HEADER RNA 21-DEC-93 XXXX TITLE CRYSTAL STRUCTURE OF AN RNA DOUBLE HELIX INCORPORATING A TITLE 2 TRACK OF NON-WATSON-CRICK BASE PAIRS COMPND 5'-R(*P*GP*GP*AP*CP*UP*UP*CP*GP*GP*UP*CP*C)-3' KEYWDS A-RNA, DOUBLE HELIX, MISMATCHED EXPDTA X-RAY DIFFRACTION AUTHOR S.R.HOLBROOK, C.CHEONG, I.TINOCO JR, S.-H.KIM JRNL AUTH S.R.HOLBROOK, C.CHEONG, I.TINOCO JR., S.H.KIM JRNL TITL CRYSTAL STRUCTURE OF AN RNA DOUBLE HELIX JRNL TITL 2 INCORPORATING A TRACK OF NON-WATSON-CRICK BASE JRNL TITL 3 PAIRS. JRNL REF NATURE V. 353 579 1991 JRNL REFN ASTM NATUAS UK ISSN 0028-0836 JRNL PMID 1922368 JRNL DOI 10.1038/353579A0 SEQRES 1 A 12 G G A C U U C G G U C C FORMUL 2 HOH *47(H2 O) CRYST1 38.280 32.280 36.380 90.00 124.80 90.00 C 1 2 1 4 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.026123 0.000000 0.018156 0.00000 SCALE2 0.000000 0.030979 0.000000 0.00000 SCALE3 0.000000 0.000000 0.033475 0.00000 MODEL 1 ATOM 1 OP3 G A 1 8.893 36.412 2.241 1.00 32.40 O ATOM 2 P G A 1 7.818 35.669 1.255 1.00 32.55 P ATOM 3 OP1 G A 1 7.212 34.572 2.181 1.00 32.01 O ATOM 4 OP2 G A 1 8.815 35.217 0.149 1.00 31.90 O ATOM 5 O5' G A 1 6.644 36.702 1.016 1.00 29.61 O ATOM 6 C5' G A 1 7.092 38.058 0.866 1.00 25.81 C ATOM 7 C4' G A 1 5.804 38.801 0.627 1.00 22.69 C ATOM 8 O4' G A 1 4.892 38.123 -0.209 1.00 21.38 O ATOM 9 C3' G A 1 5.043 38.994 1.942 1.00 21.94 C ATOM 10 O3' G A 1 5.763 39.898 2.778 1.00 22.29 O ATOM 11 C2' G A 1 3.635 39.317 1.434 1.00 20.38 C ATOM 12 O2' G A 1 3.696 40.673 1.016 1.00 21.09 O ATOM 13 C1' G A 1 3.585 38.381 0.239 1.00 17.45 C ATOM 14 N9 G A 1 3.047 37.057 0.627 1.00 15.64 N ATOM 15 C8 G A 1 3.596 35.863 0.388 1.00 13.98 C ATOM 16 N7 G A 1 2.791 34.895 0.777 1.00 14.02 N ATOM 17 C5 G A 1 1.637 35.508 1.225 1.00 13.08 C ATOM 18 C6 G A 1 0.424 34.992 1.703 1.00 13.33 C ATOM 19 O6 G A 1 0.070 33.829 1.882 1.00 13.54 O ATOM 20 N1 G A 1 -0.490 35.960 1.972 1.00 12.82 N ATOM 21 C2 G A 1 -0.254 37.283 1.852 1.00 12.50 C ATOM 22 N2 G A 1 -1.289 38.026 2.241 1.00 13.22 N ATOM 23 N3 G A 1 0.862 37.832 1.404 1.00 13.63 N ATOM 24 C4 G A 1 1.779 36.864 1.075 1.00 13.72 C ATOM 25 P G A 2 5.596 39.608 4.451 1.00 21.60 P ATOM 26 OP1 G A 2 6.561 40.705 4.660 1.00 22.08 O ATOM 27 OP2 G A 2 5.940 38.155 4.451 1.00 21.21 O ATOM 28 O5' G A 2 4.184 40.189 4.720 1.00 20.37 O ATOM 29 C5' G A 2 3.755 41.577 4.511 1.00 17.58 C ATOM 30 C4' G A 2 2.348 41.641 5.049 1.00 16.27 C ATOM 31 O4' G A 2 1.451 40.834 4.302 1.00 15.10 O ATOM 32 C3' G A 2 2.253 41.060 6.453 1.00 15.39 C ATOM 33 O3' G A 2 2.754 41.964 7.438 1.00 16.35 O ATOM 34 C2' G A 2 0.753 40.770 6.572 1.00 14.27 C ATOM 35 O2' G A 2 0.102 42.029 6.572 1.00 15.38 O ATOM 36 C1' G A 2 0.504 40.221 5.168 1.00 11.62 C ATOM 37 N9 G A 2 0.754 38.768 5.138 1.00 10.64 N ATOM 38 C8 G A 2 1.814 38.058 4.660 1.00 8.99 C ATOM 39 N7 G A 2 1.672 36.767 4.810 1.00 9.16 N ATOM 40 C5 G A 2 0.362 36.638 5.317 1.00 8.58 C ATOM 41 C6 G A 2 -0.402 35.508 5.646 1.00 8.37 C ATOM 42 O6 G A 2 -0.086 34.346 5.467 1.00 9.09 O ATOM 43 N1 G A 2 -1.618 35.766 6.184 1.00 8.02 N ATOM 44 C2 G A 2 -2.070 37.025 6.393 1.00 7.74 C ATOM 45 N2 G A 2 -3.268 37.154 6.961 1.00 8.93 N ATOM 46 N3 G A 2 -1.403 38.123 6.094 1.00 8.84 N ATOM 47 C4 G A 2 -0.204 37.864 5.527 1.00 8.69 C ATOM 48 P A A 3 3.351 41.222 8.783 1.00 16.71 P ATOM 49 OP1 A A 3 3.583 42.545 9.440 1.00 18.05 O ATOM 50 OP2 A A 3 4.273 40.156 8.723 1.00 16.52 O ATOM 51 O5' A A 3 1.983 40.802 9.649 1.00 15.11 O ATOM 52 C5' A A 3 0.993 41.835 9.918 1.00 12.32 C ATOM 53 C4' A A 3 -0.098 41.028 10.605 1.00 11.08 C ATOM 54 O4' A A 3 -0.735 40.189 9.649 1.00 9.97 O ATOM 55 C3' A A 3 0.321 40.092 11.710 1.00 10.35 C ATOM 56 O3' A A 3 0.677 40.834 12.905 1.00 10.97 O ATOM 57 C2' A A 3 -0.907 39.156 11.770 1.00 9.49 C ATOM 58 O2' A A 3 -1.886 39.898 12.517 1.00 9.21 O ATOM 59 C1' A A 3 -1.327 39.027 10.336 1.00 7.65 C ATOM 60 N9 A A 3 -0.682 37.832 9.739 1.00 6.70 N ATOM 61 C8 A A 3 0.523 37.897 9.052 1.00 5.71 C ATOM 62 N7 A A 3 0.960 36.702 8.753 1.00 5.58 N ATOM 63 C5 A A 3 0.012 35.831 9.291 1.00 4.99 C ATOM 64 C6 A A 3 -0.152 