HEADER RNA 25-MAY-10 XXXX TITLE SOLUTION STRUCTURE OF THE PSEUDOURIDINE MODIFIED P6.1 HAIRPIN OF HUMAN TITLE 2 TELOMERASE RNA COMPND 5'-R(*GP*AP*GP*AP*GP*(PSU)P*(PSU)P*GP*GP*GP*CP*(PSU)P*CP*(PSU)P*C)-3' KEYWDS TELOMERASE, RNA, PSEUDOURIDINE, P6.1, HAIRPIN EXPDTA SOLUTION NMR AUTHOR N.-K.KIM, C.A.THEIMER, J.R.MITCHELL, K.COLLINS, J.FEIGON JRNL AUTH N.K.KIM, C.A.THEIMER, J.R.MITCHELL, K.COLLINS, J.FEIGON JRNL TITL EFFECT OF PSEUDOURIDYLATION ON THE STRUCTURE AND ACTIVITY OF JRNL TITL 2 THE CATALYTICALLY ESSENTIAL P6.1 HAIRPIN IN HUMAN TELOMERASE JRNL TITL 3 RNA. JRNL REF NUCLEIC ACIDS RES. V. 38 6746 2010 JRNL REFN ASTM NARHAD UK ISSN 0305-1048 JRNL PMID 20554853 JRNL DOI 10.1093/NAR/GKQ525 SEQRES 1 A 15 G A G A G PSU PSU G G G C PSU C SEQRES 2 A 15 PSU C HETNAM PSU PSEUDOURIDINE-5'-MONOPHOSPHATE FORMUL 1 PSU 4(C9 H13 N2 O9 P) LINK O3' G A 5 P PSU A 6 1555 1555 1.61 LINK O3' PSU A 6 P PSU A 7 1555 1555 1.61 LINK O3' PSU A 7 P G A 8 1555 1555 1.61 LINK O3' C A 11 P PSU A 12 1555 1555 1.61 LINK O3' PSU A 12 P C A 13 1555 1555 1.61 LINK O3' C A 13 P PSU A 14 1555 1555 1.61 LINK O3' PSU A 14 P C A 15 1555 1555 1.61 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 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 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 MODEL 1 ATOM 1 O5' G A 1 9.038 -6.827 -10.253 1.00 0.00 O ATOM 2 C5' G A 1 9.295 -7.297 -11.579 1.00 0.00 C ATOM 3 C4' G A 1 8.013 -7.758 -12.268 1.00 0.00 C ATOM 4 O4' G A 1 7.568 -9.014 -11.751 1.00 0.00 O ATOM 5 C3' G A 1 6.877 -6.784 -12.013 1.00 0.00 C ATOM 6 O3' G A 1 6.840 -5.841 -13.086 1.00 0.00 O ATOM 7 C2' G A 1 5.640 -7.658 -12.101 1.00 0.00 C ATOM 8 O2' G A 1 5.152 -7.743 -13.445 1.00 0.00 O ATOM 9 C1' G A 1 6.139 -9.013 -11.604 1.00 0.00 C ATOM 10 N9 G A 1 5.749 -9.226 -10.199 1.00 0.00 N ATOM 11 C8 G A 1 6.315 -8.749 -9.064 1.00 0.00 C ATOM 12 N7 G A 1 5.764 -9.070 -7.941 1.00 0.00 N ATOM 13 C5 G A 1 4.693 -9.864 -8.366 1.00 0.00 C ATOM 14 C6 G A 1 3.694 -10.529 -7.604 1.00 0.00 C ATOM 15 O6 G A 1 3.553 -10.549 -6.384 1.00 0.00 O ATOM 16 N1 G A 1 2.806 -11.217 -8.421 1.00 0.00 N ATOM 17 C2 G A 1 2.865 -11.264 -9.799 1.00 0.00 C ATOM 18 N2 G A 1 1.919 -11.980 -10.406 1.00 0.00 N ATOM 19 N3 G A 1 3.801 -10.641 -10.523 1.00 0.00 N ATOM 20 C4 G A 1 4.679 -9.963 -9.749 1.00 0.00 C ATOM 21 H5' G A 1 9.995 -8.132 -11.532 1.00 0.00 H ATOM 22 H5'' G A 1 9.741 -6.492 -12.162 1.00 0.00 H ATOM 23 H4' G A 1 8.186 -7.850 -13.340 1.00 0.00 H ATOM 24 H3' G A 1 6.967 -6.299 -11.040 1.00 0.00 H ATOM 25 H2' G A 1 4.867 -7.278 -11.430 1.00 0.00 H ATOM 26 HO2' G A 1 4.638 -8.551 -13.512 1.00 0.00 H ATOM 27 H1' G A 1 5.712 -9.805 -12.221 1.00 0.00 H ATOM 28 H8 G A 1 7.202 -8.117 -9.097 1.00 0.00 H ATOM 29 H1 G A 1 2.066 -11.716 -7.948 1.00 0.00 H ATOM 30 H21 G A 1 1.211 -12.449 -9.858 1.00 0.00 H ATOM 31 H22 G A 1 1.908 -12.053 -11.413 1.00 0.00 H ATOM 32 P A A 2 5.797 -4.614 -13.058 1.00 0.00 P ATOM 33 OP1 A A 2 6.309 -3.550 -13.950 1.00 0.00 O ATOM 34 OP2 A A 2 5.483 -4.306 -11.645 1.00 0.00 O ATOM 35 O5' A A 2 4.485 -5.253 -13.739 1.00 0.00 O ATOM 36 C5' A A 2 4.342 -5.270 -15.161 1.00 0.00 C ATOM 37 C4' A A 2 3.140 -6.103 -15.594 1.00 0.00 C ATOM 38 O4' A A 2 3.081 -7.342 -14.876 1.00 0.00 O ATOM 39 C3' A A 2 1.830 -5.391 -15.285 1.00 0.00 C ATOM 40 O3' A A 2 1.419 -4.654 -16.439 1.00 0.00 O