HEADER RNA 01-FEB-03 XXXX TITLE THE LEADZYME RIBOZYME BOUND TO MG(H2O)6(II) AND SR(II) AT 1.8 A TITLE 2 RESOLUTION KEYWDS RIBOZYME, LEADZYME, LEAD-DEPENDENT CLEAVAGE, RNA, MG(H2O)6(II), KEYWDS 2 BULGED NUCLEOTIDES, HYDRATED MAGNESIUM, SR(II), PSEUDOHELICAL KEYWDS 3 PACKING, STICKY ENDS, ALTERNATE CONFORMATION, HOMOPURINE BASE PAIRS EXPDTA X-RAY DIFFRACTION AUTHOR J.E.WEDEKIND,D.B.MCKAY JRNL AUTH J.E.WEDEKIND,D.B.MCKAY JRNL TITL CRYSTAL STRUCTURE OF THE LEADZYME AT 1.8 A RESOLUTION: METAL JRNL TITL 2 ION BINDING AND THE IMPLICATIONS FOR CATALYTIC MECHANISM AND JRNL TITL 3 ALLO SITE ION REGULATION. JRNL REF BIOCHEMISTRY V. 42 9554 2003 JRNL REFN ISSN 0006-2960 JRNL PMID 12911297 JRNL DOI 10.1021/BI0300783 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH J.E.WEDEKIND,D.B.MCKAY REMARK 1 TITL CRYSTAL STRUCTURE OF A LEAD DEPENDENT RIBOZYME REVEALING REMARK 1 TITL 2 METAL BINDING SITES RELEVANT TO CATALYSIS REMARK 1 REF NAT.STRUCT.BIOL. V. 6 261 1999 REMARK 1 REFN ISSN 1072-8368 REMARK 1 DOI 10.1038/6700 SEQRES 1 A 13 C G G A C C G A G C C A G SEQRES 1 B 11 G C U G G G A G U C C SEQRES 1 C 13 C G G A C C G A G C C A G SEQRES 1 D 11 G C U G G G A G U C C SEQRES 1 E 13 C G G A C C G A G C C A G SEQRES 1 F 11 G C U G G G A G U C C SEQRES 1 G 13 C G G A C C G A G C C A G SEQRES 1 H 11 G C U G G G A G U C C HETNAM MG MAGNESIUM ION HETNAM SR STRONTIUM ION FORMUL 9 MG 10(MG 2+) FORMUL 12 SR 6(SR 2+) FORMUL 25 HOH *407(H2 O) LINK MG MG A 410 O HOH A 414 1555 1555 2.23 LINK MG MG A 410 O HOH A 412 1555 1555 2.01 LINK MG MG A 410 O HOH A 415 1555 1555 2.04 LINK MG MG A 410 O HOH A 413 1555 1555 2.02 LINK MG MG A 410 O HOH A 416 1555 1555 2.19 LINK MG MG A 410 O HOH B 425 1555 1555 2.20 LINK MG MG A 411 O HOH A 418 1555 1555 2.16 LINK MG MG A 411 O HOH A 419 1555 1555 2.23 LINK MG MG A 411 O HOH B 426 1555 1555 2.01 LINK MG MG A 411 O HOH A 417 1555 1555 2.24 LINK MG MG A 411 O HOH A 420 1555 1555 2.15 LINK MG MG A 411 O HOH B 427 1555 1555 2.28 LINK MG MG B 412 O HOH A 421 1555 1555 2.25 LINK MG MG B 412 O HOH A 423 1555 1555 2.45 LINK MG MG B 412 O HOH B 428 1555 1555 2.35 LINK MG MG B 412 O HOH B 429 1555 1555 2.22 LINK MG MG B 412 O HOH A 422 1555 1555 1.99 LINK MG MG B 412 O HOH B 430 1555 1555 2.14 LINK SR SR B 424 O HOH B 467 1555 1555 2.20 LINK SR SR