EXPDTA THEORETICAL MODEL, MODELLER 9.19 2017/10/25 12:19:15 REMARK 6 MODELLER OBJECTIVE FUNCTION: 99.6717 REMARK 6 MODELLER BEST TEMPLATE % SEQ ID: 51.724 REMARK 6 SEQUENCE: model REMARK 6 ALIGNMENT: alignment.pir REMARK 6 DOPE score: -1835.78467 REMARK 6 GA341 score: 0.99993 REMARK 6 Normalized DOPE score: -1.40419 REMARK 6 TEMPLATE: 1llmC01 101:C - 129:C MODELS 1: - 29: AT 51.7% ATOM 1 N GLU 371 2.660 32.156 62.004 1.00 51.09 N ATOM 2 CA GLU 371 2.396 33.609 61.963 1.00 51.09 C ATOM 3 CB GLU 371 1.736 34.053 63.285 1.00 51.09 C ATOM 4 CG GLU 371 0.355 33.420 63.511 1.00 51.09 C ATOM 5 CD GLU 371 -0.236 33.951 64.814 1.00 51.09 C ATOM 6 OE1 GLU 371 0.408 34.830 65.444 1.00 51.09 O ATOM 7 OE2 GLU 371 -1.346 33.487 65.193 1.00 51.09 O ATOM 8 C GLU 371 3.683 34.339 61.771 1.00 51.09 C ATOM 9 O GLU 371 4.585 33.861 61.084 1.00 51.09 O ATOM 10 N LYS 372 3.793 35.549 62.342 1.00121.74 N ATOM 11 CA LYS 372 5.024 36.270 62.205 1.00121.74 C ATOM 12 CB LYS 372 4.853 37.561 61.390 1.00121.74 C ATOM 13 CG LYS 372 3.419 38.090 61.418 1.00121.74 C ATOM 14 CD LYS 372 3.251 39.386 60.627 1.00121.74 C ATOM 15 CE LYS 372 1.834 39.599 60.092 1.00121.74 C ATOM 16 NZ LYS 372 1.131 40.621 60.896 1.00121.74 N ATOM 17 C LYS 372 5.606 36.494 63.563 1.00121.74 C ATOM 18 O LYS 372 5.287 37.419 64.314 1.00121.74 O ATOM 19 N PRO 373 6.469 35.556 63.837 1.00 84.71 N ATOM 20 CA PRO 373 7.194 35.409 65.068 1.00 84.71 C ATOM 21 CD PRO 373 6.595 34.393 62.979 1.00 84.71 C ATOM 22 CB PRO 373 7.775 33.991 65.036 1.00 84.71 C ATOM 23 CG PRO 373 7.789 33.615 63.545 1.00 84.71 C ATOM 24 C PRO 373 8.256 36.424 65.353 1.00 84.71 C ATOM 25 O PRO 373 8.645 36.525 66.516 1.00 84.71 O ATOM 26 N PHE 374 8.771 37.166 64.353 1.00117.41 N ATOM 27 CA PHE 374 9.894 37.994 64.693 1.00117.41 C ATOM 28 CB PHE 374 11.073 37.858 63.713 1.00117.41 C ATOM 29 CG PHE 374 11.482 36.434 63.822 1.00117.41 C ATOM 30 CD1 PHE 374 12.284 36.015 64.857 1.00117.41 C ATOM 31 CD2 PHE 374 11.027 35.517 62.906 1.00117.41 C ATOM 32 CE1 PHE 374 12.644 34.693 64.962 1.00117.41 C ATOM 33 CE2 PHE 374 11.384 34.195 63.006 1.00117.41 C ATOM 34 CZ PHE 374 12.195 33.781 64.036 1.00117.41 C ATOM 35 C PHE 374 9.473 39.423 64.751 1.00117.41 C ATOM 36 O PHE 374 9.008 39.986 63.760 1.00117.41 O ATOM 37 N THR 375 9.675 40.050 65.930 1.00104.36 N ATOM 38 CA THR 375 9.244 41.398 66.147 1.00104.36 C ATOM 39 CB THR 375 8.430 41.558 67.400 0.50104.36 C ATOM 40 OG1 THR 375 7.890 42.869 67.480 1.00104.36 O ATOM 41 CG2 