EXPDTA THEORETICAL MODEL, MODELLER 9.15 2017/03/07 08:56:47 REMARK 6 MODELLER OBJECTIVE FUNCTION: -1451.4434 REMARK 6 MODELLER BEST TEMPLATE % SEQ ID: 30.435 REMARK 6 SEQUENCE: model REMARK 6 DOPE score: -1451.44336 REMARK 6 GA341 score: 0.34309 REMARK 6 Normalized DOPE score: 0.26023 REMARK 6 TEMPLATE: d1wgla_ ATOM 1 N GLU 205 6.897 -8.502 -0.081 1.00 23.97 N ATOM 2 CA GLU 205 7.995 -8.394 -1.069 1.00 23.97 C ATOM 3 CB GLU 205 8.661 -9.772 -1.266 1.00 23.97 C ATOM 4 CG GLU 205 9.438 -10.263 -0.034 1.00 23.97 C ATOM 5 CD GLU 205 9.815 -11.733 -0.210 1.00 23.97 C ATOM 6 OE1 GLU 205 9.145 -12.425 -1.023 1.00 23.97 O ATOM 7 OE2 GLU 205 10.773 -12.189 0.472 1.00 23.97 O ATOM 8 C GLU 205 7.459 -7.880 -2.368 1.00 23.97 C ATOM 9 O GLU 205 6.695 -6.917 -2.392 1.00 23.97 O ATOM 10 N SER 206 7.861 -8.508 -3.491 1.00 27.46 N ATOM 11 CA SER 206 7.396 -8.054 -4.769 1.00 27.46 C ATOM 12 CB SER 206 7.994 -8.819 -5.969 1.00 27.46 C ATOM 13 OG SER 206 7.420 -10.117 -6.046 1.00 27.46 O ATOM 14 C SER 206 5.920 -8.288 -4.811 1.00 27.46 C ATOM 15 O SER 206 5.184 -7.551 -5.463 1.00 27.46 O ATOM 16 N SER 207 5.451 -9.310 -4.069 1.00 83.64 N ATOM 17 CA SER 207 4.071 -9.684 -4.101 1.00 83.64 C ATOM 18 CB SER 207 3.722 -10.772 -3.076 1.00 83.64 C ATOM 19 OG SER 207 3.749 -10.236 -1.761 1.00 83.64 O ATOM 20 C SER 207 3.283 -8.485 -3.730 1.00 83.64 C ATOM 21 O SER 207 2.209 -8.248 -4.270 1.00 83.64 O ATOM 22 N ILE 208 3.806 -7.668 -2.807 1.00 46.65 N ATOM 23 CA ILE 208 3.048 -6.522 -2.425 1.00 46.65 C ATOM 24 CB ILE 208 3.756 -5.687 -1.398 1.00 46.65 C ATOM 25 CG1 ILE 208 4.006 -6.497 -0.114 1.00 46.65 C ATOM 26 CG2 ILE 208 2.924 -4.414 -1.174 1.00 46.65 C ATOM 27 CD1 ILE 208 5.030 -5.856 0.823 1.00 46.65 C ATOM 28 C ILE 208 2.897 -5.655 -3.630 1.00 46.65 C ATOM 29 O ILE 208 1.793 -5.259 -3.998 1.00 46.65 O ATOM 30 N LYS 209 4.021 -5.392 -4.313 1.00118.50 N ATOM 31 CA LYS 209 4.020 -4.477 -5.413 1.00118.50 C ATOM 32 CB LYS 209 5.411 -4.300 -6.036 1.00118.50 C ATOM 33 CG LYS 209 5.541 -3.016 -6.851 1.00118.50 C ATOM 34 CD LYS 209 5.525 -1.786 -5.943 1.00118.50 C ATOM 35 CE LYS 209 6.158 -2.061 -4.571 1.00118.50 C ATOM 36 NZ LYS 209 6.411 -0.796 -3.843 1.00118.50 N ATOM 37 C LYS 209 3.143 -5.012 -6.486 1.00118.50 C ATOM 38 O LYS 209 2.384 -4.271 -7.110 1.00118.50 O ATOM 39 N GLU 210 3.217 -6.333 -6.722 1.00 78.15 N ATOM 40 CA GLU 210 2.487 -6.887 -7.821 1.00 78.15 C ATOM 41 CB GLU 210 2.619 -8.414 -7.937 1.00 78.15 C ATOM 42 CG GLU 210 2.092 -8.945 -9.272 1.00 78.15 C ATOM 43 CD GLU 210 1.908 -10.446 -9.151 1.00 78.15 C ATOM 44 OE1 GLU 210 1.561 -10.900 -8.028 1.00 78.15 O ATOM 45 OE2 GLU 210 2.090 -11.154 -10.179 1.00 78.15 O ATOM 46 C GLU 210 1.042 -6.614 -7.602 1.00 78.15 C ATOM 47 O GLU 210 0.351 -6.120 -8.491 1.00 78.15 O ATOM 48 N LEU 211 0.545 -6.905 -6.389 1.00 98.62 N ATOM 49 CA LEU 211 -0.846 -6.674 -6.135 1.00 98.62 C ATOM 50 CB LEU 211 -1.285 -7.143 -4.734 1.00 98.62 C ATOM 51 CG LEU 211 -1.428 -8.674 -4.611 1.00 98.62 C ATOM 52 CD1 LEU 211 -2.652 -9.178 -5.399 1.00 98.62 C ATOM 53 CD2 LEU 211 -0.141 -9.401 -5.030 1.00 98.62 C ATOM 54 C LEU 211 -1.148 -5.208 -6.214 1.00 98.62 C ATOM 55 O LEU 211 -2.101 -4.789 -6.867 1.00 98.62 O ATOM 56 N HIS 212 -0.289 -4.381 -5.594 1.00125.22 N ATOM 57 CA HIS 212 -0.561 -2.983 -5.425 1.00125.22 C ATOM 58 ND1 HIS 212 1.336 0.139 -4.735 1.00125.22 N ATOM 59 CG HIS 212 0.394 -0.816 -4.418 1.00125.22 C ATOM 60 CB HIS 212 0.585 -2.285 -4.662 1.00125.22 C ATOM 61 NE2 HIS 212 -0.371 1.219 -3.804 1.00125.22 N ATOM 62 CD2 HIS 212 -0.645 -0.137 -3.855 1.00125.22 C ATOM 63 CE1 HIS 212 0.830 1.336 -4.344 1.00125.22 C ATOM 64 C HIS 212 -0.778 -2.311 -6.737 1.00125.22 C ATOM 65 O HIS 212 -1.786 -1.627 -6.915 1.00125.22 O ATOM 66 N ASP 213 0.128 -2.507 -7.708 1.00 68.58 N ATOM 67 CA ASP 213 -0.054 -1.781 -8.925 1.00 68.58 C ATOM 68 CB ASP 213 1.107 -1.942 -9.925 1.00 68.58 C ATOM 69 CG ASP 213 2.268 -1.064 -9.464 1.00 68.58 C ATOM 70 OD1 ASP 213 2.022 -0.113 -8.674 1.00 68.58 O ATOM 71 OD2 ASP 213 3.416 -1.327 -9.909 1.00 68.58 O ATOM 72 C ASP 213 -1.327 -2.219 -9.567 1.00 68.58 C ATOM 73 O ASP 213 -2.116 -1.385 -10.009 1.00 68.58 O ATOM 74 N MET 214 -1.580 -3.540 -9.610 1.00 67.96 N ATOM 75 CA MET 214 -2.767 -4.012 -10.255 1.00 67.96 C ATOM 76 CB MET 214 -2.842 -5.550 -10.303 1.00 67.96 C ATOM 77 CG MET 214 -1.942 -6.164 -11.377 1.00 67.96 C ATOM 78 SD MET 214 -2.489 -5.763 -13.063 1.00 67.96 S ATOM 79 CE MET 214 -1.513 -7.048 -13.892 1.00 67.96 C ATOM 80 C MET 214 -3.971 -3.488 -9.543 1.00 67.96 C ATOM 81 O MET 214 -4.866 -2.931 -10.175 1.00 67.96 O ATOM 82 N PHE 215 -4.029 -3.623 -8.202 1.00100.41 N ATOM 83 CA PHE 215 -5.192 -3.111 -7.533 1.00100.41 C ATOM 84 CB PHE 215 -5.929 -4.119 -6.625 1.00100.41 C ATOM 85 CG PHE 215 -6.167 -5.444 -7.264 1.00100.41 C ATOM 86 CD1 PHE 215 -7.232 -5.678 -8.101 1.00100.41 C ATOM 87 CD2 PHE 215 -5.307 -6.478 -6.974 1.00100.41 C ATOM 88 CE1 PHE 215 -7.415 -6.925 -8.654 1.00100.41 