USER MOD reduce.3.24.130724 H: found=0, std=0, add=88, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 88 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 G O2' : rot -113:sc= 0.204 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 C O2' : rot -69:sc= 0.323 USER MOD Single : A 3 U O2' : rot 153:sc= 0.376 USER MOD Single : A 4 G O2' : rot 173:sc= -0.111 USER MOD Single : A 5 U O2' : rot 139:sc= 0.408 USER MOD Single : A 6 G O2' : rot -95:sc= 1.17 USER MOD Single : A 7 C O2' : rot 180:sc= 0 USER MOD Single : A 8 C O2' : rot -19:sc= 0.0651 USER MOD Single : A 8 C O3' : rot 180:sc= 0.0888 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 7.394 -1.853 -0.075 1.00 0.00 O ATOM 2 C5' G A 1 7.711 -2.505 -1.290 1.00 0.00 C ATOM 3 C4' G A 1 6.507 -2.559 -2.239 1.00 0.00 C ATOM 4 O4' G A 1 5.434 -3.281 -1.669 1.00 0.00 O ATOM 5 C3' G A 1 5.931 -1.188 -2.589 1.00 0.00 C ATOM 6 O3' G A 1 6.736 -0.543 -3.567 1.00 0.00 O ATOM 7 C2' G A 1 4.529 -1.575 -3.070 1.00 0.00 C ATOM 8 O2' G A 1 4.514 -1.873 -4.453 1.00 0.00 O ATOM 9 C1' G A 1 4.231 -2.868 -2.298 1.00 0.00 C ATOM 10 N9 G A 1 3.147 -2.726 -1.294 1.00 0.00 N ATOM 11 C8 G A 1 3.234 -2.759 0.077 1.00 0.00 C ATOM 12 N7 G A 1 2.085 -2.875 0.683 1.00 0.00 N ATOM 13 C5 G A 1 1.154 -2.891 -0.353 1.00 0.00 C ATOM 14 C6 G A 1 -0.271 -3.061 -0.323 1.00 0.00 C ATOM 15 O6 G A 1 -0.998 -3.285 0.645 1.00 0.00 O ATOM 16 N1 G A 1 -0.843 -2.973 -1.591 1.00 0.00 N ATOM 17 C2 G A 1 -0.120 -2.797 -2.757 1.00 0.00 C ATOM 18 N2 G A 1 -0.808 -2.737 -3.897 1.00 0.00 N ATOM 19 N3 G A 1 1.218 -2.699 -2.797 1.00 0.00 N ATOM 20 C4 G A 1 1.798 -2.745 -1.564 1.00 0.00 C ATOM 0 H5' G A 1 8.054 -3.518 -1.080 1.00 0.00 H new ATOM 0 H5'' G A 1 8.535 -1.984 -1.778 1.00 0.00 H new ATOM 0 H4' G A 1 6.904 -3.036 -3.135 1.00 0.00 H new ATOM 0 H3' G A 1 5.902 -0.459 -1.779 1.00 0.00 H new ATOM 0 H2' G A 1 3.813 -0.769 -2.908 1.00 0.00 H new ATOM 0 HO2' G A 1 3.996 -1.191 -4.929 1.00 0.00 H new ATOM 0 HO5' G A 1 8.184 -1.839 0.505 1.00 0.00 H new ATOM 0 H1' G A 1 3.872 -3.613 -3.008 1.00 0.00 H new ATOM 0 H8 G A 1 4.173 -2.694 0.607 1.00 0.00 H new ATOM 0 H1 G A 1 -1.858 -3.043 -1.664 1.00 0.00 H new ATOM 0 H21 G A 1 -0.318 -2.608 -4.782 1.00 0.00 H new ATOM 0 H22 G A 1 -1.825 -2.820 -3.884 1.00 0.00 H new ATOM 33 