data_nef_c19673_2mic 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 19741 PDB 2MIC PDB 2MJO stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 14 CYS SG 2 14 CYS SG stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 THR middle . . 3 A 3 ARG middle . . 4 A 4 GLY middle . false 5 A 5 THR middle . . 6 A 6 THR middle . . 7 A 7 ASP middle . . 8 A 8 ASN middle . . 9 A 9 LEU middle . . 10 A 10 ILE middle . . 11 A 11 PRO middle . false 12 A 12 VAL middle . . 13 A 13 TYR middle . . 14 A 14 CYS middle -HG . 15 A 15 SER middle . . 16 A 16 ILE middle . . 17 A 17 LEU middle . . 18 A 18 ALA middle . . 19 A 19 ALA middle . . 20 A 20 VAL middle . . 21 A 21 VAL middle . . 22 A 22 VAL middle . . 23 A 23 GLY middle . false 24 A 24 LEU middle . . 25 A 25 VAL middle . . 26 A 26 ALA middle . . 27 A 27 TYR middle . . 28 A 28 ILE middle . . 29 A 29 ALA middle . . 30 A 30 PHE middle . . 31 A 31 LYS middle . . 32 A 32 ARG middle . . 33 A 33 TRP middle . . 34 A 34 ASN middle . . 35 A 35 SER middle . . 36 A 36 SER middle . . 37 A 37 LYS middle . . 38 A 38 GLN middle . . 39 A 39 ASN middle . . 40 A 40 LYS middle . . 41 A 41 GLN end . . 42 B 101 MET start . . 43 B 102 THR middle . . 44 B 103 ARG middle . . 45 B 104 GLY middle . false 46 B 105 THR middle . . 47 B 106 THR middle . . 48 B 107 ASP middle . . 49 B 108 ASN middle . . 50 B 109 LEU middle . . 51 B 110 ILE middle . . 52 B 111 PRO middle . false 53 B 112 VAL middle . . 54 B 113 TYR middle . . 55 B 114 CYS middle -HG . 56 B 115 SER middle . . 57 B 116 ILE middle . . 58 B 117 LEU middle . . 59 B 118 ALA middle . . 60 B 119 ALA middle . . 61 B 120 VAL middle . . 62 B 121 VAL middle . . 63 B 122 VAL middle . . 64 B 123 GLY middle . false 65 B 124 LEU middle . . 66 B 125 VAL middle . . 67 B 126 ALA middle . . 68 B 127 TYR middle . . 69 B 128 ILE middle . . 70 B 129 ALA middle . . 71 B 130 PHE middle . . 72 B 131 LYS middle . . 73 B 132 ARG middle . . 74 B 133 TRP middle . . 75 B 134 ASN middle . . 76 B 135 SER middle . . 77 B 136 SER middle . . 78 B 137 LYS middle . . 79 B 138 GLN middle . . 80 B 139 ASN middle . . 81 B 140 LYS middle . . 82 B 141 GLN 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 2 THR H H 1 8.213 0.000 A 2 THR HA H 1 4.690 0.000 A 2 THR HB H 1 4.371 0.000 A 2 THR HG2% H 1 1.303 0.000 A 2 THR C C 13 174.181 0.000 A 2 THR CA C 13 61.504 0.000 A 2 THR CB C 13 69.577 0.000 A 2 THR CG2 C 13 21.444 0.000 A 2 THR N N 15 114.282 0.000 A 3 ARG H H 1 8.481 0.000 A 3 ARG HA H 1 4.512 0.000 A 3 ARG HBy H 1 2.031 0.000 A 3 ARG HBx H 1 1.925 0.000 A 3 ARG HDx H 1 3.320 0.000 A 3 ARG HDy H 1 3.320 0.000 A 3 ARG HGx H 1 1.796 0.000 A 3 ARG HGy H 1 1.796 0.000 A 3 ARG C C 13 176.305 0.000 A 3 ARG CA C 13 56.127 0.000 A 3 ARG CB C 13 30.716 0.000 A 3 ARG CD C 13 43.130 0.000 A 3 ARG CG C 13 26.905 0.000 A 3 ARG N N 15 122.743 0.000 A 4 GLY H H 1 8.576 0.000 A 4 GLY HAy H 1 4.696 0.000 A 4 GLY HAx H 1 4.154 0.000 A 4 GLY C C 13 174.092 0.000 A 4 GLY CA C 13 45.169 0.000 A 4 GLY N N 15 109.588 0.000 A 5 THR H H 1 8.155 0.000 A 5 THR HA H 1 4.544 0.000 A 5 THR HB H 1 4.424 0.000 A 5 THR HG2% H 1 1.343 0.000 A 5 THR C C 13 174.864 0.000 A 5 THR CA C 13 61.955 0.000 A 5 THR CB C 13 69.425 0.000 A 5 THR CG2 C 13 21.549 0.000 A 5 THR N N 15 113.251 0.000 A 6 THR H H 1 8.243 0.000 A 6 THR HA H 1 4.454 0.000 A 6 THR HB H 1 4.422 0.000 A 6 THR HG2% H 1 1.335 0.000 A 6 THR C C 13 174.181 0.000 A 6 THR CA C 13 62.062 0.000 A 6 THR CB C 13 69.306 0.000 A 6 THR CG2 C 13 21.547 0.000 A 6 THR N N 15 114.461 0.000 A 7 ASP H H 1 8.325 0.000 A 7 ASP HA H 1 4.678 0.000 A 7 ASP HBx H 1 2.777 0.000 A 7 ASP HBy H 1 2.777 0.000 A 7 ASP C C 13 175.797 0.000 A 7 ASP CA C 13 54.813 0.000 A 7 ASP CB C 13 41.012 0.000 A 7 ASP N N 15 121.828 0.000 A 8 ASN H H 1 8.267 0.000 A 8 ASN HA H 1 4.828 0.000 A 8 ASN HBy H 1 2.973 0.000 A 8 ASN HBx H 1 2.896 0.000 A 8 ASN HD2y H 1 7.702 0.000 A 8 ASN HD2x H 1 6.970 0.000 A 8 ASN C C 13 174.864 0.000 A 8 ASN CA C 13 53.127 0.000 A 8 ASN CB C 13 38.696 0.000 A 8 ASN N N 15 117.808 0.000 A 8 ASN ND2 N 15 112.102 0.000 A 9 LEU H H 1 8.452 0.000 A 9 LEU HA H 1 4.330 0.000 A 9 LEU HBy H 1 1.760 0.000 A 9 LEU HBx H 1 1.462 0.000 A 9 LEU HDx% H 1 1.049 0.000 A 9 LEU HDy% H 1 0.939 0.000 A 9 LEU HG H 1 1.721 0.000 A 9 LEU CA C 13 55.819 0.000 A 9 LEU CB C 13 42.404 0.000 A 9 LEU CDy C 13 25.049 0.000 A 9 LEU CDx C 13 23.314 0.000 A 9 LEU CG C 13 26.815 0.000 A 9 LEU N N 15 121.126 0.000 A 10 ILE H H 1 8.250 0.000 A 10 ILE