USER MOD reduce.3.24.130724 H: found=0, std=0, add=127, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 127 hydrogens (12 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 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 1 DT O5' : rot 180:sc= 0 USER MOD Single : A 3 DT C7 :methyl 150:sc= -0.301 (180deg=-0.301) USER MOD Single : A 10 DT C7 :methyl 150:sc= -1.71 (180deg=-1.71) USER MOD Single : A 11 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 -9.033 11.874 -4.002 1.00 0.00 O ATOM 2 C5' DT A 1 -7.842 11.585 -3.263 1.00 0.00 C ATOM 3 C4' DT A 1 -6.861 10.796 -4.099 1.00 0.00 C ATOM 4 O4' DT A 1 -5.613 10.696 -3.372 1.00 0.00 O ATOM 5 C3' DT A 1 -7.290 9.359 -4.419 1.00 0.00 C ATOM 6 O3' DT A 1 -7.195 9.118 -5.828 1.00 0.00 O ATOM 7 C2' DT A 1 -6.295 8.493 -3.662 1.00 0.00 C ATOM 8 C1' DT A 1 -5.090 9.398 -3.539 1.00 0.00 C ATOM 9 N1 DT A 1 -4.207 9.109 -2.391 1.00 0.00 N ATOM 10 C2 DT A 1 -2.893 8.791 -2.649 1.00 0.00 C ATOM 11 O2 DT A 1 -2.428 8.743 -3.775 1.00 0.00 O ATOM 12 N3 DT A 1 -2.139 8.533 -1.537 1.00 0.00 N ATOM 13 C4 DT A 1 -2.553 8.558 -0.224 1.00 0.00 C ATOM 14 O4 DT A 1 -1.759 8.282 0.671 1.00 0.00 O ATOM 15 C5 DT A 1 -3.943 8.903 -0.022 1.00 0.00 C ATOM 16 C7 DT A 1 -4.474 8.982 1.376 1.00 0.00 C ATOM 17 C6 DT A 1 -4.697 9.159 -1.101 1.00 0.00 C ATOM 0 H5' DT A 1 -8.095 11.021 -2.365 1.00 0.00 H new ATOM 0 H5'' DT A 1 -7.379 12.516 -2.935 1.00 0.00 H new ATOM 0 H4' DT A 1 -6.786 11.336 -5.043 1.00 0.00 H new ATOM 0 H3' DT A 1 -8.322 9.153 -4.133 1.00 0.00 H new ATOM 0 H2' DT A 1 -6.678 8.195 -2.686 1.00 0.00 H new ATOM 0 H2'' DT A 1 -6.060 7.578 -4.205 1.00 0.00 H new ATOM 0 HO5' DT A 1 -9.652 12.384 -3.439 1.00 0.00 H new ATOM 0 H1' DT A 1 -4.470 9.260 -4.425 1.00 0.00 H new ATOM 0 H3 DT A 1 -1.160 8.295 -1.699 1.00 0.00 H new ATOM 0 H71 DT A 1 -5.279 9.715 1.418 1.00 0.00 H new ATOM 0 H72 DT A 1 -4.856 8.006 1.676 1.00 0.00 H new ATOM 0 H73 DT A 1 -3.674 9.282 2.053 1.00 0.00 H new ATOM 0 H6 DT A 1 -5.736 9.416 -0.954 1.00 0.00 H new ATOM 31 P DA A 2 -7.643 7.696 -6.430 1.00 0.00 P ATOM 32 OP1 DA A 2 -8.219 7.922 -7.780 1.00 0.00 O ATOM 33 OP2 DA A 2 -8.448 6.995 -5.397 1.00 0.00 O ATOM 34 O5' DA A 2 -6.273 6.900 -6.596 1.00 0.00 O ATOM 35 C5' DA A 2 -5.143 7.506 -7.226 1.00 0.00 C ATOM 36 C4' DA A 2 -3.990 6.531 -7.290 1.00 0.00 C ATOM 37 O4' DA A 2 -3.232 