34.443 9.141 1.00 4.72 C ATOM 65 N6 A A 3 0.664 33.571 8.574 1.00 5.10 N ATOM 66 N1 A A 3 -1.260 33.926 9.798 1.00 4.60 N ATOM 67 C2 A A 3 -2.120 34.701 10.486 1.00 3.88 C ATOM 68 N3 A A 3 -2.008 35.992 10.545 1.00 5.82 N ATOM 69 C4 A A 3 -1.033 36.509 9.858 1.00 5.06 C ATOM 70 P C A 4 1.691 40.221 13.981 1.00 10.60 P ATOM 71 OP1 C A 4 1.615 41.254 15.026 1.00 10.90 O ATOM 72 OP2 C A 4 2.938 39.737 13.563 1.00 10.52 O ATOM 73 O5' C A 4 0.763 39.156 14.489 1.00 10.08 O ATOM 74 C5' C A 4 1.163 37.994 15.235 1.00 10.36 C ATOM 75 C4' C A 4 -0.027 37.057 15.295 1.00 9.48 C ATOM 76 O4' C A 4 -0.356 36.638 13.951 1.00 9.65 O ATOM 77 C3' C A 4 0.394 35.766 16.012 1.00 9.69 C ATOM 78 O3' C A 4 0.277 35.928 17.446 1.00 10.39 O ATOM 79 C2' C A 4 -0.510 34.733 15.385 1.00 8.81 C ATOM 80 O2' C A 4 -1.733 34.830 16.042 1.00 9.42 O ATOM 81 C1' C A 4 -0.662 35.217 13.951 1.00 7.64 C ATOM 82 N1 C A 4 0.379 34.572 13.114 1.00 6.49 N ATOM 83 C2 C A 4 0.162 33.248 12.875 1.00 5.58 C ATOM 84 O2 C A 4 -0.800 32.635 13.324 1.00 6.89 O ATOM 85 N3 C A 4 1.029 32.571 12.069 1.00 5.73 N ATOM 86 C4 C A 4 2.088 33.216 11.591 1.00 5.61 C ATOM 87 N4 C A 4 2.928 32.441 10.934 1.00 5.23 N ATOM 88 C5 C A 4 2.288 34.604 11.800 1.00 5.30 C ATOM 89 C6 C A 4 1.386 35.250 12.547 1.00 5.82 C ATOM 90 P U A 5 1.474 35.379 18.312 1.00 10.23 P ATOM 91 OP1 U A 5 0.982 35.669 19.627 1.00 10.10 O ATOM 92 OP2 U A 5 2.799 35.605 17.894 1.00 9.43 O ATOM 93 O5' U A 5 1.240 33.765 18.044 1.00 10.71 O ATOM 94 C5' U A 5 0.163 32.958 18.492 1.00 9.77 C ATOM 95 C4' U A 5 0.266 31.538 18.014 1.00 9.28 C ATOM 96 O4' U A 5 0.190 31.473 16.580 1.00 9.44 O ATOM 97 C3' U A 5 1.509 30.763 18.372 1.00 10.23 C ATOM 98 O3' U A 5 1.529 30.408 19.776 1.00 11.45 O ATOM 99 C2' U A 5 1.450 29.633 17.356 1.00 8.89 C ATOM 100 O2' U A 5 0.526 28.697 17.805 1.00 8.98 O ATOM 101 C1' U A 5 0.905 30.311 16.102 1.00 8.04 C ATOM 102 N1 U A 5 2.002 30.795 15.295 1.00 7.20 N ATOM 103 C2 U A 5 2.674 29.859 14.548 1.00 6.62 C ATOM 104 O2 U A 5 2.347 28.697 14.578 1.00 7.19 O ATOM 105 N3 U A 5 3.764 30.246 13.861 1.00 7.03 N ATOM 106 C4 U A 5 4.203 31.570 13.891 1.00 6.95 C ATOM 107 O4 U A 5 5.269 31.764 13.294 1.00 7.45 O ATOM 108 C5 U A 5 3.472 32.506 14.668 1.00 6.75 C ATOM 109 C6 U A 5 2.437 32.086 15.385 1.00 7.01 C ATOM 110 P U A 6 2.910 29.827 20.433 1.00 12.49 P ATOM 111 OP1 U A 6 2.564 30.085 21.867 1.00 13.36 O ATOM 112 OP2 U A 6 4.125 30.214 19.896 1.00 12.32 O ATOM 113 O5' U A 6 2.683 28.213 20.374 1.00 11.34 O ATOM 114 C5' U A 6 1.659 27.373 20.911 1.00 10.43 C ATOM 115 C4' U A 6 2.037 25.953 20.643 1.00 10.34 C ATOM 116 O4' U A 6 1.941 25.727 19.238 1.00 10.31 O ATOM 117 C3' U A 6 3.475 25.598 20.941 1.00 9.51 C ATOM 118 O3' U A 6 3.783 25.372 22.315 1.00 10.95 O ATOM 119 C2' U A 6 3.733 24.371 20.075 1.00 9.04 C ATOM 120 O2' U A 6 3.008 23.338 20.732 1.00 7.12 O ATOM 121 C1' U A 6 2.959 24.791 18.820 1.00 8.40 C ATOM 122 N1 U A 6 3.912 25.372 17.834 1.00 7.63 N ATOM 123 C2 U A 6 4.640 24.468 17.117 1.00 7.42 C ATOM 124 O2 U A 6 4.509 23.274 17.416 1.00 7.28 O ATOM 125 N3 U A 6 5.517 24.920 16.132 1.00 6.99 N ATOM 126 C4 U A 6 5.662 26.244 15.923 1.00 7.02 C ATOM 127 O4 U A 6 6.476 26.566 15.026 1.00 7.68 O ATOM 128 C5 U A 6 4.913 27.147 16.669 1.00 7.40 C ATOM 129 C6 U A 6 4.040 26.728 17.595 1.00 7.31 C ATOM 130 P C A 7 5.223 25.759 22.943 1.00 11.47 P ATOM 131 OP1 C A 7 4.825 25.630 24.287 1.00 12.35 O ATOM 132 OP2 C A 7 5.879 26.986 22.495 1.00 11.49 O ATOM 133 O5' C A 7 6.126 24.501 22.525 1.00 11.00 O ATOM 134 C5' C A 7 5.777 23.177 22.973 1.00 11.53 C ATOM 135 C4' C A 7 6.661 22.273 22.196 1.00 11.20 C ATOM 136 O4' C A 7 6.429 22.402 20.822 1.00 11.07 O ATOM 137 C3' C A 7 8.171 22.531 22.226 1.00 12.00 C ATOM 138 O3' C A 7 8.855 22.047 23.391 1.00 14.28 O ATOM 139 C2' C A 7 8.678 21.789 21.001 1.00 11.48 C ATOM 140 O2' C A 7 8.791 20.433 21.389 1.00 10.97 O ATOM 141 C1' C A 7 7.564 22.047 20.015 1.00 9.64 C ATOM 142 N1 C A 7 7.933 23.242 19.209 1.00 9.68 N ATOM 143 C2 C A 7 8.757 22.951 18.133 1.00 8.19 C ATOM 144 O2 C A 7 