data_nef_c19741_2mjo 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 2MJO 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 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 ALA middle . . 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 ALA middle . . 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 1 MET H1 H 1 8.580 0.000 A 1 MET CA C 13 54.091 0.000 A 1 MET N N 15 128.327 0.000 A 2 THR H H 1 8.186 0.000 A 2 THR HA H 1 4.392 0.000 A 2 THR HB H 1 4.254 0.000 A 2 THR HG2% H 1 1.190 0.000 A 2 THR CA C 13 61.322 0.000 A 2 THR CB C 13 69.311 0.000 A 2 THR CG2 C 13 21.225 0.000 A 2 THR N N 15 113.991 0.000 A 3 ARG H H 1 8.324 0.000 A 3 ARG HA H 1 4.374 0.000 A 3 ARG HBy H 1 1.903 0.000 A 3 ARG HBx H 1 1.796 0.000 A 3 ARG HDx H 1 3.197 0.000 A 3 ARG HDy H 1 3.197 0.000 A 3 ARG HGx H 1 1.652 0.000 A 3 ARG HGy H 1 1.652 0.000 A 3 ARG CA C 13 55.821 0.000 A 3 ARG CB C 13 30.353 0.000 A 3 ARG CD C 13 42.923 0.000 A 3 ARG CG C 13 26.726 0.000 A 3 ARG N N 15 122.762 0.000 A 4 GLY H H 1 8.436 0.000 A 4 GLY HAx H 1 4.033 0.000 A 4 GLY HAy H 1 4.033 0.000 A 4 GLY CA C 13 44.932 0.000 A 4 GLY N N 15 109.431 0.000 A 5 THR H H 1 8.040 0.000 A 5 THR HA H 1 4.563 0.000 A 5 THR HB H 1 4.302 0.000 A 5 THR HG2% H 1 1.207 0.000 A 5 THR CA C 13 61.677 0.000 A 5 THR CB C 13 69.238 0.000 A 5 THR CG2 C 13 21.303 0.000 A 5 THR N N 15 113.238 0.000 A 6 THR H H 1 8.148 0.000 A 6 THR HA H 1 4.563 0.000 A 6 THR HB H 1 4.316 0.000 A 6 THR HG2% H 1 1.210 0.000 A 6 THR CA C 13 61.897 0.000 A 6 THR CB C 13 68.913 0.000 A 6 THR CG2 C 13 21.371 0.000 A 6 THR N N 15 114.625 0.000 A 7 ASP H H 1 8.228 0.000 A 7 ASP HA H 1 4.543 0.000 A 7 ASP HBx H 1 2.664 0.000 A 7 ASP HBy H 1 2.664 0.000 A 7 ASP CA C 13 54.712 0.000 A 7 ASP CB C 13 40.714 0.000 A 7 ASP N N 15 122.028 0.000 A 8 ASN H H 1 8.218 0.000 A 8 ASN HA H 1 4.678 0.000 A 8 ASN HBx H 1 2.842 0.000 A 8 ASN HBy H 1 2.842 0.000 A 8 ASN HD2y H 1 7.628 0.000 A 8 ASN HD2x H 1 6.884 0.000 A 8 ASN CA C 13 53.210 0.000 A 8 ASN CB C 13 38.453 0.000 A 8 ASN N N 15 117.725 0.000 A 8 ASN ND2 N 15 112.242 0.000 A 9 LEU H H 1 8.301 0.000 A 9 LEU HA H 1 4.221 0.000 A 9 LEU HBy H 1 1.627 0.000 A 9 LEU HBx H 1 1.226 0.000 A 9 LEU HDx% H 1 0.912 0.000 A 9 LEU HDy% H 1 0.772 0.000 A 9 LEU HG H 1 1.587 0.000 A 9 LEU CA C 13 55.077 0.000 A 9 LEU CB C 13 41.958 0.000 A 9 LEU CDy C 13 24.963 0.000 A 9 LEU CDx C 13 22.909 0.000 A 9 LEU CG C 13 26.603 0.000 A 9 LEU N N 15 120.122 0.000 A 10 ILE H H 1 8.042 0.000 A 10 ILE HA H 1 3.881 0.000 A 10 ILE HB H 1 2.147 0.000 A 10 ILE HD1% H 1 0.947 0.000 A 10 ILE HG1y H 1 1.733 0.000 A 10 ILE HG1x H 1 1.264 0.000 A 10 ILE HG2% H 1 0.873 0.000 A 10 ILE CA C 13 65.577 0.000 A 10 ILE CB C 13 34.565 0.000 A 10 ILE CD1 C 13 11.917 0.000 A 10 ILE CG1 C 13 29.073 0.000 A 10 ILE CG2 C 13 17.142 0.000 A 10 ILE N N 15 120.060 0.000 A 11 PRO HA H 1 4.016 0.000 A 11 PRO HBx H 1 1.739 0.000 A 11 PRO HBy H 1 2.082 0.000 A 11 PRO HDx H 1 3.581 0.000 A 11 PRO HDy H 1 3.581 0.000 A 11 PRO HGy H 1 2.082 0.000 A 11 PRO HGx H 1 1.771 0.000 A 11 PRO CA C 13 65.397 0.000 A 11 PRO CB C 13 31.052 0.000 A 11 PRO CD C 13 49.300 0.000 A 11 PRO CG C 13 28.012 0.000 A 12 VAL H H 1 7.235 0.000 A 12 VAL HA H 1 3.657 0.000 A 12 VAL HB H 1 2.147 0.000 A 12 VAL HGx% H 1 0.817 0.000 A 12 VAL HGy% H 1 1.007 0.000 A 12 VAL CA C 13 65.828 0.000 A 12 VAL CB C 13 30.953 0.000 A 12 VAL CGx C 13 20.635 0.000 A 12 VAL CGy C 13 22.336 0.000 A 12 VAL N N 15 117.190 0.000 A 13 TYR H H 1 8.098 0.000 A 13 TYR HA H 1 4.331 0.000 A 13 TYR HBx H 1 3.049 0.000 A 13 TYR HBy H 1 3.049 0.000 A 13 TYR HDx H 1 6.904 0.000 A 13 TYR HDy H 1 6.904 0.000 A 13 TYR CA C 13 59.146 0.000 A 13 TYR CB C 13 37.051 0.000 A 13 TYR N N 15 118.381 0.000 A 14 ALA H H 1 8.669 0.000 A 14 ALA HA H 1 3.948 0.000 A 14 ALA HB% H 1 1.300 0.000 A 14 ALA CA C 13 54.838 0.000 A 14 ALA CB C 13 18.190 0.000 A 14 ALA N N 15 118.789 0.000 A 15 SER H H 1 7.637 0.000 A 15 SER HA H 1 4.121 0.000 A 15 SER HBy H 1 3.929 0.000 A 15 SER HBx H 1 3.657 0.000 A 15 SER CA C 13 62.629 0.000 A 15 SER N N 15 113.352 0.000 A 16 ILE H H 1 7.838 0.000 A 16 ILE HA H 1 3.665 0.000 A 16 ILE HB H 1 1.963 0.000 A 16 ILE HD1% H 1 0.811 0.000 A 16 ILE HG1x H 1 0.989 0.000 A 16 ILE HG1y H 1 1.918 0.000 A 16 ILE HG2% H 1 0.846 0.000 A 16 ILE CA C 13 64.699 0.000 A 16 ILE CB C 13 37.339 0.000 A 16 ILE CD1 C 13 13.328 0.000 A 16 ILE CG1 C 13 28.688 0.000 A 16 ILE CG2 C 13 16.913 0.000 A 16 ILE N N 15 120.830 0.000 A 17 LEU H H 1 8.075 0.000 A 17 LEU HA H 1 3.940 0.000 A 17 LEU HBx H 1 1.699 0.000 A 17 LEU HBy H 1 1.699 0.000 A 17 LEU HDx% H 1 0.823 0.000 A 17 LEU HDy% H 1 0.838 0.000 A 17 LEU HG H 1 1.679 0.000 A 17 LEU CA C 13 57.835 0.000 A 17 LEU CB C 13 41.050 0.000 A 17 LEU