USER MOD reduce.3.24.130724 H: found=0, std=0, add=152, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 153 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 180:sc= -0.449 USER MOD Single : A 2 G O2' : rot -29:sc= 0.142 USER MOD Single : A 3 C O2' : rot -78:sc= 1.23 USER MOD Single : A 4 A O2' : rot -123:sc= 0.13 USER MOD Single : A 5 C O2' : rot -18:sc= 0.0723 USER MOD Single : A 6 U O2' : rot -172:sc= 1.26 USER MOD Single : A 7 U O2' : rot -96:sc= 0.454 USER MOD Single : A 8 C O2' : rot 22:sc= 0.252 USER MOD Single : A 9 G O2' : rot -19:sc= 0.199 USER MOD Single : A 10 G O2' : rot -16:sc= 0.0795 USER MOD Single : A 11 U O2' : rot -14:sc= 0.191 USER MOD Single : A 12 G O2' : rot -15:sc= 0.163 USER MOD Single : A 13 C O2' : rot -15:sc= 0.14 USER MOD Single : A 14 C O2' : rot -28:sc= 0.305 USER MOD Single : A 14 C O3' : rot 180:sc= 0.25 USER MOD ----------------------------------------------------------------- ATOM 1 OP3 G A 1 -9.703 -5.392 11.189 1.00 10.00 O ATOM 2 P G A 1 -10.680 -4.221 10.742 1.00 10.00 P ATOM 3 OP1 G A 1 -9.887 -2.971 10.654 1.00 10.00 O ATOM 4 OP2 G A 1 -11.879 -4.263 11.610 1.00 10.00 O ATOM 5 O5' G A 1 -11.115 -4.640 9.270 1.00 10.00 O ATOM 6 C5' G A 1 -11.030 -5.991 8.829 1.00 10.00 C ATOM 7 C4' G A 1 -11.512 -6.104 7.400 1.00 10.00 C ATOM 8 O4' G A 1 -12.489 -5.053 7.125 1.00 10.00 O ATOM 9 C3' G A 1 -10.445 -5.930 6.323 1.00 10.00 C ATOM 10 O3' G A 1 -9.755 -7.153 6.054 1.00 10.00 O ATOM 11 C2' G A 1 -11.298 -5.506 5.136 1.00 10.00 C ATOM 12 O2' G A 1 -12.006 -6.601 4.591 1.00 10.00 O ATOM 13 C1' G A 1 -12.288 -4.563 5.811 1.00 10.00 C ATOM 14 N9 G A 1 -11.824 -3.179 5.846 1.00 10.00 N ATOM 15 C8 G A 1 -11.447 -2.437 6.939 1.00 10.00 C ATOM 16 N7 G A 1 -11.110 -1.212 6.641 1.00 10.00 N ATOM 17 C5 G A 1 -11.266 -1.138 5.264 1.00 10.00 C ATOM 18 C6 G A 1 -11.047 -0.054 4.365 1.00 10.00 C ATOM 19 O6 G A 1 -10.687 1.102 4.627 1.00 10.00 O ATOM 20 N1 G A 1 -11.323 -0.406 3.047 1.00 10.00 N ATOM 21 C2 G A 1 -11.760 -1.647 2.649 1.00 10.00 C ATOM 22 N2 G A 1 -11.964 -1.807 1.333 1.00 10.00 N ATOM 23 N3 G A 1 -11.971 -2.665 3.473 1.00 10.00 N ATOM 24 C4 G A 1 -11.704 -2.342 4.757 1.00 10.00 C ATOM 0 H5' G A 1 -11.631 -6.631 9.475 1.00 10.00 H new ATOM 0 H5'' G A 1 -10.000 -6.341 8.902 1.00 10.00 H new ATOM 0 H4' G A 1 -11.903 -7.120 7.343 1.00 10.00 H new ATOM 0 H3' G A 1 -9.655 -5.228 6.590 1.00 10.00 H new ATOM 0 H2' G A 1 -10.720 -5.080 4.316 1.00 10.00 H new ATOM 0 HO2' G A 1 -12.545 -6.296 3.832 1.00 10.00 H new ATOM 0 H1' G A 1 -13.216 -4.545 5.239 1.00 10.00 H new ATOM 0 H8 G A 1 -11.431 -2.829 7.945 1.00 10.00 H new ATOM 0 H1 G A 1 -11.192 0.305 2.328 1.00 10.00 H new ATOM 0 H21 G A 1 -12.288 -2.704 0.973 1.00 10.00 H new ATOM 0 H22 G A 1 -11.795 -1.031 0.693 1.00 10.00 H new ATOM 37 P G A 2 -8.196 -7.187 5.639 1.00 10.00 P ATOM 38 OP1 G A 2 -7.614 -8.423 6.213 1.00 10.00 O ATOM 39 OP2 G A 2 -7.593 -5.885 6.002 1.00 10.00 O ATOM 40 O5' G A 2 -8.165 -7.322 4.047 1.00 10.00 O ATOM 41 C5' G A 2 -9.211 -7.998 3.353 1.00 10.00 C ATOM 42 C4' G A 2 -9.379 -7.539 1.915 1.00 10.00 C