EXPDTA THEORETICAL MODEL, MODELLER 9.19 2017/10/25 12:00:01 REMARK 6 MODELLER OBJECTIVE FUNCTION: 95.2729 REMARK 6 MODELLER BEST TEMPLATE % SEQ ID: 47.619 REMARK 6 SEQUENCE: model REMARK 6 ALIGNMENT: alignment.pir REMARK 6 DOPE score: -1099.62317 REMARK 6 GA341 score: 0.73412 REMARK 6 Normalized DOPE score: -1.19447 REMARK 6 TEMPLATE: 2i13A02 75:A - 95:A MODELS 1: - 21: AT 47.6% ATOM 1 N GLU 193 -3.199 25.373 57.459 1.00 69.52 N ATOM 2 CA GLU 193 -4.582 24.853 57.354 1.00 69.52 C ATOM 3 CB GLU 193 -4.629 23.321 57.486 1.00 69.52 C ATOM 4 CG GLU 193 -4.089 22.524 56.303 1.00 69.52 C ATOM 5 CD GLU 193 -4.371 21.053 56.600 1.00 69.52 C ATOM 6 OE1 GLU 193 -5.551 20.729 56.895 1.00 69.52 O ATOM 7 OE2 GLU 193 -3.412 20.234 56.532 1.00 69.52 O ATOM 8 C GLU 193 -5.469 25.369 58.434 1.00 69.52 C ATOM 9 O GLU 193 -5.060 25.488 59.589 1.00 69.52 O ATOM 10 N LYS 194 -6.712 25.727 58.064 1.00 76.70 N ATOM 11 CA LYS 194 -7.681 26.122 59.043 1.00 76.70 C ATOM 12 CB LYS 194 -7.982 27.624 59.022 1.00 76.70 C ATOM 13 CG LYS 194 -6.857 28.507 59.558 1.00 76.70 C ATOM 14 CD LYS 194 -7.043 29.968 59.158 1.00 76.70 C ATOM 15 CE LYS 194 -6.196 30.951 59.963 1.00 76.70 C ATOM 16 NZ LYS 194 -6.233 32.287 59.326 1.00 76.70 N ATOM 17 C LYS 194 -8.949 25.436 58.649 1.00 76.70 C ATOM 18 O LYS 194 -9.873 26.051 58.129 1.00 76.70 O ATOM 19 N PRO 195 -9.012 24.166 58.905 1.00124.38 N ATOM 20 CA PRO 195 -10.125 23.359 58.495 1.00124.38 C ATOM 21 CD PRO 195 -8.238 23.540 59.964 1.00124.38 C ATOM 22 CB PRO 195 -9.823 21.962 59.019 1.00124.38 C ATOM 23 CG PRO 195 -9.007 22.248 60.293 1.00124.38 C ATOM 24 C PRO 195 -11.436 23.820 59.032 1.00124.38 C ATOM 25 O PRO 195 -12.449 23.598 58.373 1.00124.38 O ATOM 26 N PHE 196 -11.458 24.442 60.220 1.00113.09 N ATOM 27 CA PHE 196 -12.737 24.743 60.785 1.00113.09 C ATOM 28 CB PHE 196 -12.762 24.525 62.303 1.00113.09 C ATOM 29 CG PHE 196 -12.788 23.048 62.523 1.00113.09 C ATOM 30 CD1 PHE 196 -11.689 22.269 62.247 1.00113.09 C ATOM 31 CD2 PHE 196 -13.935 22.435 62.969 1.00113.09 C ATOM 32 CE1 PHE 196 -11.720 20.907 62.442 1.00113.09 C ATOM 33 CE2 PHE 196 -13.973 21.074 63.168 1.00113.09 C ATOM 34 CZ PHE 196 -12.864 20.306 62.907 1.00113.09 C ATOM 35 C PHE 196 -13.122 26.150 60.476 1.00113.09 C ATOM 36 O PHE 196 -12.376 27.093 60.734 