PFRMAT TS TARGET T0348 MODEL 4 REFINED PARENT N/A ATOM 1 N MET 1 4.472 -4.507 8.508 1.00 0.00 ATOM 2 CA MET 1 4.472 -4.507 9.958 1.00 0.00 ATOM 3 C MET 1 5.885 -4.507 10.517 1.00 0.00 ATOM 4 O MET 1 6.088 -4.507 11.731 1.00 0.00 ATOM 5 N ASP 2 6.891 -4.507 9.647 1.00 0.00 ATOM 6 CA ASP 2 8.260 -4.468 10.121 1.00 0.00 ATOM 7 C ASP 2 8.699 -3.050 10.451 1.00 0.00 ATOM 8 O ASP 2 8.009 -2.082 10.135 1.00 0.00 ATOM 9 N ALA 3 9.854 -2.898 11.092 1.00 0.00 ATOM 10 CA ALA 3 10.317 -1.571 11.447 1.00 0.00 ATOM 11 C ALA 3 10.288 -0.631 10.253 1.00 0.00 ATOM 12 O ALA 3 9.951 0.546 10.378 1.00 0.00 ATOM 13 N LYS 4 10.641 -1.128 9.071 1.00 0.00 ATOM 14 CA LYS 4 10.640 -0.277 7.897 1.00 0.00 ATOM 15 C LYS 4 9.257 0.289 7.616 1.00 0.00 ATOM 16 O LYS 4 9.099 1.479 7.351 1.00 0.00 ATOM 17 N PHE 5 8.228 -0.552 7.669 1.00 0.00 ATOM 18 CA PHE 5 6.885 -0.070 7.412 1.00 0.00 ATOM 19 C PHE 5 6.396 0.846 8.523 1.00 0.00 ATOM 20 O PHE 5 5.724 1.845 8.272 1.00 0.00 ATOM 21 N LEU 6 6.723 0.525 9.771 1.00 0.00 ATOM 22 CA LEU 6 6.290 1.364 10.872 1.00 0.00 ATOM 23 C LEU 6 6.817 2.783 10.735 1.00 0.00 ATOM 24 O LEU 6 6.099 3.753 10.973 1.00 0.00 ATOM 25 N GLU 7 8.080 2.935 10.348 1.00 0.00 ATOM 26 CA GLU 7 8.629 4.265 10.170 1.00 0.00 ATOM 27 C GLU 7 9.083 4.495 8.737 1.00 0.00 ATOM 28 O GLU 7 9.416 5.614 8.349 1.00 0.00 ATOM 29 N ILE 8 9.104 3.444 7.923 1.00 0.00 ATOM 30 CA ILE 8 9.606 3.585 6.570 1.00 0.00 ATOM 31 C ILE 8 8.919 2.622 5.616 1.00 0.00 ATOM 32 O ILE 8 8.712 1.452 5.933 1.00 0.00 ATOM 33 N LEU 9 8.552 3.093 4.427 1.00 0.00 ATOM 34 CA LEU 9 7.922 2.213 3.462 1.00 0.00 ATOM 35 C LEU 9 8.655 2.228 2.130 1.00 0.00 ATOM 36 O LEU 9 8.825 3.276 1.510 1.00 0.00 ATOM 37 N VAL 10 9.103 1.066 1.663 1.00 0.00 ATOM 38 CA VAL 10 9.729 1.002 0.357 1.00 0.00 ATOM 39 C VAL 10 8.832 0.314 -0.660 1.00 0.00 ATOM 40 O VAL 10 8.299 -0.766 -0.409 1.00 0.00 ATOM 41 N CYS 11 8.647 0.923 -1.827 1.00 0.00 ATOM 42 CA CYS 11 7.893 0.266 -2.877 1.00 0.00 ATOM 43 C CYS 11 8.738 -0.760 -3.614 1.00 0.00 ATOM 44 O CYS 11 9.825 -0.455 -4.104 1.00 0.00 ATOM 45 N PRO 12 8.259 -1.997 -3.709 1.00 0.00 ATOM 46 CA PRO 12 9.068 -3.045 -4.301 1.00 0.00 ATOM 47 C PRO 12 9.143 -2.907 -5.812 1.00 0.00 ATOM 48 O PRO 12 10.067 -3.409 -6.451 1.00 0.00 ATOM 49 N LEU 13 8.173 -2.225 -6.416 1.00 0.00 ATOM 50 CA LEU 13 8.218 -2.016 -7.850 1.00 0.00 ATOM 51 C LEU 13 9.306 -1.028 -8.238 1.00 0.00 ATOM 52 O LEU 13 10.017 -1.220 -9.223 1.00 0.00 ATOM 53 N CYS 14 9.458 0.049 -7.473 1.00 0.00 ATOM 54 CA CYS 14 10.391 1.089 -7.862 1.00 0.00 ATOM 55 C CYS 14 11.373 1.405 -6.746 1.00 0.00 ATOM 56 O CYS 14 12.220 2.288 -6.875 1.00 0.00 ATOM 57 N LYS 15 11.281 0.693 -5.626 1.00 0.00 ATOM 58 CA LYS 15 12.162 0.978 -4.511 1.00 0.00 ATOM 59 C LYS 15 12.081 2.436 -4.091 1.00 0.00 ATOM 60 O LYS 15 13.008 2.978 -3.491 1.00 0.00 ATOM 61 N GLY 16 10.971 3.102 -4.397 1.00 0.00 ATOM 62 CA GLY 16 10.787 4.460 -3.924 1.00 0.00 ATOM 63 C GLY 16 10.574 4.505 -2.420 1.00 0.00 ATOM 64 O GLY 16 9.865 3.675 -1.853 1.00 0.00 ATOM 65 N PRO 17 11.182 5.475 -1.742 1.00 0.00 ATOM 66 CA PRO 17 11.010 5.573 -0.306 1.00 0.00 ATOM 67 C PRO 17 9.669 6.189 0.057 1.00 0.00 ATOM 68 O PRO 17 9.164 7.068 -0.640 1.00 0.00 ATOM 69 N LEU 18 9.065 5.742 1.154 1.00 0.00 ATOM 70 CA LEU 18 7.788 6.299 1.556 1.00 0.00 ATOM 71 C LEU 18 7.759 6.619 3.042 1.00 0.00 ATOM 72 O LEU 18 8.599 6.150 3.809 1.00 0.00 ATOM 73 N VAL 19 6.794 7.422 3.479 1.00 0.00 ATOM 74 CA VAL 19 6.701 7.742 4.890 1.00 0.00 ATOM 75 C VAL 19 5.482 7.097 5.531 1.00 0.00 ATOM 76 O VAL 19 4.350 7.311 5.101 1.00 0.00 ATOM 77 N PHE 20 5.688 6.294 6.571 1.00 0.00 ATOM 78 CA PHE 20 4.564 5.652 7.225 1.00 0.00 ATOM 79 C PHE 20 4.251 6.300 8.564 1.00 0.00 ATOM 80 O PHE 20 5.151 6.637 9.332 1.00 0.00 ATOM 81 N ASP 21 2.971 6.486 8.872 1.00 0.00 ATOM 82 CA ASP 21 2.611 7.086 10.142 1.00 0.00 ATOM 83 C ASP 21 2.001 6.065 11.089 1.00 0.00 ATOM 84 O ASP 21 0.892 5.579 10.871 1.00 0.00 ATOM 85 N LYS 22 2.710 5.720 12.159 1.00 0.00 ATOM 86 CA LYS 22 2.197 4.722 13.078 1.00 0.00 ATOM 87 C LYS 22 0.916 5.187 13.751 1.00 0.00 ATOM 88 O LYS 22 0.022 4.392 14.034 1.00 0.00 ATOM 89 N SER 23 0.800 6.485 14.021 1.00 0.00 ATOM 90 CA SER 23 -0.396 6.986 14.668 1.00 0.00 ATOM 91 C SER 23 -1.641 6.697 13.845 1.00 0.00 ATOM 92 O SER 23 -2.620 6.147 14.346 1.00 0.00 ATOM 93 N LYS 24 -1.629 7.061 12.566 1.00 0.00 ATOM 94 