P C A 2 6.754 1.061 -3.758 1.00 0.00 P ATOM 34 OP1 C A 2 7.809 1.389 -4.742 1.00 0.00 O ATOM 35 OP2 C A 2 6.785 1.684 -2.416 1.00 0.00 O ATOM 36 O5' C A 2 5.321 1.380 -4.419 1.00 0.00 O ATOM 37 C5' C A 2 5.066 1.260 -5.808 1.00 0.00 C ATOM 38 C4' C A 2 3.576 1.504 -6.075 1.00 0.00 C ATOM 39 O4' C A 2 2.800 0.545 -5.371 1.00 0.00 O ATOM 40 C3' C A 2 3.089 2.877 -5.610 1.00 0.00 C ATOM 41 O3' C A 2 3.324 3.922 -6.547 1.00 0.00 O ATOM 42 C2' C A 2 1.609 2.584 -5.367 1.00 0.00 C ATOM 43 O2' C A 2 0.826 2.731 -6.537 1.00 0.00 O ATOM 44 C1' C A 2 1.572 1.120 -4.940 1.00 0.00 C ATOM 45 N1 C A 2 1.415 1.015 -3.460 1.00 0.00 N ATOM 46 C2 C A 2 0.155 0.698 -2.939 1.00 0.00 C ATOM 47 O2 C A 2 -0.818 0.520 -3.669 1.00 0.00 O ATOM 48 N3 C A 2 0.020 0.569 -1.588 1.00 0.00 N ATOM 49 C4 C A 2 1.048 0.807 -0.763 1.00 0.00 C ATOM 50 N4 C A 2 0.869 0.639 0.545 1.00 0.00 N ATOM 51 C5 C A 2 2.314 1.258 -1.264 1.00 0.00 C ATOM 52 C6 C A 2 2.440 1.362 -2.610 1.00 0.00 C ATOM 0 H5' C A 2 5.352 0.268 -6.157 1.00 0.00 H new ATOM 0 H5'' C A 2 5.669 1.979 -6.363 1.00 0.00 H new ATOM 0 H4' C A 2 3.457 1.433 -7.156 1.00 0.00 H new ATOM 0 H3' C A 2 3.616 3.263 -4.737 1.00 0.00 H new ATOM 0 H2' C A 2 1.201 3.277 -4.631 1.00 0.00 H new ATOM 0 HO2' C A 2 0.785 3.678 -6.786 1.00 0.00 H new ATOM 0 H1' C A 2 0.726 0.595 -5.383 1.00 0.00 H new ATOM 0 H41 C A 2 1.638 0.814 1.192 1.00 0.00 H new ATOM 0 H42 C A 2 -0.037 0.335 0.901 1.00 0.00 H new ATOM 0 H5 C A 2 3.129 1.503 -0.600 1.00 0.00 H new ATOM 0 H6 C A 2 3.368 1.726 -3.025 1.00 0.00 H new ATOM 64 P U A 3 3.057 5.479 -6.180 1.00 0.00 P ATOM 65 OP1 U A 3 3.504 6.308 -7.320 1.00 0.00 O ATOM 66 OP2 U A 3 3.599 5.732 -4.826 1.00 0.00 O ATOM 67 O5' U A 3 1.443 5.545 -6.118 1.00 0.00 O ATOM 68 C5' U A 3 0.737 6.496 -5.341 1.00 0.00 C ATOM 69 C4' U A 3 -0.553 5.821 -4.876 1.00 0.00 C ATOM 70 O4' U A 3 -0.252 4.845 -3.898 1.00 0.00 O ATOM 71 C3' U A 3 -1.539 6.721 -4.137 1.00 0.00 C ATOM 72 O3' U A 3 -2.266 7.593 -4.996 1.00 0.00 O ATOM 73 C2' U A 3 -2.392 5.650 -3.451 1.00 0.00 C ATOM 74 O2' U A 3 -3.470 5.232 -4.264 1.00 0.00 O ATOM 75 C1' U A 3 -1.464 4.454 -3.289 1.00 0.00 C ATOM 76 N1 U A 3 -1.334 4.110 -1.849 1.00 0.00 N ATOM 77 C2 U A 3 -2.280 3.268 -1.261 1.00 0.00 C ATOM 78 O2 U A 3 -3.274 2.867 -1.857 1.00 0.00 