CDy C 13 24.149 0.000 A 17 LEU CDx C 13 23.774 0.000 A 17 LEU CG C 13 26.684 0.000 A 17 LEU N N 15 118.900 0.000 A 18 ALA H H 1 8.252 0.000 A 18 ALA HA H 1 3.850 0.000 A 18 ALA HB% H 1 1.409 0.000 A 18 ALA CA C 13 55.086 0.000 A 18 ALA CB C 13 17.314 0.000 A 18 ALA N N 15 118.912 0.000 A 19 ALA H H 1 7.923 0.000 A 19 ALA HA H 1 3.940 0.000 A 19 ALA HB% H 1 1.485 0.000 A 19 ALA CA C 13 54.982 0.000 A 19 ALA CB C 13 18.205 0.000 A 19 ALA N N 15 118.497 0.000 A 20 VAL H H 1 8.231 0.000 A 20 VAL HA H 1 3.524 0.000 A 20 VAL HB H 1 2.220 0.000 A 20 VAL HGx% H 1 0.842 0.000 A 20 VAL HGy% H 1 1.002 0.000 A 20 VAL CA C 13 66.256 0.000 A 20 VAL CB C 13 30.769 0.000 A 20 VAL CGx C 13 20.799 0.000 A 20 VAL CGy C 13 22.631 0.000 A 20 VAL N N 15 116.311 0.000 A 21 VAL H H 1 8.183 0.000 A 21 VAL HA H 1 3.505 0.000 A 21 VAL HB H 1 2.168 0.000 A 21 VAL HGx% H 1 0.844 0.000 A 21 VAL HGy% H 1 1.007 0.000 A 21 VAL CA C 13 67.224 0.000 A 21 VAL CB C 13 30.870 0.000 A 21 VAL CGx C 13 20.809 0.000 A 21 VAL CGy C 13 22.581 0.000 A 21 VAL N N 15 118.109 0.000 A 22 VAL H H 1 8.327 0.000 A 22 VAL HA H 1 3.446 0.000 A 22 VAL HB H 1 2.135 0.000 A 22 VAL HGx% H 1 0.841 0.000 A 22 VAL HGy% H 1 1.018 0.000 A 22 VAL CA C 13 66.933 0.000 A 22 VAL CB C 13 30.393 0.000 A 22 VAL CGx C 13 20.858 0.000 A 22 VAL CGy C 13 23.133 0.000 A 22 VAL N N 15 117.744 0.000 A 23 GLY H H 1 8.663 0.000 A 23 GLY HAx H 1 3.594 0.000 A 23 GLY HAy H 1 3.764 0.000 A 23 GLY CA C 13 47.220 0.000 A 23 GLY N N 15 107.119 0.000 A 24 LEU H H 1 8.434 0.000 A 24 LEU HA H 1 4.143 0.000 A 24 LEU HBy H 1 1.930 0.000 A 24 LEU HBx H 1 1.658 0.000 A 24 LEU HDx% H 1 0.886 0.000 A 24 LEU HDy% H 1 0.886 0.000 A 24 LEU HG H 1 1.858 0.000 A 24 LEU CA C 13 57.849 0.000 A 24 LEU CB C 13 41.774 0.000 A 24 LEU CDy C 13 24.652 0.000 A 24 LEU CG C 13 26.500 0.000 A 24 LEU N N 15 121.284 0.000 A 25 VAL H H 1 8.353 0.000 A 25 VAL HA H 1 3.505 0.000 A 25 VAL HB H 1 2.230 0.000 A 25 VAL HGx% H 1 0.887 0.000 A 25 VAL HGy% H 1 1.053 0.000 A 25 VAL CA C 13 66.794 0.000 A 25 VAL CB C 13 30.648 0.000 A 25 VAL CGx C 13 21.175 0.000 A 25 VAL CGy C 13 22.864 0.000 A 25 VAL N N 15 118.329 0.000 A 26 ALA H H 1 8.841 0.000 A 26 ALA HA H 1 3.860 0.000 A 26 ALA HB% H 1 1.474 0.000 A 26 ALA CA C 13 55.044 0.000 A 26 ALA CB C 13 17.251 0.000 A 26 ALA N N 15 121.269 0.000 A 27 TYR H H 1 8.438 0.000 A 27 TYR HA H 1 4.144 0.000 A 27 TYR HBx H 1 3.274 0.000 A 27 TYR HBy H 1 3.274 0.000 A 27 TYR HDx H 1 6.927 0.000 A 27 TYR HDy H 1 6.927 0.000 A 27 TYR CA C 13 61.989 0.000 A 27 TYR CB C 13 38.216 0.000 A 27 TYR N N 15 118.361 0.000 A 28 ILE H H 1 8.359 0.000 A 28 ILE HA H 1 3.446 0.000 A 28 ILE HB H 1 2.025 0.000 A 28 ILE HD1% H 1 0.890 0.000 A 28 ILE HG1y H 1 1.989 0.000 A 28 ILE HG1x H 1 1.309 0.000 A 28 ILE HG2% H 1 0.887 0.000 A 28 ILE CA C 13 64.485 0.000 A 28 ILE CB C 13 37.099 0.000 A 28 ILE CD1 C 13 12.709 0.000 A 28 ILE CG1 C 13 28.669 0.000 A 28 ILE CG2 C 13 17.146 0.000 A 28 ILE N N 15 118.303 0.000 A 29 ALA H H 1 8.781 0.000 A 29 ALA HA H 1 3.879 0.000 A 29 ALA HB% H 1 1.322 0.000 A 29 ALA CA C 13 55.063 0.000 A 29 ALA CB C 13 17.712 0.000 A 29 ALA N N 15 122.265 0.000 A 30 PHE H H 1 8.812 0.000 A 30 PHE HA H 1 4.218 0.000 A 30 PHE HBx H 1 3.179 0.000 A 30 PHE HBy H 1 3.179 0.000 A 30 PHE HDx H 1 7.207 0.000 A 30 PHE HDy H 1 7.207 0.000 A 30 PHE CA C 13 60.906 0.000 A 30 PHE CB C 13 38.415 0.000 A 30 PHE N N 15 117.335 0.000 A 31 LYS H H 1 8.403 0.000 A 31 LYS HA H 1 3.896 0.000 A 31 LYS HBx H 1 1.700 0.000 A 31 LYS HBy H 1 1.700 0.000 A 31 LYS HDx H 1 1.535 0.000 A 31 LYS HDy H 1 1.535 0.000 A 31 LYS HEx H 1 2.865 0.000 A 31 LYS HEy H 1 2.960 0.000 A 31 LYS HGx H 1 1.249 0.000 A 31 LYS HGy H 1 1.249 0.000 A 31 LYS CA C 13 58.087 0.000 A 31 LYS CB C 13 30.955 0.000 A 31 LYS CD C 13 27.903 0.000 A 31 LYS CE C 13 41.309 0.000 A 31 LYS CG C 13 23.863 0.000 A 31 LYS N N 15 119.204 0.000 A 32 ARG H H 1 8.226 0.000 A 32 ARG HA H 1 4.146 0.000 A 32 ARG HBx H 1 1.886 0.000 A 32 ARG HBy H 1 1.886 0.000 A 32 ARG HDx H 1 3.058 0.000 A 32 ARG HDy H 1 3.104 0.000 A 32 ARG HGx H 1 1.645 0.000 A 32 ARG HGy H 1 1.645 0.000 A 32 ARG CA C 13 57.517 0.000 A 32 ARG CB C 13 29.575 0.000 A 32 ARG CD C 13 42.645 0.000 A 32 ARG CG C 13 27.062 0.000 A 32 ARG N N 15 118.907 0.000 A 33 TRP H H 1 8.445 0.000 A 33 TRP HA H 1 4.385 0.000 A 33 TRP HBx H 1 3.308 0.000 A 33 TRP HBy H 1 3.308 0.000 A 33 TRP CA C 13 59.193 0.000 A 33 TRP CB C 13 28.688 0.000 A 33 TRP N N 15 121.565 0.000 A 34 ASN H H 1 8.290 0.000 A 34 ASN HA H 1 4.385 0.000 A 34 ASN HBy H 1 2.676 0.000 A 34 ASN HBx H 1 2.490 0.000 A 34 ASN HD2y H 1 7.334 0.000 A 34 ASN HD2x H 1 6.616 0.000 A 34 ASN CA C 13 53.931 0.000 A 34 ASN CB C 13 38.806 0.000 A 34 ASN N N 15 117.184 0.000 A 34 