USER MOD reduce.3.24.130724 H: found=0, std=0, add=184, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 184 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 Set 1.1: A 8 A O2' : rot 130:sc= -0.387 USER MOD Set 1.2: A 11 U O2' : rot -135:sc= 0.456 USER MOD Single : A 1 U O2' : rot -5:sc= -2.1! USER MOD Single : A 1 U O5' : rot 180:sc= -0.968 USER MOD Single : A 2 G O2' : rot -150:sc= -2.81! USER MOD Single : A 3 A O2' : rot -161:sc= -2.51! USER MOD Single : A 4 G O2' : rot -136:sc= -0.698 USER MOD Single : A 5 C O2' : rot -14:sc= 0.0553 USER MOD Single : A 6 A O2' : rot -114:sc= 1.19 USER MOD Single : A 7 C O2' : rot 180:sc= -2.79! USER MOD Single : A 9 G O2' : rot 37:sc= 1.51 USER MOD Single : A 10 U O2' : rot 29:sc= 0.17 USER MOD Single : A 12 U O2' : rot -112:sc= 1.26 USER MOD Single : A 13 G O2' : rot 180:sc= -2.92! USER MOD Single : A 14 C O2' : rot -139:sc= -0.886! USER MOD Single : A 15 U O2' : rot -118:sc= 0.838 USER MOD Single : A 16 C O2' : rot -112:sc= 0.223 USER MOD Single : A 17 A O2' : rot -31:sc= 0.171 USER MOD Single : A 17 A O3' : rot 180:sc= 0.175 USER MOD ----------------------------------------------------------------- ATOM 1 O5' U A 1 13.734 20.611 24.015 1.00 0.47 O ATOM 2 C5' U A 1 12.915 19.695 23.284 1.00 0.47 C ATOM 3 C4' U A 1 12.043 20.405 22.264 1.00 0.44 C ATOM 4 O4' U A 1 11.080 21.221 22.907 1.00 0.47 O ATOM 5 C3' U A 1 12.894 21.279 21.361 1.00 0.34 C ATOM 6 O3' U A 1 13.350 20.544 20.216 1.00 0.32 O ATOM 7 C2' U A 1 11.915 22.381 20.976 1.00 0.35 C ATOM 8 O2' U A 1 11.177 22.026 19.799 1.00 0.40 O ATOM 9 C1' U A 1 11.006 22.461 22.209 1.00 0.42 C ATOM 10 N1 U A 1 11.401 23.573 23.100 1.00 0.45 N ATOM 11 C2 U A 1 10.815 24.804 22.888 1.00 0.52 C ATOM 12 O2 U A 1 10.009 24.994 21.982 1.00 0.58 O ATOM 13 N3 U A 1 11.180 25.811 23.757 1.00 0.59 N ATOM 14 C4 U A 1 12.068 25.698 24.810 1.00 0.59 C ATOM 15 O4 U A 1 12.311 26.663 25.534 1.00 0.69 O ATOM 16 C5 U A 1 12.636 24.380 24.960 1.00 0.55 C ATOM 17 C6 U A 1 12.295 23.376 24.119 1.00 0.49 C ATOM 0 H5' U A 1 12.284 19.140 23.977 1.00 0.47 H new ATOM 0 H5'' U A 1 13.548 18.967 22.776 1.00 0.47 H new ATOM 0 H4' U A 1 11.536 19.643 21.673 1.00 0.44 H new ATOM 0 H3' U A 1 13.804 21.654 21.829 1.00 0.34 H new ATOM 0 H2' U A 1 12.395 23.329 20.733 1.00 0.35 H new ATOM 0 HO2' U A 1 11.515 21.177 19.445 1.00 0.40 H new ATOM 0 HO5' U A 1 14.279 20.117 24.663 1.00 0.47 H new ATOM 0 H1' U A 1 9.983 22.652 21.885 1.00 0.42 H new ATOM 0 H3 U A 1 10.754 26.726 23.608 1.00 0.59 H new ATOM 0 H5 U A 1 13.343 24.192 25.754 1.00 0.55 H new ATOM 0 H6 U A 1 12.737 22.400 24.254 1.00 0.49 H new ATOM 29 P G A 2 14.757 20.904 19.516 1.00 0.24 P ATOM 30 OP1 G A 2 15.072 19.863 18.515 1.00 0.30 O ATOM 31 OP2 G A 2 15.742 21.206 20.574 1.00 0.27 O ATOM 32 O5' G A 2 14.399 22.259 18.740 1.00 0.25 O ATOM 33 C5' G A 2 13.393 22.273 17.727 1.00 0.26 C ATOM 34 C4' G A 2 13.540 23.490 16.828 1.00 0.24 C ATOM 35 O4' G A 2 13.076 24.674 17.475 1.00 0.32 O ATOM 36 C3' G A 2 15.007 23.670 16.487 1.00 0.20 C ATOM 37 O3' G A 2 15.347 22.999 15.281 1.00 0.22 O ATOM 38 C2' G A 2 15.112 25.174 16.367 1.00 0.29 C ATOM 39 O2' G A 2 14.712 25.635 15.066 1.00 0.41 O ATOM 40 C1' G A 2 14.138 25.615 17.452 1.00 0.31 C ATOM 41 N9 G A 2 14.808 25.654 18.771 1.00 0.30 N ATOM 42 C8 G A 2 14.755 24.742 19.782 1.00 0.29 C ATOM 43 N7 G A 2 15.464 25.038 20.821 1.00 0.31 N ATOM 44 C5 G A 2 16.045 26.253 20.468 1.00 0.30 C ATOM 45 C6 G A 2 16.931 27.080 21.202 1.00 0.32 C ATOM 46 O6 G A 2 17.394 26.897 22.324 1.00 0.38 O ATOM 47 N1 G A 2 17.265 28.219 20.490 1.00 0.32 N ATOM 48 C2 G A 2 16.819 28.524 19.229 1.00 0.31 C ATOM 49 N2 G A 2 17.287 29.654 18.704 1.00 0.35 N ATOM 50 N3 G A 2 15.977 27.755 18.528 