HA H 1 4.186 0.000 A 10 ILE HB H 1 2.245 0.000 A 10 ILE HD1% H 1 1.052 0.000 A 10 ILE HG1y H 1 1.826 0.000 A 10 ILE HG1x H 1 1.349 0.000 A 10 ILE HG2% H 1 1.063 0.000 A 10 ILE CA C 13 62.841 0.000 A 10 ILE CB C 13 35.767 0.000 A 10 ILE CD1 C 13 12.447 0.000 A 10 ILE CG1 C 13 28.976 0.000 A 10 ILE CG2 C 13 17.556 0.000 A 10 ILE N N 15 119.437 0.000 A 11 PRO HA H 1 4.380 0.000 A 11 PRO HBy H 1 2.490 0.000 A 11 PRO HBx H 1 1.879 0.000 A 11 PRO HDy H 1 3.866 0.000 A 11 PRO HDx H 1 3.684 0.000 A 11 PRO HGy H 1 2.215 0.000 A 11 PRO HGx H 1 2.118 0.000 A 11 PRO CA C 13 64.946 0.000 A 11 PRO CB C 13 31.591 0.000 A 11 PRO CD C 13 49.798 0.000 A 11 PRO CG C 13 28.057 0.000 A 12 VAL H H 1 8.330 0.000 A 12 VAL HA H 1 3.836 0.000 A 12 VAL HB H 1 2.261 0.000 A 12 VAL HGx% H 1 1.145 0.000 A 12 VAL HGy% H 1 0.965 0.000 A 12 VAL CA C 13 65.990 0.000 A 12 VAL CB C 13 31.136 0.000 A 12 VAL CGy C 13 22.291 0.000 A 12 VAL CGx C 13 20.681 0.000 A 12 VAL N N 15 118.037 0.000 A 13 TYR H H 1 8.341 0.000 A 13 TYR HA H 1 4.430 0.000 A 13 TYR HBx H 1 3.164 0.000 A 13 TYR HBy H 1 3.164 0.000 A 13 TYR HDx H 1 7.080 0.000 A 13 TYR HDy H 1 7.080 0.000 A 13 TYR HEx H 1 6.879 0.000 A 13 TYR HEy H 1 6.879 0.000 A 13 TYR CA C 13 59.774 0.000 A 13 TYR CB C 13 37.035 0.000 A 13 TYR CDx C 13 131.480 0.000 A 13 TYR CEx C 13 118.139 0.000 A 13 TYR N N 15 117.971 0.000 A 14 CYS H H 1 8.681 0.000 A 14 CYS HA H 1 4.361 0.000 A 14 CYS HBy H 1 3.320 0.000 A 14 CYS HBx H 1 3.147 0.000 A 14 CYS C C 13 175.298 0.000 A 14 CYS CA C 13 59.085 0.000 A 14 CYS CB C 13 41.529 0.000 A 14 CYS N N 15 115.494 0.000 A 15 SER H H 1 7.923 0.000 A 15 SER HA H 1 4.200 0.000 A 15 SER HBx H 1 3.878 0.000 A 15 SER HBy H 1 3.878 0.000 A 15 SER C C 13 174.951 0.000 A 15 SER CA C 13 62.671 0.000 A 15 SER CB C 13 62.565 0.000 A 15 SER N N 15 116.691 0.000 A 16 ILE H H 1 7.930 0.000 A 16 ILE HA H 1 3.765 0.000 A 16 ILE HB H 1 2.118 0.000 A 16 ILE HD1% H 1 0.964 0.000 A 16 ILE HG1y H 1 2.006 0.000 A 16 ILE HG1x H 1 1.137 0.000 A 16 ILE HG2% H 1 0.996 0.000 A 16 ILE C C 13 176.935 0.000 A 16 ILE CA C 13 65.116 0.000 A 16 ILE CB C 13 37.362 0.000 A 16 ILE CD1 C 13 13.432 0.000 A 16 ILE CG1 C 13 28.925 0.000 A 16 ILE CG2 C 13 17.050 0.000 A 16 ILE N N 15 120.993 0.000 A 17 LEU H H 1 8.037 0.000 A 17 LEU HA H 1 4.062 0.000 A 17 LEU HBy H 1 2.013 0.000 A 17 LEU HBx H 1 1.771 0.000 A 17 LEU HDx% H 1 1.021 0.000 A 17 LEU HDy% H 1 0.990 0.000 A 17 LEU HG H 1 1.954 0.000 A 17 LEU C C 13 177.684 0.000 A 17 LEU CA C 13 57.952 0.000 A 17 LEU CB C 13 41.552 0.000 A 17 LEU CDy C 13 24.469 0.000 A 17 LEU CDx C 13 23.978 0.000 A 17 LEU CG C 13 26.593 0.000 A 17 LEU N N 15 118.319 0.000 A 18 ALA H H 1 8.260 0.000 A 18 ALA HA H 1 4.015 0.000 A 18 ALA HB% H 1 1.572 0.000 A 18 ALA C C 13 177.814 0.000 A 18 ALA CA C 13 55.299 0.000 A 18 ALA CB C 13 17.626 0.000 A 18 ALA N N 15 118.970 0.000 A 19 ALA H H 1 8.027 0.000 A 19 ALA HA H 1 3.994 0.000 A 19 ALA HB% H 1 1.582 0.000 A 19 ALA C C 13 178.578 0.000 A 19 ALA CA C 13 55.299 0.000 A 19 ALA CB C 13 17.662 0.000 A 19 ALA N N 15 118.854 0.000 A 20 VAL H H 1 8.259 0.000 A 20 VAL HA H 1 3.646 0.000 A 20 VAL HB H 1 2.419 0.000 A 20 VAL HGx% H 1 1.135 0.000 A 20 VAL HGy% H 1 0.977 0.000 A 20 VAL C C 13 176.935 0.000 A 20 VAL CA C 13 66.504 0.000 A 20 VAL CB C 13 31.019 0.000 A 20 VAL CGy C 13 22.771 0.000 A 20 VAL CGx C 13 21.005 0.000 A 20 VAL N N 15 116.253 0.000 A 21 VAL H H 1 8.206 0.000 A 21 VAL HA H 1 3.639 0.000 A 21 VAL HB H 1 2.302 0.000 A 21 VAL HGx% H 1 1.128 0.000 A 21 VAL HGy% H 1 0.968 0.000 A 21 VAL C C 13 177.044 0.000 A 21 VAL CA C 13 67.502 0.000 A 21 VAL CB C 13 30.901 0.000 A 21 VAL CGy C 13 23.455 0.000 A 21 VAL CGx C 13 20.937 0.000 A 21 VAL N N 15 118.427 0.000 A 22 VAL H H 1 8.511 0.000 A 22 VAL HA H 1 3.576 0.000 A 22 VAL HB H 1 2.267 0.000 A 22 VAL HGx% H 1 1.132 0.000 A 22 VAL HGy% H 1 0.978 0.000 A 22 VAL C C 13 177.239 0.000 A 22 VAL CA C 13 67.107 0.000 A 22 VAL CB C 13 30.698 0.000 A 22 VAL CGy C 13 23.118 0.000 A 22 VAL CGx C 13 21.093 0.000 A 22 VAL N N 15 118.319 0.000 A 23 GLY H H 1 8.665 0.000 A 23 GLY HAy H 1 3.783 0.000 A 23 GLY HAx H 1 3.686 0.000 A 23 GLY C C 13 174.192 0.000 A 23 GLY CA C 13 47.329 0.000 A 23 GLY N N 15 106.678 0.000 A 24 LEU H H 1 8.604 0.000 A 24 LEU HA H 1 4.287 0.000 A 24 LEU HBy H 1 2.046 0.000 A 24 LEU HBx H 1 1.823 0.000 A 24 LEU HDx% H 1 1.023 0.000 A 24 LEU HDy% H 1 0.968 0.000 A 24 LEU HG H 1 1.986 0.000 A 24 LEU C C 13 178.486 0.000 A 24 LEU CA C 13 58.118 