USER MOD reduce.3.24.130724 H: found=0, std=0, add=193, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 196 hydrogens (33 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 Set 1.1: A 5 DT C7 :methyl -30:sc= -2.33! (180deg=-3.09!) USER MOD Set 1.2: A 6 DT C7 :methyl -30:sc= -0.958 (180deg=-0.997) USER MOD Single : A 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 1 DT O5' : rot 19:sc= 0.664 USER MOD Single : A 2 DT C7 :methyl -30:sc= -0.289 (180deg=-0.395) USER MOD Single : A 7 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 14 DT C7 :methyl -30:sc= -0.31 (180deg=-0.479) USER MOD Single : A 15 DT C7 :methyl -30:sc= -1.67! (180deg=-1.8!) USER MOD Single : A 17 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 -7.750 -13.272 -3.483 1.00 0.00 O ATOM 2 C5' DT A 1 -8.621 -13.450 -2.362 1.00 0.00 C ATOM 3 C4' DT A 1 -8.108 -12.708 -1.132 1.00 0.00 C ATOM 4 O4' DT A 1 -6.699 -12.917 -1.008 1.00 0.00 O ATOM 5 C3' DT A 1 -8.354 -11.220 -1.348 1.00 0.00 C ATOM 6 O3' DT A 1 -9.251 -10.743 -0.339 1.00 0.00 O ATOM 7 C2' DT A 1 -6.993 -10.547 -1.188 1.00 0.00 C ATOM 8 C1' DT A 1 -5.996 -11.671 -0.899 1.00 0.00 C ATOM 9 N1 DT A 1 -4.860 -11.629 -1.840 1.00 0.00 N ATOM 10 C2 DT A 1 -3.589 -11.684 -1.303 1.00 0.00 C ATOM 11 O2 DT A 1 -3.394 -11.737 -0.091 1.00 0.00 O ATOM 12 N3 DT A 1 -2.545 -11.667 -2.209 1.00 0.00 N ATOM 13 C4 DT A 1 -2.662 -11.601 -3.585 1.00 0.00 C ATOM 14 O4 DT A 1 -1.660 -11.600 -4.299 1.00 0.00 O ATOM 15 C5 DT A 1 -4.030 -11.543 -4.056 1.00 0.00 C ATOM 16 C7 DT A 1 -4.308 -11.453 -5.552 1.00 0.00 C ATOM 17 C6 DT A 1 -5.063 -11.559 -3.191 1.00 0.00 C ATOM 0 H5' DT A 1 -8.712 -14.512 -2.136 1.00 0.00 H new ATOM 0 H5'' DT A 1 -9.619 -13.091 -2.615 1.00 0.00 H new ATOM 0 H4' DT A 1 -8.615 -13.066 -0.236 1.00 0.00 H new ATOM 0 H3' DT A 1 -8.792 -11.012 -2.324 1.00 0.00 H new ATOM 0 H2' DT A 1 -6.718 -10.005 -2.092 1.00 0.00 H new ATOM 0 H2'' DT A 1 -7.010 -9.822 -0.374 1.00 0.00 H new ATOM 0 HO5' DT A 1 -6.871 -12.971 -3.170 1.00 0.00 H new ATOM 0 H1' DT A 1 -5.583 -11.554 0.103 1.00 0.00 H new ATOM 0 H3 DT A 1 -1.600 -11.707 -1.827 1.00 0.00 H new ATOM 0 H71 DT A 1 -5.261 -11.933 -5.775 1.00 0.00 H new ATOM 0 H72 DT A 1 -4.351 -10.406 -5.852 1.00 0.00 H new ATOM 0 H73 DT A 1 -3.512 -11.956 -6.101 1.00 0.00 H new ATOM 0 H6 DT A 1 -6.073 -11.516 -3.572 1.00 0.00 H new ATOM 31 P DT A 2 -9.398 -9.168 -0.050 1.00 0.00 P ATOM 32 OP1 DT A 2 -10.695 -8.935 0.623 1.00 0.00 O ATOM 33 OP2 DT A 2 -9.065 -8.433 -1.291 1.00 0.00 O ATOM 34 O5' DT A 2 -8.221 -8.915 1.018 1.00 0.00 O ATOM 35 C5' DT A 2 -7.953 -9.890 2.027 1.00 0.00 C ATOM 36 C4' DT A 2 -6.705 -9.538 2.833 1.00 0.00 C ATOM 37 O4' DT A 2 -5.540 -9.794 2.043 1.00 0.00 O ATOM 38 C3' DT A 2 -6.744 -8.046 3.140 1.00 0.00 C ATOM 39 O3' DT A 2 -6.799 -7.858 4.559 1.00 0.00 O ATOM 40 C2' DT A 2 -5.437 -7.479 2.602 1.00 0.00 C ATOM 41 C1' DT A 2 -4.644 -8.676 2.089 1.00 0.00 C ATOM 42 N1 DT A 2 -4.078 -8.398 0.757 1.00 0.00 N ATOM 43 C2 DT A 2 -2.711 -8.530 0.601 1.00 0.00 C ATOM 44 O2 DT A 2 -1.969 -8.811 1.539 1.00 0.00 O ATOM 45 N3 DT A 2 -2.225 -8.312 -0.675 1.00 0.00 N ATOM 46 C4 DT A 2 -2.975 -7.978 -1.788 1.00 0.00 C ATOM 47 O4 DT A 2 -2.438 -7.823 -2.883 1.00 0.00 O ATOM 48 C5 DT A 2 -4.389 -7.859 -1.523 1.00 0.00 C ATOM 49 C7 DT A 2 -5.342 -7.509 -2.654 1.00 0.00 C ATOM 50 C6 DT A 2 -4.887 -8.064 -0.290 1.00 0.00 C ATOM 0 H5' DT A 2 -7.823 -10.868 1.563 1.00 0.00 H new ATOM 0 H5'' DT A 2 -8.810 -9.966 2.697 1.00 0.00 H new ATOM 0 H4' DT A 2 -6.675 -10.131 3.747 1.00 0.00 H new ATOM 0 H3' DT A 2 -7.611 -7.559 2.693 1.00 0.00 H