B 424 O HOH B 456 1555 1555 2.82 LINK SR SR B 424 O HOH B 465 1555 1555 2.34 LINK SR SR B 424 O HOH B 466 1555 1555 2.18 LINK MG MG C 418 O HOH C 180 1555 1555 2.60 LINK MG MG C 418 O HOH D 372 1555 1555 2.37 LINK MG MG C 418 O HOH C 286 1555 1555 2.38 LINK MG MG C 418 O HOH C 151 1555 1555 3.11 LINK MG MG C 418 O HOH C 371 1555 1555 2.27 LINK MG MG C 418 O HOH C 198 1555 1555 2.38 LINK MG MG C 419 O HOH D 348 1555 1555 2.21 LINK MG MG C 419 O HOH C 136 1555 1555 2.09 LINK MG MG C 419 O HOH C 130 1555 1555 2.47 LINK MG MG C 419 O HOH D 158 1555 1555 2.67 LINK SR SR C 420 O HOH C 157 1555 1555 2.28 LINK SR SR C 420 O HOH C 147 1555 1555 2.67 LINK SR SR C 420 O HOH C 325 1555 1555 2.83 LINK SR SR C 420 O HOH C 395 1555 1555 3.00 LINK SR SR C 420 OP1 A C 25 1555 1555 2.87 LINK SR SR C 420 O2 C C 23 1555 1555 3.36 LINK SR SR C 420 N1 A D 45 1555 1555 2.85 LINK SR SR D 422 O HOH D 192 1555 1555 2.54 LINK SR SR D 422 O HOH D 121 1555 1555 2.61 LINK SR SR D 422 O HOH D 123 1555 1555 2.33 LINK MG MG E 416 O HOH E 93 1555 1555 2.22 LINK MG MG E 416 O HOH E 90 1555 1555 2.58 LINK MG MG E 416 O HOH F 294 1555 1555 2.09 LINK MG MG E 416 O HOH E 117 1555 1555 2.47 LINK MG MG E 416 O HOH E 112 1555 1555 2.17 LINK MG MG E 416 O HOH E 305 1555 1555 2.23 LINK MG MG E 417 O HOH F 293 1555 1555 2.07 LINK MG MG E 417 O HOH E 370 1555 1555 2.14 LINK MG MG E 417 O HOH E 367 1555 1555 2.28 LINK MG MG E 417 O HOH E 287 1555 1555 2.49 LINK MG MG E 417 O HOH E 285 1555 1555 2.53 LINK MG MG E 417 O HOH E 302 1555 1555 2.11 LINK SR SR E 421 O HOH F 114 1555 1555 2.49 LINK SR SR E 421 O HOH E 329 1555 1555 2.94 LINK SR SR E 421 O HOH E 83 1555 1555 3.06 LINK SR SR E 421 O2 C E 23 1555 1555 3.39 LINK SR SR E 421 N1 A F 45 1555 1555 2.84 LINK SR SR E 421 OP1 A E 25 1555 1555 2.85 LINK SR SR E 421 O HOH E 82 1555 1555 2.43 LINK SR SR F 425 O HOH F 331 1555 1555 2.21 LINK SR SR F 425 O HOH F 392 1555 1555 2.42 LINK SR SR F 425 O HOH F 330 1555 1555 2.32 LINK MG MG G 413 O HOH G 224 1555 1555 2.23 LINK MG MG G 413 O HOH H 226 1555 1555 2.22 LINK MG MG G 413 O HOH H 223 1555 1555 1.90 LINK MG MG G 413 O HOH H 221 1555 1555 2.26 LINK MG MG G 413 O HOH G 225 1555 1555 1.95 LINK MG MG G 413 O HOH G 222 1555 1555 1.99 LINK MG MG G 414 O HOH G 202 1555 1555 2.27 LINK MG MG G 414 O HOH H 