1.00 0.31 N ATOM 51 C4 G A 2 15.640 26.641 19.214 1.00 0.29 C ATOM 0 H5' G A 2 12.406 22.276 18.190 1.00 0.26 H new ATOM 0 H5'' G A 2 13.462 21.364 17.129 1.00 0.26 H new ATOM 0 H4' G A 2 12.943 23.328 15.930 1.00 0.24 H new ATOM 0 H3' G A 2 15.694 23.249 17.221 1.00 0.20 H new ATOM 0 H2' G A 2 16.122 25.567 16.483 1.00 0.29 H new ATOM 0 HO2' G A 2 15.204 26.453 14.843 1.00 0.41 H new ATOM 0 H1' G A 2 13.766 26.618 17.241 1.00 0.31 H new ATOM 0 H8 G A 2 14.165 23.840 19.720 1.00 0.29 H new ATOM 0 H1 G A 2 17.893 28.885 20.939 1.00 0.32 H new ATOM 0 H21 G A 2 16.996 29.941 17.769 1.00 0.35 H new ATOM 0 H22 G A 2 17.936 30.233 19.236 1.00 0.35 H new ATOM 63 P A A 3 16.837 22.447 15.060 1.00 0.20 P ATOM 64 OP1 A A 3 16.894 21.689 13.789 1.00 0.31 O ATOM 65 OP2 A A 3 17.301 21.815 16.303 1.00 0.25 O ATOM 66 O5' A A 3 17.664 23.812 14.867 1.00 0.28 O ATOM 67 C5' A A 3 17.268 24.775 13.892 1.00 0.23 C ATOM 68 C4' A A 3 18.014 26.091 14.073 1.00 0.23 C ATOM 69 O4' A A 3 17.600 26.782 15.255 1.00 0.26 O ATOM 70 C3' A A 3 19.508 25.856 14.190 1.00 0.26 C ATOM 71 O3' A A 3 20.136 25.659 12.922 1.00 0.33 O ATOM 72 C2' A A 3 19.946 27.142 14.874 1.00 0.28 C ATOM 73 O2' A A 3 20.149 28.197 13.928 1.00 0.33 O ATOM 74 C1' A A 3 18.748 27.428 15.807 1.00 0.25 C ATOM 75 N9 A A 3 19.027 26.950 17.173 1.00 0.24 N ATOM 76 C8 A A 3 18.734 25.746 17.735 1.00 0.26 C ATOM 77 N7 A A 3 19.125 25.636 18.983 1.00 0.28 N ATOM 78 C5 A A 3 19.720 26.876 19.250 1.00 0.26 C ATOM 79 C6 A A 3 20.328 27.420 20.385 1.00 0.29 C ATOM 80 N6 A A 3 20.435 26.765 21.552 1.00 0.35 N ATOM 81 N1 A A 3 20.815 28.685 20.296 1.00 0.30 N ATOM 82 C2 A A 3 20.707 29.378 19.163 1.00 0.30 C ATOM 83 N3 A A 3 20.142 28.951 18.040 1.00 0.27 N ATOM 84 C4 A A 3 19.671 27.680 18.155 1.00 0.24 C ATOM 0 H5' A A 3 16.195 24.950 13.967 1.00 0.23 H new ATOM 0 H5'' A A 3 17.458 24.382 12.893 1.00 0.23 H new ATOM 0 H4' A A 3 17.783 26.692 13.193 1.00 0.23 H new ATOM 0 H3' A A 3 19.779 24.949 14.731 1.00 0.26 H new ATOM 0 H2' A A 3 20.899 27.063 15.398 1.00 0.28 H new ATOM 0 HO2' A A 3 20.707 28.895 14.331 1.00 0.33 H new ATOM 0 H1' A A 3 18.569 28.501 15.878 1.00 0.25 H new ATOM 0 H8 A A 3 18.227 24.954 17.203 1.00 0.26 H new ATOM 0 H61 A A 3 20.890 27.212 22.348 1.00 0.35 H new ATOM 0 H62 A A 3 20.062 25.820 21.643 1.00 0.35 H new ATOM 0 H2 A A 3 21.116 30.378 19.158 1.00 0.30 H new ATOM 96 P G A 4 21.578 24.945 12.847 1.00 0.30 P ATOM 97 OP1 G A 4 21.872 24.611 11.437 1.00 0.39 O ATOM 98 OP2 G A 4 21.654 23.885 13.879 1.00 0.35 O ATOM 99 O5' G A 4 22.543 26.156 13.284 1.00 0.28 O ATOM 100 C5' G A 4 22.440 27.424 12.638 1.00 0.27 C ATOM 101 C4' G A 4 22.992 28.554 13.505 1.00 0.23 C ATOM 102 O4' G A 4 22.287 28.656 14.738 1.00 0.25 O ATOM 103 C3' G A 4 24.435 28.313 13.845 1.00 0.20 C ATOM 104 O3' G A 4 25.318 28.713 12.796 1.00 0.24 O ATOM 105 C2' G A 4 24.597 29.191 15.086 1.00 0.20 C ATOM 106 O2' G A 4 24.961 30.549 14.728 1.00 0.27 O ATOM 107 C1' G A 4 23.214 29.118 15.728 1.00 0.22 C ATOM 108 N9 G A 4 23.244 28.230 16.907 1.00 0.22 N ATOM 109 C8 G A 4 22.886 26.915 17.017 1.00 0.30 C ATOM 110 N7 G A 4 23.080 26.400 18.197 1.00 0.32 N ATOM 111 C5 G A 4 23.604 27.470 18.924 1.00 0.25 C ATOM 112 C6 G A 4 24.027 27.534 20.286 1.00 0.27 C ATOM 113 O6 G A 4 24.011 26.643 21.136 1.00 0.35 O ATOM 114 N1 G A 4 24.487 28.796 20.620 1.00 0.29 N ATOM 115 C2 G A 4 24.545 29.867 19.755 1.00 0.34 C ATOM 116 N2 G A 4 25.002 31.011 20.254 1.00 0.49 N ATOM 117 N3 G A 4 24.157 29.811 18.481 1.00 0.31 N ATOM 118 C4 G A 4 23.704 28.591 18.138 1.00 0.23 C ATOM 0 H5' G A 4 21.396 27.626 12.401 1.00 0.27 H new ATOM 0 H5'' G A 4 22.982 27.394 11.693 1.00 0.27 H new ATOM 0 H4' G A 4 22.877 29.470 12.925 1.00 0.23 H new ATOM 