new ATOM 0 H2' DT A 2 -5.622 -6.761 1.803 1.00 0.00 H new ATOM 0 H2'' DT A 2 -4.889 -6.952 3.383 1.00 0.00 H new ATOM 0 H1' DT A 2 -3.804 -8.890 2.750 1.00 0.00 H new ATOM 0 H3 DT A 2 -1.218 -8.406 -0.808 1.00 0.00 H new ATOM 0 H71 DT A 2 -4.824 -6.893 -3.389 1.00 0.00 H new ATOM 0 H72 DT A 2 -5.693 -8.424 -3.131 1.00 0.00 H new ATOM 0 H73 DT A 2 -6.194 -6.958 -2.255 1.00 0.00 H new ATOM 0 H6 DT A 2 -5.950 -7.962 -0.125 1.00 0.00 H new ATOM 63 P DA A 3 -6.514 -6.414 5.210 1.00 0.00 P ATOM 64 OP1 DA A 3 -7.036 -6.418 6.595 1.00 0.00 O ATOM 65 OP2 DA A 3 -6.962 -5.375 4.256 1.00 0.00 O ATOM 66 O5' DA A 3 -4.906 -6.374 5.279 1.00 0.00 O ATOM 67 C5' DA A 3 -4.179 -7.431 5.912 1.00 0.00 C ATOM 68 C4' DA A 3 -2.700 -7.078 6.064 1.00 0.00 C ATOM 69 O4' DA A 3 -2.032 -7.266 4.812 1.00 0.00 O ATOM 70 C3' DA A 3 -2.604 -5.601 6.430 1.00 0.00 C ATOM 71 O3' DA A 3 -2.013 -5.464 7.723 1.00 0.00 O ATOM 72 C2' DA A 3 -1.686 -4.972 5.390 1.00 0.00 C ATOM 73 C1' DA A 3 -1.252 -6.108 4.467 1.00 0.00 C ATOM 74 N9 DA A 3 -1.469 -5.749 3.052 1.00 0.00 N ATOM 75 C8 DA A 3 -2.640 -5.422 2.426 1.00 0.00 C ATOM 76 N7 DA A 3 -2.531 -5.247 1.139 1.00 0.00 N ATOM 77 C5 DA A 3 -1.180 -5.468 0.892 1.00 0.00 C ATOM 78 C6 DA A 3 -0.416 -5.436 -0.287 1.00 0.00 C ATOM 79 N6 DA A 3 -0.939 -5.196 -1.489 1.00 0.00 N ATOM 80 N1 DA A 3 0.897 -5.697 -0.176 1.00 0.00 N ATOM 81 C2 DA A 3 1.407 -5.973 1.019 1.00 0.00 C ATOM 82 N3 DA A 3 0.795 -6.039 2.194 1.00 0.00 N ATOM 83 C4 DA A 3 -0.522 -5.769 2.053 1.00 0.00 C ATOM 0 H5' DA A 3 -4.278 -8.345 5.326 1.00 0.00 H new ATOM 0 H5'' DA A 3 -4.609 -7.634 6.893 1.00 0.00 H new ATOM 0 H4' DA A 3 -2.244 -7.709 6.827 1.00 0.00 H new ATOM 0 H3' DA A 3 -3.586 -5.128 6.448 1.00 0.00 H new ATOM 0 H2' DA A 3 -2.205 -4.193 4.832 1.00 0.00 H new ATOM 0 H2'' DA A 3 -0.823 -4.503 5.864 1.00 0.00 H new ATOM 0 H1' DA A 3 -0.188 -6.307 4.592 1.00 0.00 H new ATOM 0 H8 DA A 3 -3.576 -5.318 2.954 1.00 0.00 H new ATOM 0 H61 DA A 3 -0.338 -5.184 -2.313 1.00 0.00 H new ATOM 0 H62 DA A 3 -1.940 -5.024 -1.585 1.00 0.00 H new ATOM 0 H2 DA A 3 2.468 -6.171 1.036 1.00 0.00 H new ATOM 95 P DA A 4 -2.005 -4.034 8.460 1.00 0.00 P ATOM 96 OP1 DA A 4 -1.879 -4.264 9.917 1.00 0.00 O ATOM 97 OP2 DA A 4 -3.133 -3.234 7.933 1.00 0.00 O ATOM 98 O5' DA A 4 -0.633 -3.377 7.933 1.00 0.00 O ATOM 99 C5' DA A 4 0.615 -3.750 8.519 1.00 0.00 C ATOM 100 C4' DA A 4 1.793 -3.415 7.606 1.00 0.00 C ATOM 101 O4' DA A 4 1.467 -3.758 6.257 1.00 0.00 O ATOM 102 C3' DA A 4 2.025 -1.910 7.656 1.00 0.00 C ATOM 103 O3' DA A 4 3.283 -1.641 8.280 1.00 0.00 O ATOM 104 C2' DA A 4 2.077 -1.453 6.202 1.00 0.00 C ATOM 105 C1' DA A 4 1.882 -2.714 5.365 1.00 0.00 C ATOM 106 N9 DA A 4 0.883 -2.506 4.297 1.00 0.00 N ATOM 107 C8 DA A 4 -0.483 -2.420 4.391 1.00 0.00 C ATOM 108 N7 DA A 4 -1.093 -2.322 3.243 1.00 0.00 N ATOM 109 C5 DA A 4 -0.055 -2.340 2.317 1.00 0.00 C ATOM 110 C6 DA A 4 -0.034 -2.273 0.914 1.00 0.00 C ATOM 111 N6 DA A 4 -1.138 -2.206 0.171 1.00 0.00 N ATOM 112 N1 DA A 4 1.167 -2.312 0.313 1.00 0.00 N ATOM 113 C2 DA A 4 2.262 -2.416 1.059 1.00 0.00 C ATOM 114 N3 DA A 4 2.371 -2.492 2.376 1.00 0.00 N ATOM 115 C4 DA A 4 1.152 -2.448 2.950 1.00 0.00 C ATOM 0 H5' DA A 4 0.612 -4.819 8.731 1.00 0.00 H new ATOM 0 H5'' DA A 4 0.737 -3.236 9.473 1.00 0.00 H new ATOM 0 H4' DA A 4 2.675 -3.966 7.932 1.00 0.00 H new ATOM 0 H3' DA A 4 1.245 -1.398 8.219 1.00 0.00 H new ATOM 0 H2' DA A 4 1.297 -0.721 5.994 1.00 0.00 H new ATOM 0 H2'' DA A 4 3.031 -0.976 5.975 1.00 0.00 H new ATOM 0 H1' DA A 4 2.814 -2.980 4.867 1.00 0.00 H new ATOM 0 H8 DA A 4 -1.008 -2.432 5.335 