ATOM 41 C2' A A 2 0.872 -6.547 -15.085 1.00 0.00 C ATOM 42 O2' A A 2 0.410 -7.073 -16.336 1.00 0.00 O ATOM 43 C1' A A 2 1.759 -7.539 -14.353 1.00 0.00 C ATOM 44 N9 A A 2 1.729 -7.297 -12.898 1.00 0.00 N ATOM 45 C8 A A 2 2.579 -6.577 -12.126 1.00 0.00 C ATOM 46 N7 A A 2 2.332 -6.520 -10.860 1.00 0.00 N ATOM 47 C5 A A 2 1.172 -7.295 -10.764 1.00 0.00 C ATOM 48 C6 A A 2 0.360 -7.656 -9.684 1.00 0.00 C ATOM 49 N6 A A 2 0.599 -7.270 -8.431 1.00 0.00 N ATOM 50 N1 A A 2 -0.707 -8.431 -9.945 1.00 0.00 N ATOM 51 C2 A A 2 -0.964 -8.829 -11.193 1.00 0.00 C ATOM 52 N3 A A 2 -0.265 -8.548 -12.286 1.00 0.00 N ATOM 53 C4 A A 2 0.799 -7.771 -12.001 1.00 0.00 C ATOM 54 H5' A A 2 5.244 -5.690 -15.604 1.00 0.00 H ATOM 55 H5'' A A 2 4.213 -4.246 -15.517 1.00 0.00 H ATOM 56 H4' A A 2 3.201 -6.310 -16.661 1.00 0.00 H ATOM 57 H3' A A 2 1.905 -4.765 -14.396 1.00 0.00 H ATOM 58 H2' A A 2 0.036 -6.246 -14.450 1.00 0.00 H ATOM 59 HO2' A A 2 -0.527 -7.258 -16.241 1.00 0.00 H ATOM 60 H1' A A 2 1.435 -8.556 -14.565 1.00 0.00 H ATOM 61 H8 A A 2 3.438 -6.064 -12.559 1.00 0.00 H ATOM 62 H61 A A 2 -0.019 -7.562 -7.686 1.00 0.00 H ATOM 63 H62 A A 2 1.398 -6.687 -8.224 1.00 0.00 H ATOM 64 H2 A A 2 -1.847 -9.452 -11.329 1.00 0.00 H ATOM 65 P G A 3 0.822 -3.168 -16.281 1.00 0.00 P ATOM 66 OP1 G A 3 0.436 -2.681 -17.625 1.00 0.00 O ATOM 67 OP2 G A 3 1.756 -2.378 -15.450 1.00 0.00 O ATOM 68 O5' G A 3 -0.524 -3.416 -15.431 1.00 0.00 O ATOM 69 C5' G A 3 -1.753 -3.693 -16.105 1.00 0.00 C ATOM 70 C4' G A 3 -2.755 -4.415 -15.207 1.00 0.00 C ATOM 71 O4' G A 3 -2.122 -5.394 -14.376 1.00 0.00 O ATOM 72 C3' G A 3 -3.425 -3.460 -14.237 1.00 0.00 C ATOM 73 O3' G A 3 -4.572 -2.895 -14.875 1.00 0.00 O ATOM 74 C2' G A 3 -3.888 -4.396 -13.137 1.00 0.00 C ATOM 75 O2' G A 3 -5.127 -5.031 -13.474 1.00 0.00 O ATOM 76 C1' G A 3 -2.742 -5.400 -13.074 1.00 0.00 C ATOM 77 N9 G A 3 -1.778 -5.022 -12.023 1.00 0.00 N ATOM 78 C8 G A 3 -0.490 -4.615 -12.137 1.00 0.00 C ATOM 79 N7 G A 3 0.145 -4.323 -11.053 1.00 0.00 N ATOM 80 C5 G A 3 -0.828 -4.561 -10.079 1.00 0.00 C ATOM 81 C6 G A 3 -0.752 -4.425 -8.667 1.00 0.00 C ATOM 82 O6 G A 3 0.204 -4.063 -7.987 1.00 0.00 O ATOM 83 N1 G A 3 -1.954 -4.766 -8.058 1.00 0.00 N ATOM 84 C2 G A 3 -3.090 -5.187 -8.719 1.00 0.00 C ATOM 85 N2 G A 3 -4.146 -5.468 -7.955 1.00 0.00 N ATOM 86 N3 G A 3 -3.170 -5.317 -10.048 1.00 0.00 N ATOM 87 C4 G A 3 -2.010 -4.991 -10.665 1.00 0.00 C ATOM 88 H5' G A 3 -1.547 -4.315 -16.975 1.00 0.00 H ATOM 89 H5'' G A 3 -2.193 -2.752 -16.438 1.00 0.00 H ATOM 90 H4' G A 3 -3.511 -4.901 -15.821 1.00 0.00 H ATOM 91 H3' G A 3 -2.736 -2.700 -13.866 1.00 0.00 H ATOM 92 H2' G A 3 -3.968 -3.856 -12.190 1.00 0.00 H ATOM 93 HO2' G A 3 -4.944 -5.966 -13.596 1.00 0.00 H ATOM 94 H1' G A 3 -3.135 -6.396 -12.866 1.00 0.00 H ATOM 95 H8 G A 3 -0.011 -4.535 -13.111 1.00 0.00 H ATOM 96 H1 G A 3 -1.976 -4.692 -7.051 1.00 0.00 H ATOM 97 H21 G A 3 -4.084 -5.370 -6.952 1.00 0.00 H ATOM 98 H22 G A 3 -5.007 -5.780 -8.379 1.00 0.00 H ATOM 99 P A A 4 -4.786 -1.300 -14.896 1.00 0.00 P ATOM 100 OP1 A A 4 -5.479 -0.943 -16.153 1.00 0.00 O ATOM 101 OP2 A A 4 -3.500 -0.654 -14.551 1.00 0.00 O ATOM 102 O5' A A 4 -5.807 -1.075 -13.675 1.00 0.00 O ATOM 103 C5' A A 4 -7.214 -1.202 -13.881 1.00 0.00 C ATOM 104 C4' A A 4 -7.922 -1.687 -12.622 1.00 0.00 C ATOM 105 O4' A A 4 -7.154 -2.694 -11.951 