36 ILE HA 1.0 1.8 3.21 250 225 A 37 ALA H A 37 ALA HB% 1.0 1.8 3.07 251 226 A 5 LEU H A 5 LEU HBx 1.0 1.8 3.31 252 226 A 5 LEU H A 5 LEU HBy 1.0 1.8 3.31 253 227 A 7 LEU H A 7 LEU HBx 1.0 1.8 3.61 254 227 A 7 LEU H A 7 LEU HBy 1.0 1.8 3.61 255 228 A 11 THR H A 10 LEU HBx 1.0 1.8 3.92 256 228 A 11 THR H A 10 LEU HBy 1.0 1.8 3.92 257 229 A 14 PHE H A 14 PHE HBx 1.0 1.8 3.02 258 229 A 14 PHE H A 14 PHE HBy 1.0 1.8 3.02 259 230 A 15 GLY H A 14 PHE HBx 1.0 1.8 3.75 260 230 A 15 GLY H A 14 PHE HBy 1.0 1.8 3.75 261 231 A 17 LEU H A 17 LEU HBx 1.0 1.8 3.05 262 231 A 17 LEU H A 17 LEU HBy 1.0 1.8 3.05 263 232 A 18 ILE H A 17 LEU HBx 1.0 1.8 3.51 264 232 A 18 ILE H A 17 LEU HBy 1.0 1.8 3.51 265 233 A 18 ILE H A 18 ILE HG1y 1.0 1.8 3.49 266 233 A 18 ILE H A 18 ILE HG1x 1.0 1.8 3.49 267 234 A 19 PHE H A 18 ILE HG1y 1.0 1.8 4.37 268 234 A 19 PHE H A 18 ILE HG1x 1.0 1.8 4.37 269 235 A 21 LEU H A 21 LEU HBy 1.0 1.8 3.20 270 235 A 21 LEU H A 21 LEU HBx 1.0 1.8 3.20 271 236 A 22 ILE H A 21 LEU HBy 1.0 1.8 3.29 272 236 A 22 ILE H A 21 LEU HBx 1.0 1.8 3.29 273 237 A 23 VAL H A 23 VAL HGy% 1.0 1.8 3.21 274 237 A 23 VAL H A 23 VAL HGx% 1.0 1.8 3.21 275 238 A 24 THR H A 23 VAL HGy% 1.0 1.8 3.65 276 238 A 24 THR H A 23 VAL HGx% 1.0 1.8 3.65 277 239 A 27 ILE H A 26 CYS HBy 1.0 1.8 4.32 278 239 A 27 ILE H A 26 CYS HBx 1.0 1.8 4.32 279 240 A 27 ILE H A 27 ILE HG1y 1.0 1.8 3.54 280 240 A 27 ILE H A 27 ILE HG1x 1.0 1.8 3.54 281 241 A 28 ASN H A 27 ILE HG1y 1.0 1.8 4.17 282 241 A 28 ASN H A 27 ILE HG1x 1.0 1.8 4.17 283 242 A 28 ASN H A 28 ASN HBy 1.0 1.8 3.28 284 242 A 28 ASN H A 28 ASN HBx 1.0 1.8 3.28 285 243 A 28 ASN HD2x A 28 ASN H 1.0 1.8 3.94 286 243 A 28 ASN H A 28 ASN HD2y 1.0 1.8 3.94 287 244 A 28 ASN HD2y A 28 ASN HBx 1.0 1.8 3.17 288 244 A 28 ASN HD2x A 28 ASN HBx 1.0 1.8 3.17 289 244 A 28 ASN HD2x A 28 ASN HBy 1.0 1.8 3.17 290 244 A 28 ASN HD2y A 28 ASN HBy 1.0 1.8 3.17 291 245 A 29 ALA H A 28 ASN HBy 1.0 1.8 3.60 292 245 A 29 ALA H A 28 ASN HBx 1.0 1.8 3.60 293 246 A 31 ALA H A 30 LYS HBx 1.0 1.8 4.18 294 246 A 31 ALA H A 30 LYS HBy 1.0 1.8 4.18 295 247 A 32 