O ATOM 79 N3 U A 3 -2.071 2.926 0.071 1.00 0.00 N ATOM 80 C4 U A 3 -1.056 3.425 0.878 1.00 0.00 C ATOM 81 O4 U A 3 -0.956 3.057 2.045 1.00 0.00 O ATOM 82 C5 U A 3 -0.207 4.405 0.226 1.00 0.00 C ATOM 83 C6 U A 3 -0.385 4.727 -1.079 1.00 0.00 C ATOM 0 H5' U A 3 0.516 7.387 -5.929 1.00 0.00 H new ATOM 0 H5'' U A 3 1.334 6.817 -4.487 1.00 0.00 H new ATOM 0 H4' U A 3 -0.991 5.457 -5.805 1.00 0.00 H new ATOM 0 H3' U A 3 -1.090 7.443 -3.455 1.00 0.00 H new ATOM 0 H2' U A 3 -2.803 6.038 -2.519 1.00 0.00 H new ATOM 0 HO2' U A 3 -3.717 4.312 -4.033 1.00 0.00 H new ATOM 0 H1' U A 3 -1.833 3.543 -3.761 1.00 0.00 H new ATOM 0 H3 U A 3 -2.715 2.255 0.489 1.00 0.00 H new ATOM 0 H5 U A 3 0.579 4.886 0.789 1.00 0.00 H new ATOM 0 H6 U A 3 0.238 5.490 -1.522 1.00 0.00 H new ATOM 94 P G A 4 -3.254 8.764 -4.450 1.00 0.00 P ATOM 95 OP1 G A 4 -3.343 9.785 -5.517 1.00 0.00 O ATOM 96 OP2 G A 4 -2.810 9.168 -3.097 1.00 0.00 O ATOM 97 O5' G A 4 -4.717 8.070 -4.335 1.00 0.00 O ATOM 98 C5' G A 4 -5.249 7.582 -3.113 1.00 0.00 C ATOM 99 C4' G A 4 -6.516 6.755 -3.364 1.00 0.00 C ATOM 100 O4' G A 4 -6.324 5.874 -4.465 1.00 0.00 O ATOM 101 C3' G A 4 -6.858 5.864 -2.157 1.00 0.00 C ATOM 102 O3' G A 4 -8.229 5.975 -1.817 1.00 0.00 O ATOM 103 C2' G A 4 -6.551 4.463 -2.681 1.00 0.00 C ATOM 104 O2' G A 4 -7.282 3.424 -2.060 1.00 0.00 O ATOM 105 C1' G A 4 -6.904 4.626 -4.153 1.00 0.00 C ATOM 106 N9 G A 4 -6.356 3.538 -4.998 1.00 0.00 N ATOM 107 C8 G A 4 -5.324 2.671 -4.725 1.00 0.00 C ATOM 108 N7 G A 4 -5.184 1.715 -5.602 1.00 0.00 N ATOM 109 C5 G A 4 -6.218 1.928 -6.504 1.00 0.00 C ATOM 110 C6 G A 4 -6.586 1.196 -7.681 1.00 0.00 C ATOM 111 O6 G A 4 -6.038 0.212 -8.171 1.00 0.00 O ATOM 112 N1 G A 4 -7.720 1.717 -8.304 1.00 0.00 N ATOM 113 C2 G A 4 -8.420 2.815 -7.841 1.00 0.00 C ATOM 114 N2 G A 4 -9.483 3.195 -8.551 1.00 0.00 N ATOM 115 N3 G A 4 -8.080 3.505 -6.739 1.00 0.00 N ATOM 116 C4 G A 4 -6.970 3.014 -6.113 1.00 0.00 C ATOM 0 H5' G A 4 -5.479 8.417 -2.452 1.00 0.00 H new ATOM 0 H5'' G A 4 -4.504 6.970 -2.605 1.00 0.00 H new ATOM 0 H4' G A 4 -7.317 7.470 -3.553 1.00 0.00 H new ATOM 0 H3' G A 4 -6.305 6.128 -1.256 1.00 0.00 H new ATOM 0 H2' G A 4 -5.526 4.150 -2.482 1.00 0.00 H new ATOM 0 HO2' G A 4 -7.106 2.578 -2.523 1.00 0.00 H new ATOM 0 H1' G A 4 -7.977 4.580 -4.339 1.00 0.00 H new ATOM 0 H8 G A 4 -4.685 2.773 -3.860 1.00 0.00 H new ATOM 0 H1 G A 4 -8.053 1.260 -9.153 1.00 0.00 H new ATOM 0 H21 G A 4 -10.034 4.000 -8.253 1.00 0.00 H new ATOM 0 H22 G A 4 -9.744 2.681 -9.392 1.00 0.00 H new ATOM 128 P U A 5 -8.710 6.919 -0.598 1.00 0.00 P ATOM 129 OP1 U A 5 -10.151 6.682 -0.371 1.00 0.00 O ATOM 130 OP2 U A 5 -8.215 8.290 -0.853 1.00 0.00 O ATOM 131 O5' U A 5 -7.883 6.305 0.645 1.00 0.00 O ATOM 132 C5' U A 5 -7.980 4.935 0.992 1.00 0.00 C ATOM 133 C4' U A 5 -6.758 4.491 1.802 1.00 0.00 C ATOM 134 O4' U A 5 -5.562 4.958 1.194 1.00 0.00 O ATOM 135 C3' U A 5 -6.809 5.044 3.234 1.00 0.00 C ATOM 136 O3' U A 5 -6.706 3.987 4.175 1.00 0.00 O ATOM 137 C2' U A 5 -5.590 5.958 3.300 1.00 0.00 C ATOM 138 O2' U A 5 -5.013 6.012 4.590 1.00 0.00 O ATOM 139 C1' U A 5 -4.679 5.405 2.212 1.00 0.00 C ATOM 140 N1 U A 5 -3.684 6.398 1.813 1.00 0.00 N ATOM 141 C2 U A 5 -2.434 6.403 2.456 1.00 0.00 C ATOM 142 O2 U A 5 -2.228 5.871 3.545 1.00 0.00 O ATOM 143 N3 U A 5 -1.389 7.015 1.776 1.00 0.00 N ATOM 144 C4 U A 5 -1.465 7.495 0.478 1.00 0.00 C ATOM 145 O4 U A 5 -0.465 7.900 -0.106 1.00 0.00 O ATOM 146 C5 U A 5 -2.805 7.439 -0.068 1.00 0.00 C ATOM 147 C6 U A 5 -3.865 6.982 0.607 1.00 0.00 C ATOM 0 H5' U A 5 -8.062 4.331 0.088 1.00 0.00 H new ATOM 0 H5'' U A 5 -8.887 4.765 1.572 1.00 0.00 H new ATOM 0 H4' U A 5 -6.770 3.401 1.829 1.00 0.00 H new ATOM 0 H3' U A 5 -7.739 5.563 3.466 1.00 0.00 H new ATOM 0 H2' U A 5 -5.825 7.008 3.124 1.00 0.00 H new ATOM 0 HO2' U A 5 -4.036 5.993 4.513 1.00 0.00 H new ATOM 0 H1' U A 5 -4.058 4.567 2.529 1.00 0.00 H new ATOM 0 H3 U A 5 -0.501 7.119 2.267 1.00 0.00 H new ATOM 0 H5 U A 5 -2.957 7.787 -1.079 1.00 0.00 H new ATOM 0 H6 U A 5 -4.858 7.079 0.192 1.00 0.00 H new ATOM 158 P G A 6 -8.022 3.407 4.915 1.00 0.00 P ATOM 159 OP1 G A 6 -8.832 4.550 5.388 1.00 0.00 O ATOM 160 OP2 G A 6 -7.581 2.375 5.882 1.00 0.00 O ATOM 161 O5' G A 6 -8.819 2.687 3.708 1.00 0.00 O ATOM 162 C5' G A 6 -8.615 1.322 3.409 1.00 0.00 C ATOM 163 C4' G A 6 -9.131 0.989 2.010 1.00 0.00 C ATOM 164 O4' G A 6 -8.279 1.540 1.013 1.00 0.00 O ATOM 165 C3' G A 6 -9.203 -0.517 1.751 1.00 0.00 C ATOM 166 O3' G A 6 -10.479 -1.075 2.001 1.00 0.00 O ATOM 167 C2' G A 6 -8.783 -0.581 0.283 1.00 0.00 C ATOM 168 O2' G A 6 -9.883 -0.313 -0.562 1.00 0.00 O ATOM 169 C1' G A 6 -7.768 0.546 0.128 1.00 0.00 C ATOM 170 N9 G A 6 -6.375 0.209 0.526 1.00 0.00 N ATOM 171 C8 G A 6 -5.930 -0.213 1.748 1.00 0.00 C ATOM 172 N7 G A 6 -4.655 -0.422 1.840 1.00 0.00 N ATOM 173 C5 G A 6 -4.224 -0.245 0.538 1.00 0.00 C ATOM 174 C6 G A 6 -2.901 -0.332 0.015 1.00 0.00 C ATOM 175 O6 G A 6 -1.856 -0.485 0.638 1.00 0.00 O ATOM 176 N1 G A 6 -2.868 -0.199 -1.367 1.00 0.00 N ATOM 177 C2 G A 6 -3.985 0.017 -2.148 1.00 0.00 C ATOM 178 N2 G A 6 -3.765 0.124 -3.457 1.00 0.00 N ATOM 179 N3 G A 6 -5.234 0.145 -1.657 1.00 0.00 N ATOM 180 C4 G A 6 -5.294 -0.012 -0.302 1.00 0.00 C ATOM 0 H5' G A 6 -9.126 0.703 4.147 1.00 0.00 H new ATOM 0 H5'' G A 6 -7.553 1.085 3.475 1.00 0.00 H new ATOM 0 H4' G A 6 -10.133 1.416 1.959 1.00 0.00 H new ATOM 0 H3' G A 6 -8.575 -1.110 2.416 1.00 0.00 H new ATOM 0 H2' G A 6 -8.391 -1.563 0.019 1.00 0.00 H new ATOM 0 HO2' G A 6 -10.292 -1.158 -0.844 1.00 0.00 H new ATOM 0 H1' G A 6 -7.675 0.830 -0.920 1.00 0.00 H new ATOM 0 H8 G A 6 -6.599 -0.362 2.583 1.00 0.00 H new ATOM 0 H1 G A 6 -1.963 -0.265 -1.833 1.00 0.00 H new ATOM 0 H21 G A 6 -4.545 0.284 -4.094 1.00 0.00 H new ATOM 0 H22 G A 6 -2.816 0.046 -3.823 1.00 0.00 H new ATOM 192 P C A 7 -10.748 -2.091 3.238 1.00 0.00 P ATOM 193 OP1 C A 7 -12.097 -2.674 3.055 1.00 0.00 O ATOM 194 OP2 C A 7 -10.435 -1.379 4.495 1.00 0.00 O ATOM 195 O5' C A 7 -9.657 -3.291 3.073 1.00 0.00 O ATOM 196 C5' C A 7 -9.185 -3.781 1.821 1.00 0.00 C ATOM 197 C4' C A 7 -10.289 -4.240 0.883 1.00 0.00 C ATOM 198 O4' C A 7 -11.006 -3.176 0.295 1.00 0.00 O ATOM 199 C3' C A 7 -9.883 -4.911 -0.429 1.00 0.00 C ATOM 200 O3' C A 7 -9.062 -6.059 -0.386 1.00 0.00 O ATOM 201 C2' C A 7 -11.270 -5.100 -1.046 1.00 0.00 C ATOM 202 O2' C A 7 -11.959 -6.197 -0.476 1.00 0.00 O ATOM 203 C1' C A 7 -11.903 -3.770 -0.620 1.00 0.00 C ATOM 204 N1 C A 7 -12.194 -2.899 -1.793 1.00 0.00 N ATOM 205 C2 C A 7 -13.507 -2.843 -2.285 1.00 0.00 C ATOM 206 O2 C A 7 -14.427 -3.432 -1.719 1.00 0.00 O ATOM 207 N3 C A 7 -13.756 -2.113 -3.413 1.00 0.00 N ATOM 208 C4 C A 7 -12.765 -1.483 -4.059 1.00 0.00 C ATOM 209 N4 C A 7 -13.065 -0.782 -5.152 1.00 0.00 N ATOM 210 C5 C A 7 -11.405 -1.565 -3.605 1.00 0.00 C ATOM 211 C6 C A 7 -11.172 -2.285 -2.480 1.00 0.00 C ATOM 0 H5' C A 