REMARK SEQUENCE t0227 REMARK MODEL 14 REMARK PARENT 1LBA REMARK SCORE 0.574 REMARK LOOPP v3.0 with LOOPP driver v3.1 [ALI] (08/24/04 12:18 EST) (compiled Sep 20 2004 17:13:12) REMARK prediction finished on Mon Oct 11 09:03:25 2004 EST ATOM 1 CA ARG 30 -15.569 11.362 -2.512 1.00 0.00 ATOM 2 N ARG 30 -16.488 11.308 -3.635 1.00 0.00 ATOM 3 C ARG 30 -16.271 10.535 -1.426 1.00 0.00 ATOM 4 O ARG 30 -17.508 10.514 -1.476 1.00 0.00 ATOM 5 CA LYS 31 -16.262 8.960 0.488 1.00 0.00 ATOM 6 N LYS 31 -15.604 9.843 -0.477 1.00 0.00 ATOM 7 C LYS 31 -15.506 8.751 1.817 1.00 0.00 ATOM 8 O LYS 31 -14.440 9.345 2.045 1.00 0.00 ATOM 9 CA THR 32 -15.640 7.608 4.037 1.00 0.00 ATOM 10 N THR 32 -16.097 7.906 2.683 1.00 0.00 ATOM 11 C THR 32 -14.897 6.291 4.005 1.00 0.00 ATOM 12 O THR 32 -15.182 5.488 3.115 1.00 0.00 ATOM 13 CA ARG 33 -13.286 4.709 4.915 1.00 0.00 ATOM 14 N ARG 33 -13.980 5.993 4.918 1.00 0.00 ATOM 15 C ARG 33 -14.163 3.528 5.285 1.00 0.00 ATOM 16 O ARG 33 -15.158 3.688 5.991 1.00 0.00 ATOM 17 CA HIS 34 -14.591 1.168 5.294 1.00 0.00 ATOM 18 N HIS 34 -13.806 2.314 4.865 1.00 0.00 ATOM 19 C HIS 34 -14.119 0.848 6.707 1.00 0.00 ATOM 20 O HIS 34 -14.923 0.841 7.640 1.00 0.00 ATOM 21 CA ARG 35 -12.298 0.323 8.207 1.00 0.00 ATOM 22 N ARG 35 -12.814 0.646 6.908 1.00 0.00 ATOM 23 C ARG 35 -11.186 1.279 8.647 1.00 0.00 ATOM 24 O ARG 35 -10.836 2.214 7.921 1.00 0.00 ATOM 25 CA GLY 36 -9.523 1.872 10.366 1.00 0.00 ATOM 26 N GLY 36 -10.641 1.099 9.866 1.00 0.00 ATOM 27 C GLY 36 -8.610 0.883 11.047 1.00 0.00 ATOM 28 O GLY 36 -8.682 0.574 12.234 1.00 0.00 ATOM 29 CA PRO 37 -6.751 -0.584 10.717 1.00 0.00 ATOM 30 N PRO 37 -7.742 0.343 10.238 1.00 0.00 ATOM 31 C PRO 37 -5.580 0.082 11.412 1.00 0.00 ATOM 32 O PRO 37 -4.862 -0.573 12.168 1.00 0.00 ATOM 33 CA LEU 38 -4.127 1.991 11.685 1.00 0.00 ATOM 34 N LEU 38 -5.289 1.352 11.106 1.00 0.00 ATOM 35 C LEU 38 -4.225 3.487 11.883 1.00 0.00 ATOM 36 O LEU 38 -5.114 4.136 11.317 1.00 0.00 ATOM 37 CA GLY 39 -3.237 5.455 12.971 1.00 0.00 ATOM 38 N GLY 39 -3.374 4.018 12.758 1.00 0.00 ATOM 39 C GLY 39 -1.773 5.610 12.639 1.00 0.00 ATOM 40 O GLY 39 -0.931 4.961 13.281 1.00 0.00 ATOM 41 CA ILE 40 -0.097 6.671 11.159 1.00 0.00 ATOM 42 N ILE 40 -1.488 6.398 11.589 1.00 