6.627 -6.059 1.00 0.00 O ATOM 38 C3' DA A 2 -4.385 5.057 -7.438 1.00 0.00 C ATOM 39 O3' DA A 2 -3.566 4.426 -8.430 1.00 0.00 O ATOM 40 C2' DA A 2 -4.119 4.465 -6.065 1.00 0.00 C ATOM 41 C1' DA A 2 -2.998 5.334 -5.538 1.00 0.00 C ATOM 42 N9 DA A 2 -2.946 5.439 -4.080 1.00 0.00 N ATOM 43 C8 DA A 2 -3.969 5.768 -3.226 1.00 0.00 C ATOM 44 N7 DA A 2 -3.619 5.782 -1.963 1.00 0.00 N ATOM 45 C5 DA A 2 -2.276 5.436 -1.987 1.00 0.00 C ATOM 46 C6 DA A 2 -1.325 5.273 -0.967 1.00 0.00 C ATOM 47 N6 DA A 2 -1.593 5.446 0.328 1.00 0.00 N ATOM 48 N1 DA A 2 -0.070 4.923 -1.327 1.00 0.00 N ATOM 49 C2 DA A 2 0.198 4.752 -2.629 1.00 0.00 C ATOM 50 N3 DA A 2 -0.611 4.875 -3.678 1.00 0.00 N ATOM 51 C4 DA A 2 -1.848 5.223 -3.284 1.00 0.00 C ATOM 0 H5' DA A 2 -4.844 8.396 -6.673 1.00 0.00 H new ATOM 0 H5'' DA A 2 -5.410 7.830 -8.232 1.00 0.00 H new ATOM 0 H4' DA A 2 -3.432 6.812 -8.183 1.00 0.00 H new ATOM 0 H3' DA A 2 -5.419 4.922 -7.755 1.00 0.00 H new ATOM 0 H2' DA A 2 -5.001 4.511 -5.427 1.00 0.00 H new ATOM 0 H2'' DA A 2 -3.824 3.417 -6.126 1.00 0.00 H new ATOM 0 H1' DA A 2 -2.052 4.886 -5.842 1.00 0.00 H new ATOM 0 H8 DA A 2 -4.970 5.994 -3.564 1.00 0.00 H new ATOM 0 H61 DA A 2 -0.858 5.313 1.023 1.00 0.00 H new ATOM 0 H62 DA A 2 -2.532 5.712 0.623 1.00 0.00 H new ATOM 0 H2 DA A 2 1.216 4.475 -2.860 1.00 0.00 H new ATOM 63 P DT A 3 -3.855 2.903 -8.856 1.00 0.00 P ATOM 64 OP1 DT A 3 -3.607 2.777 -10.315 1.00 0.00 O ATOM 65 OP2 DT A 3 -5.179 2.517 -8.302 1.00 0.00 O ATOM 66 O5' DT A 3 -2.737 2.069 -8.086 1.00 0.00 O ATOM 67 C5' DT A 3 -1.357 2.177 -8.446 1.00 0.00 C ATOM 68 C4' DT A 3 -0.517 1.282 -7.565 1.00 0.00 C ATOM 69 O4' DT A 3 -0.572 1.791 -6.211 1.00 0.00 O ATOM 70 C3' DT A 3 -0.980 -0.178 -7.497 1.00 0.00 C ATOM 71 O3' DT A 3 0.128 -1.063 -7.698 1.00 0.00 O ATOM 72 C2' DT A 3 -1.523 -0.328 -6.086 1.00 0.00 C ATOM 73 C1' DT A 3 -0.733 0.711 -5.320 1.00 0.00 C ATOM 74 N1 DT A 3 -1.394 1.217 -4.106 1.00 0.00 N ATOM 75 C2 DT A 3 -0.656 1.312 -2.948 1.00 0.00 C ATOM 76 O2 DT A 3 0.520 0.997 -2.876 1.00 0.00 O ATOM 77 N3 DT A 3 -1.348 1.791 -1.869 1.00 0.00 N ATOM 78 C4 DT A 3 -2.671 2.176 -1.828 1.00 0.00 C ATOM 79 O4 DT A 3 -3.151 2.596 -0.779 1.00 0.00 O ATOM 80 C5 DT A 3 -3.387 2.048 -3.078 1.00 0.00 C ATOM 81 C7 DT A 3 -4.839 2.406 -3.123 1.00 0.00 C ATOM 82 C6 DT A 3 -2.723 1.583 -4.145 1.00 0.00 C