ASP H A 32 ASP HBx 1.0 1.8 3.14 296 247 A 32 ASP H A 32 ASP HBy 1.0 1.8 3.14 297 248 A 33 VAL H A 32 ASP HBx 1.0 1.8 3.79 298 248 A 33 VAL H A 32 ASP HBy 1.0 1.8 3.79 299 249 A 34 LEU H A 34 LEU HBx 1.0 1.8 3.06 300 249 A 34 LEU H A 34 LEU HBy 1.0 1.8 3.06 301 250 A 34 LEU H A 34 LEU HDy% 1.0 1.8 3.53 302 250 A 34 LEU H A 34 LEU HDx% 1.0 1.8 3.53 303 251 A 35 PHE H A 34 LEU HBx 1.0 1.8 3.16 304 251 A 35 PHE H A 34 LEU HBy 1.0 1.8 3.16 305 252 A 35 PHE H A 35 PHE HBx 1.0 1.8 3.00 306 252 A 35 PHE H A 35 PHE HBy 1.0 1.8 3.00 307 253 A 36 ILE H A 35 PHE HBx 1.0 1.8 3.49 308 253 A 36 ILE H A 35 PHE HBy 1.0 1.8 3.49 309 254 A 36 ILE H A 36 ILE HG1x 1.0 1.8 3.33 310 254 A 36 ILE H A 36 ILE HG1y 1.0 1.8 3.33 311 255 A 39 ARG H A 38 PRO HBx 1.0 1.8 3.33 312 255 A 39 ARG H A 38 PRO HBy 1.0 1.8 3.33 313 256 A 40 GLU H A 40 GLU HGx 1.0 1.8 3.33 314 256 A 40 GLU H A 40 GLU HGy 1.0 1.8 3.33 315 257 A 44 VAL H A 44 VAL HGy% 1.0 1.8 3.61 316 257 A 44 VAL H A 44 VAL HGx% 1.0 1.8 3.61 317 258 A 45 SER H A 44 VAL HGy% 1.0 1.8 4.20 318 258 A 44 VAL HGx% A 45 SER H 1.0 1.8 4.20 stop_ save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_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 2 SER C A 3 LYS N A 3 LYS CA A 3 LYS C 1.0 -75.2 -49.1 PHI 2 2 A 3 LYS N A 3 LYS CA A 3 LYS C A 4 GLU N 1.0 -48.0 -28.0 PSI 3 3 A 3 LYS C A 4 GLU N A 4 GLU CA A 4 GLU C 1.0 -73.0 -53.0 PHI 4 4 A 4 GLU N A 4 GLU CA A 4 GLU C A 5 LEU N 1.0 -60.1 -20.7 PSI 5 5 A 4 GLU C A 5 LEU N A 5 LEU CA A 5 LEU C 1.0 -77.0 -57.0 PHI 6 6 A 5 LEU N A 5 LEU CA A 5 LEU C A 6 GLU N 1.0 -50.4 -29.2 PSI 7 7 A 5 LEU C A 6 GLU N A 6 GLU CA A 6 GLU C 1.0 -74.4 -54.4 PHI 8 8 A 6 GLU N A 6 GLU CA A 6 GLU C A 7 LEU N 1.0 -52.9 -32.9 PSI 9 9 A 6 GLU C A 7 LEU N A 7 LEU CA A 7 LEU C 1.0 -72.0 -52.0 PHI 10 10 A 7 LEU N A 7 LEU CA A 7 LEU C A 8 ILE N 1.0 -55.4 -26.3 PSI 11 11 A 7 LEU C A 8 ILE N A 8 ILE CA A 8 ILE C 1.0 -75.8 -54.6 PHI 12 12 A 8 ILE N A 8 ILE CA A 8 ILE C A 9 THR N 1.0 -55.7 -26.4 PSI 13 13 A 8 ILE C A 9 THR N A 9 THR CA A 9 THR C 1.0 -74.6 -54.6 PHI 14 14 A 9 THR N A 9 THR CA A 9 THR C A 