EXPDTA THEORETICAL MODEL, MODELLER 9.19 2017/10/25 12:02:22 REMARK 6 MODELLER OBJECTIVE FUNCTION: 102.2892 REMARK 6 MODELLER BEST TEMPLATE % SEQ ID: 48.276 REMARK 6 SEQUENCE: model REMARK 6 ALIGNMENT: alignment.pir REMARK 6 DOPE score: -1689.23865 REMARK 6 GA341 score: 0.99815 REMARK 6 Normalized DOPE score: -1.28113 REMARK 6 TEMPLATE: 1llmC01 101:C - 129:C MODELS 1: - 29: AT 48.3% ATOM 1 N GLU 259 -4.659 69.362 65.495 1.00 27.22 N ATOM 2 CA GLU 259 -5.325 68.297 64.712 1.00 27.22 C ATOM 3 CB GLU 259 -5.569 68.780 63.276 1.00 27.22 C ATOM 4 CG GLU 259 -6.500 67.868 62.482 1.00 27.22 C ATOM 5 CD GLU 259 -6.783 68.549 61.154 1.00 27.22 C ATOM 6 OE1 GLU 259 -7.165 69.750 61.174 1.00 27.22 O ATOM 7 OE2 GLU 259 -6.621 67.875 60.103 1.00 27.22 O ATOM 8 C GLU 259 -4.454 67.088 64.678 1.00 27.22 C ATOM 9 O GLU 259 -4.147 66.513 65.721 1.00 27.22 O ATOM 10 N LYS 260 -4.047 66.647 63.472 1.00114.04 N ATOM 11 CA LYS 260 -3.162 65.520 63.418 1.00114.04 C ATOM 12 CB LYS 260 -3.676 64.376 62.530 1.00114.04 C ATOM 13 CG LYS 260 -4.830 63.592 63.159 1.00114.04 C ATOM 14 CD LYS 260 -6.129 64.388 63.285 1.00114.04 C ATOM 15 CE LYS 260 -6.987 64.349 62.019 1.00114.04 C ATOM 16 NZ LYS 260 -8.240 65.102 62.237 1.00114.04 N ATOM 17 C LYS 260 -1.861 65.998 62.856 1.00114.04 C ATOM 18 O LYS 260 -1.670 66.107 61.644 1.00114.04 O ATOM 19 N PRO 261 -0.984 66.318 63.763 1.00 81.78 N ATOM 20 CA PRO 261 0.331 66.811 63.460 1.00 81.78 C ATOM 21 CD PRO 261 -1.399 66.672 65.109 1.00 81.78 C ATOM 22 CB PRO 261 0.808 67.542 64.717 1.00 81.78 C ATOM 23 CG PRO 261 -0.095 67.009 65.839 1.00 81.78 C ATOM 24 C PRO 261 1.330 65.798 62.998 1.00 81.78 C ATOM 25 O PRO 261 2.376 66.210 62.500 1.00 81.78 O ATOM 26 N PHE 262 1.078 64.486 63.156 1.00 64.49 N ATOM 27 CA PHE 262 2.155 63.587 62.846 1.00 64.49 C ATOM 28 CB PHE 262 2.378 62.547 63.958 1.00 64.49 C ATOM 29 CG PHE 262 2.648 63.346 65.187 1.00 64.49 C ATOM 30 CD1 PHE 262 1.597 63.804 65.947 1.00 64.49 C ATOM 31 CD2 PHE 262 3.932 63.657 65.574 1.00 64.49 C ATOM 32 CE1 PHE 262 1.821 64.548 67.081 1.00 64.49 C ATOM 33 CE2 PHE 262 4.162 64.401 66.708 1.00 64.49 C ATOM 34 CZ PHE 262 3.106 64.847 67.464 1.00 64.49 C ATOM 35 C PHE 262 1.856 62.878 61.568 1.00 64.49 C ATOM 36 O PHE 262 0.846 62.186 61.453 1.00 64.49 O ATOM 37 N THR 263 2.771 63.003 60.582 1.00113.19 N ATOM 38 CA THR 263 2.509 62.451 59.286 1.00113.19 C ATOM 39 CB THR 263 2.685 63.456 58.189 0.50113.19 C ATOM 40 OG1 THR 263 4.054 63.808 58.055 1.00113.19 O ATOM 41 CG2 THR 263 1.892 64.712 58.576 1.00113.19 C ATOM 42 C THR 263 3.462 61.334 