204 1555 1555 2.26 LINK MG MG G 414 O HOH H 201 1555 1555 2.09 LINK MG MG G 414 O HOH G 206 1555 1555 2.08 LINK MG MG G 414 O HOH G 205 1555 1555 2.13 LINK MG MG G 414 O HOH G 203 1555 1555 2.15 LINK MG MG H 415 O HOH H 232 1555 1555 2.13 LINK MG MG H 415 O HOH G 231 1555 1555 2.20 LINK MG MG H 415 O HOH G 229 1555 1555 2.01 LINK MG MG H 415 O HOH G 228 1555 1555 2.21 LINK MG MG H 415 O HOH H 230 1555 1555 2.15 LINK MG MG H 415 O HOH H 227 1555 1555 2.30 LINK SR SR H 423 O HOH H 243 1555 1555 2.25 LINK SR SR H 423 O HOH H 270 1555 1555 2.29 LINK SR SR H 423 O HOH H 283 1555 1555 2.68 LINK SR SR H 423 O HOH H 236 1555 1555 2.13 LINK SR SR H 423 O HOH G 284 1555 1555 2.41 SITE 1 AC1 6 HOH A 412 HOH A 413 HOH A 414 HOH A 415 SITE 2 AC1 6 HOH A 416 HOH B 425 SITE 1 AC2 6 HOH A 417 HOH A 418 HOH A 419 HOH A 420 SITE 2 AC2 6 HOH B 426 HOH B 427 SITE 1 AC3 6 HOH A 421 HOH A 422 HOH A 423 HOH B 428 SITE 2 AC3 6 HOH B 429 HOH B 430 SITE 1 AC4 6 HOH G 222 HOH G 224 HOH G 225 HOH H 221 SITE 2 AC4 6 HOH H 223 HOH H 226 SITE 1 AC5 6 HOH G 202 HOH G 203 HOH G 205 HOH G 206 SITE 2 AC5 6 HOH H 201 HOH H 204 SITE 1 AC6 6 HOH G 228 HOH G 229 HOH G 231 HOH H 227 SITE 2 AC6 6 HOH H 230 HOH H 232 SITE 1 AC7 6 HOH E 90 HOH E 93 HOH E 112 HOH E 117 SITE 2 AC7 6 HOH E 305 HOH F 294 SITE 1 AC8 6 HOH E 285 HOH E 287 HOH E 302 HOH E 367 SITE 2 AC8 6 HOH E 370 HOH F 293 SITE 1 AC9 5 HOH C 180 HOH C 198 HOH C 286 HOH C 371 SITE 2 AC9 5 HOH D 372 SITE 1 BC1 4 HOH C 130 HOH C 136 HOH D 158 HOH D 348 SITE 1 BC2 7 C C 23 A C 25 HOH C 147 HOH C 157 SITE 2 BC2 7 HOH C 325 HOH C 395 A D 45 SITE 1 BC3 7 C E 23 A E 25 HOH E 82 HOH E 83 SITE 2 BC3 7 HOH E 329 A F 45 HOH F 114 SITE 1 BC4 3 HOH D 121 HOH D 123 HOH D 192 SITE 1 BC5 5 HOH G 284 HOH H 236 HOH H 243 HOH H 270 SITE 2 BC5 5 HOH H 283 SITE 1 BC6 4 HOH B 456 HOH B 465 HOH B 466 HOH B 467 SITE 1 BC7 3 HOH F 330 HOH F 331 HOH F 392 CRYST1 60.600 60.600 133.100 90.00 90.00 120.00 P 61 24 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 0.016502 0.009527 0.000000 0.00000 SCALE2 0.000000 0.019054 0.000000 0.00000 SCALE3 0.000000 0.000000 0.007513 0.00000 MODEL 1 ATOM 1 O5' C C 18 15.999 -1.921 26.831 1.00 33.53 O ATOM 2 C5' C C 18 16.172 -3.014 27.724 1.00 27.85 C ATOM 3 C4' C C 18 17.525 -3.668 27.566 1.00 28.41 C ATOM 4 O4' C C 