HEADER DNA 16-AUG-89 XXXX TITLE CRYSTALLOGRAPHIC STUDY OF ONE TURN OF G/C-RICH B-DNA COMPND 5'-D(*CP*CP*AP*GP*GP*CP*CP*TP*GP*G)-3' KEYWDS B-DNA, DOUBLE HELIX EXPDTA X-RAY DIFFRACTION AUTHOR U.HEINEMANN JRNL AUTH U.HEINEMANN, C.ALINGS JRNL TITL CRYSTALLOGRAPHIC STUDY OF ONE TURN OF G/C-RICH JRNL TITL 2 B-DNA. JRNL REF J.MOL.BIOL. V. 210 369 1989 JRNL REFN ASTM JMOBAK UK ISSN 0022-2836 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH U.HEINEMANN, C.ALINGS, H.LAUBLE REMARK 1 TITL STRUCTURAL FEATURES OF G/C-RICH DNA GOING A OR B REMARK 1 REF STRUCTURE AND METHODS. DNA V. 3 39 1989 REMARK 1 REF 2 AND RNA REMARK 1 PUBL ADENINE PRESS, ALBANY, NY REMARK 1 REFN ISSN 0-940030-31-4 REMARK 1 REFERENCE 2 REMARK 1 AUTH U.HEINEMANN, C.ALINGS, H.LAUBLE REMARK 1 TITL X-RAY STUDIES OF DNA AIMING AT ELUCIDATING THE REMARK 1 TITL 2 SEQUENCE-STRUCTURE CODE REMARK 1 REF NUCLEOSIDES AND NUCLEOTIDES V. 9 349 1990 REMARK 1 REFN ASTM NUNUD5 US ISSN 0732-8311 SEQRES 1 A 10 DC DC DA DG DG DC DC DT DG DG HETNAM TEA TRIETHYLAMMONIUM ION FORMUL 2 TEA 2(C6 H16 N 1+) FORMUL 4 HOH *41(H2 O) CRYST1 32.150 25.490 34.820 90.00 116.71 90.00 C 1 2 1 4 ORIGX1 0.031104 0.000000 0.015651 0.00000 ORIGX2 0.000000 0.039231 0.000000 0.00000 ORIGX3 0.000000 0.000000 0.032150 0.00000 SCALE1 0.031104 0.000000 0.015651 0.00000 SCALE2 0.000000 0.039231 0.000000 0.00000 SCALE3 0.000000 0.000000 0.032150 0.00000 MODEL 1 ATOM 1 N1 DC A 1 -10.223 0.834 12.445 1.00 15.53 N ATOM 2 C2 DC A 1 -8.948 0.594 13.005 1.00 15.06 C ATOM 3 O2 DC A 1 -8.211 1.491 13.406 1.00 16.33 O ATOM 4 N3 DC A 1 -8.557 -0.724 13.070 1.00 14.34 N ATOM 5 C4 DC A 1 -9.368 -1.723 12.650 1.00 12.46 C ATOM 6 N4 DC A 1 -8.886 -2.972 12.747 1.00 12.62 N ATOM 7 C5 DC A 1 -10.638 -1.425 12.056 1.00 13.52 C ATOM 8 C6 DC A 1 -11.037 -0.150 12.019 1.00 9.68 C ATOM 9 O5' DC A 1 -14.290 1.968 11.705 1.00 34.31 O ATOM 10 C5' DC A 1 -14.107 3.082 12.638 1.00 24.09 C ATOM 11 C4' DC A 1 -12.616 3.326 12.709 1.00 24.17 C ATOM 12 O4' DC A 1 -12.009 2.067 12.902 1.00 27.94 O ATOM 13 C3' DC A 1 -11.940 3.869 11.443 1.00 18.46 C ATOM 14 O3' DC A 1 -11.536 5.205 11.751 1.00 17.76 O ATOM 15 C2' DC A 1 -10.838 2.891 11.061 1.00 15.10 C ATOM 16 C1' DC A 1 -10.661 2.225 12.395 1.00 18.87 C ATOM 17 P DC A 2 -11.308 6.217 10.551 1.00 16.86 P ATOM 18 N1 DC A 2 -7.170 2.623 9.540 1.00 10.29 N ATOM 19 C2 DC A 2 -6.282 1.718 10.134 1.00 12.11 C ATOM 20 O2 DC A 2 -5.287 2.105 10.762 1.00 14.50 O ATOM 21 N3 DC A 2 -6.572 0.382 10.121 1.00 11.51 N ATOM 22 C4 DC A 2 -7.715 -0.071 9.537 1.00 12.34 C ATOM 23 N4 DC A 2 -7.900 -1.374 9.527 1.00 9.61 N ATOM 24 C5 DC A 2 -8.582 0.836 8.883 1.00 12.39 C ATOM 25 C6 DC A 2 -8.290 2.136 8.930 1.00 10.32 C ATOM 26 OP1 DC A 2 -11.553 7.453 11.222 1.00 19.81 O ATOM 27 OP2 DC A 2 -11.784 5.373 9.387 1.00 20.64 O ATOM 28 O5' DC A 2 -9.684 6.146 10.429 1.00 17.92 O ATOM 29 C5' DC A 2 -8.720 6.421 11.496 1.00 15.47 C ATOM 30 C4' DC A 2 -7.398 5.949 10.939 1.00 15.75 C ATOM 31 O4' DC A 2 -7.357 4.537 10.902 1.00 17.71 O ATOM 32 C3' DC A 2 -7.146 6.316 9.468 1.00 16.86 C ATOM 33 O3' DC A 2 -5.812 6.765 9.269 1.00 17.67 O ATOM 34 C2' DC A 2 -7.427 5.029 8.715 1.00 9.27 C ATOM 35 C1' DC A 2 -6.809 4.027 9.667 1.00 9.74 C ATOM 36 P DA A 3 -5.445 8.249 9.300 1.00 16.31 P ATOM 37 N9 DA A 3 -2.635 4.907 8.221 1.00 9.19 N ATOM 38 C8 DA A 3 -3.564 5.493 7.422 1.00 9.02 C ATOM 39 N7 DA A 3 -4.350 4.652 6.824 1.00 11.31 N ATOM 40 C5 DA A 3 -3.955 3.426 7.350 1.00 7.46 C ATOM 41 C6 DA A 3 -4.421 2.116 7.138 1.00 8.29 C ATOM 42 N6 DA A 3 -5.442 1.807 6.330 1.00 