ASN ND2 N 15 111.849 0.000 A 35 SER H H 1 7.862 0.000 A 35 SER HA H 1 4.362 0.000 A 35 SER HBx H 1 3.933 0.000 A 35 SER HBy H 1 3.933 0.000 A 35 SER CA C 13 59.100 0.000 A 35 SER CB C 13 63.175 0.000 A 35 SER N N 15 114.662 0.000 A 36 SER H H 1 7.979 0.000 A 36 SER HA H 1 4.404 0.000 A 36 SER HBx H 1 3.890 0.000 A 36 SER HBy H 1 3.890 0.000 A 36 SER CA C 13 58.628 0.000 A 36 SER CB C 13 63.288 0.000 A 36 SER N N 15 117.160 0.000 A 37 LYS H H 1 7.897 0.000 A 37 LYS HA H 1 4.238 0.000 A 37 LYS HBy H 1 1.774 0.000 A 37 LYS HBx H 1 1.681 0.000 A 37 LYS HDx H 1 1.549 0.000 A 37 LYS HDy H 1 1.549 0.000 A 37 LYS HEx H 1 2.862 0.000 A 37 LYS HEy H 1 2.862 0.000 A 37 LYS HGx H 1 1.294 0.000 A 37 LYS HGy H 1 1.294 0.000 A 37 LYS CA C 13 55.932 0.000 A 37 LYS CB C 13 32.163 0.000 A 37 LYS CD C 13 28.423 0.000 A 37 LYS CE C 13 41.640 0.000 A 37 LYS CG C 13 23.989 0.000 A 37 LYS N N 15 122.102 0.000 A 38 GLN H H 1 8.058 0.000 A 38 GLN HA H 1 4.309 0.000 A 38 GLN HBy H 1 2.090 0.000 A 38 GLN HBx H 1 1.953 0.000 A 38 GLN HGx H 1 2.342 0.000 A 38 GLN HGy H 1 2.342 0.000 A 38 GLN CA C 13 55.436 0.000 A 38 GLN CB C 13 28.954 0.000 A 38 GLN CG C 13 33.332 0.000 A 38 GLN N N 15 119.979 0.000 A 39 ASN H H 1 8.269 0.000 A 39 ASN HA H 1 4.681 0.000 A 39 ASN HBy H 1 2.806 0.000 A 39 ASN HBx H 1 2.737 0.000 A 39 ASN CA C 13 52.858 0.000 A 39 ASN CB C 13 38.498 0.000 A 39 ASN N N 15 119.701 0.000 A 40 LYS H H 1 8.108 0.000 A 40 LYS HA H 1 4.342 0.000 A 40 LYS HBx H 1 1.738 0.000 A 40 LYS HBy H 1 1.853 0.000 A 40 LYS HDx H 1 1.655 0.000 A 40 LYS HDy H 1 1.655 0.000 A 40 LYS HEx H 1 2.988 0.000 A 40 LYS HEy H 1 2.988 0.000 A 40 LYS HGx H 1 1.440 0.000 A 40 LYS HGy H 1 1.440 0.000 A 40 LYS CA C 13 55.860 0.000 A 40 LYS CB C 13 32.595 0.000 A 40 LYS CD C 13 28.528 0.000 A 40 LYS CE C 13 41.682 0.000 A 40 LYS CG C 13 24.046 0.000 A 40 LYS N N 15 121.895 0.000 A 41 GLN H H 1 7.901 0.000 A 41 GLN HA H 1 4.569 0.000 A 41 GLN HBy H 1 2.092 0.000 A 41 GLN HBx H 1 1.908 0.000 A 41 GLN HGx H 1 2.280 0.000 A 41 GLN HGy H 1 2.280 0.000 A 41 GLN CA C 13 56.958 0.000 A 41 GLN CB C 13 30.081 0.000 A 41 GLN CG C 13 33.916 0.000 A 41 GLN N N 15 108.768 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 32 ARG H A 31 LYS HGx 1.0 . 4.39 2 1 A 31 LYS HGy A 32 ARG H 1.0 . 4.39 3 2 A 28 ILE H A 27 TYR HBx 1.0 . 4.08 4 2 A 27 TYR HBy A 28 ILE H 1.0 . 4.08 5 3 A 26 ALA H A 27 TYR H 1.0 . 3.65 6 4 A 25 VAL H A 24 LEU HBy 1.0 . 3.02 7 5 A 25 VAL H A 24 LEU HBx 1.0 . 3.02 8 6 A 21 VAL HA A 24 LEU H 1.0 . 3.73 9 7 A 19 ALA HA A 23 GLY H 1.0 . 3.92 10 8 A 23 GLY H A 20 VAL HA 1.0 . 3.50 11 9 A 21 VAL HA A 22 VAL H 1.0 . 3.50 12 10 A 18 ALA H A 19 ALA H 1.0 . 3.64 13 11 A 15 SER HA A 17 LEU H 1.0 . 4.31 14 12 A 24 LEU H A 24 LEU HDx% 1.0 . 4.06 15 12 A 24 LEU H A 24 LEU HDy% 1.0 . 4.06 16 13 A 18 ALA H A 17 LEU HBx 1.0 . 3.31 17 13 A 18 ALA H A 17 LEU HBy 1.0 . 3.31 18 14 A 12 VAL HA A 15 SER H 1.0 . 4.16 19 15 A 17 LEU H A 15 SER H 1.0 . 4.12 20 16 A 16 ILE H A 16 ILE HG2% 1.0 . 4.20 21 17 A 15 SER H A 16 ILE H 1.0 . 3.25 22 18 A 16 ILE H A 16 ILE HG1y 1.0 . 3.51 23 19 A 16 ILE H A 16 ILE HG1x 1.0 . 3.51 24 20 A 16 ILE H A 16 ILE HD1% 1.0 . 3.37 25 21 A 16 ILE H A 13 TYR HA 1.0 . 3.89 26 22 A 16 ILE H A 16 ILE HB 1.0 . 2.91 27 23 A 17 LEU H A 16 ILE H 1.0 . 3.27 28 24 A 20 VAL HB A 21 VAL H 1.0 . 3.34 29 25 A 21 VAL H A 21 VAL HGy% 1.0 . 2.98 30 26 A 22 VAL H A 21 VAL H 1.0 . 3.27 31 27 A 21 VAL H A 21 VAL HB 1.0 . 3.49 32 28 A 21 VAL H A 17 LEU HA 1.0 . 4.31 33 29 A 21 VAL H A 18 ALA HA 1.0 . 4.11 34 30 A 23 GLY H A 22 VAL HGx% 1.0 . 3.47 35 31 A 23 GLY H A 22 VAL HB 1.0 . 3.54 36 32 A 23 GLY H A 22 VAL HGy% 1.0 . 3.69 37 33 A 32 ARG H A 32 ARG HBx 1.0 . 3.39 38 33 A 32 ARG H A 32 ARG HBy 1.0 . 3.39 39 34 A 32 ARG H A 32 ARG HGx 1.0 . 3.59 40 34 A 32 ARG H A 32 ARG HGy 1.0 . 3.59 41 35 A 32 ARG H A 31 LYS HBx 1.0 . 3.67 42 35 A 32 ARG H A 31 LYS HBy 1.0 . 3.67 43 36 A 20 VAL HB A 20 VAL H 1.0 . 3.28 44 37 A 19 ALA HA A 20 VAL H 1.0 . 3.55 45 38 A 19 ALA H A 20 VAL H 1.0 . 3.34 46 39 A 20 VAL H A 19 ALA HB% 1.0 . 3.31 47 40 A 20 VAL H A 20 VAL HGy% 1.0 . 3.00 48 41 A 32 ARG H A 33 TRP H 1.0 . 3.38 49 42 A 33 TRP H A 33 TRP HBx 1.0 . 3.11 50 42 A 33 TRP H A 33 TRP HBy 1.0 . 3.11 51 43 A 33 TRP H A 29 ALA HA 1.0 . 4.24 52 44 A 33 TRP H A 32 ARG HBx 1.0 . 3.70 53 44 A 32 ARG HBy A 33 TRP H 1.0 . 3.70 54 45 A 6 THR HA A 9 LEU H 1.0 . 4.39 55 46 A 9 LEU H A 9 LEU HG 1.0 . 3.67 56 47 A 9 LEU H A 8 ASN HBx 1.0 . 4.19 57 47 A 9 LEU H A 8 ASN HBy 1.0 . 4.19 58 48 A 2 THR H A 2 THR HG2% 1.0 . 4.06 59 49 A 15 SER H A 14 ALA HB% 1.0 . 3.48 60 50 A 9 LEU H A 10 ILE H 1.0 . 3.44 61 51 A 10 ILE H A 10 ILE HG1y 1.0 . 3.57 62 52 A 10 ILE H A 10 ILE HB 1.0 . 3.30 63 53 A 10 ILE H A 10 ILE HG1x 1.0 . 