10 LEU N 1.0 -58.2 -21.4 PSI 15 15 A 9 THR C A 10 LEU N A 10 LEU CA A 10 LEU C 1.0 -71.8 -51.9 PHI 16 16 A 10 LEU N A 10 LEU CA A 10 LEU C A 11 THR N 1.0 -50.4 -26.7 PSI 17 17 A 10 LEU C A 11 THR N A 11 THR CA A 11 THR C 1.0 -79.6 -46.4 PHI 18 18 A 11 THR N A 11 THR CA A 11 THR C A 12 VAL N 1.0 -53.7 -33.7 PSI 19 19 A 11 THR C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -72.7 -52.7 PHI 20 20 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 GLY N 1.0 -58.4 -22.3 PSI 21 21 A 12 VAL C A 13 GLY N A 13 GLY CA A 13 GLY C 1.0 -71.9 -51.9 PHI 22 22 A 13 GLY N A 13 GLY CA A 13 GLY C A 14 PHE N 1.0 -52.6 -31.6 PSI 23 23 A 13 GLY C A 14 PHE N A 14 PHE CA A 14 PHE C 1.0 -81.5 -50.0 PHI 24 24 A 14 PHE N A 14 PHE CA A 14 PHE C A 15 GLY N 1.0 -53.0 -33.0 PSI 25 25 A 14 PHE C A 15 GLY N A 15 GLY CA A 15 GLY C 1.0 -79.3 -46.7 PHI 26 26 A 15 GLY N A 15 GLY CA A 15 GLY C A 16 ILE N 1.0 -54.1 -34.0 PSI 27 27 A 15 GLY C A 16 ILE N A 16 ILE CA A 16 ILE C 1.0 -73.3 -53.3 PHI 28 28 A 16 ILE N A 16 ILE CA A 16 ILE C A 17 LEU N 1.0 -51.1 -31.1 PSI 29 29 A 16 ILE C A 17 LEU N A 17 LEU CA A 17 LEU C 1.0 -73.8 -53.8 PHI 30 30 A 17 LEU N A 17 LEU CA A 17 LEU C A 18 ILE N 1.0 -56.4 -36.4 PSI 31 31 A 17 LEU C A 18 ILE N A 18 ILE CA A 18 ILE C 1.0 -74.6 -54.6 PHI 32 32 A 18 ILE N A 18 ILE CA A 18 ILE C A 19 PHE N 1.0 -51.8 -29.2 PSI 33 33 A 18 ILE C A 19 PHE N A 19 PHE CA A 19 PHE C 1.0 -71.0 -51.0 PHI 34 34 A 19 PHE N A 19 PHE CA A 19 PHE C A 20 SER N 1.0 -50.7 -30.7 PSI 35 35 A 19 PHE C A 20 SER N A 20 SER CA A 20 SER C 1.0 -79.5 -51.8 PHI 36 36 A 20 SER N A 20 SER CA A 20 SER C A 21 LEU N 1.0 -55.2 -24.6 PSI 37 37 A 20 SER C A 21 LEU N A 21 LEU CA A 21 LEU C 1.0 -72.6 -52.6 PHI 38 38 A 21 LEU N A 21 LEU CA A 21 LEU C A 22 ILE N 1.0 -54.1 -34.1 PSI 39 39 A 21 LEU C A 22 ILE N A 22 ILE CA A 22 ILE C 1.0 -72.4 -52.4 PHI 40 40 A 22 ILE N A 22 ILE CA A 22 ILE C A 23 VAL N 1.0 -56.8 -23.1 PSI 41 41 A 22 ILE C A 23 VAL N A 23 VAL CA A 23 VAL C 1.0 -73.2 -53.2 PHI 42 42 A 23 VAL N A 23 VAL CA A 23 VAL C A 24 THR N 1.0 -52.7 -32.7 PSI 43 43 A 23 VAL C A 24 THR N A 24 THR