USER MOD reduce.3.24.130724 H: found=0, std=0, add=172, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 172 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 42 G O2' : rot -2:sc= -0.639 USER MOD Single : A 42 G O5' : rot 180:sc= 0 USER MOD Single : A 43 A O2' : rot 180:sc= -0.369 USER MOD Single : A 44 U O2' : rot 180:sc= -0.136 USER MOD Single : A 45 C O2' : rot -5:sc= -0.547 USER MOD Single : A 46 U O2' : rot -12:sc= 0.088 USER MOD Single : A 47 C O2' : rot -127:sc= -2.56! USER MOD Single : A 48 U O2' : rot -112:sc= -6.4! USER MOD Single : A 49 U O2' : rot -49:sc= 0.563 USER MOD Single : A 50 G O2' : rot -5:sc= -4.88! USER MOD Single : A 51 U O2' : rot 180:sc= -4.13! USER MOD Single : A 52 A O2' : rot -5:sc= -0.38 USER MOD Single : A 53 G O2' : rot 180:sc= -0.354 USER MOD Single : A 54 A O2' : rot 0:sc= -1.94! USER MOD Single : A 55 U O2' : rot -3:sc= -0.78 USER MOD Single : A 56 C O2' : rot 180:sc= -2.68! USER MOD Single : A 57 A O2' : rot 180:sc= 0 USER MOD Single : A 57 A O3' : rot 129:sc= 0.239 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 42 6.360 -4.236 9.294 1.00 0.00 O ATOM 2 C5' G A 42 7.240 -3.755 10.313 1.00 0.00 C ATOM 3 C4' G A 42 8.100 -2.605 9.808 1.00 0.00 C ATOM 4 O4' G A 42 9.019 -3.046 8.811 1.00 0.00 O ATOM 5 C3' G A 42 7.320 -1.465 9.183 1.00 0.00 C ATOM 6 O3' G A 42 6.821 -0.585 10.194 1.00 0.00 O ATOM 7 C2' G A 42 8.389 -0.791 8.359 1.00 0.00 C ATOM 8 O2' G A 42 9.206 0.071 9.160 1.00 0.00 O ATOM 9 C1' G A 42 9.175 -1.990 7.847 1.00 0.00 C ATOM 10 N9 G A 42 8.699 -2.513 6.558 1.00 0.00 N ATOM 11 C8 G A 42 7.872 -3.578 6.333 1.00 0.00 C ATOM 12 N7 G A 42 7.639 -3.810 5.073 1.00 0.00 N ATOM 13 C5 G A 42 8.364 -2.824 4.412 1.00 0.00 C ATOM 14 C6 G A 42 8.493 -2.572 3.020 1.00 0.00 C ATOM 15 O6 G A 42 7.986 -3.194 2.090 1.00 0.00 O ATOM 16 N1 G A 42 9.315 -1.476 2.771 1.00 0.00 N ATOM 17 C2 G A 42 9.939 -0.721 3.748 1.00 0.00 C ATOM 18 N2 G A 42 10.694 0.294 3.326 1.00 0.00 N ATOM 19 N3 G A 42 9.818 -0.962 5.058 1.00 0.00 N ATOM 20 C4 G A 42 9.018 -2.023 5.314 1.00 0.00 C ATOM 0 H5' G A 42 7.881 -4.567 10.655 1.00 0.00 H new ATOM 0 H5'' G A 42 6.657 -3.425 11.173 1.00 0.00 H new ATOM 0 H4' G A 42 8.601 -2.245 10.706 1.00 0.00 H new ATOM 0 H3' G A 42 6.446 -1.775 8.610 1.00 0.00 H new ATOM 0 H2' G A 42 8.002 -0.144 7.572 1.00 0.00 H new ATOM 0 HO2' G A 42 8.874 0.072 10.082 1.00 0.00 H new ATOM 0 HO5' G A 42 5.822 -4.975 9.648 1.00 0.00 H new ATOM 0 H1' G A 42 10.205 -1.662 7.706 1.00 0.00 H new ATOM 0 H8 G A 42 7.450 -4.174 7.129 1.00 0.00 H new ATOM 0 H1 G A 42 9.468 -1.211 1.798 1.00 0.00 H new ATOM 0 H21 G A 42 11.178 0.885 4.002 1.00 0.00 H new ATOM 0 H22 G A 42 10.787 0.479 2.327 1.00 0.00 H new ATOM 33 P A A 43 5.491 0.291 9.944 1.00 0.00 P ATOM 34 OP1 A A 43 5.167 1.008 11.198 1.00 0.00 O ATOM 35 OP2 A A 43 4.476 -0.580 9.310 1.00 0.00 O ATOM 36 O5' A A 43 5.975 1.375 8.855 1.00 0.00 O ATOM 37 C5' A A 43 6.967 2.345 9.190 1.00 0.00 C ATOM 38 C4' A A 43 7.380 3.179 7.979 1.00 0.00 C ATOM 39 O4' A A 43 8.031 2.361 6.997 1.00 0.00 O ATOM 40 C3' A A 43 6.234 3.848 7.240 1.00 0.00 C ATOM 41 O3' A A 43 5.849 5.057 7.910 1.00 0.00 O ATOM 42 C2' A A 43 6.875 4.138 5.903 1.00 0.00 C ATOM 43 O2' A A 43 7.692 5.314 5.951 1.00 0.00 O ATOM 44 C1' A A 43 7.710 2.882 5.689 1.00 0.00 C ATOM 45 N9 A A 43 6.997 1.829 4.935 1.00 0.00 N ATOM 46 C8 A A 43 6.301 0.745 5.407 1.00 0.00 C ATOM 47 N7 A A 43 5.761 0.014 4.470 1.00 0.00 N ATOM 