0.00 ATOM 43 C ILE 40 0.352 8.000 11.733 1.00 0.00 ATOM 44 O ILE 40 -0.442 8.949 11.749 1.00 0.00 ATOM 45 CA VAL 41 2.148 9.377 12.581 1.00 0.00 ATOM 46 N VAL 41 1.602 8.104 12.125 1.00 0.00 ATOM 47 C VAL 41 3.190 9.816 11.539 1.00 0.00 ATOM 48 O VAL 41 3.984 9.033 10.966 1.00 0.00 ATOM 49 CA SER 42 4.032 11.792 10.267 1.00 0.00 ATOM 50 N SER 42 3.154 11.120 11.226 1.00 0.00 ATOM 51 C SER 42 4.506 13.096 10.935 1.00 0.00 ATOM 52 O SER 42 3.965 13.521 11.964 1.00 0.00 ATOM 53 CA GLY 43 5.963 15.089 10.565 1.00 0.00 ATOM 54 N GLY 43 5.519 13.713 10.323 1.00 0.00 ATOM 55 C GLY 43 5.781 15.835 9.210 1.00 0.00 ATOM 56 O GLY 43 5.686 15.187 8.133 1.00 0.00 ATOM 57 CA GLY 44 5.535 18.023 8.084 1.00 0.00 ATOM 58 N GLY 44 5.666 17.179 9.258 1.00 0.00 ATOM 59 C GLY 44 6.845 18.369 7.378 1.00 0.00 ATOM 60 O GLY 44 6.833 19.074 6.369 1.00 0.00 ATOM 61 CA ARG 45 9.324 18.161 7.392 1.00 0.00 ATOM 62 N ARG 45 7.981 17.909 7.872 1.00 0.00 ATOM 63 C ARG 45 9.632 19.650 7.302 1.00 0.00 ATOM 64 O ARG 45 10.109 20.135 6.273 1.00 0.00 ATOM 65 CA LEU 46 9.657 21.790 8.472 1.00 0.00 ATOM 66 N LEU 46 9.293 20.389 8.368 1.00 0.00 ATOM 67 C LEU 46 10.610 22.019 9.649 1.00 0.00 ATOM 68 O LEU 46 10.933 21.130 10.465 1.00 0.00 ATOM 69 CA ILE 47 12.219 23.628 10.564 1.00 0.00 ATOM 70 N ILE 47 11.262 23.186 9.564 1.00 0.00 ATOM 71 C ILE 47 11.573 24.239 11.807 1.00 0.00 ATOM 72 O ILE 47 10.454 24.776 11.701 1.00 0.00 ATOM 73 CA GLY 48 11.857 24.977 14.191 1.00 0.00 ATOM 74 N GLY 48 12.255 24.274 12.972 1.00 0.00 ATOM 75 C GLY 48 11.108 26.305 14.065 1.00 0.00 ATOM 76 O GLY 48 10.017 26.476 14.621 1.00 0.00 ATOM 77 CA GLU 49 11.108 28.546 13.087 1.00 0.00 ATOM 78 N GLU 49 11.659 27.211 13.240 1.00 0.00 ATOM 79 C GLU 49 9.798 28.549 12.350 1.00 0.00 ATOM 80 O GLU 49 9.111 29.580 12.283 1.00 0.00 ATOM 81 CA GLY 50 8.233 27.361 10.991 1.00 0.00 ATOM 82 N GLY 50 9.444 27.404 11.746 1.00 0.00 ATOM 83 C GLY 50 7.066 27.011 11.883 1.00 0.00 ATOM 84 O GLY 50 6.629 25.873 12.055 1.00 0.00 ATOM 85 CA PRO 51 5.347 27.927 13.258 1.00 0.00 ATOM 86 N PRO 51 6.537 28.061 12.453 1.00 0.00 ATOM 87 C PRO 51 4.064 27.846 12.425 1.00 0.00 ATOM 88 O PRO 51 3.182 28.732 12.433 1.00 0.00 ATOM 89 CA PHE 52 2.706 26.631 10.852 1.00 