ATOM 0 H5' DT A 3 -1.027 3.211 -8.346 1.00 0.00 H new ATOM 0 H5'' DT A 3 -1.223 1.899 -9.492 1.00 0.00 H new ATOM 0 H4' DT A 3 0.480 1.291 -8.006 1.00 0.00 H new ATOM 0 H3' DT A 3 -1.718 -0.420 -8.262 1.00 0.00 H new ATOM 0 H2' DT A 3 -2.595 -0.137 -6.041 1.00 0.00 H new ATOM 0 H2'' DT A 3 -1.361 -1.332 -5.693 1.00 0.00 H new ATOM 0 H1' DT A 3 0.195 0.252 -4.980 1.00 0.00 H new ATOM 0 H3 DT A 3 -0.826 1.872 -0.997 1.00 0.00 H new ATOM 0 H71 DT A 3 -5.094 2.769 -4.119 1.00 0.00 H new ATOM 0 H72 DT A 3 -5.438 1.525 -2.894 1.00 0.00 H new ATOM 0 H73 DT A 3 -5.044 3.185 -2.389 1.00 0.00 H new ATOM 0 H6 DT A 3 -3.254 1.490 -5.081 1.00 0.00 H new ATOM 95 P DC A 4 -0.120 -2.652 -7.759 1.00 0.00 P ATOM 96 OP1 DC A 4 0.513 -3.171 -8.996 1.00 0.00 O ATOM 97 OP2 DC A 4 -1.566 -2.900 -7.518 1.00 0.00 O ATOM 98 O5' DC A 4 0.686 -3.216 -6.506 1.00 0.00 O ATOM 99 C5' DC A 4 2.113 -3.166 -6.467 1.00 0.00 C ATOM 100 C4' DC A 4 2.626 -3.829 -5.211 1.00 0.00 C ATOM 101 O4' DC A 4 2.127 -3.100 -4.063 1.00 0.00 O ATOM 102 C3' DC A 4 2.180 -5.279 -5.012 1.00 0.00 C ATOM 103 O3' DC A 4 3.225 -6.040 -4.394 1.00 0.00 O ATOM 104 C2' DC A 4 0.986 -5.155 -4.085 1.00 0.00 C ATOM 105 C1' DC A 4 1.352 -3.953 -3.234 1.00 0.00 C ATOM 106 N1 DC A 4 0.205 -3.175 -2.736 1.00 0.00 N ATOM 107 C2 DC A 4 0.131 -2.881 -1.374 1.00 0.00 C ATOM 108 O2 DC A 4 1.027 -3.291 -0.621 1.00 0.00 O ATOM 109 N3 DC A 4 -0.914 -2.159 -0.908 1.00 0.00 N ATOM 110 C4 DC A 4 -1.861 -1.740 -1.749 1.00 0.00 C ATOM 111 N4 DC A 4 -2.870 -1.028 -1.247 1.00 0.00 N ATOM 112 C5 DC A 4 -1.815 -2.030 -3.143 1.00 0.00 C ATOM 113 C6 DC A 4 -0.773 -2.744 -3.590 1.00 0.00 C ATOM 0 H5' DC A 4 2.449 -2.130 -6.502 1.00 0.00 H new ATOM 0 H5'' DC A 4 2.525 -3.665 -7.344 1.00 0.00 H new ATOM 0 H4' DC A 4 3.711 -3.823 -5.312 1.00 0.00 H new ATOM 0 H3' DC A 4 1.941 -5.789 -5.945 1.00 0.00 H new ATOM 0 H2' DC A 4 0.060 -4.994 -4.636 1.00 0.00 H new ATOM 0 H2'' DC A 4 0.846 -6.052 -3.481 1.00 0.00 H new ATOM 0 H1' DC A 4 1.872 -4.322 -2.350 1.00 0.00 H new ATOM 0 H41 DC A 4 -3.612 -0.691 -1.861 1.00 0.00 H new ATOM 0 H42 DC A 4 -2.900 -0.820 -0.249 1.00 0.00 H new ATOM 0 H5 DC A 4 -2.590 -1.688 -3.813 1.00 0.00 H new ATOM 0 H6 DC A 4 -0.704 -2.983 -4.641 1.00 0.00 H new ATOM 125 P DA A 5 3.098 -7.642 -4.292 1.00 0.00 P ATOM 126 OP1 DA A 5 4.454 -8.207 -4.512 1.00 0.00 O ATOM 