48 C5 A A 43 6.125 0.660 3.293 1.00 0.00 C ATOM 49 C6 A A 43 5.864 0.390 1.938 1.00 0.00 C ATOM 50 N6 A A 43 5.146 -0.656 1.519 1.00 0.00 N ATOM 51 N1 A A 43 6.374 1.241 1.036 1.00 0.00 N ATOM 52 C2 A A 43 7.092 2.277 1.450 1.00 0.00 C ATOM 53 N3 A A 43 7.406 2.635 2.683 1.00 0.00 N ATOM 54 C4 A A 43 6.879 1.766 3.569 1.00 0.00 C ATOM 0 H5' A A 43 7.843 1.842 9.600 1.00 0.00 H new ATOM 0 H5'' A A 43 6.583 3.003 9.970 1.00 0.00 H new ATOM 0 H4' A A 43 8.027 3.945 8.407 1.00 0.00 H new ATOM 0 H3' A A 43 5.323 3.254 7.171 1.00 0.00 H new ATOM 0 H2' A A 43 6.162 4.339 5.104 1.00 0.00 H new ATOM 0 HO2' A A 43 8.092 5.471 5.070 1.00 0.00 H new ATOM 0 H1' A A 43 8.590 3.153 5.105 1.00 0.00 H new ATOM 0 H8 A A 43 6.208 0.517 6.459 1.00 0.00 H new ATOM 0 H61 A A 43 4.990 -0.801 0.521 1.00 0.00 H new ATOM 0 H62 A A 43 4.754 -1.310 2.197 1.00 0.00 H new ATOM 0 H2 A A 43 7.474 2.918 0.669 1.00 0.00 H new ATOM 66 P U A 44 4.345 5.631 7.777 1.00 0.00 P ATOM 67 OP1 U A 44 4.210 6.787 8.690 1.00 0.00 O ATOM 68 OP2 U A 44 3.406 4.493 7.886 1.00 0.00 O ATOM 69 O5' U A 44 4.296 6.180 6.261 1.00 0.00 O ATOM 70 C5' U A 44 5.113 7.292 5.886 1.00 0.00 C ATOM 71 C4' U A 44 5.058 7.582 4.385 1.00 0.00 C ATOM 72 O4' U A 44 5.629 6.497 3.653 1.00 0.00 O ATOM 73 C3' U A 44 3.669 7.760 3.799 1.00 0.00 C ATOM 74 O3' U A 44 3.183 9.090 4.037 1.00 0.00 O ATOM 75 C2' U A 44 3.966 7.551 2.326 1.00 0.00 C ATOM 76 O2' U A 44 4.545 8.720 1.733 1.00 0.00 O ATOM 77 C1' U A 44 4.960 6.399 2.380 1.00 0.00 C ATOM 78 N1 U A 44 4.312 5.077 2.308 1.00 0.00 N ATOM 79 C2 U A 44 4.033 4.578 1.053 1.00 0.00 C ATOM 80 O2 U A 44 4.334 5.185 0.027 1.00 0.00 O ATOM 81 N3 U A 44 3.397 3.354 1.016 1.00 0.00 N ATOM 82 C4 U A 44 3.020 2.593 2.106 1.00 0.00 C ATOM 83 O4 U A 44 2.465 1.507 1.949 1.00 0.00 O ATOM 84 C5 U A 44 3.345 3.192 3.379 1.00 0.00 C ATOM 85 C6 U A 44 3.966 4.395 3.442 1.00 0.00 C ATOM 0 H5' U A 44 6.145 7.095 6.177 1.00 0.00 H new ATOM 0 H5'' U A 44 4.791 8.177 6.435 1.00 0.00 H new ATOM 0 H4' U A 44 5.600 8.523 4.292 1.00 0.00 H new ATOM 0 H3' U A 44 2.908 7.098 4.212 1.00 0.00 H new ATOM 0 H2' U A 44 3.084 7.349 1.719 1.00 0.00 H new ATOM 0 HO2' U A 44 4.725 8.551 0.785 1.00 0.00 H new ATOM 0 H1' U A 44 5.632 6.476 1.525 1.00 0.00 H new ATOM 0 H3 U A 44 3.184 2.974 0.094 1.00 0.00 H new ATOM 0 H5 U A 44 3.090 2.675 4.292 1.00 0.00 H new ATOM 0 H6 U A 44 4.192 4.824 4.407 1.00 0.00 H new ATOM 96 P C A 45 1.595 9.372 4.143 1.00 0.00 P ATOM 97 OP1 C A 45 1.404 10.789 4.525 1.00 0.00 O ATOM 98 OP2 C A 45 0.990 8.301 4.965 1.00 0.00 O ATOM 99 O5' C A 45 1.083 9.189 2.625 1.00 0.00 O ATOM 100 C5' C A 45 1.504 10.098 1.606 1.00 0.00 C ATOM 101 C4' C A 45 1.054 9.646 0.217 1.00 0.00 C ATOM 102 O4' C A 45 1.705 8.432 -0.143 1.00 0.00 O ATOM 103 C3' C A 45 -0.429 9.358 0.063 1.00 0.00 C ATOM 104 O3' C A 45 -1.162 10.568 -0.144 1.00 0.00 O ATOM 105 C2' C A 45 -0.435 8.509 -1.189 1.00 0.00 C ATOM 106 O2' C A 45 -0.360 9.313 -2.372 1.00 0.00 O ATOM 107 C1' C A 45 0.824 7.674 -0.996 1.00 0.00 C ATOM 108 N1 C A 45 0.560 6.383 -0.337 1.00 0.00 N ATOM 109 C2 C A 45 0.151 5.337 -1.139 1.00 0.00 C ATOM 110 O2 C A 45 0.018 5.511 -2.352 1.00 0.00 O ATOM 111 N3 C A 45 -0.102 4.134 -0.550 1.00 0.00 N ATOM 112 C4 C A 45 0.046 3.968 0.769 1.00 0.00 C ATOM 113 N4 C A 45 -0.202 2.773 1.309 1.00 0.00 N ATOM 114 C5 C A 45 0.465 5.051 1.602 1.00 0.00 C ATOM 115 C6 C A 45 0.703 6.237 1.010 1.00 0.00 C ATOM 0 H5' C A 45 