0.000 A 24 LEU CB C 13 41.878 0.000 A 24 LEU CDy C 13 24.876 0.000 A 24 LEU CDx C 13 24.138 0.000 A 24 LEU CG C 13 26.682 0.000 A 24 LEU N N 15 121.389 0.000 A 25 VAL H H 1 8.514 0.000 A 25 VAL HA H 1 3.652 0.000 A 25 VAL HB H 1 2.355 0.000 A 25 VAL HGx% H 1 1.171 0.000 A 25 VAL HGy% H 1 1.019 0.000 A 25 VAL C C 13 177.109 0.000 A 25 VAL CA C 13 66.991 0.000 A 25 VAL CB C 13 30.792 0.000 A 25 VAL CGy C 13 22.992 0.000 A 25 VAL CGx C 13 21.360 0.000 A 25 VAL N N 15 118.366 0.000 A 26 ALA H H 1 8.864 0.000 A 26 ALA HA H 1 4.083 0.000 A 26 ALA HB% H 1 1.627 0.000 A 26 ALA C C 13 178.345 0.000 A 26 ALA CA C 13 55.254 0.000 A 26 ALA CB C 13 17.728 0.000 A 26 ALA N N 15 121.150 0.000 A 27 TYR H H 1 8.686 0.000 A 27 TYR HA H 1 4.290 0.000 A 27 TYR HBy H 1 3.467 0.000 A 27 TYR HBx H 1 3.305 0.000 A 27 TYR HDx H 1 7.095 0.000 A 27 TYR HDy H 1 7.095 0.000 A 27 TYR HEx H 1 6.915 0.000 A 27 TYR HEy H 1 6.915 0.000 A 27 TYR C C 13 176.867 0.000 A 27 TYR CA C 13 61.979 0.000 A 27 TYR CB C 13 38.526 0.000 A 27 TYR CDy C 13 132.456 0.000 A 27 TYR CEy C 13 117.677 0.000 A 27 TYR N N 15 118.180 0.000 A 28 ILE H H 1 8.537 0.000 A 28 ILE HA H 1 3.595 0.000 A 28 ILE HB H 1 2.158 0.000 A 28 ILE HD1% H 1 1.037 0.000 A 28 ILE HG1y H 1 2.141 0.000 A 28 ILE HG1x H 1 1.410 0.000 A 28 ILE HG2% H 1 1.033 0.000 A 28 ILE C C 13 177.922 0.000 A 28 ILE CA C 13 64.740 0.000 A 28 ILE CB C 13 37.375 0.000 A 28 ILE CD1 C 13 13.016 0.000 A 28 ILE CG1 C 13 28.936 0.000 A 28 ILE CG2 C 13 17.352 0.000 A 28 ILE N N 15 118.426 0.000 A 29 ALA H H 1 8.920 0.000 A 29 ALA HA H 1 4.013 0.000 A 29 ALA HB% H 1 1.486 0.000 A 29 ALA C C 13 178.779 0.000 A 29 ALA CA C 13 55.299 0.000 A 29 ALA CB C 13 17.974 0.000 A 29 ALA N N 15 121.944 0.000 A 30 PHE H H 1 8.868 0.000 A 30 PHE HA H 1 4.347 0.000 A 30 PHE HBy H 1 3.384 0.000 A 30 PHE HBx H 1 3.325 0.000 A 30 PHE HDx H 1 7.318 0.000 A 30 PHE HDy H 1 7.318 0.000 A 30 PHE HEx H 1 7.494 0.000 A 30 PHE HEy H 1 7.494 0.000 A 30 PHE HZ H 1 7.434 0.000 A 30 PHE C C 13 177.543 0.000 A 30 PHE CA C 13 61.206 0.000 A 30 PHE CB C 13 39.066 0.000 A 30 PHE CDy C 13 131.700 0.000 A 30 PHE CEy C 13 131.052 0.000 A 30 PHE CZ C 13 130.922 0.000 A 30 PHE N N 15 117.662 0.000 A 31 LYS H H 1 8.437 0.000 A 31 LYS HA H 1 3.994 0.000 A 31 LYS HBy H 1 1.897 0.000 A 31 LYS HBx H 1 1.799 0.000 A 31 LYS HDx H 1 1.679 0.000 A 31 LYS HDy H 1 1.679 0.000 A 31 LYS HEy H 1 3.087 0.000 A 31 LYS HEx H 1 2.964 0.000 A 31 LYS HGy H 1 1.374 0.000 A 31 LYS HGx H 1 1.296 0.000 A 31 LYS C C 13 179.148 0.000 A 31 LYS CA C 13 57.831 0.000 A 31 LYS CB C 13 31.119 0.000 A 31 LYS CD C 13 27.790 0.000 A 31 LYS CE C 13 41.553 0.000 A 31 LYS CG C 13 23.962 0.000 A 31 LYS N N 15 118.519 0.000 A 32 ARG H H 1 8.311 0.000 A 32 ARG HA H 1 4.265 0.000 A 32 ARG HBx H 1 1.996 0.000 A 32 ARG HBy H 1 1.996 0.000 A 32 ARG HDy H 1 3.252 0.000 A 32 ARG HDx H 1 3.137 0.000 A 32 ARG HE H 1 7.759 0.000 A 32 ARG HGx H 1 1.737 0.000 A 32 ARG HGy H 1 1.737 0.000 A 32 ARG C C 13 178.041 0.000 A 32 ARG CA C 13 57.623 0.000 A 32 ARG CB C 13 29.828 0.000 A 32 ARG CD C 13 42.611 0.000 A 32 ARG CG C 13 27.234 0.000 A 32 ARG N N 15 118.783 0.000 A 32 ARG NE N 15 120.295 0.000 A 33 TRP H H 1 8.579 0.000 A 33 TRP HA H 1 4.515 0.000 A 33 TRP HBx H 1 3.418 0.000 A 33 TRP HBy H 1 3.418 0.000 A 33 TRP HD1 H 1 7.312 0.000 A 33 TRP HE3 H 1 7.572 0.000 A 33 TRP HH2 H 1 7.256 0.000 A 33 TRP HZ2 H 1 7.624 0.000 A 33 TRP HZ3 H 1 7.114 0.000 A 33 TRP C C 13 176.935 0.000 A 33 TRP CA C 13 59.427 0.000 A 33 TRP CB C 13 28.903 0.000 A 33 TRP CD1 C 13 126.271 0.000 A 33 TRP CE3 C 13 120.530 0.000 A 33 TRP CH2 C 13 123.834 0.000 A 33 TRP CZ2 C 13 114.325 0.000 A 33 TRP CZ3 C 13 121.129 0.000 A 33 TRP N N 15 121.389 0.000 A 34 ASN H H 1 8.313 0.000 A 34 ASN HA H 1 4.518 0.000 A 34 ASN HBy H 1 2.723 0.000 A 34 ASN HBx H 1 2.532 0.000 A 34 ASN HD2y H 1 7.302 0.000 A 34 ASN HD2x H 1 6.670 0.000 A 34 ASN C C 13 175.770 0.000 A 34 ASN CA C 13 54.119 0.000 A 34 ASN CB C 13 38.987 0.000 A 34 ASN N N 15 117.319 0.000 A 34 ASN ND2 N 15 112.261 0.000 A 35 SER H H 1 7.952 0.000 A 35 SER HA H 1 4.481 0.000 A 35 SER HBx H 1 4.048 0.000 A 35 SER HBy H 1 4.048 0.000 A 35 SER C C 13 174.852 0.000 A 35 SER CA C 13 59.319 0.000 A 35 SER CB C 13 63.433 0.000 A 35 SER N N 15 114.896 0.000 A 36 SER H H 1 8.094 0.000 A 36 SER HA H 1 4.518 0.000 A 36 SER HBx H 1 4.021 0.000 A 36 SER HBy H 1 4.021 0.000 A 36 SER C C 13 174.485 0.000 A 36 SER CA C 13 58.833 0.000 A 36 SER CB C 13 63.445 0.000 