59.001 1.00113.19 C ATOM 43 O THR 263 4.630 61.369 59.384 1.00113.19 O ATOM 44 N CYS 264 2.954 60.302 58.301 1.00 37.01 N ATOM 45 CA CYS 264 3.739 59.168 57.921 1.00 37.01 C ATOM 46 CB CYS 264 2.893 57.891 57.773 1.00 37.01 C ATOM 47 SG CYS 264 3.866 56.434 57.292 1.00 37.01 S ATOM 48 C CYS 264 4.327 59.496 56.589 1.00 37.01 C ATOM 49 O CYS 264 3.634 59.957 55.685 1.00 37.01 O ATOM 50 N THR 265 5.647 59.287 56.452 1.00106.83 N ATOM 51 CA THR 265 6.355 59.607 55.248 1.00106.83 C ATOM 52 CB THR 265 7.840 59.452 55.404 1.00106.83 C ATOM 53 OG1 THR 265 8.509 59.959 54.260 1.00106.83 O ATOM 54 CG2 THR 265 8.176 57.965 55.605 1.00106.83 C ATOM 55 C THR 265 5.921 58.725 54.118 1.00106.83 C ATOM 56 O THR 265 5.838 59.183 52.978 1.00106.83 O ATOM 57 N GLN 266 5.695 57.419 54.379 1.00104.24 N ATOM 58 CA GLN 266 5.360 56.563 53.276 1.00104.24 C ATOM 59 CB GLN 266 5.348 55.068 53.648 1.00104.24 C ATOM 60 CG GLN 266 6.719 54.499 54.015 1.00104.24 C ATOM 61 CD GLN 266 7.045 54.887 55.450 1.00104.24 C ATOM 62 OE1 GLN 266 6.152 55.034 56.284 1.00104.24 O ATOM 63 NE2 GLN 266 8.360 55.051 55.752 1.00104.24 N ATOM 64 C GLN 266 4.002 56.865 52.705 1.00104.24 C ATOM 65 O GLN 266 3.885 57.222 51.534 1.00104.24 O ATOM 66 N CYS 267 2.937 56.717 53.524 1.00 58.11 N ATOM 67 CA CYS 267 1.578 56.933 53.091 1.00 58.11 C ATOM 68 CB CYS 267 0.540 56.253 54.004 1.00 58.11 C ATOM 69 SG CYS 267 0.643 56.784 55.738 1.00 58.11 S ATOM 70 C CYS 267 1.246 58.389 52.992 1.00 58.11 C ATOM 71 O CYS 267 0.556 58.815 52.068 1.00 58.11 O ATOM 72 N GLY 268 1.731 59.198 53.954 1.00 24.76 N ATOM 73 CA GLY 268 1.421 60.600 53.959 1.00 24.76 C ATOM 74 C GLY 268 0.202 60.835 54.805 1.00 24.76 C ATOM 75 O GLY 268 -0.319 61.949 54.856 1.00 24.76 O ATOM 76 N ARG 269 -0.287 59.789 55.499 1.00101.33 N ATOM 77 CA ARG 269 -1.452 59.945 56.321 1.00101.33 C ATOM 78 CB ARG 269 -2.069 58.609 56.772 1.00101.33 C ATOM 79 CG ARG 269 -3.508 58.744 57.274 1.00101.33 C ATOM 80 CD ARG 269 -4.091 57.446 57.837 1.00101.33 C ATOM 81 NE ARG 269 -5.568 57.622 57.913 1.00101.33 N ATOM 82 CZ ARG 269 -6.337 57.261 56.843 1.00101.33 C ATOM 83 NH1 ARG 269 -5.753 56.690 55.750 1.00101.33 N ATOM 84 NH2 ARG 269 -7.687 57.460 56.866 1.00101.33 N ATOM 85 C ARG 269 -1.052 60.712 57.545 1.00101.33 C ATOM 86 O ARG 269 0.110 60.691 57.950 1.00101.33 O ATOM 87 N ASN 270 -2.021 61.425 58.160 1.00 55.49 N ATOM 88 CA ASN 270 -1.748 62.239 59.316 1.00 55.49 C ATOM 89 CB ASN 270 -2.406 63.628 59.237 1.00 55.49 C ATOM 90 CG ASN 270 -1.901 64.364 57.999 1.00 55.49 C ATOM 91 OD1 ASN 270 -0.704 64.457 