4.10 64 54 A 10 ILE H A 10 ILE HG2% 1.0 . 3.75 65 55 A 10 ILE H A 10 ILE HD1% 1.0 . 3.73 66 56 A 25 VAL H A 25 VAL HGy% 1.0 . 2.45 67 57 A 25 VAL H A 25 VAL HA 1.0 . 2.67 68 58 A 25 VAL H A 25 VAL HB 1.0 . 2.58 69 59 A 15 SER H A 14 ALA H 1.0 . 3.36 70 60 A 14 ALA H A 13 TYR HBx 1.0 . 3.57 71 60 A 14 ALA H A 13 TYR HBy 1.0 . 3.57 72 61 A 14 ALA HB% A 14 ALA H 1.0 . 3.00 73 62 A 14 ALA H A 11 PRO HA 1.0 . 3.80 74 63 A 23 GLY H A 22 VAL H 1.0 . 3.37 75 64 A 22 VAL H A 22 VAL HB 1.0 . 3.04 76 65 A 19 ALA HA A 22 VAL H 1.0 . 3.95 77 66 A 22 VAL H A 22 VAL HGy% 1.0 . 2.97 78 67 A 22 VAL H A 18 ALA HA 1.0 . 3.97 79 68 A 13 TYR H A 13 TYR HD% 1.0 . 4.11 80 69 A 13 TYR H A 12 VAL HGy% 1.0 . 3.79 81 70 A 13 TYR H A 12 VAL HB 1.0 . 3.40 82 71 A 14 ALA H A 13 TYR H 1.0 . 3.68 83 72 A 13 TYR H A 13 TYR HBx 1.0 . 3.36 84 72 A 13 TYR HBy A 13 TYR H 1.0 . 3.36 85 73 A 13 TYR H A 12 VAL HGx% 1.0 . 3.63 86 74 A 27 TYR H A 27 TYR HD% 1.0 . 3.95 87 75 A 27 TYR H A 27 TYR HBx 1.0 . 3.25 88 75 A 27 TYR HBy A 27 TYR H 1.0 . 3.25 89 76 A 27 TYR H A 26 ALA HB% 1.0 . 3.45 90 77 A 24 LEU H A 23 GLY H 1.0 . 3.48 91 78 A 24 LEU H A 24 LEU HG 1.0 . 3.67 92 79 A 24 LEU H A 24 LEU HBy 1.0 . 3.53 93 80 A 24 LEU H A 24 LEU HBx 1.0 . 3.53 94 81 A 35 SER H A 35 SER HBx 1.0 . 3.42 95 81 A 35 SER H A 35 SER HBy 1.0 . 3.42 96 82 A 35 SER H A 32 ARG HA 1.0 . 4.55 97 83 A 6 THR HG2% A 7 ASP H 1.0 . 4.57 98 84 A 7 ASP H A 6 THR HB 1.0 . 3.37 99 85 A 32 ARG H A 31 LYS H 1.0 . 3.39 100 86 A 31 LYS H A 30 PHE HBx 1.0 . 3.67 101 86 A 31 LYS H A 30 PHE HBy 1.0 . 3.67 102 87 A 31 LYS H A 28 ILE HA 1.0 . 4.35 103 88 A 31 LYS H A 31 LYS HDx 1.0 . 4.31 104 88 A 31 LYS H A 31 LYS HDy 1.0 . 4.31 105 89 A 31 LYS H A 31 LYS HGx 1.0 . 3.67 106 89 A 31 LYS HGy A 31 LYS H 1.0 . 3.67 107 90 A 31 LYS H A 27 TYR HA 1.0 . 4.39 108 91 A 31 LYS H A 31 LYS HBx 1.0 . 3.37 109 91 A 31 LYS HBy A 31 LYS H 1.0 . 3.37 110 92 A 38 GLN H A 38 GLN HGx 1.0 . 4.27 111 92 A 38 GLN H A 38 GLN HGy 1.0 . 4.27 112 93 A 19 ALA H A 16 ILE HA 1.0 . 4.22 113 94 A 19 ALA H A 19 ALA HB% 1.0 . 3.01 114 95 A 37 LYS H A 37 LYS HGx 1.0 . 3.80 115 95 A 37 LYS H A 37 LYS HGy 1.0 . 3.80 116 96 A 5 THR H A 5 THR HG2% 1.0 . 4.05 117 97 A 40 LYS H A 40 LYS HEx 1.0 . 5.50 118 97 A 40 LYS H A 40 LYS HEy 1.0 . 5.50 119 98 A 40 LYS H A 40 LYS HDx 1.0 . 5.50 120 98 A 40 LYS H A 40 LYS HDy 1.0 . 5.50 121 99 A 28 ILE HD1% A 29 ALA H 1.0 . 4.07 122 100 A 29 ALA H A 29 ALA HB% 1.0 . 3.07 123 101 A 29 ALA H A 28 ILE HB 1.0 . 3.59 124 102 A 29 ALA H A 28 ILE HG2% 1.0 . 4.57 125 103 A 29 ALA H A 25 VAL HGx% 1.0 . 4.57 126 104 A 18 ALA H A 18 ALA HB% 1.0 . 3.12 127 105 A 30 PHE H A 30 PHE HBx 1.0 . 3.25 128 105 A 30 PHE HBy A 30 PHE H 1.0 . 3.25 129 106 A 31 LYS H A 30 PHE H 1.0 . 3.47 130 107 A 30 PHE H A 30 PHE HD% 1.0 . 4.86 131 108 A 29 ALA HB% A 30 PHE H 1.0 . 3.43 132 109 A 31 LYS HA A 34 ASN H 1.0 . 4.45 133 110 A 34 ASN H A 33 TRP HBx 1.0 . 3.80 134 110 A 33 TRP HBy A 34 ASN H 1.0 . 3.80 135 111 A 35 SER H A 34 ASN H 1.0 . 4.03 136 112 A 6 THR HG2% A 8 ASN H 1.0 . 4.63 137 113 A 8 ASN H A 7 ASP HBx 1.0 . 4.23 138 113 A 8 ASN H A 7 ASP HBy 1.0 . 4.23 139 114 A 8 ASN H A 8 ASN HBx 1.0 . 3.74 140 114 A 8 ASN HBy A 8 ASN H 1.0 . 3.74 141 115 A 3 ARG H A 3 ARG HDx 1.0 . 5.04 142 115 A 3 ARG H A 3 ARG HDy 1.0 . 5.04 143 116 A 3 ARG H A 2 THR HB 1.0 . 3.77 144 117 A 3 ARG H A 3 ARG HGx 1.0 . 4.22 145 117 A 3 ARG H A 3 ARG HGy 1.0 . 4.22 146 118 A 12 VAL HGy% A 12 VAL H 1.0 . 3.02 147 119 A 12 VAL HB A 12 VAL H 1.0 . 3.16 148 120 A 13 TYR H A 12 VAL H 1.0 . 3.08 149 121 A 35 SER HA A 36 SER H 1.0 . 3.17 150 122 A 36 SER H A 35 SER HBx 1.0 . 3.44 151 122 A 35 SER HBy A 36 SER H 1.0 . 3.44 152 123 A 6 THR HG2% A 6 THR H 1.0 . 3.70 153 124 A 5 THR H A 6 THR H 1.0 . 4.18 154 125 A 17 LEU H A 16 ILE HB 1.0 . 3.47 155 126 A 18 ALA H A 17 LEU H 1.0 . 3.50 156 127 A 17 LEU H A 17 LEU HBx 1.0 . 2.93 157 127 A 17 LEU H A 17 LEU HBy 1.0 . 2.93 158 128 A 26 ALA H A 25 VAL H 1.0 . 2.94 159 129 A 26 ALA H A 25 VAL HGy% 1.0 . 3.99 160 130 A 26 ALA H A 25 VAL HB 1.0 . 3.68 161 131 A 26 ALA H A 26 ALA HB% 1.0 . 3.09 162 132 A 26 ALA H A 25 VAL HGx% 1.0 . 3.80 163 133 A 28 ILE H A 28 ILE HD1% 1.0 . 3.62 164 134 A 28 ILE H A 28 ILE HG1x 1.0 . 4.10 165 135 A 28 ILE H A 29 ALA H 1.0 . 3.73 166 136 A 28 ILE H A 28 ILE HG1y 1.0 . 4.10 167 137 A 28 ILE H A 28 ILE HB 1.0 . 3.77 168 138 A 8 ASN H A 8 ASN HD2x 1.0 . 4.95 169 138 A 8 ASN H A 8 ASN HD2y 1.0 . 4.95 170 139 A 8 ASN HA A 8 ASN HD2x 1.0 . 4.47 171 139 A 8 ASN HD2y A 8 ASN HA 1.0 . 4.47 172 140 A 10 ILE HD1% A 8 ASN HD2x 1.0 . 4.54 173 140 A 10 ILE HD1% A 8 ASN HD2y 1.0 . 4.54 174 141 A 9 LEU H A 9 LEU HDy% 1.0 . 3.80 175 141 A 9 LEU H A 9 LEU HDx% 1.0 . 3.80 176 142 A 10 ILE H A 10 ILE HG1x 1.0 . 