1.00 0.00 O ATOM 106 C3' A A 4 -8.095 -0.563 -11.615 1.00 0.00 C ATOM 107 O3' A A 4 -9.380 0.029 -11.821 1.00 0.00 O ATOM 108 C2' A A 4 -8.111 -1.305 -10.293 1.00 0.00 C ATOM 109 O2' A A 4 -9.409 -1.844 -10.012 1.00 0.00 O ATOM 110 C1' A A 4 -7.092 -2.408 -10.544 1.00 0.00 C ATOM 111 N9 A A 4 -5.737 -1.976 -10.148 1.00 0.00 N ATOM 112 C8 A A 4 -4.649 -1.712 -10.915 1.00 0.00 C ATOM 113 N7 A A 4 -3.567 -1.349 -10.311 1.00 0.00 N ATOM 114 C5 A A 4 -3.972 -1.368 -8.972 1.00 0.00 C ATOM 115 C6 A A 4 -3.304 -1.082 -7.777 1.00 0.00 C ATOM 116 N6 A A 4 -2.028 -0.702 -7.729 1.00 0.00 N ATOM 117 N1 A A 4 -4.002 -1.201 -6.634 1.00 0.00 N ATOM 118 C2 A A 4 -5.281 -1.580 -6.661 1.00 0.00 C ATOM 119 N3 A A 4 -6.009 -1.875 -7.733 1.00 0.00 N ATOM 120 C4 A A 4 -5.290 -1.748 -8.866 1.00 0.00 C ATOM 121 H5' A A 4 -7.394 -1.912 -14.689 1.00 0.00 H ATOM 122 H5'' A A 4 -7.619 -0.230 -14.164 1.00 0.00 H ATOM 123 H4' A A 4 -8.897 -2.092 -12.881 1.00 0.00 H ATOM 124 H3' A A 4 -7.287 0.167 -11.669 1.00 0.00 H ATOM 125 H2' A A 4 -7.772 -0.654 -9.486 1.00 0.00 H ATOM 126 HO2' A A 4 -9.663 -1.534 -9.140 1.00 0.00 H ATOM 127 H1' A A 4 -7.373 -3.297 -9.977 1.00 0.00 H ATOM 128 H8 A A 4 -4.689 -1.796 -12.001 1.00 0.00 H ATOM 129 H61 A A 4 -1.593 -0.505 -6.839 1.00 0.00 H ATOM 130 H62 A A 4 -1.496 -0.608 -8.583 1.00 0.00 H ATOM 131 H2 A A 4 -5.786 -1.647 -5.699 1.00 0.00 H ATOM 132 P G A 5 -9.557 1.628 -11.799 1.00 0.00 P ATOM 133 OP1 G A 5 -10.837 1.964 -12.462 1.00 0.00 O ATOM 134 OP2 G A 5 -8.297 2.241 -12.273 1.00 0.00 O ATOM 135 O5' G A 5 -9.710 1.938 -10.228 1.00 0.00 O ATOM 136 C5' G A 5 -10.547 1.117 -9.410 1.00 0.00 C ATOM 137 C4' G A 5 -10.385 1.443 -7.933 1.00 0.00 C ATOM 138 O4' G A 5 -9.346 0.667 -7.346 1.00 0.00 O ATOM 139 C3' G A 5 -9.978 2.891 -7.736 1.00 0.00 C ATOM 140 O3' G A 5 -11.160 3.666 -7.539 1.00 0.00 O ATOM 141 C2' G A 5 -9.202 2.866 -6.430 1.00 0.00 C ATOM 142 O2' G A 5 -10.063 3.094 -5.309 1.00 0.00 O ATOM 143 C1' G A 5 -8.610 1.457 -6.402 1.00 0.00 C ATOM 144 N9 G A 5 -7.177 1.482 -6.742 1.00 0.00 N ATOM 145 C8 G A 5 -6.575 1.415 -7.953 1.00 0.00 C ATOM 146 N7 G A 5 -5.286 1.454 -7.984 1.00 0.00 N ATOM 147 C5 G A 5 -4.973 1.560 -6.626 1.00 0.00 C ATOM 148 C6 G A 5 -3.706 1.646 -5.990 1.00 0.00 C ATOM 149 O6 G A 5 -2.592 1.644 -6.508 1.00 0.00 O ATOM 150 N1 G A 5 -3.835 1.740 -4.610 1.00 0.00 N ATOM 151 C2 G A 5 -5.032 1.751 -3.922 1.00 0.00 C ATOM 152 N2 G A 5 -4.951 1.848 -2.596 1.00 0.00 N ATOM 153 N3 G A 5 -6.227 1.671 -4.515 1.00 0.00 N ATOM 154 C4 G A 5 -6.126 1.579 -5.860 1.00 0.00 C ATOM 155 H5' G A 5 -10.283 0.071 -9.570 1.00 0.00 H ATOM 156 H5'' G A 5 -11.587 1.270 -9.698 1.00 0.00 H ATOM 157 H4' G A 5 -11.320 1.250 -7.409 1.00 0.00 H ATOM 158 H3' G A 5 -9.374 3.263 -8.564 1.00 0.00 H ATOM 159 H2' G A 5 -8.400 3.607 -6.460 1.00 0.00 H ATOM 160 HO2' G A 5 -9.966 2.345 -4.717 1.00 0.00 H ATOM 161 H1' G A 5 -8.736 1.033 -5.409 1.00 0.00 H ATOM 162 H8 G A 5 -7.157 1.333 -8.869 1.00 0.00 H ATOM 163 H1 G A 5 -2.973 1.804 -4.088 1.00 0.00 H ATOM 164 H21 G A 5 -4.048 1.908 -2.149 1.00 0.00 H ATOM 165 H22 G A 5 -5.794 1.861 -2.039 1.00 0.00 H HETATM 166 N1 PSU A 6 -6.382 7.220 -9.850 1.00 0.00 N HETATM 167 C2 PSU A 6 -5.108 7.490 -10.263 1.00 0.00 C HETATM 168 N3 PSU A 6 -4.124 7.566 -9.314 1.00 0.00 N HETATM 169 C4 PSU A 6 -4.298 7.392 -7.946 1.00 0.00 