EXPDTA THEORETICAL MODEL, MODELLER 9.19 2017/10/25 12:18:11 REMARK 6 MODELLER OBJECTIVE FUNCTION: 88.1828 REMARK 6 MODELLER BEST TEMPLATE % SEQ ID: 52.174 REMARK 6 SEQUENCE: model REMARK 6 ALIGNMENT: alignment.pir REMARK 6 DOPE score: -1578.45166 REMARK 6 GA341 score: 0.93944 REMARK 6 Normalized DOPE score: 0.02741 REMARK 6 TEMPLATE: 2i13A02 75:A - 97:A MODELS 1: - 23: AT 52.2% ATOM 1 N GLU 287 -25.426 29.270 47.224 1.00 61.29 N ATOM 2 CA GLU 287 -24.739 29.822 48.414 1.00 61.29 C ATOM 3 CB GLU 287 -25.246 29.153 49.698 1.00 61.29 C ATOM 4 CG GLU 287 -26.707 29.450 50.019 1.00 61.29 C ATOM 5 CD GLU 287 -27.008 28.767 51.342 1.00 61.29 C ATOM 6 OE1 GLU 287 -26.784 29.409 52.401 1.00 61.29 O ATOM 7 OE2 GLU 287 -27.448 27.585 51.313 1.00 61.29 O ATOM 8 C GLU 287 -23.276 29.548 48.341 1.00 61.29 C ATOM 9 O GLU 287 -22.692 29.509 47.259 1.00 61.29 O ATOM 10 N LYS 288 -22.649 29.376 49.522 1.00 98.28 N ATOM 11 CA LYS 288 -21.250 29.064 49.608 1.00 98.28 C ATOM 12 CB LYS 288 -20.448 30.190 50.262 1.00 98.28 C ATOM 13 CG LYS 288 -20.633 31.558 49.609 1.00 98.28 C ATOM 14 CD LYS 288 -20.210 32.691 50.541 1.00 98.28 C ATOM 15 CE LYS 288 -20.919 32.624 51.894 1.00 98.28 C ATOM 16 NZ LYS 288 -20.224 33.479 52.880 1.00 98.28 N ATOM 17 C LYS 288 -21.129 27.907 50.561 1.00 98.28 C ATOM 18 O LYS 288 -21.169 28.092 51.777 1.00 98.28 O ATOM 19 N PRO 289 -20.996 26.719 50.048 1.00110.60 N ATOM 20 CA PRO 289 -20.874 25.561 50.899 1.00110.60 C ATOM 21 CD PRO 289 -21.701 26.407 48.814 1.00110.60 C ATOM 22 CB PRO 289 -21.244 24.364 50.028 1.00110.60 C ATOM 23 CG PRO 289 -22.173 24.956 48.957 1.00110.60 C ATOM 24 C PRO 289 -19.571 25.372 51.618 1.00110.60 C ATOM 25 O PRO 289 -19.562 24.633 52.603 1.00110.60 O ATOM 26 N PHE 290 -18.460 25.988 51.163 1.00 66.02 N ATOM 27 CA PHE 290 -17.218 25.672 51.814 1.00 66.02 C ATOM 28 CB PHE 290 -16.061 25.397 50.832 1.00 66.02 C ATOM 29 CG PHE 290 -16.366 24.071 50.214 1.00 66.02 C ATOM 30 CD1 PHE 290 -15.953 22.915 50.834 1.00 66.02 C ATOM 31 CD2 PHE 290 -17.074 23.969 49.037 1.00 66.02 C ATOM 32 CE1 PHE 290 -16.224 21.681 50.293 1.00 66.02 C ATOM 33 CE2 PHE 290 -17.350 22.736 48.489 1.00 66.02 C ATOM 34 CZ PHE 290 -16.927 21.587 49.115 1.00 66.02 C ATOM 35 C PHE 290 -16.826 26.763 52.760 1.00 66.02 C ATOM 36 O PHE 290 -16.727 27.930 52.388 1.00 66.02 O ATOM 37 N THR 291 -16.573 26.371 54.029 1.00 37.01 N ATOM 38 CA THR 291 -16.249 27.307 55.067 1.00 37.01 C ATOM 39 CB THR 291 -17.073 27.112 56.313 1.00 37.01 C ATOM 40 OG1 THR 291 -18.458 27.216 56.019 1.00 37.01 O ATOM 41 CG2 THR 291 -16.676 28.172 57.353 1.00 37.01 C ATOM 42 C THR 291 -14.827 27.092 55.488 1.00 37.01 C ATOM 43 O THR 291 -14.376 25.958 55.645 