57.753 1.00 55.49 O ATOM 92 ND2 ASN 270 -2.847 64.900 57.181 1.00 55.49 N ATOM 93 C ASN 270 -2.369 61.571 60.506 1.00 55.49 C ATOM 94 O ASN 270 -3.412 60.929 60.394 1.00 55.49 O ATOM 95 N TYR 271 -1.738 61.697 61.694 1.00116.54 N ATOM 96 CA TYR 271 -2.291 61.046 62.848 1.00116.54 C ATOM 97 CB TYR 271 -1.486 59.810 63.300 1.00116.54 C ATOM 98 CG TYR 271 -1.468 58.867 62.148 1.00116.54 C ATOM 99 CD1 TYR 271 -0.496 58.989 61.180 1.00116.54 C ATOM 100 CD2 TYR 271 -2.414 57.874 62.035 1.00116.54 C ATOM 101 CE1 TYR 271 -0.472 58.131 60.108 1.00116.54 C ATOM 102 CE2 TYR 271 -2.394 57.013 60.963 1.00116.54 C ATOM 103 CZ TYR 271 -1.423 57.145 59.999 1.00116.54 C ATOM 104 OH TYR 271 -1.394 56.272 58.894 1.00116.54 O ATOM 105 C TYR 271 -2.339 62.019 63.983 1.00116.54 C ATOM 106 O TYR 271 -1.530 62.940 64.078 1.00116.54 O ATOM 107 N SER 272 -3.338 61.824 64.862 1.00 77.98 N ATOM 108 CA SER 272 -3.588 62.649 66.006 1.00 77.98 C ATOM 109 CB SER 272 -4.927 62.301 66.672 1.00 77.98 C ATOM 110 OG SER 272 -5.133 63.136 67.799 1.00 77.98 O ATOM 111 C SER 272 -2.513 62.453 67.036 1.00 77.98 C ATOM 112 O SER 272 -2.221 63.369 67.805 1.00 77.98 O ATOM 113 N GLN 273 -1.897 61.253 67.094 1.00 41.28 N ATOM 114 CA GLN 273 -0.933 61.026 68.141 1.00 41.28 C ATOM 115 CB GLN 273 -1.388 59.984 69.176 1.00 41.28 C ATOM 116 CG GLN 273 -2.614 60.415 69.980 1.00 41.28 C ATOM 117 CD GLN 273 -2.938 59.300 70.967 1.00 41.28 C ATOM 118 OE1 GLN 273 -3.700 58.382 70.669 1.00 41.28 O ATOM 119 NE2 GLN 273 -2.323 59.377 72.178 1.00 41.28 N ATOM 120 C GLN 273 0.362 60.525 67.576 1.00 41.28 C ATOM 121 O GLN 273 0.390 59.734 66.633 1.00 41.28 O ATOM 122 N SER 274 1.482 60.981 68.177 1.00 29.68 N ATOM 123 CA SER 274 2.813 60.631 67.764 1.00 29.68 C ATOM 124 CB SER 274 3.900 61.427 68.508 1.00 29.68 C ATOM 125 OG SER 274 3.880 61.112 69.892 1.00 29.68 O ATOM 126 C SER 274 3.067 59.176 68.013 1.00 29.68 C ATOM 127 O SER 274 3.729 58.515 67.214 1.00 29.68 O ATOM 128 N SER 275 2.558 58.633 69.135 1.00 62.68 N ATOM 129 CA SER 275 2.792 57.250 69.440 1.00 62.68 C ATOM 130 CB SER 275 2.231 56.836 70.811 1.00 62.68 C ATOM 131 OG SER 275 2.874 57.570 71.843 1.00 62.68 O ATOM 132 C SER 275 2.106 56.423 68.398 1.00 62.68 C ATOM 133 O SER 275 2.621 55.389 67.975 1.00 62.68 O ATOM 134 N SER 276 0.918 56.872 67.952 1.00 61.85 N ATOM 135 CA SER 276 0.155 56.153 66.972 1.00 61.85 C ATOM 136 CB SER 276 -1.222 56.789 66.711 1.00 61.85 C ATOM 137 OG SER 276 -1.938 56.045 65.735 1.00 61.85 O ATOM 138 C SER 276 0.912 56.160 65.681 1.00 61.85 C ATOM 139 O SER 276 0.867 55.193 