127 OP2 DA A 5 1.970 -8.085 -5.151 1.00 0.00 O ATOM 128 O5' DA A 5 2.696 -7.902 -2.773 1.00 0.00 O ATOM 129 C5' DA A 5 3.352 -7.213 -1.707 1.00 0.00 C ATOM 130 C4' DA A 5 2.727 -7.586 -0.384 1.00 0.00 C ATOM 131 O4' DA A 5 1.464 -6.892 -0.253 1.00 0.00 O ATOM 132 C3' DA A 5 2.395 -9.067 -0.220 1.00 0.00 C ATOM 133 O3' DA A 5 2.466 -9.437 1.163 1.00 0.00 O ATOM 134 C2' DA A 5 0.976 -9.151 -0.749 1.00 0.00 C ATOM 135 C1' DA A 5 0.384 -7.812 -0.328 1.00 0.00 C ATOM 136 N9 DA A 5 -0.606 -7.262 -1.256 1.00 0.00 N ATOM 137 C8 DA A 5 -0.839 -7.621 -2.560 1.00 0.00 C ATOM 138 N7 DA A 5 -1.800 -6.936 -3.133 1.00 0.00 N ATOM 139 C5 DA A 5 -2.228 -6.067 -2.140 1.00 0.00 C ATOM 140 C6 DA A 5 -3.225 -5.075 -2.114 1.00 0.00 C ATOM 141 N6 DA A 5 -4.004 -4.777 -3.156 1.00 0.00 N ATOM 142 N1 DA A 5 -3.397 -4.388 -0.964 1.00 0.00 N ATOM 143 C2 DA A 5 -2.616 -4.684 0.082 1.00 0.00 C ATOM 144 N3 DA A 5 -1.647 -5.591 0.181 1.00 0.00 N ATOM 145 C4 DA A 5 -1.502 -6.257 -0.978 1.00 0.00 C ATOM 0 H5' DA A 5 3.280 -6.136 -1.861 1.00 0.00 H new ATOM 0 H5'' DA A 5 4.413 -7.464 -1.700 1.00 0.00 H new ATOM 0 H4' DA A 5 3.473 -7.317 0.364 1.00 0.00 H new ATOM 0 H3' DA A 5 3.078 -9.738 -0.740 1.00 0.00 H new ATOM 0 H2' DA A 5 0.954 -9.282 -1.831 1.00 0.00 H new ATOM 0 H2'' DA A 5 0.431 -9.989 -0.315 1.00 0.00 H new ATOM 0 H1' DA A 5 -0.137 -7.971 0.616 1.00 0.00 H new ATOM 0 H8 DA A 5 -0.283 -8.395 -3.067 1.00 0.00 H new ATOM 0 H61 DA A 5 -4.710 -4.045 -3.072 1.00 0.00 H new ATOM 0 H62 DA A 5 -3.893 -5.281 -4.036 1.00 0.00 H new ATOM 0 H2 DA A 5 -2.798 -4.103 0.974 1.00 0.00 H new HETATM 157 P 0DT A 6 1.962 -10.891 1.630 1.00 0.00 P HETATM 158 OP1 0DT A 6 2.601 -11.210 2.931 1.00 0.00 O HETATM 159 OP2 0DT A 6 2.127 -11.823 0.484 1.00 0.00 O HETATM 160 O5' 0DT A 6 0.403 -10.681 1.878 1.00 0.00 O HETATM 161 C5' 0DT A 6 -0.069 -9.614 2.701 1.00 0.00 C HETATM 162 C4' 0DT A 6 -0.727 -10.163 3.945 1.00 0.00 C HETATM 163 O4' 0DT A 6 -1.208 -11.498 3.671 1.00 0.00 O HETATM 164 C3' 0DT A 6 -1.950 -9.392 4.430 1.00 0.00 C HETATM 165 O3' 0DT A 6 -2.117 -9.553 5.844 1.00 0.00 O HETATM 166 C2' 0DT A 6 -3.094 -10.049 3.678 1.00 0.00 C HETATM 167 C1' 0DT A 6 -2.610 -11.478 3.436 1.00 0.00 C HETATM 168 N1 0DT A 6 -2.848 -11.969 2.062 1.00 0.00 N HETATM 169 C2 0DT A 6 -3.734 -13.009 1.887 1.00 0.00 C HETATM 170 O2 0DT A 6 -4.323 -13.545 2.810 