3.07 177 142 A 10 ILE H A 10 ILE HG1y 1.0 . 3.07 178 143 A 16 ILE H A 15 SER HBy 1.0 . 3.63 179 143 A 16 ILE H A 15 SER HBx 1.0 . 3.63 180 144 A 17 LEU H A 16 ILE HG1y 1.0 . 3.95 181 144 A 17 LEU H A 16 ILE HG1x 1.0 . 3.95 182 145 A 17 LEU H A 17 LEU HDx% 1.0 . 2.38 183 145 A 17 LEU H A 17 LEU HDy% 1.0 . 2.38 184 146 A 18 ALA H A 17 LEU HDx% 1.0 . 3.85 185 146 A 18 ALA H A 17 LEU HDy% 1.0 . 3.85 186 147 A 24 LEU H A 24 LEU HBy 1.0 . 3.03 187 147 A 24 LEU H A 24 LEU HBx 1.0 . 3.03 188 148 A 32 ARG H A 32 ARG HDx 1.0 . 4.33 189 148 A 32 ARG H A 32 ARG HDy 1.0 . 4.33 190 149 A 34 ASN H A 34 ASN HD2x 1.0 . 4.39 191 149 A 34 ASN H A 34 ASN HD2y 1.0 . 4.39 192 150 A 34 ASN HA A 34 ASN HD2x 1.0 . 4.64 193 150 A 34 ASN HD2y A 34 ASN HA 1.0 . 4.64 194 151 A 40 LYS H A 40 LYS HBx 1.0 . 4.64 195 151 A 40 LYS H A 40 LYS HBy 1.0 . 4.64 196 152 A 27 TYR HD% A 28 ILE HD1% 1.0 . 3.96 197 153 A 28 ILE HD1% A 24 LEU HA 1.0 . 4.38 198 154 A 25 VAL HA A 28 ILE HD1% 1.0 . 3.21 199 155 A 28 ILE HD1% A 29 ALA H 1.0 . 4.01 200 156 A 16 ILE HG2% A 13 TYR HA 1.0 . 3.89 201 157 A 16 ILE HG2% A 17 LEU HA 1.0 . 3.18 202 158 A 13 TYR HD% A 12 VAL HGy% 1.0 . 4.02 203 159 A 12 VAL HB A 9 LEU HA 1.0 . 3.94 204 160 A 20 VAL HB A 17 LEU HA 1.0 . 3.87 205 161 A 10 ILE HB A 11 PRO HDy 1.0 . 3.53 206 162 A 24 LEU HA A 27 TYR HBx 1.0 . 3.49 207 162 A 27 TYR HBy A 24 LEU HA 1.0 . 3.49 208 163 A 16 ILE HD1% A 13 TYR HA 1.0 . 3.32 209 164 A 19 ALA HA A 22 VAL HB 1.0 . 3.84 210 165 A 15 SER HA A 18 ALA HB% 1.0 . 3.36 211 166 A 21 VAL HA A 24 LEU HBy 1.0 . 3.74 212 167 A 30 PHE HA A 33 TRP HBx 1.0 . 3.88 213 167 A 33 TRP HBy A 30 PHE HA 1.0 . 3.88 214 168 A 21 VAL HA A 24 LEU HDx% 1.0 . 3.28 215 168 A 21 VAL HA A 24 LEU HDy% 1.0 . 3.28 216 169 A 29 ALA HA A 32 ARG HBx 1.0 . 3.96 217 169 A 32 ARG HBy A 29 ALA HA 1.0 . 3.96 218 170 A 12 VAL HB A 9 LEU HDy% 1.0 . 3.50 219 171 A 21 VAL HB A 18 ALA HA 1.0 . 3.75 220 172 A 25 VAL HB A 22 VAL HA 1.0 . 3.74 221 173 A 13 TYR HA A 16 ILE HB 1.0 . 4.15 222 174 A 21 VAL HA A 24 LEU HBx 1.0 . 4.16 223 175 A 6 THR HA A 10 ILE HD1% 1.0 . 4.17 224 176 A 29 ALA HB% A 26 ALA HA 1.0 . 2.61 225 177 A 14 ALA HA A 17 LEU HBx 1.0 . 3.18 226 177 A 17 LEU HBy A 14 ALA HA 1.0 . 3.18 227 178 A 26 ALA HB% A 23 GLY HAy 1.0 . 3.34 228 179 A 28 ILE HA A 31 LYS HBx 1.0 . 4.01 229 179 A 31 LYS HBy A 28 ILE HA 1.0 . 4.01 230 180 A 19 ALA HB% A 16 ILE HA 1.0 . 3.05 231 181 A 25 VAL HA A 28 ILE HB 1.0 . 3.73 232 182 A 25 VAL HGx% A 26 ALA HA 1.0 . 3.51 233 183 A 14 ALA HB% A 11 PRO HA 1.0 . 2.99 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 8 ASN C A 9 LEU N A 9 LEU CA A 9 LEU C 1.0 -96.5 -56.5 PHI 2 2 A 9 LEU N A 9 LEU CA A 9 LEU C A 10 ILE N 1.0 -55.3 -4.3 PSI 3 3 A 9 LEU C A 10 ILE N A 10 ILE CA A 10 ILE C 1.0 -90.0 -20.0 PHI 4 4 A 11 PRO N A 11 PRO CA A 11 PRO C A 12 VAL N 1.0 -56.1 -16.1 PSI 5 5 A 11 PRO C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -88.8 -48.8 PHI 6 6 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 TYR N 1.0 -62.0 -22.0 PSI 7 7 A 12 VAL C A 13 TYR N A 13 TYR CA A 13 TYR C 1.0 -84.8 -44.8 PHI 8 8 A 13 TYR N A 13 TYR CA A 13 TYR C A 14 ALA N 1.0 -57.7 -17.7 PSI 9 9 A 13 TYR C A 14 ALA N A 14 ALA CA A 14 ALA C 1.0 -84.0 -44.0 PHI 10 10 A 14 ALA N A 14 ALA CA A 14 ALA C A 15 SER N 1.0 -60.6 -20.6 PSI 11 11 A 14 ALA C A 15 SER N A 15 SER CA A 15 SER C 1.0 -86.5 -46.5 PHI 12 12 A 15 SER N A 15 SER CA A 15 SER C A 16 ILE N 1.0 -61.8 -21.8 PSI 13 13 A 15 SER C A 16 ILE N A 16 ILE CA A 16 ILE C 1.0 -83.8 -43.8 PHI 14 14 A 16 ILE N A 16 ILE CA A 16 ILE C A 17 LEU N 1.0 -64.0 -24.0 PSI 15 15 A 16 ILE C A 17 LEU N A 17 LEU CA A 17 LEU C 1.0 -82.8 -42.8 PHI 16 16 A 17 LEU N A 17 LEU CA A 17 LEU C A 18 ALA N 1.0 -62.7 -22.7 PSI 17 17 A 17 LEU C A 18 ALA N A 18 ALA CA A 18 ALA C 1.0 -83.0 -43.0 PHI 18 18 A 18 ALA N A 18 ALA CA A 18 ALA C A 19 ALA N 1.0 -62.2 -22.2 PSI 19 19 A 18 ALA C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -85.6 -45.6 PHI 20 20 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 VAL N 1.0 -60.8 -20.8 PSI 21 21 A 19 ALA C A 20 VAL N A 20 VAL CA A 20 VAL C 1.0 -84.8 -44.8 PHI 22 22 A 20 VAL N A 20 VAL CA A 20 VAL C A 21 VAL N 1.0 -63.2 -23.2 PSI 23 23 A 20 VAL C A 21 VAL N A 21 VAL CA A 21 VAL C 1.0 -82.6 -42.6 PHI 24 24 A 21 VAL N A 21 VAL CA A 21 VAL C A 22 VAL N 1.0 -65.3 -25.3 PSI 25 25 A 21 VAL C A 22 VAL N A 22 VAL CA A 22 VAL C 1.0 -81.9 -41.9 PHI 26 26 A 22 VAL N A 22 VAL CA A 22 VAL C A 23 GLY N 1.0 -63.4 -23.4 PSI 27 27 A 22 VAL C A 23 GLY N A 23 GLY CA A 23 GLY C 1.0 -83.5 -43.5 PHI 28 28 A 23 GLY N A 23 GLY CA A 23 GLY C A 24 LEU N 1.0 -62.6 -22.6 PSI 29 29 A 23 GLY C A 24 LEU N A 24 LEU CA A 24 LEU C 1.0 -85.2 -45.2 PHI 30 30 A 24 LEU N A 24 LEU CA A 24 LEU C A 25 VAL N 1.0 -62.5 -22.5 PSI 31 31 A 24 LEU C A 25 VAL N A 25 VAL CA A 25 VAL C 1.0 -83.1 -43.1 PHI 32 32 A 25 VAL N A 25 VAL CA A 25 VAL C A 26 ALA N 1.0 -64.0 -24.0 PSI 33 33 A 25 VAL C A 26 ALA N A 26 ALA CA A 26 ALA C 1.0 -83.6 -43.6 PHI 34 34 A 26 ALA N A 26 ALA CA A 26 ALA C A 27 TYR N 1.0 -59.3 -19.3 PSI 35 35 A 26 ALA C A 27 TYR N A 27 TYR CA A 27 TYR C 1.0 -80.1 -40.1 PHI 36 36 A 27 TYR N A 27 TYR CA A 27 TYR C A 28 ILE N 1.0 -66.6 -26.6 PSI 37 37 A 27 TYR C A 28 ILE N A 28 ILE CA A 28 ILE C 1.0 -84.0 -44.0 PHI 38 38 A 28 ILE N A 28 ILE CA A 28 ILE C A 29 ALA N 1.0 -63.4 -23.4 PSI 39 39 A 28 ILE C A 29 ALA N A 29 ALA CA A 29 ALA C 1.0 -84.0 -44.0 PHI 40 40 A 29 ALA N A 29 ALA CA A 29 ALA C A 30 PHE N 1.0 -60.7 -20.7 PSI 41 41 A 29 ALA C A 30 PHE N A 30 PHE CA A 30 PHE C 1.0 -84.9 -44.9 PHI 42 42 A 30 PHE N A 30 PHE CA A 30 PHE C A 31 LYS N 1.0 -63.0 -23.0 PSI 43 43 A 30 PHE C A 31 LYS N A 31 LYS CA A 31 LYS C 1.0 -86.9 -46.9 PHI 44 44 A 31 LYS N A 31 LYS CA A 31 LYS C A 32 ARG N 1.0 -58.4 -18.4 PSI 45 45 A 31 LYS C A 32 ARG N A 32 ARG CA A 32 ARG C 1.0 -85.5 -45.5 PHI 46 46 A 32 ARG N A 32 ARG CA A 32 ARG C A 33 TRP N 1.0 -59.9 -19.9 PSI 47 47 A 32 ARG C A 33 TRP N A 33 TRP CA A 33 TRP C 1.0 -86.0 -46.0 PHI 48 48 A 33 TRP N A 33 TRP CA A 33 TRP C A 34 ASN N 1.0 -62.1 -22.1 PSI 49 49 A 33 TRP C A 34 ASN N A 34 ASN CA A 34 ASN C 1.0 -86.6 -46.6 PHI 50 50 A 34 ASN N A 34 ASN CA A 34 ASN C A 35 SER N 1.0 -51.4 -11.4 PSI 51 51 A 34 ASN C A 35 SER N A 35 SER CA A 35 SER C 1.0 -92.7 -52.7 PHI 52 52 A 35 SER N A 35 SER CA A 35 SER C A 36 SER N 1.0 -42.0 -2.0 PSI 53 53 A 28 ILE N A 28 ILE CA A 28 ILE CB A 28 ILE CG1 1.0 -90.0 -30.0 CHI1 54 54 A 16 ILE N A 16 ILE CA A 16 ILE CB A 16 ILE CG1 1.0 -90.0 -30.0 CHI1 55 55 A 12 VAL N A 12 VAL CA A 12 VAL CB A 12 VAL CG1 1.0 150.0 210.0 CHI1 56 56 A 20 VAL N A 20 VAL CA A 20 VAL CB A 20 VAL CG1 1.0 150.0 210.0 CHI1 57 57 A 21 VAL N A 21 VAL CA A 21 VAL CB A 21 VAL CG1 1.0 150.0 210.0 CHI1 58 58 A 22 VAL N A 22 VAL CA A 22 VAL CB A 22 VAL CG1 1.0 150.0 210.0 CHI1 59 59 A 25 VAL N A 25 VAL CA A 25 VAL CB A 25 VAL CG1 1.0 150.0 210.0 CHI1 60 60 A 1 MET N A 1 MET CA A 1 MET C A 2 THR N 1.0 -68.0 178.0 PSI 61 61 A 1 MET N A 1 MET CA A 1 MET C A 2 THR N 1.0 32.0 48.0 PSI 62 62 A 1 MET N A 1 MET CA A 1 MET C A 2 THR N 1.0 102.0 178.0 PSI 63 63 A 1 MET N A 1 MET CA A 1 MET C A 2 THR N 1.0 -258.0 18.0 PSI 64 64 A 1 MET N A 1 MET CA A 1 MET C A 2 THR N 1.0 -168.0 88.0 PSI 65 65 A 1 MET N A 1 MET CA A 1 MET C A 2 THR N 1.0 -38.0 248.0 PSI 66 66 A 1 MET N A 1 MET CA A 1 MET C A 2 THR N 1.0 -208.0 68.0 PSI 67 67 A 1 MET C A 2 THR N A 2 THR CA A 2 THR C 1.0 -168.0 68.0 PHI 68 68 A 1 MET C A 2 THR N A 2 THR CA A 2 THR C 1.0 -248.0 -32.0 PHI 69 69 A 1 MET C A 2 THR N A 2 THR CA A 2 THR C 1.0 -118.0 68.0 PHI 70 70 A 1 MET C A 2 THR N A 2 THR CA A 2 THR C 1.0 52.0 68.0 PHI 71 71 A 1 MET C A 2 THR N A 2 THR CA A 2 THR C 1.0 -208.0 -52.0 PHI 72 72 A 1 MET C A 2 THR N A 2 THR CA A 2 THR C 1.0 -98.0 208.0 PHI 73 73 A 1 MET C A 2 THR N A 2 THR CA A 2 THR C 1.0 -158.0 178.0 PHI 74 74 A 2 THR N A 2 THR CA A 2 THR C A 3 ARG N 1.0 -68.0 178.0 PSI 75 75 A 2 THR N A 2 THR CA A 2 THR C A 3 ARG N 1.0 32.0 48.0 PSI 76 76 A 2 THR N A 2 THR CA A 2 THR C A 3 ARG N 1.0 102.0 178.0 PSI 77 77 A 2 THR N A 2 THR CA A 2 THR C A 3 ARG N 1.0 -258.0 18.0 PSI 78 78 A 2 THR N A 2 THR CA A 2 THR C A 3 ARG N 1.0 -168.0 88.0 PSI 79 79 A 2 THR N A 2 THR CA A 2 THR C A 3 ARG N 1.0 -38.0 248.0 PSI 80 80 A 2 THR N A 2 THR CA A 2 THR C A 3 ARG N 1.0 -208.0 68.0 PSI 81 81 A 2 THR C A 3 ARG N A 3 ARG CA A 3 ARG C 1.0 -168.0 68.0 PHI 82 82 A 2 THR C A 3 ARG N A 3 ARG CA A 3 ARG C 1.0 -248.0 -32.0 PHI 83 83 A 2 THR C A 3 ARG N A 3 ARG CA A 3 ARG C 1.0 -118.0 68.0 PHI 84 84 A 2 THR C A 3 ARG N A 3 ARG CA A 3 ARG C 1.0 52.0 68.0 PHI 85 85 A 2 THR C A 3 ARG N A 3 ARG CA A 3 ARG C 1.0 -208.0 -52.0 PHI 86 86 A 2 THR C A 3 ARG N A 3 ARG CA A 3 ARG C 1.0 -98.0 208.0 PHI 87 87 A 2 THR C A 3 ARG N A 3 ARG CA A 3 ARG C 1.0 -158.0 178.0 PHI 88 88 A 3 ARG N A 3 ARG CA A 3 ARG C A 4 GLY N 1.0 -68.0 178.0 PSI 89 89 A 3 ARG N A 3 ARG CA A 3 ARG C A 4 GLY N 1.0 32.0 48.0 PSI 90 90 A 3 ARG N A 3 ARG CA A 3 ARG C A 4 GLY N 1.0 102.0 178.0 PSI 91 91 A 3 ARG N A 3 ARG CA A 3 ARG C A 4 GLY N 1.0 -258.0 18.0 PSI 92 92 A 3 ARG N A 3 ARG CA A 3 ARG C A 4 GLY N 1.0 -168.0 88.0 PSI 93 93 A 3 ARG N A 3 ARG CA A 3 ARG C A 4 GLY N 1.0 -38.0 248.0 PSI 94 94 A 3 ARG N A 3 ARG CA A 3 ARG C A 4 GLY N 1.0 -208.0 68.0 PSI 95 95 A 4 GLY C A 5 THR N A 5 THR CA A 5 THR C 1.0 -168.0 68.0 PHI 96 96 A 4 GLY C A 5 THR N A 5 THR CA A 5 THR C 1.0 -248.0 -32.0 PHI 97 97 A 4 GLY C A 5 THR N A 5 THR CA A 5 THR C 1.0 -118.0 68.0 PHI 98 98 A 4 GLY C A 5 THR N A 5 THR CA A 5 THR C 1.0 52.0 68.0 PHI 