EXPDTA THEORETICAL MODEL, MODELLER 9.19 2017/10/25 12:11:14 REMARK 6 MODELLER OBJECTIVE FUNCTION: 108.1299 REMARK 6 MODELLER BEST TEMPLATE % SEQ ID: 41.667 REMARK 6 SEQUENCE: model REMARK 6 ALIGNMENT: alignment.pir REMARK 6 DOPE score: -1454.69592 REMARK 6 GA341 score: 0.97361 REMARK 6 Normalized DOPE score: 0.37073 REMARK 6 TEMPLATE: 2i13A02 75:A - 98:A MODELS 1: - 24: AT 41.7% ATOM 1 N VAL 311 -16.631 23.463 55.903 1.00 70.62 N ATOM 2 CA VAL 311 -16.431 24.897 56.180 1.00 70.62 C ATOM 3 CB VAL 311 -17.610 25.431 56.941 1.00 70.62 C ATOM 4 CG1 VAL 311 -17.571 24.866 58.368 1.00 70.62 C ATOM 5 CG2 VAL 311 -17.632 26.967 56.850 1.00 70.62 C ATOM 6 C VAL 311 -15.170 25.089 56.963 1.00 70.62 C ATOM 7 O VAL 311 -14.284 24.236 56.939 1.00 70.62 O ATOM 8 N ARG 312 -15.041 26.234 57.659 1.00132.50 N ATOM 9 CA ARG 312 -13.845 26.503 58.396 1.00132.50 C ATOM 10 CB ARG 312 -13.186 27.779 57.857 1.00132.50 C ATOM 11 CG ARG 312 -12.784 27.568 56.391 1.00132.50 C ATOM 12 CD ARG 312 -12.963 28.784 55.483 1.00132.50 C ATOM 13 NE ARG 312 -12.157 29.913 56.019 1.00132.50 N ATOM 14 CZ ARG 312 -11.875 30.962 55.192 1.00132.50 C ATOM 15 NH1 ARG 312 -12.204 30.882 53.869 1.00132.50 N ATOM 16 NH2 ARG 312 -11.308 32.100 55.690 1.00132.50 N ATOM 17 C ARG 312 -14.249 26.665 59.828 1.00132.50 C ATOM 18 O ARG 312 -14.741 27.713 60.239 1.00132.50 O ATOM 19 N GLU 313 -14.039 25.595 60.619 1.00 56.04 N ATOM 20 CA GLU 313 -14.440 25.482 61.992 1.00 56.04 C ATOM 21 CB GLU 313 -14.239 24.051 62.510 1.00 56.04 C ATOM 22 CG GLU 313 -15.112 23.034 61.777 1.00 56.04 C ATOM 23 CD GLU 313 -14.798 21.651 62.318 1.00 56.04 C ATOM 24 OE1 GLU 313 -13.997 21.554 63.284 1.00 56.04 O ATOM 25 OE2 GLU 313 -15.359 20.669 61.763 1.00 56.04 O ATOM 26 C GLU 313 -13.676 26.388 62.905 1.00 56.04 C ATOM 27 O GLU 313 -14.271 27.018 63.779 1.00 56.04 O ATOM 28 N PHE 314 -12.343 26.493 62.735 1.00120.85 N ATOM 29 CA PHE 314 -11.582 27.220 63.713 1.00120.85 C ATOM 30 CB PHE 314 -10.290 26.508 64.137 1.00120.85 C ATOM 31 CG PHE 314 -10.723 25.440 65.080 1.00120.85 C ATOM 32 CD1 PHE 314 -11.137 24.214 64.612 1.00120.85 C ATOM 33 CD2 PHE 314 -10.745 25.683 66.433 1.00120.85 C ATOM 34 CE1 PHE 314 -11.545 23.227 65.477 1.00120.85 C ATOM 35 CE2 PHE 314 -11.150 24.701 67.305 1.00120.85 C ATOM 36 CZ PHE 314 -11.550 23.473 66.829 1.00120.85 C ATOM 37 C PHE 314 -11.233 28.596 63.262 1.00120.85 C ATOM 38 O PHE 314 -10.669 28.799 62.189 1.00120.85 O ATOM 39 N VAL 315 -11.547 29.576 64.133 1.00 37.93 N ATOM 40 CA VAL 315 -11.321 30.965 63.876 1.00 37.93 C ATOM 41 CB VAL 315 -12.522 31.816 64.181 1.00 37.93 C ATOM 42 CG1 VAL 315 -12.121 33.292 64.052 1.00 37.93 C ATOM 43 CG2 VAL 315 -13.675 31.409 63.250 1.00 37.93 C ATOM 44 C VAL 315 -10.225 31.442 64.775 