CA LYS 24 -2.792 6.821 11.733 1.00 0.00 ATOM 95 C LYS 24 -2.675 5.509 10.974 1.00 0.00 ATOM 96 O LYS 24 -3.637 5.039 10.368 1.00 0.00 ATOM 97 N ASP 25 -1.497 4.893 10.990 1.00 0.00 ATOM 98 CA ASP 25 -1.317 3.654 10.259 1.00 0.00 ATOM 99 C ASP 25 -1.416 3.870 8.758 1.00 0.00 ATOM 100 O ASP 25 -1.632 2.932 7.993 1.00 0.00 ATOM 101 N GLU 26 -1.260 5.111 8.305 1.00 0.00 ATOM 102 CA GLU 26 -1.369 5.384 6.885 1.00 0.00 ATOM 103 C GLU 26 -0.011 5.358 6.204 1.00 0.00 ATOM 104 O GLU 26 0.923 6.041 6.622 1.00 0.00 ATOM 105 N LEU 27 0.128 4.571 5.140 1.00 0.00 ATOM 106 CA LEU 27 1.401 4.504 4.450 1.00 0.00 ATOM 107 C LEU 27 1.349 5.216 3.109 1.00 0.00 ATOM 108 O LEU 27 0.561 4.865 2.232 1.00 0.00 ATOM 109 N ILE 28 2.187 6.233 2.920 1.00 0.00 ATOM 110 CA ILE 28 2.175 6.958 1.665 1.00 0.00 ATOM 111 C ILE 28 3.473 6.768 0.897 1.00 0.00 ATOM 112 O ILE 28 4.564 6.943 1.439 1.00 0.00 ATOM 113 N CYS 29 3.384 6.406 -0.380 1.00 0.00 ATOM 114 CA CYS 29 4.586 6.257 -1.177 1.00 0.00 ATOM 115 C CYS 29 4.711 7.362 -2.212 1.00 0.00 ATOM 116 O CYS 29 3.828 7.555 -3.046 1.00 0.00 ATOM 117 N LYS 30 5.811 8.110 -2.182 1.00 0.00 ATOM 118 CA LYS 30 5.940 9.245 -3.075 1.00 0.00 ATOM 119 C LYS 30 6.268 8.808 -4.493 1.00 0.00 ATOM 120 O LYS 30 6.182 9.593 -5.436 1.00 0.00 ATOM 121 N GLY 31 6.652 7.547 -4.673 1.00 0.00 ATOM 122 CA GLY 31 6.918 7.055 -6.011 1.00 0.00 ATOM 123 C GLY 31 5.662 6.502 -6.664 1.00 0.00 ATOM 124 O GLY 31 5.372 6.786 -7.825 1.00 0.00 ATOM 125 N ASP 32 4.891 5.701 -5.933 1.00 0.00 ATOM 126 CA ASP 32 3.752 5.040 -6.539 1.00 0.00 ATOM 127 C ASP 32 2.443 5.698 -6.134 1.00 0.00 ATOM 128 O ASP 32 1.385 5.401 -6.687 1.00 0.00 ATOM 129 N ARG 33 2.486 6.603 -5.161 1.00 0.00 ATOM 130 CA ARG 33 1.255 7.104 -4.582 1.00 0.00 ATOM 131 C ARG 33 0.454 5.993 -3.922 1.00 0.00 ATOM 132 O ARG 33 -0.715 6.168 -3.582 1.00 0.00 ATOM 133 N LEU 34 1.065 4.828 -3.728 1.00 0.00 ATOM 134 CA LEU 34 0.344 3.722 -3.129 1.00 0.00 ATOM 135 C LEU 34 0.073 3.965 -1.653 1.00 0.00 ATOM 136 O LEU 34 0.911 4.508 -0.934 1.00 0.00 ATOM 137 N ALA 35 -1.101 3.568 -1.171 1.00 0.00 ATOM 138 CA ALA 35 -1.437 3.819 0.217 1.00 0.00 ATOM 139 C ALA 35 -1.637 2.525 0.988 1.00 0.00 ATOM 