THR 375 9.344 41.278 68.608 1.00104.36 C ATOM 42 C THR 375 10.433 42.297 66.282 1.00104.36 C ATOM 43 O THR 375 11.458 41.944 66.870 1.00104.36 O ATOM 44 N CYS 376 10.302 43.509 65.708 1.00 35.80 N ATOM 45 CA CYS 376 11.315 44.515 65.785 1.00 35.80 C ATOM 46 CB CYS 376 11.262 45.520 64.619 1.00 35.80 C ATOM 47 SG CYS 376 12.547 46.801 64.732 1.00 35.80 S ATOM 48 C CYS 376 11.067 45.261 67.052 1.00 35.80 C ATOM 49 O CYS 376 9.948 45.689 67.337 1.00 35.80 O ATOM 50 N THR 377 12.133 45.420 67.852 1.00107.76 N ATOM 51 CA THR 377 12.081 46.061 69.132 1.00107.76 C ATOM 52 CB THR 377 13.410 46.001 69.827 1.00107.76 C ATOM 53 OG1 THR 377 13.311 46.553 71.130 1.00107.76 O ATOM 54 CG2 THR 377 14.453 46.768 68.993 1.00107.76 C ATOM 55 C THR 377 11.712 47.505 68.981 1.00107.76 C ATOM 56 O THR 377 10.971 48.043 69.805 1.00107.76 O ATOM 57 N GLN 378 12.249 48.185 67.947 1.00103.64 N ATOM 58 CA GLN 378 12.008 49.596 67.847 1.00103.64 C ATOM 59 CB GLN 378 12.825 50.242 66.709 1.00103.64 C ATOM 60 CG GLN 378 14.324 49.909 66.713 1.00103.64 C ATOM 61 CD GLN 378 14.997 50.474 67.956 1.00103.64 C ATOM 62 OE1 GLN 378 16.207 50.339 68.131 1.00103.64 O ATOM 63 NE2 GLN 378 14.208 51.129 68.847 1.00103.64 N ATOM 64 C GLN 378 10.561 49.901 67.553 1.00103.64 C ATOM 65 O GLN 378 9.877 50.515 68.372 1.00103.64 O ATOM 66 N CYS 379 10.069 49.471 66.363 1.00 62.27 N ATOM 67 CA CYS 379 8.720 49.699 65.897 1.00 62.27 C ATOM 68 CB CYS 379 8.594 49.611 64.363 1.00 62.27 C ATOM 69 SG CYS 379 9.117 48.016 63.670 1.00 62.27 S ATOM 70 C CYS 379 7.717 48.770 66.522 1.00 62.27 C ATOM 71 O CYS 379 6.588 49.161 66.813 1.00 62.27 O ATOM 72 N GLY 380 8.098 47.495 66.733 1.00 24.81 N ATOM 73 CA GLY 380 7.182 46.544 67.296 1.00 24.81 C ATOM 74 C GLY 380 6.473 45.804 66.194 1.00 24.81 C ATOM 75 O GLY 380 5.573 45.008 66.459 1.00 24.81 O ATOM 76 N LYS 381 6.857 46.038 64.924 1.00 62.01 N ATOM 77 CA LYS 381 6.229 45.357 63.824 1.00 62.01 C ATOM 78 CB LYS 381 6.572 45.973 62.453 1.00 62.01 C ATOM 79 CG LYS 381 5.725 45.434 61.298 1.00 62.01 C ATOM 80 CD LYS 381 5.837 46.261 60.013 1.00 62.01 C ATOM 81 CE LYS 381 4.939 45.773 58.871 1.00 62.01 C ATOM 82 NZ LYS 381 3.630 46.467 58.904 1.00 62.01 N ATOM 83 C LYS 381 6.695 43.928 63.832 1.00 62.01 C ATOM 84 O LYS 381 7.803 43.630 64.273 1.00 62.01 O ATOM 85 N SER 382 5.841 42.999 63.344 1.00 38.14 N ATOM 86 CA SER 382 6.177 41.598 63.359 1.00 38.14 C ATOM 87 CB SER 382 5.073 40.708 63.961 1.00 38.14 C ATOM 88 OG SER 382 4.929 40.981 