6.75 N ATOM 43 N1 DA A 3 -3.670 1.175 7.742 1.00 7.68 N ATOM 44 C2 DA A 3 -2.642 1.392 8.572 1.00 8.66 C ATOM 45 N3 DA A 3 -2.183 2.610 8.862 1.00 9.15 N ATOM 46 C4 DA A 3 -2.870 3.569 8.190 1.00 10.92 C ATOM 47 OP1 DA A 3 -5.947 9.046 10.408 1.00 25.02 O ATOM 48 OP2 DA A 3 -5.425 8.748 7.907 1.00 27.07 O ATOM 49 O5' DA A 3 -3.819 8.073 9.661 1.00 24.22 O ATOM 50 C5' DA A 3 -3.362 7.797 11.008 1.00 16.31 C ATOM 51 C4' DA A 3 -2.077 7.048 10.837 1.00 10.93 C ATOM 52 O4' DA A 3 -2.311 5.763 10.292 1.00 15.97 O ATOM 53 C3' DA A 3 -1.016 7.670 9.891 1.00 15.59 C ATOM 54 O3' DA A 3 0.235 7.642 10.600 1.00 13.40 O ATOM 55 C2' DA A 3 -1.101 6.862 8.597 1.00 16.17 C ATOM 56 C1' DA A 3 -1.601 5.529 9.055 1.00 11.79 C ATOM 57 P DG A 4 1.695 8.129 10.081 1.00 16.35 P ATOM 58 N9 DG A 4 0.272 4.598 5.670 1.00 13.71 N ATOM 59 C8 DG A 4 -0.398 5.631 5.086 1.00 12.90 C ATOM 60 N7 DG A 4 -1.522 5.261 4.501 1.00 13.58 N ATOM 61 C5 DG A 4 -1.558 3.880 4.700 1.00 16.07 C ATOM 62 C6 DG A 4 -2.500 2.863 4.336 1.00 10.45 C ATOM 63 O6 DG A 4 -3.557 3.082 3.714 1.00 13.56 O ATOM 64 N1 DG A 4 -2.111 1.583 4.669 1.00 11.24 N ATOM 65 C2 DG A 4 -0.966 1.315 5.331 1.00 10.42 C ATOM 66 N2 DG A 4 -0.760 0.054 5.695 1.00 13.16 N ATOM 67 N3 DG A 4 -0.094 2.220 5.751 1.00 14.98 N ATOM 68 C4 DG A 4 -0.412 3.459 5.394 1.00 12.00 C ATOM 69 OP1 DG A 4 2.491 7.894 11.303 1.00 17.98 O ATOM 70 OP2 DG A 4 1.479 9.457 9.546 1.00 13.26 O ATOM 71 O5' DG A 4 2.044 7.104 9.048 1.00 21.56 O ATOM 72 C5' DG A 4 2.539 5.812 9.459 1.00 21.85 C ATOM 73 C4' DG A 4 2.808 5.004 8.202 1.00 19.92 C ATOM 74 O4' DG A 4 1.510 4.598 7.714 1.00 21.85 O ATOM 75 C3' DG A 4 3.483 5.661 7.014 1.00 19.89 C ATOM 76 O3' DG A 4 4.395 4.774 6.395 1.00 21.77 O ATOM 77 C2' DG A 4 2.295 6.000 6.090 1.00 19.28 C ATOM 78 C1' DG A 4 1.578 4.657 6.296 1.00 15.69 C ATOM 79 P DG A 5 5.995 5.029 6.277 1.00 25.27 P ATOM 80 N9 DG A 5 3.519 1.935 3.580 1.00 18.26 N ATOM 81 C8 DG A 5 3.481 3.278 3.381 1.00 13.53 C ATOM 82 N7 DG A 5 2.427 3.724 2.799 1.00 17.64 N ATOM 83 C5 DG A 5 1.708 2.554 2.572 1.00 13.66 C ATOM 84 C6 DG A 5 0.427 2.353 1.981 1.00 15.13 C ATOM 85 O6 DG A 5 -0.299 3.242 1.540 1.00 14.25 O ATOM 86 N1 DG A 5 0.071 1.025 1.910 1.00 13.33 N ATOM 87 C2 DG A 5 0.795 0.013 2.432 1.00 14.57 C ATOM 88 N2 DG A 5 0.270 -1.188 2.327 1.00 15.30 N ATOM 89 N3 DG A 5 1.982 0.148 3.026 1.00 12.78 N ATOM 90 C4 DG A 5 2.348 1.455 3.039 1.00 14.14 C ATOM 91 OP1 DG A 5 6.272 5.615 7.490 1.00 20.12 O ATOM 92 OP2 DG A 5 6.048 5.957 5.110 1.00 25.12 O ATOM 93 O5' DG A 5 6.388 3.515 5.988 1.00 23.40 O ATOM 94 C5' DG A 5 5.988 2.516 6.949 1.00 21.01 C ATOM 95 C4' DG A 5 5.747 1.208 6.227 1.00 18.10 C ATOM 96 O4' DG A 5 4.428 1.218 5.692 1.00 14.25 O ATOM 97 C3' DG A 5 6.713 0.956 5.079 1.00 20.86 C ATOM 98 O3' DG A 5 7.130 -0.415 5.023 1.00 27.65 O ATOM 99 C2' DG A 5 5.936 1.402 3.826 1.00 15.18 C ATOM 100 C1' DG A 5 4.511 1.068 4.255 1.00 12.95 C ATOM 101 P DC A 6 7.903 -1.366 3.845 1.00 25.67 P ATOM 102 N1 DC A 6 3.924 -1.203 0.252 1.00 20.37 N ATOM 103 C2 DC A 6 2.710 -0.930 -0.376 1.00 14.25 C ATOM 104 O2 DC A 6 1.930 -1.863 -0.616 1.00 20.50 O ATOM 105 N3 DC A 6 2.439 0.380 -0.663 1.00 10.08 N ATOM 106 C4 DC A 6 3.290 1.359 -0.386 1.00 12.50 C ATOM 107 N4 DC A 6 2.952 2.608 -0.691 1.00 15.91 N ATOM 108 C5 DC A 6 4.560 1.065 0.221 1.00 18.38 C ATOM 109 C6 DC A 6 4.844 -0.212 0.513 1.00 15.97 C ATOM 110 OP1 DC A 6 8.750 -2.167 4.756 1.00 28.44 O ATOM 111 OP2 DC A 6 8.479 -0.403 2.886 1.00 27.24 O ATOM 112 O5' DC A 6 6.710 -2.156 3.291 1.00 24.79 O ATOM 113 C5' DC