0.00 ATOM 90 N PHE 52 3.912 26.756 11.689 1.00 0.00 ATOM 91 C PHE 52 1.646 25.622 11.334 1.00 0.00 ATOM 92 O PHE 52 1.903 24.804 12.220 1.00 0.00 ATOM 93 CA SER 53 -0.647 24.736 11.011 1.00 0.00 ATOM 94 N SER 53 0.465 25.629 10.726 1.00 0.00 ATOM 95 C SER 53 -1.432 24.376 9.740 1.00 0.00 ATOM 96 O SER 53 -0.920 24.593 8.628 1.00 0.00 ATOM 97 CA VAL 54 -3.471 23.476 8.696 1.00 0.00 ATOM 98 N VAL 54 -2.687 23.910 9.848 1.00 0.00 ATOM 99 C VAL 54 -3.711 24.533 7.653 1.00 0.00 ATOM 100 O VAL 54 -3.806 24.119 6.511 1.00 0.00 ATOM 101 CA GLU 55 -4.052 26.863 6.960 1.00 0.00 ATOM 102 N GLU 55 -3.848 25.831 7.966 1.00 0.00 ATOM 103 C GLU 55 -2.911 26.843 5.923 1.00 0.00 ATOM 104 O GLU 55 -3.118 26.916 4.699 1.00 0.00 ATOM 105 CA GLU 56 -0.545 26.665 5.446 1.00 0.00 ATOM 106 N GLU 56 -1.674 26.663 6.366 1.00 0.00 ATOM 107 C GLU 56 -0.406 25.304 4.783 1.00 0.00 ATOM 108 O GLU 56 -0.442 25.258 3.557 1.00 0.00 ATOM 109 CA LEU 57 -0.152 22.858 4.921 1.00 0.00 ATOM 110 N LEU 57 -0.336 24.179 5.506 1.00 0.00 ATOM 111 C LEU 57 -1.319 22.507 3.998 1.00 0.00 ATOM 112 O LEU 57 -1.121 21.714 3.093 1.00 0.00 ATOM 113 CA LEU 58 -3.648 22.709 3.247 1.00 0.00 ATOM 114 N LEU 58 -2.547 22.966 4.171 1.00 0.00 ATOM 115 C LEU 58 -3.323 23.409 1.930 1.00 0.00 ATOM 116 O LEU 58 -3.334 22.765 0.877 1.00 0.00 ATOM 117 CA ALA 59 -2.441 25.465 0.887 1.00 0.00 ATOM 118 N ALA 59 -2.871 24.669 2.020 1.00 0.00 ATOM 119 C ALA 59 -1.311 24.806 0.127 1.00 0.00 ATOM 120 O ALA 59 -1.356 24.724 -1.106 1.00 0.00 ATOM 121 CA HIS 60 0.812 23.601 0.170 1.00 0.00 ATOM 122 N HIS 60 -0.305 24.287 0.814 1.00 0.00 ATOM 123 C HIS 60 0.417 22.322 -0.546 1.00 0.00 ATOM 124 O HIS 60 1.010 21.940 -1.567 1.00 0.00 ATOM 125 CA GLN 61 -0.990 20.335 -0.592 1.00 0.00 ATOM 126 N GLN 61 -0.568 21.606 -0.025 1.00 0.00 ATOM 127 C GLN 61 -1.853 20.547 -1.821 1.00 0.00 ATOM 128 O GLN 61 -1.786 19.788 -2.795 1.00 0.00 ATOM 129 CA GLU 62 -3.474 21.951 -2.945 1.00 0.00 ATOM 130 N GLU 62 -2.674 21.589 -1.802 1.00 0.00 ATOM 131 C GLU 62 -2.608 22.550 -4.019 1.00 0.00 ATOM 132 O GLU 62 -2.877 22.237 -5.176 1.00 0.00 ATOM 133 CA LYS 63 -0.655 23.776 -4.834 1.00 0.00 ATOM 134 N LYS 63 -1.582 23.380 -3.775 1.00 0.00 ATOM 135 C LYS 63 -0.029 22.505 -5.414 1.00 