9.244 21.854 17.984 1.00 8.42 O ATOM 145 N3 C A 7 9.123 24.016 17.386 1.00 8.17 N ATOM 146 C4 C A 7 8.689 25.275 17.625 1.00 8.04 C ATOM 147 N4 C A 7 9.250 26.147 16.819 1.00 7.82 N ATOM 148 C5 C A 7 7.883 25.533 18.731 1.00 9.06 C ATOM 149 C6 C A 7 7.440 24.501 19.477 1.00 8.73 C ATOM 150 P G A 8 10.192 22.983 23.779 1.00 14.82 P ATOM 151 OP1 G A 8 10.212 22.596 25.183 1.00 15.39 O ATOM 152 OP2 G A 8 10.041 24.371 23.391 1.00 15.47 O ATOM 153 O5' G A 8 11.209 22.080 23.032 1.00 15.17 O ATOM 154 C5' G A 8 12.310 22.822 22.495 1.00 14.35 C ATOM 155 C4' G A 8 12.793 21.918 21.359 1.00 13.85 C ATOM 156 O4' G A 8 11.835 22.112 20.314 1.00 13.41 O ATOM 157 C3' G A 8 14.100 22.499 20.911 1.00 13.63 C ATOM 158 O3' G A 8 15.136 21.757 21.569 1.00 14.73 O ATOM 159 C2' G A 8 14.066 22.305 19.418 1.00 12.51 C ATOM 160 O2' G A 8 14.382 20.950 19.238 1.00 13.19 O ATOM 161 C1' G A 8 12.589 22.467 19.119 1.00 11.05 C ATOM 162 N9 G A 8 12.349 23.919 18.970 1.00 9.98 N ATOM 163 C8 G A 8 11.541 24.726 19.746 1.00 9.09 C ATOM 164 N7 G A 8 11.672 25.985 19.448 1.00 9.19 N ATOM 165 C5 G A 8 12.517 26.018 18.342 1.00 8.54 C ATOM 166 C6 G A 8 12.927 27.051 17.476 1.00 8.62 C ATOM 167 O6 G A 8 12.656 28.245 17.536 1.00 9.06 O ATOM 168 N1 G A 8 13.912 26.663 16.610 1.00 7.94 N ATOM 169 C2 G A 8 14.231 25.372 16.371 1.00 7.95 C ATOM 170 N2 G A 8 15.108 25.178 15.385 1.00 8.07 N ATOM 171 N3 G A 8 13.754 24.339 17.058 1.00 9.19 N ATOM 172 C4 G A 8 12.954 24.726 18.044 1.00 8.79 C ATOM 173 P G A 9 16.301 22.531 22.315 1.00 14.06 P ATOM 174 OP1 G A 9 16.919 21.337 22.913 1.00 15.41 O ATOM 175 OP2 G A 9 15.785 23.629 23.003 1.00 13.86 O ATOM 176 O5' G A 9 17.250 22.919 21.061 1.00 13.39 O ATOM 177 C5' G A 9 17.820 22.015 20.075 1.00 11.72 C ATOM 178 C4' G A 9 18.620 22.854 19.089 1.00 11.38 C ATOM 179 O4' G A 9 17.673 23.435 18.193 1.00 11.24 O ATOM 180 C3' G A 9 19.391 24.016 19.687 1.00 10.99 C ATOM 181 O3' G A 9 20.643 23.726 20.254 1.00 11.87 O ATOM 182 C2' G A 9 19.456 24.952 18.492 1.00 10.18 C ATOM 183 O2' G A 9 20.441 24.339 17.625 1.00 10.65 O ATOM 184 C1' G A 9 18.114 24.759 17.834 1.00 9.38 C ATOM 185 N9 G A 9 17.219 25.727 18.462 1.00 8.38 N ATOM 186 C8 G A 9 16.195 25.469 19.328 1.00 7.66 C ATOM 187 N7 G A 9 15.637 26.566 19.746 1.00 8.18 N ATOM 188 C5 G A 9 16.177 27.599 18.970 1.00 7.55 C ATOM 189 C6 G A 9 15.933 28.987 18.880 1.00 7.57 C ATOM 190 O6 G A 9 15.061 29.665 19.418 1.00 7.74 O ATOM 191 N1 G A 9 16.799 29.698 18.073 1.00 7.19 N ATOM 192 C2 G A 9 17.775 29.084 17.386 1.00 7.08 C ATOM 193 N2 G A 9 18.617 29.859 16.669 1.00 6.71 N ATOM 194 N3 G A 9 17.984 27.793 17.416 1.00 7.84 N ATOM 195 C4 G A 9 17.193 27.083 18.223 1.00 7.56 C ATOM 196 P U A 10 21.326 24.630 21.419 1.00 12.04 P ATOM 197 OP1 U A 10 22.427 23.726 21.598 1.00 12.39 O ATOM 198 OP2 U A 10 20.394 25.082 22.375 1.00 12.24 O ATOM 199 O5' U A 10 21.904 25.889 20.643 1.00 10.94 O ATOM 200 C5' U A 10 22.881 25.792 19.567 1.00 10.51 C ATOM 201 C4' U A 10 23.164 27.147 18.940 1.00 10.37 C ATOM 202 O4' U A 10 21.930 27.696 18.402 1.00 10.37 O ATOM 203 C3' U A 10 23.607 28.180 19.955 1.00 10.59 C ATOM 204 O3' U A 10 24.983 28.051 20.344 1.00 12.10 O ATOM 205 C2' U A 10 23.245 29.439 19.209 1.00 9.81 C ATOM 206 O2' U A 10 24.254 29.536 18.253 1.00 9.05 O ATOM 207 C1' U A 10 21.941 29.117 18.551 1.00 8.32 C ATOM 208 N1 U A 10 20.730 29.439 19.358 1.00 7.71 N ATOM 209 C2 U A 10 20.347 30.763 19.358 1.00 7.16 C ATOM 210 O2 U A 10 20.989 31.634 18.820 1.00 8.20 O ATOM 211 N3 U A 10 19.216 31.150 20.105 1.00 6.64 N ATOM 212 C4 U A 10 18.494 30.214 20.702 1.00 6.70 C ATOM 213 O4 U A 10 17.540 30.731 21.359 1.00 7.57 O ATOM 214 C5 U A 10 18.947 28.891 20.822 1.00 6.55 C ATOM 215 C6 U A 10 20.058 28.536 20.105 1.00 6.85 C ATOM 216 P C A 11 25.320 28.439 21.897 1.00 12.50 P ATOM 217 OP1 C A 11 26.677 27.922 21.927 1.00 13.03 O ATOM 218 OP2 C A 11 24.293 28.084 22.823 1.00 12.88 O ATOM 219 O5' C A 11 25.417 30.085 21.867 1.00 12.00 O ATOM 220 C5' C A 11 26.255 30.763 20.882 1.00 11.80 C ATOM 221 C4' C A 11 25.834 32.215 20.882 