C ATOM 89 CE2 PHE 215 -5.482 -7.724 -7.520 1.00100.41 C ATOM 90 CZ PHE 215 -6.543 -7.948 -8.363 1.00100.41 C ATOM 91 C PHE 215 -4.690 -2.145 -6.512 1.00100.41 C ATOM 92 O PHE 215 -4.479 -2.531 -5.363 1.00100.41 O ATOM 93 N MET 216 -4.475 -0.869 -6.856 1.00140.28 N ATOM 94 CA MET 216 -4.050 -0.013 -5.789 1.00140.28 C ATOM 95 CB MET 216 -3.689 1.428 -6.192 1.00140.28 C ATOM 96 CG MET 216 -2.658 1.582 -7.307 1.00140.28 C ATOM 97 SD MET 216 -3.385 1.488 -8.968 1.00140.28 S ATOM 98 CE MET 216 -4.335 3.020 -8.739 1.00140.28 C ATOM 99 C MET 216 -5.223 0.141 -4.875 1.00140.28 C ATOM 100 O MET 216 -5.090 0.205 -3.654 1.00140.28 O ATOM 101 N ASP 217 -6.418 0.207 -5.490 1.00122.87 N ATOM 102 CA ASP 217 -7.642 0.542 -4.827 1.00122.87 C ATOM 103 CB ASP 217 -8.837 0.530 -5.789 1.00122.87 C ATOM 104 CG ASP 217 -8.513 1.459 -6.942 1.00122.87 C ATOM 105 OD1 ASP 217 -7.481 2.178 -6.870 1.00122.87 O ATOM 106 OD2 ASP 217 -9.294 1.441 -7.929 1.00122.87 O ATOM 107 C ASP 217 -8.004 -0.423 -3.743 1.00122.87 C ATOM 108 O ASP 217 -8.257 0.000 -2.617 1.00122.87 O ATOM 109 N ILE 218 -8.028 -1.744 -4.014 1.00 70.79 N ATOM 110 CA ILE 218 -8.599 -2.554 -2.974 1.00 70.79 C ATOM 111 CB ILE 218 -10.015 -2.918 -3.308 1.00 70.79 C ATOM 112 CG1 ILE 218 -10.872 -1.636 -3.313 1.00 70.79 C ATOM 113 CG2 ILE 218 -10.491 -4.016 -2.346 1.00 70.79 C ATOM 114 CD1 ILE 218 -12.254 -1.806 -3.937 1.00 70.79 C ATOM 115 C ILE 218 -7.836 -3.816 -2.733 1.00 70.79 C ATOM 116 O ILE 218 -7.460 -4.511 -3.674 1.00 70.79 O ATOM 117 N ALA 219 -7.583 -4.146 -1.446 1.00 52.21 N ATOM 118 CA ALA 219 -6.940 -5.395 -1.144 1.00 52.21 C ATOM 119 CB ALA 219 -5.464 -5.451 -1.572 1.00 52.21 C ATOM 120 C ALA 219 -6.975 -5.603 0.335 1.00 52.21 C ATOM 121 O ALA 219 -7.087 -4.647 1.098 1.00 52.21 O ATOM 122 N MET 220 -6.894 -6.880 0.769 1.00 72.53 N ATOM 123 CA MET 220 -6.882 -7.212 2.168 1.00 72.53 C ATOM 124 CB MET 220 -6.927 -8.729 2.425 1.00 72.53 C ATOM 125 CG MET 220 -8.210 -9.393 1.920 1.00 72.53 C ATOM 126 SD MET 220 -8.433 -11.119 2.439 1.00 72.53 S ATOM 127 CE MET 220 -7.016 -11.722 1.479 1.00 72.53 C ATOM 128 C MET 220 -5.612 -6.699 2.776 1.00 72.53 C ATOM 129 O MET 220 -5.606 -6.164 3.885 1.00 72.53 O ATOM 130 N LEU 221 -4.498 -6.843 2.036 1.00105.78 N ATOM 131 CA LEU 221 -3.202 -6.471 2.525 1.00105.78 C ATOM 132 CB LEU 221 -2.076 -6.785 1.522 1.00105.78 C ATOM 133 CG LEU 221 -1.943 -8.286 1.192 1.00105.78 C ATOM 134 CD1 LEU 221 -3.156 -8.797 0.399 1.00105.78 C ATOM 135 CD2 