EXPDTA THEORETICAL MODEL, MODELLER 9.19 2017/10/25 12:14:06 REMARK 6 MODELLER OBJECTIVE FUNCTION: 73.1313 REMARK 6 MODELLER BEST TEMPLATE % SEQ ID: 41.667 REMARK 6 SEQUENCE: model REMARK 6 ALIGNMENT: alignment.pir REMARK 6 DOPE score: -1458.11707 REMARK 6 GA341 score: 0.77750 REMARK 6 Normalized DOPE score: -0.25986 REMARK 6 TEMPLATE: 1llmC01 101:C - 124:C MODELS 1: - 24: AT 41.7% ATOM 1 N GLU 314 -4.510 41.463 55.909 1.00 47.31 N ATOM 2 CA GLU 314 -4.096 42.416 54.854 1.00 47.31 C ATOM 3 CB GLU 314 -4.935 43.698 54.935 1.00 47.31 C ATOM 4 CG GLU 314 -6.392 43.478 54.517 1.00 47.31 C ATOM 5 CD GLU 314 -7.124 44.807 54.631 1.00 47.31 C ATOM 6 OE1 GLU 314 -6.530 45.761 55.204 1.00 47.31 O ATOM 7 OE2 GLU 314 -8.282 44.893 54.147 1.00 47.31 O ATOM 8 C GLU 314 -2.651 42.771 54.962 1.00 47.31 C ATOM 9 O GLU 314 -1.791 42.045 54.467 1.00 47.31 O ATOM 10 N LYS 315 -2.336 43.914 55.601 1.00 78.76 N ATOM 11 CA LYS 315 -0.953 44.269 55.726 1.00 78.76 C ATOM 12 CB LYS 315 -0.655 45.655 55.136 1.00 78.76 C ATOM 13 CG LYS 315 -0.776 45.675 53.610 1.00 78.76 C ATOM 14 CD LYS 315 -0.959 47.071 53.011 1.00 78.76 C ATOM 15 CE LYS 315 -2.414 47.549 53.036 1.00 78.76 C ATOM 16 NZ LYS 315 -2.534 48.864 52.373 1.00 78.76 N ATOM 17 C LYS 315 -0.623 44.289 57.183 1.00 78.76 C ATOM 18 O LYS 315 -0.746 45.303 57.865 1.00 78.76 O ATOM 19 N PRO 316 -0.219 43.143 57.655 1.00 83.86 N ATOM 20 CA PRO 316 0.143 42.957 59.031 1.00 83.86 C ATOM 21 CD PRO 316 -0.625 41.897 57.033 1.00 83.86 C ATOM 22 CB PRO 316 0.021 41.456 59.308 1.00 83.86 C ATOM 23 CG PRO 316 -0.011 40.805 57.915 1.00 83.86 C ATOM 24 C PRO 316 1.473 43.505 59.428 1.00 83.86 C ATOM 25 O PRO 316 1.731 43.579 60.628 1.00 83.86 O ATOM 26 N PHE 317 2.350 43.879 58.483 1.00116.84 N ATOM 27 CA PHE 317 3.647 44.271 58.947 1.00116.84 C ATOM 28 CB PHE 317 4.780 43.627 58.136 1.00116.84 C ATOM 29 CG PHE 317 4.608 42.157 58.327 1.00116.84 C ATOM 30 CD1 PHE 317 5.203 41.516 59.388 1.00116.84 C ATOM 31 CD2 PHE 317 3.830 41.419 57.460 1.00116.84 C ATOM 32 CE1 PHE 317 5.047 40.163 59.573 1.00116.84 C ATOM 33 CE2 PHE 317 3.668 40.064 57.639 1.00116.84 C ATOM 34 CZ PHE 317 4.277 39.433 58.696 1.00116.84 C ATOM 35 C PHE 317 3.760 45.753 58.861 1.00116.84 C ATOM 36 O PHE 317 3.555 46.337 57.799 1.00116.84 O ATOM 37 N ILE 318 4.116 46.402 59.989 1.00 92.74 N ATOM 38 CA ILE 318 4.170 47.833 59.995 1.00 92.74 C ATOM 39 CB ILE 318 3.279 48.475 61.019 0.50 92.74 C ATOM 40 CG1 ILE 318 3.744 48.090 62.433 1.00 92.74 C ATOM 41 CG2 ILE 318 1.824 48.080 60.710 1.00 92.74 C ATOM 42 CD1 ILE 318 3.138 48.951 63.542 1.00 92.74 C ATOM 43 C ILE 318 5.560 48.277 