0.00 ATOM 136 O LYS 63 0.301 22.485 -6.585 1.00 0.00 ATOM 137 CA HIS 64 0.737 20.214 -5.348 1.00 0.00 ATOM 138 N HIS 64 0.221 21.410 -4.701 1.00 0.00 ATOM 139 C HIS 64 -0.325 19.412 -6.071 1.00 0.00 ATOM 140 O HIS 64 -0.008 18.329 -6.551 1.00 0.00 ATOM 141 CA LEU 65 -2.562 19.073 -6.972 1.00 0.00 ATOM 142 N LEU 65 -1.589 19.837 -6.197 1.00 0.00 ATOM 143 C LEU 65 -3.531 18.237 -6.186 1.00 0.00 ATOM 144 O LEU 65 -4.414 17.631 -6.804 1.00 0.00 ATOM 145 CA LYS 66 -4.481 17.344 -4.163 1.00 0.00 ATOM 146 N LYS 66 -3.461 18.129 -4.862 1.00 0.00 ATOM 147 C LYS 66 -5.691 18.191 -3.848 1.00 0.00 ATOM 148 O LYS 66 -5.685 19.417 -3.959 1.00 0.00 ATOM 149 CA ASP 67 -7.972 18.199 -3.136 1.00 0.00 ATOM 150 N ASP 67 -6.737 17.526 -3.399 1.00 0.00 ATOM 151 C ASP 67 -8.036 18.883 -1.787 1.00 0.00 ATOM 152 O ASP 67 -8.849 19.796 -1.639 1.00 0.00 ATOM 153 CA GLU 68 -7.299 19.080 0.538 1.00 0.00 ATOM 154 N GLU 68 -7.191 18.536 -0.810 1.00 0.00 ATOM 155 C GLU 68 -6.018 18.674 1.230 1.00 0.00 ATOM 156 O GLU 68 -5.122 18.060 0.630 1.00 0.00 ATOM 157 CA PRO 69 -4.867 18.539 3.394 1.00 0.00 ATOM 158 N PRO 69 -5.923 19.019 2.517 1.00 0.00 ATOM 159 C PRO 69 -5.042 17.024 3.405 1.00 0.00 ATOM 160 O PRO 69 -6.181 16.593 3.518 1.00 0.00 ATOM 161 CA LEU 70 -4.098 14.766 3.425 1.00 0.00 ATOM 162 N LEU 70 -3.982 16.219 3.377 1.00 0.00 ATOM 163 C LEU 70 -4.201 14.161 4.837 1.00 0.00 ATOM 164 O LEU 70 -4.437 12.948 5.009 1.00 0.00 ATOM 165 CA TYR 71 -3.971 14.468 7.253 1.00 0.00 ATOM 166 N TYR 71 -4.044 14.999 5.887 1.00 0.00 ATOM 167 C TYR 71 -5.305 14.763 7.892 1.00 0.00 ATOM 168 O TYR 71 -5.976 15.746 7.594 1.00 0.00 ATOM 169 CA ALA 72 -6.854 14.042 9.624 1.00 0.00 ATOM 170 N ALA 72 -5.645 13.896 8.829 1.00 0.00 ATOM 171 C ALA 72 -6.551 14.988 10.793 1.00 0.00 ATOM 172 O ALA 72 -7.419 15.800 11.114 1.00 0.00 ATOM 173 CA TRP 73 -5.005 15.920 12.485 1.00 0.00 ATOM 174 N TRP 73 -5.321 15.035 11.365 1.00 0.00 ATOM 175 C TRP 73 -3.617 16.544 12.366 1.00 0.00 ATOM 176 O TRP 73 -2.665 15.818 12.019 1.00 0.00 ATOM 177 CA VAL 74 -2.147 18.518 12.691 1.00 0.00 ATOM 178 N VAL 74 -3.469 17.872 12.615 1.00 0.00 ATOM 179 C VAL 74 -1.844 18.998 14.115 1.00 0.00 ATOM 180 O VAL 74 -2.672 19.678 14.723 1.00 0.00 ATOM 181 CA