1.00 12.01 C ATOM 222 O4' C A 11 24.503 32.248 20.374 1.00 12.08 O ATOM 223 C3' C A 11 25.763 32.958 22.196 1.00 12.10 C ATOM 224 O3' C A 11 27.014 33.345 22.764 1.00 13.91 O ATOM 225 C2' C A 11 24.804 34.088 21.867 1.00 11.77 C ATOM 226 O2' C A 11 25.595 34.959 21.061 1.00 11.31 O ATOM 227 C1' C A 11 23.861 33.410 20.911 1.00 10.91 C ATOM 228 N1 C A 11 22.667 32.990 21.748 1.00 10.98 N ATOM 229 C2 C A 11 21.823 33.991 22.136 1.00 9.81 C ATOM 230 O2 C A 11 22.034 35.153 21.778 1.00 11.03 O ATOM 231 N3 C A 11 20.695 33.668 22.823 1.00 9.92 N ATOM 232 C4 C A 11 20.463 32.377 23.212 1.00 9.92 C ATOM 233 N4 C A 11 19.300 32.054 23.839 1.00 9.66 N ATOM 234 C5 C A 11 21.381 31.376 22.883 1.00 9.94 C ATOM 235 C6 C A 11 22.526 31.731 22.226 1.00 9.97 C ATOM 236 P C A 12 27.254 33.216 24.347 1.00 14.86 P ATOM 237 OP1 C A 12 28.742 33.378 24.078 1.00 15.09 O ATOM 238 OP2 C A 12 26.845 31.860 24.825 1.00 14.63 O ATOM 239 O5' C A 12 26.543 34.378 25.094 1.00 13.05 O ATOM 240 C5' C A 12 26.988 35.734 25.004 1.00 13.06 C ATOM 241 C4' C A 12 25.855 36.670 25.422 1.00 13.06 C ATOM 242 O4' C A 12 24.625 36.380 24.825 1.00 13.30 O ATOM 243 C3' C A 12 25.527 36.606 26.886 1.00 13.10 C ATOM 244 O3' C A 12 26.533 37.090 27.752 1.00 13.84 O ATOM 245 C2' C A 12 24.146 37.316 26.946 1.00 12.76 C ATOM 246 O2' C A 12 24.508 38.704 26.976 1.00 13.38 O ATOM 247 C1' C A 12 23.546 36.831 25.661 1.00 11.01 C ATOM 248 N1 C A 12 22.631 35.702 25.930 1.00 10.38 N ATOM 249 C2 C A 12 21.398 36.057 26.438 1.00 9.03 C ATOM 250 O2 C A 12 21.065 37.219 26.587 1.00 10.15 O ATOM 251 N3 C A 12 20.522 35.056 26.707 1.00 8.60 N ATOM 252 C4 C A 12 20.859 33.765 26.498 1.00 8.80 C ATOM 253 N4 C A 12 19.876 32.958 26.976 1.00 9.06 N ATOM 254 C5 C A 12 22.148 33.378 26.020 1.00 9.33 C ATOM 255 C6 C A 12 22.968 34.378 25.721 1.00 9.43 C TER 256 C A 12 HETATM 257 O HOH A 13 6.843 22.983 14.608 1.00 11.70 O HETATM 258 O HOH A 14 6.253 28.600 20.194 1.00 18.22 O HETATM 259 O HOH A 15 3.216 36.638 21.479 0.77 32.41 O HETATM 260 O HOH A 16 8.713 26.631 22.823 0.90 31.53 O HETATM 261 O HOH A 17 11.149 25.889 26.259 0.81 40.25 O HETATM 262 O HOH A 18 3.225 32.958 0.538 1.00 38.23 O HETATM 263 O HOH A 19 -3.269 38.252 14.728 1.00 19.74 O HETATM 264 O HOH A 20 3.886 20.982 20.075 1.00 14.93 O HETATM 265 O HOH A 21 3.590 38.510 18.133 1.00 16.07 O HETATM 266 O HOH A 22 0.471 26.534 16.341 0.91 13.36 O HETATM 267 O HOH A 23 6.674 33.862 11.382 1.00 25.11 O HETATM 268 O HOH A 24 4.240 35.992 15.325 0.50 34.42 O HETATM 269 O HOH A 25 9.579 18.690 19.209 0.92 38.37 O HETATM 270 O HOH A 26 13.965 26.147 21.987 1.00 27.66 O HETATM 271 O HOH A 27 17.817 25.985 22.943 0.99 20.57 O HETATM 272 O HOH A 28 21.181 27.922 23.391 1.00 26.92 O HETATM 273 O HOH A 29 5.173 30.569 17.177 1.00 16.29 O HETATM 274 O HOH A 30 7.261 29.117 14.668 1.00 25.19 O HETATM 275 O HOH A 31 9.206 28.568 11.979 1.00 38.23 O HETATM 276 O HOH A 32 21.264 29.794 26.796 1.00 30.64 O HETATM 277 O HOH A 33 11.318 19.723 25.960 0.93 28.99 O HETATM 278 O HOH A 34 -0.390 42.836 14.937 0.73 26.43 O HETATM 279 O HOH A 35 3.750 37.542 12.009 0.91 29.65 O HETATM 280 O HOH A 36 10.339 27.987 20.374 0.67 28.58 O HETATM 281 O HOH A 37 19.655 28.697 24.705 1.00 32.93 O HETATM 282 O HOH A 38 1.842 32.538 4.839 0.85 40.82 O HETATM 283 O HOH A 39 8.759 20.627 14.937 0.50 30.44 O HETATM 284 O HOH A 40 5.203 39.252 15.206 0.93 30.46 O HETATM 285 O HOH A 41 12.902 29.213 20.762 0.50 35.67 O HETATM 286 O HOH A 42 5.850 20.691 17.027 0.78 31.23 O HETATM 287 O HOH A 43 -2.108 29.246 19.776 0.99 35.53 O HETATM 288 O HOH A 44 19.036 22.209 24.825 1.00 45.58 O HETATM 289 O HOH A 45 -4.009 37.057 12.487 0.84 28.88 O HETATM 290 O HOH A 46 -3.567 36.541 16.699 1.00 40.18 O HETATM 291 O HOH A 47 17.637 18.690 21.330 1.00 45.93 O HETATM 292 O HOH A 48 15.879 29.859 23.032 1.00 50.42 O HETATM 293 O HOH A 49 24.549 30.020 25.153 0.64 27.66 O HETATM 294 O HOH A 50 -3.512 34.507 19.209 0.51 20.57 O HETATM 295 O HOH A 51 8.513 32.506 11.710 0.49 16.29 O HETATM 296 O HOH A 52 25.387 34.540 17.834 