A 6 5.553 -2.822 3.789 1.00 31.38 C ATOM 114 C4' DC A 6 4.774 -3.523 2.666 1.00 33.95 C ATOM 115 O4' DC A 6 3.844 -2.671 2.028 1.00 30.09 O ATOM 116 C3' DC A 6 5.646 -4.134 1.540 1.00 33.19 C ATOM 117 O3' DC A 6 5.211 -5.475 1.291 1.00 35.10 O ATOM 118 C2' DC A 6 5.501 -3.153 0.389 1.00 31.32 C ATOM 119 C1' DC A 6 4.112 -2.618 0.600 1.00 23.76 C ATOM 120 P DC A 7 6.038 -6.668 0.523 1.00 34.14 P ATOM 121 N1 DC A 7 4.144 -2.962 -3.680 1.00 16.93 N ATOM 122 C2 DC A 7 3.368 -1.932 -4.202 1.00 16.07 C ATOM 123 O2 DC A 7 2.306 -2.218 -4.768 1.00 15.44 O ATOM 124 N3 DC A 7 3.824 -0.647 -4.034 1.00 12.83 N ATOM 125 C4 DC A 7 4.976 -0.385 -3.384 1.00 9.10 C ATOM 126 N4 DC A 7 5.377 0.874 -3.222 1.00 12.77 N ATOM 127 C5 DC A 7 5.775 -1.440 -2.877 1.00 14.56 C ATOM 128 C6 DC A 7 5.288 -2.707 -2.989 1.00 14.13 C ATOM 129 OP1 DC A 7 5.510 -7.871 1.151 1.00 34.71 O ATOM 130 OP2 DC A 7 7.265 -6.064 0.137 1.00 37.02 O ATOM 131 O5' DC A 7 5.130 -6.502 -0.942 1.00 31.91 O ATOM 132 C5' DC A 7 3.666 -6.472 -0.846 1.00 24.18 C ATOM 133 C4' DC A 7 3.214 -6.018 -2.227 1.00 19.54 C ATOM 134 O4' DC A 7 3.385 -4.649 -2.364 1.00 23.64 O ATOM 135 C3' DC A 7 4.061 -6.625 -3.369 1.00 22.55 C ATOM 136 O3' DC A 7 3.287 -7.614 -4.034 1.00 21.80 O ATOM 137 C2' DC A 7 4.461 -5.434 -4.246 1.00 18.11 C ATOM 138 C1' DC A 7 3.607 -4.313 -3.776 1.00 16.89 C ATOM 139 P DT A 8 3.754 -8.452 -5.282 1.00 22.62 P ATOM 140 N1 DT A 8 4.157 -3.801 -8.128 1.00 11.77 N ATOM 141 C2 DT A 8 3.774 -2.457 -8.196 1.00 13.52 C ATOM 142 O2 DT A 8 2.745 -2.098 -8.765 1.00 13.18 O ATOM 143 N3 DT A 8 4.566 -1.509 -7.617 1.00 13.11 N ATOM 144 C4 DT A 8 5.719 -1.876 -6.977 1.00 9.04 C ATOM 145 O4 DT A 8 6.393 -0.964 -6.488 1.00 10.78 O ATOM 146 C5 DT A 8 6.103 -3.253 -6.902 1.00 15.29 C ATOM 147 C6 DT A 8 5.296 -4.178 -7.484 1.00 14.86 C ATOM 148 OP1 DT A 8 2.919 -9.579 -5.110 1.00 23.01 O ATOM 149 OP2 DT A 8 5.199 -8.621 -5.303 1.00 23.70 O ATOM 150 O5' DT A 8 3.240 -7.665 -6.638 1.00 21.72 O ATOM 151 C5' DT A 8 1.833 -7.420 -6.896 1.00 20.60 C ATOM 152 C4' DT A 8 1.792 -6.449 -8.053 1.00 15.18 C ATOM 153 O4' DT A 8 2.296 -5.180 -7.733 1.00 15.07 O ATOM 154 C3' DT A 8 2.647 -6.933 -9.229 1.00 15.84 C ATOM 155 O3' DT A 8 1.859 -6.783 -10.417 1.00 18.16 O ATOM 156 C2' DT A 8 3.881 -6.072 -9.157 1.00 13.85 C ATOM 157 C1' DT A 8 3.238 -4.764 -8.703 1.00 12.51 C ATOM 158 C7 DT A 8 7.385 -3.699 -6.224 1.00 13.55 C ATOM 159 P DG A 9 0.949 -7.795 -11.235 1.00 16.66 P ATOM 160 N9 DG A 9 2.179 -4.081 -13.002 1.00 11.99 N ATOM 161 C8 DG A 9 2.965 -5.187 -12.927 1.00 10.49 C ATOM 162 N7 DG A 9 4.131 -4.958 -12.395 1.00 7.35 N ATOM 163 C5 DG A 9 4.131 -3.630 -12.031 1.00 9.56 C ATOM 164 C6 DG A 9 5.122 -2.773 -11.496 1.00 6.67 C ATOM 165 O6 DG A 9 6.179 -3.128 -11.002 1.00 10.19 O ATOM 166 N1 DG A 9 4.762 -1.476 -11.369 1.00 8.98 N ATOM 167 C2 DG A 9 3.529 -1.017 -11.754 1.00 13.00 C ATOM 168 N2 DG A 9 3.206 0.280 -11.630 1.00 11.62 N ATOM 169 N3 DG A 9 2.595 -1.761 -12.358 1.00 11.43 N ATOM 170 C4 DG A 9 2.940 -3.072 -12.470 1.00 9.87 C ATOM 171 OP1 DG A 9 0.173 -8.636 -10.292 1.00 17.36 O ATOM 172 OP2 DG A 9 1.977 -8.641 -11.891 1.00 16.06 O ATOM 173 O5' DG A 9 -0.032 -7.053 -12.146 1.00 14.77 O ATOM 174 C5' DG A 9 -0.929 -6.118 -11.527 1.00 12.15 C ATOM 175 C4' DG A 9 -1.156 -4.978 -12.501 1.00 9.64 C ATOM 176 O4' DG A 9 -0.108 -4.050 -12.373 1.00 10.97 O ATOM 177 C3' DG A 9 -1.101 -5.220 -14.003 1.00 15.49 C ATOM 178 O3' DG A 9 -1.831 -4.124 -14.585 1.00 18.77 O ATOM 179 C2' DG A 9 0.330 -5.098 -14.439 1.00 16.28 C ATOM 180 C1' DG A 9 0.779 -3.982 -13.515 1.00 13.38 C ATOM 181 P DG A 10 -2.449 -4.438 -16.084 1.00 20.19 P ATOM 182 N9 DG A 10 2.842 -2.314 -16.523 1.00 13.24 N ATOM 183 C8 DG A 10 3.013 -3.660 -16.563 1.00 13.19 C ATOM 184 N7 DG A 10 4.069 -4.117 -15.991 1.00 12.63 N ATOM 185 C5 DG A 10 4.661 -2.934 -15.493 1.00 10.12 C ATOM 186 C6 DG A 10 5.859 -2.717 -14.750 1.00 10.55 C ATOM 187 O6 DG A 10 6.675 -3.541 -14.345 1.00 13.18 O ATOM 188 N1 DG A 10 6.123 -1.379 -14.507 1.00 11.59 N ATOM 189 C2 DG A 10 5.266 -0.372 -14.880 1.00 7.90 C ATOM 190 N2 DG A 10 5.690 0.821 -14.535 1.00 11.41 N ATOM 191 N3 DG A 10 4.122 -0.510 -15.527 1.00 9.90 N ATOM 192 C4 DG A 10 3.890 -1.817 -15.795 1.00 9.93 C ATOM 193 OP1 DG A 10 -3.770 -3.844 -16.028 1.00 20.33 O ATOM 194 OP2 DG A 10 -2.339 -5.809 -16.417 1.00 21.29 O ATOM 195 O5' DG A 10 -1.370 -3.416 -16.856 1.00 16.05 O ATOM 196 C5' DG A 10 -1.654 -2.019 -16.610 1.00 18.23 C ATOM 197 C4' DG A 10 -0.479 -1.216 -17.170 1.00 17.73 C ATOM 198 O4' DG A 10 0.610 -1.402 -16.311 1.00 16.69 O ATOM 199 C3' DG A 10 -0.044 -1.659 -18.557 1.00 21.57 C ATOM 200 O3' DG A 10 -0.307 -0.668 -19.574 1.00 30.39 O ATOM 201 C2' DG A 10 1.441 -1.917 -18.479 1.00 12.94 C ATOM 202 C1' DG A 10 1.799 -1.443 -17.101 1.00 14.67 C TER 203 DG A 10 HETATM 204 N TEA A 11 -1.533 -2.467 -9.042 1.00 44.64 N HETATM 205 C11 TEA A 11 -0.053 -2.837 -9.282 1.00 32.44 C HETATM 206 C21 TEA A 11 -2.558 -3.589 -9.375 1.00 33.76 C HETATM 207 C31 TEA A 11 -1.856 -1.876 -7.639 1.00 43.55 C HETATM 208 C32 TEA A 11 -3.433 -1.519 -7.586 1.00 43.01 C HETATM 209 N TEA A 12 10.033 -5.740 3.810 1.00 49.55 N HETATM 210 C11 TEA A 12 10.096 -6.350 5.250 1.00 44.62 C HETATM 211 C21 TEA A 12 11.101 -4.563 3.733 1.00 51.02 C HETATM 212 C31 TEA A 12 10.441 -6.737 2.712 1.00 46.06 C HETATM 213 C32 TEA A 12 10.098 -6.013 1.356 1.00 48.73 C HETATM 214 O HOH A 13 2.007 1.173 7.282 1.00 31.28 O HETATM 215 O HOH A 14 5.074 8.032 11.282 1.00 16.08 O HETATM 216 O HOH A 15 6.474 -7.267 -7.888 1.00 24.21 O HETATM 217 O HOH A 16 -8.982 -0.484 5.474 1.00 20.25 O HETATM 218 O HOH A 17 3.610 11.180 8.958 1.00 25.67 O HETATM 219 O HOH A 18 -4.753 4.226 13.950 1.00 50.44 O HETATM 220 O HOH A 19 -0.238 -3.258 5.897 1.00 21.93 O HETATM 221 O HOH A 20 1.980 6.107 13.316 1.00 28.27 O HETATM 222 O HOH A 21 11.039 -5.080 -2.712 1.00 52.19 O HETATM 223 O HOH A 22 -2.579 13.464 -9.257 1.00 32.83 O HETATM 224 O HOH A 23 -9.602 -4.619 8.905 1.00 22.07 O HETATM 225 O HOH A 24 -10.302 -2.394 7.835 1.00 15.76 O HETATM 226 O HOH A 25 4.005 -12.595 -4.523 1.00 49.28 O HETATM 227 O HOH A 26 8.091 3.895 -4.803 1.00 36.61 O HETATM 228 O HOH A 27 -6.812 -6.283 13.384 1.00 28.12 O HETATM 229 O HOH A 28 -9.585 -6.752 10.513 1.00 56.88 O HETATM 230 O HOH A 29 -1.827 -4.731 -6.510 1.00 60.62 O HETATM 231 O HOH A 30 8.304 -4.280 -2.115 1.00 48.05 O HETATM 232 O HOH A 31 -0.018 1.970 10.227 1.00 33.09 O HETATM 233 O HOH A 32 2.166 4.397 15.988 1.00 45.61 O HETATM 234 O HOH A 33 -4.998 -4.927 -13.944 1.00 27.89 O HETATM 235 O HOH A 34 -0.331 -11.269 8.709 1.00 40.54 O HETATM 236 O HOH A 35 -2.325 -8.588 -8.376 1.00 42.23 O HETATM 237 O HOH A 36 2.741 -11.646 -12.647 1.00 63.75 O HETATM 238 O HOH A 37 -0.107 -0.110 -12.911 1.00 45.14 O HETATM 239 O HOH A 38 -7.364 -5.358 10.156 1.00 19.95 O HETATM 240 O HOH A 39 -6.672 -7.683 11.107 1.00 36.48 O HETATM 241 O HOH A 40 0.000 -3.778 0.000 0.50 43.95 O HETATM 242 O HOH A 41 -9.405 -6.671 13.446 0.50 14.45 O HETATM 243 O HOH A 42 4.708 -6.375 -16.193 0.50 14.47 O HETATM 244 O HOH A 43 9.895 5.381 -15.104 0.50 19.11 O