C HETATM 170 C5 PSU A 6 -5.665 7.113 -7.589 1.00 0.00 C HETATM 171 C6 PSU A 6 -6.651 7.033 -8.524 1.00 0.00 C HETATM 172 O2 PSU A 6 -4.852 7.661 -11.454 1.00 0.00 O HETATM 173 O4 PSU A 6 -3.328 7.487 -7.197 1.00 0.00 O HETATM 174 C1' PSU A 6 -6.028 6.922 -6.141 1.00 0.00 C HETATM 175 C2' PSU A 6 -6.224 8.274 -5.463 1.00 0.00 C HETATM 176 O2' PSU A 6 -5.665 8.286 -4.145 1.00 0.00 O HETATM 177 C3' PSU A 6 -7.733 8.438 -5.428 1.00 0.00 C HETATM 178 C4' PSU A 6 -8.252 7.008 -5.369 1.00 0.00 C HETATM 179 O3' PSU A 6 -8.082 9.097 -4.207 1.00 0.00 O HETATM 180 O4' PSU A 6 -7.267 6.203 -6.022 1.00 0.00 O HETATM 181 C5' PSU A 6 -9.613 6.886 -6.056 1.00 0.00 C HETATM 182 O5' PSU A 6 -9.848 5.564 -6.544 1.00 0.00 O HETATM 183 P PSU A 6 -11.088 5.271 -7.530 1.00 0.00 P HETATM 184 OP1 PSU A 6 -12.318 5.786 -6.891 1.00 0.00 O HETATM 185 OP2 PSU A 6 -10.717 5.726 -8.890 1.00 0.00 O HETATM 186 HN1 PSU A 6 -7.107 7.163 -10.550 1.00 0.00 H HETATM 187 HN3 PSU A 6 -3.188 7.767 -9.637 1.00 0.00 H HETATM 188 H6 PSU A 6 -7.668 6.813 -8.206 1.00 0.00 H HETATM 189 H1' PSU A 6 -5.234 6.370 -5.639 1.00 0.00 H HETATM 190 H2' PSU A 6 -5.786 9.060 -6.078 1.00 0.00 H HETATM 191 HO2' PSU A 6 -4.986 7.608 -4.116 1.00 0.00 H HETATM 192 H3' PSU A 6 -8.102 8.973 -6.303 1.00 0.00 H HETATM 193 H4' PSU A 6 -8.340 6.695 -4.329 1.00 0.00 H HETATM 194 H5' PSU A 6 -10.394 7.145 -5.342 1.00 0.00 H HETATM 195 H5'' PSU A 6 -9.653 7.582 -6.894 1.00 0.00 H HETATM 196 N1 PSU A 7 -5.278 12.613 -7.497 1.00 0.00 N HETATM 197 C2 PSU A 7 -4.502 13.499 -8.192 1.00 0.00 C HETATM 198 N3 PSU A 7 -3.200 13.659 -7.801 1.00 0.00 N HETATM 199 C4 PSU A 7 -2.576 13.001 -6.749 1.00 0.00 C HETATM 200 C5 PSU A 7 -3.453 12.086 -6.062 1.00 0.00 C HETATM 201 C6 PSU A 7 -4.756 11.915 -6.443 1.00 0.00 C HETATM 202 O2 PSU A 7 -4.961 14.133 -9.140 1.00 0.00 O HETATM 203 O4 PSU A 7 -1.397 13.238 -6.502 1.00 0.00 O HETATM 204 C1' PSU A 7 -2.917 11.304 -4.888 1.00 0.00 C HETATM 205 C2' PSU A 7 -2.556 12.246 -3.731 1.00 0.00 C HETATM 206 O2' PSU A 7 -1.156 12.187 -3.434 1.00 0.00 O HETATM 207 C3' PSU A 7 -3.389 11.736 -2.556 1.00 0.00 C HETATM 208 C4' PSU A 7 -4.476 10.892 -3.202 1.00 0.00 C HETATM 209 O3' PSU A 7 -2.566 10.874 -1.766 1.00 0.00 O HETATM 210 O4' PSU A 7 -3.901 10.384 -4.399 1.00 0.00 O HETATM 211 C5' PSU A 7 -5.721 11.723 -3.496 1.00 0.00 C HETATM 212 O5' PSU A 7 -6.556 11.084 -4.467 1.00 0.00 O HETATM 213 P PSU A 7 -8.082 10.706 -4.114 1.00 0.00 P HETATM 214 OP1 PSU A 7 -8.339 11.088 -2.708 1.00 0.00 O HETATM 215 OP2 PSU A 7 -8.949 11.232 -5.191 1.00 0.00 O HETATM 216 HN1 PSU A 7 -6.239 12.494 -7.786 1.00 0.00 H HETATM 217 HN3 PSU A 7 -2.641 14.318 -8.324 1.00 0.00 H HETATM 218 H6 PSU A 7 -5.387 11.212 -5.900 1.00 0.00 H HETATM 219 H1' PSU A 7 -2.030 10.755 -5.199 1.00 0.00 H HETATM 220 H2' PSU A 7 -2.852 13.270 -3.976 1.00 0.00 H HETATM 221 HO2' PSU A 7 -1.068 11.872 -2.532 1.00 0.00 H HETATM 222 H3' PSU A 7 -3.805 12.554 -1.967 1.00 0.00 H HETATM 223 H4' PSU A 7 -4.733 10.064 -2.545 1.00 0.00 H HETATM 224 H5' PSU A 7 -6.285 11.857 -2.575 1.00 0.00 H HETATM 225 H5'' PSU A 7 -5.417 12.698 -3.874 1.00 0.00 H ATOM 226 P G A 8 -1.790 11.437 -0.472 1.00 0.00 P ATOM 227 OP1 G A 8 -0.801 10.422 -0.047 1.00 0.00 O ATOM 228 OP2 G A 8 -2.796 11.936 0.492 1.00 0.00 O ATOM 229 O5' G A 8 -0.989 12.703 -1.065 1.00 0.00 O