0.42 25.19 O HETATM 297 O HOH A 53 21.544 29.568 14.936 0.50 38.23 O HETATM 298 O HOH A 54 24.521 32.022 17.207 1.00 35.93 O HETATM 299 O HOH A 55 3.685 35.702 7.916 0.74 31.93 O HETATM 300 O HOH A 56 12.245 16.882 16.639 0.56 26.43 O HETATM 301 O HOH A 57 -0.904 41.028 1.852 1.00 30.40 O HETATM 302 O HOH A 58 0.000 44.417 0.000 0.50 30.31 O HETATM 303 O HOH A 59 -3.825 45.127 1.703 1.00 30.56 O ENDMDL MODEL 2 ATOM 1 OP3 G A 1 8.624 36.412 27.632 1.00 32.40 O ATOM 2 P G A 1 9.699 35.669 28.618 1.00 32.55 P ATOM 3 OP1 G A 1 10.305 34.572 27.692 1.00 32.01 O ATOM 4 OP2 G A 1 8.702 35.217 29.724 1.00 31.90 O ATOM 5 O5' G A 1 10.873 36.702 28.857 1.00 29.61 O ATOM 6 C5' G A 1 10.425 38.058 29.007 1.00 25.81 C ATOM 7 C4' G A 1 11.713 38.801 29.246 1.00 22.69 C ATOM 8 O4' G A 1 12.625 38.123 30.082 1.00 21.38 O ATOM 9 C3' G A 1 12.474 38.994 27.931 1.00 21.94 C ATOM 10 O3' G A 1 11.754 39.898 27.095 1.00 22.29 O ATOM 11 C2' G A 1 13.882 39.317 28.439 1.00 20.38 C ATOM 12 O2' G A 1 13.821 40.673 28.857 1.00 21.09 O ATOM 13 C1' G A 1 13.932 38.381 29.634 1.00 17.45 C ATOM 14 N9 G A 1 14.470 37.057 29.246 1.00 15.64 N ATOM 15 C8 G A 1 13.921 35.863 29.485 1.00 13.98 C ATOM 16 N7 G A 1 14.726 34.895 29.096 1.00 14.02 N ATOM 17 C5 G A 1 15.880 35.508 28.648 1.00 13.08 C ATOM 18 C6 G A 1 17.093 34.992 28.170 1.00 13.33 C ATOM 19 O6 G A 1 17.447 33.829 27.991 1.00 13.54 O ATOM 20 N1 G A 1 18.007 35.960 27.901 1.00 12.82 N ATOM 21 C2 G A 1 17.771 37.283 28.021 1.00 12.50 C ATOM 22 N2 G A 1 18.806 38.026 27.632 1.00 13.22 N ATOM 23 N3 G A 1 16.655 37.832 28.469 1.00 13.63 N ATOM 24 C4 G A 1 15.738 36.864 28.798 1.00 13.72 C ATOM 25 P G A 2 11.921 39.608 25.422 1.00 21.60 P ATOM 26 OP1 G A 2 10.956 40.705 25.213 1.00 22.08 O ATOM 27 OP2 G A 2 11.577 38.155 25.422 1.00 21.21 O ATOM 28 O5' G A 2 13.333 40.189 25.153 1.00 20.37 O ATOM 29 C5' G A 2 13.762 41.577 25.362 1.00 17.58 C ATOM 30 C4' G A 2 15.169 41.641 24.824 1.00 16.27 C ATOM 31 O4' G A 2 16.066 40.834 25.571 1.00 15.10 O ATOM 32 C3' G A 2 15.264 41.060 23.420 1.00 15.39 C ATOM 33 O3' G A 2 14.763 41.964 22.435 1.00 16.35 O ATOM 34 C2' G A 2 16.764 40.770 23.301 1.00 14.27 C ATOM 35 O2' G A 2 17.415 42.029 23.301 1.00 15.38 O ATOM 36 C1' G A 2 17.013 40.221 24.705 1.00 11.62 C ATOM 37 N9 G A 2 16.763 38.768 24.735 1.00 10.64 N ATOM 38 C8 G A 2 15.703 38.058 25.213 1.00 8.99 C ATOM 39 N7 G A 2 15.845 36.767 25.063 1.00 9.16 N ATOM 40 C5 G A 2 17.155 36.638 24.556 1.00 8.58 C ATOM 41 C6 G A 2 17.919 35.508 24.227 1.00 8.37 C ATOM 42 O6 G A 2 17.603 34.346 24.406 1.00 9.09 O ATOM 43 N1 G A 2 19.135 35.766 23.689 1.00 8.02 N ATOM 44 C2 G A 2 19.587 37.025 23.480 1.00 7.74 C ATOM 45 N2 G A 2 20.785 37.154 22.912 1.00 8.93 N ATOM 46 N3 G A 2 18.920 38.123 23.779 1.00 8.84 N ATOM 47 C4 G A 2 17.721 37.864 24.346 1.00 8.69 C ATOM 48 P A A 3 14.166 41.222 21.090 1.00 16.71 P ATOM 49 OP1 A A 3 13.934 42.545 20.433 1.00 18.05 O ATOM 50 OP2 A A 3 13.244 40.156 21.150 1.00 16.52 O ATOM 51 O5' A A 3 15.534 40.802 20.224 1.00 15.11 O ATOM 52 C5' A A 3 16.524 41.835 19.955 1.00 12.32 C ATOM 53 C4' A A 3 17.615 41.028 19.268 1.00 11.08 C ATOM 54 O4' A A 3 18.252 40.189 20.224 1.00 9.97 O ATOM 55 C3' A A 3 17.196 40.092 18.163 1.00 10.35 C ATOM 56 O3' A A 3 16.840 40.834 16.968 1.00 10.97 O ATOM 57 C2' A A 3 18.424 39.156 18.103 1.00 9.49 C ATOM 58 O2' A A 3 19.403 39.898 17.356 1.00 9.21 O ATOM 59 C1' A A 3 18.844 39.027 19.537 1.00 7.65 C ATOM 60 N9 A A 3 18.199 37.832 20.134 1.00 6.70 N ATOM 61 C8 A A 3 16.994 37.897 20.821 1.00 5.71 C ATOM 62 N7 A A 3 16.557 36.702 21.120 1.00 5.58 N ATOM 63 C5 A A 3 17.505 35.831 20.582 1.00 4.99 C ATOM 64 C6 A A 3 17.669 34.443 20.732 1.00 4.72 C ATOM 65 N6 A A 3 16.853 33.571 21.299 1.00 5.10 N ATOM 66 N1 A A 3 18.777 33.926 20.075 1.00 4.60 N ATOM 67 C2 A A 3 19.637 34.701 19.387 1.00 3.88 C ATOM 68 N3 A A 3 19.525 35.992 19.328 1.00 5.82 N ATOM 69 C4 A A 3 18.550 36.509 20.015 1.00 5.06 C ATOM 70 P C A 4 15.826 40.221 15.892 1.00 10.60 P ATOM 71 OP1 C A 4 15.902 41.254 14.847 1.00 10.90 O ATOM 72 