0 H3' G A 4 24.680 27.262 13.999 1.00 0.20 H new ATOM 0 H2' G A 4 25.394 28.862 15.754 1.00 0.20 H new ATOM 0 HO2' G A 4 25.679 30.861 15.318 1.00 0.27 H new ATOM 0 H1' G A 4 22.901 30.101 16.079 1.00 0.22 H new ATOM 0 H8 G A 4 22.476 26.350 16.193 1.00 0.30 H new ATOM 0 H1 G A 4 24.807 28.944 21.577 1.00 0.29 H new ATOM 0 H21 G A 4 25.067 31.837 19.659 1.00 0.49 H new ATOM 0 H22 G A 4 25.288 31.063 21.232 1.00 0.49 H new ATOM 130 P C A 5 26.856 28.234 12.843 1.00 0.22 P ATOM 131 OP1 C A 5 27.437 28.440 11.503 1.00 0.32 O ATOM 132 OP2 C A 5 26.932 26.901 13.464 1.00 0.34 O ATOM 133 O5' C A 5 27.494 29.320 13.846 1.00 0.24 O ATOM 134 C5' C A 5 27.604 30.681 13.410 1.00 0.24 C ATOM 135 C4' C A 5 28.330 31.562 14.430 1.00 0.20 C ATOM 136 O4' C A 5 27.550 31.781 15.574 1.00 0.22 O ATOM 137 C3' C A 5 29.610 30.894 14.868 1.00 0.18 C ATOM 138 O3' C A 5 30.654 31.103 13.916 1.00 0.22 O ATOM 139 C2' C A 5 29.845 31.570 16.213 1.00 0.21 C ATOM 140 O2' C A 5 30.434 32.860 16.058 1.00 0.26 O ATOM 141 C1' C A 5 28.412 31.691 16.715 1.00 0.22 C ATOM 142 N1 C A 5 28.036 30.528 17.540 1.00 0.24 N ATOM 143 C2 C A 5 28.580 30.447 18.818 1.00 0.32 C ATOM 144 O2 C A 5 29.314 31.344 19.233 1.00 0.39 O ATOM 145 N3 C A 5 28.275 29.336 19.570 1.00 0.35 N ATOM 146 C4 C A 5 27.475 28.363 19.103 1.00 0.32 C ATOM 147 N4 C A 5 27.190 27.316 19.867 1.00 0.40 N ATOM 148 C5 C A 5 26.908 28.457 17.803 1.00 0.28 C ATOM 149 C6 C A 5 27.224 29.552 17.050 1.00 0.24 C ATOM 0 H5' C A 5 26.607 31.084 13.230 1.00 0.24 H new ATOM 0 H5'' C A 5 28.138 30.714 12.460 1.00 0.24 H new ATOM 0 H4' C A 5 28.532 32.516 13.943 1.00 0.20 H new ATOM 0 H3' C A 5 29.571 29.807 14.946 1.00 0.18 H new ATOM 0 H2' C A 5 30.525 31.032 16.873 1.00 0.21 H new ATOM 0 HO2' C A 5 30.777 32.955 15.145 1.00 0.26 H new ATOM 0 H1' C A 5 28.319 32.579 17.340 1.00 0.22 H new ATOM 0 H41 C A 5 26.583 26.577 19.513 1.00 0.40 H new ATOM 0 H42 C A 5 27.578 27.251 20.808 1.00 0.40 H new ATOM 0 H5 C A 5 26.250 27.689 17.424 1.00 0.28 H new ATOM 0 H6 C A 5 26.824 29.645 16.051 1.00 0.24 H new ATOM 161 P A A 6 31.528 29.836 13.412 1.00 0.22 P ATOM 162 OP1 A A 6 32.204 30.188 12.136 1.00 0.28 O ATOM 163 OP2 A A 6 30.708 28.616 13.486 1.00 0.28 O ATOM 164 O5' A A 6 32.632 29.770 14.569 1.00 0.23 O ATOM 165 C5' A A 6 33.619 30.786 14.665 1.00 0.20 C ATOM 166 C4' A A 6 34.124 30.927 16.084 1.00 0.19 C ATOM 167 O4' A A 6 33.030 31.083 16.992 1.00 0.24 O ATOM 168 C3' A A 6 34.909 29.695 16.505 1.00 0.20 C ATOM 169 O3' A A 6 36.296 29.785 16.144 1.00 0.23 O ATOM 170 C2' A A 6 34.708 29.733 18.009 1.00 0.22 C ATOM 171 O2' A A 6 35.607 30.652 18.641 1.00 0.26 O ATOM 172 C1' A A 6 33.266 30.223 18.100 1.00 0.22 C ATOM 173 N9 A A 6 32.340 29.079 18.097 1.00 0.23 N ATOM 174 C8 A A 6 31.425 28.693 17.151 1.00 0.27 C ATOM 175 N7 A A 6 30.806 27.571 17.425 1.00 0.29 N ATOM 176 C5 A A 6 31.363 27.187 18.649 1.00 0.26 C ATOM 177 C6 A A 6 31.146 26.086 19.496 1.00 0.30 C ATOM 178 N6 A A 6 30.288 25.105 19.222 1.00 0.35 N ATOM 179 N1 A A 6 31.868 26.024 20.628 1.00 0.29 N ATOM 180 C2 A A 6 32.745 26.981 20.929 1.00 0.26 C ATOM 181 N3 A A 6 33.024 28.053 20.204 1.00 0.23 N ATOM 182 C4 A A 6 32.287 28.094 19.070 1.00 0.23 C ATOM 0 H5' A A 6 33.201 31.735 14.329 1.00 0.20 H new ATOM 0 H5'' A A 6 34.452 30.552 14.002 1.00 0.20 H new ATOM 0 H4' A A 6 34.768 31.806 16.113 1.00 0.19 H new ATOM 0 H3' A A 6 34.583 28.770 16.029 1.00 0.20 H new ATOM 0 H2' A A 6 34.896 28.781 18.506 1.00 0.22 H new ATOM 0 HO2' A A 6 36.230 30.158 19.214 1.00 0.26 H new ATOM 0 H1' A A 6 33.100 30.769 19.029 1.00 0.22 H new ATOM 0 H8 A A 6 31.231 29.265 16.256 1.00 0.27 H new ATOM 0 H61 A A 6 30.173 24.331 19.876 1.00 0.35 H new ATOM 0 H62 A A 6 29.746 25.128 18.358 