ATOM 230 C5' G A 8 0.430 12.650 -1.234 1.00 0.00 C ATOM 231 C4' G A 8 1.004 14.025 -1.567 1.00 0.00 C ATOM 232 O4' G A 8 0.169 15.065 -1.077 1.00 0.00 O ATOM 233 C3' G A 8 2.349 14.238 -0.896 1.00 0.00 C ATOM 234 O3' G A 8 3.088 15.190 -1.668 1.00 0.00 O ATOM 235 C2' G A 8 2.002 14.877 0.445 1.00 0.00 C ATOM 236 O2' G A 8 2.929 15.915 0.778 1.00 0.00 O ATOM 237 C1' G A 8 0.590 15.439 0.240 1.00 0.00 C ATOM 238 N9 G A 8 -0.336 14.909 1.258 1.00 0.00 N ATOM 239 C8 G A 8 -1.478 14.193 1.103 1.00 0.00 C ATOM 240 N7 G A 8 -2.113 13.843 2.171 1.00 0.00 N ATOM 241 C5 G A 8 -1.305 14.387 3.175 1.00 0.00 C ATOM 242 C6 G A 8 -1.459 14.351 4.587 1.00 0.00 C ATOM 243 O6 G A 8 -2.354 13.823 5.244 1.00 0.00 O ATOM 244 N1 G A 8 -0.424 15.021 5.230 1.00 0.00 N ATOM 245 C2 G A 8 0.630 15.649 4.598 1.00 0.00 C ATOM 246 N2 G A 8 1.527 16.239 5.389 1.00 0.00 N ATOM 247 N3 G A 8 0.781 15.687 3.270 1.00 0.00 N ATOM 248 C4 G A 8 -0.214 15.041 2.622 1.00 0.00 C ATOM 249 H5' G A 8 0.667 11.960 -2.044 1.00 0.00 H ATOM 250 H5'' G A 8 0.886 12.288 -0.312 1.00 0.00 H ATOM 251 H4' G A 8 1.111 14.125 -2.646 1.00 0.00 H ATOM 252 H3' G A 8 2.894 13.302 -0.769 1.00 0.00 H ATOM 253 H2' G A 8 1.986 14.112 1.226 1.00 0.00 H ATOM 254 HO2' G A 8 3.119 15.838 1.715 1.00 0.00 H ATOM 255 H1' G A 8 0.620 16.525 0.314 1.00 0.00 H ATOM 256 H8 G A 8 -1.846 13.922 0.113 1.00 0.00 H ATOM 257 H1 G A 8 -0.466 15.037 6.238 1.00 0.00 H ATOM 258 H21 G A 8 1.412 16.210 6.393 1.00 0.00 H ATOM 259 H22 G A 8 2.321 16.714 4.986 1.00 0.00 H ATOM 260 P G A 9 4.698 15.210 -1.623 1.00 0.00 P ATOM 261 OP1 G A 9 5.120 16.037 -0.471 1.00 0.00 O ATOM 262 OP2 G A 9 5.195 15.528 -2.981 1.00 0.00 O ATOM 263 O5' G A 9 5.061 13.675 -1.300 1.00 0.00 O ATOM 264 C5' G A 9 4.926 12.667 -2.305 1.00 0.00 C ATOM 265 C4' G A 9 6.184 11.806 -2.405 1.00 0.00 C ATOM 266 O4' G A 9 6.855 11.732 -1.146 1.00 0.00 O ATOM 267 C3' G A 9 5.847 10.365 -2.813 1.00 0.00 C ATOM 268 O3' G A 9 6.473 10.101 -4.071 1.00 0.00 O ATOM 269 C2' G A 9 6.521 9.495 -1.761 1.00 0.00 C ATOM 270 O2' G A 9 7.790 9.010 -2.218 1.00 0.00 O ATOM 271 C1' G A 9 6.675 10.438 -0.583 1.00 0.00 C ATOM 272 N9 G A 9 5.488 10.401 0.291 1.00 0.00 N ATOM 273 C8 G A 9 5.404 10.598 1.626 1.00 0.00 C ATOM 274 N7 G A 9 4.239 10.517 2.173 1.00 0.00 N ATOM 275 C5 G A 9 3.427 10.230 1.072 1.00 0.00 C ATOM 276 C6 G A 9 2.023 10.019 1.007 1.00 0.00 C ATOM 277 O6 G A 9 1.206 10.045 1.924 1.00 0.00 O ATOM 278 N1 G A 9 1.607 9.757 -0.291 1.00 0.00 N ATOM 279 C2 G A 9 2.433 9.702 -1.396 1.00 0.00 C ATOM 280 N2 G A 9 1.842 9.437 -2.560 1.00 0.00 N ATOM 281 N3 G A 9 3.756 9.899 -1.346 1.00 0.00 N ATOM 282 C4 G A 9 4.186 10.156 -0.087 1.00 0.00 C ATOM 283 H5' G A 9 4.746 13.146 -3.266 1.00 0.00 H ATOM 284 H5'' G A 9 4.077 12.034 -2.057 1.00 0.00 H ATOM 285 H4' G A 9 6.858 12.238 -3.139 1.00 0.00 H ATOM 286 H3' G A 9 4.772 10.188 -2.853 1.00 0.00 H ATOM 287 H2' G A 9 5.865 8.668 -1.488 1.00 0.00 H ATOM 288 HO2' G A 9 8.209 8.567 -1.478 1.00 0.00 H ATOM 289 H1' G A 9 7.559 10.162 -0.009 1.00 0.00 H ATOM 290 H8 G A 9 6.292 10.817 2.214 1.00 0.00 H ATOM 291 H1 G A 9 0.617 9.597 -0.415 1.00 0.00 H ATOM 292 H21 G A 9 0.844 9.290 -2.597 1.00 0.00 H ATOM 293 H22 G A 9 2.392 9.384 -3.406 1.00 0.00 H ATOM 294 P G A 10 6.214 8.707 -4.834 1.00 0.00 P ATOM 295 OP1 G A 10 7.487 7.954 -4.865 1.00 0.00 O ATOM 