65.347 1.00 38.14 O ATOM 89 C SER 382 6.398 41.145 61.950 1.00 38.14 C ATOM 90 O SER 382 5.787 41.663 61.018 1.00 38.14 O ATOM 91 N PHE 383 7.300 40.156 61.763 1.00 53.20 N ATOM 92 CA PHE 383 7.611 39.702 60.437 1.00 53.20 C ATOM 93 CB PHE 383 9.018 40.118 59.979 1.00 53.20 C ATOM 94 CG PHE 383 9.069 41.608 59.974 1.00 53.20 C ATOM 95 CD1 PHE 383 9.386 42.305 61.119 1.00 53.20 C ATOM 96 CD2 PHE 383 8.795 42.314 58.826 1.00 53.20 C ATOM 97 CE1 PHE 383 9.436 43.679 61.124 1.00 53.20 C ATOM 98 CE2 PHE 383 8.841 43.688 58.820 1.00 53.20 C ATOM 99 CZ PHE 383 9.162 44.370 59.968 1.00 53.20 C ATOM 100 C PHE 383 7.562 38.203 60.383 1.00 53.20 C ATOM 101 O PHE 383 7.766 37.510 61.378 1.00 53.20 O ATOM 102 N SER 384 7.266 37.683 59.174 1.00 82.88 N ATOM 103 CA SER 384 7.162 36.283 58.879 1.00 82.88 C ATOM 104 CB SER 384 6.668 36.039 57.446 1.00 82.88 C ATOM 105 OG SER 384 5.390 36.627 57.270 1.00 82.88 O ATOM 106 C SER 384 8.515 35.640 58.953 1.00 82.88 C ATOM 107 O SER 384 8.633 34.475 59.333 1.00 82.88 O ATOM 108 N GLN 385 9.584 36.370 58.576 1.00 48.39 N ATOM 109 CA GLN 385 10.867 35.721 58.546 1.00 48.39 C ATOM 110 CB GLN 385 11.429 35.503 57.124 1.00 48.39 C ATOM 111 CG GLN 385 10.632 34.527 56.247 1.00 48.39 C ATOM 112 CD GLN 385 11.441 34.287 54.976 1.00 48.39 C ATOM 113 OE1 GLN 385 12.192 35.151 54.528 1.00 48.39 O ATOM 114 NE2 GLN 385 11.301 33.071 54.384 1.00 48.39 N ATOM 115 C GLN 385 11.890 36.524 59.295 1.00 48.39 C ATOM 116 O GLN 385 11.858 37.752 59.324 1.00 48.39 O ATOM 117 N SER 386 12.851 35.802 59.910 1.00 69.48 N ATOM 118 CA SER 386 13.920 36.363 60.686 1.00 69.48 C ATOM 119 CB SER 386 14.821 35.284 61.308 1.00 69.48 C ATOM 120 OG SER 386 15.873 35.887 62.045 1.00 69.48 O ATOM 121 C SER 386 14.799 37.208 59.819 1.00 69.48 C ATOM 122 O SER 386 15.235 38.279 60.238 1.00 69.48 O ATOM 123 N SER 387 15.095 36.753 58.587 1.00 72.86 N ATOM 124 CA SER 387 15.987 37.505 57.749 1.00 72.86 C ATOM 125 CB SER 387 16.314 36.830 56.406 1.00 72.86 C ATOM 126 OG SER 387 17.141 35.698 56.627 1.00 72.86 O ATOM 127 C SER 387 15.360 38.821 57.444 1.00 72.86 C ATOM 128 O SER 387 16.049 39.839 57.388 1.00 72.86 O ATOM 129 N HIS 388 14.030 38.835 57.249 1.00 43.36 N ATOM 130 CA HIS 388 13.348 40.053 56.930 1.00 43.36 C ATOM 131 ND1 HIS 388 11.856 39.879 54.112 1.00 43.36 N ATOM 132 CG HIS 388 11.592 39.242 55.303 1.00 43.36 C ATOM 133 CB HIS 388 11.854 39.861 56.641 1.00 43.36 C ATOM 134 NE2 HIS 388 10.950 37.917 53.595 1.00 43.36 N ATOM 135 