1.00 0.35 H new ATOM 0 H2 A A 6 33.283 26.871 21.859 1.00 0.26 H new ATOM 194 P C A 7 37.173 28.440 15.926 1.00 0.26 P ATOM 195 OP1 C A 7 38.259 28.742 14.966 1.00 0.38 O ATOM 196 OP2 C A 7 36.256 27.315 15.642 1.00 0.38 O ATOM 197 O5' C A 7 37.813 28.207 17.394 1.00 0.26 O ATOM 198 C5' C A 7 38.535 29.245 18.056 1.00 0.25 C ATOM 199 C4' C A 7 38.599 29.028 19.572 1.00 0.24 C ATOM 200 O4' C A 7 37.288 29.061 20.154 1.00 0.27 O ATOM 201 C3' C A 7 39.220 27.678 19.906 1.00 0.24 C ATOM 202 O3' C A 7 40.642 27.756 20.088 1.00 0.28 O ATOM 203 C2' C A 7 38.539 27.337 21.210 1.00 0.26 C ATOM 204 O2' C A 7 39.176 27.973 22.338 1.00 0.31 O ATOM 205 C1' C A 7 37.143 27.903 20.978 1.00 0.27 C ATOM 206 N1 C A 7 36.271 26.905 20.330 1.00 0.28 N ATOM 207 C2 C A 7 35.707 25.924 21.127 1.00 0.33 C ATOM 208 O2 C A 7 35.953 25.867 22.326 1.00 0.38 O ATOM 209 N3 C A 7 34.887 25.009 20.533 1.00 0.39 N ATOM 210 C4 C A 7 34.641 25.064 19.218 1.00 0.40 C ATOM 211 N4 C A 7 33.836 24.164 18.665 1.00 0.51 N ATOM 212 C5 C A 7 35.238 26.071 18.404 1.00 0.37 C ATOM 213 C6 C A 7 36.035 26.958 18.998 1.00 0.30 C ATOM 0 H5' C A 7 38.062 30.205 17.847 1.00 0.25 H new ATOM 0 H5'' C A 7 39.547 29.295 17.654 1.00 0.25 H new ATOM 0 H4' C A 7 39.210 29.834 19.978 1.00 0.24 H new ATOM 0 H3' C A 7 39.084 26.943 19.113 1.00 0.24 H new ATOM 0 H2' C A 7 38.563 26.274 21.450 1.00 0.26 H new ATOM 0 HO2' C A 7 38.704 27.727 23.161 1.00 0.31 H new ATOM 0 H1' C A 7 36.675 28.164 21.927 1.00 0.27 H new ATOM 0 H41 C A 7 33.643 24.199 17.664 1.00 0.51 H new ATOM 0 H42 C A 7 33.410 23.438 19.241 1.00 0.51 H new ATOM 0 H5 C A 7 35.050 26.113 17.341 1.00 0.37 H new ATOM 0 H6 C A 7 36.501 27.733 18.407 1.00 0.30 H new ATOM 225 P A A 8 41.560 26.498 19.698 1.00 0.27 P ATOM 226 OP1 A A 8 42.982 26.858 19.880 1.00 0.34 O ATOM 227 OP2 A A 8 41.109 25.996 18.389 1.00 0.34 O ATOM 228 O5' A A 8 41.165 25.384 20.803 1.00 0.25 O ATOM 229 C5' A A 8 41.026 25.721 22.184 1.00 0.24 C ATOM 230 C4' A A 8 40.040 24.795 22.881 1.00 0.20 C ATOM 231 O4' A A 8 38.795 24.730 22.164 1.00 0.22 O ATOM 232 C3' A A 8 40.596 23.381 22.954 1.00 0.17 C ATOM 233 O3' A A 8 41.346 23.131 24.145 1.00 0.20 O ATOM 234 C2' A A 8 39.316 22.550 22.930 1.00 0.18 C ATOM 235 O2' A A 8 38.717 22.453 24.232 1.00 0.26 O ATOM 236 C1' A A 8 38.471 23.351 21.971 1.00 0.20 C ATOM 237 N9 A A 8 38.767 22.911 20.600 1.00 0.22 N ATOM 238 C8 A A 8 39.052 23.646 19.486 1.00 0.27 C ATOM 239 N7 A A 8 39.358 22.936 18.432 1.00 0.29 N ATOM 240 C5 A A 8 39.284 21.624 18.902 1.00 0.26 C ATOM 241 C6 A A 8 39.489 20.369 18.297 1.00 0.29 C ATOM 242 N6 A A 8 39.873 20.220 17.036 1.00 0.34 N ATOM 243 N1 A A 8 39.321 19.283 19.055 1.00 0.30 N ATOM 244 C2 A A 8 38.962 19.407 20.331 1.00 0.28 C ATOM 245 N3 A A 8 38.740 20.530 20.996 1.00 0.24 N ATOM 246 C4 A A 8 38.922 21.606 20.213 1.00 0.22 C ATOM 0 H5' A A 8 40.687 26.753 22.277 1.00 0.24 H new ATOM 0 H5'' A A 8 41.997 25.659 22.676 1.00 0.24 H new ATOM 0 H4' A A 8 39.877 25.198 23.881 1.00 0.20 H new ATOM 0 H3' A A 8 41.303 23.162 22.154 1.00 0.17 H new ATOM 0 H2' A A 8 39.459 21.511 22.635 1.00 0.18 H new ATOM 0 HO2' A A 8 37.767 22.684 24.173 1.00 0.26 H new ATOM 0 H1' A A 8 37.405 23.206 22.146 1.00 0.20 H new ATOM 0 H8 A A 8 39.027 24.726 19.476 1.00 0.27 H new ATOM 0 H61 A A 8 40.006 19.285 16.650 1.00 0.34 H new ATOM 0 H62 A A 8 40.035 21.040 16.452 1.00 0.34 H new ATOM 0 H2 A A 8 38.838 18.489 20.886 1.00 0.28 H new ATOM 258 P G A 9 41.736 21.615 24.554 1.00 0.20 P ATOM 259 OP1 G A 9 40.966 21.249 25.760 1.00 0.32 O ATOM 260 OP2 G A 9 43.207 21.502 24.570 1.00 0.33 O ATOM 261 O5' G A 9 41.168 20.760 23.305 1.00 0.20 O ATOM 262 C5' G A 9 40.719 19.407 23.461 1.00 0.19 C ATOM 263 C4' G A 9 41.594 18.430 