60.317 1.00 92.74 C ATOM 44 O ILE 318 6.268 47.659 61.112 1.00 92.74 O ATOM 45 N CYS 319 5.983 49.377 59.664 1.00 40.31 N ATOM 46 CA CYS 319 7.264 49.967 59.901 1.00 40.31 C ATOM 47 CB CYS 319 7.725 50.863 58.738 1.00 40.31 C ATOM 48 SG CYS 319 9.321 51.679 59.031 1.00 40.31 S ATOM 49 C CYS 319 7.104 50.824 61.113 1.00 40.31 C ATOM 50 O CYS 319 6.183 51.633 61.204 1.00 40.31 O ATOM 51 N THR 320 8.004 50.642 62.091 1.00108.33 N ATOM 52 CA THR 320 7.909 51.350 63.332 1.00108.33 C ATOM 53 CB THR 320 8.974 50.933 64.300 1.00108.33 C ATOM 54 OG1 THR 320 10.251 51.284 63.793 1.00108.33 O ATOM 55 CG2 THR 320 8.895 49.410 64.494 1.00108.33 C ATOM 56 C THR 320 8.096 52.815 63.107 1.00108.33 C ATOM 57 O THR 320 7.407 53.639 63.709 1.00108.33 O ATOM 58 N GLN 321 9.087 53.181 62.273 1.00 57.64 N ATOM 59 CA GLN 321 9.388 54.572 62.109 1.00 57.64 C ATOM 60 CB GLN 321 10.730 54.753 61.383 1.00 57.64 C ATOM 61 CG GLN 321 11.883 54.160 62.197 1.00 57.64 C ATOM 62 CD GLN 321 13.156 54.167 61.363 1.00 57.64 C ATOM 63 OE1 GLN 321 14.242 53.894 61.871 1.00 57.64 O ATOM 64 NE2 GLN 321 13.026 54.475 60.044 1.00 57.64 N ATOM 65 C GLN 321 8.315 55.322 61.370 1.00 57.64 C ATOM 66 O GLN 321 7.761 56.287 61.896 1.00 57.64 O ATOM 67 N CYS 322 8.000 54.904 60.125 1.00 55.81 N ATOM 68 CA CYS 322 7.002 55.567 59.327 1.00 55.81 C ATOM 69 CB CYS 322 7.141 55.276 57.822 1.00 55.81 C ATOM 70 SG CYS 322 6.997 53.520 57.392 1.00 55.81 S ATOM 71 C CYS 322 5.618 55.217 59.776 1.00 55.81 C ATOM 72 O CYS 322 4.740 56.077 59.831 1.00 55.81 O ATOM 73 N GLY 323 5.383 53.935 60.116 1.00 23.68 N ATOM 74 CA GLY 323 4.080 53.520 60.553 1.00 23.68 C ATOM 75 C GLY 323 3.305 52.964 59.395 1.00 23.68 C ATOM 76 O GLY 323 2.138 52.607 59.546 1.00 23.68 O ATOM 77 N LYS 324 3.927 52.873 58.203 1.00 65.96 N ATOM 78 CA LYS 324 3.216 52.349 57.072 1.00 65.96 C ATOM 79 CB LYS 324 3.860 52.696 55.716 1.00 65.96 C ATOM 80 CG LYS 324 2.913 52.479 54.533 1.00 65.96 C ATOM 81 CD LYS 324 3.312 53.247 53.270 1.00 65.96 C ATOM 82 CE LYS 324 3.876 52.372 52.152 1.00 65.96 C ATOM 83 NZ LYS 324 4.091 53.196 50.939 1.00 65.96 N ATOM 84 C LYS 324 3.134 50.859 57.212 1.00 65.96 C ATOM 85 O LYS 324 3.987 50.235 57.841 1.00 65.96 O ATOM 86 N SER 325 2.076 50.253 56.631 1.00 34.56 N ATOM 87 CA SER 325 1.877 48.835 56.753 1.00 34.56 C ATOM 88 CB SER 325 0.450 48.462 57.186 1.00 34.56 C ATOM 89 OG SER 325 0.193 48.964 58.490 1.00 34.56 O ATOM 90 C SER 325 2.123 48.204 55.420 1.00 34.56 C ATOM 91 O SER 325 1.901 48.813 54.376 1.00 34.56 O ATOM 92 N PHE 326 2.609 46.944 55.433 1.00 56.17 N ATOM 93 CA PHE 326 2.922 46.261 54.212 1.00 56.17 C ATOM 