1.00113.09 O ATOM 37 N THR 197 -14.334 26.317 59.915 1.00100.33 N ATOM 38 CA THR 197 -14.786 27.633 59.579 1.00100.33 C ATOM 39 CB THR 197 -15.094 27.821 58.121 1.00100.33 C ATOM 40 OG1 THR 197 -15.408 29.184 57.875 1.00100.33 O ATOM 41 CG2 THR 197 -16.281 26.921 57.726 1.00100.33 C ATOM 42 C THR 197 -16.055 27.902 60.311 1.00100.33 C ATOM 43 O THR 197 -16.879 27.008 60.497 1.00100.33 O ATOM 44 N CYS 198 -16.231 29.158 60.766 1.00 40.39 N ATOM 45 CA CYS 198 -17.451 29.515 61.428 1.00 40.39 C ATOM 46 CB CYS 198 -17.350 30.814 62.245 1.00 40.39 C ATOM 47 SG CYS 198 -18.891 31.246 63.109 1.00 40.39 S ATOM 48 C CYS 198 -18.472 29.733 60.355 1.00 40.39 C ATOM 49 O CYS 198 -18.215 30.393 59.352 1.00 40.39 O ATOM 50 N THR 199 -19.683 29.187 60.549 1.00 40.18 N ATOM 51 CA THR 199 -20.665 29.304 59.519 1.00 40.18 C ATOM 52 CB THR 199 -21.895 28.508 59.809 1.00 40.18 C ATOM 53 OG1 THR 199 -21.554 27.141 59.996 1.00 40.18 O ATOM 54 CG2 THR 199 -22.843 28.650 58.608 1.00 40.18 C ATOM 55 C THR 199 -21.054 30.740 59.335 1.00 40.18 C ATOM 56 O THR 199 -21.188 31.205 58.204 1.00 40.18 O ATOM 57 N ARG 200 -21.280 31.476 60.439 1.00119.03 N ATOM 58 CA ARG 200 -21.735 32.834 60.305 1.00119.03 C ATOM 59 CB ARG 200 -22.131 33.439 61.661 1.00119.03 C ATOM 60 CG ARG 200 -22.344 34.957 61.663 1.00119.03 C ATOM 61 CD ARG 200 -23.324 35.387 62.753 1.00119.03 C ATOM 62 NE ARG 200 -23.002 36.784 63.151 1.00119.03 N ATOM 63 CZ ARG 200 -23.865 37.809 62.900 1.00119.03 C ATOM 64 NH1 ARG 200 -24.940 37.610 62.084 1.00119.03 N ATOM 65 NH2 ARG 200 -23.663 39.020 63.499 1.00119.03 N ATOM 66 C ARG 200 -20.734 33.757 59.671 1.00119.03 C ATOM 67 O ARG 200 -20.995 34.333 58.616 1.00119.03 O ATOM 68 N CYS 201 -19.560 33.931 60.311 1.00 58.10 N ATOM 69 CA CYS 201 -18.560 34.861 59.854 1.00 58.10 C ATOM 70 CB CYS 201 -17.576 35.277 60.964 1.00 58.10 C ATOM 71 SG CYS 201 -16.719 33.871 61.732 1.00 58.10 S ATOM 72 C CYS 201 -17.790 34.360 58.665 1.00 58.10 C ATOM 73 O CYS 201 -17.486 35.124 57.751 1.00 58.10 O ATOM 74 N GLY 202 -17.461 33.055 58.633 1.00 25.67 N ATOM 75 CA GLY 202 -16.658 32.554 57.555 1.00 25.67 C ATOM 76 C GLY 202 -15.227 32.552 58.006 1.00 25.67 C ATOM 77 O GLY 202 -14.320 32.252 57.231 1.00 25.67 O ATOM 78 N ARG 203 -14.992 32.894 59.289 1.00154.39 N ATOM 79 