LEU 75 -0.390 19.215 16.004 1.00 0.00 ATOM 182 N LEU 75 -0.679 18.726 14.677 1.00 0.00 ATOM 183 C LEU 75 0.644 20.315 15.829 1.00 0.00 ATOM 184 O LEU 75 1.781 20.023 15.470 1.00 0.00 ATOM 185 CA GLU 76 1.128 22.756 15.923 1.00 0.00 ATOM 186 N GLU 76 0.254 21.568 16.044 1.00 0.00 ATOM 187 C GLU 76 2.171 22.705 17.027 1.00 0.00 ATOM 188 O GLU 76 1.981 21.935 17.985 1.00 0.00 ATOM 189 CA ASN 77 4.337 23.464 17.905 1.00 0.00 ATOM 190 N ASN 77 3.220 23.540 16.983 1.00 0.00 ATOM 191 C ASN 77 4.024 23.936 19.297 1.00 0.00 ATOM 192 O ASN 77 4.729 23.562 20.210 1.00 0.00 ATOM 193 CA ALA 78 2.565 25.007 20.886 1.00 0.00 ATOM 194 N ALA 78 3.007 24.738 19.528 1.00 0.00 ATOM 195 C ALA 78 1.651 23.909 21.455 1.00 0.00 ATOM 196 O ALA 78 1.117 24.119 22.552 1.00 0.00 ATOM 197 CA PHE 79 0.567 21.686 21.260 1.00 0.00 ATOM 198 N PHE 79 1.389 22.781 20.753 1.00 0.00 ATOM 199 C PHE 79 -0.867 21.771 20.815 1.00 0.00 ATOM 200 O PHE 79 -1.651 20.910 21.187 1.00 0.00 ATOM 201 CA ARG 80 -2.718 22.900 19.568 1.00 0.00 ATOM 202 N ARG 80 -1.324 22.771 20.035 1.00 0.00 ATOM 203 C ARG 80 -2.934 21.792 18.541 1.00 0.00 ATOM 204 O ARG 80 -2.071 21.667 17.656 1.00 0.00 ATOM 205 CA TYR 81 -4.287 20.025 17.611 1.00 0.00 ATOM 206 N TYR 81 -4.022 21.015 18.620 1.00 0.00 ATOM 207 C TYR 81 -5.440 20.602 16.789 1.00 0.00 ATOM 208 O TYR 81 -6.428 21.088 17.337 1.00 0.00 ATOM 209 CA GLU 82 -6.220 21.199 14.538 1.00 0.00 ATOM 210 N GLU 82 -5.242 20.654 15.468 1.00 0.00 ATOM 211 C GLU 82 -6.646 20.034 13.653 1.00 0.00 ATOM 212 O GLU 82 -5.866 19.106 13.376 1.00 0.00 ATOM 213 CA LYS 83 -8.430 19.025 12.423 1.00 0.00 ATOM 214 N LYS 83 -7.893 20.072 13.241 1.00 0.00 ATOM 215 C LYS 83 -8.173 19.318 10.942 1.00 0.00 ATOM 216 O LYS 83 -8.179 20.487 10.532 1.00 0.00 ATOM 217 CA PRO 84 -7.684 18.499 8.737 1.00 0.00 ATOM 218 N PRO 84 -7.961 18.289 10.140 1.00 0.00 ATOM 219 C PRO 84 -8.884 17.951 8.002 1.00 0.00 ATOM 220 O PRO 84 -9.967 18.524 8.022 1.00 0.00 ATOM 221 CA LEU 85 -13.927 9.442 8.868 1.00 0.00 ATOM 222 N LEU 85 -13.513 10.695 9.496 1.00 0.00 ATOM 223 C LEU 85 -13.615 9.266 7.371 1.00 0.00 ATOM 224 O LEU 85 -13.895 8.232 6.766 1.00 0.00 ATOM 225 CA HIS 86 -12.710 10.258 5.308 1.00 0.00 ATOM 226 N HIS 86 -12.958 10.242 