1.00 37.93 C ATOM 45 O VAL 315 -10.187 31.133 65.966 1.00 37.93 O ATOM 46 N CYS 316 -9.276 32.202 64.195 1.00 44.45 N ATOM 47 CA CYS 316 -8.213 32.746 64.986 1.00 44.45 C ATOM 48 CB CYS 316 -7.017 33.254 64.157 1.00 44.45 C ATOM 49 SG CYS 316 -5.675 33.936 65.181 1.00 44.45 S ATOM 50 C CYS 316 -8.795 33.903 65.735 1.00 44.45 C ATOM 51 O CYS 316 -9.529 34.719 65.182 1.00 44.45 O ATOM 52 N SER 317 -8.471 34.004 67.033 1.00 73.66 N ATOM 53 CA SER 317 -9.043 35.032 67.848 1.00 73.66 C ATOM 54 CB SER 317 -8.623 34.922 69.323 1.00 73.66 C ATOM 55 OG SER 317 -9.222 35.963 70.083 1.00 73.66 O ATOM 56 C SER 317 -8.594 36.368 67.354 1.00 73.66 C ATOM 57 O SER 317 -9.397 37.294 67.250 1.00 73.66 O ATOM 58 N GLU 318 -7.288 36.516 67.055 1.00126.51 N ATOM 59 CA GLU 318 -6.804 37.818 66.688 1.00126.51 C ATOM 60 CB GLU 318 -5.270 37.857 66.631 1.00126.51 C ATOM 61 CG GLU 318 -4.628 37.607 67.996 1.00126.51 C ATOM 62 CD GLU 318 -4.892 38.828 68.867 1.00126.51 C ATOM 63 OE1 GLU 318 -5.305 39.872 68.296 1.00126.51 O ATOM 64 OE2 GLU 318 -4.682 38.739 70.107 1.00126.51 O ATOM 65 C GLU 318 -7.306 38.304 65.353 1.00126.51 C ATOM 66 O GLU 318 -8.005 39.316 65.281 1.00126.51 O ATOM 67 N CYS 319 -6.947 37.584 64.268 1.00 68.01 N ATOM 68 CA CYS 319 -7.208 37.961 62.899 1.00 68.01 C ATOM 69 CB CYS 319 -6.261 37.260 61.908 1.00 68.01 C ATOM 70 SG CYS 319 -6.371 35.450 62.004 1.00 68.01 S ATOM 71 C CYS 319 -8.621 37.706 62.466 1.00 68.01 C ATOM 72 O CYS 319 -9.161 38.442 61.640 1.00 68.01 O ATOM 73 N GLU 320 -9.256 36.664 63.035 1.00143.72 N ATOM 74 CA GLU 320 -10.561 36.227 62.623 1.00143.72 C ATOM 75 CB GLU 320 -11.554 37.389 62.453 1.00143.72 C ATOM 76 CG GLU 320 -12.976 36.948 62.104 1.00143.72 C ATOM 77 CD GLU 320 -13.460 36.065 63.245 1.00143.72 C ATOM 78 OE1 GLU 320 -12.953 36.256 64.382 1.00143.72 O ATOM 79 OE2 GLU 320 -14.330 35.187 62.999 1.00143.72 O ATOM 80 C GLU 320 -10.449 35.479 61.323 1.00143.72 C ATOM 81 O GLU 320 -11.429 35.275 60.608 1.00143.72 O ATOM 82 N LYS 321 -9.241 34.994 60.988 1.00 63.91 N ATOM 83 CA LYS 321 -9.155 34.187 59.806 1.00 63.91 C ATOM 84 CB LYS 321 -7.732 34.073 59.235 1.00 63.91 C ATOM 85 CG LYS 321 -7.669 33.362 57.884 1.00 63.91 C ATOM 86 CD LYS 321 -6.345 33.618 57.161 1.00 63.91 C ATOM 87 CE LYS 321 -6.222 32.958 55.785 1.00 63.91 C ATOM 88 NZ LYS 321 -4.953 33.390 55.151 1.00 63.91 N ATOM 89 C LYS 321 -9.635 32.822 60.199 1.00 63.91 C ATOM 90 O LYS 321 -9.416 32.384 61.328 1.00 63.91 O ATOM 91 N SER 322 -10.323 32.113 59.281 1.00 51.98 N ATOM 92 CA SER 322 -10.869 30.837 59.653 1.00 51.98 C ATOM 93 CB SER 322 -12.357 30.665 59.300 1.00 51.98 C ATOM 94 OG SER 322 -13.150 31.575 60.048 1.00 51.98 O ATOM 95 C SER 322 -10.125 29.763 58.933 1.00 51.98 C ATOM 96 O SER 