1.00 0.00 H new ATOM 0 H61 DA A 4 -1.067 -2.159 -0.845 1.00 0.00 H new ATOM 0 H62 DA A 4 -2.054 -2.202 0.619 1.00 0.00 H new ATOM 0 H2 DA A 4 3.194 -2.442 0.514 1.00 0.00 H new ATOM 127 P DT A 5 3.677 -0.137 8.695 1.00 0.00 P ATOM 128 OP1 DT A 5 4.790 -0.200 9.669 1.00 0.00 O ATOM 129 OP2 DT A 5 2.434 0.586 9.043 1.00 0.00 O ATOM 130 O5' DT A 5 4.245 0.473 7.317 1.00 0.00 O ATOM 131 C5' DT A 5 5.468 -0.011 6.757 1.00 0.00 C ATOM 132 C4' DT A 5 5.885 0.799 5.531 1.00 0.00 C ATOM 133 O4' DT A 5 5.010 0.500 4.441 1.00 0.00 O ATOM 134 C3' DT A 5 5.727 2.279 5.863 1.00 0.00 C ATOM 135 O3' DT A 5 7.011 2.909 5.841 1.00 0.00 O ATOM 136 C2' DT A 5 4.859 2.862 4.753 1.00 0.00 C ATOM 137 C1' DT A 5 4.576 1.705 3.797 1.00 0.00 C ATOM 138 N1 DT A 5 3.139 1.629 3.464 1.00 0.00 N ATOM 139 C2 DT A 5 2.790 1.667 2.127 1.00 0.00 C ATOM 140 O2 DT A 5 3.626 1.807 1.237 1.00 0.00 O ATOM 141 N3 DT A 5 1.441 1.547 1.848 1.00 0.00 N ATOM 142 C4 DT A 5 0.427 1.395 2.778 1.00 0.00 C ATOM 143 O4 DT A 5 -0.742 1.289 2.418 1.00 0.00 O ATOM 144 C5 DT A 5 0.887 1.370 4.149 1.00 0.00 C ATOM 145 C7 DT A 5 -0.125 1.207 5.279 1.00 0.00 C ATOM 146 C6 DT A 5 2.197 1.485 4.446 1.00 0.00 C ATOM 0 H5' DT A 5 5.352 -1.059 6.479 1.00 0.00 H new ATOM 0 H5'' DT A 5 6.256 0.034 7.509 1.00 0.00 H new ATOM 0 H4' DT A 5 6.914 0.559 5.263 1.00 0.00 H new ATOM 0 H3' DT A 5 5.284 2.430 6.848 1.00 0.00 H new ATOM 0 H2' DT A 5 3.933 3.273 5.155 1.00 0.00 H new ATOM 0 H2'' DT A 5 5.373 3.676 4.241 1.00 0.00 H new ATOM 0 H1' DT A 5 5.111 1.853 2.859 1.00 0.00 H new ATOM 0 H3 DT A 5 1.168 1.573 0.866 1.00 0.00 H new ATOM 0 H71 DT A 5 -1.078 1.642 4.979 1.00 0.00 H new ATOM 0 H72 DT A 5 -0.262 0.147 5.495 1.00 0.00 H new ATOM 0 H73 DT A 5 0.241 1.715 6.171 1.00 0.00 H new ATOM 0 H6 DT A 5 2.509 1.463 5.480 1.00 0.00 H new ATOM 159 P DT A 6 7.182 4.429 6.345 1.00 0.00 P ATOM 160 OP1 DT A 6 8.583 4.615 6.785 1.00 0.00 O ATOM 161 OP2 DT A 6 6.070 4.738 7.271 1.00 0.00 O ATOM 162 O5' DT A 6 6.960 5.273 4.995 1.00 0.00 O ATOM 163 C5' DT A 6 7.639 4.909 3.792 1.00 0.00 C ATOM 164 C4' DT A 6 7.112 5.693 2.593 1.00 0.00 C ATOM 165 O4' DT A 6 5.843 5.168 2.194 1.00 0.00 O ATOM 166 C3' DT A 6 6.897 7.140 3.029 1.00 0.00 C ATOM 167 O3' DT A 6 7.728 7.993 2.238 1.00 0.00 O ATOM 168 C2' DT A 6 5.433 7.447 2.734 1.00 0.00 C ATOM 169 C1' DT A 6 4.912 6.234 1.970 1.00 0.00 C ATOM 170 N1 DT A 6 3.552 5.850 2.401 1.00 0.00 N ATOM 171 C2 DT A 6 2.596 5.704 1.413 1.00 0.00 C ATOM 172 O2 DT A 6 2.831 5.960 0.234 1.00 0.00 O ATOM 173 N3 DT A 6 1.353 5.267 1.828 1.00 0.00 N ATOM 174 C4 DT A 6 0.985 4.972 3.128 1.00 0.00 C ATOM 175 O4 DT A 6 -0.149 4.570 3.383 1.00 0.00 O ATOM 176 C5 DT A 6 2.044 5.165 4.095 1.00 0.00 C ATOM 177 C7 DT A 6 1.772 4.881 5.567 1.00 0.00 C ATOM 178 C6 DT A 6 3.267 5.589 3.715 1.00 0.00 C ATOM 0 H5' DT A 6 7.516 3.841 3.612 1.00 0.00 H new ATOM 0 H5'' DT A 6 8.707 5.092 3.906 1.00 0.00 H new ATOM 0 H4' DT A 6 7.822 5.623 1.769 1.00 0.00 H new ATOM 0 H3' DT A 6 7.140 7.293 4.081 1.00 0.00 H new ATOM 0 H2' DT A 6 4.871 7.603 3.655 1.00 0.00 H new ATOM 0 H2'' DT A 6 5.334 8.357 2.142 1.00 0.00 H new ATOM 0 H1' DT A 6 4.833 6.467 0.908 1.00 0.00 H new ATOM 0 H3 DT A 6 0.640 5.151 1.108 1.00 0.00 H new ATOM 0 H71 DT A 6 0.721 5.071 5.786 1.00 0.00 H new ATOM 0 H72 DT A 6 2.006 3.839 5.786 1.00 0.00 H new ATOM 0 H73 DT A 6 2.394 5.530 6.184 1.00 0.00 H new ATOM 0 H6 DT A 6 4.036 5.725 4.461 1.00 0.00 H new ATOM 191 P DT A 7 7.576 9.592 2.326 1.00 0.00 P ATOM 192 OP1 DT A 7 8.788 10.209 1.738 1.00 0.00 O ATOM 193 OP2 DT A 7 7.165 9.941 3.704 1.00 0.00 O ATOM 