LEU 221 -0.608 -8.597 0.498 1.00105.78 C ATOM 136 C LEU 221 -3.181 -5.003 2.780 1.00105.78 C ATOM 137 O LEU 221 -2.655 -4.561 3.797 1.00105.78 O ATOM 138 N VAL 222 -3.748 -4.208 1.856 1.00 34.18 N ATOM 139 CA VAL 222 -3.758 -2.788 2.038 1.00 34.18 C ATOM 140 CB VAL 222 -4.396 -2.054 0.900 1.00 34.18 C ATOM 141 CG1 VAL 222 -4.514 -0.571 1.290 1.00 34.18 C ATOM 142 CG2 VAL 222 -3.556 -2.293 -0.365 1.00 34.18 C ATOM 143 C VAL 222 -4.560 -2.508 3.256 1.00 34.18 C ATOM 144 O VAL 222 -4.198 -1.656 4.067 1.00 34.18 O ATOM 145 N GLU 223 -5.669 -3.248 3.423 1.00 91.13 N ATOM 146 CA GLU 223 -6.505 -3.035 4.558 1.00 91.13 C ATOM 147 CB GLU 223 -7.685 -4.015 4.618 1.00 91.13 C ATOM 148 CG GLU 223 -8.668 -3.707 5.744 1.00 91.13 C ATOM 149 CD GLU 223 -9.715 -4.800 5.695 1.00 91.13 C ATOM 150 OE1 GLU 223 -9.433 -5.903 6.233 1.00 91.13 O ATOM 151 OE2 GLU 223 -10.804 -4.554 5.112 1.00 91.13 O ATOM 152 C GLU 223 -5.634 -3.295 5.733 1.00 91.13 C ATOM 153 O GLU 223 -5.719 -2.618 6.757 1.00 91.13 O ATOM 154 N ASN 224 -4.733 -4.276 5.581 1.00188.73 N ATOM 155 CA ASN 224 -3.844 -4.616 6.642 1.00188.73 C ATOM 156 CB ASN 224 -3.207 -6.002 6.506 1.00188.73 C ATOM 157 CG ASN 224 -4.230 -7.008 6.993 1.00188.73 C ATOM 158 OD1 ASN 224 -5.018 -7.547 6.217 1.00188.73 O ATOM 159 ND2 ASN 224 -4.214 -7.271 8.327 1.00188.73 N ATOM 160 C ASN 224 -2.747 -3.614 6.686 1.00188.73 C ATOM 161 O ASN 224 -2.428 -2.934 5.715 1.00188.73 O ATOM 162 N GLN 225 -2.149 -3.482 7.877 1.00210.12 N ATOM 163 CA GLN 225 -1.141 -2.491 8.054 1.00210.12 C ATOM 164 CB GLN 225 -0.775 -2.319 9.540 1.00210.12 C ATOM 165 CG GLN 225 0.021 -1.060 9.860 1.00210.12 C ATOM 166 CD GLN 225 -0.905 0.118 9.607 1.00210.12 C ATOM 167 OE1 GLN 225 -2.090 -0.063 9.330 1.00210.12 O ATOM 168 NE2 GLN 225 -0.347 1.356 9.684 1.00210.12 N ATOM 169 C GLN 225 0.074 -2.946 7.329 1.00210.12 C ATOM 170 O GLN 225 0.752 -3.868 7.777 1.00210.12 O ATOM 171 N GLY 226 0.398 -2.287 6.200 1.00 74.11 N ATOM 172 CA GLY 226 1.585 -2.668 5.499 1.00 74.11 C ATOM 173 C GLY 226 1.418 -4.069 5.023 1.00 74.11 C ATOM 174 O GLY 226 0.841 -4.303 3.961 1.00 74.11 O ATOM 175 N SER 227 1.964 -5.039 5.781 1.00 76.17 N ATOM 176 CA SER 227 1.881 -6.417 5.400 1.00 76.17 C ATOM 177 CB SER 227 2.393 -7.395 6.475 1.00 76.17 C ATOM 178 OG SER 227 3.757 -7.128 6.766 1.00 76.17 O ATOM 179 C SER 227 0.424 -6.744 5.149 1.00 76.17 C ATOM 180 O SER 227 0.102 -7.045 3.971 1.00 76.17 O ATOM 181 OXT SER 227 -0.380 -6.707 6.119 1.00 76.17 O