140 O ALA 35 -2.289 1.596 0.512 1.00 0.00 ATOM 141 N PHE 36 -1.083 2.435 2.193 1.00 0.00 ATOM 142 CA PHE 36 -1.285 1.246 2.998 1.00 0.00 ATOM 143 C PHE 36 -2.072 1.554 4.262 1.00 0.00 ATOM 144 O PHE 36 -1.687 2.409 5.058 1.00 0.00 ATOM 145 N PRO 37 -3.190 0.864 4.472 1.00 0.00 ATOM 146 CA PRO 37 -3.989 1.122 5.655 1.00 0.00 ATOM 147 C PRO 37 -3.859 0.001 6.673 1.00 0.00 ATOM 148 O PRO 37 -4.069 -1.170 6.359 1.00 0.00 ATOM 149 N ILE 38 -3.511 0.334 7.912 1.00 0.00 ATOM 150 CA ILE 38 -3.398 -0.688 8.934 1.00 0.00 ATOM 151 C ILE 38 -4.364 -0.442 10.081 1.00 0.00 ATOM 152 O ILE 38 -4.436 0.658 10.626 1.00 0.00 ATOM 153 N LYS 39 -5.126 -1.460 10.472 1.00 0.00 ATOM 154 CA LYS 39 -6.051 -1.292 11.575 1.00 0.00 ATOM 155 C LYS 39 -5.832 -2.339 12.654 1.00 0.00 ATOM 156 O LYS 39 -6.280 -3.478 12.536 1.00 0.00 ATOM 157 N ASP 40 -5.138 -1.976 13.730 1.00 0.00 ATOM 158 CA ASP 40 -4.848 -2.947 14.767 1.00 0.00 ATOM 159 C ASP 40 -3.971 -4.075 14.248 1.00 0.00 ATOM 160 O ASP 40 -2.800 -3.873 13.928 1.00 0.00 ATOM 161 N GLY 41 -4.517 -5.284 14.154 1.00 0.00 ATOM 162 CA GLY 41 -3.734 -6.395 13.649 1.00 0.00 ATOM 163 C GLY 41 -4.127 -6.756 12.226 1.00 0.00 ATOM 164 O GLY 41 -3.655 -7.746 11.668 1.00 0.00 ATOM 165 N ILE 42 -4.998 -5.963 11.610 1.00 0.00 ATOM 166 CA ILE 42 -5.413 -6.258 10.252 1.00 0.00 ATOM 167 C ILE 42 -4.507 -5.588 9.232 1.00 0.00 ATOM 168 O ILE 42 -4.161 -4.415 9.362 1.00 0.00 ATOM 169 N PRO 43 -4.103 -6.318 8.196 1.00 0.00 ATOM 170 CA PRO 43 -3.315 -5.708 7.142 1.00 0.00 ATOM 171 C PRO 43 -4.188 -5.248 5.986 1.00 0.00 ATOM 172 O PRO 43 -5.087 -5.963 5.545 1.00 0.00 ATOM 173 N MET 44 -3.943 -4.046 5.472 1.00 0.00 ATOM 174 CA MET 44 -4.811 -3.508 4.443 1.00 0.00 ATOM 175 C MET 44 -4.017 -3.013 3.244 1.00 0.00 ATOM 176 O MET 44 -2.946 -2.426 3.389 1.00 0.00 ATOM 177 N MET 45 -4.525 -3.240 2.036 1.00 0.00 ATOM 178 CA MET 45 -3.861 -2.711 0.860 1.00 0.00 ATOM 179 C MET 45 -4.777 -1.794 0.066 1.00 0.00 ATOM 180 O MET 45 -5.924 -2.133 -0.220 1.00 0.00 ATOM 181 N LEU 46 -4.290 -0.613 -0.307 1.00 0.00 ATOM 182 CA LEU 46 -5.129 0.320 -1.033 1.00 0.00 ATOM 183 C LEU 46 -4.703 0.441 -2.487 1.00 0.00 ATOM 184 O LEU 46 -3.525 0.624 -2.791 