A 36 SER N N 15 117.172 0.000 A 37 LYS H H 1 8.011 0.000 A 37 LYS HA H 1 4.374 0.000 A 37 LYS HBy H 1 1.891 0.000 A 37 LYS HBx H 1 1.796 0.000 A 37 LYS HDx H 1 1.698 0.000 A 37 LYS HDy H 1 1.698 0.000 A 37 LYS HEx H 1 2.991 0.000 A 37 LYS HEy H 1 2.991 0.000 A 37 LYS HGx H 1 1.428 0.000 A 37 LYS HGy H 1 1.428 0.000 A 37 LYS C C 13 176.339 0.000 A 37 LYS CA C 13 56.197 0.000 A 37 LYS CB C 13 32.357 0.000 A 37 LYS CD C 13 28.606 0.000 A 37 LYS CE C 13 41.853 0.000 A 37 LYS CG C 13 24.218 0.000 A 37 LYS N N 15 122.146 0.000 A 38 GLN H H 1 8.177 0.000 A 38 GLN HA H 1 4.418 0.000 A 38 GLN HBy H 1 2.206 0.000 A 38 GLN HBx H 1 2.073 0.000 A 38 GLN HGx H 1 2.459 0.000 A 38 GLN HGy H 1 2.459 0.000 A 38 GLN C C 13 175.424 0.000 A 38 GLN CA C 13 55.646 0.000 A 38 GLN CB C 13 29.129 0.000 A 38 GLN CG C 13 33.505 0.000 A 38 GLN N N 15 120.055 0.000 A 39 ASN H H 1 8.379 0.000 A 39 ASN HA H 1 4.808 0.000 A 39 ASN HBx H 1 2.864 0.000 A 39 ASN HBy H 1 2.864 0.000 A 39 ASN C C 13 174.550 0.000 A 39 ASN CA C 13 53.040 0.000 A 39 ASN N N 15 119.734 0.000 A 40 LYS H H 1 8.220 0.000 A 40 LYS HA H 1 4.450 0.000 A 40 LYS HBy H 1 1.974 0.000 A 40 LYS HBx H 1 1.861 0.000 A 40 LYS HDx H 1 1.796 0.000 A 40 LYS HDy H 1 1.796 0.000 A 40 LYS HEx H 1 3.114 0.000 A 40 LYS HEy H 1 3.114 0.000 A 40 LYS HGx H 1 1.534 0.000 A 40 LYS HGy H 1 1.534 0.000 A 40 LYS CA C 13 56.131 0.000 A 40 LYS CB C 13 32.775 0.000 A 40 LYS CD C 13 28.690 0.000 A 40 LYS CE C 13 41.932 0.000 A 40 LYS CG C 13 24.242 0.000 A 40 LYS N N 15 121.900 0.000 A 41 GLN H H 1 8.004 0.000 A 41 GLN HA H 1 4.287 0.000 A 41 GLN HBy H 1 2.205 0.000 A 41 GLN HBx H 1 2.036 0.000 A 41 GLN HGx H 1 2.404 0.000 A 41 GLN HGy H 1 2.404 0.000 A 41 GLN CA C 13 57.168 0.000 A 41 GLN CB C 13 30.260 0.000 A 41 GLN CG C 13 34.111 0.000 A 41 GLN N N 15 126.738 0.000 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 20 VAL HB A 21 VAL H 1.0 . 3.46 2 2 A 21 VAL H A 22 VAL H 1.0 . 3.33 3 3 A 21 VAL H A 18 ALA HA 1.0 . 3.66 4 4 A 9 LEU H A 10 ILE H 1.0 . 3.39 5 5 A 24 LEU H A 25 VAL H 1.0 . 3.09 6 6 A 15 SER H A 14 CYS HBy 1.0 . 3.99 7 7 A 15 SER H A 14 CYS HBx 1.0 . 3.99 8 8 A 26 ALA HA A 30 PHE H 1.0 . 4.44 9 9 A 30 PHE H A 29 ALA HB% 1.0 . 3.29 10 10 A 28 ILE H A 27 TYR HBx 1.0 . 4.00 11 11 A 28 ILE H A 27 TYR HD% 1.0 . 4.03 12 12 A 28 ILE H A 27 TYR HBy 1.0 . 4.00 13 13 A 28 ILE H A 27 TYR H 1.0 . 3.33 14 14 A 6 THR HG2% A 7 ASP H 1.0 . 4.70 15 15 A 14 CYS HA A 17 LEU H 1.0 . 3.89 16 16 A 17 LEU H A 16 ILE HB 1.0 . 3.24 17 17 A 17 LEU H A 16 ILE H 1.0 . 3.20 18 18 A 31 LYS H A 32 ARG H 1.0 . 3.40 19 19 A 32 ARG H A 33 TRP H 1.0 . 3.51 20 20 A 17 LEU HA A 20 VAL H 1.0 . 3.98 21 21 A 20 VAL H A 19 ALA HB% 1.0 . 3.14 22 22 A 36 SER H A 35 SER HBx 1.0 . 3.53 23 22 A 35 SER HBy A 36 SER H 1.0 . 3.53 24 23 A 36 SER H A 35 SER H 1.0 . 3.82 25 24 A 28 ILE H A 29 ALA H 1.0 . 3.48 26 25 A 29 ALA H A 28 ILE HG2% 1.0 . 3.98 27 26 A 29 ALA H A 28 ILE HD1% 1.0 . 3.98 28 27 A 29 ALA H A 28 ILE HB 1.0 . 3.47 29 28 A 34 ASN H A 33 TRP HBx 1.0 . 3.67 30 28 A 33 TRP HBy A 34 ASN H 1.0 . 3.67 31 29 A 34 ASN H A 36 SER HBx 1.0 . 4.37 32 29 A 34 ASN H A 36 SER HBy 1.0 . 4.37 33 30 A 34 ASN H A 33 TRP HA 1.0 . 3.41 34 31 A 16 ILE HA A 19 ALA H 1.0 . 4.12 35 32 A 20 VAL H A 19 ALA H 1.0 . 3.41 36 33 A 19 ALA H A 18 ALA HB% 1.0 . 2.77 37 34 A 19 ALA H A 18 ALA H 1.0 . 3.49 38 35 A 18 ALA HA A 19 ALA H 1.0 . 3.80 39 36 A 19 ALA HA A 23 GLY H 1.0 . 4.05 40 37 A 23 GLY H A 22 VAL HGy% 1.0 . 3.56 41 38 A 23 GLY H A 22 VAL HB 1.0 . 3.33 42 39 A 30 PHE H A 31 LYS H 1.0 . 3.42 43 40 A 18 ALA H A 17 LEU HBy 1.0 . 3.66 44 41 A 17 LEU H A 18 ALA H 1.0 . 3.20 45 42 A 18 ALA H A 17 LEU HBx 1.0 . 3.66 46 43 A 24 LEU HA A 26 ALA H 1.0 . 4.46 47 44 A 26 ALA H A 25 VAL HGx% 1.0 . 3.84 48 45 A 26 ALA H A 25 VAL HB 1.0 . 3.52 49 46 A 25 VAL H A 26 ALA H 1.0 . 3.35 50 47 A 26 ALA H A 25 VAL HGy% 1.0 . 3.68 51 48 A 9 LEU H A 8 ASN H 1.0 . 3.45 52 49 A 16 ILE H A 12 VAL HA 1.0 . 3.70 53 50 A 16 ILE H A 13 TYR HA 1.0 . 3.62 54 51 A 35 SER H A 34 ASN HBx 1.0 . 4.62 55 52 A 35 SER H A 34 ASN HBy 1.0 . 4.62 56 53 A 35 SER H A 34 ASN H 1.0 . 3.95 57 54 A 35 SER H A 32 ARG HA 1.0 . 4.83 58 55 A 33 TRP H A 34 ASN H 1.0 . 2.40 59 56 A 2 THR HG2% A 3 ARG H 1.0 . 4.51 60 57 A 3 ARG H A 2 THR H 1.0 . 4.53 61 58 A 3 ARG H A 2 THR HB 1.0 . 4.01 62 59 A 27 TYR H A 26 ALA HB% 1.0 . 3.20 63 60 A 27 TYR H A 26 ALA H 1.0 . 3.35 64 61 A 10 ILE H A 9 LEU HDy% 1.0 . 4.14 65 61 A 10 ILE H A 9 LEU HDx% 1.0 . 