22.700 1.00 0.18 C ATOM 264 O4' G A 9 41.464 18.650 21.312 1.00 0.21 O ATOM 265 C3' G A 9 43.056 18.578 23.124 1.00 0.19 C ATOM 266 O3' G A 9 43.562 17.362 23.692 1.00 0.20 O ATOM 267 C2' G A 9 43.797 18.954 21.832 1.00 0.27 C ATOM 268 O2' G A 9 44.889 18.071 21.579 1.00 0.43 O ATOM 269 C1' G A 9 42.744 18.836 20.734 1.00 0.21 C ATOM 270 N9 G A 9 42.778 20.041 19.893 1.00 0.21 N ATOM 271 C8 G A 9 42.308 21.292 20.166 1.00 0.31 C ATOM 272 N7 G A 9 42.521 22.177 19.240 1.00 0.39 N ATOM 273 C5 G A 9 43.181 21.440 18.249 1.00 0.34 C ATOM 274 C6 G A 9 43.667 21.843 16.977 1.00 0.44 C ATOM 275 O6 G A 9 43.632 22.961 16.458 1.00 0.55 O ATOM 276 N1 G A 9 44.267 20.788 16.310 1.00 0.47 N ATOM 277 C2 G A 9 44.373 19.505 16.794 1.00 0.44 C ATOM 278 N2 G A 9 45.001 18.630 16.022 1.00 0.59 N ATOM 279 N3 G A 9 43.923 19.121 17.981 1.00 0.34 N ATOM 280 C4 G A 9 43.327 20.130 18.642 1.00 0.26 C ATOM 0 H5' G A 9 39.691 19.323 23.110 1.00 0.19 H new ATOM 0 H5'' G A 9 40.717 19.145 24.519 1.00 0.19 H new ATOM 0 H4' G A 9 41.270 17.415 22.931 1.00 0.18 H new ATOM 0 H3' G A 9 43.186 19.331 23.901 1.00 0.19 H new ATOM 0 H2' G A 9 44.229 19.953 21.891 1.00 0.27 H new ATOM 0 HO2' G A 9 44.642 17.161 21.844 1.00 0.43 H new ATOM 0 H1' G A 9 42.959 17.971 20.107 1.00 0.21 H new ATOM 0 H8 G A 9 41.795 21.529 21.086 1.00 0.31 H new ATOM 0 H1 G A 9 44.661 20.977 15.388 1.00 0.47 H new ATOM 0 H21 G A 9 45.109 17.664 16.330 1.00 0.59 H new ATOM 0 H22 G A 9 45.376 18.923 15.120 1.00 0.59 H new ATOM 292 P U A 10 43.422 17.060 25.275 1.00 0.21 P ATOM 293 OP1 U A 10 43.002 18.296 25.961 1.00 0.28 O ATOM 294 OP2 U A 10 44.635 16.347 25.737 1.00 0.33 O ATOM 295 O5' U A 10 42.189 16.009 25.319 1.00 0.20 O ATOM 296 C5' U A 10 40.846 16.457 25.546 1.00 0.22 C ATOM 297 C4' U A 10 39.881 15.882 24.525 1.00 0.20 C ATOM 298 O4' U A 10 40.335 16.149 23.205 1.00 0.19 O ATOM 299 C3' U A 10 39.753 14.362 24.690 1.00 0.23 C ATOM 300 O3' U A 10 38.426 13.915 24.401 1.00 0.21 O ATOM 301 C2' U A 10 40.740 13.852 23.652 1.00 0.29 C ATOM 302 O2' U A 10 40.395 12.533 23.200 1.00 0.41 O ATOM 303 C1' U A 10 40.578 14.909 22.563 1.00 0.23 C ATOM 304 N1 U A 10 41.770 14.982 21.691 1.00 0.23 N ATOM 305 C2 U A 10 41.563 15.022 20.321 1.00 0.31 C ATOM 306 O2 U A 10 40.444 14.956 19.818 1.00 0.41 O ATOM 307 N3 U A 10 42.696 15.123 19.541 1.00 0.36 N ATOM 308 C4 U A 10 43.999 15.182 20.000 1.00 0.34 C ATOM 309 O4 U A 10 44.927 15.282 19.212 1.00 0.40 O ATOM 310 C5 U A 10 44.124 15.126 21.438 1.00 0.31 C ATOM 311 C6 U A 10 43.032 15.032 22.226 1.00 0.26 C ATOM 0 H5' U A 10 40.814 17.546 25.504 1.00 0.22 H new ATOM 0 H5'' U A 10 40.530 16.167 26.548 1.00 0.22 H new ATOM 0 H4' U A 10 38.912 16.353 24.690 1.00 0.20 H new ATOM 0 H3' U A 10 39.953 14.012 25.703 1.00 0.23 H new ATOM 0 H2' U A 10 41.764 13.739 24.007 1.00 0.29 H new ATOM 0 HO2' U A 10 39.426 12.407 23.269 1.00 0.41 H new ATOM 0 H1' U A 10 39.743 14.648 21.913 1.00 0.23 H new ATOM 0 H3 U A 10 42.560 15.157 18.531 1.00 0.36 H new ATOM 0 H5 U A 10 45.105 15.160 21.889 1.00 0.31 H new ATOM 0 H6 U A 10 43.154 14.995 23.298 1.00 0.26 H new ATOM 322 P U A 11 37.264 14.095 25.497 1.00 0.17 P ATOM 323 OP1 U A 11 37.702 13.502 26.772 1.00 0.25 O ATOM 324 OP2 U A 11 35.992 13.647 24.892 1.00 0.23 O ATOM 325 O5' U A 11 37.216 15.696 25.671 1.00 0.24 O ATOM 326 C5' U A 11 36.285 16.455 24.917 1.00 0.23 C ATOM 327 C4' U A 11 36.520 17.956 25.051 1.00 0.21 C ATOM 328 O4' U A 11 37.179 18.486 23.909 1.00 0.22 O ATOM 329 C3' U A 11 35.197 18.680 25.182 1.00 0.19 C ATOM 330 O3' U A 11 34.742 18.704 26.540 1.00 0.21 O ATOM 331 C2' U A 11 35.547 20.074 24.665 1.00 0.22 C ATOM 332 O2' U A 11 36.019 20.943 25.701 1.00 0.29 O ATOM 333 C1' U A 11 36.642 19.787 23.654 