194 O5' DT A 7 6.336 9.883 1.341 1.00 0.00 O ATOM 195 C5' DT A 7 6.275 9.281 0.045 1.00 0.00 C ATOM 196 C4' DT A 7 4.980 9.646 -0.676 1.00 0.00 C ATOM 197 O4' DT A 7 3.890 8.924 -0.095 1.00 0.00 O ATOM 198 C3' DT A 7 4.717 11.131 -0.455 1.00 0.00 C ATOM 199 O3' DT A 7 4.802 11.821 -1.704 1.00 0.00 O ATOM 200 C2' DT A 7 3.291 11.224 0.069 1.00 0.00 C ATOM 201 C1' DT A 7 2.761 9.791 0.070 1.00 0.00 C ATOM 202 N1 DT A 7 2.028 9.499 1.318 1.00 0.00 N ATOM 203 C2 DT A 7 0.737 9.019 1.197 1.00 0.00 C ATOM 204 O2 DT A 7 0.213 8.827 0.103 1.00 0.00 O ATOM 205 N3 DT A 7 0.068 8.769 2.381 1.00 0.00 N ATOM 206 C4 DT A 7 0.569 8.956 3.656 1.00 0.00 C ATOM 207 O4 DT A 7 -0.117 8.701 4.643 1.00 0.00 O ATOM 208 C5 DT A 7 1.924 9.461 3.685 1.00 0.00 C ATOM 209 C7 DT A 7 2.599 9.716 5.026 1.00 0.00 C ATOM 210 C6 DT A 7 2.599 9.711 2.544 1.00 0.00 C ATOM 0 H5' DT A 7 6.347 8.198 0.141 1.00 0.00 H new ATOM 0 H5'' DT A 7 7.129 9.606 -0.550 1.00 0.00 H new ATOM 0 H4' DT A 7 5.069 9.407 -1.736 1.00 0.00 H new ATOM 0 H3' DT A 7 5.438 11.571 0.234 1.00 0.00 H new ATOM 0 H2' DT A 7 3.269 11.651 1.072 1.00 0.00 H new ATOM 0 H2'' DT A 7 2.681 11.867 -0.565 1.00 0.00 H new ATOM 0 H1' DT A 7 2.050 9.640 -0.742 1.00 0.00 H new ATOM 0 H3 DT A 7 -0.885 8.413 2.307 1.00 0.00 H new ATOM 0 H71 DT A 7 3.674 9.568 4.926 1.00 0.00 H new ATOM 0 H72 DT A 7 2.401 10.740 5.344 1.00 0.00 H new ATOM 0 H73 DT A 7 2.205 9.023 5.769 1.00 0.00 H new ATOM 0 H6 DT A 7 3.610 10.086 2.599 1.00 0.00 H new HETATM 223 C4 D33 A 8 2.257 8.840 -4.677 1.00 0.00 C HETATM 224 C5 D33 A 8 1.250 9.640 -4.223 1.00 0.00 C HETATM 225 C2 D33 A 8 2.430 10.816 -5.685 1.00 0.00 C HETATM 226 N1 D33 A 8 1.374 10.866 -4.860 1.00 0.00 N HETATM 227 P D33 A 8 4.600 13.417 -1.764 1.00 0.00 P HETATM 228 OP1 D33 A 8 5.500 13.957 -2.807 1.00 0.00 O HETATM 229 OP2 D33 A 8 4.670 13.943 -0.383 1.00 0.00 O HETATM 230 O5' D33 A 8 3.081 13.563 -2.284 1.00 0.00 O HETATM 231 C5' D33 A 8 2.807 14.214 -3.526 1.00 0.00 C HETATM 232 C4' D33 A 8 1.328 14.127 -3.906 1.00 0.00 C HETATM 233 O4' D33 A 8 1.190 13.244 -5.024 1.00 0.00 O HETATM 234 C1' D33 A 8 0.497 12.041 -4.660 1.00 0.00 C HETATM 235 N3 D33 A 8 2.973 9.593 -5.581 1.00 0.00 N HETATM 236 C2' D33 A 8 0.077 12.168 -3.194 1.00 0.00 C HETATM 237 C3' D33 A 8 0.559 13.534 -2.730 1.00 0.00 C HETATM 238 O3' D33 A 8 -0.573 14.361 -2.436 1.00 0.00 O HETATM 0 H25' D33 A 8 3.103 15.261 -3.459 1.00 0.00 H new HETATM 0 H22' D33 A 8 0.520 11.374 -2.592 1.00 0.00 H new HETATM 0 H15' D33 A 8 3.410 13.762 -4.313 1.00 0.00 H new HETATM 0 H12' D33 A 8 -1.005 12.081 -3.090 1.00 0.00 H new HETATM 0 H55 D33 A 8 0.488 9.366 -3.494 1.00 0.00 H new HETATM 0 H44 D33 A 8 2.456 7.809 -4.383 1.00 0.00 H new HETATM 0 H4' D33 A 8 0.946 15.117 -4.155 1.00 0.00 H new HETATM 0 H3' D33 A 8 1.178 13.464 -1.836 1.00 0.00 H new HETATM 0 H22 D33 A 8 2.784 11.624 -6.325 1.00 0.00 H new HETATM 0 H1' D33 A 8 -0.384 11.901 -5.286 1.00 0.00 H new HETATM 250 C4 D33 A 9 2.467 13.976 1.256 1.00 0.00 C HETATM 251 C5 D33 A 9 1.297 13.285 1.131 1.00 0.00 C HETATM 252 C2 D33 A 9 1.597 13.695 3.284 1.00 0.00 C HETATM 253 N1 D33 A 9 0.775 13.123 2.402 1.00 0.00 N HETATM 254 P D33 A 9 -1.724 13.864 -1.419 1.00 0.00 P HETATM 255 OP1 D33 A 9 -2.904 13.463 -2.217 1.00 0.00 O HETATM 256 OP2 D33 A 9 -1.867 14.882 -0.354 1.00 0.00 O HETATM 257 O5' D33 A 9 -1.087 12.537 -0.761 1.00 0.00 O HETATM 258 C5' D33 A 9 -1.939 11.484 -0.293 1.00 0.00 C HETATM 259 C4' D33 A 9 -2.039 11.464 1.230 1.00 0.00 C HETATM 260 O4' D33 A 9 -0.728 11.367 1.790 1.00 0.00 O HETATM 261 C1' D33 A 9 -0.481 12.427 2.723 