296 OP2 G A 10 5.497 8.997 -6.096 1.00 0.00 O ATOM 297 O5' G A 10 5.201 7.942 -3.841 1.00 0.00 O ATOM 298 C5' G A 10 5.638 6.798 -3.102 1.00 0.00 C ATOM 299 C4' G A 10 4.685 6.473 -1.946 1.00 0.00 C ATOM 300 O4' G A 10 3.658 7.464 -1.836 1.00 0.00 O ATOM 301 C3' G A 10 3.982 5.122 -2.145 1.00 0.00 C ATOM 302 O3' G A 10 4.451 4.232 -1.129 1.00 0.00 O ATOM 303 C2' G A 10 2.509 5.404 -1.874 1.00 0.00 C ATOM 304 O2' G A 10 2.156 5.081 -0.524 1.00 0.00 O ATOM 305 C1' G A 10 2.383 6.896 -2.140 1.00 0.00 C ATOM 306 N9 G A 10 2.004 7.167 -3.539 1.00 0.00 N ATOM 307 C8 G A 10 2.751 7.650 -4.564 1.00 0.00 C ATOM 308 N7 G A 10 2.166 7.820 -5.702 1.00 0.00 N ATOM 309 C5 G A 10 0.864 7.402 -5.419 1.00 0.00 C ATOM 310 C6 G A 10 -0.276 7.346 -6.264 1.00 0.00 C ATOM 311 O6 G A 10 -0.362 7.660 -7.449 1.00 0.00 O ATOM 312 N1 G A 10 -1.389 6.865 -5.587 1.00 0.00 N ATOM 313 C2 G A 10 -1.411 6.484 -4.261 1.00 0.00 C ATOM 314 N2 G A 10 -2.580 6.050 -3.792 1.00 0.00 N ATOM 315 N3 G A 10 -0.343 6.534 -3.458 1.00 0.00 N ATOM 316 C4 G A 10 0.755 7.000 -4.097 1.00 0.00 C ATOM 317 H5' G A 10 6.628 7.002 -2.694 1.00 0.00 H ATOM 318 H5'' G A 10 5.704 5.946 -3.775 1.00 0.00 H ATOM 319 H4' G A 10 5.252 6.446 -1.015 1.00 0.00 H ATOM 320 H3' G A 10 4.134 4.711 -3.141 1.00 0.00 H ATOM 321 H2' G A 10 1.887 4.848 -2.580 1.00 0.00 H ATOM 322 HO2' G A 10 1.234 5.324 -0.404 1.00 0.00 H ATOM 323 H1' G A 10 1.629 7.317 -1.474 1.00 0.00 H ATOM 324 H8 G A 10 3.807 7.885 -4.433 1.00 0.00 H ATOM 325 H1 G A 10 -2.240 6.798 -6.126 1.00 0.00 H ATOM 326 H21 G A 10 -3.386 6.014 -4.400 1.00 0.00 H ATOM 327 H22 G A 10 -2.661 5.755 -2.829 1.00 0.00 H ATOM 328 P C A 11 4.416 2.640 -1.358 1.00 0.00 P ATOM 329 OP1 C A 11 5.632 2.056 -0.750 1.00 0.00 O ATOM 330 OP2 C A 11 4.106 2.383 -2.783 1.00 0.00 O ATOM 331 O5' C A 11 3.145 2.189 -0.478 1.00 0.00 O ATOM 332 C5' C A 11 3.203 2.232 0.950 1.00 0.00 C ATOM 333 C4' C A 11 1.821 2.428 1.565 1.00 0.00 C ATOM 334 O4' C A 11 1.106 3.489 0.912 1.00 0.00 O ATOM 335 C3' C A 11 0.963 1.181 1.394 1.00 0.00 C ATOM 336 O3' C A 11 1.033 0.404 2.593 1.00 0.00 O ATOM 337 C2' C A 11 -0.435 1.752 1.277 1.00 0.00 C ATOM 338 O2' C A 11 -0.995 2.037 2.564 1.00 0.00 O ATOM 339 C1' C A 11 -0.180 3.019 0.486 1.00 0.00 C ATOM 340 N1 C A 11 -0.192 2.745 -0.964 1.00 0.00 N ATOM 341 C2 C A 11 -1.422 2.533 -1.565 1.00 0.00 C ATOM 342 O2 C A 11 -2.451 2.577 -0.894 1.00 0.00 O ATOM 343 N3 C A 11 -1.451 2.276 -2.902 1.00 0.00 N ATOM 344 C4 C A 11 -0.319 2.232 -3.618 1.00 0.00 C ATOM 345 N4 C A 11 -0.381 1.979 -4.925 1.00 0.00 N ATOM 346 C5 C A 11 0.952 2.451 -2.999 1.00 0.00 C ATOM 347 C6 C A 11 0.968 2.704 -1.677 1.00 0.00 C ATOM 348 H5' C A 11 3.848 3.056 1.255 1.00 0.00 H ATOM 349 H5'' C A 11 3.627 1.297 1.317 1.00 0.00 H ATOM 350 H4' C A 11 1.922 2.661 2.624 1.00 0.00 H ATOM 351 H3' C A 11 1.245 0.607 0.510 1.00 0.00 H ATOM 352 H2' C A 11 -1.074 1.079 0.710 1.00 0.00 H ATOM 353 HO2' C A 11 -1.878 2.386 2.419 1.00 0.00 H ATOM 354 H1' C A 11 -0.945 3.755 0.725 1.00 0.00 H ATOM 355 H41 C A 11 -1.276 1.824 -5.368 1.00 0.00 H ATOM 356 H42 C A 11 0.466 1.943 -5.473 1.00 0.00 H ATOM 357 H5 C A 11 1.875 2.416 -3.578 1.00 0.00 H ATOM 358 H6 C A 11 1.917 2.874 -1.171 1.00 0.00 H HETATM 359 N1 PSU A 12 -1.231 -0.529 -2.503 1.00 0.00 N HETATM 360 C2 PSU A 12 -1.734 -0.642 -3.769 1.00 0.00 C HETATM 