94 CB PHE 326 4.438 46.135 53.977 1.00 56.17 C ATOM 95 CG PHE 326 5.004 47.512 53.835 1.00 56.17 C ATOM 96 CD1 PHE 326 5.376 48.241 54.944 1.00 56.17 C ATOM 97 CD2 PHE 326 5.161 48.077 52.592 1.00 56.17 C ATOM 98 CE1 PHE 326 5.899 49.510 54.811 1.00 56.17 C ATOM 99 CE2 PHE 326 5.685 49.341 52.454 1.00 56.17 C ATOM 100 CZ PHE 326 6.051 50.063 53.564 1.00 56.17 C ATOM 101 C PHE 326 2.358 44.872 54.268 1.00 56.17 C ATOM 102 O PHE 326 2.223 44.272 55.334 1.00 56.17 O ATOM 103 N SER 327 1.997 44.339 53.084 1.00 74.82 N ATOM 104 CA SER 327 1.428 43.027 52.949 1.00 74.82 C ATOM 105 CB SER 327 0.866 42.759 51.544 1.00 74.82 C ATOM 106 OG SER 327 0.333 41.446 51.482 1.00 74.82 O ATOM 107 C SER 327 2.469 41.981 53.201 1.00 74.82 C ATOM 108 O SER 327 2.138 40.873 53.623 1.00 74.82 O ATOM 109 N GLN 328 3.758 42.282 52.938 1.00 46.89 N ATOM 110 CA GLN 328 4.717 41.229 53.096 1.00 46.89 C ATOM 111 CB GLN 328 5.334 40.782 51.762 1.00 46.89 C ATOM 112 CG GLN 328 4.281 40.251 50.786 1.00 46.89 C ATOM 113 CD GLN 328 4.986 39.828 49.510 1.00 46.89 C ATOM 114 OE1 GLN 328 4.439 39.941 48.413 1.00 46.89 O ATOM 115 NE2 GLN 328 6.236 39.315 49.656 1.00 46.89 N ATOM 116 C GLN 328 5.826 41.655 54.011 1.00 46.89 C ATOM 117 O GLN 328 6.265 42.803 54.000 1.00 46.89 O ATOM 118 N SER 329 6.304 40.701 54.836 1.00 69.27 N ATOM 119 CA SER 329 7.327 40.928 55.818 1.00 69.27 C ATOM 120 CB SER 329 7.567 39.697 56.705 1.00 69.27 C ATOM 121 OG SER 329 8.587 39.971 57.653 1.00 69.27 O ATOM 122 C SER 329 8.636 41.257 55.162 1.00 69.27 C ATOM 123 O SER 329 9.363 42.132 55.629 1.00 69.27 O ATOM 124 N SER 330 8.976 40.560 54.064 1.00 56.28 N ATOM 125 CA SER 330 10.241 40.809 53.433 1.00 56.28 C ATOM 126 CB SER 330 10.520 39.883 52.234 1.00 56.28 C ATOM 127 OG SER 330 11.783 40.190 51.659 1.00 56.28 O ATOM 128 C SER 330 10.236 42.210 52.922 1.00 56.28 C ATOM 129 O SER 330 11.250 42.907 52.973 1.00 56.28 O ATOM 130 N SER 331 9.068 42.652 52.420 1.00 57.52 N ATOM 131 CA SER 331 8.928 43.964 51.866 1.00 57.52 C ATOM 132 CB SER 331 7.530 44.206 51.276 1.00 57.52 C ATOM 133 OG SER 331 7.446 45.519 50.741 1.00 57.52 O ATOM 134 C SER 331 9.146 44.963 52.953 1.00 57.52 C ATOM 135 O SER 331 9.706 46.030 52.713 1.00 57.52 O ATOM 136 N LEU 332 8.697 44.650 54.182 1.00 34.00 N ATOM 137 CA LEU 332 8.872 45.566 55.269 1.00 34.00 C ATOM 138 CB LEU 332 8.235 45.075 56.582 0.50 34.00 C ATOM 139 CG LEU 332 8.444 46.048 57.755 0.50 34.00 C ATOM 140 CD1 LEU 332 7.774 47.403 57.478 0.50 34.00 C ATOM 141 CD2 LEU 332 8.003 45.418 59.085 0.50 34.00 C ATOM 142 C LEU 332 10.335 45.735 55.525 1.00 34.00 C ATOM 143 O LEU 332 10.816 