1.00 0.20 C ATOM 334 N1 U A 11 36.079 19.875 22.289 1.00 0.21 N ATOM 335 C2 U A 11 35.892 21.148 21.761 1.00 0.23 C ATOM 336 O2 U A 11 36.132 22.173 22.400 1.00 0.29 O ATOM 337 N3 U A 11 35.360 21.199 20.490 1.00 0.28 N ATOM 338 C4 U A 11 35.003 20.107 19.702 1.00 0.30 C ATOM 339 O4 U A 11 34.531 20.277 18.582 1.00 0.37 O ATOM 340 C5 U A 11 35.225 18.819 20.327 1.00 0.30 C ATOM 341 C6 U A 11 35.749 18.739 21.573 1.00 0.27 C ATOM 0 H5' U A 11 35.274 16.217 25.246 1.00 0.23 H new ATOM 0 H5'' U A 11 36.353 16.171 23.867 1.00 0.23 H new ATOM 0 H4' U A 11 37.140 18.102 25.935 1.00 0.21 H new ATOM 0 H3' U A 11 34.378 18.210 24.637 1.00 0.19 H new ATOM 0 H2' U A 11 34.684 20.594 24.249 1.00 0.22 H new ATOM 0 HO2' U A 11 35.584 21.817 25.618 1.00 0.29 H new ATOM 0 H1' U A 11 37.446 20.518 23.741 1.00 0.20 H new ATOM 0 H3 U A 11 35.214 22.125 20.088 1.00 0.28 H new ATOM 0 H5 U A 11 34.970 17.915 19.794 1.00 0.30 H new ATOM 0 H6 U A 11 35.913 17.768 22.017 1.00 0.27 H new ATOM 352 P U A 12 33.220 19.119 26.869 1.00 0.22 P ATOM 353 OP1 U A 12 32.922 18.755 28.264 1.00 0.27 O ATOM 354 OP2 U A 12 32.352 18.615 25.787 1.00 0.27 O ATOM 355 O5' U A 12 33.276 20.727 26.757 1.00 0.26 O ATOM 356 C5' U A 12 33.994 21.502 27.718 1.00 0.23 C ATOM 357 C4' U A 12 34.009 22.982 27.363 1.00 0.22 C ATOM 358 O4' U A 12 34.701 23.208 26.135 1.00 0.26 O ATOM 359 C3' U A 12 32.594 23.521 27.199 1.00 0.21 C ATOM 360 O3' U A 12 32.021 23.936 28.444 1.00 0.20 O ATOM 361 C2' U A 12 32.836 24.705 26.275 1.00 0.24 C ATOM 362 O2' U A 12 33.230 25.870 27.013 1.00 0.29 O ATOM 363 C1' U A 12 33.968 24.188 25.392 1.00 0.24 C ATOM 364 N1 U A 12 33.421 23.610 24.145 1.00 0.22 N ATOM 365 C2 U A 12 33.135 24.482 23.114 1.00 0.25 C ATOM 366 O2 U A 12 33.330 25.692 23.211 1.00 0.31 O ATOM 367 N3 U A 12 32.605 23.919 21.969 1.00 0.27 N ATOM 368 C4 U A 12 32.345 22.577 21.763 1.00 0.27 C ATOM 369 O4 U A 12 31.850 22.191 20.702 1.00 0.34 O ATOM 370 C5 U A 12 32.679 21.736 22.891 1.00 0.26 C ATOM 371 C6 U A 12 33.196 22.269 24.026 1.00 0.25 C ATOM 0 H5' U A 12 35.018 21.136 27.787 1.00 0.23 H new ATOM 0 H5'' U A 12 33.542 21.370 28.701 1.00 0.23 H new ATOM 0 H4' U A 12 34.515 23.495 28.181 1.00 0.22 H new ATOM 0 H3' U A 12 31.885 22.785 26.818 1.00 0.21 H new ATOM 0 H2' U A 12 31.954 25.019 25.716 1.00 0.24 H new ATOM 0 HO2' U A 12 32.521 26.545 26.962 1.00 0.29 H new ATOM 0 H1' U A 12 34.633 25.004 25.110 1.00 0.24 H new ATOM 0 H3 U A 12 32.384 24.554 21.202 1.00 0.27 H new ATOM 0 H5 U A 12 32.515 20.670 22.829 1.00 0.26 H new ATOM 0 H6 U A 12 33.435 21.618 24.854 1.00 0.25 H new ATOM 382 P G A 13 30.458 24.286 28.547 1.00 0.21 P ATOM 383 OP1 G A 13 29.992 23.975 29.917 1.00 0.31 O ATOM 384 OP2 G A 13 29.752 23.683 27.400 1.00 0.28 O ATOM 385 O5' G A 13 30.443 25.896 28.346 1.00 0.27 O ATOM 386 C5' G A 13 31.130 26.760 29.252 1.00 0.23 C ATOM 387 C4' G A 13 31.247 28.182 28.709 1.00 0.23 C ATOM 388 O4' G A 13 31.952 28.179 27.467 1.00 0.26 O ATOM 389 C3' G A 13 29.857 28.788 28.477 1.00 0.21 C ATOM 390 O3' G A 13 29.403 29.526 29.620 1.00 0.22 O ATOM 391 C2' G A 13 30.097 29.674 27.259 1.00 0.24 C ATOM 392 O2' G A 13 30.555 30.979 27.628 1.00 0.30 O ATOM 393 C1' G A 13 31.170 28.893 26.511 1.00 0.24 C ATOM 394 N9 G A 13 30.555 27.972 25.550 1.00 0.23 N ATOM 395 C8 G A 13 30.256 26.652 25.694 1.00 0.24 C ATOM 396 N7 G A 13 29.707 26.094 24.654 1.00 0.26 N ATOM 397 C5 G A 13 29.628 27.143 23.740 1.00 0.25 C ATOM 398 C6 G A 13 29.115 27.160 22.421 1.00 0.30 C ATOM 399 O6 G A 13 28.623 26.233 21.788 1.00 0.36 O ATOM 400 N1 G A 13 29.234 28.420 21.847 1.00 0.34 N ATOM 401 C2 G A 13 29.775 29.521 22.463 1.00 0.34 C ATOM 402 N2 G A 13 29.804 30.645 21.751 1.00 0.45 N ATOM 403 N3 G A 13 30.260 