1.00 0.00 C HETATM 262 N3 D33 A 9 2.628 14.218 2.604 1.00 0.00 N HETATM 263 C2' D33 A 9 -1.665 13.395 2.664 1.00 0.00 C HETATM 264 C3' D33 A 9 -2.657 12.783 1.686 1.00 0.00 C HETATM 265 O3' D33 A 9 -3.888 12.518 2.365 1.00 0.00 O HETATM 0 H25' D33 A 9 -2.934 11.606 -0.720 1.00 0.00 H new HETATM 0 H22' D33 A 9 -1.346 14.382 2.330 1.00 0.00 H new HETATM 0 H15' D33 A 9 -1.557 10.525 -0.644 1.00 0.00 H new HETATM 0 H12' D33 A 9 -2.115 13.522 3.649 1.00 0.00 H new HETATM 0 H55 D33 A 9 0.855 12.927 0.201 1.00 0.00 H new HETATM 0 H44 D33 A 9 3.139 14.276 0.452 1.00 0.00 H new HETATM 0 H4' D33 A 9 -2.644 10.616 1.552 1.00 0.00 H new HETATM 0 H3' D33 A 9 -2.859 13.447 0.846 1.00 0.00 H new HETATM 0 H22 D33 A 9 1.456 13.731 4.364 1.00 0.00 H new HETATM 0 H1' D33 A 9 -0.379 12.021 3.729 1.00 0.00 H new HETATM 277 C4 D33 A 10 -4.558 11.384 6.357 1.00 0.00 C HETATM 278 C5 D33 A 10 -5.287 11.199 5.217 1.00 0.00 C HETATM 279 C2 D33 A 10 -5.661 9.458 6.535 1.00 0.00 C HETATM 280 N1 D33 A 10 -5.965 9.997 5.349 1.00 0.00 N HETATM 281 P D33 A 10 -5.233 13.305 1.958 1.00 0.00 P HETATM 282 OP1 D33 A 10 -5.283 13.404 0.482 1.00 0.00 O HETATM 283 OP2 D33 A 10 -5.319 14.530 2.782 1.00 0.00 O HETATM 284 O5' D33 A 10 -6.391 12.293 2.435 1.00 0.00 O HETATM 285 C5' D33 A 10 -7.021 11.416 1.498 1.00 0.00 C HETATM 286 C4' D33 A 10 -7.430 10.094 2.150 1.00 0.00 C HETATM 287 O4' D33 A 10 -6.378 9.649 3.012 1.00 0.00 O HETATM 288 C1' D33 A 10 -6.866 9.408 4.340 1.00 0.00 C HETATM 289 N3 D33 A 10 -4.808 10.288 7.156 1.00 0.00 N HETATM 290 C2' D33 A 10 -8.266 10.016 4.435 1.00 0.00 C HETATM 291 C3' D33 A 10 -8.669 10.349 3.005 1.00 0.00 C HETATM 292 O3' D33 A 10 -9.722 9.471 2.585 1.00 0.00 O HETATM 0 H25' D33 A 10 -7.901 11.903 1.078 1.00 0.00 H new HETATM 0 H22' D33 A 10 -8.263 10.910 5.059 1.00 0.00 H new HETATM 0 H15' D33 A 10 -6.341 11.218 0.670 1.00 0.00 H new HETATM 0 H12' D33 A 10 -8.968 9.314 4.886 1.00 0.00 H new HETATM 0 H55 D33 A 10 -5.328 11.872 4.361 1.00 0.00 H new HETATM 0 H44 D33 A 10 -3.909 12.228 6.589 1.00 0.00 H new HETATM 0 H4' D33 A 10 -7.629 9.344 1.384 1.00 0.00 H new HETATM 0 H3' D33 A 10 -9.021 11.377 2.916 1.00 0.00 H new HETATM 0 H22 D33 A 10 -6.038 8.514 6.927 1.00 0.00 H new HETATM 0 H1' D33 A 10 -6.905 8.337 4.539 1.00 0.00 H new ATOM 304 P DA A 11 -9.618 7.874 2.800 1.00 0.00 P ATOM 305 OP1 DA A 11 -10.990 7.342 2.959 1.00 0.00 O ATOM 306 OP2 DA A 11 -8.600 7.604 3.839 1.00 0.00 O ATOM 307 O5' DA A 11 -9.039 7.358 1.388 1.00 0.00 O ATOM 308 C5' DA A 11 -9.831 7.438 0.198 1.00 0.00 C ATOM 309 C4' DA A 11 -8.975 7.246 -1.057 1.00 0.00 C ATOM 310 O4' DA A 11 -7.694 7.846 -0.838 1.00 0.00 O ATOM 311 C3' DA A 11 -8.761 5.752 -1.288 1.00 0.00 C ATOM 312 O3' DA A 11 -8.970 5.459 -2.676 1.00 0.00 O ATOM 313 C2' DA A 11 -7.306 5.482 -0.931 1.00 0.00 C ATOM 314 C1' DA A 11 -6.662 6.853 -0.734 1.00 0.00 C ATOM 315 N9 DA A 11 -5.989 6.925 0.576 1.00 0.00 N ATOM 316 C8 DA A 11 -6.483 6.623 1.817 1.00 0.00 C ATOM 317 N7 DA A 11 -5.631 6.789 2.788 1.00 0.00 N ATOM 318 C5 DA A 11 -4.481 7.236 2.141 1.00 0.00 C ATOM 319 C6 DA A 11 -3.208 7.597 2.610 1.00 0.00 C ATOM 320 N6 DA A 11 -2.867 7.559 3.898 1.00 0.00 N ATOM 321 N1 DA A 11 -2.306 7.994 1.697 1.00 0.00 N ATOM 322 C2 DA A 11 -2.652 8.029 0.415 1.00 0.00 C ATOM 323 N3 DA A 11 -3.809 7.717 -0.146 1.00 0.00 N ATOM 324 C4 DA A 11 -4.693 7.323 0.793 1.00 0.00 C ATOM 0 H5' DA A 11 -10.330 8.406 0.155 1.00 0.00 H new ATOM 0 H5'' DA A 11 -10.612 6.678 0.227 1.00 0.00 H new ATOM 0 H4' DA A 11 -9.472 7.699 -1.915 1.00 0.00 H new ATOM 0 H3' DA A 11 -9.444 5.144 -0.695 1.00 