18 17.683 -4.135 26.197 1.00 22.56 O ATOM 5 C3' C C 18 18.743 -2.775 27.775 1.00 26.75 C ATOM 6 O3' C C 18 19.056 -2.606 29.152 1.00 27.70 O ATOM 7 C2' C C 18 19.818 -3.577 27.059 1.00 22.63 C ATOM 8 O2' C C 18 20.252 -4.703 27.793 1.00 24.40 O ATOM 9 C1' C C 18 19.053 -4.035 25.820 1.00 22.34 C ATOM 10 N1 C C 18 19.197 -3.042 24.732 1.00 22.35 N ATOM 11 C2 C C 18 20.386 -3.039 23.992 1.00 21.89 C ATOM 12 O2 C C 18 21.262 -3.877 24.267 1.00 22.24 O ATOM 13 N3 C C 18 20.550 -2.126 22.999 1.00 22.04 N ATOM 14 C4 C C 18 19.581 -1.244 22.739 1.00 22.38 C ATOM 15 N4 C C 18 19.782 -0.358 21.756 1.00 21.84 N ATOM 16 C5 C C 18 18.359 -1.228 23.475 1.00 23.43 C ATOM 17 C6 C C 18 18.211 -2.135 24.453 1.00 22.02 C ATOM 18 P G C 19 19.697 -1.218 29.675 1.00 29.40 P ATOM 19 OP1 G C 19 19.803 -1.363 31.148 1.00 29.11 O ATOM 20 OP2 G C 19 18.941 -0.077 29.104 1.00 28.63 O ATOM 21 O5' G C 19 21.164 -1.187 29.057 1.00 23.34 O ATOM 22 C5' G C 19 22.123 -2.175 29.406 1.00 22.30 C ATOM 23 C4' G C 19 23.370 -2.022 28.564 1.00 23.42 C ATOM 24 O4' G C 19 23.042 -2.213 27.161 1.00 23.46 O ATOM 25 C3' G C 19 24.048 -0.660 28.576 1.00 24.99 C ATOM 26 O3' G C 19 24.860 -0.488 29.731 1.00 28.18 O ATOM 27 C2' G C 19 24.892 -0.741 27.314 1.00 23.10 C ATOM 28 O2' G C 19 26.016 -1.584 27.485 1.00 27.99 O ATOM 29 C1' G C 19 23.923 -1.438 26.357 1.00 22.06 C ATOM 30 N9 G C 19 23.133 -0.530 25.525 1.00 21.69 N ATOM 31 C8 G C 19 21.797 -0.237 25.653 1.00 20.20 C ATOM 32 N7 G C 19 21.363 0.590 24.739 1.00 20.15 N ATOM 33 C5 G C 19 22.484 0.865 23.961 1.00 21.29 C ATOM 34 C6 G C 19 22.631 1.707 22.825 1.00 20.18 C ATOM 35 O6 G C 19 21.767 2.384 22.256 1.00 21.39 O ATOM 36 N1 G C 19 23.945 1.716 22.357 1.00 21.36 N ATOM 37 C2 G C 19 24.983 1.007 22.919 1.00 20.46 C ATOM 38 N2 G C 19 26.192 1.160 22.354 1.00 21.04 N ATOM 39 N3 G C 19 24.849 0.212 23.966 1.00 21.61 N ATOM 40 C4 G C 19 23.584 0.190 24.435 1.00 20.62 C ATOM 41 P G C 20 25.107 0.988 30.321 1.00 30.43 P ATOM 42 OP1 G C 20 25.707 0.800 31.666 1.00 34.61 O ATOM 43 OP2 G C 20 23.877 1.800 30.178 1.00 27.75 O ATOM 44 O5' G C 20 26.203 1.607 29.356 1.00 26.86 O ATOM 45 C5' G C 20 27.562 1.222 29.460 1.00 30.58 C ATOM 46 C4' G C 20 28.389 1.958 28.442 1.00 26.48 C ATOM 47 O4' G C 20 27.959 1.579 27.106 1.00 27.75 O ATOM 48 C3' G C 