ATOM 43 O4' G A 2 -10.115 -6.290 1.922 1.00 10.00 O ATOM 44 C3' G A 2 -8.124 -7.247 1.098 1.00 10.00 C ATOM 45 O3' G A 2 -7.687 -8.415 0.417 1.00 10.00 O ATOM 46 C2' G A 2 -8.598 -6.184 0.112 1.00 10.00 C ATOM 47 O2' G A 2 -9.304 -6.760 -0.973 1.00 10.00 O ATOM 48 C1' G A 2 -9.560 -5.383 0.991 1.00 10.00 C ATOM 49 N9 G A 2 -8.930 -4.310 1.756 1.00 10.00 N ATOM 50 C8 G A 2 -8.624 -4.338 3.095 1.00 10.00 C ATOM 51 N7 G A 2 -8.108 -3.223 3.529 1.00 10.00 N ATOM 52 C5 G A 2 -8.064 -2.404 2.411 1.00 10.00 C ATOM 53 C6 G A 2 -7.600 -1.071 2.270 1.00 10.00 C ATOM 54 O6 G A 2 -7.125 -0.323 3.139 1.00 10.00 O ATOM 55 N1 G A 2 -7.731 -0.612 0.963 1.00 10.00 N ATOM 56 C2 G A 2 -8.247 -1.353 -0.076 1.00 10.00 C ATOM 57 N2 G A 2 -8.287 -0.753 -1.274 1.00 10.00 N ATOM 58 N3 G A 2 -8.685 -2.597 0.042 1.00 10.00 N ATOM 59 C4 G A 2 -8.565 -3.059 1.304 1.00 10.00 C ATOM 0 H5' G A 2 -10.149 -7.845 3.887 1.00 10.00 H new ATOM 0 H5'' G A 2 -9.010 -9.069 3.363 1.00 10.00 H new ATOM 0 H4' G A 2 -9.863 -8.393 1.442 1.00 10.00 H new ATOM 0 H3' G A 2 -7.277 -6.922 1.703 1.00 10.00 H new ATOM 0 H2' G A 2 -7.789 -5.610 -0.339 1.00 10.00 H new ATOM 0 HO2' G A 2 -8.972 -7.668 -1.134 1.00 10.00 H new ATOM 0 H1' G A 2 -10.287 -4.914 0.329 1.00 10.00 H new ATOM 0 H8 G A 2 -8.794 -5.198 3.725 1.00 10.00 H new ATOM 0 H1 G A 2 -7.423 0.339 0.761 1.00 10.00 H new ATOM 0 H21 G A 2 -8.659 -1.252 -2.082 1.00 10.00 H new ATOM 0 H22 G A 2 -7.946 0.203 -1.377 1.00 10.00 H new ATOM 71 P C A 3 -6.145 -8.589 0.007 1.00 10.00 P ATOM 72 OP1 C A 3 -6.000 -9.963 -0.533 1.00 10.00 O ATOM 73 OP2 C A 3 -5.310 -8.171 1.159 1.00 10.00 O ATOM 74 O5' C A 3 -5.925 -7.548 -1.178 1.00 10.00 O ATOM 75 C5' C A 3 -6.228 -7.876 -2.532 1.00 10.00 C ATOM 76 C4' C A 3 -6.053 -6.665 -3.425 1.00 10.00 C ATOM 77 O4' C A 3 -6.573 -5.489 -2.750 1.00 10.00 O ATOM 78 C3' C A 3 -4.613 -6.316 -3.791 1.00 10.00 C ATOM 79 O3' C A 3 -4.234 -6.998 -4.990 1.00 10.00 O ATOM 80 C2' C A 3 -4.657 -4.806 -4.005 1.00 10.00 C ATOM 81 O2' C A 3 -4.990 -4.492 -5.344 1.00 10.00 O ATOM 82 C1' C A 3 -5.801 -4.353 -3.094 1.00 10.00 C ATOM 83 N1 C A 3 -5.369 -3.680 -1.855 1.00 10.00 N ATOM 84 C2 C A 3 -5.037 -2.323 -1.907 1.00 10.00 C ATOM 85 O2 C A 3 -5.003 -1.752 -3.007 1.00 10.00 O ATOM 86 N3 C A 3 -4.756 -1.662 -0.757 1.00 10.00 N ATOM 87 C4 C A 3 -4.800 -2.306 0.411 1.00 10.00 C ATOM 88 N4 C A 3 -4.562 -1.608 1.523 1.00 10.00 N ATOM 89 C5 C A 3 -5.120 -3.691 0.492 1.00 10.00 C ATOM 90 C6 C A 3 -5.389 -4.330 -0.653 1.00 10.00 C ATOM 0 H5' C A 3 -7.252 -8.242 -2.603 1.00 10.00 H new ATOM 0 H5'' C A 3 -5.577 -8.682 -2.871 1.00 10.00 H new ATOM 0 H4' C A 3 -6.581 -6.934 -4.340 1.00 10.00 H new ATOM 0 H3' C A 3 -3.887 -6.608 -3.033 1.00 10.00 H new ATOM 0 H2' C A 3 -3.699 -4.332 -3.793 1.00 10.00 H new ATOM 0 HO2' C A 3 -4.202 -4.612 -5.914 1.00 10.00 H new ATOM 0 H1' C A 3 -6.371 -3.614 -3.656 1.00 10.00 H new ATOM 0 H41 C A 3 -4.588 -2.071 2.431 1.00 10.00 H new ATOM 0 H42 C A 3 -4.354 -0.611 1.465 1.00 10.00 H new ATOM 0 H5 C A 3 -5.145 -4.206 1.441 1.00 10.00 H new ATOM 0 H6 C A 3 -5.627 -5.383 -0.626 