0.00 H new ATOM 0 H2' DA A 11 -7.231 4.881 -0.024 1.00 0.00 H new ATOM 0 H2'' DA A 11 -6.806 4.926 -1.724 1.00 0.00 H new ATOM 0 H1' DA A 11 -5.903 7.027 -1.497 1.00 0.00 H new ATOM 0 H8 DA A 11 -7.493 6.277 1.977 1.00 0.00 H new ATOM 0 H61 DA A 11 -1.927 7.832 4.185 1.00 0.00 H new ATOM 0 H62 DA A 11 -3.546 7.257 4.597 1.00 0.00 H new ATOM 0 H2 DA A 11 -1.880 8.358 -0.265 1.00 0.00 H new ATOM 336 P DA A 12 -8.534 4.035 -3.297 1.00 0.00 P ATOM 337 OP1 DA A 12 -9.388 3.764 -4.475 1.00 0.00 O ATOM 338 OP2 DA A 12 -8.462 3.051 -2.195 1.00 0.00 O ATOM 339 O5' DA A 12 -7.034 4.321 -3.818 1.00 0.00 O ATOM 340 C5' DA A 12 -6.773 5.390 -4.732 1.00 0.00 C ATOM 341 C4' DA A 12 -5.356 5.315 -5.305 1.00 0.00 C ATOM 342 O4' DA A 12 -4.407 5.476 -4.246 1.00 0.00 O ATOM 343 C3' DA A 12 -5.161 3.929 -5.912 1.00 0.00 C ATOM 344 O3' DA A 12 -4.652 4.063 -7.243 1.00 0.00 O ATOM 345 C2' DA A 12 -4.113 3.242 -5.049 1.00 0.00 C ATOM 346 C1' DA A 12 -3.548 4.328 -4.137 1.00 0.00 C ATOM 347 N9 DA A 12 -3.479 3.870 -2.737 1.00 0.00 N ATOM 348 C8 DA A 12 -4.418 3.195 -2.003 1.00 0.00 C ATOM 349 N7 DA A 12 -4.092 3.012 -0.754 1.00 0.00 N ATOM 350 C5 DA A 12 -2.838 3.608 -0.653 1.00 0.00 C ATOM 351 C6 DA A 12 -1.943 3.762 0.420 1.00 0.00 C ATOM 352 N6 DA A 12 -2.202 3.334 1.655 1.00 0.00 N ATOM 353 N1 DA A 12 -0.787 4.401 0.172 1.00 0.00 N ATOM 354 C2 DA A 12 -0.547 4.853 -1.053 1.00 0.00 C ATOM 355 N3 DA A 12 -1.304 4.776 -2.136 1.00 0.00 N ATOM 356 C4 DA A 12 -2.456 4.130 -1.858 1.00 0.00 C ATOM 0 H5' DA A 12 -6.909 6.344 -4.223 1.00 0.00 H new ATOM 0 H5'' DA A 12 -7.497 5.357 -5.546 1.00 0.00 H new ATOM 0 H4' DA A 12 -5.215 6.095 -6.053 1.00 0.00 H new ATOM 0 H3' DA A 12 -6.095 3.368 -5.948 1.00 0.00 H new ATOM 0 H2' DA A 12 -4.555 2.433 -4.467 1.00 0.00 H new ATOM 0 H2'' DA A 12 -3.329 2.800 -5.664 1.00 0.00 H new ATOM 0 H1' DA A 12 -2.531 4.575 -4.442 1.00 0.00 H new ATOM 0 H8 DA A 12 -5.349 2.844 -2.423 1.00 0.00 H new ATOM 0 H61 DA A 12 -1.516 3.472 2.397 1.00 0.00 H new ATOM 0 H62 DA A 12 -3.086 2.868 1.858 1.00 0.00 H new ATOM 0 H2 DA A 12 0.400 5.355 -1.184 1.00 0.00 H new ATOM 368 P DA A 13 -4.149 2.769 -8.062 1.00 0.00 P ATOM 369 OP1 DA A 13 -4.203 3.089 -9.506 1.00 0.00 O ATOM 370 OP2 DA A 13 -4.868 1.585 -7.543 1.00 0.00 O ATOM 371 O5' DA A 13 -2.602 2.648 -7.630 1.00 0.00 O ATOM 372 C5' DA A 13 -1.607 3.468 -8.251 1.00 0.00 C ATOM 373 C4' DA A 13 -0.192 3.042 -7.856 1.00 0.00 C ATOM 374 O4' DA A 13 -0.062 3.085 -6.433 1.00 0.00 O ATOM 375 C3' DA A 13 0.017 1.599 -8.306 1.00 0.00 C ATOM 376 O3' DA A 13 1.106 1.545 -9.233 1.00 0.00 O ATOM 377 C2' DA A 13 0.390 0.821 -7.048 1.00 0.00 C ATOM 378 C1' DA A 13 0.482 1.856 -5.930 1.00 0.00 C ATOM 379 N9 DA A 13 -0.260 1.417 -4.733 1.00 0.00 N ATOM 380 C8 DA A 13 -1.561 1.000 -4.633 1.00 0.00 C ATOM 381 N7 DA A 13 -1.955 0.759 -3.415 1.00 0.00 N ATOM 382 C5 DA A 13 -0.826 1.034 -2.646 1.00 0.00 C ATOM 383 C6 DA A 13 -0.583 0.977 -1.265 1.00 0.00 C ATOM 384 N6 DA A 13 -1.516 0.645 -0.373 1.00 0.00 N ATOM 385 N1 DA A 13 0.648 1.310 -0.840 1.00 0.00 N ATOM 386 C2 DA A 13 1.562 1.675 -1.731 1.00 0.00 C ATOM 387 N3 DA A 13 1.455 1.773 -3.047 1.00 0.00 N ATOM 388 C4 DA A 13 0.211 1.430 -3.443 1.00 0.00 C ATOM 0 H5' DA A 13 -1.765 4.509 -7.968 1.00 0.00 H new ATOM 0 H5'' DA A 13 -1.714 3.412 -9.334 1.00 0.00 H new ATOM 0 H4' DA A 13 0.537 3.708 -8.318 1.00 0.00 H new ATOM 0 H3' DA A 13 -0.871 1.192 -8.789 1.00 0.00 H new ATOM 0 H2' DA A 13 -0.361 0.064 -6.819 1.00 0.00 H new ATOM 0 H2'' DA A 13 1.339 0.300 -7.177 1.00 0.00 H new ATOM 0 H1' DA A 13 1.522 1.988 -5.630 1.00 0.00 H