OP2 C A 4 14.579 39.737 16.310 1.00 10.52 O ATOM 73 O5' C A 4 16.754 39.156 15.384 1.00 10.08 O ATOM 74 C5' C A 4 16.354 37.994 14.638 1.00 10.36 C ATOM 75 C4' C A 4 17.544 37.057 14.578 1.00 9.48 C ATOM 76 O4' C A 4 17.873 36.638 15.922 1.00 9.65 O ATOM 77 C3' C A 4 17.123 35.766 13.861 1.00 9.69 C ATOM 78 O3' C A 4 17.240 35.928 12.427 1.00 10.39 O ATOM 79 C2' C A 4 18.027 34.733 14.488 1.00 8.81 C ATOM 80 O2' C A 4 19.250 34.830 13.831 1.00 9.42 O ATOM 81 C1' C A 4 18.179 35.217 15.922 1.00 7.64 C ATOM 82 N1 C A 4 17.138 34.572 16.759 1.00 6.49 N ATOM 83 C2 C A 4 17.355 33.248 16.998 1.00 5.58 C ATOM 84 O2 C A 4 18.317 32.635 16.549 1.00 6.89 O ATOM 85 N3 C A 4 16.488 32.571 17.804 1.00 5.73 N ATOM 86 C4 C A 4 15.429 33.216 18.282 1.00 5.61 C ATOM 87 N4 C A 4 14.589 32.441 18.939 1.00 5.23 N ATOM 88 C5 C A 4 15.229 34.604 18.073 1.00 5.30 C ATOM 89 C6 C A 4 16.131 35.250 17.326 1.00 5.82 C ATOM 90 P U A 5 16.043 35.379 11.561 1.00 10.23 P ATOM 91 OP1 U A 5 16.535 35.669 10.246 1.00 10.10 O ATOM 92 OP2 U A 5 14.718 35.605 11.979 1.00 9.43 O ATOM 93 O5' U A 5 16.277 33.765 11.829 1.00 10.71 O ATOM 94 C5' U A 5 17.354 32.958 11.381 1.00 9.77 C ATOM 95 C4' U A 5 17.251 31.538 11.859 1.00 9.28 C ATOM 96 O4' U A 5 17.327 31.473 13.293 1.00 9.44 O ATOM 97 C3' U A 5 16.008 30.763 11.501 1.00 10.23 C ATOM 98 O3' U A 5 15.988 30.408 10.097 1.00 11.45 O ATOM 99 C2' U A 5 16.067 29.633 12.517 1.00 8.89 C ATOM 100 O2' U A 5 16.991 28.697 12.068 1.00 8.98 O ATOM 101 C1' U A 5 16.612 30.311 13.771 1.00 8.04 C ATOM 102 N1 U A 5 15.515 30.795 14.578 1.00 7.20 N ATOM 103 C2 U A 5 14.843 29.859 15.325 1.00 6.62 C ATOM 104 O2 U A 5 15.170 28.697 15.295 1.00 7.19 O ATOM 105 N3 U A 5 13.753 30.246 16.012 1.00 7.03 N ATOM 106 C4 U A 5 13.314 31.570 15.982 1.00 6.95 C ATOM 107 O4 U A 5 12.248 31.764 16.579 1.00 7.45 O ATOM 108 C5 U A 5 14.045 32.506 15.205 1.00 6.75 C ATOM 109 C6 U A 5 15.080 32.086 14.488 1.00 7.01 C ATOM 110 P U A 6 14.607 29.827 9.440 1.00 12.49 P ATOM 111 OP1 U A 6 14.953 30.085 8.006 1.00 13.36 O ATOM 112 OP2 U A 6 13.392 30.214 9.977 1.00 12.32 O ATOM 113 O5' U A 6 14.834 28.213 9.499 1.00 11.34 O ATOM 114 C5' U A 6 15.858 27.373 8.962 1.00 10.43 C ATOM 115 C4' U A 6 15.480 25.953 9.230 1.00 10.34 C ATOM 116 O4' U A 6 15.576 25.727 10.635 1.00 10.31 O ATOM 117 C3' U A 6 14.042 25.598 8.932 1.00 9.51 C ATOM 118 O3' U A 6 13.734 25.372 7.558 1.00 10.95 O ATOM 119 C2' U A 6 13.784 24.371 9.798 1.00 9.04 C ATOM 120 O2' U A 6 14.509 23.338 9.141 1.00 7.12 O ATOM 121 C1' U A 6 14.558 24.791 11.053 1.00 8.40 C ATOM 122 N1 U A 6 13.605 25.372 12.039 1.00 7.63 N ATOM 123 C2 U A 6 12.877 24.468 12.756 1.00 7.42 C ATOM 124 O2 U A 6 13.008 23.274 12.457 1.00 7.28 O ATOM 125 N3 U A 6 12.000 24.920 13.741 1.00 6.99 N ATOM 126 C4 U A 6 11.855 26.244 13.950 1.00 7.02 C ATOM 127 O4 U A 6 11.041 26.566 14.847 1.00 7.68 O ATOM 128 C5 U A 6 12.604 27.147 13.204 1.00 7.40 C ATOM 129 C6 U A 6 13.477 26.728 12.278 1.00 7.31 C ATOM 130 P C A 7 12.294 25.759 6.930 1.00 11.47 P ATOM 131 OP1 C A 7 12.692 25.630 5.586 1.00 12.35 O ATOM 132 OP2 C A 7 11.638 26.986 7.378 1.00 11.49 O ATOM 133 O5' C A 7 11.391 24.501 7.348 1.00 11.00 O ATOM 134 C5' C A 7 11.740 23.177 6.900 1.00 11.53 C ATOM 135 C4' C A 7 10.856 22.273 7.677 1.00 11.20 C ATOM 136 O4' C A 7 11.088 22.402 9.051 1.00 11.07 O ATOM 137 C3' C A 7 9.346 22.531 7.647 1.00 12.00 C ATOM 138 O3' C A 7 8.662 22.047 6.482 1.00 14.28 O ATOM 139 C2' C A 7 8.839 21.789 8.872 1.00 11.48 C ATOM 140 O2' C A 7 8.726 20.433 8.484 1.00 10.97 O ATOM 141 C1' C A 7 9.953 22.047 9.858 1.00 9.64 C ATOM 142 N1 C A 7 9.584 23.242 10.664 1.00 9.68 N ATOM 143 C2 C A 7 8.760 22.951 11.740 1.00 8.19 C ATOM 144 O2 C A 7 8.273 21.854 11.889 1.00 8.42 O ATOM 145 N3 C A 7 8.394 24.016 12.487 1.00 8.17 N ATOM 146 C4 C A 7 8.828 25.275 12.248 1.00 8.04 C ATOM 147 N4 C A 7 8.267 26.147 13.054 1.00 7.82 N ATOM 148 C5 C A 7 9.634 25.533 11.142 1.00 9.06 C ATOM 149 C6 C A 7 10.077 24.501 10.396 1.00 8.73 C ATOM 150 P G A 8 7.325 22.983 6.094 1.00 14.82 P ATOM 151 OP1 