CA ARG 203 -13.676 32.927 59.859 1.00154.39 C ATOM 80 CB ARG 203 -13.679 33.577 61.254 1.00154.39 C ATOM 81 CG ARG 203 -12.296 33.699 61.890 1.00154.39 C ATOM 82 CD ARG 203 -11.369 34.651 61.136 1.00154.39 C ATOM 83 NE ARG 203 -11.883 36.026 61.369 1.00154.39 N ATOM 84 CZ ARG 203 -11.011 37.048 61.600 1.00154.39 C ATOM 85 NH1 ARG 203 -9.664 36.838 61.514 1.00154.39 N ATOM 86 NH2 ARG 203 -11.496 38.276 61.945 1.00154.39 N ATOM 87 C ARG 203 -13.201 31.507 59.999 1.00154.39 C ATOM 88 O ARG 203 -13.992 30.603 60.271 1.00154.39 O ATOM 89 N SER 204 -11.885 31.269 59.811 1.00 93.92 N ATOM 90 CA SER 204 -11.403 29.917 59.879 1.00 93.92 C ATOM 91 CB SER 204 -10.725 29.462 58.577 1.00 93.92 C ATOM 92 OG SER 204 -9.661 30.342 58.249 1.00 93.92 O ATOM 93 C SER 204 -10.421 29.798 61.005 1.00 93.92 C ATOM 94 O SER 204 -9.713 30.751 61.327 1.00 93.92 O ATOM 95 N PHE 205 -10.358 28.607 61.646 1.00136.87 N ATOM 96 CA PHE 205 -9.502 28.452 62.787 1.00136.87 C ATOM 97 CB PHE 205 -10.276 28.295 64.109 1.00136.87 C ATOM 98 CG PHE 205 -10.998 29.568 64.391 1.00136.87 C ATOM 99 CD1 PHE 205 -12.257 29.783 63.875 1.00136.87 C ATOM 100 CD2 PHE 205 -10.418 30.550 65.162 1.00136.87 C ATOM 101 CE1 PHE 205 -12.928 30.956 64.129 1.00136.87 C ATOM 102 CE2 PHE 205 -11.085 31.726 65.422 1.00136.87 C ATOM 103 CZ PHE 205 -12.343 31.928 64.908 1.00136.87 C ATOM 104 C PHE 205 -8.673 27.218 62.648 1.00136.87 C ATOM 105 O PHE 205 -9.041 26.256 61.972 1.00136.87 O ATOM 106 N SER 206 -7.498 27.246 63.299 1.00 72.06 N ATOM 107 CA SER 206 -6.601 26.135 63.322 1.00 72.06 C ATOM 108 CB SER 206 -5.261 26.467 63.995 1.00 72.06 C ATOM 109 OG SER 206 -4.507 25.274 64.152 1.00 72.06 O ATOM 110 C SER 206 -7.206 25.018 64.117 1.00 72.06 C ATOM 111 O SER 206 -7.062 23.854 63.747 1.00 72.06 O ATOM 112 N GLY 207 -7.914 25.335 65.223 1.00 28.33 N ATOM 113 CA GLY 207 -8.373 24.262 66.061 1.00 28.33 C ATOM 114 C GLY 207 -9.855 24.304 66.250 1.00 28.33 C ATOM 115 O GLY 207 -10.502 25.346 66.183 1.00 28.33 O ATOM 116 N SER 208 -10.412 23.108 66.532 1.00 35.00 N ATOM 117 CA SER 208 -11.814 22.896 66.729 1.00 35.00 C ATOM 118 CB SER 208 -12.132 21.419 67.015 1.00 35.00 C ATOM 119 OG SER 208 -11.617 20.603 65.977 1.00 35.00 O ATOM 120 C SER 208 -12.285 23.653 67.932 1.00 35.00 C ATOM 121 O SER 208 -13.308 24.333 67.879 1.00 35.00 O ATOM 122 N SER 209 -11.544 23.558 69.050 1.00 65.92 N ATOM 123 CA SER 209 -12.000 24.161 70.273 1.00 65.92 C ATOM 124 CB SER 209 -11.099 23.844 71.481 1.00 65.92 C ATOM 125 OG SER 209 -11.150 22.460 71.801 1.00 65.92 O ATOM 126 C SER 209 -12.044 25.645 70.116 1.00 65.92 C ATOM 127 O SER 209 -12.961 26.300 70.608 1.00 65.92 O ATOM 128 N GLN 210 -11.054 26.217 69.415 1.00 33.85 N ATOM 129 CA GLN 210 -11.006 27.641 69.290 1.00 33.85 C ATOM 130 CB GLN 210 -9.715 28.098 68.579 1.00 33.85 C ATOM 131 CG GLN 210 -8.467 27.664 69.361 1.00 33.85 C ATOM 132 CD GLN 210 -7.214 28.097 68.608 1.00 33.85 C ATOM 133 OE1 GLN 210 -7.288 28.739 67.562 1.00 33.85 O ATOM 134 NE2 GLN 210 -6.018 27.741 69.148 1.00 33.85 N ATOM 135 C GLN 210 -12.216 28.105 68.535 1.00 33.85 C ATOM 136 O GLN 210 -12.830 29.102 68.914 1.00 33.85 O ATOM 137 N LEU 211 -12.611 27.394 67.461 1.00 49.31 N ATOM 138 CA LEU 211 -13.766 27.816 66.717 1.00 49.31 C ATOM 139 CB LEU 211 -14.023 26.974 65.457 1.00 49.31 C ATOM 140 CG LEU 211 -15.316 27.366 64.712 1.00 49.31 C ATOM 141 CD1 LEU 211 -15.296 28.839 64.283 1.00 49.31 C ATOM 142 CD2 LEU 211 -15.586 26.422 63.525 1.00 49.31 C ATOM 143 C LEU 211 -14.988 27.709 67.577 1.00 49.31 C ATOM 144 O LEU 211 -15.830 28.604 67.586 1.00 49.31 O ATOM 145 N ASN 212 -15.103 26.607 68.341 1.00 33.98 N ATOM 146 CA ASN 212 -16.266 26.405 69.154 1.00 33.98 C ATOM 147 CB ASN 212 -16.236 25.104 69.963 1.00 33.98 C ATOM 148 CG ASN 212 -16.713 24.006 69.026 1.00 33.98 C ATOM 149 OD1 ASN 212 -17.887 23.949 68.667 1.00 33.98 O ATOM 150 ND2 ASN 212 -15.779 23.104 68.621 1.00 33.98 N ATOM 151 C ASN 212 -16.380 27.523 70.122 1.00 33.98 C ATOM 152 O ASN 212 -17.475 28.016 70.380 1.00 33.98 O ATOM 153 N GLN 213 -15.243 27.962 70.684 1.00 87.96 N ATOM 154 CA GLN 213 -15.311 29.014 71.644 1.00 87.96 C ATOM 155 CB GLN 213 -13.937 29.393 72.214 1.00 87.96 C ATOM 156 CG GLN 213 -14.024 30.188 73.516 1.00 87.96 C ATOM 157 CD GLN 213 -14.314 29.206 74.645 1.00 87.96 C ATOM 158 OE1 GLN 213 -13.726 29.290 75.722 1.00 87.96 O ATOM 159 NE2 GLN 213 -15.257 28.257 74.399 1.00 87.96 N ATOM 160 C GLN 213 -15.880 30.235 70.936 1.00 87.96 C ATOM 161 O GLN 213 -17.007 30.664 71.305 1.00 87.96 O ATOM 162 OXT GLN 213 -15.197 30.753 70.013 1.00 87.96 O