46.848 55.731 1.00 34.00 O ATOM 144 N ASN 333 11.096 44.628 55.488 1.00 26.63 N ATOM 145 CA ASN 333 12.494 44.708 55.791 1.00 26.63 C ATOM 146 CB ASN 333 13.198 43.342 55.730 1.00 26.63 C ATOM 147 CG ASN 333 12.684 42.478 56.877 1.00 26.63 C ATOM 148 OD1 ASN 333 12.360 42.975 57.955 1.00 26.63 O ATOM 149 ND2 ASN 333 12.617 41.141 56.640 1.00 26.63 N ATOM 150 C ASN 333 13.173 45.606 54.804 1.00 26.63 C ATOM 151 O ASN 333 13.958 46.474 55.182 1.00 26.63 O ATOM 152 N TYR 334 12.870 45.437 53.504 1.00 83.89 N ATOM 153 CA TYR 334 13.511 46.213 52.480 1.00 83.89 C ATOM 154 CB TYR 334 13.052 45.813 51.066 1.00 83.89 C ATOM 155 CG TYR 334 13.661 46.795 50.131 1.00 83.89 C ATOM 156 CD1 TYR 334 14.951 46.625 49.691 1.00 83.89 C ATOM 157 CD2 TYR 334 12.941 47.889 49.702 1.00 83.89 C ATOM 158 CE1 TYR 334 15.519 47.533 48.831 1.00 83.89 C ATOM 159 CE2 TYR 334 13.506 48.798 48.840 1.00 83.89 C ATOM 160 CZ TYR 334 14.797 48.622 48.404 1.00 83.89 C ATOM 161 OH TYR 334 15.385 49.552 47.521 1.00 83.89 O ATOM 162 C TYR 334 13.166 47.657 52.671 1.00 83.89 C ATOM 163 O TYR 334 14.019 48.535 52.576 1.00 83.89 O ATOM 164 N HIS 335 11.890 47.930 52.985 1.00 45.16 N ATOM 165 CA HIS 335 11.424 49.279 53.098 1.00 45.16 C ATOM 166 ND1 HIS 335 9.026 51.530 52.483 1.00 45.16 N ATOM 167 CG HIS 335 9.434 50.770 53.556 1.00 45.16 C ATOM 168 CB HIS 335 9.930 49.360 53.455 1.00 45.16 C ATOM 169 NE2 HIS 335 8.815 52.812 54.289 1.00 45.16 N ATOM 170 CD2 HIS 335 9.297 51.566 54.651 1.00 45.16 C ATOM 171 CE1 HIS 335 8.667 52.742 52.977 1.00 45.16 C ATOM 172 C HIS 335 12.172 50.004 54.168 1.00 45.16 C ATOM 173 O HIS 335 12.554 51.158 53.981 1.00 45.16 O ATOM 174 N MET 336 12.427 49.352 55.316 1.00 74.11 N ATOM 175 CA MET 336 13.039 50.073 56.393 1.00 74.11 C ATOM 176 CB MET 336 13.244 49.227 57.666 1.00 74.11 C ATOM 177 CG MET 336 13.763 50.051 58.847 1.00 74.11 C ATOM 178 SD MET 336 13.598 49.256 60.474 1.00 74.11 S ATOM 179 CE MET 336 14.828 47.958 60.166 1.00 74.11 C ATOM 180 C MET 336 14.370 50.606 55.963 1.00 74.11 C ATOM 181 O MET 336 14.675 51.771 56.213 1.00 74.11 O ATOM 182 N LYS 337 15.201 49.792 55.285 1.00 78.49 N ATOM 183 CA LYS 337 16.470 50.336 54.890 1.00 78.49 C ATOM 184 CB LYS 337 17.553 49.291 54.566 1.00 78.49 C ATOM 185 CG LYS 337 18.912 49.942 54.290 1.00 78.49 C ATOM 186 CD LYS 337 20.098 48.972 54.263 1.00 78.49 C ATOM 187 CE LYS 337 20.468 48.405 55.637 1.00 78.49 C ATOM 188 NZ LYS 337 21.619 47.487 55.500 1.00 78.49 N ATOM 189 C LYS 337 16.244 51.149 53.620 1.00 78.49 C ATOM 190 O LYS 337 17.221 51.794 53.152 1.00 78.49 O ATOM 191 OXT LYS 337 15.097 51.130 53.097 1.00 78.49 O