2.590 10.186 1.625 1.00 0.00 H new ATOM 0 H5'' C A 45 1.100 11.089 1.814 1.00 0.00 H new ATOM 0 H4' C A 45 1.310 10.497 -0.415 1.00 0.00 H new ATOM 0 H3' C A 45 -0.888 8.885 0.931 1.00 0.00 H new ATOM 0 H2' C A 45 -1.342 7.919 -1.321 1.00 0.00 H new ATOM 0 HO2' C A 45 -0.407 10.261 -2.127 1.00 0.00 H new ATOM 0 H1' C A 45 1.249 7.461 -1.977 1.00 0.00 H new ATOM 0 H41 C A 45 -0.093 2.635 2.314 1.00 0.00 H new ATOM 0 H42 C A 45 -0.501 1.998 0.717 1.00 0.00 H new ATOM 0 H5 C A 45 0.586 4.923 2.667 1.00 0.00 H new ATOM 0 H6 C A 45 1.010 7.081 1.609 1.00 0.00 H new ATOM 127 P U A 46 -2.713 10.676 0.287 1.00 0.00 P ATOM 128 OP1 U A 46 -3.155 12.072 0.072 1.00 0.00 O ATOM 129 OP2 U A 46 -2.864 10.054 1.621 1.00 0.00 O ATOM 130 O5' U A 46 -3.465 9.739 -0.793 1.00 0.00 O ATOM 131 C5' U A 46 -3.475 10.098 -2.177 1.00 0.00 C ATOM 132 C4' U A 46 -4.140 9.032 -3.053 1.00 0.00 C ATOM 133 O4' U A 46 -3.383 7.817 -3.035 1.00 0.00 O ATOM 134 C3' U A 46 -5.534 8.629 -2.612 1.00 0.00 C ATOM 135 O3' U A 46 -6.496 9.589 -3.074 1.00 0.00 O ATOM 136 C2' U A 46 -5.685 7.309 -3.346 1.00 0.00 C ATOM 137 O2' U A 46 -6.011 7.507 -4.727 1.00 0.00 O ATOM 138 C1' U A 46 -4.294 6.705 -3.181 1.00 0.00 C ATOM 139 N1 U A 46 -4.170 5.854 -1.980 1.00 0.00 N ATOM 140 C2 U A 46 -4.568 4.534 -2.086 1.00 0.00 C ATOM 141 O2 U A 46 -4.983 4.056 -3.138 1.00 0.00 O ATOM 142 N3 U A 46 -4.471 3.776 -0.936 1.00 0.00 N ATOM 143 C4 U A 46 -4.018 4.212 0.294 1.00 0.00 C ATOM 144 O4 U A 46 -3.975 3.445 1.251 1.00 0.00 O ATOM 145 C5 U A 46 -3.625 5.602 0.317 1.00 0.00 C ATOM 146 C6 U A 46 -3.712 6.367 -0.798 1.00 0.00 C ATOM 0 H5' U A 46 -2.451 10.256 -2.516 1.00 0.00 H new ATOM 0 H5'' U A 46 -4.001 11.045 -2.300 1.00 0.00 H new ATOM 0 H4' U A 46 -4.189 9.502 -4.035 1.00 0.00 H new ATOM 0 H3' U A 46 -5.681 8.565 -1.534 1.00 0.00 H new ATOM 0 H2' U A 46 -6.490 6.681 -2.964 1.00 0.00 H new ATOM 0 HO2' U A 46 -6.254 8.445 -4.875 1.00 0.00 H new ATOM 0 H1' U A 46 -4.083 6.074 -4.044 1.00 0.00 H new ATOM 0 H3 U A 46 -4.762 2.800 -1.001 1.00 0.00 H new ATOM 0 H5 U A 46 -3.257 6.037 1.235 1.00 0.00 H new ATOM 0 H6 U A 46 -3.413 7.404 -0.752 1.00 0.00 H new ATOM 157 P C A 47 -7.867 9.836 -2.253 1.00 0.00 P ATOM 158 OP1 C A 47 -8.574 10.978 -2.875 1.00 0.00 O ATOM 159 OP2 C A 47 -7.536 9.878 -0.811 1.00 0.00 O ATOM 160 O5' C A 47 -8.733 8.506 -2.526 1.00 0.00 O ATOM 161 C5' C A 47 -9.214 8.218 -3.840 1.00 0.00 C ATOM 162 C4' C A 47 -9.874 6.844 -3.917 1.00 0.00 C ATOM 163 O4' C A 47 -8.917 5.826 -3.719 1.00 0.00 O ATOM 164 C3' C A 47 -10.965 6.581 -2.899 1.00 0.00 C ATOM 165 O3' C A 47 -12.192 7.166 -3.359 1.00 0.00 O ATOM 166 C2' C A 47 -11.032 5.060 -2.907 1.00 0.00 C ATOM 167 O2' C A 47 -11.907 4.581 -3.932 1.00 0.00 O ATOM 168 C1' C A 47 -9.573 4.664 -3.186 1.00 0.00 C ATOM 169 N1 C A 47 -8.823 4.284 -1.986 1.00 0.00 N ATOM 170 C2 C A 47 -8.902 2.973 -1.570 1.00 0.00 C ATOM 171 O2 C A 47 -9.586 2.176 -2.206 1.00 0.00 O ATOM 172 N3 C A 47 -8.204 2.608 -0.456 1.00 0.00 N ATOM 173 C4 C A 47 -7.467 3.506 0.214 1.00 0.00 C ATOM 174 N4 C A 47 -6.790 3.124 1.296 1.00 0.00 N ATOM 175 C5 C A 47 -7.397 4.867 -0.215 1.00 0.00 C ATOM 176 C6 C A 47 -8.092 5.208 -1.313 1.00 0.00 C ATOM 0 H5' C A 47 -8.386 8.263 -4.547 1.00 0.00 H new ATOM 0 H5'' C A 47 -9.931 8.982 -4.140 1.00 0.00 H new ATOM 0 H4' C A 47 -10.324 6.838 -4.910 1.00 0.00 H new ATOM 0 H3' C A 47 -10.787 6.996 -1.907 1.00 0.00 H new ATOM 0 H2' C A 47 -11.427 4.639 -1.982 