4.14 66 62 A 15 SER H A 14 CYS HBx 1.0 . 3.47 67 62 A 15 SER H A 14 CYS HBy 1.0 . 3.47 68 63 A 18 ALA H A 17 LEU HDy% 1.0 . 3.46 69 63 A 18 ALA H A 17 LEU HDx% 1.0 . 3.46 70 64 A 23 GLY H A 22 VAL HGy% 1.0 . 3.12 71 64 A 23 GLY H A 22 VAL HGx% 1.0 . 3.12 72 65 A 27 TYR H A 23 GLY HAy 1.0 . 3.99 73 65 A 27 TYR H A 23 GLY HAx 1.0 . 3.99 74 66 A 28 ILE H A 27 TYR HBx 1.0 . 3.42 75 66 A 28 ILE H A 27 TYR HBy 1.0 . 3.42 76 67 A 31 LYS H A 30 PHE HBx 1.0 . 3.47 77 67 A 31 LYS H A 30 PHE HBy 1.0 . 3.47 78 68 A 32 ARG H A 31 LYS HBx 1.0 . 3.42 79 68 A 32 ARG H A 31 LYS HBy 1.0 . 3.42 80 69 A 35 SER H A 34 ASN HBx 1.0 . 3.99 81 69 A 35 SER H A 34 ASN HBy 1.0 . 3.99 82 70 A 23 GLY HAx A 22 VAL HGy% 1.0 . 4.33 83 71 A 23 GLY HAx A 22 VAL HGy% 1.0 . 4.43 84 72 A 31 LYS H A 30 PHE HBy 1.0 . 3.91 85 73 A 17 LEU HA A 20 VAL HGx% 1.0 . 2.99 86 74 A 19 ALA HB% A 20 VAL HGx% 1.0 . 2.82 87 75 A 29 ALA H A 28 ILE HA 1.0 . 5.50 88 76 A 25 VAL HB A 22 VAL HA 1.0 . 3.39 89 77 A 9 LEU H A 8 ASN HBy 1.0 . 4.18 90 78 A 8 ASN HBy A 8 ASN HD2y 1.0 . 3.82 91 79 A 28 ILE H A 27 TYR HA 1.0 . 4.22 92 80 A 26 ALA HB% A 27 TYR HA 1.0 . 4.11 93 81 A 15 SER H A 14 CYS HA 1.0 . 4.52 94 82 A 14 CYS HA A 17 LEU HBy 1.0 . 4.02 95 83 A 14 CYS HA A 17 LEU H 1.0 . 4.48 96 84 A 14 CYS HA A 17 LEU HBx 1.0 . 4.25 97 85 A 14 CYS HA A 17 LEU HDy% 1.0 . 3.79 98 86 A 37 LYS HBy A 38 GLN H 1.0 . 5.00 99 87 A 9 LEU H A 8 ASN HA 1.0 . 3.47 100 88 A 26 ALA HB% A 23 GLY HAx 1.0 . 3.77 101 89 A 35 SER H A 34 ASN HBx 1.0 . 4.48 102 90 A 30 PHE HA A 33 TRP HBx 1.0 . 3.63 103 90 A 33 TRP HBy A 30 PHE HA 1.0 . 3.63 104 91 A 34 ASN H A 33 TRP HBx 1.0 . 3.73 105 91 A 33 TRP HBy A 34 ASN H 1.0 . 3.73 106 92 A 24 LEU HA A 27 TYR HBx 1.0 . 3.70 107 93 A 27 TYR HD% A 24 LEU HA 1.0 . 4.37 108 94 A 24 LEU HA A 27 TYR HBy 1.0 . 3.68 109 95 A 25 VAL H A 24 LEU HA 1.0 . 3.81 110 96 A 24 LEU HA A 26 ALA H 1.0 . 4.73 111 97 A 40 LYS HA A 41 GLN H 1.0 . 4.50 112 98 A 12 VAL HGy% A 13 TYR HBx 1.0 . 4.22 113 98 A 12 VAL HGy% A 13 TYR HBy 1.0 . 4.22 114 99 A 16 ILE H A 12 VAL HA 1.0 . 4.25 115 100 A 32 ARG H A 31 LYS HBx 1.0 . 4.00 116 101 A 12 VAL HGy% A 13 TYR HBx 1.0 . 3.91 117 101 A 12 VAL HGy% A 13 TYR HBy 1.0 . 3.91 118 102 A 13 TYR HA A 12 VAL HGy% 1.0 . 3.42 119 103 A 12 VAL HGy% A 13 TYR HD% 1.0 . 3.55 120 104 A 30 PHE HA A 33 TRP HBx 1.0 . 3.15 121 104 A 33 TRP HBy A 30 PHE HA 1.0 . 3.15 122 105 A 31 LYS H A 30 PHE HA 1.0 . 4.19 123 106 A 14 CYS HA A 17 LEU HBy 1.0 . 4.03 124 107 A 18 ALA H A 17 LEU HBy 1.0 . 4.33 125 108 A 17 LEU HA A 16 ILE HG2% 1.0 . 3.47 126 109 A 3 ARG H A 2 THR HA 1.0 . 4.79 127 110 A 18 ALA HA A 21 VAL HGx% 1.0 . 2.98 128 111 A 16 ILE HA A 19 ALA H 1.0 . 3.87 129 112 A 19 ALA HB% A 16 ILE HA 1.0 . 3.41 130 113 A 4 GLY HAx A 10 ILE HD1% 1.0 . 4.70 131 114 A 4 GLY HAx A 5 THR H 1.0 . 3.35 132 115 A 19 ALA HA A 23 GLY H 1.0 . 3.86 133 116 A 19 ALA HA A 22 VAL HB 1.0 . 3.41 134 117 A 38 GLN HA A 39 ASN H 1.0 . 4.49 135 118 A 2 THR HG2% A 3 ARG H 1.0 . 4.24 136 119 A 20 VAL HB A 21 VAL H 1.0 . 3.42 137 120 A 20 VAL HB A 17 LEU HA 1.0 . 3.65 138 121 A 29 ALA H A 28 ILE HG2% 1.0 . 3.47 139 122 A 6 THR HG2% A 7 ASP H 1.0 . 3.20 140 123 A 24 LEU HA A 27 TYR HBx 1.0 . 3.19 141 124 A 28 ILE H A 27 TYR HBx 1.0 . 3.96 142 125 A 9 LEU H A 8 ASN HBx 1.0 . 4.17 143 126 A 8 ASN HD2y A 8 ASN HBx 1.0 . 3.87 144 127 A 26 ALA HB% A 23 GLY HAy 1.0 . 3.44 145 128 A 26 ALA HB% A 23 GLY HAy 1.0 . 3.26 146 129 A 27 TYR H A 26 ALA HB% 1.0 . 2.90 147 130 A 25 VAL H A 24 LEU HBy 1.0 . 3.61 148 131 A 8 ASN H A 7 ASP HA 1.0 . 5.37 149 132 A 26 ALA HB% A 23 GLY HAy 1.0 . 3.80 150 133 A 37 LYS H A 36 SER HBx 1.0 . 3.95 151 133 A 36 SER HBy A 37 LYS H 1.0 . 3.95 152 134 A 34 ASN H A 36 SER HBx 1.0 . 4.79 153 134 A 34 ASN H A 36 SER HBy 1.0 . 4.79 154 135 A 35 SER H A 34 ASN HBy 1.0 . 4.55 155 136 A 21 VAL HA A 24 LEU HDx% 1.0 . 3.01 156 137 A 36 SER H A 35 SER HA 1.0 . 4.57 157 138 A 6 THR HA A 9 LEU HBy 1.0 . 4.72 158 139 A 34 ASN H A 33 TRP HA 1.0 . 4.04 159 140 A 26 ALA HA A 30 PHE H 1.0 . 3.25 160 141 A 26 ALA HA A 27 TYR H 1.0 . 3.92 161 142 A 10 ILE H A 9 LEU HDy% 1.0 . 3.98 162 143 A 13 TYR HA A 12 VAL HGy% 1.0 . 3.83 163 144 A 16 ILE HB A 13 TYR HA 1.0 . 3.96 164 145 A 16 ILE H A 13 TYR HA 1.0 . 3.95 165 146 A 13 TYR HA A 16 ILE HD1% 1.0 . 3.78 166 147 A 35 SER H A 32 ARG HA 1.0 . 4.86 167 148 A 33 TRP H A 32 ARG HA 1.0 . 3.75 168 149 A 3 ARG HBx A 4 GLY H 1.0 . 4.46 169 150 A 13 TYR HD% A 12 VAL HGx% 1.0 . 4.22 170 151 A 17 LEU H A 16 ILE HB 1.0 . 