CD2 HIS 388 11.041 38.044 54.970 1.00 43.36 C ATOM 136 CE1 HIS 388 11.453 39.043 53.123 1.00 43.36 C ATOM 137 C HIS 388 13.460 40.974 58.093 1.00 43.36 C ATOM 138 O HIS 388 13.606 42.183 57.924 1.00 43.36 O ATOM 139 N LEU 389 13.378 40.424 59.315 1.00 37.45 N ATOM 140 CA LEU 389 13.483 41.248 60.480 1.00 37.45 C ATOM 141 CB LEU 389 13.352 40.462 61.793 0.50 37.45 C ATOM 142 CG LEU 389 13.528 41.343 63.044 0.50 37.45 C ATOM 143 CD1 LEU 389 12.402 42.375 63.177 0.50 37.45 C ATOM 144 CD2 LEU 389 13.712 40.489 64.305 0.50 37.45 C ATOM 145 C LEU 389 14.840 41.885 60.489 1.00 37.45 C ATOM 146 O LEU 389 14.974 43.065 60.800 1.00 37.45 O ATOM 147 N ASN 390 15.883 41.113 60.131 1.00 73.24 N ATOM 148 CA ASN 390 17.235 41.597 60.174 1.00 73.24 C ATOM 149 CB ASN 390 18.244 40.515 59.731 1.00 73.24 C ATOM 150 CG ASN 390 19.670 40.985 59.983 1.00 73.24 C ATOM 151 OD1 ASN 390 19.932 42.179 60.129 1.00 73.24 O ATOM 152 ND2 ASN 390 20.624 40.014 60.014 1.00 73.24 N ATOM 153 C ASN 390 17.391 42.779 59.262 1.00 73.24 C ATOM 154 O ASN 390 17.939 43.804 59.666 1.00 73.24 O ATOM 155 N GLN 391 16.902 42.679 58.009 1.00112.28 N ATOM 156 CA GLN 391 17.075 43.763 57.079 1.00112.28 C ATOM 157 CB GLN 391 16.625 43.432 55.642 1.00112.28 C ATOM 158 CG GLN 391 17.179 44.397 54.581 1.00112.28 C ATOM 159 CD GLN 391 16.541 45.774 54.747 1.00112.28 C ATOM 160 OE1 GLN 391 17.223 46.799 54.730 1.00112.28 O ATOM 161 NE2 GLN 391 15.192 45.793 54.923 1.00112.28 N ATOM 162 C GLN 391 16.277 44.939 57.549 1.00112.28 C ATOM 163 O GLN 391 16.729 46.078 57.468 1.00112.28 O ATOM 164 N HIS 392 15.074 44.679 58.085 1.00 60.14 N ATOM 165 CA HIS 392 14.173 45.715 58.499 1.00 60.14 C ATOM 166 ND1 HIS 392 11.177 46.977 59.102 1.00 60.14 N ATOM 167 CG HIS 392 12.057 46.176 59.791 1.00 60.14 C ATOM 168 CB HIS 392 12.917 45.129 59.164 1.00 60.14 C ATOM 169 NE2 HIS 392 11.051 47.581 61.238 1.00 60.14 N ATOM 170 CD2 HIS 392 11.968 46.556 61.095 1.00 60.14 C ATOM 171 CE1 HIS 392 10.602 47.800 60.015 1.00 60.14 C ATOM 172 C HIS 392 14.825 46.604 59.512 1.00 60.14 C ATOM 173 O HIS 392 14.713 47.827 59.434 1.00 60.14 O ATOM 174 N MET 393 15.550 46.011 60.473 1.00114.20 N ATOM 175 CA MET 393 16.133 46.753 61.554 1.00114.20 C ATOM 176 CB MET 393 16.884 45.889 62.577 1.00114.20 C ATOM 177 CG MET 393 17.378 46.713 63.771 1.00114.20 C ATOM 178 SD MET 393 18.286 45.781 65.042 1.00114.20 S ATOM 179 CE MET 393 18.353 47.144 66.241 1.00114.20 C ATOM 180 C MET 393 17.122 47.737 61.017 1.00114.20 C