HETATM 245 O HOH A 44 8.290 5.042 -16.053 0.50 20.74 O HETATM 246 O HOH A 45 -0.465 4.384 14.445 0.50 28.53 O HETATM 247 O HOH A 46 7.740 3.966 2.367 0.50 31.48 O HETATM 248 O HOH A 47 8.559 4.823 3.474 0.50 31.32 O HETATM 249 O HOH A 48 -2.285 3.676 12.700 0.50 26.36 O HETATM 250 O HOH A 49 6.073 3.632 0.697 0.50 20.50 O HETATM 251 O HOH A 50 4.443 5.180 0.320 0.50 26.30 O HETATM 252 O HOH A 51 6.232 -10.176 -2.967 0.50 19.36 O HETATM 253 O HOH A 52 6.496 4.746 2.156 0.50 24.88 O HETATM 254 O HOH A 53 8.314 2.299 0.740 0.50 32.96 O ENDMDL MODEL 2 ATOM 1 O5' DC A 1 14.290 1.968 -11.705 1.00 34.31 O ATOM 2 C5' DC A 1 14.107 3.082 -12.638 1.00 24.09 C ATOM 3 C4' DC A 1 12.616 3.326 -12.709 1.00 24.17 C ATOM 4 O4' DC A 1 12.009 2.067 -12.902 1.00 27.94 O ATOM 5 C3' DC A 1 11.940 3.869 -11.443 1.00 18.46 C ATOM 6 O3' DC A 1 11.536 5.205 -11.751 1.00 17.76 O ATOM 7 C2' DC A 1 10.838 2.891 -11.061 1.00 15.10 C ATOM 8 C1' DC A 1 10.661 2.225 -12.395 1.00 18.87 C ATOM 9 N1 DC A 1 10.223 0.834 -12.445 1.00 15.53 N ATOM 10 C2 DC A 1 8.948 0.594 -13.005 1.00 15.06 C ATOM 11 O2 DC A 1 8.211 1.491 -13.406 1.00 16.33 O ATOM 12 N3 DC A 1 8.557 -0.724 -13.070 1.00 14.34 N ATOM 13 C4 DC A 1 9.368 -1.723 -12.650 1.00 12.46 C ATOM 14 N4 DC A 1 8.886 -2.972 -12.747 1.00 12.62 N ATOM 15 C5 DC A 1 10.638 -1.425 -12.056 1.00 13.52 C ATOM 16 C6 DC A 1 11.037 -0.150 -12.019 1.00 9.68 C ATOM 17 P DC A 2 11.308 6.217 -10.551 1.00 16.86 P ATOM 18 OP1 DC A 2 11.553 7.453 -11.222 1.00 19.81 O ATOM 19 OP2 DC A 2 11.784 5.373 -9.387 1.00 20.64 O ATOM 20 O5' DC A 2 9.684 6.146 -10.429 1.00 17.92 O ATOM 21 C5' DC A 2 8.720 6.421 -11.496 1.00 15.47 C ATOM 22 C4' DC A 2 7.398 5.949 -10.939 1.00 15.75 C ATOM 23 O4' DC A 2 7.357 4.537 -10.902 1.00 17.71 O ATOM 24 C3' DC A 2 7.146 6.316 -9.468 1.00 16.86 C ATOM 25 O3' DC A 2 5.812 6.765 -9.269 1.00 17.67 O ATOM 26 C2' DC A 2 7.427 5.029 -8.715 1.00 9.27 C ATOM 27 C1' DC A 2 6.809 4.027 -9.667 1.00 9.74 C ATOM 28 N1 DC A 2 7.170 2.623 -9.540 1.00 10.29 N ATOM 29 C2 DC A 2 6.282 1.718 -10.134 1.00 12.11 C ATOM 30 O2 DC A 2 5.287 2.105 -10.762 1.00 14.50 O ATOM 31 N3 DC A 2 6.572 0.382 -10.121 1.00 11.51 N ATOM 32 C4 DC A 2 7.715 -0.071 -9.537 1.00 12.34 C ATOM 33 N4 DC A 2 7.900 -1.374 -9.527 1.00 9.61 N ATOM 34 C5 DC A 2 8.582 0.836 -8.883 1.00 12.39 C ATOM 35 C6 DC A 2 8.290 2.136 -8.930 1.00 10.32 C ATOM 36 P DA A 3 5.445 8.249 -9.300 1.00 16.31 P ATOM 37 OP1 DA A 3 5.947 9.046 -10.408 1.00 25.02 O ATOM 38 OP2 DA A 3 5.425 8.748 -7.907 1.00 27.07 O ATOM 39 O5' DA A 3 3.819 8.073 -9.661 1.00 24.22 O ATOM 40 C5' DA A 3 3.362 7.797 -11.008 1.00 16.31 C ATOM 41 C4' DA A 3 2.077 7.048 -10.837 1.00 10.93 C ATOM 42 O4' DA A 3 2.311 5.763 -10.292 1.00 15.97 O ATOM 43 C3' DA A 3 1.016 7.670 -9.891 1.00 15.59 C ATOM 44 O3' DA A 3 -0.235 7.642 -10.600 1.00 13.40 O ATOM 45 C2' DA A 3 1.101 6.862 -8.597 1.00 16.17 C ATOM 46 C1' DA A 3 1.601 5.529 -9.055 1.00 11.79 C ATOM 47 N9 DA A 3 2.635 4.907 -8.221 1.00 9.19 N ATOM 48 C8 DA A 3 3.564 5.493 -7.422 1.00 9.02 C ATOM 49 N7 DA A 3 4.350 4.652 -6.824 1.00 11.31 N ATOM 50 C5 DA A 3 3.955 3.426 -7.350 1.00 7.46 C ATOM 51 C6 DA A 3 4.421 2.116 -7.138 1.00 8.29 C ATOM 52 N6 DA A 3 5.442 1.807 -6.330 1.00 6.75 N ATOM 53 N1 DA A 3 3.670 1.175 -7.742 1.00 7.68 N ATOM 54 C2 DA A 3 2.642 1.392 -8.572 1.00 8.66 C ATOM 55 N3 DA A 3 2.183 2.610 -8.862 1.00 9.15 N ATOM 56 C4 DA A 3 2.870 3.569 -8.190 1.00 10.92 C ATOM 57 P DG A 4 -1.695 8.129 -10.081 1.00 16.35 P ATOM 58 OP1 DG A 4 -2.491 7.894 -11.303 1.00 17.98 O ATOM 59 OP2 DG A 4 -1.479 9.457 -9.546 1.00 13.26 O ATOM 60 O5' DG A 4 -2.044 7.104 -9.048 1.00 21.56 O ATOM 61 C5' DG A 4 -2.539 5.812 -9.459 1.00 21.85 C ATOM 62 C4' DG A 4 -2.808 5.004 -8.202 1.00 19.92 C ATOM 63 O4' DG A 4 -1.510 4.598 -7.714 1.00 21.85 O ATOM 64 C3' DG A 4 -3.483 5.661 -7.014 1.00 19.89 C ATOM 65 O3' DG A 4 -4.395 4.774 -6.395 1.00 21.77 O ATOM 66 C2' DG A 4 -2.295 6.000 -6.090 1.00 19.28 C ATOM 67 C1' DG A 4 -1.578 4.657 -6.296 1.00 15.69 C ATOM 68 N9 DG A 4 -0.272 4.598 -5.670 1.00 13.71 N ATOM 69 C8 DG A 4 0.398 5.631 -5.086 1.00 12.90 C ATOM 70 N7 DG A 4 1.522 5.261 -4.501 1.00 13.58 N ATOM 71 C5 DG A 4 1.558 3.880 -4.700 1.00 16.07 C ATOM 72 C6 DG A 4 2.500 2.863 -4.336 1.00 10.45 C ATOM 73 O6 DG A 4 3.557 3.082 -3.714 1.00 13.56 O ATOM 74 N1 DG A 4 2.111 1.583 -4.669 1.00 11.24 N ATOM 75 C2 DG A 4 0.966 1.315 -5.331 1.00 10.42 C ATOM 76 N2 DG A 4 0.760 0.054 -5.695 1.00 13.16 N ATOM 77 N3 DG A 4 0.094 2.220 -5.751 1.00 14.98 N ATOM 78 C4 DG A 4 0.412 3.459 -5.394 1.00 12.00 C ATOM 79 P DG A 5 -5.995 5.029 -6.277 1.00 25.27 P ATOM 80 OP1 DG A 5 -6.272 5.615 -7.490 1.00 20.12 O ATOM 81 OP2 DG A 5 -6.048 5.957 -5.110 1.00 25.12 O ATOM 82 O5' DG A 5 -6.388 3.515 -5.988 1.00 23.40 O ATOM 83 C5' DG A 5 -5.988 2.516 -6.949 1.00 21.01 C ATOM 84 C4' DG A 5 -5.747 1.208 -6.227 1.00 18.10 C ATOM 85 O4' DG A 5 -4.428 1.218 -5.692 1.00 14.25 O ATOM 86 C3' DG A 5 -6.713 0.956 -5.079 1.00 20.86 C ATOM 87 O3' DG A 5 -7.130 -0.415 -5.023 1.00 27.65 O ATOM 88 C2' DG A 5 -5.936 1.402 -3.826 1.00 15.18 C ATOM 89 C1' DG A 5 -4.511 1.068 -4.255 1.00 12.95 C ATOM 90 N9 DG A 5 -3.519 1.935 -3.580 1.00 18.26 N ATOM 91 C8 DG A 5 -3.481 3.278 -3.381 1.00 13.53 C ATOM 92 N7 DG A 5 -2.427 3.724 -2.799 1.00 17.64 N ATOM 93 C5 DG A 5 -1.708 2.554 -2.572 1.00 13.66 C ATOM 94 C6 DG A 5 -0.427 2.353 -1.981 1.00 15.13 C ATOM 95 O6 DG A 5 0.299 3.242 -1.540 1.00 14.25 O ATOM 96 N1 DG A 5 -0.071 1.025 -1.910 1.00 13.33 N ATOM 97 C2 DG A 5 -0.795 0.013 -2.432 1.00 14.57 C ATOM 98 N2 DG A 5 -0.270 -1.188 -2.327 1.00 15.30 N ATOM 99 N3 DG A 5 -1.982 0.148 -3.026 1.00 12.78 N ATOM 100 C4 DG A 5 -2.348 1.455 -3.039 1.00 14.14 C ATOM 101 P DC A 6 -7.903 -1.366 -3.845 1.00 25.67 P ATOM 102 OP1 DC A 6 -8.750 -2.167 -4.756 1.00 28.44 O ATOM 103 OP2 DC A 6 -8.479 -0.403 -2.886 1.00 27.24 O ATOM 104 O5' DC A 6 -6.710 -2.156 -3.291 1.00 24.79 O ATOM 105 C5' DC A 6 -5.553 -2.822 -3.789 1.00 31.38 C ATOM 106 C4' DC A 6 -4.774 -3.523 -2.666 1.00 33.95 C ATOM 107 O4' DC A 6 -3.844 -2.671 -2.028 1.00 30.09 O ATOM 108 C3' DC A 6 -5.646 -4.134 -1.540 1.00 33.19 C ATOM 109 O3' DC A 6 -5.211 -5.475 -1.291 1.00 35.10 O ATOM 110 C2' DC A 6 -5.501 -3.153 -0.389 1.00 31.32 C ATOM 111 C1' DC A 6 -4.112 -2.618 -0.600 1.00 23.76 C ATOM 112 N1 DC A 6 -3.924 -1.203 -0.252 1.00 20.37 N ATOM 113 C2 DC A 6 -2.710 -0.930 0.376 1.00 14.25 C ATOM 114 O2 DC A 6 -1.930 -1.863 0.616 1.00 20.50 O ATOM 115 N3 DC A 6 -2.439 0.380 0.663 1.00 10.08 N ATOM 116 C4 DC A 6 -3.290 1.359 0.386 1.00 12.50 C ATOM 117 N4 DC A 6 -2.952 2.608 0.691 1.00 15.91 N ATOM 118 C5 DC A 6 -4.560 1.065 -0.221 1.00 18.38 C ATOM 119 C6 DC A 6 -4.844 -0.212 -0.513 1.00 15.97 C ATOM 120 P DC A 7 -6.038 -6.668 -0.523 1.00 34.14 P ATOM 121 OP1 DC A 7 -5.510 -7.871 -1.151 1.00 34.71 O ATOM 122 OP2 DC A 7 -7.265 -6.064 -0.137 1.00 37.02 O ATOM 123 O5' DC A 7 -5.130 -6.502 0.942 1.00 31.91 O ATOM 124 C5' DC A 7 -3.666 -6.472 0.846 1.00 24.18 C ATOM 125 C4' DC A 7 -3.214 -6.018 2.227 1.00 19.54 C ATOM 126 O4' DC A 7 -3.385 -4.649 2.364 1.00 23.64 O ATOM 127 C3' DC A 7 -4.061 -6.625 3.369 1.00 22.55 C ATOM 128 O3' DC A 7 -3.287 -7.614 4.034 1.00 21.80 O ATOM 129 C2' DC A 7 -4.461 -5.434 4.246 1.00 18.11 C ATOM 130 C1' DC A 7 -3.607 -4.313 3.776 1.00 16.89 C ATOM 131 N1 DC A 7 -4.144 -2.962 3.680 1.00 16.93 N ATOM 132 C2 DC A 7 -3.368 -1.932 4.202 1.00 16.07 C ATOM 133 O2 DC A 7 -2.306 -2.218 4.768 1.00 15.44 O ATOM 134 N3 DC A 7 -3.824 -0.647 4.034 1.00 12.83 N ATOM 135 C4 DC A 7 -4.976 -0.385 3.384 1.00 9.10 C ATOM 136 N4 DC A 7 -5.377 0.874 3.222 1.00 12.77 N ATOM 137 C5 DC A 7 -5.775 -1.440 2.877 1.00 14.56 C ATOM 138 C6 DC A 7 -5.288 -2.707 2.989 1.00 14.13 C ATOM 139 P DT A 8 -3.754 -8.452 5.282 1.00 22.62 P ATOM 140 OP1 DT A 8 -2.919 -9.579 5.110 1.00 23.01 O ATOM 141 OP2 DT A 8 -5.199 -8.621 5.303 1.00 23.70 O ATOM 142 O5' DT A 8 -3.240 -7.665 6.638 1.00 21.72 O ATOM 143 C5' DT A 8 -1.833 -7.420 6.896 1.00 20.60 C ATOM 144 C4' DT A 8 -1.792 -6.449 8.053 1.00 15.18 C ATOM 145 O4' DT A 8 -2.296 -5.180 7.733 1.00 15.07 O ATOM 146 C3' DT A 8 -2.647 -6.933 9.229 1.00 15.84 C ATOM 147 O3' DT A 8 -1.859 -6.783 10.417 1.00 18.16 O ATOM 148 C2' DT A 8 -3.881 -6.072 9.157 1.00 13.85 C ATOM 149 C1' DT A 8 -3.238 -4.764 8.703 1.00 12.51 C ATOM 150 N1 DT A 8 -4.157 -3.801 8.128 1.00 11.77 N ATOM 151 C2 DT A 8 -3.774 -2.457 8.196 1.00 13.52 C ATOM 152 O2 DT A 8 -2.745 -2.098 8.765 1.00 13.18 O ATOM 153 N3 DT A 8 -4.566 -1.509 7.617 1.00 13.11 N ATOM 154 C4 DT A 8 -5.719 -1.876 6.977 1.00 9.04 C ATOM 155 O4 DT A 8 -6.393 -0.964 6.488 1.00 10.78 O ATOM 156 C5 DT A 8 -6.103 -3.253 6.902 1.00 15.29 C ATOM 157 C7 DT A 8 -7.385 -3.699 6.224 1.00 13.55 C ATOM 158 C6 DT A 8 -5.296 -4.178 7.484 1.00 14.86 C ATOM 159 P DG A 9 -0.949 -7.795 11.235 1.00 16.66 P ATOM 160 OP1 DG A 9 -0.173 -8.636 10.292 1.00 17.36 O ATOM 161 OP2 DG A 9 -1.977 -8.641 11.891 1.00 16.06 O ATOM 162 O5' DG A 9 0.032 -7.053 12.146 1.00 14.77 O ATOM 163 C5' DG A 9 0.929 -6.118 11.527 1.00 12.15 C ATOM 164 C4' DG A 9 1.156 -4.978 12.501 1.00 9.64 C ATOM 165 O4' DG A 9 0.108 -4.050 12.373 1.00 10.97 O ATOM 166 C3' DG A 9 1.101 -5.220 14.003 1.00 15.49 C ATOM 167 O3' DG A 9 1.831 -4.124 14.585 1.00 18.77 O ATOM 168 C2' DG A 9 -0.330 -5.098 14.439 1.00 16.28 C ATOM 169 C1' DG A 9 -0.779 -3.982 13.515 1.00 13.38 C ATOM 170 N9 DG A 9 -2.179 -4.081 13.002 1.00 11.99 N ATOM 171 C8 DG A 9 -2.965 -5.187 12.927 1.00 10.49 C ATOM 172 N7 DG A 9 -4.131 -4.958 12.395 1.00 7.35 N ATOM 173 C5 DG A 9 -4.131 -3.630 12.031 1.00 9.56 C ATOM 174 C6 DG A 9 -5.122 -2.773 11.496 1.00 6.67 C ATOM 175 O6 DG A 9 -6.179 -3.128 11.002 1.00 10.19 O ATOM 176 N1 DG A 9 -4.762 -1.476 11.369 1.00 8.98 N ATOM 177 C2 DG A 9 -3.529 -1.017 11.754 1.00 13.00 C ATOM 178 N2 DG A 9 -3.206 0.280 11.630 1.00 11.62 N ATOM 179 N3 DG A 9 -2.595 -1.761 12.358 1.00 11.43 N ATOM 180 C4 DG A 9 -2.940 -3.072 12.470 1.00 9.87 C ATOM 181 P DG A 10 2.449 -4.438 16.084 1.00 20.19 P ATOM 182 OP1 DG A 10 3.770 -3.844 16.028 1.00 20.33 O ATOM 183 OP2 DG A 10 2.339 -5.809 16.417 1.00 21.29 O ATOM 184 O5' DG A 10 1.370 -3.416 16.856 1.00 16.05 O ATOM 185 C5' DG A 10 1.654 -2.019 16.610 1.00 18.23 C ATOM 186 C4' DG A 10 0.479 -1.216 17.170 1.00 17.73 C ATOM 187 O4' DG A 10 -0.610 -1.402 16.311 1.00 16.69 O ATOM 188 C3' DG A 10 0.044 -1.659 18.557 1.00 21.57 C ATOM 189 O3' DG A 10 0.307 -0.668 19.574 1.00 30.39 O ATOM 190 C2' DG A 10 -1.441 -1.917 18.479 1.00 12.94 C ATOM 191 C1' DG A 10 -1.799 -1.443 17.101 1.00 14.67 C ATOM 192 N9 DG A 10 -2.842 -2.314 16.523 1.00 13.24 N ATOM 193 C8 DG A 10 -3.013 -3.660 16.563 1.00 13.19 C ATOM 194 N7 DG A 10 -4.069 -4.117 15.991 1.00 12.63 N ATOM 195 C5 DG A 10 -4.661 -2.934 15.493 1.00 10.12 C ATOM 196 C6 DG A 10 -5.859 -2.717 14.750 1.00 10.55 C ATOM 197 O6 DG A 10 -6.675 -3.541 14.345 1.00 13.18 O ATOM 198 N1 DG A 10 -6.123 -1.379 14.507 1.00 11.59 N ATOM 199 C2 DG A 10 -5.266 -0.372 14.880 1.00 7.90 C ATOM 200 N2 DG A 10 -5.690 0.821 14.535 1.00 11.41 N ATOM 201 N3 DG A 10 -4.122 -0.510 15.527 1.00 9.90 N ATOM 202 C4 DG A 10 -3.890 -1.817 15.795 1.00 9.93 C TER 203 DG A 10 HETATM 204 N TEA A 11 1.533 -2.467 9.042 1.00 44.64 N HETATM 205 C11 TEA A 11 0.053 -2.837 9.282 1.00 32.44 C HETATM 206 C21 TEA A 11 2.558 -3.589 9.375 1.00 33.76 C HETATM 207 C31 TEA A 11 1.856 -1.876 7.639 1.00 43.55 C HETATM 208 C32 TEA A 11 3.433 -1.519 7.586 1.00 43.01 C HETATM 209 N TEA A 12 -10.033 -5.740 -3.810 1.00 49.55 N HETATM 210 C11 TEA A 12 -10.096 -6.350 -5.250 1.00 44.62 C HETATM 211 C21 TEA A 12 -11.101 -4.563 -3.733 1.00 51.02 C HETATM 212 C31 TEA A 12 -10.441 -6.737 -2.712 1.00 46.06 C HETATM 213 C32 TEA A 12 -10.098 -6.013 -1.356 1.00 48.73 C HETATM 214 O HOH A 13 -2.007 1.173 -7.282 1.00 31.28 O HETATM 215 O HOH A 14 -5.074 8.032 -11.282 1.00 16.08 O HETATM 216 O HOH A 15 -6.474 -7.267 7.888 1.00 24.21 O HETATM 217 O HOH A 16 8.982 -0.484 -5.474 1.00 20.25 O HETATM 218 O HOH A 17 -3.610 11.180 -8.958 1.00 25.67 O HETATM 219 O HOH A 18 4.753 4.226 -13.950 1.00 50.44 O HETATM 220 O HOH A 19 0.238 -3.258 -5.897 1.00 21.93 O HETATM 221 O HOH A 20 -1.980 6.107 -13.316 1.00 28.27 O HETATM 222 O HOH A 21 -11.039 -5.080 2.712 1.00 52.19 O HETATM 223 O HOH A 22 2.579 13.464 9.257 1.00 32.83 O HETATM 224 O HOH A 23 9.602 -4.619 -8.905 1.00 22.07 O HETATM 225 O HOH A 24 10.302 -2.394 -7.835 1.00 15.76 O HETATM 226 O HOH A 25 -4.005 -12.595 4.523 1.00 49.28 O HETATM 227 O HOH A 26 -8.091 3.895 4.803 1.00 36.61 O HETATM 228 O HOH A 27 6.812 -6.283 -13.384 1.00 28.12 O HETATM 229 O HOH A 28 9.585 -6.752 -10.513 1.00 56.88 O HETATM 230 O HOH A 29 1.827 -4.731 6.510 1.00 60.62 O HETATM 231 O HOH A 30 -8.304 -4.280 2.115 1.00 48.05 O HETATM 232 O HOH A 31 0.018 1.970 -10.227 1.00 33.09 O HETATM 233 O HOH A 32 -2.166 4.397 -15.988 1.00 45.61 O HETATM 234 O HOH A 33 4.998 -4.927 13.944 1.00 27.89 O HETATM 235 O HOH A 34 0.331 -11.269 -8.709 1.00 40.54 O HETATM 236 O HOH A 35 2.325 -8.588 8.376 1.00 42.23 O HETATM 237 O HOH A 36 -2.741 -11.646 12.647 1.00 63.75 O HETATM 238 O HOH A 37 0.107 -0.110 12.911 1.00 45.14 O HETATM 239 O HOH A 38 7.364 -5.358 -10.156 1.00 19.95 O HETATM 240 O HOH A 39 6.672 -7.683 -11.107 1.00 36.48 O HETATM 241 O HOH A 40 0.000 -3.778 0.000 0.50 43.95 O HETATM 242 O HOH A 41 9.405 -6.671 -13.446 0.50 14.45 O HETATM 243 O HOH A 42 -4.708 -6.375 16.193 0.50 14.47 O HETATM 244 O HOH A 43 -9.895 5.381 15.104 0.50 19.11 O HETATM 245 O HOH A 44 -8.290 5.042 16.053 0.50 20.74 O HETATM 246 O HOH A 45 0.465 4.384 -14.445 0.50 28.53 O HETATM 247 O HOH A 46 -7.740 3.966 -2.367 0.50 31.48 O HETATM 248 O HOH A 47 -8.559 4.823 -3.474 0.50 31.32 O HETATM 249 O HOH A 48 2.285 3.676 -12.700 0.50 26.36 O HETATM 250 O HOH A 49 -6.073 3.632 -0.697 0.50 20.50 O HETATM 251 O HOH A 50 -4.443 5.180 -0.320 0.50 26.30 O HETATM 252 O HOH A 51 -6.232 -10.176 2.967 0.50 19.36 O HETATM 253 O HOH A 52 -6.496 4.746 -2.156 0.50 24.88 O HETATM 254 O HOH A 53 -8.314 2.299 -0.740 0.50 32.96 O ENDMDL CONECT 204 205 206 207 CONECT 205 204 CONECT 206 204 CONECT 207 204 208 CONECT 208 207 CONECT 209 210 211 212 CONECT 210 209 CONECT 211 209 CONECT 212 209 213 CONECT 213 212 MASTER 14 0 0 0 0 0 0 6 506 2 10 1 END