1.00 0.00 O HETATM 171 N3 0DT A 6 -3.907 -13.399 0.587 1.00 0.00 N HETATM 172 C4 0DT A 6 -3.301 -12.871 -0.531 1.00 0.00 C HETATM 173 O4 0DT A 6 -3.565 -13.326 -1.640 1.00 0.00 O HETATM 174 C5 0DT A 6 -2.380 -11.787 -0.279 1.00 0.00 C HETATM 175 C5M 0DT A 6 -1.696 -11.131 -1.439 1.00 0.00 C HETATM 176 C6 0DT A 6 -2.197 -11.393 0.989 1.00 0.00 C HETATM 0 H5'' 0DT A 6 0.761 -8.964 2.977 1.00 0.00 H new HETATM 0 H2'' 0DT A 6 -4.015 -10.034 4.261 1.00 0.00 H new HETATM 0 H73 0DT A 6 -1.105 -11.871 -1.979 1.00 0.00 H new HETATM 0 H72 0DT A 6 -2.443 -10.704 -2.108 1.00 0.00 H new HETATM 0 H71 0DT A 6 -1.041 -10.340 -1.075 1.00 0.00 H new HETATM 0 H6 0DT A 6 -1.500 -10.578 1.183 1.00 0.00 H new HETATM 0 H5' 0DT A 6 -0.780 -9.004 2.144 1.00 0.00 H new HETATM 0 H4' 0DT A 6 0.045 -10.103 4.712 1.00 0.00 H new HETATM 0 H3' 0DT A 6 -1.881 -8.319 4.253 1.00 0.00 H new HETATM 0 H3 0DT A 6 -4.558 -14.168 0.428 1.00 0.00 H new HETATM 0 H2' 0DT A 6 -3.302 -9.534 2.740 1.00 0.00 H new HETATM 0 H1' 0DT A 6 -3.172 -12.129 4.106 1.00 0.00 H new ATOM 189 P DC A 7 -2.962 -8.469 6.678 1.00 0.00 P ATOM 190 OP1 DC A 7 -3.732 -9.216 7.707 1.00 0.00 O ATOM 191 OP2 DC A 7 -3.680 -7.589 5.720 1.00 0.00 O ATOM 192 O5' DC A 7 -1.851 -7.593 7.412 1.00 0.00 O ATOM 193 C5' DC A 7 -1.664 -7.665 8.829 1.00 0.00 C ATOM 194 C4' DC A 7 -1.241 -6.318 9.369 1.00 0.00 C ATOM 195 O4' DC A 7 -0.013 -5.912 8.728 1.00 0.00 O ATOM 196 C3' DC A 7 -2.213 -5.178 9.094 1.00 0.00 C ATOM 197 O3' DC A 7 -2.032 -4.130 10.054 1.00 0.00 O ATOM 198 C2' DC A 7 -1.798 -4.728 7.706 1.00 0.00 C ATOM 199 C1' DC A 7 -0.283 -4.950 7.711 1.00 0.00 C ATOM 200 N1 DC A 7 0.302 -5.462 6.455 1.00 0.00 N ATOM 201 C2 DC A 7 1.675 -5.741 6.429 1.00 0.00 C ATOM 202 O2 DC A 7 2.353 -5.527 7.445 1.00 0.00 O ATOM 203 N3 DC A 7 2.229 -6.236 5.299 1.00 0.00 N ATOM 204 C4 DC A 7 1.472 -6.452 4.223 1.00 0.00 C ATOM 205 N4 DC A 7 2.063 -6.946 3.134 1.00 0.00 N ATOM 206 C5 DC A 7 0.074 -6.173 4.216 1.00 0.00 C ATOM 207 C6 DC A 7 -0.463 -5.674 5.339 1.00 0.00 C ATOM 0 H5' DC A 7 -0.908 -8.414 9.066 1.00 0.00 H new ATOM 0 H5'' DC A 7 -2.589 -7.983 9.310 1.00 0.00 H new ATOM 0 H4' DC A 7 -1.167 -6.470 10.446 1.00 0.00 H new ATOM 0 H3' DC A 7 -3.264 -5.461 9.159 1.00 0.00 H new ATOM 0 H2' DC A 7 -2.289 -5.313 6.928 1.00 0.00 H new ATOM 0 H2'' DC A 7 -2.052 -3.683 7.527 1.00 0.00 