1.00 10.00 H new ATOM 102 P A A 4 -2.759 -6.874 -5.619 1.00 10.00 P ATOM 103 OP1 A A 4 -2.676 -7.834 -6.746 1.00 10.00 O ATOM 104 OP2 A A 4 -1.773 -6.960 -4.519 1.00 10.00 O ATOM 105 O5' A A 4 -2.688 -5.407 -6.231 1.00 10.00 O ATOM 106 C5' A A 4 -2.207 -5.189 -7.554 1.00 10.00 C ATOM 107 C4' A A 4 -1.543 -3.835 -7.673 1.00 10.00 C ATOM 108 O4' A A 4 -2.109 -2.920 -6.692 1.00 10.00 O ATOM 109 C3' A A 4 -0.045 -3.798 -7.400 1.00 10.00 C ATOM 110 O3' A A 4 0.698 -4.126 -8.570 1.00 10.00 O ATOM 111 C2' A A 4 0.169 -2.350 -6.990 1.00 10.00 C ATOM 112 O2' A A 4 0.224 -1.509 -8.122 1.00 10.00 O ATOM 113 C1' A A 4 -1.094 -2.063 -6.187 1.00 10.00 C ATOM 114 N9 A A 4 -0.957 -2.307 -4.752 1.00 10.00 N ATOM 115 C8 A A 4 -1.229 -3.464 -4.064 1.00 10.00 C ATOM 116 N7 A A 4 -1.047 -3.369 -2.769 1.00 10.00 N ATOM 117 C5 A A 4 -0.624 -2.061 -2.592 1.00 10.00 C ATOM 118 C6 A A 4 -0.269 -1.337 -1.446 1.00 10.00 C ATOM 119 N6 A A 4 -0.284 -1.857 -0.216 1.00 10.00 N ATOM 120 N1 A A 4 0.110 -0.053 -1.605 1.00 10.00 N ATOM 121 C2 A A 4 0.123 0.461 -2.844 1.00 10.00 C ATOM 122 N3 A A 4 -0.188 -0.122 -4.003 1.00 10.00 N ATOM 123 C4 A A 4 -0.560 -1.397 -3.803 1.00 10.00 C ATOM 0 H5' A A 4 -3.034 -5.256 -8.261 1.00 10.00 H new ATOM 0 H5'' A A 4 -1.496 -5.971 -7.820 1.00 10.00 H new ATOM 0 H4' A A 4 -1.717 -3.564 -8.714 1.00 10.00 H new ATOM 0 H3' A A 4 0.285 -4.515 -6.649 1.00 10.00 H new ATOM 0 H2' A A 4 1.098 -2.182 -6.446 1.00 10.00 H new ATOM 0 HO2' A A 4 1.075 -1.022 -8.127 1.00 10.00 H new ATOM 0 H1' A A 4 -1.324 -1.003 -6.297 1.00 10.00 H new ATOM 0 H8 A A 4 -1.563 -4.371 -4.546 1.00 10.00 H new ATOM 0 H61 A A 4 -0.015 -1.283 0.584 1.00 10.00 H new ATOM 0 H62 A A 4 -0.564 -2.828 -0.076 1.00 10.00 H new ATOM 0 H2 A A 4 0.429 1.494 -2.913 1.00 10.00 H new ATOM 135 P C A 5 2.208 -4.647 -8.425 1.00 10.00 P ATOM 136 OP1 C A 5 2.760 -4.822 -9.788 1.00 10.00 O ATOM 137 OP2 C A 5 2.219 -5.782 -7.474 1.00 10.00 O ATOM 138 O5' C A 5 2.959 -3.425 -7.742 1.00 10.00 O ATOM 139 C5' C A 5 3.677 -2.480 -8.523 1.00 10.00 C ATOM 140 C4' C A 5 3.858 -1.199 -7.752 1.00 10.00 C ATOM 141 O4' C A 5 2.802 -1.084 -6.767 1.00 10.00 O ATOM 142 C3' C A 5 5.124 -1.111 -6.920 1.00 10.00 C ATOM 143 O3' C A 5 6.238 -0.705 -7.709 1.00 10.00 O ATOM 144 C2' C A 5 4.744 -0.062 -5.885 1.00 10.00 C ATOM 145 O2' C A 5 4.776 1.245 -6.426 1.00 10.00 O ATOM 146 C1' C A 5 3.294 -0.463 -5.595 1.00 10.00 C ATOM 147 N1 C A 5 3.163 -1.372 -4.437 1.00 10.00 N ATOM 148 C2 C A 5 3.403 -0.854 -3.160 1.00 10.00 C ATOM 149 O2 C A 5 3.715 0.340 -3.046 1.00 10.00 O ATOM 150 N3 C A 5 3.274 -1.656 -2.080 1.00 10.00 N ATOM 151 C4 C A 5 2.912 -2.930 -2.235 1.00 10.00 C ATOM 152 N4 C A 5 2.782 -3.682 -1.141 1.00 10.00 N ATOM 153 C5 C A 5 2.657 -3.487 -3.521 1.00 10.00 C ATOM 154 C6 C A 5 2.801 -2.684 -4.583 1.00 10.00 C ATOM 0 H5' C A 5 3.141 -2.282 -9.451 1.00 10.00 H new ATOM 0 H5'' C A 5 4.650 -2.888 -8.798 1.00 10.00 H new ATOM 0 H4' C A 5 3.874 -0.430 -8.524 1.00 10.00 H new ATOM 0 H3' C A 5 5.436 -2.059 -6.483 1.00 10.00 H new ATOM 0 H2' C A 5 5.410 -0.035 -5.022 1.00 10.00 H new