3.92 171 152 A 16 ILE HB A 13 TYR HA 1.0 . 4.09 172 153 A 18 ALA HA A 21 VAL HB 1.0 . 3.72 173 154 A 25 VAL HB A 22 VAL HA 1.0 . 3.49 174 155 A 26 ALA H A 25 VAL HB 1.0 . 3.80 175 156 A 5 THR HA A 6 THR H 1.0 . 3.71 176 157 A 14 CYS HA A 17 LEU HBx 1.0 . 4.12 177 158 A 18 ALA H A 17 LEU HBx 1.0 . 4.20 178 159 A 4 GLY H A 3 ARG HA 1.0 . 3.79 179 160 A 21 VAL HA A 24 LEU HDx% 1.0 . 2.97 180 161 A 19 ALA H A 18 ALA HB% 1.0 . 2.68 181 162 A 18 ALA HB% A 15 SER HA 1.0 . 3.07 182 163 A 26 ALA H A 25 VAL HA 1.0 . 3.98 183 164 A 28 ILE HB A 25 VAL HA 1.0 . 3.39 184 165 A 17 LEU HA A 20 VAL HGx% 1.0 . 3.39 185 166 A 17 LEU HA A 16 ILE HG2% 1.0 . 3.50 186 167 A 20 VAL HB A 17 LEU HA 1.0 . 4.30 187 168 A 17 LEU HA A 20 VAL H 1.0 . 3.70 188 169 A 19 ALA HB% A 20 VAL HGx% 1.0 . 2.77 189 170 A 19 ALA HB% A 16 ILE HA 1.0 . 2.94 190 171 A 20 VAL H A 19 ALA HB% 1.0 . 2.72 191 172 A 30 PHE H A 29 ALA HA 1.0 . 3.49 192 173 A 29 ALA H A 28 ILE HD1% 1.0 . 4.20 193 174 A 27 TYR HD% A 28 ILE HD1% 1.0 . 3.55 194 175 A 7 ASP H A 6 THR HA 1.0 . 3.30 195 176 A 6 THR HA A 9 LEU HBy 1.0 . 4.17 196 177 A 9 LEU HDx% A 6 THR HA 1.0 . 4.07 197 178 A 24 LEU HA A 27 TYR HBy 1.0 . 3.51 198 179 A 28 ILE H A 27 TYR HBy 1.0 . 4.14 199 180 A 38 GLN H A 37 LYS HBx 1.0 . 5.50 200 181 A 8 ASN H A 7 ASP HBx 1.0 . 3.74 201 181 A 8 ASN H A 7 ASP HBy 1.0 . 3.74 202 182 A 30 PHE H A 29 ALA HB% 1.0 . 2.77 203 183 A 29 ALA HB% A 25 VAL HGy% 1.0 . 3.10 204 184 A 38 GLN H A 37 LYS HA 1.0 . 4.05 205 185 A 4 GLY HAx A 10 ILE HD1% 1.0 . 3.39 206 186 A 25 VAL H A 24 LEU HBx 1.0 . 3.67 207 187 A 10 ILE H A 9 LEU HA 1.0 . 3.82 208 188 A 9 LEU HA A 12 VAL HB 1.0 . 3.76 209 189 A 37 LYS H A 36 SER HA 1.0 . 4.22 210 190 A 35 SER H A 34 ASN HA 1.0 . 4.53 211 191 A 27 TYR HD% A 24 LEU HDy% 1.0 . 4.13 212 192 A 36 SER H A 35 SER HBx 1.0 . 4.39 213 192 A 35 SER HBy A 36 SER H 1.0 . 4.39 214 193 A 9 LEU HDx% A 6 THR HA 1.0 . 3.42 215 194 A 9 LEU HA A 12 VAL HB 1.0 . 3.86 216 195 A 4 GLY H A 3 ARG HBy 1.0 . 4.48 217 196 A 32 ARG H A 31 LYS HA 1.0 . 3.99 218 197 A 39 ASN HA A 40 LYS H 1.0 . 4.31 219 198 A 3 ARG H A 2 THR HB 1.0 . 4.44 220 199 A 18 ALA HB% A 15 SER HA 1.0 . 3.77 221 200 A 16 ILE H A 15 SER HA 1.0 . 3.82 222 201 A 29 ALA HB% A 25 VAL HGy% 1.0 . 2.96 223 202 A 14 CYS HA A 17 LEU HDy% 1.0 . 2.99 224 203 A 18 ALA H A 17 LEU HDy% 1.0 . 3.46 225 204 A 13 TYR HA A 16 ILE HD1% 1.0 . 3.22 226 205 A 13 TYR HD% A 16 ILE HD1% 1.0 . 3.65 227 206 A 5 THR H A 4 GLY HAy 1.0 . 5.50 228 207 A 21 VAL H A 18 ALA HA 1.0 . 3.80 229 208 A 18 ALA HA A 21 VAL HGx% 1.0 . 3.16 230 209 A 18 ALA HA A 19 ALA H 1.0 . 3.56 231 210 A 18 ALA HA A 21 VAL HB 1.0 . 3.65 232 211 A 29 ALA H A 28 ILE HB 1.0 . 3.93 233 212 A 28 ILE HB A 25 VAL HA 1.0 . 3.51 234 213 A 27 TYR H A 28 ILE HB 1.0 . 5.15 235 214 A 19 ALA HA A 22 VAL HB 1.0 . 3.60 236 215 A 23 GLY H A 22 VAL HB 1.0 . 3.57 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 undefined _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 14 CYS SG B 114 CYS SG 1.0 . 2.0 2 2 A 14 CYS SG B 114 CYS CB 1.0 . 3.0 3 3 B 114 CYS SG A 14 CYS CB 1.0 . 3.0 4 4 A 14 CYS SG B 114 CYS SG 1.0 . 2.1 5 5 A 14 CYS SG B 114 CYS CB 1.0 . 3.1 6 6 B 114 CYS SG A 14 CYS CB 1.0 . 3.1 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 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 16 ILE H A 12 VAL O 1.0 . 1.7 2 2 A 16 ILE H A 12 VAL C 1.0 . 2.6 3 3 A 12 VAL O A 16 ILE N 1.0 . 2.6 4 4 A 17 LEU H A 13 TYR O 1.0 . 1.7 5 5 A 17 LEU H A 13 TYR C 1.0 . 2.6 6 6 A 13 TYR O A 17 LEU N 1.0 . 2.6 7 7 A 18 ALA H A 14 CYS O 1.0 . 1.7 8 8 A 18 ALA H A 14 CYS C 1.0 . 2.6 9 9 A 14 CYS O A 18 ALA N 1.0 . 2.6 10 10 A 19 ALA H A 15 SER O 1.0 . 1.7 11 11 A 19 ALA H A 15 SER C 1.0 . 2.6 12 12 A 15 SER O A 19 ALA N 1.0 . 2.6 13 13 A 20 VAL H A 16 ILE O 1.0 . 1.7 14 14 A 20 VAL H A 16 ILE C 1.0 . 2.6 15 15 A 16 ILE O A 20 VAL N 1.0 . 2.6 16 16 A 21 VAL H A 17 LEU O 1.0 . 1.7 17 17 A 21 VAL H A 17 LEU C 1.0 . 2.6 18 18 A 17 LEU O A 21 VAL N 1.0 . 2.6 19 19 A 22 VAL H A 18 ALA O 1.0 . 1.7 20 20 A 22 VAL H A 18 ALA C 1.0 . 2.6 21 21 A 18 ALA O A 22 VAL N 1.0 . 2.6 22 22 A 23 GLY H A 19 ALA O 1.0 . 1.7 23 23 A 23 GLY H A 19 ALA C 1.0 . 2.6 24 24 A 19 ALA O A 23 GLY N 1.0 . 2.6 25 25 A 24 LEU H A 20 VAL O 1.0 . 1.7 26 26 A 24 LEU H A 20 VAL C 1.0 . 2.6 27 27 A 20 VAL O A 24 LEU N 1.0 . 2.6 28 28 A 25 VAL H A 21 VAL O 1.0 . 1.7 29 29 A 25 VAL H A 21 VAL C 1.0 . 2.6 30 30 A 21 VAL O A 25 VAL N 1.0 . 2.6 31 31 A 26 ALA H A 22 VAL O 1.0 . 