1.00 0.00 H new ATOM 0 HO2' C A 47 -12.566 3.970 -3.541 1.00 0.00 H new ATOM 0 H1' C A 47 -9.594 3.805 -3.856 1.00 0.00 H new ATOM 0 H41 C A 47 -6.227 3.801 1.811 1.00 0.00 H new ATOM 0 H42 C A 47 -6.835 2.154 1.609 1.00 0.00 H new ATOM 0 H5 C A 47 -6.807 5.594 0.323 1.00 0.00 H new ATOM 0 H6 C A 47 -8.069 6.229 -1.664 1.00 0.00 H new ATOM 188 P U A 48 -13.336 7.661 -2.332 1.00 0.00 P ATOM 189 OP1 U A 48 -14.372 8.375 -3.113 1.00 0.00 O ATOM 190 OP2 U A 48 -12.671 8.346 -1.202 1.00 0.00 O ATOM 191 O5' U A 48 -13.986 6.294 -1.774 1.00 0.00 O ATOM 192 C5' U A 48 -15.377 6.274 -1.420 1.00 0.00 C ATOM 193 C4' U A 48 -15.862 4.881 -1.028 1.00 0.00 C ATOM 194 O4' U A 48 -15.855 4.026 -2.176 1.00 0.00 O ATOM 195 C3' U A 48 -15.018 4.213 0.056 1.00 0.00 C ATOM 196 O3' U A 48 -15.898 3.475 0.922 1.00 0.00 O ATOM 197 C2' U A 48 -14.150 3.260 -0.749 1.00 0.00 C ATOM 198 O2' U A 48 -13.754 2.120 0.014 1.00 0.00 O ATOM 199 C1' U A 48 -15.065 2.875 -1.889 1.00 0.00 C ATOM 200 N1 U A 48 -14.366 2.494 -3.125 1.00 0.00 N ATOM 201 C2 U A 48 -13.937 1.186 -3.241 1.00 0.00 C ATOM 202 O2 U A 48 -14.126 0.355 -2.355 1.00 0.00 O ATOM 203 N3 U A 48 -13.280 0.865 -4.414 1.00 0.00 N ATOM 204 C4 U A 48 -13.020 1.728 -5.466 1.00 0.00 C ATOM 205 O4 U A 48 -12.425 1.334 -6.467 1.00 0.00 O ATOM 206 C5 U A 48 -13.506 3.074 -5.257 1.00 0.00 C ATOM 207 C6 U A 48 -14.151 3.409 -4.114 1.00 0.00 C ATOM 0 H5' U A 48 -15.968 6.637 -2.261 1.00 0.00 H new ATOM 0 H5'' U A 48 -15.547 6.961 -0.591 1.00 0.00 H new ATOM 0 H4' U A 48 -16.866 5.021 -0.627 1.00 0.00 H new ATOM 0 H3' U A 48 -14.440 4.898 0.677 1.00 0.00 H new ATOM 0 H2' U A 48 -13.210 3.706 -1.073 1.00 0.00 H new ATOM 0 HO2' U A 48 -12.788 2.154 0.176 1.00 0.00 H new ATOM 0 H1' U A 48 -15.637 2.002 -1.576 1.00 0.00 H new ATOM 0 H3 U A 48 -12.956 -0.097 -4.514 1.00 0.00 H new ATOM 0 H5 U A 48 -13.353 3.821 -6.022 1.00 0.00 H new ATOM 0 H6 U A 48 -14.503 4.422 -3.983 1.00 0.00 H new ATOM 218 P U A 49 -15.632 3.243 2.506 1.00 0.00 P ATOM 219 OP1 U A 49 -16.820 2.563 3.070 1.00 0.00 O ATOM 220 OP2 U A 49 -15.189 4.531 3.084 1.00 0.00 O ATOM 221 O5' U A 49 -14.394 2.215 2.585 1.00 0.00 O ATOM 222 C5' U A 49 -14.493 0.893 2.060 1.00 0.00 C ATOM 223 C4' U A 49 -13.182 0.128 2.229 1.00 0.00 C ATOM 224 O4' U A 49 -12.163 0.803 1.473 1.00 0.00 O ATOM 225 C3' U A 49 -12.678 0.047 3.673 1.00 0.00 C ATOM 226 O3' U A 49 -12.133 -1.257 3.887 1.00 0.00 O ATOM 227 C2' U A 49 -11.568 1.072 3.773 1.00 0.00 C ATOM 228 O2' U A 49 -10.510 0.613 4.622 1.00 0.00 O ATOM 229 C1' U A 49 -11.095 1.231 2.341 1.00 0.00 C ATOM 230 N1 U A 49 -10.745 2.628 2.014 1.00 0.00 N ATOM 231 C2 U A 49 -9.475 3.060 2.350 1.00 0.00 C ATOM 232 O2 U A 49 -8.645 2.312 2.861 1.00 0.00 O ATOM 233 N3 U A 49 -9.191 4.386 2.077 1.00 0.00 N ATOM 234 C4 U A 49 -10.052 5.303 1.501 1.00 0.00 C ATOM 235 O4 U A 49 -9.692 6.461 1.300 1.00 0.00 O ATOM 236 C5 U A 49 -11.355 4.765 1.182 1.00 0.00 C ATOM 237 C6 U A 49 -11.657 3.471 1.446 1.00 0.00 C ATOM 0 H5' U A 49 -14.756 0.938 1.003 1.00 0.00 H new ATOM 0 H5'' U A 49 -15.296 0.358 2.566 1.00 0.00 H new ATOM 0 H4' U A 49 -13.381 -0.889 1.890 1.00 0.00 H new ATOM 0 H3' U A 49 -13.466 0.230 4.403 1.00 0.00 H new ATOM 0 H2' U A 49 -11.902 2.012 4.213 1.00 0.00 H new ATOM 0 HO2' U A 49 -10.886 0.287 5.466 1.00 0.00 H new ATOM 0 H1' U A 49 -10.195 0.631 2.208 1.00 0.00 H new ATOM 0 H3 U A 49 -8.259 4.719 2.324 1.00 0.00 H new ATOM 0 H5 U A 49 -12.098 5.403 