CA A 24 THR C 1.0 -72.3 -52.3 PHI 44 44 A 24 THR N A 24 THR CA A 24 THR C A 25 TYR N 1.0 -52.2 -32.2 PSI 45 45 A 24 THR C A 25 TYR N A 25 TYR CA A 25 TYR C 1.0 -76.1 -56.1 PHI 46 46 A 25 TYR N A 25 TYR CA A 25 TYR C A 26 CYS N 1.0 -52.2 -32.2 PSI 47 47 A 25 TYR C A 26 CYS N A 26 CYS CA A 26 CYS C 1.0 -74.5 -46.6 PHI 48 48 A 26 CYS N A 26 CYS CA A 26 CYS C A 27 ILE N 1.0 -62.7 -30.3 PSI 49 49 A 26 CYS C A 27 ILE N A 27 ILE CA A 27 ILE C 1.0 -85.2 -46.3 PHI 50 50 A 27 ILE N A 27 ILE CA A 27 ILE C A 28 ASN N 1.0 -66.2 -4.5 PSI 51 51 A 27 ILE C A 28 ASN N A 28 ASN CA A 28 ASN C 1.0 -107.0 -39.0 PHI 52 52 A 28 ASN N A 28 ASN CA A 28 ASN C A 29 ALA N 1.0 -67.0 -3.0 PSI 53 53 A 28 ASN C A 29 ALA N A 29 ALA CA A 29 ALA C 1.0 -107.0 -43.0 PHI 54 54 A 29 ALA N A 29 ALA CA A 29 ALA C A 30 LYS N 1.0 -56.0 -4.0 PSI 55 55 A 29 ALA C A 30 LYS N A 30 LYS CA A 30 LYS C 1.0 -121.0 -49.0 PHI 56 56 A 30 LYS N A 30 LYS CA A 30 LYS C A 31 ALA N 1.0 -58.0 30.0 PSI 57 57 A 30 LYS C A 31 ALA N A 31 ALA CA A 31 ALA C 1.0 -88.0 -44.0 PHI 58 58 A 31 ALA N A 31 ALA CA A 31 ALA C A 32 ASP N 1.0 -53.0 -5.0 PSI 59 59 A 31 ALA C A 32 ASP N A 32 ASP CA A 32 ASP C 1.0 -89.0 -53.0 PHI 60 60 A 32 ASP N A 32 ASP CA A 32 ASP C A 33 VAL N 1.0 -58.0 6.0 PSI 61 61 A 32 ASP C A 33 VAL N A 33 VAL CA A 33 VAL C 1.0 -105.0 -49.0 PHI 62 62 A 33 VAL N A 33 VAL CA A 33 VAL C A 34 LEU N 1.0 -58.0 14.0 PSI 63 63 A 33 VAL C A 34 LEU N A 34 LEU CA A 34 LEU C 1.0 -130.0 -50.0 PHI 64 64 A 34 LEU N A 34 LEU CA A 34 LEU C A 35 PHE N 1.0 -55.0 41.0 PSI 65 65 A 34 LEU C A 35 PHE N A 35 PHE CA A 35 PHE C 1.0 -129.0 -81.0 PHI 66 66 A 35 PHE N A 35 PHE CA A 35 PHE C A 36 ILE N 1.0 -37.0 39.0 PSI 67 67 A 36 ILE C A 37 ALA N A 37 ALA CA A 37 ALA C 1.0 -101.0 -49.0 PHI 68 68 A 37 ALA N A 37 ALA CA A 37 ALA C A 38 PRO N 1.0 130.0 162.0 PSI 69 69 A 38 PRO C A 39 ARG N A 39 ARG CA A 39 ARG C 1.0 -125.0 -61.0 PHI 70 70 A 39 ARG N A 39 ARG CA A 39 ARG C A 40 GLU N 1.0 104.0 160.0 PSI 71 71 A 39 ARG C A 40 GLU N A 40 GLU CA A 40 GLU C 1.0 -114.0 -50.0 PHI 72 72 A 40 GLU N A 40 GLU CA A 40 GLU C A 41 PRO N 1.0 