G A 8 7.305 22.596 4.690 1.00 15.39 O ATOM 152 OP2 G A 8 7.476 24.371 6.482 1.00 15.47 O ATOM 153 O5' G A 8 6.308 22.080 6.841 1.00 15.17 O ATOM 154 C5' G A 8 5.207 22.822 7.378 1.00 14.35 C ATOM 155 C4' G A 8 4.724 21.918 8.514 1.00 13.85 C ATOM 156 O4' G A 8 5.682 22.112 9.559 1.00 13.41 O ATOM 157 C3' G A 8 3.417 22.499 8.962 1.00 13.63 C ATOM 158 O3' G A 8 2.381 21.757 8.304 1.00 14.73 O ATOM 159 C2' G A 8 3.451 22.305 10.455 1.00 12.51 C ATOM 160 O2' G A 8 3.135 20.950 10.635 1.00 13.19 O ATOM 161 C1' G A 8 4.928 22.467 10.754 1.00 11.05 C ATOM 162 N9 G A 8 5.168 23.919 10.903 1.00 9.98 N ATOM 163 C8 G A 8 5.976 24.726 10.127 1.00 9.09 C ATOM 164 N7 G A 8 5.845 25.985 10.425 1.00 9.19 N ATOM 165 C5 G A 8 5.000 26.018 11.531 1.00 8.54 C ATOM 166 C6 G A 8 4.590 27.051 12.397 1.00 8.62 C ATOM 167 O6 G A 8 4.861 28.245 12.337 1.00 9.06 O ATOM 168 N1 G A 8 3.605 26.663 13.263 1.00 7.94 N ATOM 169 C2 G A 8 3.286 25.372 13.502 1.00 7.95 C ATOM 170 N2 G A 8 2.409 25.178 14.488 1.00 8.07 N ATOM 171 N3 G A 8 3.763 24.339 12.815 1.00 9.19 N ATOM 172 C4 G A 8 4.563 24.726 11.829 1.00 8.79 C ATOM 173 P G A 9 1.216 22.531 7.558 1.00 14.06 P ATOM 174 OP1 G A 9 0.598 21.337 6.960 1.00 15.41 O ATOM 175 OP2 G A 9 1.732 23.629 6.870 1.00 13.86 O ATOM 176 O5' G A 9 0.267 22.919 8.812 1.00 13.39 O ATOM 177 C5' G A 9 -0.303 22.015 9.798 1.00 11.72 C ATOM 178 C4' G A 9 -1.103 22.854 10.784 1.00 11.38 C ATOM 179 O4' G A 9 -0.156 23.435 11.680 1.00 11.24 O ATOM 180 C3' G A 9 -1.874 24.016 10.186 1.00 10.99 C ATOM 181 O3' G A 9 -3.126 23.726 9.619 1.00 11.87 O ATOM 182 C2' G A 9 -1.939 24.952 11.381 1.00 10.18 C ATOM 183 O2' G A 9 -2.924 24.339 12.248 1.00 10.65 O ATOM 184 C1' G A 9 -0.597 24.759 12.039 1.00 9.38 C ATOM 185 N9 G A 9 0.298 25.727 11.411 1.00 8.38 N ATOM 186 C8 G A 9 1.322 25.469 10.545 1.00 7.66 C ATOM 187 N7 G A 9 1.880 26.566 10.127 1.00 8.18 N ATOM 188 C5 G A 9 1.340 27.599 10.903 1.00 7.55 C ATOM 189 C6 G A 9 1.584 28.987 10.993 1.00 7.57 C ATOM 190 O6 G A 9 2.456 29.665 10.455 1.00 7.74 O ATOM 191 N1 G A 9 0.718 29.698 11.800 1.00 7.19 N ATOM 192 C2 G A 9 -0.258 29.084 12.487 1.00 7.08 C ATOM 193 N2 G A 9 -1.100 29.859 13.204 1.00 6.71 N ATOM 194 N3 G A 9 -0.467 27.793 12.457 1.00 7.84 N ATOM 195 C4 G A 9 0.324 27.083 11.650 1.00 7.56 C ATOM 196 P U A 10 -3.809 24.630 8.454 1.00 12.04 P ATOM 197 OP1 U A 10 -4.910 23.726 8.275 1.00 12.39 O ATOM 198 OP2 U A 10 -2.877 25.082 7.498 1.00 12.24 O ATOM 199 O5' U A 10 -4.387 25.889 9.230 1.00 10.94 O ATOM 200 C5' U A 10 -5.364 25.792 10.306 1.00 10.51 C ATOM 201 C4' U A 10 -5.647 27.147 10.933 1.00 10.37 C ATOM 202 O4' U A 10 -4.413 27.696 11.471 1.00 10.37 O ATOM 203 C3' U A 10 -6.090 28.180 9.918 1.00 10.59 C ATOM 204 O3' U A 10 -7.466 28.051 9.529 1.00 12.10 O ATOM 205 C2' U A 10 -5.728 29.439 10.664 1.00 9.81 C ATOM 206 O2' U A 10 -6.737 29.536 11.620 1.00 9.05 O ATOM 207 C1' U A 10 -4.424 29.117 11.322 1.00 8.32 C ATOM 208 N1 U A 10 -3.213 29.439 10.515 1.00 7.71 N ATOM 209 C2 U A 10 -2.830 30.763 10.515 1.00 7.16 C ATOM 210 O2 U A 10 -3.472 31.634 11.053 1.00 8.20 O ATOM 211 N3 U A 10 -1.699 31.150 9.768 1.00 6.64 N ATOM 212 C4 U A 10 -0.977 30.214 9.171 1.00 6.70 C ATOM 213 O4 U A 10 -0.023 30.731 8.514 1.00 7.57 O ATOM 214 C5 U A 10 -1.430 28.891 9.051 1.00 6.55 C ATOM 215 C6 U A 10 -2.541 28.536 9.768 1.00 6.85 C ATOM 216 P C A 11 -7.803 28.439 7.976 1.00 12.50 P ATOM 217 OP1 C A 11 -9.160 27.922 7.946 1.00 13.03 O ATOM 218 OP2 C A 11 -6.776 28.084 7.050 1.00 12.88 O ATOM 219 O5' C A 11 -7.900 30.085 8.006 1.00 12.00 O ATOM 220 C5' C A 11 -8.738 30.763 8.991 1.00 11.80 C ATOM 221 C4' C A 11 -8.317 32.215 8.991 1.00 12.01 C ATOM 222 O4' C A 11 -6.986 32.248 9.499 1.00 12.08 O ATOM 223 C3' C A 11 -8.246 32.958 7.677 1.00 12.10 C ATOM 224 O3' C A 11 -9.497 33.345 7.109 1.00 13.91 O ATOM 225 C2' C A 11 -7.287 34.088 8.006 1.00 11.77 C ATOM 226 O2' C A 11 -8.078 34.959 8.812 1.00 11.31 O ATOM 227 C1' C A 11 -6.344 33.410 8.962 1.00 10.91 C ATOM 228 N1 C A 11 -5.150 32.990 8.125 1.00 10.98 N ATOM 229 C2 C A 11 -4.306 