ATOM 181 O MET 393 17.303 48.814 61.582 1.00114.20 O ATOM 182 N MET 394 17.782 47.398 59.897 1.00 64.97 N ATOM 183 CA MET 394 18.813 48.227 59.346 1.00 64.97 C ATOM 184 CB MET 394 19.380 47.700 58.015 1.00 64.97 C ATOM 185 CG MET 394 20.177 46.399 58.130 1.00 64.97 C ATOM 186 SD MET 394 20.798 45.760 56.545 1.00 64.97 S ATOM 187 CE MET 394 22.058 44.682 57.287 1.00 64.97 C ATOM 188 C MET 394 18.235 49.571 59.056 1.00 64.97 C ATOM 189 O MET 394 18.934 50.573 59.180 1.00 64.97 O ATOM 190 N SER 395 16.956 49.648 58.645 1.00 40.87 N ATOM 191 CA SER 395 16.413 50.940 58.344 1.00 40.87 C ATOM 192 CB SER 395 14.934 50.894 57.919 1.00 40.87 C ATOM 193 OG SER 395 14.133 50.359 58.962 1.00 40.87 O ATOM 194 C SER 395 16.518 51.821 59.555 1.00 40.87 C ATOM 195 O SER 395 16.886 52.991 59.454 1.00 40.87 O ATOM 196 N HIS 396 16.176 51.296 60.740 1.00 50.23 N ATOM 197 CA HIS 396 16.233 52.098 61.925 1.00 50.23 C ATOM 198 ND1 HIS 396 13.133 52.052 62.722 1.00 50.23 N ATOM 199 CG HIS 396 14.120 51.097 62.828 1.00 50.23 C ATOM 200 CB HIS 396 15.561 51.409 63.120 1.00 50.23 C ATOM 201 NE2 HIS 396 12.152 50.088 62.368 1.00 50.23 N ATOM 202 CD2 HIS 396 13.503 49.902 62.608 1.00 50.23 C ATOM 203 CE1 HIS 396 11.978 51.394 62.446 1.00 50.23 C ATOM 204 C HIS 396 17.657 52.411 62.275 1.00 50.23 C ATOM 205 O HIS 396 17.989 53.556 62.577 1.00 50.23 O ATOM 206 N THR 397 18.554 51.407 62.214 1.00 28.49 N ATOM 207 CA THR 397 19.918 51.636 62.596 1.00 28.49 C ATOM 208 CB THR 397 20.775 50.398 62.543 1.00 28.49 C ATOM 209 OG1 THR 397 20.866 49.902 61.215 1.00 28.49 O ATOM 210 CG2 THR 397 20.161 49.328 63.466 1.00 28.49 C ATOM 211 C THR 397 20.491 52.650 61.666 1.00 28.49 C ATOM 212 O THR 397 21.287 53.494 62.071 1.00 28.49 O ATOM 213 N GLY 398 20.084 52.590 60.385 1.00 18.07 N ATOM 214 CA GLY 398 20.580 53.504 59.404 1.00 18.07 C ATOM 215 C GLY 398 21.571 52.766 58.574 1.00 18.07 C ATOM 216 O GLY 398 21.970 53.236 57.510 1.00 18.07 O ATOM 217 N GLU 399 21.998 51.579 59.046 1.00 31.77 N ATOM 218 CA GLU 399 22.911 50.793 58.273 1.00 31.77 C ATOM 219 CB GLU 399 23.737 49.785 59.091 1.00 31.77 C ATOM 220 CG GLU 399 24.830 49.103 58.264 1.00 31.77 C ATOM 221 CD GLU 399 25.236 47.826 58.975 1.00 31.77 C ATOM 222 OE1 GLU 399 24.333 46.984 59.217 1.00 31.77 O ATOM 223 OE2 GLU 399 26.452 47.669 59.274 1.00 31.77 O ATOM 224 C GLU 399 22.017 49.967 57.359 1.00 31.77 C ATOM 225 O GLU 399 22.474 48.897 56.879 1.00 31.77 O ATOM 226 OXT GLU 399 20.851 50.392 57.139 1.00 31.77 O