100.0 172.0 PSI 73 73 A 41 PRO C A 42 GLY N A 42 GLY CA A 42 GLY C 1.0 37.0 121.0 PHI 74 74 A 42 GLY N A 42 GLY CA A 42 GLY C A 43 ALA N 1.0 -66.0 78.0 PSI 75 75 A 43 ALA C A 44 VAL N A 44 VAL CA A 44 VAL C 1.0 -242.0 10.0 PHI 76 76 A 44 VAL N A 44 VAL CA A 44 VAL C A 45 SER N 1.0 92.0 168.0 PSI 77 77 A 44 VAL C A 45 SER N A 45 SER CA A 45 SER C 1.0 -163.0 41.0 PHI 78 78 A 45 SER N A 45 SER CA A 45 SER C A 46 TYR N 1.0 90.0 158.0 PSI 79 79 A 5 LEU N A 5 LEU CA A 5 LEU CB A 5 LEU CG 1.0 -76.8 -58.2 CHI1 80 80 A 8 ILE N A 8 ILE CA A 8 ILE CB A 8 ILE CG1 1.0 -72.0 -58.0 CHI1 81 81 A 9 THR N A 9 THR CA A 9 THR CB A 9 THR OG1 1.0 -66.1 -54.1 CHI1 82 82 A 11 THR N A 11 THR CA A 11 THR CB A 11 THR OG1 1.0 -70.4 -54.6 CHI1 83 83 A 12 VAL N A 12 VAL CA A 12 VAL CB A 12 VAL CG1 1.0 169.1 187.1 CHI1 84 84 A 14 PHE N A 14 PHE CA A 14 PHE CB A 14 PHE CG 1.0 172.1 182.1 CHI1 85 85 A 16 ILE N A 16 ILE CA A 16 ILE CB A 16 ILE CG1 1.0 -71.1 -60.7 CHI1 86 86 A 18 ILE N A 18 ILE CA A 18 ILE CB A 18 ILE CG1 1.0 -70.4 -61.2 CHI1 87 87 A 21 LEU N A 21 LEU CA A 21 LEU CB A 21 LEU CG 1.0 170.9 182.5 CHI1 88 88 A 22 ILE N A 22 ILE CA A 22 ILE CB A 22 ILE CG1 1.0 -69.9 -60.5 CHI1 89 89 A 23 VAL N A 23 VAL CA A 23 VAL CB A 23 VAL CG1 1.0 170.2 184.6 CHI1 90 90 A 24 THR N A 24 THR CA A 24 THR CB A 24 THR OG1 1.0 -67.8 -54.0 CHI1 91 91 A 25 TYR N A 25 TYR CA A 25 TYR CB A 25 TYR CG 1.0 169.6 184.0 CHI1 92 92 A 26 CYS N A 26 CYS CA A 26 CYS CB A 26 CYS SG 1.0 -72.5 -59.1 CHI1 93 93 A 27 ILE N A 27 ILE CA A 27 ILE CB A 27 ILE CG1 1.0 -72.8 -61.8 CHI1 94 94 A 28 ASN N A 28 ASN CA A 28 ASN CB A 28 ASN CG 1.0 -81.8 -67.4 CHI1 95 95 A 30 LYS N A 30 LYS CA A 30 LYS CB A 30 LYS CG 1.0 -73.7 -55.5 CHI1 96 96 A 32 ASP N A 32 ASP CA A 32 ASP CB A 32 ASP CG 1.0 -82.0 -65.8 CHI1 97 97 A 34 LEU N A 34 LEU CA A 34 LEU CB A 34 LEU CG 1.0 -73.1 -59.9 CHI1 98 98 A 35 PHE N A 35 PHE CA A 35 PHE CB A 35 PHE CG 1.0 -76.4 -51.4 CHI1 99 99 A 36 ILE N A 36 ILE CA A 36 ILE CB A 36 ILE CG1 1.0 -69.7 -53.5 CHI1 100 100 A 44 VAL N A 44 VAL CA A 44 VAL CB A 44 VAL CG1 1.0 -188.9 -170.3 CHI1 stop_ save_