7 -8.505 -4.614 2.001 1.00 0.00 H new ATOM 0 H5'' C A 7 -8.607 -2.998 1.330 1.00 0.00 H new ATOM 0 H4' C A 7 -10.805 -4.897 1.583 1.00 0.00 H new ATOM 0 H3' C A 7 -9.177 -4.317 -1.009 1.00 0.00 H new ATOM 0 H2' C A 7 -11.277 -5.313 -2.115 1.00 0.00 H new ATOM 0 HO2' C A 7 -12.840 -6.283 -0.896 1.00 0.00 H new ATOM 0 H1' C A 7 -12.872 -3.927 -0.146 1.00 0.00 H new ATOM 0 H41 C A 7 -12.329 -0.293 -5.662 1.00 0.00 H new ATOM 0 H42 C A 7 -14.030 -0.734 -5.478 1.00 0.00 H new ATOM 0 H5 C A 7 -10.603 -1.075 -4.136 1.00 0.00 H new ATOM 0 H6 C A 7 -10.160 -2.379 -2.114 1.00 0.00 H new ATOM 223 P C A 8 -8.527 -6.751 -1.755 1.00 0.00 P ATOM 224 OP1 C A 8 -9.682 -7.392 -2.423 1.00 0.00 O ATOM 225 OP2 C A 8 -7.351 -7.573 -1.397 1.00 0.00 O ATOM 226 O5' C A 8 -7.996 -5.528 -2.695 1.00 0.00 O ATOM 227 C5' C A 8 -8.822 -4.892 -3.667 1.00 0.00 C ATOM 228 C4' C A 8 -8.125 -3.753 -4.424 1.00 0.00 C ATOM 229 O4' C A 8 -7.791 -2.637 -3.597 1.00 0.00 O ATOM 230 C3' C A 8 -6.843 -4.215 -5.122 1.00 0.00 C ATOM 231 O3' C A 8 -7.036 -4.569 -6.477 1.00 0.00 O ATOM 232 C2' C A 8 -5.949 -2.991 -4.973 1.00 0.00 C ATOM 233 O2' C A 8 -6.255 -1.985 -5.927 1.00 0.00 O ATOM 234 C1' C A 8 -6.372 -2.503 -3.579 1.00 0.00 C ATOM 235 N1 C A 8 -5.772 -3.186 -2.388 1.00 0.00 N ATOM 236 C2 C A 8 -4.376 -3.172 -2.217 1.00 0.00 C ATOM 237 O2 C A 8 -3.609 -2.992 -3.158 1.00 0.00 O ATOM 238 N3 C A 8 -3.842 -3.377 -0.982 1.00 0.00 N ATOM 239 C4 C A 8 -4.621 -3.479 0.098 1.00 0.00 C ATOM 240 N4 C A 8 -4.016 -3.611 1.278 1.00 0.00 N ATOM 241 C5 C A 8 -6.050 -3.362 -0.016 1.00 0.00 C ATOM 242 C6 C A 8 -6.559 -3.246 -1.260 1.00 0.00 C ATOM 0 H5' C A 8 -9.710 -4.497 -3.173 1.00 0.00 H new ATOM 0 H5'' C A 8 -9.162 -5.638 -4.385 1.00 0.00 H new ATOM 0 H4' C A 8 -8.864 -3.439 -5.161 1.00 0.00 H new ATOM 0 H3' C A 8 -6.430 -5.127 -4.690 1.00 0.00 H new ATOM 0 H2' C A 8 -4.890 -3.210 -5.108 1.00 0.00 H new ATOM 0 HO2' C A 8 -6.755 -2.381 -6.671 1.00 0.00 H new ATOM 0 HO3' C A 8 -6.182 -4.853 -6.866 1.00 0.00 H new ATOM 0 H1' C A 8 -5.998 -1.489 -3.433 1.00 0.00 H new ATOM 0 H41 C A 8 -4.571 -3.692 2.130 1.00 0.00 H new ATOM 0 H42 C A 8 -2.997 -3.631 1.329 1.00 0.00 H new ATOM 0 H5 C A 8 -6.687 -3.367 0.856 1.00 0.00 H new ATOM 0 H6 C A 8 -7.632 -3.198 -1.376 1.00 0.00 H new TER 255 C A 8