0.727 1.00 0.00 H new ATOM 0 H6 U A 49 -12.641 3.098 1.202 1.00 0.00 H new ATOM 248 P G A 50 -12.053 -1.915 5.354 1.00 0.00 P ATOM 249 OP1 G A 50 -13.420 -1.967 5.919 1.00 0.00 O ATOM 250 OP2 G A 50 -10.963 -1.254 6.105 1.00 0.00 O ATOM 251 O5' G A 50 -11.591 -3.415 5.000 1.00 0.00 O ATOM 252 C5' G A 50 -12.480 -4.295 4.306 1.00 0.00 C ATOM 253 C4' G A 50 -11.744 -5.129 3.270 1.00 0.00 C ATOM 254 O4' G A 50 -11.288 -4.310 2.200 1.00 0.00 O ATOM 255 C3' G A 50 -10.522 -5.854 3.779 1.00 0.00 C ATOM 256 O3' G A 50 -10.872 -7.106 4.346 1.00 0.00 O ATOM 257 C2' G A 50 -9.690 -6.036 2.539 1.00 0.00 C ATOM 258 O2' G A 50 -10.123 -7.167 1.775 1.00 0.00 O ATOM 259 C1' G A 50 -9.967 -4.732 1.811 1.00 0.00 C ATOM 260 N9 G A 50 -9.054 -3.630 2.158 1.00 0.00 N ATOM 261 C8 G A 50 -8.178 -3.518 3.205 1.00 0.00 C ATOM 262 N7 G A 50 -7.503 -2.403 3.212 1.00 0.00 N ATOM 263 C5 G A 50 -7.964 -1.731 2.086 1.00 0.00 C ATOM 264 C6 G A 50 -7.604 -0.458 1.578 1.00 0.00 C ATOM 265 O6 G A 50 -6.773 0.330 2.026 1.00 0.00 O ATOM 266 N1 G A 50 -8.322 -0.151 0.424 1.00 0.00 N ATOM 267 C2 G A 50 -9.259 -0.979 -0.166 1.00 0.00 C ATOM 268 N2 G A 50 -9.846 -0.532 -1.273 1.00 0.00 N ATOM 269 N3 G A 50 -9.590 -2.173 0.314 1.00 0.00 N ATOM 270 C4 G A 50 -8.909 -2.480 1.436 1.00 0.00 C ATOM 0 H5' G A 50 -13.261 -3.713 3.817 1.00 0.00 H new ATOM 0 H5'' G A 50 -12.973 -4.954 5.021 1.00 0.00 H new ATOM 0 H4' G A 50 -12.485 -5.868 2.964 1.00 0.00 H new ATOM 0 H3' G A 50 -10.001 -5.312 4.568 1.00 0.00 H new ATOM 0 H2' G A 50 -8.634 -6.229 2.731 1.00 0.00 H new ATOM 0 HO2' G A 50 -10.834 -7.637 2.260 1.00 0.00 H new ATOM 0 H1' G A 50 -9.843 -4.930 0.746 1.00 0.00 H new ATOM 0 H8 G A 50 -8.058 -4.284 3.957 1.00 0.00 H new ATOM 0 H1 G A 50 -8.143 0.751 -0.018 1.00 0.00 H new ATOM 0 H21 G A 50 -10.544 -1.105 -1.747 1.00 0.00 H new ATOM 0 H22 G A 50 -9.598 0.383 -1.648 1.00 0.00 H new ATOM 282 P U A 51 -9.735 -7.935 5.098 1.00 0.00 P ATOM 283 OP1 U A 51 -10.356 -9.114 5.741 1.00 0.00 O ATOM 284 OP2 U A 51 -8.911 -6.996 5.892 1.00 0.00 O ATOM 285 O5' U A 51 -8.872 -8.434 3.832 1.00 0.00 O ATOM 286 C5' U A 51 -7.524 -8.860 3.978 1.00 0.00 C ATOM 287 C4' U A 51 -6.990 -9.465 2.683 1.00 0.00 C ATOM 288 O4' U A 51 -7.724 -10.655 2.391 1.00 0.00 O ATOM 289 C3' U A 51 -7.083 -8.565 1.453 1.00 0.00 C ATOM 290 O3' U A 51 -5.915 -8.796 0.666 1.00 0.00 O ATOM 291 C2' U A 51 -8.315 -9.041 0.703 1.00 0.00 C ATOM 292 O2' U A 51 -8.087 -9.035 -0.711 1.00 0.00 O ATOM 293 C1' U A 51 -8.527 -10.467 1.217 1.00 0.00 C ATOM 294 N1 U A 51 -9.931 -10.798 1.579 1.00 0.00 N ATOM 295 C2 U A 51 -10.459 -11.982 1.085 1.00 0.00 C ATOM 296 O2 U A 51 -9.808 -12.735 0.363 1.00 0.00 O ATOM 297 N3 U A 51 -11.760 -12.271 1.452 1.00 0.00 N ATOM 298 C4 U A 51 -12.574 -11.495 2.257 1.00 0.00 C ATOM 299 O4 U A 51 -13.721 -11.851 2.516 1.00 0.00 O ATOM 300 C5 U A 51 -11.948 -10.281 2.730 1.00 0.00 C ATOM 301 C6 U A 51 -10.673 -9.973 2.387 1.00 0.00 C ATOM 0 H5' U A 51 -7.458 -9.595 4.780 1.00 0.00 H new ATOM 0 H5'' U A 51 -6.902 -8.013 4.270 1.00 0.00 H new ATOM 0 H4' U A 51 -5.930 -9.640 2.868 1.00 0.00 H new ATOM 0 H3' U A 51 -7.151 -7.504 1.692 1.00 0.00 H new ATOM 0 H2' U A 51 -9.182 -8.401 0.867 1.00 0.00 H new ATOM 0 HO2' U A 51 -8.893 -9.347 -1.174 1.00 0.00 H new ATOM 0 H1' U A 51 -8.248 -11.123 0.393 1.00 0.00 H new ATOM 0 H3 U A 51 -12.158 -13.140 1.095 1.00 0.00 H new ATOM 0 H5 U A 51 -12.505 -9.609 3.366 1.00 0.00 H new ATOM 0 H6 U