33.991 7.737 1.00 9.81 C ATOM 230 O2 C A 11 -4.517 35.153 8.095 1.00 11.03 O ATOM 231 N3 C A 11 -3.178 33.668 7.050 1.00 9.92 N ATOM 232 C4 C A 11 -2.946 32.377 6.661 1.00 9.92 C ATOM 233 N4 C A 11 -1.783 32.054 6.034 1.00 9.66 N ATOM 234 C5 C A 11 -3.864 31.376 6.990 1.00 9.94 C ATOM 235 C6 C A 11 -5.009 31.731 7.647 1.00 9.97 C ATOM 236 P C A 12 -9.737 33.216 5.526 1.00 14.86 P ATOM 237 OP1 C A 12 -11.225 33.378 5.795 1.00 15.09 O ATOM 238 OP2 C A 12 -9.328 31.860 5.048 1.00 14.63 O ATOM 239 O5' C A 12 -9.026 34.378 4.779 1.00 13.05 O ATOM 240 C5' C A 12 -9.471 35.734 4.869 1.00 13.06 C ATOM 241 C4' C A 12 -8.338 36.670 4.451 1.00 13.06 C ATOM 242 O4' C A 12 -7.108 36.380 5.048 1.00 13.30 O ATOM 243 C3' C A 12 -8.010 36.606 2.987 1.00 13.10 C ATOM 244 O3' C A 12 -9.016 37.090 2.121 1.00 13.84 O ATOM 245 C2' C A 12 -6.629 37.316 2.927 1.00 12.76 C ATOM 246 O2' C A 12 -6.991 38.704 2.897 1.00 13.38 O ATOM 247 C1' C A 12 -6.029 36.831 4.212 1.00 11.01 C ATOM 248 N1 C A 12 -5.114 35.702 3.943 1.00 10.38 N ATOM 249 C2 C A 12 -3.881 36.057 3.435 1.00 9.03 C ATOM 250 O2 C A 12 -3.548 37.219 3.286 1.00 10.15 O ATOM 251 N3 C A 12 -3.005 35.056 3.166 1.00 8.60 N ATOM 252 C4 C A 12 -3.342 33.765 3.375 1.00 8.80 C ATOM 253 N4 C A 12 -2.359 32.958 2.897 1.00 9.06 N ATOM 254 C5 C A 12 -4.631 33.378 3.853 1.00 9.33 C ATOM 255 C6 C A 12 -5.451 34.378 4.152 1.00 9.43 C TER 256 C A 12 HETATM 257 O HOH A 13 10.674 22.983 15.265 1.00 11.70 O HETATM 258 O HOH A 14 11.264 28.600 9.679 1.00 18.22 O HETATM 259 O HOH A 15 14.301 36.638 8.394 0.77 32.41 O HETATM 260 O HOH A 16 8.804 26.631 7.050 0.90 31.53 O HETATM 261 O HOH A 17 6.368 25.889 3.614 0.81 40.25 O HETATM 262 O HOH A 18 14.292 32.958 29.335 1.00 38.23 O HETATM 263 O HOH A 19 20.786 38.252 15.145 1.00 19.74 O HETATM 264 O HOH A 20 13.631 20.982 9.798 1.00 14.93 O HETATM 265 O HOH A 21 13.927 38.510 11.740 1.00 16.07 O HETATM 266 O HOH A 22 17.046 26.534 13.532 0.91 13.36 O HETATM 267 O HOH A 23 10.843 33.862 18.491 1.00 25.11 O HETATM 268 O HOH A 24 13.277 35.992 14.548 0.50 34.42 O HETATM 269 O HOH A 25 7.938 18.690 10.664 0.92 38.37 O HETATM 270 O HOH A 26 3.552 26.147 7.886 1.00 27.66 O HETATM 271 O HOH A 27 -0.300 25.985 6.930 0.99 20.57 O HETATM 272 O HOH A 28 -3.664 27.922 6.482 1.00 26.92 O HETATM 273 O HOH A 29 12.344 30.569 12.696 1.00 16.29 O HETATM 274 O HOH A 30 10.256 29.117 15.205 1.00 25.19 O HETATM 275 O HOH A 31 8.311 28.568 17.894 1.00 38.23 O HETATM 276 O HOH A 32 -3.747 29.794 3.077 1.00 30.64 O HETATM 277 O HOH A 33 6.199 19.723 3.913 0.93 28.99 O HETATM 278 O HOH A 34 17.907 42.836 14.936 0.73 26.43 O HETATM 279 O HOH A 35 13.767 37.542 17.864 0.91 29.65 O HETATM 280 O HOH A 36 7.178 27.987 9.499 0.67 28.58 O HETATM 281 O HOH A 37 -2.138 28.697 5.168 1.00 32.93 O HETATM 282 O HOH A 38 15.675 32.538 25.034 0.85 40.82 O HETATM 283 O HOH A 39 8.758 20.627 14.936 0.50 30.44 O HETATM 284 O HOH A 40 12.314 39.252 14.667 0.93 30.46 O HETATM 285 O HOH A 41 4.615 29.213 9.111 0.50 35.67 O HETATM 286 O HOH A 42 11.667 20.691 12.846 0.78 31.23 O HETATM 287 O HOH A 43 19.625 29.246 10.097 0.99 35.53 O HETATM 288 O HOH A 44 -1.519 22.209 5.048 1.00 45.58 O HETATM 289 O HOH A 45 21.526 37.057 17.386 0.84 28.88 O HETATM 290 O HOH A 46 21.084 36.541 13.174 1.00 40.18 O HETATM 291 O HOH A 47 -0.120 18.690 8.543 1.00 45.93 O HETATM 292 O HOH A 48 1.638 29.859 6.841 1.00 50.42 O HETATM 293 O HOH A 49 -7.032 30.020 4.720 0.64 27.66 O HETATM 294 O HOH A 50 21.029 34.507 10.664 0.51 20.57 O HETATM 295 O HOH A 51 9.004 32.506 18.163 0.49 16.29 O HETATM 296 O HOH A 52 -7.870 34.540 12.039 0.42 25.19 O HETATM 297 O HOH A 53 -4.027 29.568 14.937 0.50 38.23 O HETATM 298 O HOH A 54 -7.004 32.022 12.666 1.00 35.93 O HETATM 299 O HOH A 55 13.832 35.702 21.957 0.74 31.93 O HETATM 300 O HOH A 56 5.272 16.882 13.234 0.56 26.43 O HETATM 301 O HOH A 57 18.421 41.028 28.021 1.00 30.40 O HETATM 302 O HOH A 58 17.517 44.417 29.873 0.50 30.31 O HETATM 303 O HOH A 59 21.342 45.127 28.170 1.00 30.56 O ENDMDL MASTER 0 0 0 0 0 0 0 6 302 1 0 1 END