H new ATOM 0 H1' DC A 7 0.169 -3.970 7.868 1.00 0.00 H new ATOM 0 H41 DC A 7 1.515 -7.124 2.292 1.00 0.00 H new ATOM 0 H42 DC A 7 3.063 -7.146 3.143 1.00 0.00 H new ATOM 0 H5 DC A 7 -0.530 -6.357 3.340 1.00 0.00 H new ATOM 0 H6 DC A 7 -1.516 -5.435 5.364 1.00 0.00 H new ATOM 219 P DG A 8 -3.176 -3.018 10.256 1.00 0.00 P ATOM 220 OP1 DG A 8 -3.040 -2.462 11.626 1.00 0.00 O ATOM 221 OP2 DG A 8 -4.469 -3.616 9.835 1.00 0.00 O ATOM 222 O5' DG A 8 -2.797 -1.882 9.204 1.00 0.00 O ATOM 223 C5' DG A 8 -1.829 -0.876 9.515 1.00 0.00 C ATOM 224 C4' DG A 8 -0.461 -1.293 9.025 1.00 0.00 C ATOM 225 O4' DG A 8 -0.589 -1.909 7.720 1.00 0.00 O ATOM 226 C3' DG A 8 0.529 -0.145 8.840 1.00 0.00 C ATOM 227 O3' DG A 8 1.870 -0.587 9.080 1.00 0.00 O ATOM 228 C2' DG A 8 0.344 0.235 7.383 1.00 0.00 C ATOM 229 C1' DG A 8 -0.001 -1.087 6.720 1.00 0.00 C ATOM 230 N9 DG A 8 -0.955 -0.966 5.624 1.00 0.00 N ATOM 231 C8 DG A 8 -2.237 -0.484 5.702 1.00 0.00 C ATOM 232 N7 DG A 8 -2.857 -0.478 4.554 1.00 0.00 N ATOM 233 C5 DG A 8 -1.927 -0.992 3.661 1.00 0.00 C ATOM 234 C6 DG A 8 -2.023 -1.226 2.266 1.00 0.00 C ATOM 235 O6 DG A 8 -2.981 -1.017 1.513 1.00 0.00 O ATOM 236 N1 DG A 8 -0.846 -1.759 1.753 1.00 0.00 N ATOM 237 C2 DG A 8 0.281 -2.033 2.489 1.00 0.00 C ATOM 238 N2 DG A 8 1.317 -2.545 1.818 1.00 0.00 N ATOM 239 N3 DG A 8 0.385 -1.819 3.789 1.00 0.00 N ATOM 240 C4 DG A 8 -0.748 -1.301 4.307 1.00 0.00 C ATOM 0 H5' DG A 8 -1.801 -0.709 10.592 1.00 0.00 H new ATOM 0 H5'' DG A 8 -2.116 0.069 9.053 1.00 0.00 H new ATOM 0 H4' DG A 8 -0.079 -1.960 9.798 1.00 0.00 H new ATOM 0 H3' DG A 8 0.359 0.684 9.527 1.00 0.00 H new ATOM 0 H2' DG A 8 -0.452 0.969 7.256 1.00 0.00 H new ATOM 0 H2'' DG A 8 1.250 0.672 6.963 1.00 0.00 H new ATOM 0 H1' DG A 8 0.916 -1.496 6.296 1.00 0.00 H new ATOM 0 H8 DG A 8 -2.688 -0.143 6.622 1.00 0.00 H new ATOM 0 H1 DG A 8 -0.817 -1.962 0.754 1.00 0.00 H new ATOM 0 H21 DG A 8 2.182 -2.770 2.309 1.00 0.00 H new ATOM 0 H22 DG A 8 1.243 -2.711 0.814 1.00 0.00 H new ATOM 252 P DA A 9 3.089 0.454 8.949 1.00 0.00 P ATOM 253 OP1 DA A 9 4.240 -0.070 9.727 1.00 0.00 O ATOM 254 OP2 DA A 9 2.559 1.809 9.247 1.00 0.00 O ATOM 255 O5' DA A 9 3.468 0.413 7.401 1.00 0.00 O ATOM 256 C5' DA A 9 4.119 -0.723 6.829 1.00 0.00 C ATOM 257 C4' DA A 9 4.694 -0.372 5.475 1.00 0.00 C ATOM 258 O4' DA A 9 3.610 -0.266 4.519 1.00 0.00 