99 99 A 4 GLY C A 5 THR N A 5 THR CA A 5 THR C 1.0 -208.0 -52.0 PHI 100 100 A 4 GLY C A 5 THR N A 5 THR CA A 5 THR C 1.0 -98.0 208.0 PHI 101 101 A 4 GLY C A 5 THR N A 5 THR CA A 5 THR C 1.0 -158.0 178.0 PHI 102 102 A 5 THR N A 5 THR CA A 5 THR C A 6 THR N 1.0 -68.0 178.0 PSI 103 103 A 5 THR N A 5 THR CA A 5 THR C A 6 THR N 1.0 32.0 48.0 PSI 104 104 A 5 THR N A 5 THR CA A 5 THR C A 6 THR N 1.0 102.0 178.0 PSI 105 105 A 5 THR N A 5 THR CA A 5 THR C A 6 THR N 1.0 -258.0 18.0 PSI 106 106 A 5 THR N A 5 THR CA A 5 THR C A 6 THR N 1.0 -168.0 88.0 PSI 107 107 A 5 THR N A 5 THR CA A 5 THR C A 6 THR N 1.0 -38.0 248.0 PSI 108 108 A 5 THR N A 5 THR CA A 5 THR C A 6 THR N 1.0 -208.0 68.0 PSI 109 109 A 5 THR C A 6 THR N A 6 THR CA A 6 THR C 1.0 -168.0 68.0 PHI 110 110 A 5 THR C A 6 THR N A 6 THR CA A 6 THR C 1.0 -248.0 -32.0 PHI 111 111 A 5 THR C A 6 THR N A 6 THR CA A 6 THR C 1.0 -118.0 68.0 PHI 112 112 A 5 THR C A 6 THR N A 6 THR CA A 6 THR C 1.0 52.0 68.0 PHI 113 113 A 5 THR C A 6 THR N A 6 THR CA A 6 THR C 1.0 -208.0 -52.0 PHI 114 114 A 5 THR C A 6 THR N A 6 THR CA A 6 THR C 1.0 -98.0 208.0 PHI 115 115 A 5 THR C A 6 THR N A 6 THR CA A 6 THR C 1.0 -158.0 178.0 PHI 116 116 A 6 THR N A 6 THR CA A 6 THR C A 7 ASP N 1.0 -68.0 178.0 PSI 117 117 A 6 THR N A 6 THR CA A 6 THR C A 7 ASP N 1.0 32.0 48.0 PSI 118 118 A 6 THR N A 6 THR CA A 6 THR C A 7 ASP N 1.0 102.0 178.0 PSI 119 119 A 6 THR N A 6 THR CA A 6 THR C A 7 ASP N 1.0 -258.0 18.0 PSI 120 120 A 6 THR N A 6 THR CA A 6 THR C A 7 ASP N 1.0 -168.0 88.0 PSI 121 121 A 6 THR N A 6 THR CA A 6 THR C A 7 ASP N 1.0 -38.0 248.0 PSI 122 122 A 6 THR N A 6 THR CA A 6 THR C A 7 ASP N 1.0 -208.0 68.0 PSI 123 123 A 6 THR C A 7 ASP N A 7 ASP CA A 7 ASP C 1.0 -168.0 68.0 PHI 124 124 A 6 THR C A 7 ASP N A 7 ASP CA A 7 ASP C 1.0 -248.0 -32.0 PHI 125 125 A 6 THR C A 7 ASP N A 7 ASP CA A 7 ASP C 1.0 -118.0 68.0 PHI 126 126 A 6 THR C A 7 ASP N A 7 ASP CA A 7 ASP C 1.0 52.0 68.0 PHI 127 127 A 6 THR C A 7 ASP N A 7 ASP CA A 7 ASP C 1.0 -208.0 -52.0 PHI 128 128 A 6 THR C A 7 ASP N A 7 ASP CA A 7 ASP C 1.0 -98.0 208.0 PHI 129 129 A 6 THR C A 7 ASP N A 7 ASP CA A 7 ASP C 1.0 -158.0 178.0 PHI 130 130 A 7 ASP N A 7 ASP CA A 7 ASP C A 8 ASN N 1.0 -68.0 178.0 PSI 131 131 A 7 ASP N A 7 ASP CA A 7 ASP C A 8 ASN N 1.0 32.0 48.0 PSI 132 132 A 7 ASP N A 7 ASP CA A 7 ASP C A 8 ASN N 1.0 102.0 178.0 PSI 133 133 A 7 ASP N A 7 ASP CA A 7 ASP C A 8 ASN N 1.0 -258.0 18.0 PSI 134 134 A 7 ASP N A 7 ASP CA A 7 ASP C A 8 ASN N 1.0 -168.0 88.0 PSI 135 135 A 7 ASP N A 7 ASP CA A 7 ASP C A 8 ASN N 1.0 -38.0 248.0 PSI 136 136 A 7 ASP N A 7 ASP CA A 7 ASP C A 8 ASN N 1.0 -208.0 68.0 PSI 137 137 A 7 ASP C A 8 ASN N A 8 ASN CA A 8 ASN C 1.0 -168.0 68.0 PHI 138 138 A 7 ASP C A 8 ASN N A 8 ASN CA A 8 ASN C 1.0 -248.0 -32.0 PHI 139 139 A 7 ASP C A 8 ASN N A 8 ASN CA A 8 ASN C 1.0 -118.0 68.0 PHI 140 140 A 7 ASP C A 8 ASN N A 8 ASN CA A 8 ASN C 1.0 52.0 68.0 PHI 141 141 A 7 ASP C A 8 ASN N A 8 ASN CA A 8 ASN C 1.0 -208.0 -52.0 PHI 142 142 A 7 ASP C A 8 ASN N A 8 ASN CA A 8 ASN C 1.0 -98.0 208.0 PHI 143 143 A 7 ASP C A 8 ASN N A 8 ASN CA A 8 ASN C 1.0 -158.0 178.0 PHI 144 144 A 8 ASN N A 8 ASN CA A 8 ASN C A 9 LEU N 1.0 -68.0 178.0 PSI 145 145 A 8 ASN N A 8 ASN CA A 8 ASN C A 9 LEU N 1.0 32.0 48.0 PSI 146 146 A 8 ASN N A 8 ASN CA A 8 ASN C A 9 LEU N 1.0 102.0 178.0 PSI 147 147 A 8 ASN N A 8 ASN CA A 8 ASN C A 9 LEU N 1.0 -258.0 18.0 PSI 148 148 A 8 ASN N A 8 ASN CA A 8 ASN C A 9 LEU N 1.0 -168.0 88.0 PSI 149 149 A 8 ASN N A 8 ASN CA A 8 ASN C A 9 LEU N 1.0 -38.0 248.0 PSI 150 150 A 8 ASN N A 8 ASN CA A 8 ASN C A 9 LEU N 1.0 -208.0 68.0 PSI 151 151 A 35 SER C A 36 SER N A 36 SER CA A 36 SER C 1.0 -168.0 68.0 PHI 152 152 A 35 SER C A 36 SER N A 36 SER CA A 36 SER C 1.0 -248.0 -32.0 PHI 153 153 A 35 SER C A 36 SER N A 36 SER CA A 36 SER C 1.0 -118.0 68.0 PHI 154 154 A 35 SER C A 36 SER N A 36 SER CA A 36 SER C 1.0 52.0 68.0 PHI 155 155 A 35 SER C A 36 SER N A 36 SER CA A 36 SER C 1.0 -208.0 -52.0 PHI 156 156 A 35 SER C A 36 SER N A 36 SER CA A 36 SER C 1.0 -98.0 208.0 PHI 157 157 A 35 SER C A 36 SER N A 36 SER CA A 36 SER C 1.0 -158.0 178.0 PHI 158 158 A 36 SER N A 36 SER CA A 36 SER C A 37 LYS N 1.0 -68.0 178.0 PSI 159 159 A 36 SER N A 36 SER CA A 36 SER C A 37 LYS N 1.0 32.0 48.0 PSI 160 160 A 36 SER N A 36 SER CA A 36 SER C A 37 LYS N 1.0 102.0 178.0 PSI 161 161 A 36 SER N A 36 SER CA A 36 SER C A 37 LYS N 1.0 -258.0 18.0 PSI 162 162 A 36 SER N A 36 SER CA A 36 SER C A 37 LYS N 1.0 -168.0 88.0 PSI 163 163 A 36 SER N A 36 SER CA A 36 SER C A 37 LYS N 1.0 -38.0 248.0 PSI 164 164 A 36 SER N A 36 SER CA A 36 SER C A 37 LYS N 1.0 -208.0 68.0 PSI 165 165 A 36 SER C A 37 LYS N A 37 LYS CA A 37 LYS C 1.0 -168.0 68.0 PHI 166 166 A 36 SER C A 37 LYS N A 