1.7 32 32 A 26 ALA H A 22 VAL C 1.0 . 2.6 33 33 A 22 VAL O A 26 ALA N 1.0 . 2.6 34 34 A 27 TYR H A 23 GLY O 1.0 . 1.7 35 35 A 27 TYR H A 23 GLY C 1.0 . 2.6 36 36 A 23 GLY O A 27 TYR N 1.0 . 2.6 37 37 A 28 ILE H A 24 LEU O 1.0 . 1.7 38 38 A 28 ILE H A 24 LEU C 1.0 . 2.6 39 39 A 24 LEU O A 28 ILE N 1.0 . 2.6 40 40 A 29 ALA H A 25 VAL O 1.0 . 1.7 41 41 A 29 ALA H A 25 VAL C 1.0 . 2.6 42 42 A 25 VAL O A 29 ALA N 1.0 . 2.6 43 43 A 16 ILE H A 12 VAL O 1.0 . 2.2 44 44 A 16 ILE H A 12 VAL C 1.0 . 3.3 45 45 A 12 VAL O A 16 ILE N 1.0 . 3.3 46 46 A 17 LEU H A 13 TYR O 1.0 . 2.2 47 47 A 17 LEU H A 13 TYR C 1.0 . 3.3 48 48 A 13 TYR O A 17 LEU N 1.0 . 3.3 49 49 A 18 ALA H A 14 CYS O 1.0 . 2.2 50 50 A 18 ALA H A 14 CYS C 1.0 . 3.3 51 51 A 14 CYS O A 18 ALA N 1.0 . 3.3 52 52 A 19 ALA H A 15 SER O 1.0 . 2.2 53 53 A 19 ALA H A 15 SER C 1.0 . 3.3 54 54 A 15 SER O A 19 ALA N 1.0 . 3.3 55 55 A 20 VAL H A 16 ILE O 1.0 . 2.2 56 56 A 20 VAL H A 16 ILE C 1.0 . 3.3 57 57 A 16 ILE O A 20 VAL N 1.0 . 3.3 58 58 A 21 VAL H A 17 LEU O 1.0 . 2.2 59 59 A 21 VAL H A 17 LEU C 1.0 . 3.3 60 60 A 17 LEU O A 21 VAL N 1.0 . 3.3 61 61 A 22 VAL H A 18 ALA O 1.0 . 2.2 62 62 A 22 VAL H A 18 ALA C 1.0 . 3.3 63 63 A 18 ALA O A 22 VAL N 1.0 . 3.3 64 64 A 23 GLY H A 19 ALA O 1.0 . 2.2 65 65 A 23 GLY H A 19 ALA C 1.0 . 3.3 66 66 A 19 ALA O A 23 GLY N 1.0 . 3.3 67 67 A 24 LEU H A 20 VAL O 1.0 . 2.2 68 68 A 24 LEU H A 20 VAL C 1.0 . 3.3 69 69 A 20 VAL O A 24 LEU N 1.0 . 3.3 70 70 A 25 VAL H A 21 VAL O 1.0 . 2.2 71 71 A 25 VAL H A 21 VAL C 1.0 . 3.3 72 72 A 21 VAL O A 25 VAL N 1.0 . 3.3 73 73 A 26 ALA H A 22 VAL O 1.0 . 2.2 74 74 A 26 ALA H A 22 VAL C 1.0 . 3.3 75 75 A 22 VAL O A 26 ALA N 1.0 . 3.3 76 76 A 27 TYR H A 23 GLY O 1.0 . 2.2 77 77 A 27 TYR H A 23 GLY C 1.0 . 3.3 78 78 A 23 GLY O A 27 TYR N 1.0 . 3.3 79 79 A 28 ILE H A 24 LEU O 1.0 . 2.2 80 80 A 28 ILE H A 24 LEU C 1.0 . 3.3 81 81 A 24 LEU O A 28 ILE N 1.0 . 3.3 82 82 A 29 ALA H A 25 VAL O 1.0 . 2.2 83 83 A 29 ALA H A 25 VAL C 1.0 . 3.3 84 84 A 25 VAL O A 29 ALA N 1.0 . 3.3 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 11 PRO C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -77.3 -37.3 PHI 2 2 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 TYR N 1.0 -57.9 -17.9 PSI 3 3 A 12 VAL C A 13 TYR N A 13 TYR CA A 13 TYR C 1.0 -85.9 -45.9 PHI 4 4 A 13 TYR N A 13 TYR CA A 13 TYR C A 14 CYS N 1.0 -49.3 -9.3 PSI 5 5 A 13 TYR C A 14 CYS N A 14 CYS CA A 14 CYS C 1.0 -87.4 -47.4 PHI 6 6 A 14 CYS N A 14 CYS CA A 14 CYS C A 15 SER N 1.0 -58.0 -18.0 PSI 7 7 A 14 CYS C A 15 SER N A 15 SER CA A 15 SER C 1.0 -86.5 -46.5 PHI 8 8 A 15 SER N A 15 SER CA A 15 SER C A 16 ILE N 1.0 -61.6 -21.6 PSI 9 9 A 15 SER C A 16 ILE N A 16 ILE CA A 16 ILE C 1.0 -84.4 -44.4 PHI 10 10 A 16 ILE N A 16 ILE CA A 16 ILE C A 17 LEU N 1.0 -62.7 -22.7 PSI 11 11 A 16 ILE N A 16 ILE CA A 16 ILE CB A 16 ILE CG1 1.0 -90.0 -30.0 CHI1 12 12 A 16 ILE C A 17 LEU N A 17 LEU CA A 17 LEU C 1.0 -83.8 -43.8 PHI 13 13 A 17 LEU N A 17 LEU CA A 17 LEU C A 18 ALA N 1.0 -62.2 -22.2 PSI 14 14 A 17 LEU C A 18 ALA N A 18 ALA CA A 18 ALA C 1.0 -83.3 -43.3 PHI 15 15 A 18 ALA N A 18 ALA CA A 18 ALA C A 19 ALA N 1.0 -60.7 -20.7 PSI 16 16 A 18 ALA C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -84.7 -44.7 PHI 17 17 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 VAL N 1.0 -62.1 -22.1 PSI 18 18 A 19 ALA C A 20 VAL N A 20 VAL CA A 20 VAL C 1.0 -85.2 -45.2 PHI 19 19 A 20 VAL N A 20 VAL CA A 20 VAL C A 21 VAL N 1.0 -63.6 -23.6 PSI 20 20 A 20 VAL N A 20 VAL CA A 20 VAL CB A 20 VAL CG1 1.0 150.0 210.0 CHI1 21 21 A 20 VAL C A 21 VAL N A 21 VAL CA A 21 VAL C 1.0 -83.3 -43.3 PHI 22 22 A 21 VAL N A 21 VAL CA A 21 VAL C A 22 VAL N 1.0 -65.6 -25.6 PSI 23 23 A 21 VAL N A 21 VAL CA A 21 VAL CB A 21 VAL CG1 1.0 150.0 210.0 CHI1 24 24 A 21 VAL C A 22 VAL N A 22 VAL CA A 22 VAL C 1.0 -81.4 -41.4 PHI 25 25 A 22 VAL N A 22 VAL CA A 22 VAL C A 23 GLY N 1.0 -63.1 -23.1 PSI 26 26 A 22 VAL N A 22 VAL CA A 22 VAL CB A 22 VAL CG1 1.0 150.0 210.0 CHI1 27 27 A 22 VAL C A 23 GLY N A 23 GLY CA A 23 GLY C 1.0 -84.6 -44.6 PHI 28 28 A 23 GLY N A 23 GLY CA A 23 GLY C A 24 LEU N 1.0 -62.8 -22.8 PSI 29 29 A 23 GLY C A 24 LEU N A 24 LEU CA A 24 LEU C 1.0 -85.4 -45.4 PHI 30 30 A 24 LEU N A 24 LEU CA A 24 LEU C A 25 VAL N 1.0 -61.8 -21.8 PSI 31 31 A 24 LEU C A 25 VAL N A 25 VAL CA A 25 VAL C 1.0 -83.4 -43.4 PHI 32 32 A 25 VAL N A 25 VAL CA A 25 VAL C A 26 ALA N 1.0 -63.6 -23.6 PSI 33 33 A 25 VAL N A 25 VAL CA A 25 VAL CB A 25 VAL CG1 1.0 150.0 210.0 CHI1 34 