ATOM 0 HO2' C A 5 5.297 1.243 -7.256 1.00 10.00 H new ATOM 0 H1' C A 5 2.721 0.426 -5.332 1.00 10.00 H new ATOM 0 H41 C A 5 2.506 -4.661 -1.225 1.00 10.00 H new ATOM 0 H42 C A 5 2.958 -3.278 -0.221 1.00 10.00 H new ATOM 0 H5 C A 5 2.359 -4.519 -3.635 1.00 10.00 H new ATOM 0 H6 C A 5 2.628 -3.079 -5.573 1.00 10.00 H new ATOM 166 P U A 6 7.605 -1.546 -7.645 1.00 10.00 P ATOM 167 OP1 U A 6 8.574 -0.959 -8.600 1.00 10.00 O ATOM 168 OP2 U A 6 7.253 -2.978 -7.761 1.00 10.00 O ATOM 169 O5' U A 6 8.141 -1.281 -6.172 1.00 10.00 O ATOM 170 C5' U A 6 8.993 -0.175 -5.902 1.00 10.00 C ATOM 171 C4' U A 6 9.221 -0.039 -4.418 1.00 10.00 C ATOM 172 O4' U A 6 7.974 -0.256 -3.707 1.00 10.00 O ATOM 173 C3' U A 6 10.163 -1.057 -3.802 1.00 10.00 C ATOM 174 O3' U A 6 11.520 -0.697 -4.034 1.00 10.00 O ATOM 175 C2' U A 6 9.782 -0.960 -2.329 1.00 10.00 C ATOM 176 O2' U A 6 10.339 0.194 -1.729 1.00 10.00 O ATOM 177 C1' U A 6 8.260 -0.802 -2.428 1.00 10.00 C ATOM 178 N1 U A 6 7.520 -2.066 -2.273 1.00 10.00 N ATOM 179 C2 U A 6 7.369 -2.575 -0.994 1.00 10.00 C ATOM 180 O2 U A 6 7.809 -2.020 -0.005 1.00 10.00 O ATOM 181 N3 U A 6 6.681 -3.761 -0.911 1.00 10.00 N ATOM 182 C4 U A 6 6.135 -4.477 -1.955 1.00 10.00 C ATOM 183 O4 U A 6 5.529 -5.527 -1.727 1.00 10.00 O ATOM 184 C5 U A 6 6.333 -3.889 -3.242 1.00 10.00 C ATOM 185 C6 U A 6 6.997 -2.735 -3.361 1.00 10.00 C ATOM 0 H5' U A 6 8.548 0.740 -6.294 1.00 10.00 H new ATOM 0 H5'' U A 6 9.947 -0.309 -6.412 1.00 10.00 H new ATOM 0 H4' U A 6 9.648 0.959 -4.321 1.00 10.00 H new ATOM 0 H3' U A 6 10.078 -2.065 -4.208 1.00 10.00 H new ATOM 0 H2' U A 6 10.126 -1.803 -1.731 1.00 10.00 H new ATOM 0 HO2' U A 6 10.189 0.164 -0.761 1.00 10.00 H new ATOM 0 H1' U A 6 7.937 -0.157 -1.611 1.00 10.00 H new ATOM 0 H3 U A 6 6.561 -4.154 0.023 1.00 10.00 H new ATOM 0 H5 U A 6 5.944 -4.379 -4.123 1.00 10.00 H new ATOM 0 H6 U A 6 7.129 -2.310 -4.345 1.00 10.00 H new ATOM 196 P U A 7 12.701 -1.753 -3.788 1.00 10.00 P ATOM 197 OP1 U A 7 13.801 -1.435 -4.729 1.00 10.00 O ATOM 198 OP2 U A 7 12.114 -3.115 -3.802 1.00 10.00 O ATOM 199 O5' U A 7 13.194 -1.442 -2.307 1.00 10.00 O ATOM 200 C5' U A 7 14.485 -1.844 -1.857 1.00 10.00 C ATOM 201 C4' U A 7 15.035 -0.818 -0.899 1.00 10.00 C ATOM 202 O4' U A 7 15.105 0.455 -1.596 1.00 10.00 O ATOM 203 C3' U A 7 14.196 -0.573 0.354 1.00 10.00 C ATOM 204 O3' U A 7 15.007 -0.526 1.522 1.00 10.00 O ATOM 205 C2' U A 7 13.525 0.775 0.117 1.00 10.00 C ATOM 206 O2' U A 7 13.404 1.505 1.321 1.00 10.00 O ATOM 207 C1' U A 7 14.546 1.465 -0.783 1.00 10.00 C ATOM 208 N1 U A 7 13.960 2.502 -1.645 1.00 10.00 N ATOM 209 C2 U A 7 14.344 3.818 -1.452 1.00 10.00 C ATOM 210 O2 U A 7 15.196 4.154 -0.648 1.00 10.00 O ATOM 211 N3 U A 7 13.706 4.733 -2.254 1.00 10.00 N ATOM 212 C4 U A 7 12.751 4.475 -3.216 1.00 10.00 C ATOM 213 O4 U A 7 12.256 5.410 -3.848 1.00 10.00 O ATOM 214 C5 U A 7 12.415 3.095 -3.359 1.00 10.00 C ATOM 215 C6 U A 7 13.014 2.176 -2.595 1.00 10.00 C ATOM 0 H5' U A 7 15.157 -1.958 -2.707 1.00 10.00 H new ATOM 0 H5'' U A 7 14.423 -2.816 -1.367 1.00 10.00 H new ATOM 0 H4' U A 7 15.997 -1.213 -0.571 1.00 10.00 H new ATOM 0 H3' U A 7 13.476 -1.375 0.518 1.00 10.00 H new ATOM 0 H2' U A 7 12.519 0.692 -0.294 1.00 10.00 H new ATOM 0 HO2' U A 7 12.509 1.369 1.697 1.00 10.00 H new ATOM 0 H1' U A 7 15.281 1.971 -0.157 1.00 10.00 H new ATOM 0 H3 U A 7 13.967 5.710 -2.124 1.00 10.00 H new ATOM 0 H5 U A 7 11.675 2.793 -4.086 1.00 10.00 H new ATOM 0 H6 U A 7 12.747 1.138 -2.727 1.00 10.00 H new ATOM 226 P C A 8 15.152 -1.819 2.460 1.00 10.00 P ATOM 227 OP1 C A 8 15.815 -1.393 3.716 1.00 10.00 O ATOM 228 OP2 C A 8 15.769 -2.889 1.642 1.00 10.00 O ATOM 229 O5' C A 8 13.656 -2.248 2.793 1.00 10.00 O ATOM 230 C5' C A 8 13.016 -1.858 4.007 1.00 10.00 C ATOM 231 C4' C A 8 11.889 -2.812 4.331 1.00 10.00 C ATOM 232 O4' C A 8 11.039 -2.933 3.160 1.00 10.00 O ATOM 233 C3' C A 8 12.310 -4.237 4.688 1.00 10.00 C ATOM 234 O3' C A 8 11.558 -4.745 5.782 1.00 10.00 O ATOM 235 C2' C A 8 12.021 -5.040 3.425 1.00 10.00 C ATOM 236 O2' C A 8 11.671 -6.378 3.729 1.00 10.00 O ATOM 237 C1' C A 8 10.803 -4.297 2.888 1.00 10.00 C ATOM 238 N1 C A 8 10.615 -4.439 1.436 1.00 10.00 N ATOM 239 C2 C A 8 9.559 -5.198 0.927 1.00 10.00 C ATOM 240 O2 C A 8 8.777 -5.757 1.708 1.00 10.00 O ATOM 241 N3 C A 8 9.417 -5.311 -0.415 1.00 10.00 N ATOM 242 C4 C A 8 10.286 -4.702 -1.228 1.00 10.00 C ATOM 243 N4 C A 8 10.109 -4.799 -2.539 1.00 10.00 N ATOM 244 C5 C A 8 11.367 -3.935 -0.736 1.00 10.00 C ATOM 245 C6 C A 8 11.491 -3.824 0.587 1.00 10.00 C ATOM 0 H5' C A 8 12.628 -0.844 3.913 1.00 10.00 H new ATOM 0 H5'' C A 8 13.740 -1.848 4.822 1.00 10.00 H new ATOM 0 H4' C A 8 11.404 -2.383 5.208 1.00 10.00 H new ATOM 0 H3' C A 8 13.355 -4.288 4.995 1.00 10.00 H new ATOM 0 H2' C A 8 12.868 -5.108 2.742 1.00 10.00 H new ATOM 0 HO2' C A 8 11.354 -6.431 4.655 1.00 10.00 H new ATOM 0 H1' C A 8 9.909 -4.705 3.359 1.00 10.00 H new ATOM 0 H41 C A 8 10.761 -4.342 -3.177 1.00 10.00 H new ATOM 0 H42 C A 8 9.321 -5.331 -2.909 1.00 10.00 H new ATOM 0 H5 C A 8 12.066 -3.457 -1.406 1.00 10.00 H new ATOM 0 H6 C A 8 12.300 -3.236 0.995 1.00 10.00 H new ATOM 257 P G A 9 12.124 -4.638 7.280 1.00 10.00 P ATOM 258 OP1 G A 9 13.602 -4.774 7.244 1.00 10.00 O ATOM 259 OP2 G A 9 11.335 -5.579 8.103 1.00 10.00 O ATOM 260 O5' G A 9 11.767 -3.154 7.730 1.00 10.00 O ATOM 261 C5' G A 9 10.410 -2.728 7.859 1.00 10.00 C ATOM 262 C4' G A 9 10.367 -1.223 7.978 1.00 10.00 C ATOM 263 O4' G A 9 11.212 -0.644 6.957 1.00 10.00 O ATOM 264 C3' G A 9 9.019 -0.556 7.747 1.00 10.00 C ATOM 265 O3' G A 9 8.202 -0.610 8.909 1.00 10.00 O ATOM 266 C2' G A 9 9.437 0.878 7.442 1.00 10.00 C ATOM 267 O2' G A 9 9.647 1.603 8.638 1.00 10.00 O ATOM 268 C1' G A 9 10.767 0.675 6.715 1.00 10.00 C ATOM 269 N9 G A 9 10.679 0.892 5.274 1.00 10.00 N ATOM 270 C8 G A 9 11.326 1.884 4.585 1.00 10.00 C ATOM 271 N7 G A 9 11.102 1.859 3.301 1.00 10.00 N ATOM 272 C5 G A 9 10.247 0.780 3.128 1.00 10.00 C ATOM 273 C6 G A 9 9.664 0.260 1.944 1.00 10.00 C ATOM 274 O6 G A 9 9.787 0.666 0.779 1.00 10.00 O ATOM 275 N1 G A 9 8.865 -0.848 2.197 1.00 10.00 N ATOM 276 C2 G A 9 8.647 -1.382 3.449 1.00 10.00 C ATOM 277 N2 G A 9 7.820 -2.443 