new ATOM 0 H8 DA A 13 -2.206 0.881 -5.491 1.00 0.00 H new ATOM 0 H61 DA A 13 -1.286 0.619 0.620 1.00 0.00 H new ATOM 0 H62 DA A 13 -2.460 0.417 -0.684 1.00 0.00 H new ATOM 0 H2 DA A 13 2.530 1.928 -1.325 1.00 0.00 H new ATOM 400 P DT A 14 1.756 0.133 -9.654 1.00 0.00 P ATOM 401 OP1 DT A 14 2.746 0.382 -10.727 1.00 0.00 O ATOM 402 OP2 DT A 14 0.660 -0.836 -9.871 1.00 0.00 O ATOM 403 O5' DT A 14 2.555 -0.298 -8.323 1.00 0.00 O ATOM 404 C5' DT A 14 3.827 0.282 -8.022 1.00 0.00 C ATOM 405 C4' DT A 14 4.624 -0.574 -7.038 1.00 0.00 C ATOM 406 O4' DT A 14 3.971 -0.585 -5.766 1.00 0.00 O ATOM 407 C3' DT A 14 4.649 -2.008 -7.557 1.00 0.00 C ATOM 408 O3' DT A 14 5.985 -2.359 -7.922 1.00 0.00 O ATOM 409 C2' DT A 14 4.202 -2.878 -6.386 1.00 0.00 C ATOM 410 C1' DT A 14 3.944 -1.915 -5.228 1.00 0.00 C ATOM 411 N1 DT A 14 2.645 -2.184 -4.579 1.00 0.00 N ATOM 412 C2 DT A 14 2.636 -2.300 -3.202 1.00 0.00 C ATOM 413 O2 DT A 14 3.668 -2.246 -2.534 1.00 0.00 O ATOM 414 N3 DT A 14 1.399 -2.493 -2.616 1.00 0.00 N ATOM 415 C4 DT A 14 0.188 -2.582 -3.281 1.00 0.00 C ATOM 416 O4 DT A 14 -0.857 -2.741 -2.658 1.00 0.00 O ATOM 417 C5 DT A 14 0.298 -2.457 -4.717 1.00 0.00 C ATOM 418 C7 DT A 14 -0.959 -2.553 -5.577 1.00 0.00 C ATOM 419 C6 DT A 14 1.492 -2.267 -5.311 1.00 0.00 C ATOM 0 H5' DT A 14 3.682 1.278 -7.603 1.00 0.00 H new ATOM 0 H5'' DT A 14 4.398 0.404 -8.943 1.00 0.00 H new ATOM 0 H4' DT A 14 5.631 -0.168 -6.939 1.00 0.00 H new ATOM 0 H3' DT A 14 4.008 -2.135 -8.430 1.00 0.00 H new ATOM 0 H2' DT A 14 3.301 -3.439 -6.637 1.00 0.00 H new ATOM 0 H2'' DT A 14 4.969 -3.607 -6.125 1.00 0.00 H new ATOM 0 H1' DT A 14 4.709 -2.042 -4.462 1.00 0.00 H new ATOM 0 H3 DT A 14 1.376 -2.578 -1.600 1.00 0.00 H new ATOM 0 H71 DT A 14 -1.685 -3.204 -5.089 1.00 0.00 H new ATOM 0 H72 DT A 14 -1.390 -1.560 -5.704 1.00 0.00 H new ATOM 0 H73 DT A 14 -0.701 -2.964 -6.553 1.00 0.00 H new ATOM 0 H6 DT A 14 1.540 -2.178 -6.386 1.00 0.00 H new ATOM 432 P DT A 15 6.382 -3.896 -8.185 1.00 0.00 P ATOM 433 OP1 DT A 15 7.723 -3.929 -8.808 1.00 0.00 O ATOM 434 OP2 DT A 15 5.241 -4.561 -8.853 1.00 0.00 O ATOM 435 O5' DT A 15 6.505 -4.486 -6.692 1.00 0.00 O ATOM 436 C5' DT A 15 7.655 -4.196 -5.895 1.00 0.00 C ATOM 437 C4' DT A 15 7.564 -4.840 -4.512 1.00 0.00 C ATOM 438 O4' DT A 15 6.299 -4.536 -3.919 1.00 0.00 O ATOM 439 C3' DT A 15 7.642 -6.352 -4.685 1.00 0.00 C ATOM 440 O3' DT A 15 8.853 -6.836 -4.099 1.00 0.00 O ATOM 441 C2' DT A 15 6.453 -6.917 -3.920 1.00 0.00 C ATOM 442 C1' DT A 15 5.734 -5.711 -3.319 1.00 0.00 C ATOM 443 N1 DT A 15 4.280 -5.775 -3.565 1.00 0.00 N ATOM 444 C2 DT A 15 3.449 -5.827 -2.462 1.00 0.00 C ATOM 445 O2 DT A 15 3.888 -5.881 -1.315 1.00 0.00 O ATOM 446 N3 DT A 15 2.091 -5.825 -2.724 1.00 0.00 N ATOM 447 C4 DT A 15 1.503 -5.779 -3.976 1.00 0.00 C ATOM 448 O4 DT A 15 0.279 -5.768 -4.093 1.00 0.00 O ATOM 449 C5 DT A 15 2.450 -5.733 -5.067 1.00 0.00 C ATOM 450 C7 DT A 15 1.937 -5.673 -6.503 1.00 0.00 C ATOM 451 C6 DT A 15 3.778 -5.736 -4.837 1.00 0.00 C ATOM 0 H5' DT A 15 7.760 -3.116 -5.787 1.00 0.00 H new ATOM 0 H5'' DT A 15 8.550 -4.554 -6.404 1.00 0.00 H new ATOM 0 H4' DT A 15 8.371 -4.466 -3.882 1.00 0.00 H new ATOM 0 H3' DT A 15 7.627 -6.641 -5.736 1.00 0.00 H new ATOM 0 H2' DT A 15 5.792 -7.476 -4.582 1.00 0.00 H new ATOM 0 H2'' DT A 15 6.781 -7.605 -3.141 1.00 0.00 H new ATOM 0 H1' DT A 15 5.867 -5.695 -2.237 1.00 0.00 H new ATOM 0 H3 DT A 15 1.465 -5.861 -1.920 1.00 0.00 H new ATOM 0 H71 DT A 15 0.977 -6.185 -6.568 1.00 0.00 H new ATOM 0 H72 DT A 15 1.814 -4.632 -6.802 1.00 0.00 H new ATOM 0 H73 DT A 15 2.653 -6.159 -7.166 