361 N3 PSU A 12 -3.064 -0.944 -3.908 1.00 0.00 N HETATM 362 C4 PSU A 12 -3.967 -1.151 -2.873 1.00 0.00 C HETATM 363 C5 PSU A 12 -3.365 -1.016 -1.570 1.00 0.00 C HETATM 364 C6 PSU A 12 -2.040 -0.715 -1.418 1.00 0.00 C HETATM 365 O2 PSU A 12 -1.017 -0.478 -4.753 1.00 0.00 O HETATM 366 O4 PSU A 12 -5.138 -1.417 -3.135 1.00 0.00 O HETATM 367 C1' PSU A 12 -4.216 -1.217 -0.342 1.00 0.00 C HETATM 368 C2' PSU A 12 -4.115 -2.660 0.148 1.00 0.00 C HETATM 369 O2' PSU A 12 -5.367 -3.126 0.661 1.00 0.00 O HETATM 370 C3' PSU A 12 -3.068 -2.559 1.244 1.00 0.00 C HETATM 371 C4' PSU A 12 -3.338 -1.190 1.838 1.00 0.00 C HETATM 372 O3' PSU A 12 -3.351 -3.548 2.236 1.00 0.00 O HETATM 373 O4' PSU A 12 -3.763 -0.379 0.738 1.00 0.00 O HETATM 374 C5' PSU A 12 -2.089 -0.623 2.509 1.00 0.00 C HETATM 375 O5' PSU A 12 -0.896 -1.017 1.823 1.00 0.00 O HETATM 376 P PSU A 12 0.506 -1.119 2.611 1.00 0.00 P HETATM 377 OP1 PSU A 12 0.222 -1.493 4.015 1.00 0.00 O HETATM 378 OP2 PSU A 12 1.434 -1.939 1.803 1.00 0.00 O HETATM 379 HN1 PSU A 12 -0.250 -0.307 -2.400 1.00 0.00 H HETATM 380 HN3 PSU A 12 -3.419 -1.025 -4.850 1.00 0.00 H HETATM 381 H6 PSU A 12 -1.623 -0.625 -0.418 1.00 0.00 H HETATM 382 H1' PSU A 12 -5.253 -0.982 -0.577 1.00 0.00 H HETATM 383 H2' PSU A 12 -3.755 -3.306 -0.657 1.00 0.00 H HETATM 384 HO2' PSU A 12 -5.194 -3.939 1.140 1.00 0.00 H HETATM 385 H3' PSU A 12 -2.055 -2.643 0.852 1.00 0.00 H HETATM 386 H4' PSU A 12 -4.145 -1.260 2.567 1.00 0.00 H HETATM 387 H5' PSU A 12 -2.154 0.463 2.518 1.00 0.00 H HETATM 388 H5'' PSU A 12 -2.043 -0.986 3.536 1.00 0.00 H ATOM 389 P C A 13 -2.638 -4.988 2.171 1.00 0.00 P ATOM 390 OP1 C A 13 -3.017 -5.748 3.384 1.00 0.00 O ATOM 391 OP2 C A 13 -1.210 -4.783 1.842 1.00 0.00 O ATOM 392 O5' C A 13 -3.357 -5.672 0.904 1.00 0.00 O ATOM 393 C5' C A 13 -4.647 -6.269 1.039 1.00 0.00 C ATOM 394 C4' C A 13 -5.314 -6.478 -0.316 1.00 0.00 C ATOM 395 O4' C A 13 -5.142 -5.349 -1.171 1.00 0.00 O ATOM 396 C3' C A 13 -4.678 -7.633 -1.060 1.00 0.00 C ATOM 397 O3' C A 13 -5.368 -8.834 -0.705 1.00 0.00 O ATOM 398 C2' C A 13 -4.981 -7.316 -2.515 1.00 0.00 C ATOM 399 O2' C A 13 -6.220 -7.900 -2.930 1.00 0.00 O ATOM 400 C1' C A 13 -5.050 -5.788 -2.538 1.00 0.00 C ATOM 401 N1 C A 13 -3.856 -5.232 -3.200 1.00 0.00 N ATOM 402 C2 C A 13 -3.927 -5.021 -4.567 1.00 0.00 C ATOM 403 O2 C A 13 -4.970 -5.257 -5.173 1.00 0.00 O ATOM 404 N3 C A 13 -2.822 -4.551 -5.206 1.00 0.00 N ATOM 405 C4 C A 13 -1.695 -4.298 -4.529 1.00 0.00 C ATOM 406 N4 C A 13 -0.625 -3.844 -5.185 1.00 0.00 N ATOM 407 C5 C A 13 -1.619 -4.510 -3.119 1.00 0.00 C ATOM 408 C6 C A 13 -2.718 -4.975 -2.495 1.00 0.00 C ATOM 409 H5' C A 13 -5.276 -5.623 1.651 1.00 0.00 H ATOM 410 H5'' C A 13 -4.541 -7.234 1.535 1.00 0.00 H ATOM 411 H4' C A 13 -6.377 -6.668 -0.178 1.00 0.00 H ATOM 412 H3' C A 13 -3.606 -7.700 -0.871 1.00 0.00 H ATOM 413 H2' C A 13 -4.160 -7.656 -3.147 1.00 0.00 H ATOM 414 HO2' C A 13 -6.923 -7.324 -2.625 1.00 0.00 H ATOM 415 H1' C A 13 -5.941 -5.479 -3.082 1.00 0.00 H ATOM 416 H41 C A 13 -0.670 -3.692 -6.182 1.00 0.00 H ATOM 417 H42 C A 13 0.231 -3.653 -4.684 1.00 0.00 H ATOM 418 H5 C A 13 -0.700 -4.319 -2.571 1.00 0.00 H ATOM 419 H6 C A 13 -2.698 -5.146 -1.419 1.00 0.00 H HETATM 420 N1 PSU A 14 -2.459 -8.702 -4.883 1.00 0.00 N HETATM 421 C2 PSU A 14 -1.650 -8.468 -5.958 1.00 0.00 C HETATM 422 