A 51 -10.232 -9.059 2.757 1.00 0.00 H new ATOM 312 P A A 52 -4.759 -7.696 0.468 1.00 0.00 P ATOM 313 OP1 A A 52 -3.617 -8.345 -0.216 1.00 0.00 O ATOM 314 OP2 A A 52 -4.547 -7.011 1.763 1.00 0.00 O ATOM 315 O5' A A 52 -5.418 -6.644 -0.551 1.00 0.00 O ATOM 316 C5' A A 52 -6.327 -7.086 -1.558 1.00 0.00 C ATOM 317 C4' A A 52 -6.645 -5.973 -2.545 1.00 0.00 C ATOM 318 O4' A A 52 -7.333 -4.880 -1.919 1.00 0.00 O ATOM 319 C3' A A 52 -5.399 -5.369 -3.162 1.00 0.00 C ATOM 320 O3' A A 52 -4.961 -6.195 -4.248 1.00 0.00 O ATOM 321 C2' A A 52 -5.918 -4.035 -3.652 1.00 0.00 C ATOM 322 O2' A A 52 -6.620 -4.167 -4.894 1.00 0.00 O ATOM 323 C1' A A 52 -6.859 -3.651 -2.515 1.00 0.00 C ATOM 324 N9 A A 52 -6.216 -2.863 -1.451 1.00 0.00 N ATOM 325 C8 A A 52 -5.795 -3.273 -0.211 1.00 0.00 C ATOM 326 N7 A A 52 -5.293 -2.315 0.518 1.00 0.00 N ATOM 327 C5 A A 52 -5.390 -1.191 -0.298 1.00 0.00 C ATOM 328 C6 A A 52 -5.026 0.153 -0.113 1.00 0.00 C ATOM 329 N6 A A 52 -4.472 0.610 1.007 1.00 0.00 N ATOM 330 N1 A A 52 -5.256 1.001 -1.129 1.00 0.00 N ATOM 331 C2 A A 52 -5.810 0.539 -2.244 1.00 0.00 C ATOM 332 N3 A A 52 -6.197 -0.692 -2.536 1.00 0.00 N ATOM 333 C4 A A 52 -5.951 -1.518 -1.498 1.00 0.00 C ATOM 0 H5' A A 52 -7.248 -7.435 -1.091 1.00 0.00 H new ATOM 0 H5'' A A 52 -5.898 -7.935 -2.090 1.00 0.00 H new ATOM 0 H4' A A 52 -7.263 -6.453 -3.304 1.00 0.00 H new ATOM 0 H3' A A 52 -4.545 -5.276 -2.491 1.00 0.00 H new ATOM 0 H2' A A 52 -5.140 -3.300 -3.858 1.00 0.00 H new ATOM 0 HO2' A A 52 -6.548 -5.091 -5.214 1.00 0.00 H new ATOM 0 H1' A A 52 -7.650 -3.033 -2.940 1.00 0.00 H new ATOM 0 H8 A A 52 -5.872 -4.295 0.130 1.00 0.00 H new ATOM 0 H61 A A 52 -4.227 1.597 1.089 1.00 0.00 H new ATOM 0 H62 A A 52 -4.293 -0.026 1.784 1.00 0.00 H new ATOM 0 H2 A A 52 -5.967 1.271 -3.022 1.00 0.00 H new ATOM 345 P G A 53 -3.408 -6.257 -4.671 1.00 0.00 P ATOM 346 OP1 G A 53 -3.259 -7.272 -5.738 1.00 0.00 O ATOM 347 OP2 G A 53 -2.596 -6.358 -3.438 1.00 0.00 O ATOM 348 O5' G A 53 -3.160 -4.810 -5.318 1.00 0.00 O ATOM 349 C5' G A 53 -3.824 -4.433 -6.521 1.00 0.00 C ATOM 350 C4' G A 53 -3.561 -2.973 -6.853 1.00 0.00 C ATOM 351 O4' G A 53 -4.130 -2.127 -5.849 1.00 0.00 O ATOM 352 C3' G A 53 -2.094 -2.591 -6.907 1.00 0.00 C ATOM 353 O3' G A 53 -1.522 -2.945 -8.170 1.00 0.00 O ATOM 354 C2' G A 53 -2.194 -1.085 -6.767 1.00 0.00 C ATOM 355 O2' G A 53 -2.581 -0.467 -8.000 1.00 0.00 O ATOM 356 C1' G A 53 -3.290 -0.967 -5.713 1.00 0.00 C ATOM 357 N9 G A 53 -2.764 -0.928 -4.338 1.00 0.00 N ATOM 358 C8 G A 53 -2.619 -1.947 -3.432 1.00 0.00 C ATOM 359 N7 G A 53 -2.091 -1.573 -2.299 1.00 0.00 N ATOM 360 C5 G A 53 -1.869 -0.211 -2.469 1.00 0.00 C ATOM 361 C6 G A 53 -1.307 0.739 -1.573 1.00 0.00 C ATOM 362 O6 G A 53 -0.901 0.555 -0.425 1.00 0.00 O ATOM 363 N1 G A 53 -1.258 2.009 -2.146 1.00 0.00 N ATOM 364 C2 G A 53 -1.699 2.320 -3.421 1.00 0.00 C ATOM 365 N2 G A 53 -1.574 3.590 -3.810 1.00 0.00 N ATOM 366 N3 G A 53 -2.227 1.425 -4.254 1.00 0.00 N ATOM 367 C4 G A 53 -2.279 0.189 -3.714 1.00 0.00 C ATOM 0 H5' G A 53 -4.896 -4.598 -6.416 1.00 0.00 H new ATOM 0 H5'' G A 53 -3.483 -5.064 -7.342 1.00 0.00 H new ATOM 0 H4' G A 53 -4.004 -2.842 -7.840 1.00 0.00 H new ATOM 0 H3' G A 53 -1.468 -3.080 -6.161 1.00 0.00 H new ATOM 0 H2' G A 53 -1.258 -0.593 -6.501 1.00 0.00 H new ATOM 0 HO2' G A 53 -2.638 0.503 -7.876 1.00 0.00 H new ATOM 0 H1' G A 53 -3.827 -0.032 -5.874 1.00 0.00 H new ATOM 0 H8 G A 53 -2.915 -2.965 -3.637 1.00 0.00 