322 -9.626 29.968 57.828 1.00 51.98 O ATOM 97 N PHE 323 -10.030 28.575 59.566 1.00149.93 N ATOM 98 CA PHE 323 -9.276 27.495 58.997 1.00149.93 C ATOM 99 CB PHE 323 -7.987 27.193 59.781 1.00149.93 C ATOM 100 CG PHE 323 -7.079 28.356 59.590 1.00149.93 C ATOM 101 CD1 PHE 323 -7.126 29.424 60.453 1.00149.93 C ATOM 102 CD2 PHE 323 -6.186 28.382 58.541 1.00149.93 C ATOM 103 CE1 PHE 323 -6.294 30.505 60.274 1.00149.93 C ATOM 104 CE2 PHE 323 -5.351 29.458 58.358 1.00149.93 C ATOM 105 CZ PHE 323 -5.401 30.521 59.230 1.00149.93 C ATOM 106 C PHE 323 -10.091 26.243 59.013 1.00149.93 C ATOM 107 O PHE 323 -10.919 26.016 59.893 1.00149.93 O ATOM 108 N ILE 324 -9.863 25.396 57.990 1.00136.59 N ATOM 109 CA ILE 324 -10.500 24.120 57.843 1.00136.59 C ATOM 110 CB ILE 324 -10.222 23.498 56.504 1.00136.59 C ATOM 111 CG1 ILE 324 -11.125 22.279 56.229 1.00136.59 C ATOM 112 CG2 ILE 324 -8.716 23.213 56.429 1.00136.59 C ATOM 113 CD1 ILE 324 -10.839 21.045 57.082 1.00136.59 C ATOM 114 C ILE 324 -10.029 23.209 58.940 1.00136.59 C ATOM 115 O ILE 324 -10.809 22.416 59.464 1.00136.59 O ATOM 116 N THR 325 -8.731 23.273 59.309 1.00 36.33 N ATOM 117 CA THR 325 -8.280 22.376 60.338 1.00 36.33 C ATOM 118 CB THR 325 -7.321 21.332 59.857 1.00 36.33 C ATOM 119 OG1 THR 325 -7.935 20.562 58.834 1.00 36.33 O ATOM 120 CG2 THR 325 -6.935 20.426 61.043 1.00 36.33 C ATOM 121 C THR 325 -7.610 23.138 61.441 1.00 36.33 C ATOM 122 O THR 325 -7.011 24.191 61.230 1.00 36.33 O ATOM 123 N ALA 326 -7.722 22.594 62.671 1.00 32.59 N ATOM 124 CA ALA 326 -7.199 23.175 63.874 1.00 32.59 C ATOM 125 CB ALA 326 -7.600 22.395 65.134 1.00 32.59 C ATOM 126 C ALA 326 -5.708 23.223 63.818 1.00 32.59 C ATOM 127 O ALA 326 -5.089 24.189 64.262 1.00 32.59 O ATOM 128 N GLY 327 -5.080 22.172 63.267 1.00 18.47 N ATOM 129 CA GLY 327 -3.648 22.135 63.247 1.00 18.47 C ATOM 130 C GLY 327 -3.150 23.313 62.475 1.00 18.47 C ATOM 131 O GLY 327 -2.162 23.936 62.860 1.00 18.47 O ATOM 132 N ASP 328 -3.824 23.643 61.357 1.00 37.56 N ATOM 133 CA ASP 328 -3.415 24.738 60.525 1.00 37.56 C ATOM 134 CB ASP 328 -4.278 24.884 59.264 1.00 37.56 C ATOM 135 CG ASP 328 -4.070 23.648 58.401 1.00 37.56 C ATOM 136 OD1 ASP 328 -2.898 23.311 58.083 1.00 37.56 O ATOM 137 OD2 ASP 328 -5.103 23.022 58.048 1.00 37.56 O ATOM 138 C ASP 328 -3.546 26.013 61.301 1.00 37.56 C ATOM 139 O ASP 328 -2.701 26.899 61.185 1.00 37.56 O ATOM 140 N LEU 329 -4.603 26.130 62.130 1.00125.51 N ATOM 141 CA LEU 329 -4.844 27.327 62.890 1.00125.51 C ATOM 142 CB LEU 329 -6.006 27.142 63.883 1.00125.51 C ATOM 143 CG LEU 329 -6.562 28.400 64.598 1.00125.51 C ATOM 144 CD1 LEU 329 -7.380 27.982 65.835 1.00125.51 C ATOM 145 CD2 LEU 329 -5.522 29.499 64.882 1.00125.51 C ATOM 146 C LEU 329 -3.634 27.532 63.748 1.00125.51 