64.925 1.00 61.85 O ATOM 140 N LEU 277 1.626 57.263 65.391 1.00 41.11 N ATOM 141 CA LEU 277 2.388 57.360 64.177 1.00 41.11 C ATOM 142 CB LEU 277 3.072 58.727 64.012 0.50 41.11 C ATOM 143 CG LEU 277 3.914 58.839 62.727 0.50 41.11 C ATOM 144 CD1 LEU 277 3.048 58.665 61.471 0.50 41.11 C ATOM 145 CD2 LEU 277 4.730 60.141 62.706 0.50 41.11 C ATOM 146 C LEU 277 3.466 56.321 64.212 1.00 41.11 C ATOM 147 O LEU 277 3.727 55.649 63.216 1.00 41.11 O ATOM 148 N LYS 278 4.108 56.149 65.382 1.00 91.83 N ATOM 149 CA LYS 278 5.202 55.225 65.506 1.00 91.83 C ATOM 150 CB LYS 278 5.748 55.147 66.946 1.00 91.83 C ATOM 151 CG LYS 278 6.487 56.390 67.454 1.00 91.83 C ATOM 152 CD LYS 278 7.830 56.661 66.770 1.00 91.83 C ATOM 153 CE LYS 278 8.653 57.752 67.465 1.00 91.83 C ATOM 154 NZ LYS 278 10.035 57.767 66.936 1.00 91.83 N ATOM 155 C LYS 278 4.723 53.845 65.177 1.00 91.83 C ATOM 156 O LYS 278 5.353 53.135 64.396 1.00 91.83 O ATOM 157 N ARG 279 3.580 53.441 65.762 1.00 96.69 N ATOM 158 CA ARG 279 3.041 52.122 65.574 1.00 96.69 C ATOM 159 CB ARG 279 1.741 51.902 66.362 1.00 96.69 C ATOM 160 CG ARG 279 1.917 51.907 67.880 1.00 96.69 C ATOM 161 CD ARG 279 0.585 51.826 68.624 1.00 96.69 C ATOM 162 NE ARG 279 -0.227 50.773 67.954 1.00 96.69 N ATOM 163 CZ ARG 279 -1.527 50.577 68.320 1.00 96.69 C ATOM 164 NH1 ARG 279 -2.073 51.330 69.319 1.00 96.69 N ATOM 165 NH2 ARG 279 -2.279 49.627 67.691 1.00 96.69 N ATOM 166 C ARG 279 2.678 51.940 64.137 1.00 96.69 C ATOM 167 O ARG 279 2.944 50.895 63.546 1.00 96.69 O ATOM 168 N HIS 280 2.078 52.979 63.533 1.00 69.32 N ATOM 169 CA HIS 280 1.583 52.899 62.191 1.00 69.32 C ATOM 170 ND1 HIS 280 -0.544 53.441 59.788 1.00 69.32 N ATOM 171 CG HIS 280 0.547 54.127 60.271 1.00 69.32 C ATOM 172 CB HIS 280 0.932 54.206 61.714 1.00 69.32 C ATOM 173 NE2 HIS 280 0.497 54.308 58.024 1.00 69.32 N ATOM 174 CD2 HIS 280 1.170 54.652 59.182 1.00 69.32 C ATOM 175 CE1 HIS 280 -0.525 53.581 58.438 1.00 69.32 C ATOM 176 C HIS 280 2.693 52.593 61.236 1.00 69.32 C ATOM 177 O HIS 280 2.511 51.809 60.307 1.00 69.32 O ATOM 178 N MET 281 3.879 53.187 61.455 1.00114.19 N ATOM 179 CA MET 281 4.995 53.029 60.565 1.00114.19 C ATOM 180 CB MET 281 6.252 53.779 61.042 1.00114.19 C ATOM 181 CG MET 281 6.166 55.306 60.953 1.00114.19 C ATOM 182 SD MET 281 6.340 55.971 59.267 1.00114.19 S ATOM 183 CE MET 281 8.111 55.584 59.127 1.00114.19 C ATOM 184 C MET 281 5.357 51.578 60.504 1.00114.19 C ATOM 185 O MET 281 5.745 51.066 59.455 1.00114.19 O ATOM 186 N MET 282 5.212 50.868 61.632 1.00 78.42 N ATOM 187 CA MET 282 5.584 49.487 61.724 