29.509 23.702 1.00 0.30 N ATOM 404 C4 G A 13 30.149 28.299 24.277 1.00 0.24 C ATOM 0 H5' G A 13 32.126 26.363 29.446 1.00 0.23 H new ATOM 0 H5'' G A 13 30.603 26.778 30.206 1.00 0.23 H new ATOM 0 H4' G A 13 31.788 28.777 29.445 1.00 0.23 H new ATOM 0 H3' G A 13 29.070 28.050 28.319 1.00 0.21 H new ATOM 0 H2' G A 13 29.198 29.863 26.673 1.00 0.24 H new ATOM 0 HO2' G A 13 30.698 31.516 26.821 1.00 0.30 H new ATOM 0 H1' G A 13 31.808 29.576 25.950 1.00 0.24 H new ATOM 0 H8 G A 13 30.459 26.108 26.604 1.00 0.24 H new ATOM 0 H1 G A 13 28.892 28.536 20.893 1.00 0.34 H new ATOM 0 H21 G A 13 30.194 31.496 22.156 1.00 0.45 H new ATOM 0 H22 G A 13 29.436 30.656 20.800 1.00 0.45 H new ATOM 416 P C A 14 27.870 30.008 29.723 1.00 0.26 P ATOM 417 OP1 C A 14 27.772 31.023 30.786 1.00 0.41 O ATOM 418 OP2 C A 14 26.996 28.819 29.774 1.00 0.34 O ATOM 419 O5' C A 14 27.649 30.740 28.302 1.00 0.30 O ATOM 420 C5' C A 14 27.993 32.120 28.131 1.00 0.30 C ATOM 421 C4' C A 14 27.331 32.707 26.898 1.00 0.26 C ATOM 422 O4' C A 14 27.804 32.080 25.714 1.00 0.28 O ATOM 423 C3' C A 14 25.831 32.488 26.954 1.00 0.25 C ATOM 424 O3' C A 14 25.182 33.510 27.714 1.00 0.28 O ATOM 425 C2' C A 14 25.460 32.529 25.474 1.00 0.26 C ATOM 426 O2' C A 14 25.272 33.873 25.013 1.00 0.34 O ATOM 427 C1' C A 14 26.691 31.890 24.836 1.00 0.25 C ATOM 428 N1 C A 14 26.465 30.447 24.591 1.00 0.24 N ATOM 429 C2 C A 14 25.816 30.094 23.423 1.00 0.29 C ATOM 430 O2 C A 14 25.481 30.966 22.623 1.00 0.38 O ATOM 431 N3 C A 14 25.575 28.779 23.183 1.00 0.31 N ATOM 432 C4 C A 14 25.945 27.845 24.063 1.00 0.32 C ATOM 433 N4 C A 14 25.684 26.567 23.799 1.00 0.39 N ATOM 434 C5 C A 14 26.624 28.199 25.273 1.00 0.31 C ATOM 435 C6 C A 14 26.854 29.506 25.501 1.00 0.27 C ATOM 0 H5' C A 14 29.075 32.219 28.047 1.00 0.30 H new ATOM 0 H5'' C A 14 27.689 32.684 29.013 1.00 0.30 H new ATOM 0 H4' C A 14 27.571 33.770 26.880 1.00 0.26 H new ATOM 0 H3' C A 14 25.527 31.565 27.448 1.00 0.25 H new ATOM 0 H2' C A 14 24.522 32.026 25.239 1.00 0.26 H new ATOM 0 HO2' C A 14 24.501 33.907 24.409 1.00 0.34 H new ATOM 0 H1' C A 14 26.892 32.360 23.873 1.00 0.25 H new ATOM 0 H41 C A 14 25.961 25.843 24.462 1.00 0.39 H new ATOM 0 H42 C A 14 25.207 26.312 22.934 1.00 0.39 H new ATOM 0 H5 C A 14 26.940 27.444 25.978 1.00 0.31 H new ATOM 0 H6 C A 14 27.350 29.812 26.410 1.00 0.27 H new ATOM 447 P U A 15 23.629 33.373 28.101 1.00 0.26 P ATOM 448 OP1 U A 15 23.312 34.385 29.124 1.00 0.35 O ATOM 449 OP2 U A 15 23.334 31.953 28.364 1.00 0.31 O ATOM 450 O5' U A 15 22.913 33.798 26.722 1.00 0.25 O ATOM 451 C5' U A 15 23.072 35.119 26.188 1.00 0.23 C ATOM 452 C4' U A 15 22.361 35.278 24.848 1.00 0.23 C ATOM 453 O4' U A 15 22.920 34.405 23.871 1.00 0.26 O ATOM 454 C3' U A 15 20.887 34.936 24.987 1.00 0.25 C ATOM 455 O3' U A 15 20.103 36.067 25.394 1.00 0.28 O ATOM 456 C2' U A 15 20.541 34.497 23.566 1.00 0.28 C ATOM 457 O2' U A 15 20.195 35.631 22.745 1.00 0.37 O ATOM 458 C1' U A 15 21.847 33.846 23.106 1.00 0.26 C ATOM 459 N1 U A 15 21.791 32.374 23.261 1.00 0.26 N ATOM 460 C2 U A 15 21.191 31.655 22.240 1.00 0.31 C ATOM 461 O2 U A 15 20.692 32.194 21.255 1.00 0.41 O ATOM 462 N3 U A 15 21.192 30.281 22.389 1.00 0.32 N ATOM 463 C4 U A 15 21.721 29.567 23.442 1.00 0.36 C ATOM 464 O4 U A 15 21.662 28.336 23.464 1.00 0.46 O ATOM 465 C5 U A 15 22.325 30.391 24.463 1.00 0.38 C ATOM 466 C6 U A 15 22.347 31.743 24.347 1.00 0.32 C ATOM 0 H5' U A 15 24.133 35.336 26.064 1.00 0.23 H new ATOM 0 H5'' U A 15 22.678 35.847 26.897 1.00 0.23 H new ATOM 0 H4' U A 15 22.484 36.315 24.535 1.00 0.23 H new ATOM 0 H3' U A 15 20.683 34.185 25.751 1.00 0.25 H new ATOM 0 H2' U A 15 19.679 33.832 23.504 1.00 0.28 H new ATOM 0 HO2' U A 15 19.271 35.539 22.433 1.00 