3.508 1.00 10.00 N ATOM 278 N3 G A 9 9.184 -0.907 4.567 1.00 10.00 N ATOM 279 C4 G A 9 9.972 0.168 4.335 1.00 10.00 C ATOM 0 H5' G A 9 9.955 -3.187 8.737 1.00 10.00 H new ATOM 0 H5'' G A 9 9.831 -3.052 6.994 1.00 10.00 H new ATOM 0 H4' G A 9 10.668 -1.049 9.011 1.00 10.00 H new ATOM 0 H3' G A 9 8.424 -1.028 6.965 1.00 10.00 H new ATOM 0 H2' G A 9 8.695 1.438 6.873 1.00 10.00 H new ATOM 0 HO2' G A 9 9.204 1.143 9.381 1.00 10.00 H new ATOM 0 H1' G A 9 11.466 1.416 7.102 1.00 10.00 H new ATOM 0 H8 G A 9 11.961 2.617 5.060 1.00 10.00 H new ATOM 0 H1 G A 9 8.409 -1.297 1.403 1.00 10.00 H new ATOM 0 H21 G A 9 7.618 -2.883 4.406 1.00 10.00 H new ATOM 0 H22 G A 9 7.395 -2.806 2.655 1.00 10.00 H new ATOM 291 P G A 10 6.606 -0.558 8.759 1.00 10.00 P ATOM 292 OP1 G A 10 6.045 0.031 9.996 1.00 10.00 O ATOM 293 OP2 G A 10 6.165 -1.907 8.337 1.00 10.00 O ATOM 294 O5' G A 10 6.338 0.455 7.561 1.00 10.00 O ATOM 295 C5' G A 10 6.170 1.846 7.815 1.00 10.00 C ATOM 296 C4' G A 10 6.260 2.669 6.548 1.00 10.00 C ATOM 297 O4' G A 10 6.871 1.867 5.502 1.00 10.00 O ATOM 298 C3' G A 10 4.943 3.121 5.930 1.00 10.00 C ATOM 299 O3' G A 10 4.524 4.336 6.541 1.00 10.00 O ATOM 300 C2' G A 10 5.342 3.334 4.475 1.00 10.00 C ATOM 301 O2' G A 10 6.122 4.504 4.334 1.00 10.00 O ATOM 302 C1' G A 10 6.216 2.100 4.268 1.00 10.00 C ATOM 303 N9 G A 10 5.454 0.906 3.926 1.00 10.00 N ATOM 304 C8 G A 10 4.981 -0.038 4.797 1.00 10.00 C ATOM 305 N7 G A 10 4.336 -1.011 4.208 1.00 10.00 N ATOM 306 C5 G A 10 4.376 -0.674 2.858 1.00 10.00 C ATOM 307 C6 G A 10 3.842 -1.339 1.717 1.00 10.00 C ATOM 308 O6 G A 10 3.195 -2.398 1.670 1.00 10.00 O ATOM 309 N1 G A 10 4.112 -0.649 0.538 1.00 10.00 N ATOM 310 C2 G A 10 4.808 0.537 0.472 1.00 10.00 C ATOM 311 N2 G A 10 4.977 1.070 -0.746 1.00 10.00 N ATOM 312 N3 G A 10 5.307 1.165 1.521 1.00 10.00 N ATOM 313 C4 G A 10 5.058 0.511 2.672 1.00 10.00 C ATOM 0 H5' G A 10 6.932 2.180 8.519 1.00 10.00 H new ATOM 0 H5'' G A 10 5.203 2.014 8.288 1.00 10.00 H new ATOM 0 H4' G A 10 6.816 3.551 6.866 1.00 10.00 H new ATOM 0 H3' G A 10 4.112 2.425 6.050 1.00 10.00 H new ATOM 0 H2' G A 10 4.510 3.450 3.781 1.00 10.00 H new ATOM 0 HO2' G A 10 6.028 5.058 5.137 1.00 10.00 H new ATOM 0 H1' G A 10 6.897 2.289 3.438 1.00 10.00 H new ATOM 0 H8 G A 10 5.126 0.016 5.866 1.00 10.00 H new ATOM 0 H1 G A 10 3.771 -1.049 -0.336 1.00 10.00 H new ATOM 0 H21 G A 10 5.485 1.948 -0.852 1.00 10.00 H new ATOM 0 H22 G A 10 4.597 0.598 -1.566 1.00 10.00 H new ATOM 325 P U A 11 3.050 4.919 6.296 1.00 10.00 P ATOM 326 OP1 U A 11 2.990 6.253 6.928 1.00 10.00 O ATOM 327 OP2 U A 11 2.086 3.875 6.722 1.00 10.00 O ATOM 328 O5' U A 11 2.945 5.098 4.718 1.00 10.00 O ATOM 329 C5' U A 11 3.311 6.320 4.080 1.00 10.00 C ATOM 330 C4' U A 11 3.042 6.245 2.594 1.00 10.00 C ATOM 331 O4' U A 11 3.327 4.906 2.107 1.00 10.00 O ATOM 332 C3' U A 11 1.599 6.503 2.188 1.00 10.00 C ATOM 333 O3' U A 11 1.382 7.898 1.992 1.00 10.00 O ATOM 334 C2' U A 11 1.451 5.734 0.879 1.00 10.00 C ATOM 335 O2' U A 11 1.870 6.519 -0.222 1.00 10.00 O ATOM 336 C1' U A 11 2.417 4.564 1.076 1.00 10.00 