H new ATOM 0 H1 G A 53 -0.868 2.766 -1.584 1.00 0.00 H new ATOM 0 H21 G A 53 -1.884 3.871 -4.740 1.00 0.00 H new ATOM 0 H22 G A 53 -1.169 4.280 -3.177 1.00 0.00 H new ATOM 379 P A A 54 0.050 -3.291 -8.289 1.00 0.00 P ATOM 380 OP1 A A 54 0.329 -3.714 -9.679 1.00 0.00 O ATOM 381 OP2 A A 54 0.417 -4.175 -7.160 1.00 0.00 O ATOM 382 O5' A A 54 0.739 -1.858 -8.050 1.00 0.00 O ATOM 383 C5' A A 54 0.543 -0.796 -8.978 1.00 0.00 C ATOM 384 C4' A A 54 1.134 0.511 -8.459 1.00 0.00 C ATOM 385 O4' A A 54 0.448 0.946 -7.281 1.00 0.00 O ATOM 386 C3' A A 54 2.595 0.452 -8.053 1.00 0.00 C ATOM 387 O3' A A 54 3.449 0.577 -9.187 1.00 0.00 O ATOM 388 C2' A A 54 2.710 1.692 -7.201 1.00 0.00 C ATOM 389 O2' A A 54 2.852 2.870 -8.004 1.00 0.00 O ATOM 390 C1' A A 54 1.385 1.679 -6.463 1.00 0.00 C ATOM 391 N9 A A 54 1.464 1.031 -5.143 1.00 0.00 N ATOM 392 C8 A A 54 1.112 -0.242 -4.773 1.00 0.00 C ATOM 393 N7 A A 54 1.290 -0.491 -3.505 1.00 0.00 N ATOM 394 C5 A A 54 1.803 0.700 -3.004 1.00 0.00 C ATOM 395 C6 A A 54 2.208 1.095 -1.720 1.00 0.00 C ATOM 396 N6 A A 54 2.150 0.294 -0.656 1.00 0.00 N ATOM 397 N1 A A 54 2.673 2.347 -1.582 1.00 0.00 N ATOM 398 C2 A A 54 2.728 3.142 -2.643 1.00 0.00 C ATOM 399 N3 A A 54 2.374 2.891 -3.889 1.00 0.00 N ATOM 400 C4 A A 54 1.912 1.629 -3.997 1.00 0.00 C ATOM 0 H5' A A 54 -0.523 -0.666 -9.165 1.00 0.00 H new ATOM 0 H5'' A A 54 1.005 -1.053 -9.931 1.00 0.00 H new ATOM 0 H4' A A 54 1.025 1.182 -9.311 1.00 0.00 H new ATOM 0 H3' A A 54 2.877 -0.480 -7.563 1.00 0.00 H new ATOM 0 H2' A A 54 3.582 1.700 -6.547 1.00 0.00 H new ATOM 0 HO2' A A 54 2.846 2.622 -8.952 1.00 0.00 H new ATOM 0 H1' A A 54 1.079 2.711 -6.291 1.00 0.00 H new ATOM 0 H8 A A 54 0.723 -0.971 -5.468 1.00 0.00 H new ATOM 0 H61 A A 54 2.458 0.633 0.255 1.00 0.00 H new ATOM 0 H62 A A 54 1.798 -0.658 -0.753 1.00 0.00 H new ATOM 0 H2 A A 54 3.117 4.133 -2.461 1.00 0.00 H new ATOM 412 P U A 55 4.931 -0.047 -9.168 1.00 0.00 P ATOM 413 OP1 U A 55 5.558 0.191 -10.487 1.00 0.00 O ATOM 414 OP2 U A 55 4.858 -1.417 -8.613 1.00 0.00 O ATOM 415 O5' U A 55 5.644 0.906 -8.085 1.00 0.00 O ATOM 416 C5' U A 55 5.796 2.301 -8.330 1.00 0.00 C ATOM 417 C4' U A 55 6.344 3.025 -7.103 1.00 0.00 C ATOM 418 O4' U A 55 5.422 2.924 -6.017 1.00 0.00 O ATOM 419 C3' U A 55 7.633 2.453 -6.551 1.00 0.00 C ATOM 420 O3' U A 55 8.757 2.931 -7.296 1.00 0.00 O ATOM 421 C2' U A 55 7.645 3.049 -5.155 1.00 0.00 C ATOM 422 O2' U A 55 8.175 4.380 -5.157 1.00 0.00 O ATOM 423 C1' U A 55 6.163 3.038 -4.784 1.00 0.00 C ATOM 424 N1 U A 55 5.805 1.906 -3.908 1.00 0.00 N ATOM 425 C2 U A 55 6.029 2.071 -2.558 1.00 0.00 C ATOM 426 O2 U A 55 6.483 3.117 -2.096 1.00 0.00 O ATOM 427 N3 U A 55 5.715 0.995 -1.754 1.00 0.00 N ATOM 428 C4 U A 55 5.198 -0.216 -2.170 1.00 0.00 C ATOM 429 O4 U A 55 4.947 -1.101 -1.351 1.00 0.00 O ATOM 430 C5 U A 55 4.995 -0.305 -3.603 1.00 0.00 C ATOM 431 C6 U A 55 5.304 0.737 -4.413 1.00 0.00 C ATOM 0 H5' U A 55 4.833 2.730 -8.608 1.00 0.00 H new ATOM 0 H5'' U A 55 6.468 2.453 -9.174 1.00 0.00 H new ATOM 0 H4' U A 55 6.513 4.042 -7.457 1.00 0.00 H new ATOM 0 H3' U A 55 7.690 1.365 -6.585 1.00 0.00 H new ATOM 0 H2' U A 55 8.274 2.501 -4.453 1.00 0.00 H new ATOM 0 HO2' U A 55 8.471 4.613 -6.062 1.00 0.00 H new ATOM 0 H1' U A 55 5.930 3.951 -4.236 1.00 0.00 H new ATOM 0 H3 U A 55 5.881 1.105 -0.754 1.00 0.00 H new ATOM 0 H5 U A 55 4.593 -1.212 -4.030 1.00 0.00 H new ATOM 0 H6 U A 55 5.152 0.643 -5.478 1.00 0.00 H new ATOM 