O ATOM 259 C3' DA A 9 5.446 0.960 5.411 1.00 0.00 C ATOM 260 O3' DA A 9 6.603 0.832 4.576 1.00 0.00 O ATOM 261 C2' DA A 9 4.433 1.907 4.793 1.00 0.00 C ATOM 262 C1' DA A 9 3.662 0.990 3.867 1.00 0.00 C ATOM 263 N9 DA A 9 2.288 1.412 3.594 1.00 0.00 N ATOM 264 C8 DA A 9 1.346 1.856 4.490 1.00 0.00 C ATOM 265 N7 DA A 9 0.197 2.159 3.941 1.00 0.00 N ATOM 266 C5 DA A 9 0.394 1.900 2.593 1.00 0.00 C ATOM 267 C6 DA A 9 -0.447 2.020 1.475 1.00 0.00 C ATOM 268 N6 DA A 9 -1.709 2.445 1.541 1.00 0.00 N ATOM 269 N1 DA A 9 0.059 1.680 0.269 1.00 0.00 N ATOM 270 C2 DA A 9 1.326 1.249 0.203 1.00 0.00 C ATOM 271 N3 DA A 9 2.212 1.093 1.182 1.00 0.00 N ATOM 272 C4 DA A 9 1.678 1.440 2.365 1.00 0.00 C ATOM 0 H5' DA A 9 3.410 -1.545 6.729 1.00 0.00 H new ATOM 0 H5'' DA A 9 4.914 -1.067 7.491 1.00 0.00 H new ATOM 0 H4' DA A 9 5.407 -1.168 5.258 1.00 0.00 H new ATOM 0 H3' DA A 9 5.805 1.303 6.381 1.00 0.00 H new ATOM 0 H2' DA A 9 3.789 2.361 5.545 1.00 0.00 H new ATOM 0 H2'' DA A 9 4.914 2.721 4.252 1.00 0.00 H new ATOM 0 H1' DA A 9 4.170 0.982 2.903 1.00 0.00 H new ATOM 0 H8 DA A 9 1.536 1.947 5.549 1.00 0.00 H new ATOM 0 H61 DA A 9 -2.270 2.511 0.692 1.00 0.00 H new ATOM 0 H62 DA A 9 -2.113 2.705 2.441 1.00 0.00 H new ATOM 0 H2 DA A 9 1.677 0.992 -0.785 1.00 0.00 H new ATOM 284 P DT A 10 7.574 2.096 4.351 1.00 0.00 P ATOM 285 OP1 DT A 10 8.976 1.620 4.454 1.00 0.00 O ATOM 286 OP2 DT A 10 7.107 3.196 5.234 1.00 0.00 O ATOM 287 O5' DT A 10 7.301 2.528 2.842 1.00 0.00 O ATOM 288 C5' DT A 10 7.504 1.610 1.766 1.00 0.00 C ATOM 289 C4' DT A 10 7.192 2.272 0.444 1.00 0.00 C ATOM 290 O4' DT A 10 5.757 2.449 0.341 1.00 0.00 O ATOM 291 C3' DT A 10 7.807 3.661 0.246 1.00 0.00 C ATOM 292 O3' DT A 10 8.338 3.778 -1.079 1.00 0.00 O ATOM 293 C2' DT A 10 6.636 4.609 0.441 1.00 0.00 C ATOM 294 C1' DT A 10 5.465 3.780 -0.042 1.00 0.00 C ATOM 295 N1 DT A 10 4.159 4.146 0.540 1.00 0.00 N ATOM 296 C2 DT A 10 3.095 4.313 -0.316 1.00 0.00 C ATOM 297 O2 DT A 10 3.178 4.167 -1.525 1.00 0.00 O ATOM 298 N3 DT A 10 1.920 4.661 0.294 1.00 0.00 N ATOM 299 C4 DT A 10 1.704 4.850 1.641 1.00 0.00 C ATOM 300 O4 DT A 10 0.587 5.169 2.039 1.00 0.00 O ATOM 301 C5 DT A 10 2.861 4.655 2.486 1.00 0.00 C ATOM 302 C7 DT A 10 2.722 4.858 3.963 1.00 0.00 C ATOM 303 C6 DT A 10 4.020 4.314 1.904 1.00 0.00 C ATOM 0 H5' DT A 10 6.868 0.735 1.901 1.00 0.00 H