1.00 78.42 C ATOM 188 CB MET 282 5.393 48.903 63.136 1.00 78.42 C ATOM 189 CG MET 282 6.282 49.591 64.177 1.00 78.42 C ATOM 190 SD MET 282 6.140 48.952 65.872 1.00 78.42 S ATOM 191 CE MET 282 7.098 47.450 65.523 1.00 78.42 C ATOM 192 C MET 282 4.753 48.711 60.756 1.00 78.42 C ATOM 193 O MET 282 5.164 47.651 60.296 1.00 78.42 O ATOM 194 N SER 283 3.538 49.189 60.448 1.00 88.76 N ATOM 195 CA SER 283 2.679 48.522 59.513 1.00 88.76 C ATOM 196 CB SER 283 1.399 49.338 59.266 1.00 88.76 C ATOM 197 OG SER 283 0.635 48.759 58.224 1.00 88.76 O ATOM 198 C SER 283 3.388 48.384 58.196 1.00 88.76 C ATOM 199 O SER 283 3.338 47.326 57.569 1.00 88.76 O ATOM 200 N HIS 284 4.058 49.456 57.732 1.00 48.58 N ATOM 201 CA HIS 284 4.722 49.428 56.460 1.00 48.58 C ATOM 202 ND1 HIS 284 3.176 51.942 55.174 1.00 48.58 N ATOM 203 CG HIS 284 4.210 51.872 56.080 1.00 48.58 C ATOM 204 CB HIS 284 5.272 50.808 56.069 1.00 48.58 C ATOM 205 NE2 HIS 284 2.917 53.657 56.565 1.00 48.58 N ATOM 206 CD2 HIS 284 4.037 52.927 56.923 1.00 48.58 C ATOM 207 CE1 HIS 284 2.432 53.027 55.510 1.00 48.58 C ATOM 208 C HIS 284 5.875 48.472 56.510 1.00 48.58 C ATOM 209 O HIS 284 6.048 47.641 55.620 1.00 48.58 O ATOM 210 N THR 285 6.681 48.567 57.584 1.00 39.44 N ATOM 211 CA THR 285 7.860 47.766 57.755 1.00 39.44 C ATOM 212 CB THR 285 8.663 48.160 58.959 1.00 39.44 C ATOM 213 OG1 THR 285 7.895 47.987 60.140 1.00 39.44 O ATOM 214 CG2 THR 285 9.094 49.630 58.809 1.00 39.44 C ATOM 215 C THR 285 7.462 46.335 57.922 1.00 39.44 C ATOM 216 O THR 285 8.167 45.421 57.497 1.00 39.44 O ATOM 217 N GLU 286 6.290 46.117 58.536 1.00 48.35 N ATOM 218 CA GLU 286 5.793 44.818 58.862 1.00 48.35 C ATOM 219 CB GLU 286 5.748 43.878 57.645 1.00 48.35 C ATOM 220 CG GLU 286 4.740 44.333 56.585 1.00 48.35 C ATOM 221 CD GLU 286 4.852 43.401 55.387 1.00 48.35 C ATOM 222 OE1 GLU 286 5.610 42.400 55.491 1.00 48.35 O ATOM 223 OE2 GLU 286 4.184 43.680 54.355 1.00 48.35 O ATOM 224 C GLU 286 6.685 44.238 59.907 1.00 48.35 C ATOM 225 O GLU 286 6.842 43.022 60.003 1.00 48.35 O ATOM 226 N GLU 287 7.280 45.117 60.740 1.00 54.05 N ATOM 227 CA GLU 287 8.109 44.654 61.810 1.00 54.05 C ATOM 228 CB GLU 287 9.375 45.498 62.026 1.00 54.05 C ATOM 229 CG GLU 287 9.100 46.947 62.432 1.00 54.05 C ATOM 230 CD GLU 287 10.447 47.598 62.707 1.00 54.05 C ATOM 231 OE1 GLU 287 11.180 47.077 63.588 1.00 54.05 O ATOM 232 OE2 GLU 287 10.767 48.614 62.033 1.00 54.05 O ATOM 233 C GLU 287 7.288 44.738 63.094 1.00 54.05 C ATOM 234 O GLU 287 6.110 45.181 63.022 1.00 54.05 O ATOM 235 OXT GLU 287 7.833 44.363 64.166 1.00 54.05 O