N3 PSU A 14 -2.054 -8.932 -7.184 1.00 0.00 N HETATM 423 C4 PSU A 14 -3.227 -9.629 -7.444 1.00 0.00 C HETATM 424 C5 PSU A 14 -4.027 -9.837 -6.265 1.00 0.00 C HETATM 425 C6 PSU A 14 -3.634 -9.379 -5.038 1.00 0.00 C HETATM 426 O2 PSU A 14 -0.589 -7.860 -5.831 1.00 0.00 O HETATM 427 O4 PSU A 14 -3.472 -9.990 -8.593 1.00 0.00 O HETATM 428 C1' PSU A 14 -5.334 -10.576 -6.386 1.00 0.00 C HETATM 429 C2' PSU A 14 -5.149 -12.056 -6.072 1.00 0.00 C HETATM 430 O2' PSU A 14 -6.047 -12.869 -6.835 1.00 0.00 O HETATM 431 C3' PSU A 14 -5.461 -12.123 -4.587 1.00 0.00 C HETATM 432 C4' PSU A 14 -6.490 -11.017 -4.382 1.00 0.00 C HETATM 433 O3' PSU A 14 -6.094 -13.377 -4.319 1.00 0.00 O HETATM 434 O4' PSU A 14 -6.290 -10.073 -5.442 1.00 0.00 O HETATM 435 C5' PSU A 14 -6.316 -10.356 -3.018 1.00 0.00 C HETATM 436 O5' PSU A 14 -4.996 -10.550 -2.501 1.00 0.00 O HETATM 437 P PSU A 14 -4.678 -10.268 -0.949 1.00 0.00 P HETATM 438 OP1 PSU A 14 -5.398 -11.274 -0.137 1.00 0.00 O HETATM 439 OP2 PSU A 14 -3.214 -10.108 -0.796 1.00 0.00 O HETATM 440 HN1 PSU A 14 -2.161 -8.360 -3.981 1.00 0.00 H HETATM 441 HN3 PSU A 14 -1.443 -8.751 -7.967 1.00 0.00 H HETATM 442 H6 PSU A 14 -4.269 -9.556 -4.172 1.00 0.00 H HETATM 443 H1' PSU A 14 -5.720 -10.463 -7.398 1.00 0.00 H HETATM 444 H2' PSU A 14 -4.111 -12.349 -6.251 1.00 0.00 H HETATM 445 HO2' PSU A 14 -6.499 -13.450 -6.218 1.00 0.00 H HETATM 446 H3' PSU A 14 -4.571 -11.972 -3.975 1.00 0.00 H HETATM 447 H4' PSU A 14 -7.492 -11.435 -4.457 1.00 0.00 H HETATM 448 H5' PSU A 14 -6.506 -9.286 -3.113 1.00 0.00 H HETATM 449 H5'' PSU A 14 -7.036 -10.784 -2.321 1.00 0.00 H ATOM 450 P C A 15 -5.217 -14.681 -3.965 1.00 0.00 P ATOM 451 OP1 C A 15 -6.145 -15.793 -3.657 1.00 0.00 O ATOM 452 OP2 C A 15 -4.181 -14.290 -2.982 1.00 0.00 O ATOM 453 O5' C A 15 -4.488 -15.007 -5.363 1.00 0.00 O ATOM 454 C5' C A 15 -5.193 -15.687 -6.405 1.00 0.00 C ATOM 455 C4' C A 15 -4.351 -15.803 -7.672 1.00 0.00 C ATOM 456 O4' C A 15 -3.867 -14.525 -8.091 1.00 0.00 O ATOM 457 C3' C A 15 -3.117 -16.656 -7.435 1.00 0.00 C ATOM 458 O3' C A 15 -3.393 -18.047 -7.635 1.00 0.00 O ATOM 459 C2' C A 15 -2.154 -16.123 -8.481 1.00 0.00 C ATOM 460 O2' C A 15 -2.345 -16.768 -9.745 1.00 0.00 O ATOM 461 C1' C A 15 -2.513 -14.642 -8.551 1.00 0.00 C ATOM 462 N1 C A 15 -1.601 -13.835 -7.719 1.00 0.00 N ATOM 463 C2 C A 15 -0.487 -13.290 -8.338 1.00 0.00 C ATOM 464 O2 C A 15 -0.287 -13.492 -9.534 1.00 0.00 O ATOM 465 N3 C A 15 0.364 -12.537 -7.590 1.00 0.00 N ATOM 466 C4 C A 15 0.134 -12.327 -6.287 1.00 0.00 C ATOM 467 N4 C A 15 0.988 -11.583 -5.584 1.00 0.00 N ATOM 468 C5 C A 15 -1.014 -12.889 -5.643 1.00 0.00 C ATOM 469 C6 C A 15 -1.850 -13.632 -6.393 1.00 0.00 C ATOM 470 H5' C A 15 -6.106 -15.137 -6.635 1.00 0.00 H ATOM 471 H5'' C A 15 -5.458 -16.687 -6.062 1.00 0.00 H ATOM 472 H4' C A 15 -4.950 -16.241 -8.470 1.00 0.00 H ATOM 473 H3' C A 15 -2.722 -16.475 -6.432 1.00 0.00 H ATOM 474 H2' C A 15 -1.124 -16.242 -8.136 1.00 0.00 H ATOM 475 HO2' C A 15 -2.381 -17.713 -9.581 1.00 0.00 H ATOM 476 H1' C A 15 -2.454 -14.304 -9.585 1.00 0.00 H ATOM 477 H41 C A 15 1.799 -11.185 -6.035 1.00 0.00 H ATOM 478 H42 C A 15 0.824 -11.418 -4.601 1.00 0.00 H ATOM 479 H5 C A 15 -1.210 -12.712 -4.586 1.00 0.00 H ATOM 480 H6 C A 15 -2.732 -14.080 -5.935 1.00 0.00 H TER 481 C A 15 ENDMDL MASTER 0 0 0 0 0 0 0 6 319 1 0 2 END