442 P C A 56 10.100 2.045 -7.415 1.00 0.00 P ATOM 443 OP1 C A 56 11.034 2.744 -8.325 1.00 0.00 O ATOM 444 OP2 C A 56 9.705 0.647 -7.699 1.00 0.00 O ATOM 445 O5' C A 56 10.714 2.100 -5.927 1.00 0.00 O ATOM 446 C5' C A 56 11.184 3.327 -5.368 1.00 0.00 C ATOM 447 C4' C A 56 11.656 3.140 -3.926 1.00 0.00 C ATOM 448 O4' C A 56 10.574 2.793 -3.075 1.00 0.00 O ATOM 449 C3' C A 56 12.678 2.040 -3.727 1.00 0.00 C ATOM 450 O3' C A 56 13.977 2.536 -4.064 1.00 0.00 O ATOM 451 C2' C A 56 12.571 1.763 -2.233 1.00 0.00 C ATOM 452 O2' C A 56 13.496 2.562 -1.487 1.00 0.00 O ATOM 453 C1' C A 56 11.117 2.142 -1.911 1.00 0.00 C ATOM 454 N1 C A 56 10.250 0.989 -1.597 1.00 0.00 N ATOM 455 C2 C A 56 10.278 0.498 -0.300 1.00 0.00 C ATOM 456 O2 C A 56 11.019 1.014 0.536 1.00 0.00 O ATOM 457 N3 C A 56 9.469 -0.556 0.010 1.00 0.00 N ATOM 458 C4 C A 56 8.670 -1.103 -0.919 1.00 0.00 C ATOM 459 N4 C A 56 7.884 -2.126 -0.589 1.00 0.00 N ATOM 460 C5 C A 56 8.645 -0.602 -2.256 1.00 0.00 C ATOM 461 C6 C A 56 9.448 0.437 -2.551 1.00 0.00 C ATOM 0 H5' C A 56 10.388 4.071 -5.398 1.00 0.00 H new ATOM 0 H5'' C A 56 12.004 3.714 -5.973 1.00 0.00 H new ATOM 0 H4' C A 56 12.106 4.103 -3.685 1.00 0.00 H new ATOM 0 H3' C A 56 12.516 1.152 -4.338 1.00 0.00 H new ATOM 0 H2' C A 56 12.811 0.732 -1.972 1.00 0.00 H new ATOM 0 HO2' C A 56 13.404 2.363 -0.532 1.00 0.00 H new ATOM 0 H1' C A 56 11.137 2.776 -1.024 1.00 0.00 H new ATOM 0 H41 C A 56 7.274 -2.547 -1.290 1.00 0.00 H new ATOM 0 H42 C A 56 7.892 -2.488 0.364 1.00 0.00 H new ATOM 0 H5 C A 56 8.003 -1.042 -3.005 1.00 0.00 H new ATOM 0 H6 C A 56 9.457 0.838 -3.554 1.00 0.00 H new ATOM 473 P A A 57 15.146 1.558 -4.585 1.00 0.00 P ATOM 474 OP1 A A 57 16.304 2.391 -4.979 1.00 0.00 O ATOM 475 OP2 A A 57 14.555 0.613 -5.560 1.00 0.00 O ATOM 476 O5' A A 57 15.549 0.729 -3.265 1.00 0.00 O ATOM 477 C5' A A 57 16.117 1.402 -2.139 1.00 0.00 C ATOM 478 C4' A A 57 16.416 0.442 -0.988 1.00 0.00 C ATOM 479 O4' A A 57 15.180 -0.054 -0.449 1.00 0.00 O ATOM 480 C3' A A 57 17.252 -0.773 -1.401 1.00 0.00 C ATOM 481 O3' A A 57 18.229 -1.090 -0.403 1.00 0.00 O ATOM 482 C2' A A 57 16.227 -1.884 -1.522 1.00 0.00 C ATOM 483 O2' A A 57 16.801 -3.161 -1.219 1.00 0.00 O ATOM 484 C1' A A 57 15.188 -1.485 -0.494 1.00 0.00 C ATOM 485 N9 A A 57 13.824 -1.951 -0.805 1.00 0.00 N ATOM 486 C8 A A 57 13.123 -1.844 -1.979 1.00 0.00 C ATOM 487 N7 A A 57 11.935 -2.382 -1.934 1.00 0.00 N ATOM 488 C5 A A 57 11.843 -2.879 -0.638 1.00 0.00 C ATOM 489 C6 A A 57 10.827 -3.568 0.046 1.00 0.00 C ATOM 490 N6 A A 57 9.659 -3.887 -0.511 1.00 0.00 N ATOM 491 N1 A A 57 11.067 -3.913 1.322 1.00 0.00 N ATOM 492 C2 A A 57 12.234 -3.593 1.871 1.00 0.00 C ATOM 493 N3 A A 57 13.260 -2.952 1.336 1.00 0.00 N ATOM 494 C4 A A 57 12.990 -2.620 0.056 1.00 0.00 C ATOM 0 H5' A A 57 15.431 2.177 -1.796 1.00 0.00 H new ATOM 0 H5'' A A 57 17.037 1.902 -2.442 1.00 0.00 H new ATOM 0 H4' A A 57 16.989 1.016 -0.260 1.00 0.00 H new ATOM 0 H3' A A 57 17.812 -0.606 -2.321 1.00 0.00 H new ATOM 0 H2' A A 57 15.822 -1.992 -2.528 1.00 0.00 H new ATOM 0 HO2' A A 57 16.116 -3.856 -1.304 1.00 0.00 H new ATOM 0 HO3' A A 57 18.166 -2.041 -0.174 1.00 0.00 H new ATOM 0 H1' A A 57 15.459 -1.949 0.454 1.00 0.00 H new ATOM 0 H8 A A 57 13.518 -1.359 -2.860 1.00 0.00 H new ATOM 0 H61 A A 57 8.955 -4.388 0.031 1.00 0.00 H new ATOM 0 H62 A A 57 9.469 -3.630 -1.480 1.00 0.00 H new ATOM 0 H2 A A 57 12.363 -3.899 2.899 1.00 0.00 H new TER 507 A A 57