C ATOM 147 O LEU 329 -3.119 28.642 63.875 1.00125.51 O ATOM 148 N ARG 330 -3.131 26.427 64.327 1.00111.64 N ATOM 149 CA ARG 330 -2.039 26.491 65.255 1.00111.64 C ATOM 150 CB ARG 330 -1.602 25.107 65.768 1.00111.64 C ATOM 151 CG ARG 330 -0.691 25.127 67.003 1.00111.64 C ATOM 152 CD ARG 330 -0.359 23.720 67.498 1.00111.64 C ATOM 153 NE ARG 330 -1.640 22.953 67.459 1.00111.64 N ATOM 154 CZ ARG 330 -2.529 23.025 68.492 1.00111.64 C ATOM 155 NH1 ARG 330 -2.202 23.699 69.633 1.00111.64 N ATOM 156 NH2 ARG 330 -3.747 22.420 68.380 1.00111.64 N ATOM 157 C ARG 330 -0.862 27.089 64.571 1.00111.64 C ATOM 158 O ARG 330 -0.201 27.961 65.132 1.00111.64 O ATOM 159 N ARG 331 -0.577 26.656 63.331 1.00 92.86 N ATOM 160 CA ARG 331 0.567 27.187 62.652 1.00 92.86 C ATOM 161 CB ARG 331 0.819 26.543 61.278 1.00 92.86 C ATOM 162 CG ARG 331 1.201 25.063 61.380 1.00 92.86 C ATOM 163 CD ARG 331 1.966 24.541 60.162 1.00 92.86 C ATOM 164 NE ARG 331 3.280 25.249 60.138 1.00 92.86 N ATOM 165 CZ ARG 331 4.393 24.624 59.649 1.00 92.86 C ATOM 166 NH1 ARG 331 4.310 23.348 59.174 1.00 92.86 N ATOM 167 NH2 ARG 331 5.583 25.294 59.611 1.00 92.86 N ATOM 168 C ARG 331 0.349 28.653 62.460 1.00 92.86 C ATOM 169 O ARG 331 1.268 29.458 62.611 1.00 92.86 O ATOM 170 N HIS 332 -0.893 29.044 62.133 1.00 45.94 N ATOM 171 CA HIS 332 -1.172 30.431 61.922 1.00 45.94 C ATOM 172 ND1 HIS 332 -2.403 32.818 60.032 1.00 45.94 N ATOM 173 CG HIS 332 -2.812 32.171 61.177 1.00 45.94 C ATOM 174 CB HIS 332 -2.602 30.711 61.440 1.00 45.94 C ATOM 175 NE2 HIS 332 -3.347 34.361 61.324 1.00 45.94 N ATOM 176 CD2 HIS 332 -3.387 33.130 61.956 1.00 45.94 C ATOM 177 CE1 HIS 332 -2.746 34.124 60.172 1.00 45.94 C ATOM 178 C HIS 332 -0.969 31.199 63.194 1.00 45.94 C ATOM 179 O HIS 332 -0.403 32.292 63.178 1.00 45.94 O ATOM 180 N GLN 333 -1.405 30.648 64.344 1.00 55.03 N ATOM 181 CA GLN 333 -1.290 31.392 65.568 1.00 55.03 C ATOM 182 CB GLN 333 -1.795 30.665 66.828 1.00 55.03 C ATOM 183 CG GLN 333 -3.310 30.653 67.015 1.00 55.03 C ATOM 184 CD GLN 333 -3.565 30.233 68.460 1.00 55.03 C ATOM 185 OE1 GLN 333 -3.858 31.060 69.322 1.00 55.03 O ATOM 186 NE2 GLN 333 -3.444 28.907 68.736 1.00 55.03 N ATOM 187 C GLN 333 0.144 31.681 65.832 1.00 55.03 C ATOM 188 O GLN 333 0.471 32.771 66.300 1.00 55.03 O ATOM 189 N MET 334 1.017 30.700 65.535 1.00 92.64 N ATOM 190 CA MET 334 2.427 30.778 65.786 1.00 92.64 C ATOM 191 CB MET 334 3.236 29.760 64.968 1.00 92.64 C ATOM 192 CG MET 334 4.729 29.770 65.299 1.00 92.64 C ATOM 193 SD MET 334 5.729 28.536 64.417 1.00 92.64 S ATOM 194 CE MET 334 7.220 28.906 65.383 1.00 92.64 C ATOM 195 C MET 334 2.988 32.159 65.475 1.00 92.64 C ATOM 196 O MET 334 2.449 32.821 64.548 1.00 92.64 O ATOM 197 OXT MET 334 3.947 32.577 66.175 1.00 92.64 O