1.00 37.01 O ATOM 44 N CYS 292 -14.073 28.199 55.665 1.00 92.90 N ATOM 45 CA CYS 292 -12.721 28.087 56.128 1.00 92.90 C ATOM 46 CB CYS 292 -11.811 29.268 55.747 1.00 92.90 C ATOM 47 SG CYS 292 -12.299 30.820 56.546 1.00 92.90 S ATOM 48 C CYS 292 -12.750 27.961 57.619 1.00 92.90 C ATOM 49 O CYS 292 -13.508 28.633 58.318 1.00 92.90 O ATOM 50 N ILE 293 -11.893 27.074 58.146 1.00 90.92 N ATOM 51 CA ILE 293 -11.867 26.801 59.549 1.00 90.92 C ATOM 52 CB ILE 293 -10.907 25.701 59.874 1.00 90.92 C ATOM 53 CG1 ILE 293 -11.341 24.413 59.152 1.00 90.92 C ATOM 54 CG2 ILE 293 -10.849 25.563 61.403 1.00 90.92 C ATOM 55 CD1 ILE 293 -12.729 23.926 59.568 1.00 90.92 C ATOM 56 C ILE 293 -11.443 28.018 60.317 1.00 90.92 C ATOM 57 O ILE 293 -12.020 28.332 61.359 1.00 90.92 O ATOM 58 N GLN 294 -10.388 28.717 59.851 1.00103.66 N ATOM 59 CA GLN 294 -9.879 29.814 60.632 1.00103.66 C ATOM 60 CB GLN 294 -8.553 30.362 60.073 1.00103.66 C ATOM 61 CG GLN 294 -7.391 29.374 60.173 1.00103.66 C ATOM 62 CD GLN 294 -6.944 29.323 61.627 1.00103.66 C ATOM 63 OE1 GLN 294 -6.679 30.351 62.250 1.00103.66 O ATOM 64 NE2 GLN 294 -6.866 28.086 62.186 1.00103.66 N ATOM 65 C GLN 294 -10.812 30.991 60.700 1.00103.66 C ATOM 66 O GLN 294 -11.246 31.379 61.785 1.00103.66 O ATOM 67 N CYS 295 -11.118 31.594 59.527 1.00107.63 N ATOM 68 CA CYS 295 -11.911 32.798 59.431 1.00107.63 C ATOM 69 CB CYS 295 -11.878 33.464 58.044 1.00107.63 C ATOM 70 SG CYS 295 -10.219 33.790 57.395 1.00107.63 S ATOM 71 C CYS 295 -13.361 32.525 59.643 1.00107.63 C ATOM 72 O CYS 295 -14.053 33.247 60.359 1.00107.63 O ATOM 73 N GLY 296 -13.857 31.454 58.998 1.00 31.76 N ATOM 74 CA GLY 296 -15.258 31.174 59.003 1.00 31.76 C ATOM 75 C GLY 296 -15.834 31.739 57.736 1.00 31.76 C ATOM 76 O GLY 296 -17.042 31.673 57.515 1.00 31.76 O ATOM 77 N LYS 297 -14.979 32.323 56.868 1.00 86.77 N ATOM 78 CA LYS 297 -15.442 32.887 55.629 1.00 86.77 C ATOM 79 CB LYS 297 -14.387 33.786 54.956 1.00 86.77 C ATOM 80 CG LYS 297 -14.927 34.585 53.771 1.00 86.77 C ATOM 81 CD LYS 297 -14.100 35.827 53.431 1.00 86.77 C ATOM 82 CE LYS 297 -12.668 35.535 52.988 1.00 86.77 C ATOM 83 NZ LYS 297 -11.977 36.808 52.673 1.00 86.77 N ATOM 84 C LYS 297 -15.814 31.753 54.720 1.00 86.77 C ATOM 85 O LYS 297 -15.175 30.702 54.737 1.00 86.77 O ATOM 86 N SER 298 -16.867 31.936 53.891 1.00 88.22 N ATOM 87 CA SER 298 -17.327 30.822 53.103 1.00 88.22 C ATOM 88 CB SER 298 -18.790 30.452 53.396 1.00 88.22 C ATOM 89 OG SER 298 -19.087 29.174 52.860 1.00 88.22 O ATOM 90 C SER 298 -17.182 31.135 51.640 1.00 88.22 C ATOM 91 O SER 298 -17.164 32.298 51.239 1.00 88.22 O ATOM 92 N PHE 299 -17.069 30.086 50.794 1.00 66.93 N ATOM 93 CA PHE 299 -16.807 30.307 49.398 