34 A 25 VAL C A 26 ALA N A 26 ALA CA A 26 ALA C 1.0 -82.7 -42.7 PHI 35 35 A 26 ALA N A 26 ALA CA A 26 ALA C A 27 TYR N 1.0 -60.2 -20.2 PSI 36 36 A 26 ALA C A 27 TYR N A 27 TYR CA A 27 TYR C 1.0 -80.2 -40.2 PHI 37 37 A 27 TYR N A 27 TYR CA A 27 TYR C A 28 ILE N 1.0 -66.4 -26.4 PSI 38 38 A 27 TYR C A 28 ILE N A 28 ILE CA A 28 ILE C 1.0 -84.7 -44.7 PHI 39 39 A 28 ILE N A 28 ILE CA A 28 ILE C A 29 ALA N 1.0 -63.1 -23.1 PSI 40 40 A 28 ILE N A 28 ILE CA A 28 ILE CB A 28 ILE CG1 1.0 -90.0 -30.0 CHI1 41 41 A 28 ILE C A 29 ALA N A 29 ALA CA A 29 ALA C 1.0 -83.7 -43.7 PHI 42 42 A 29 ALA N A 29 ALA CA A 29 ALA C A 30 PHE N 1.0 -61.1 -21.1 PSI 43 43 A 29 ALA C A 30 PHE N A 30 PHE CA A 30 PHE C 1.0 -84.9 -44.9 PHI 44 44 A 30 PHE N A 30 PHE CA A 30 PHE C A 31 LYS N 1.0 -62.7 -22.7 PSI 45 45 A 30 PHE C A 31 LYS N A 31 LYS CA A 31 LYS C 1.0 -87.0 -47.0 PHI 46 46 A 31 LYS N A 31 LYS CA A 31 LYS C A 32 ARG N 1.0 -58.7 -18.7 PSI 47 47 A 31 LYS C A 32 ARG N A 32 ARG CA A 32 ARG C 1.0 -86.6 -46.6 PHI 48 48 A 32 ARG N A 32 ARG CA A 32 ARG C A 33 TRP N 1.0 -57.0 -17.0 PSI 49 49 A 32 ARG C A 33 TRP N A 33 TRP CA A 33 TRP C 1.0 -86.2 -46.2 PHI 50 50 A 33 TRP N A 33 TRP CA A 33 TRP C A 34 ASN N 1.0 -57.6 -17.6 PSI 51 51 A 33 TRP C A 34 ASN N A 34 ASN CA A 34 ASN C 1.0 -88.0 -48.0 PHI 52 52 A 34 ASN N A 34 ASN CA A 34 ASN C A 35 SER N 1.0 -45.4 -5.4 PSI 53 53 B 111 PRO C B 112 VAL N B 112 VAL CA B 112 VAL C 1.0 -77.3 -37.3 PHI 54 54 B 112 VAL N B 112 VAL CA B 112 VAL C B 113 TYR N 1.0 -57.9 -17.9 PSI 55 55 B 112 VAL C B 113 TYR N B 113 TYR CA B 113 TYR C 1.0 -85.9 -45.9 PHI 56 56 B 113 TYR N B 113 TYR CA B 113 TYR C B 114 CYS N 1.0 -49.3 -9.3 PSI 57 57 B 113 TYR C B 114 CYS N B 114 CYS CA B 114 CYS C 1.0 -87.4 -47.4 PHI 58 58 B 114 CYS N B 114 CYS CA B 114 CYS C B 115 SER N 1.0 -58.0 -18.0 PSI 59 59 B 114 CYS C B 115 SER N B 115 SER CA B 115 SER C 1.0 -86.5 -46.5 PHI 60 60 B 115 SER N B 115 SER CA B 115 SER C B 116 ILE N 1.0 -61.6 -21.6 PSI 61 61 B 115 SER C B 116 ILE N B 116 ILE CA B 116 ILE C 1.0 -84.4 -44.4 PHI 62 62 B 116 ILE N B 116 ILE CA B 116 ILE C B 117 LEU N 1.0 -62.7 -22.7 PSI 63 63 B 116 ILE N B 116 ILE CA B 116 ILE CB B 116 ILE CG1 1.0 -90.0 -30.0 CHI1 64 64 B 116 ILE C B 117 LEU N B 117 LEU CA B 117 LEU C 1.0 -83.8 -43.8 PHI 65 65 B 117 LEU N B 117 LEU CA B 117 LEU C B 118 ALA N 1.0 -62.2 -22.2 PSI 66 66 B 117 LEU C B 118 ALA N B 118 ALA CA B 118 ALA C 1.0 -83.3 -43.3 PHI 67 67 B 118 ALA N B 118 ALA CA B 118 ALA C B 119 ALA N 1.0 -60.7 -20.7 PSI 68 68 B 118 ALA C B 119 ALA N B 119 ALA CA B 119 ALA C 1.0 -84.7 -44.7 PHI 69 69 B 119 ALA N B 119 ALA CA B 119 ALA C B 120 VAL N 1.0 -62.1 -22.1 PSI 70 70 B 119 ALA C B 120 VAL N B 120 VAL CA B 120 VAL C 1.0 -85.2 -45.2 PHI 71 71 B 120 VAL N B 120 VAL CA B 120 VAL C B 121 VAL N 1.0 -63.6 -23.6 PSI 72 72 B 120 VAL N B 120 VAL CA B 120 VAL CB B 120 VAL CG1 1.0 150.0 210.0 CHI1 73 73 B 120 VAL C B 121 VAL N B 121 VAL CA B 121 VAL C 1.0 -83.3 -43.3 PHI 74 74 B 121 VAL N B 121 VAL CA B 121 VAL C B 122 VAL N 1.0 -65.6 -25.6 PSI 75 75 B 121 VAL C B 122 VAL N B 122 VAL CA B 122 VAL C 1.0 -81.4 -41.4 PHI 76 76 B 122 VAL N B 122 VAL CA B 122 VAL C B 123 GLY N 1.0 -63.1 -23.1 PSI 77 77 B 122 VAL N B 122 VAL CA B 122 VAL CB B 122 VAL CG1 1.0 150.0 210.0 CHI1 78 78 B 122 VAL C B 123 GLY N B 123 GLY CA B 123 GLY C 1.0 -84.6 -44.6 PHI 79 79 B 123 GLY N B 123 GLY CA B 123 GLY C B 124 LEU N 1.0 -62.8 -22.8 PSI 80 80 B 123 GLY C B 124 LEU N B 124 LEU CA B 124 LEU C 1.0 -85.4 -45.4 PHI 81 81 B 124 LEU N B 124 LEU CA B 124 LEU C B 125 VAL N 1.0 -61.8 -21.8 PSI 82 82 B 124 LEU C B 125 VAL N B 125 VAL CA B 125 VAL C 1.0 -83.4 -43.4 PHI 83 83 B 125 VAL N B 125 VAL CA B 125 VAL C B 126 ALA N 1.0 -63.6 -23.6 PSI 84 84 B 125 VAL N B 125 VAL CA B 125 VAL CB B 125 VAL CG1 1.0 150.0 210.0 CHI1 85 85 B 125 VAL C B 126 ALA N B 126 ALA CA B 126 ALA C 1.0 -82.7 -42.7 PHI 86 86 B 126 ALA N B 126 ALA CA B 126 ALA C B 127 TYR N 1.0 -60.2 -20.2 PSI 87 87 B 126 ALA C B 127 TYR N B 127 TYR CA B 127 TYR C 1.0 -80.2 -40.2 PHI 88 88 B 127 TYR N B 127 TYR CA B 127 TYR C B 128 ILE N 1.0 -66.4 -26.4 PSI 89 89 B 127 TYR C B 128 ILE N B 128 ILE CA B 128 ILE C 1.0 -84.7 -44.7 PHI 90 90 B 128 ILE N B 128 ILE CA B 128 ILE C B 129 ALA N 1.0 -63.1 -23.1 PSI 91 91 B 128 ILE N B 128 ILE CA B 128 ILE CB B 128 ILE CG1 1.0 -90.0 -30.0 CHI1 92 92 B 128 ILE C B 129 ALA N B 129 ALA CA B 129 ALA C 1.0 -83.7 -43.7 PHI 93 93 B 129 ALA N B 129 ALA CA B 129 ALA C B 130 PHE N 1.0 -61.1 -21.1 PSI stop_ save_