new ATOM 0 H5'' DT A 10 8.536 1.258 1.769 1.00 0.00 H new ATOM 0 H4' DT A 10 7.619 1.611 -0.310 1.00 0.00 H new ATOM 0 H3' DT A 10 8.629 3.867 0.931 1.00 0.00 H new ATOM 0 H2' DT A 10 6.522 4.905 1.484 1.00 0.00 H new ATOM 0 H2'' DT A 10 6.753 5.524 -0.139 1.00 0.00 H new ATOM 0 H1' DT A 10 5.361 3.938 -1.116 1.00 0.00 H new ATOM 0 H3 DT A 10 1.115 4.795 -0.317 1.00 0.00 H new ATOM 0 H71 DT A 10 3.423 4.208 4.487 1.00 0.00 H new ATOM 0 H72 DT A 10 2.937 5.898 4.209 1.00 0.00 H new ATOM 0 H73 DT A 10 1.704 4.616 4.269 1.00 0.00 H new ATOM 0 H6 DT A 10 4.886 4.164 2.532 1.00 0.00 H new ATOM 316 P DA A 11 9.083 5.130 -1.528 1.00 0.00 P ATOM 317 OP1 DA A 11 10.260 4.733 -2.342 1.00 0.00 O ATOM 318 OP2 DA A 11 9.276 5.988 -0.330 1.00 0.00 O ATOM 319 O5' DA A 11 8.033 5.846 -2.489 1.00 0.00 O ATOM 320 C5' DA A 11 7.691 5.283 -3.757 1.00 0.00 C ATOM 321 C4' DA A 11 6.887 6.271 -4.570 1.00 0.00 C ATOM 322 O4' DA A 11 5.541 6.324 -4.037 1.00 0.00 O ATOM 323 C3' DA A 11 7.408 7.710 -4.538 1.00 0.00 C ATOM 324 O3' DA A 11 7.229 8.340 -5.809 1.00 0.00 O ATOM 325 C2' DA A 11 6.534 8.375 -3.491 1.00 0.00 C ATOM 326 C1' DA A 11 5.213 7.656 -3.681 1.00 0.00 C ATOM 327 N9 DA A 11 4.364 7.608 -2.491 1.00 0.00 N ATOM 328 C8 DA A 11 4.752 7.422 -1.187 1.00 0.00 C ATOM 329 N7 DA A 11 3.758 7.434 -0.332 1.00 0.00 N ATOM 330 C5 DA A 11 2.639 7.639 -1.128 1.00 0.00 C ATOM 331 C6 DA A 11 1.271 7.752 -0.824 1.00 0.00 C ATOM 332 N6 DA A 11 0.776 7.670 0.411 1.00 0.00 N ATOM 333 N1 DA A 11 0.414 7.954 -1.850 1.00 0.00 N ATOM 334 C2 DA A 11 0.910 8.034 -3.092 1.00 0.00 C ATOM 335 N3 DA A 11 2.173 7.946 -3.502 1.00 0.00 N ATOM 336 C4 DA A 11 2.997 7.746 -2.459 1.00 0.00 C ATOM 0 H5' DA A 11 7.117 4.368 -3.613 1.00 0.00 H new ATOM 0 H5'' DA A 11 8.597 5.009 -4.297 1.00 0.00 H new ATOM 0 H4' DA A 11 6.950 5.913 -5.598 1.00 0.00 H new ATOM 0 H3' DA A 11 8.473 7.773 -4.313 1.00 0.00 H new ATOM 0 H2' DA A 11 6.930 8.242 -2.484 1.00 0.00 H new ATOM 0 H2'' DA A 11 6.442 9.448 -3.658 1.00 0.00 H new ATOM 0 HO3' DA A 11 7.566 9.259 -5.769 1.00 0.00 H new ATOM 0 H1' DA A 11 4.642 8.201 -4.433 1.00 0.00 H new ATOM 0 H8 DA A 11 5.781 7.279 -0.893 1.00 0.00 H new ATOM 0 H61 DA A 11 -0.228 7.761 0.565 1.00 0.00 H new ATOM 0 H62 DA A 11 1.402 7.517 1.202 1.00 0.00 H new ATOM 0 H2 DA A 11 0.180 8.193 -3.872 1.00 0.00 H new TER 349 DA A 11