1.00 66.93 C ATOM 94 CB PHE 299 -15.356 29.975 49.020 1.00 66.93 C ATOM 95 CG PHE 299 -14.452 30.935 49.715 1.00 66.93 C ATOM 96 CD1 PHE 299 -14.114 32.129 49.118 1.00 66.93 C ATOM 97 CD2 PHE 299 -13.943 30.638 50.962 1.00 66.93 C ATOM 98 CE1 PHE 299 -13.278 33.014 49.752 1.00 66.93 C ATOM 99 CE2 PHE 299 -13.105 31.524 51.601 1.00 66.93 C ATOM 100 CZ PHE 299 -12.771 32.712 50.991 1.00 66.93 C ATOM 101 C PHE 299 -17.674 29.431 48.543 1.00 66.93 C ATOM 102 O PHE 299 -18.181 28.399 48.979 1.00 66.93 O ATOM 103 N ASN 300 -17.862 29.868 47.279 1.00 98.16 N ATOM 104 CA ASN 300 -18.642 29.206 46.272 1.00 98.16 C ATOM 105 CB ASN 300 -18.698 29.995 44.953 1.00 98.16 C ATOM 106 CG ASN 300 -19.362 31.341 45.187 1.00 98.16 C ATOM 107 OD1 ASN 300 -20.514 31.423 45.609 1.00 98.16 O ATOM 108 ND2 ASN 300 -18.597 32.431 44.905 1.00 98.16 N ATOM 109 C ASN 300 -17.973 27.926 45.888 1.00 98.16 C ATOM 110 O ASN 300 -18.639 26.917 45.661 1.00 98.16 O ATOM 111 N PHE 301 -16.629 27.944 45.786 1.00103.07 N ATOM 112 CA PHE 301 -15.966 26.788 45.257 1.00103.07 C ATOM 113 CB PHE 301 -15.239 27.064 43.930 1.00103.07 C ATOM 114 CG PHE 301 -16.214 27.624 42.953 1.00103.07 C ATOM 115 CD1 PHE 301 -16.943 26.800 42.125 1.00103.07 C ATOM 116 CD2 PHE 301 -16.393 28.987 42.871 1.00103.07 C ATOM 117 CE1 PHE 301 -17.840 27.332 41.228 1.00103.07 C ATOM 118 CE2 PHE 301 -17.286 29.526 41.978 1.00103.07 C ATOM 119 CZ PHE 301 -18.004 28.696 41.151 1.00103.07 C ATOM 120 C PHE 301 -14.896 26.337 46.199 1.00103.07 C ATOM 121 O PHE 301 -14.305 27.124 46.936 1.00103.07 O ATOM 122 N SER 302 -14.605 25.023 46.162 1.00 62.55 N ATOM 123 CA SER 302 -13.594 24.457 47.004 1.00 62.55 C ATOM 124 CB SER 302 -13.495 22.929 46.886 1.00 62.55 C ATOM 125 OG SER 302 -12.462 22.446 47.732 1.00 62.55 O ATOM 126 C SER 302 -12.263 25.015 46.610 1.00 62.55 C ATOM 127 O SER 302 -11.411 25.255 47.464 1.00 62.55 O ATOM 128 N SER 303 -12.060 25.246 45.297 1.00 29.10 N ATOM 129 CA SER 303 -10.796 25.698 44.786 1.00 29.10 C ATOM 130 CB SER 303 -10.796 25.854 43.255 1.00 29.10 C ATOM 131 OG SER 303 -11.633 26.934 42.868 1.00 29.10 O ATOM 132 C SER 303 -10.469 27.033 45.373 1.00 29.10 C ATOM 133 O SER 303 -9.332 27.278 45.775 1.00 29.10 O ATOM 134 N ASN 304 -11.464 27.936 45.437 1.00 31.12 N ATOM 135 CA ASN 304 -11.230 29.246 45.968 1.00 31.12 C ATOM 136 CB ASN 304 -12.445 30.180 45.817 1.00 31.12 C ATOM 137 CG ASN 304 -12.566 30.541 44.345 1.00 31.12 C ATOM 138 OD1 ASN 304 -11.576 30.873 43.697 1.00 31.12 O ATOM 139 ND2 ASN 304 -13.807 30.470 43.797 1.00 31.12 N ATOM 140 C ASN 304 -10.898 29.128 47.425 1.00 31.12 C ATOM 141 O ASN 304 -10.008 29.815 47.923 1.00 31.12 O ATOM 142 N LEU 305 -11.595 