37 LYS CA A 37 LYS C 1.0 -248.0 -32.0 PHI 167 167 A 36 SER C A 37 LYS N A 37 LYS CA A 37 LYS C 1.0 -118.0 68.0 PHI 168 168 A 36 SER C A 37 LYS N A 37 LYS CA A 37 LYS C 1.0 52.0 68.0 PHI 169 169 A 36 SER C A 37 LYS N A 37 LYS CA A 37 LYS C 1.0 -208.0 -52.0 PHI 170 170 A 36 SER C A 37 LYS N A 37 LYS CA A 37 LYS C 1.0 -98.0 208.0 PHI 171 171 A 36 SER C A 37 LYS N A 37 LYS CA A 37 LYS C 1.0 -158.0 178.0 PHI 172 172 A 37 LYS N A 37 LYS CA A 37 LYS C A 38 GLN N 1.0 -68.0 178.0 PSI 173 173 A 37 LYS N A 37 LYS CA A 37 LYS C A 38 GLN N 1.0 32.0 48.0 PSI 174 174 A 37 LYS N A 37 LYS CA A 37 LYS C A 38 GLN N 1.0 102.0 178.0 PSI 175 175 A 37 LYS N A 37 LYS CA A 37 LYS C A 38 GLN N 1.0 -258.0 18.0 PSI 176 176 A 37 LYS N A 37 LYS CA A 37 LYS C A 38 GLN N 1.0 -168.0 88.0 PSI 177 177 A 37 LYS N A 37 LYS CA A 37 LYS C A 38 GLN N 1.0 -38.0 248.0 PSI 178 178 A 37 LYS N A 37 LYS CA A 37 LYS C A 38 GLN N 1.0 -208.0 68.0 PSI 179 179 A 37 LYS C A 38 GLN N A 38 GLN CA A 38 GLN C 1.0 -168.0 68.0 PHI 180 180 A 37 LYS C A 38 GLN N A 38 GLN CA A 38 GLN C 1.0 -248.0 -32.0 PHI 181 181 A 37 LYS C A 38 GLN N A 38 GLN CA A 38 GLN C 1.0 -118.0 68.0 PHI 182 182 A 37 LYS C A 38 GLN N A 38 GLN CA A 38 GLN C 1.0 52.0 68.0 PHI 183 183 A 37 LYS C A 38 GLN N A 38 GLN CA A 38 GLN C 1.0 -208.0 -52.0 PHI 184 184 A 37 LYS C A 38 GLN N A 38 GLN CA A 38 GLN C 1.0 -98.0 208.0 PHI 185 185 A 37 LYS C A 38 GLN N A 38 GLN CA A 38 GLN C 1.0 -158.0 178.0 PHI 186 186 A 38 GLN N A 38 GLN CA A 38 GLN C A 39 ASN N 1.0 -68.0 178.0 PSI 187 187 A 38 GLN N A 38 GLN CA A 38 GLN C A 39 ASN N 1.0 32.0 48.0 PSI 188 188 A 38 GLN N A 38 GLN CA A 38 GLN C A 39 ASN N 1.0 102.0 178.0 PSI 189 189 A 38 GLN N A 38 GLN CA A 38 GLN C A 39 ASN N 1.0 -258.0 18.0 PSI 190 190 A 38 GLN N A 38 GLN CA A 38 GLN C A 39 ASN N 1.0 -168.0 88.0 PSI 191 191 A 38 GLN N A 38 GLN CA A 38 GLN C A 39 ASN N 1.0 -38.0 248.0 PSI 192 192 A 38 GLN N A 38 GLN CA A 38 GLN C A 39 ASN N 1.0 -208.0 68.0 PSI 193 193 A 38 GLN C A 39 ASN N A 39 ASN CA A 39 ASN C 1.0 -168.0 68.0 PHI 194 194 A 38 GLN C A 39 ASN N A 39 ASN CA A 39 ASN C 1.0 -248.0 -32.0 PHI 195 195 A 38 GLN C A 39 ASN N A 39 ASN CA A 39 ASN C 1.0 -118.0 68.0 PHI 196 196 A 38 GLN C A 39 ASN N A 39 ASN CA A 39 ASN C 1.0 52.0 68.0 PHI 197 197 A 38 GLN C A 39 ASN N A 39 ASN CA A 39 ASN C 1.0 -208.0 -52.0 PHI 198 198 A 38 GLN C A 39 ASN N A 39 ASN CA A 39 ASN C 1.0 -98.0 208.0 PHI 199 199 A 38 GLN C A 39 ASN N A 39 ASN CA A 39 ASN C 1.0 -158.0 178.0 PHI 200 200 A 39 ASN N A 39 ASN CA A 39 ASN C A 40 LYS N 1.0 -68.0 178.0 PSI 201 201 A 39 ASN N A 39 ASN CA A 39 ASN C A 40 LYS N 1.0 32.0 48.0 PSI 202 202 A 39 ASN N A 39 ASN CA A 39 ASN C A 40 LYS N 1.0 102.0 178.0 PSI 203 203 A 39 ASN N A 39 ASN CA A 39 ASN C A 40 LYS N 1.0 -258.0 18.0 PSI 204 204 A 39 ASN N A 39 ASN CA A 39 ASN C A 40 LYS N 1.0 -168.0 88.0 PSI 205 205 A 39 ASN N A 39 ASN CA A 39 ASN C A 40 LYS N 1.0 -38.0 248.0 PSI 206 206 A 39 ASN N A 39 ASN CA A 39 ASN C A 40 LYS N 1.0 -208.0 68.0 PSI 207 207 A 39 ASN C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 -168.0 68.0 PHI 208 208 A 39 ASN C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 -248.0 -32.0 PHI 209 209 A 39 ASN C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 -118.0 68.0 PHI 210 210 A 39 ASN C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 52.0 68.0 PHI 211 211 A 39 ASN C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 -208.0 -52.0 PHI 212 212 A 39 ASN C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 -98.0 208.0 PHI 213 213 A 39 ASN C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 -158.0 178.0 PHI 214 214 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 GLN N 1.0 -68.0 178.0 PSI 215 215 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 GLN N 1.0 32.0 48.0 PSI 216 216 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 GLN N 1.0 102.0 178.0 PSI 217 217 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 GLN N 1.0 -258.0 18.0 PSI 218 218 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 GLN N 1.0 -168.0 88.0 PSI 219 219 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 GLN N 1.0 -38.0 248.0 PSI 220 220 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 GLN N 1.0 -208.0 68.0 PSI 221 221 A 40 LYS C A 41 GLN N A 41 GLN CA A 41 GLN C 1.0 -168.0 68.0 PHI 222 222 A 40 LYS C A 41 GLN N A 41 GLN CA A 41 GLN C 1.0 -248.0 -32.0 PHI 223 223 A 40 LYS C A 41 GLN N A 41 GLN CA A 41 GLN C 1.0 -118.0 68.0 PHI 224 224 A 40 LYS C A 41 GLN N A 41 GLN CA A 41 GLN C 1.0 52.0 68.0 PHI 225 225 A 40 LYS C A 41 GLN N A 41 GLN CA A 41 GLN C 1.0 -208.0 -52.0 PHI 226 226 A 40 LYS C A 41 GLN N A 41 GLN CA A 41 GLN C 1.0 -98.0 208.0 PHI 227 227 A 40 LYS C A 41 GLN N A 41 GLN CA A 41 GLN C 1.0 -158.0 178.0 PHI stop_ save_