C ATOM 337 N1 U A 11 1.755 3.297 1.425 1.00 10.00 N ATOM 338 C2 U A 11 1.277 2.515 0.387 1.00 10.00 C ATOM 339 O2 U A 11 1.328 2.862 -0.782 1.00 10.00 O ATOM 340 N3 U A 11 0.741 1.309 0.767 1.00 10.00 N ATOM 341 C4 U A 11 0.639 0.810 2.046 1.00 10.00 C ATOM 342 O4 U A 11 0.147 -0.305 2.227 1.00 10.00 O ATOM 343 C5 U A 11 1.146 1.677 3.057 1.00 10.00 C ATOM 344 C6 U A 11 1.667 2.860 2.729 1.00 10.00 C ATOM 0 H5' U A 11 4.367 6.525 4.254 1.00 10.00 H new ATOM 0 H5'' U A 11 2.750 7.147 4.516 1.00 10.00 H new ATOM 0 H4' U A 11 3.678 7.023 2.172 1.00 10.00 H new ATOM 0 H3' U A 11 0.876 6.188 2.941 1.00 10.00 H new ATOM 0 H2' U A 11 0.423 5.439 0.669 1.00 10.00 H new ATOM 0 HO2' U A 11 1.950 7.455 0.056 1.00 10.00 H new ATOM 0 H1' U A 11 2.918 4.399 0.122 1.00 10.00 H new ATOM 0 H3 U A 11 0.378 0.718 0.019 1.00 10.00 H new ATOM 0 H5 U A 11 1.108 1.375 4.093 1.00 10.00 H new ATOM 0 H6 U A 11 2.035 3.501 3.517 1.00 10.00 H new ATOM 355 P G A 12 -0.091 8.521 2.118 1.00 10.00 P ATOM 356 OP1 G A 12 0.026 9.992 1.979 1.00 10.00 O ATOM 357 OP2 G A 12 -0.724 7.958 3.333 1.00 10.00 O ATOM 358 O5' G A 12 -0.864 7.959 0.846 1.00 10.00 O ATOM 359 C5' G A 12 -1.177 8.810 -0.252 1.00 10.00 C ATOM 360 C4' G A 12 -1.741 8.015 -1.403 1.00 10.00 C ATOM 361 O4' G A 12 -1.207 6.667 -1.362 1.00 10.00 O ATOM 362 C3' G A 12 -3.252 7.833 -1.390 1.00 10.00 C ATOM 363 O3' G A 12 -3.912 8.916 -2.038 1.00 10.00 O ATOM 364 C2' G A 12 -3.449 6.534 -2.164 1.00 10.00 C ATOM 365 O2' G A 12 -3.480 6.760 -3.561 1.00 10.00 O ATOM 366 C1' G A 12 -2.188 5.747 -1.798 1.00 10.00 C ATOM 367 N9 G A 12 -2.417 4.775 -0.734 1.00 10.00 N ATOM 368 C8 G A 12 -2.252 4.959 0.617 1.00 10.00 C ATOM 369 N7 G A 12 -2.570 3.907 1.322 1.00 10.00 N ATOM 370 C5 G A 12 -2.971 2.970 0.378 1.00 10.00 C ATOM 371 C6 G A 12 -3.429 1.634 0.542 1.00 10.00 C ATOM 372 O6 G A 12 -3.569 0.993 1.595 1.00 10.00 O ATOM 373 N1 G A 12 -3.732 1.035 -0.679 1.00 10.00 N ATOM 374 C2 G A 12 -3.606 1.658 -1.901 1.00 10.00 C ATOM 375 N2 G A 12 -3.953 0.940 -2.975 1.00 10.00 N ATOM 376 N3 G A 12 -3.182 2.900 -2.068 1.00 10.00 N ATOM 377 C4 G A 12 -2.882 3.492 -0.894 1.00 10.00 C ATOM 0 H5' G A 12 -0.280 9.339 -0.575 1.00 10.00 H new ATOM 0 H5'' G A 12 -1.898 9.565 0.062 1.00 10.00 H new ATOM 0 H4' G A 12 -1.464 8.591 -2.286 1.00 10.00 H new ATOM 0 H3' G A 12 -3.667 7.804 -0.383 1.00 10.00 H new ATOM 0 H2' G A 12 -4.386 6.033 -1.922 1.00 10.00 H new ATOM 0 HO2' G A 12 -3.615 7.715 -3.735 1.00 10.00 H new ATOM 0 H1' G A 12 -1.870 5.195 -2.682 1.00 10.00 H new ATOM 0 H8 G A 12 -1.895 5.881 1.052 1.00 10.00 H new ATOM 0 H1 G A 12 -4.069 0.072 -0.667 1.00 10.00 H new ATOM 0 H21 G A 12 -3.881 1.349 -3.907 1.00 10.00 H new ATOM 0 H22 G A 12 -4.290 -0.016 -2.862 1.00 10.00 H new ATOM 389 P C A 13 -5.393 9.333 -1.584 1.00 10.00 P ATOM 390 OP1 C A 13 -5.823 10.495 -2.396 1.00 10.00 O ATOM 391 OP2 C A 13 -5.391 9.448 -0.108 1.00 10.00 O ATOM 392 O5' C A 13 -6.291 8.084 -1.988 1.00 10.00 O ATOM 393 C5' C A 13 -7.046 8.095 -3.196 1.00 10.00 C ATOM 394 C4' C A 13 -7.497 6.700 -3.558 1.00 10.00 C ATOM 395 O4' C