28.238 48.153 1.00 49.86 N ATOM 143 CA LEU 305 -11.347 28.118 49.560 1.00 49.86 C ATOM 144 CB LEU 305 -12.257 27.093 50.252 1.00 49.86 C ATOM 145 CG LEU 305 -11.976 26.976 51.763 1.00 49.86 C ATOM 146 CD1 LEU 305 -12.249 28.301 52.488 1.00 49.86 C ATOM 147 CD2 LEU 305 -12.746 25.806 52.387 1.00 49.86 C ATOM 148 C LEU 305 -9.942 27.660 49.767 1.00 49.86 C ATOM 149 O LEU 305 -9.252 28.127 50.672 1.00 49.86 O ATOM 150 N TYR 306 -9.465 26.736 48.918 1.00130.69 N ATOM 151 CA TYR 306 -8.145 26.200 49.091 1.00130.69 C ATOM 152 CB TYR 306 -7.793 25.147 48.032 1.00130.69 C ATOM 153 CG TYR 306 -6.458 24.627 48.420 1.00130.69 C ATOM 154 CD1 TYR 306 -6.371 23.640 49.371 1.00130.69 C ATOM 155 CD2 TYR 306 -5.309 25.125 47.852 1.00130.69 C ATOM 156 CE1 TYR 306 -5.149 23.145 49.752 1.00130.69 C ATOM 157 CE2 TYR 306 -4.082 24.631 48.230 1.00130.69 C ATOM 158 CZ TYR 306 -4.004 23.641 49.180 1.00130.69 C ATOM 159 OH TYR 306 -2.749 23.131 49.573 1.00130.69 O ATOM 160 C TYR 306 -7.152 27.314 48.970 1.00130.69 C ATOM 161 O TYR 306 -6.225 27.424 49.773 1.00130.69 O ATOM 162 N ARG 307 -7.341 28.187 47.966 1.00107.83 N ATOM 163 CA ARG 307 -6.446 29.286 47.746 1.00107.83 C ATOM 164 CB ARG 307 -6.859 30.137 46.536 1.00107.83 C ATOM 165 CG ARG 307 -5.942 31.326 46.264 1.00107.83 C ATOM 166 CD ARG 307 -6.445 32.195 45.111 1.00107.83 C ATOM 167 NE ARG 307 -7.577 33.011 45.635 1.00107.83 N ATOM 168 CZ ARG 307 -8.420 33.672 44.787 1.00107.83 C ATOM 169 NH1 ARG 307 -8.257 33.588 43.435 1.00107.83 N ATOM 170 NH2 ARG 307 -9.439 34.417 45.302 1.00107.83 N ATOM 171 C ARG 307 -6.481 30.168 48.953 1.00107.83 C ATOM 172 O ARG 307 -5.448 30.657 49.407 1.00107.83 O ATOM 173 N HIS 308 -7.687 30.384 49.507 1.00 39.34 N ATOM 174 CA HIS 308 -7.837 31.223 50.657 1.00 39.34 C ATOM 175 ND1 HIS 308 -9.491 33.618 52.206 1.00 39.34 N ATOM 176 CG HIS 308 -9.538 32.242 52.274 1.00 39.34 C ATOM 177 CB HIS 308 -9.307 31.341 51.098 1.00 39.34 C ATOM 178 NE2 HIS 308 -9.988 33.101 54.312 1.00 39.34 N ATOM 179 CD2 HIS 308 -9.843 31.943 53.567 1.00 39.34 C ATOM 180 CE1 HIS 308 -9.768 34.079 53.450 1.00 39.34 C ATOM 181 C HIS 308 -7.075 30.630 51.791 1.00 39.34 C ATOM 182 O HIS 308 -6.322 31.332 52.462 1.00 39.34 O ATOM 183 N MET 309 -7.236 29.314 52.022 1.00 36.86 N ATOM 184 CA MET 309 -6.563 28.696 53.124 1.00 36.86 C ATOM 185 CB MET 309 -6.785 27.177 53.200 1.00 36.86 C ATOM 186 CG MET 309 -8.217 26.771 53.556 1.00 36.86 C ATOM 187 SD MET 309 -8.489 24.976 53.576 1.00 36.86 S ATOM 188 CE MET 309 -10.218 25.067 54.117 1.00 36.86 C ATOM 189 C MET 309 -5.070 28.942 52.971 1.00 36.86 C ATOM 190 O MET 309 -4.531 29.783 53.741 1.00 36.86 O ATOM 191 OXT MET 309 -4.446 28.297 52.088 1.00 36.86 O