6.746 1.00 0.00 ATOM 227 C HIS 86 -11.391 9.649 4.938 1.00 0.00 ATOM 228 O HIS 86 -10.524 9.436 5.793 1.00 0.00 ATOM 229 CA VAL 87 -9.984 8.803 3.101 1.00 0.00 ATOM 230 N VAL 87 -11.240 9.326 3.653 1.00 0.00 ATOM 231 C VAL 87 -9.105 10.040 2.971 1.00 0.00 ATOM 232 O VAL 87 -9.567 11.115 2.579 1.00 0.00 ATOM 233 CA PRO 88 -7.023 11.172 3.265 1.00 0.00 ATOM 234 N PRO 88 -7.871 10.000 3.405 1.00 0.00 ATOM 235 C PRO 88 -5.864 10.788 2.381 1.00 0.00 ATOM 236 O PRO 88 -5.853 9.661 1.896 1.00 0.00 ATOM 237 CA ARG 89 -3.705 11.242 1.351 1.00 0.00 ATOM 238 N ARG 89 -4.848 11.618 2.171 1.00 0.00 ATOM 239 C ARG 89 -2.388 11.422 2.121 1.00 0.00 ATOM 240 O ARG 89 -1.762 12.497 2.111 1.00 0.00 ATOM 241 CA ARG 90 -0.788 10.589 3.707 1.00 0.00 ATOM 242 N ARG 90 -1.904 10.395 2.803 1.00 0.00 ATOM 243 C ARG 90 0.177 9.424 3.684 1.00 0.00 ATOM 244 O ARG 90 1.403 9.552 3.979 1.00 0.00 ATOM 245 CA PRO 91 -8.089 3.526 2.357 1.00 0.00 ATOM 246 N PRO 91 -6.788 4.157 2.246 1.00 0.00 ATOM 247 C PRO 91 -8.536 3.062 3.751 1.00 0.00 ATOM 248 O PRO 91 -9.733 2.901 4.013 1.00 0.00 ATOM 249 CA GLY 92 -8.031 2.263 5.960 1.00 0.00 ATOM 250 N GLY 92 -7.628 2.836 4.684 1.00 0.00 ATOM 251 C GLY 92 -7.266 2.832 7.183 1.00 0.00 ATOM 252 O GLY 92 -6.882 2.061 8.097 1.00 0.00 ATOM 253 CA ARG 93 -6.205 4.665 8.355 1.00 0.00 ATOM 254 N ARG 93 -7.048 4.160 7.292 1.00 0.00 ATOM 255 C ARG 93 -6.412 6.105 8.681 1.00 0.00 ATOM 256 O ARG 93 -7.072 6.791 7.921 1.00 0.00 ATOM 257 CA VAL 94 -5.939 7.974 10.284 1.00 0.00 ATOM 258 N VAL 94 -5.896 6.576 9.825 1.00 0.00 ATOM 259 C VAL 94 -4.523 8.466 10.062 1.00 0.00 ATOM 260 O VAL 94 -3.566 7.736 10.303 1.00 0.00 ATOM 261 CA MET 95 -2.974 10.212 9.477 1.00 0.00 ATOM 262 N MET 95 -4.323 9.699 9.613 1.00 0.00 ATOM 263 C MET 95 -2.835 11.413 10.414 1.00 0.00 ATOM 264 O MET 95 -3.719 12.299 10.388 1.00 0.00 ATOM 265 CA PHE 96 -1.599 12.466 12.211 1.00 0.00 ATOM 266 N PHE 96 -1.785 11.403 11.237 1.00 0.00 ATOM 267 C PHE 96 -0.279 13.124 11.845 1.00 0.00 ATOM 268 O PHE 96 0.730 12.457 11.584 1.00 0.00 ATOM 269 CA VAL 97 1.005 15.143 11.511 1.00 0.00 ATOM 270 N VAL 97 -0.236 14.437 11.829 1.00 0.00 ATOM 271 C VAL 97 1.573 16.101 12.562 1.00 0.00 ATOM 272 O VAL 97 0.912 17.028 13.026 1.00 0.00