A 13 -6.583 5.728 -2.993 1.00 10.00 O ATOM 396 C3' C A 13 -8.851 6.280 -3.002 1.00 10.00 C ATOM 397 O3' C A 13 -9.922 6.786 -3.801 1.00 10.00 O ATOM 398 C2' C A 13 -8.762 4.761 -3.081 1.00 10.00 C ATOM 399 O2' C A 13 -9.070 4.300 -4.381 1.00 10.00 O ATOM 400 C1' C A 13 -7.280 4.514 -2.773 1.00 10.00 C ATOM 401 N1 C A 13 -7.046 4.061 -1.389 1.00 10.00 N ATOM 402 C2 C A 13 -7.286 2.716 -1.074 1.00 10.00 C ATOM 403 O2 C A 13 -7.668 1.948 -1.968 1.00 10.00 O ATOM 404 N3 C A 13 -7.098 2.285 0.196 1.00 10.00 N ATOM 405 C4 C A 13 -6.681 3.138 1.135 1.00 10.00 C ATOM 406 N4 C A 13 -6.529 2.677 2.380 1.00 10.00 N ATOM 407 C5 C A 13 -6.425 4.509 0.844 1.00 10.00 C ATOM 408 C6 C A 13 -6.620 4.925 -0.414 1.00 10.00 C ATOM 0 H5' C A 13 -6.442 8.508 -4.004 1.00 10.00 H new ATOM 0 H5'' C A 13 -7.914 8.745 -3.082 1.00 10.00 H new ATOM 0 H4' C A 13 -7.541 6.725 -4.647 1.00 10.00 H new ATOM 0 H3' C A 13 -9.054 6.657 -2.000 1.00 10.00 H new ATOM 0 H2' C A 13 -9.454 4.250 -2.412 1.00 10.00 H new ATOM 0 HO2' C A 13 -9.506 5.017 -4.888 1.00 10.00 H new ATOM 0 H1' C A 13 -6.926 3.717 -3.426 1.00 10.00 H new ATOM 0 H41 C A 13 -6.212 3.303 3.120 1.00 10.00 H new ATOM 0 H42 C A 13 -6.730 1.699 2.590 1.00 10.00 H new ATOM 0 H5 C A 13 -6.086 5.189 1.611 1.00 10.00 H new ATOM 0 H6 C A 13 -6.438 5.960 -0.665 1.00 10.00 H new ATOM 420 P C A 14 -11.322 7.222 -3.140 1.00 10.00 P ATOM 421 OP1 C A 14 -11.975 8.210 -4.032 1.00 10.00 O ATOM 422 OP2 C A 14 -11.075 7.587 -1.726 1.00 10.00 O ATOM 423 O5' C A 14 -12.201 5.895 -3.153 1.00 10.00 O ATOM 424 C5' C A 14 -12.507 5.229 -4.375 1.00 10.00 C ATOM 425 C4' C A 14 -12.838 3.779 -4.105 1.00 10.00 C ATOM 426 O4' C A 14 -11.770 3.195 -3.323 1.00 10.00 O ATOM 427 C3' C A 14 -14.096 3.537 -3.281 1.00 10.00 C ATOM 428 O3' C A 14 -15.252 3.403 -4.118 1.00 10.00 O ATOM 429 C2' C A 14 -13.814 2.228 -2.551 1.00 10.00 C ATOM 430 O2' C A 14 -14.290 1.132 -3.304 1.00 10.00 O ATOM 431 C1' C A 14 -12.284 2.186 -2.477 1.00 10.00 C ATOM 432 N1 C A 14 -11.752 2.412 -1.124 1.00 10.00 N ATOM 433 C2 C A 14 -11.521 1.318 -0.288 1.00 10.00 C ATOM 434 O2 C A 14 -11.843 0.186 -0.675 1.00 10.00 O ATOM 435 N3 C A 14 -10.982 1.526 0.939 1.00 10.00 N ATOM 436 C4 C A 14 -10.678 2.766 1.337 1.00 10.00 C ATOM 437 N4 C A 14 -10.172 2.933 2.560 1.00 10.00 N ATOM 438 C5 C A 14 -10.909 3.896 0.506 1.00 10.00 C ATOM 439 C6 C A 14 -11.441 3.674 -0.699 1.00 10.00 C ATOM 0 H5' C A 14 -11.660 5.296 -5.057 1.00 10.00 H new ATOM 0 H5'' C A 14 -13.350 5.718 -4.864 1.00 10.00 H new ATOM 0 H4' C A 14 -12.982 3.344 -5.094 1.00 10.00 H new ATOM 0 H3' C A 14 -14.310 4.366 -2.606 1.00 10.00 H new ATOM 0 H2' C A 14 -14.297 2.172 -1.575 1.00 10.00 H new ATOM 0 HO2' C A 14 -15.050 1.418 -3.853 1.00 10.00 H new ATOM 0 HO3' C A 14 -16.043 3.247 -3.561 1.00 10.00 H new ATOM 0 H1' C A 14 -11.978 1.185 -2.782 1.00 10.00 H new ATOM 0 H41 C A 14 -9.931 3.868 2.889 1.00 10.00 H new ATOM 0 H42 C A 14 -10.026 2.126 3.166 1.00 10.00 H new ATOM 0 H5 C A 14 -10.664 4.895 0.836 1.00 10.00 H new ATOM 0 H6 C A 14 -11.630 4.512 -1.354 1.00 10.00 H new TER 452 C A 14