1.00 0.00 ATOM 185 N GLU 47 -5.650 0.341 -3.415 1.00 0.00 ATOM 186 CA GLU 47 -5.308 0.473 -4.818 1.00 0.00 ATOM 187 C GLU 47 -5.796 1.794 -5.390 1.00 0.00 ATOM 188 O GLU 47 -6.989 1.984 -5.622 1.00 0.00 ATOM 189 N SER 48 -4.886 2.733 -5.631 1.00 0.00 ATOM 190 CA SER 48 -5.293 4.017 -6.169 1.00 0.00 ATOM 191 C SER 48 -5.446 3.966 -7.681 1.00 0.00 ATOM 192 O SER 48 -4.942 3.059 -8.340 1.00 0.00 ATOM 193 N GLU 49 -6.146 4.938 -8.260 1.00 0.00 ATOM 194 CA GLU 49 -6.374 4.913 -9.691 1.00 0.00 ATOM 195 C GLU 49 -6.836 3.543 -10.160 1.00 0.00 ATOM 196 O GLU 49 -6.277 2.968 -11.093 1.00 0.00 ATOM 197 N ALA 50 -7.867 2.993 -9.526 1.00 0.00 ATOM 198 CA ALA 50 -8.354 1.687 -9.928 1.00 0.00 ATOM 199 C ALA 50 -8.717 1.656 -11.404 1.00 0.00 ATOM 200 O ALA 50 -8.479 0.668 -12.096 1.00 0.00 ATOM 201 N ARG 51 -9.301 2.736 -11.915 1.00 0.00 ATOM 202 CA ARG 51 -9.696 2.755 -13.310 1.00 0.00 ATOM 203 C ARG 51 -8.489 2.733 -14.234 1.00 0.00 ATOM 204 O ARG 51 -8.619 2.571 -15.446 1.00 0.00 ATOM 205 N GLU 52 -7.290 2.897 -13.681 1.00 0.00 ATOM 206 CA GLU 52 -6.101 2.870 -14.510 1.00 0.00 ATOM 207 C GLU 52 -5.393 1.527 -14.428 1.00 0.00 ATOM 208 O GLU 52 -4.447 1.261 -15.169 1.00 0.00 ATOM 209 N LEU 53 -5.834 0.654 -13.528 1.00 0.00 ATOM 210 CA LEU 53 -5.177 -0.630 -13.380 1.00 0.00 ATOM 211 C LEU 53 -5.460 -1.543 -14.561 1.00 0.00 ATOM 212 O LEU 53 -6.589 -1.632 -15.040 1.00 0.00 ATOM 213 N ALA 54 -4.441 -2.241 -15.055 1.00 0.00 ATOM 214 CA ALA 54 -4.658 -3.161 -16.155 1.00 0.00 ATOM 215 C ALA 54 -5.150 -4.514 -15.664 1.00 0.00 ATOM 216 O ALA 54 -5.429 -4.697 -14.480 1.00 0.00 ATOM 217 N PRO 55 -5.265 -5.488 -16.562 1.00 0.00 ATOM 218 CA PRO 55 -5.892 -6.742 -16.194 1.00 0.00 ATOM 219 C PRO 55 -5.092 -7.478 -15.132 1.00 0.00 ATOM 220 O PRO 55 -5.652 -8.062 -14.206 1.00 0.00 ATOM 221 N GLU 56 -3.767 -7.465 -15.243 1.00 0.00 ATOM 222 CA GLU 56 -2.948 -8.106 -14.232 1.00 0.00 ATOM 223 C GLU 56 -3.176 -7.497 -12.859 1.00 0.00 ATOM 224 O GLU 56 -3.305 -8.207 -11.862 1.00 0.00 ATOM 225 N GLU 57 -3.229 -6.171 -12.776 1.00 0.00 ATOM 226 CA GLU 57 -3.481 -5.533 -11.498 1.00 0.00 ATOM 227 C GLU 57 -4.870 -5.861 -10.974 1.00 0.00 ATOM 228 O GLU 57 -5.036 -6.255 -9.820 1.00 0.00 ATOM 229 N GLU 58 -5.894 -5.707 -11.808 1.00 0.00 ATOM 230 CA GLU 58 -7.239 -6.030 -11.373 1.00 0.00 ATOM 231 C GLU 58 -7.346 -7.475 -10.913 1.00 0.00 ATOM 232 O GLU 58 -7.960 -7.772 -9.890 1.00 0.00 ATOM 233 N VAL 59 -6.751 -8.402 -11.658 1.00 0.00 ATOM 234 CA VAL 59 -6.804 -9.796 -11.261 1.00 0.00 ATOM 235 C VAL 59 -6.156 -10.016 -9.904 1.00 0.00 ATOM 236 O VAL 59 -6.656 -10.777 -9.077 1.00 0.00 ATOM 237 N LYS 60 -5.030 -9.355 -9.647 1.00 0.00 ATOM 238 CA LYS 60 -4.372 -9.517 -8.365 1.00 0.00 ATOM 239 C LYS 60 -5.198 -8.929 -7.233 1.00 0.00 ATOM 240 O LYS 60 -5.268 -9.488 -6.140 1.00 0.00 ATOM 241 N LEU 61 -5.841 -7.789 -7.471 1.00 0.00 ATOM 242 CA LEU 61 -6.660 -7.189 -6.435 1.00 0.00 ATOM 243 C LEU 61 -7.815 -8.095 -6.040 1.00 0.00 ATOM 244 O LEU 61 -8.133 -8.242 -4.861 1.00 0.00 ATOM 245 N GLU 62 -8.466 -8.721 -7.017 1.00 0.00 ATOM 246 CA GLU 62 -9.571 -9.605 -6.701 1.00 0.00 ATOM 247 C GLU 62 -9.119 -10.789 -5.862 1.00 0.00 ATOM 248 O GLU 62 -9.761 -11.153 -4.878 1.00 0.00 ATOM 249 N HIS 63 -8.004 -11.413 -6.232 1.00 0.00 ATOM 250 CA HIS 63 -7.516 -12.541 -5.463 1.00 0.00 ATOM 251 C HIS 63 -7.204 -12.147 -4.028 1.00 0.00 ATOM 252 O HIS 63 -7.409 -12.924 -3.097 1.00 0.00 ATOM 253 N HIS 64 -6.702 -10.933 -3.820 1.00 0.00 ATOM 254 CA HIS 64 -6.377 -10.503 -2.474 1.00 0.00 ATOM 255 C HIS 64 -7.478 -9.639 -1.881 1.00 0.00 ATOM 256 O HIS 64 -8.558 -9.503 -2.455 1.00 0.00 ATOM 257 N HIS 65 -7.229 -9.037 -0.722 1.00 0.00 ATOM 258 CA HIS 65 -8.240 -8.197 -0.109 1.00 0.00 ATOM 259 C HIS 65 -7.951 -6.721 -0.331 1.00 0.00 ATOM 260 O HIS 65 -8.032 -5.912 0.592 1.00 0.00 ATOM 261 N HIS 66 -7.608 -6.340 -1.558 1.00 0.00 ATOM 262 CA HIS 66 -7.317 -4.946 -1.830 1.00 0.00 ATOM 263 C HIS 66 -8.589 -4.122 -1.947 1.00 0.00 ATOM 264 O HIS 66 -9.590 -4.573 -2.500 1.00 0.00 ATOM 265 N HIS 67 -8.576 -2.897 -1.429 1.00 0.00 ATOM 266 CA HIS 67 -9.755 -2.057 -1.523 1.00 0.00 ATOM 267 C HIS 67 -9.936 -1.503 -2.927 1.00 0.00 ATOM 268 O HIS 67 -9.001 -0.976 -3.528 1.00 0.00 ATOM 269 N HIS 68 -11.142 -1.609 -3.478 1.00 0.00 ATOM 270 CA HIS 68 -12.223 -2.236 -2.742 1.00 0.00 ATOM 271 C HIS 68 -11.769 -2.700 -1.368 1.00 0.00 TER END