0.37 H new ATOM 0 H1' U A 15 22.007 34.046 22.047 1.00 0.26 H new ATOM 0 H3 U A 15 20.756 29.740 21.642 1.00 0.32 H new ATOM 0 H5 U A 15 22.766 29.924 25.332 1.00 0.38 H new ATOM 0 H6 U A 15 22.810 32.334 25.123 1.00 0.32 H new ATOM 477 P C A 16 18.761 35.841 26.271 1.00 0.32 P ATOM 478 OP1 C A 16 18.316 37.156 26.783 1.00 0.43 O ATOM 479 OP2 C A 16 19.004 34.738 27.217 1.00 0.39 O ATOM 480 O5' C A 16 17.717 35.333 25.150 1.00 0.33 O ATOM 481 C5' C A 16 17.216 36.238 24.165 1.00 0.40 C ATOM 482 C4' C A 16 16.690 35.527 22.911 1.00 0.36 C ATOM 483 O4' C A 16 17.634 34.590 22.418 1.00 0.40 O ATOM 484 C3' C A 16 15.405 34.767 23.195 1.00 0.30 C ATOM 485 O3' C A 16 14.245 35.617 23.121 1.00 0.30 O ATOM 486 C2' C A 16 15.425 33.731 22.067 1.00 0.35 C ATOM 487 O2' C A 16 14.826 34.237 20.863 1.00 0.43 O ATOM 488 C1' C A 16 16.913 33.488 21.872 1.00 0.38 C ATOM 489 N1 C A 16 17.313 32.221 22.539 1.00 0.36 N ATOM 490 C2 C A 16 16.973 31.033 21.924 1.00 0.42 C ATOM 491 O2 C A 16 16.400 31.039 20.841 1.00 0.50 O ATOM 492 N3 C A 16 17.292 29.859 22.547 1.00 0.44 N ATOM 493 C4 C A 16 17.931 29.843 23.719 1.00 0.39 C ATOM 494 N4 C A 16 18.225 28.677 24.275 1.00 0.46 N ATOM 495 C5 C A 16 18.295 31.053 24.372 1.00 0.36 C ATOM 496 C6 C A 16 17.977 32.220 23.748 1.00 0.33 C ATOM 0 H5' C A 16 18.008 36.930 23.879 1.00 0.40 H new ATOM 0 H5'' C A 16 16.415 36.834 24.601 1.00 0.40 H new ATOM 0 H4' C A 16 16.507 36.309 22.174 1.00 0.36 H new ATOM 0 H3' C A 16 15.350 34.341 24.197 1.00 0.30 H new ATOM 0 H2' C A 16 14.857 32.832 22.305 1.00 0.35 H new ATOM 0 HO2' C A 16 13.987 33.761 20.690 1.00 0.43 H new ATOM 0 H1' C A 16 17.139 33.399 20.809 1.00 0.38 H new ATOM 0 H41 C A 16 18.713 28.647 25.170 1.00 0.46 H new ATOM 0 H42 C A 16 17.963 27.809 23.808 1.00 0.46 H new ATOM 0 H5 C A 16 18.803 31.046 25.325 1.00 0.36 H new ATOM 0 H6 C A 16 18.249 33.159 24.206 1.00 0.33 H new ATOM 508 P A A 17 12.903 35.222 23.933 1.00 0.26 P ATOM 509 OP1 A A 17 12.021 36.408 24.005 1.00 0.36 O ATOM 510 OP2 A A 17 13.309 34.564 25.179 1.00 0.34 O ATOM 511 O5' A A 17 12.213 34.129 22.988 1.00 0.28 O ATOM 512 C5' A A 17 11.573 34.523 21.780 1.00 0.28 C ATOM 513 C4' A A 17 11.119 33.324 20.977 1.00 0.28 C ATOM 514 O4' A A 17 12.233 32.536 20.532 1.00 0.34 O ATOM 515 C3' A A 17 10.199 32.427 21.806 1.00 0.27 C ATOM 516 O3' A A 17 8.828 32.819 21.719 1.00 0.33 O ATOM 517 C2' A A 17 10.437 31.083 21.144 1.00 0.28 C ATOM 518 O2' A A 17 9.590 30.905 20.010 1.00 0.36 O ATOM 519 C1' A A 17 11.916 31.167 20.742 1.00 0.30 C ATOM 520 N9 A A 17 12.761 30.595 21.789 1.00 0.30 N ATOM 521 C8 A A 17 13.352 31.233 22.852 1.00 0.29 C ATOM 522 N7 A A 17 13.984 30.436 23.659 1.00 0.33 N ATOM 523 C5 A A 17 13.805 29.165 23.078 1.00 0.37 C ATOM 524 C6 A A 17 14.230 27.877 23.431 1.00 0.45 C ATOM 525 N6 A A 17 14.944 27.640 24.528 1.00 0.50 N ATOM 526 N1 A A 17 13.887 26.836 22.619 1.00 0.51 N ATOM 527 C2 A A 17 13.143 27.063 21.524 1.00 0.51 C ATOM 528 N3 A A 17 12.697 28.253 21.093 1.00 0.44 N ATOM 529 C4 A A 17 13.063 29.260 21.930 1.00 0.36 C ATOM 0 H5' A A 17 12.259 35.124 21.183 1.00 0.28 H new ATOM 0 H5'' A A 17 10.715 35.154 22.011 1.00 0.28 H new ATOM 0 H4' A A 17 10.581 33.713 20.112 1.00 0.28 H new ATOM 0 H3' A A 17 10.406 32.453 22.876 1.00 0.27 H new ATOM 0 H2' A A 17 10.215 30.233 21.790 1.00 0.28 H new ATOM 0 HO2' A A 17 8.747 31.383 20.153 1.00 0.36 H new ATOM 0 HO3' A A 17 8.280 32.216 22.263 1.00 0.33 H new ATOM 0 H1' A A 17 12.095 30.598 19.830 1.00 0.30 H new ATOM 0 H8 A A 17 13.296 32.301 23.003 1.00 0.29 H new ATOM 0 H61 A A 17 15.235 26.688 24.751 1.00 0.50 H new ATOM 0 H62 A A 17 15.201 28.410 25.146 1.00 0.50 H new ATOM 0 H2 A A 17 12.877 26.201 20.931 1.00 0.51 H new TER 542 A A 17