1.00 0.00 H new ATOM 0 H6 DT A 15 4.460 -5.707 -5.674 1.00 0.00 H new ATOM 464 P DA A 16 9.103 -8.418 -3.942 1.00 0.00 P ATOM 465 OP1 DA A 16 10.543 -8.636 -3.678 1.00 0.00 O ATOM 466 OP2 DA A 16 8.447 -9.106 -5.076 1.00 0.00 O ATOM 467 O5' DA A 16 8.285 -8.768 -2.600 1.00 0.00 O ATOM 468 C5' DA A 16 8.732 -8.277 -1.334 1.00 0.00 C ATOM 469 C4' DA A 16 7.825 -8.744 -0.197 1.00 0.00 C ATOM 470 O4' DA A 16 6.492 -8.269 -0.419 1.00 0.00 O ATOM 471 C3' DA A 16 7.787 -10.271 -0.214 1.00 0.00 C ATOM 472 O3' DA A 16 8.221 -10.766 1.058 1.00 0.00 O ATOM 473 C2' DA A 16 6.323 -10.640 -0.427 1.00 0.00 C ATOM 474 C1' DA A 16 5.551 -9.339 -0.262 1.00 0.00 C ATOM 475 N9 DA A 16 4.456 -9.237 -1.243 1.00 0.00 N ATOM 476 C8 DA A 16 4.520 -9.193 -2.610 1.00 0.00 C ATOM 477 N7 DA A 16 3.366 -9.047 -3.196 1.00 0.00 N ATOM 478 C5 DA A 16 2.466 -8.993 -2.136 1.00 0.00 C ATOM 479 C6 DA A 16 1.071 -8.844 -2.081 1.00 0.00 C ATOM 480 N6 DA A 16 0.308 -8.692 -3.165 1.00 0.00 N ATOM 481 N1 DA A 16 0.501 -8.836 -0.865 1.00 0.00 N ATOM 482 C2 DA A 16 1.266 -8.963 0.211 1.00 0.00 C ATOM 483 N3 DA A 16 2.579 -9.104 0.291 1.00 0.00 N ATOM 484 C4 DA A 16 3.123 -9.111 -0.944 1.00 0.00 C ATOM 0 H5' DA A 16 8.759 -7.188 -1.355 1.00 0.00 H new ATOM 0 H5'' DA A 16 9.751 -8.617 -1.150 1.00 0.00 H new ATOM 0 H4' DA A 16 8.202 -8.366 0.753 1.00 0.00 H new ATOM 0 H3' DA A 16 8.431 -10.690 -0.987 1.00 0.00 H new ATOM 0 H2' DA A 16 6.166 -11.068 -1.417 1.00 0.00 H new ATOM 0 H2'' DA A 16 5.996 -11.386 0.298 1.00 0.00 H new ATOM 0 H1' DA A 16 5.083 -9.295 0.721 1.00 0.00 H new ATOM 0 H8 DA A 16 5.448 -9.273 -3.156 1.00 0.00 H new ATOM 0 H61 DA A 16 -0.702 -8.588 -3.067 1.00 0.00 H new ATOM 0 H62 DA A 16 0.735 -8.680 -4.091 1.00 0.00 H new ATOM 0 H2 DA A 16 0.743 -8.949 1.156 1.00 0.00 H new ATOM 496 P DA A 17 8.467 -12.341 1.285 1.00 0.00 P ATOM 497 OP1 DA A 17 9.586 -12.502 2.242 1.00 0.00 O ATOM 498 OP2 DA A 17 8.531 -12.997 -0.041 1.00 0.00 O ATOM 499 O5' DA A 17 7.109 -12.810 2.014 1.00 0.00 O ATOM 500 C5' DA A 17 7.005 -12.796 3.441 1.00 0.00 C ATOM 501 C4' DA A 17 5.564 -12.549 3.897 1.00 0.00 C ATOM 502 O4' DA A 17 4.855 -11.823 2.888 1.00 0.00 O ATOM 503 C3' DA A 17 4.868 -13.897 4.063 1.00 0.00 C ATOM 504 O3' DA A 17 4.728 -14.234 5.447 1.00 0.00 O ATOM 505 C2' DA A 17 3.505 -13.727 3.403 1.00 0.00 C ATOM 506 C1' DA A 17 3.537 -12.366 2.710 1.00 0.00 C ATOM 507 N9 DA A 17 3.210 -12.511 1.279 1.00 0.00 N ATOM 508 C8 DA A 17 3.992 -12.996 0.269 1.00 0.00 C ATOM 509 N7 DA A 17 3.414 -13.008 -0.900 1.00 0.00 N ATOM 510 C5 DA A 17 2.147 -12.491 -0.645 1.00 0.00 C ATOM 511 C6 DA A 17 1.036 -12.241 -1.471 1.00 0.00 C ATOM 512 N6 DA A 17 1.027 -12.489 -2.781 1.00 0.00 N ATOM 513 N1 DA A 17 -0.061 -11.726 -0.890 1.00 0.00 N ATOM 514 C2 DA A 17 -0.048 -11.479 0.414 1.00 0.00 C ATOM 515 N3 DA A 17 0.926 -11.668 1.293 1.00 0.00 N ATOM 516 C4 DA A 17 2.013 -12.185 0.683 1.00 0.00 C ATOM 0 H5' DA A 17 7.654 -12.020 3.846 1.00 0.00 H new ATOM 0 H5'' DA A 17 7.357 -13.747 3.842 1.00 0.00 H new ATOM 0 H4' DA A 17 5.575 -11.988 4.831 1.00 0.00 H new ATOM 0 H3' DA A 17 5.440 -14.707 3.610 1.00 0.00 H new ATOM 0 H2' DA A 17 3.317 -14.526 2.685 1.00 0.00 H new ATOM 0 H2'' DA A 17 2.706 -13.769 4.143 1.00 0.00 H new ATOM 0 HO3' DA A 17 4.278 -15.101 5.529 1.00 0.00 H new ATOM 0 H1' DA A 17 2.795 -11.694 3.142 1.00 0.00 H new ATOM 0 H8 DA A 17 5.004 -13.340 0.426 1.00 0.00 H new ATOM 0 H61 DA A 17 0.193 -12.288 -3.332 1.00 0.00 H new ATOM 0 H62 DA A 17 1.854 -12.880 -3.232 1.00 0.00 H new ATOM 0 H2 DA A 17 -0.961 -11.065 0.816 1.00 0.00 H new TER 529 DA A 17