20 28.258 3.472 28.438 1.00 29.59 C ATOM 49 O3' G C 20 29.036 4.075 29.465 1.00 31.00 O ATOM 50 C2' G C 20 28.773 3.794 27.046 1.00 28.08 C ATOM 51 O2' G C 20 30.174 3.608 26.937 1.00 29.25 O ATOM 52 C1' G C 20 28.079 2.697 26.237 1.00 27.33 C ATOM 53 N9 G C 20 26.743 3.101 25.799 1.00 24.24 N ATOM 54 C8 G C 20 25.536 2.839 26.406 1.00 25.70 C ATOM 55 N7 G C 20 24.520 3.356 25.768 1.00 22.97 N ATOM 56 C5 G C 20 25.092 4.000 24.678 1.00 24.22 C ATOM 57 C6 G C 20 24.493 4.761 23.641 1.00 23.94 C ATOM 58 O6 G C 20 23.295 5.023 23.468 1.00 25.87 O ATOM 59 N1 G C 20 25.444 5.248 22.752 1.00 24.03 N ATOM 60 C2 G C 20 26.797 5.041 22.849 1.00 25.90 C ATOM 61 N2 G C 20 27.556 5.620 21.908 1.00 23.26 N ATOM 62 N3 G C 20 27.367 4.327 23.807 1.00 22.75 N ATOM 63 C4 G C 20 26.461 3.845 24.681 1.00 23.61 C ATOM 64 P A C 21 28.592 5.499 30.073 1.00 31.60 P ATOM 65 OP1 A C 21 29.510 5.776 31.210 1.00 33.90 O ATOM 66 OP2 A C 21 27.124 5.499 30.305 1.00 31.05 O ATOM 67 O5' A C 21 28.882 6.533 28.890 1.00 31.74 O ATOM 68 C5' A C 21 30.184 6.647 28.316 1.00 30.55 C ATOM 69 C4' A C 21 30.148 7.496 27.062 1.00 32.51 C ATOM 70 O4' A C 21 29.379 6.833 26.020 1.00 28.72 O ATOM 71 C3' A C 21 29.483 8.852 27.210 1.00 34.38 C ATOM 72 O3' A C 21 30.331 9.777 27.903 1.00 39.09 O ATOM 73 C2' A C 21 29.100 9.182 25.763 1.00 31.50 C ATOM 74 O2' A C 21 30.124 9.693 24.931 1.00 32.41 O ATOM 75 C1' A C 21 28.682 7.802 25.242 1.00 31.01 C ATOM 76 N9 A C 21 27.245 7.573 25.398 1.00 25.48 N ATOM 77 C8 A C 21 26.601 6.905 26.408 1.00 25.98 C ATOM 78 N7 A C 21 25.295 6.925 26.306 1.00 27.26 N ATOM 79 C5 A C 21 25.064 7.643 25.143 1.00 23.88 C ATOM 80 C6 A C 21 23.881 8.024 24.492 1.00 23.88 C ATOM 81 N6 A C 21 22.659 7.741 24.953 1.00 21.13 N ATOM 82 N1 A C 21 23.997 8.724 23.344 1.00 23.14 N ATOM 83 C2 A C 21 25.223 9.030 22.903 1.00 25.99 C ATOM 84 N3 A C 21 26.404 8.739 23.433 1.00 24.61 N ATOM 85 C4 A C 21 26.254 8.034 24.565 1.00 25.63 C ATOM 86 P C C 22 29.754 11.206 28.341 1.00 40.95 P ATOM 87 OP1 C C 22 30.854 12.083 28.846 1.00 42.96 O ATOM 88 OP2 C C 22 28.560 10.999 29.209 1.00 39.36 O ATOM 89 O5' C C 22 29.260 11.778 26.947 1.00 41.00 O ATOM 90 C5' C C 22 28.445 12.913 26.970 1.00 36.02 C ATOM 91 C4' C C 22 27.793 13.110 25.653 1.00 37.62 C ATOM 92 O4' C C 22 27.083 11.891 25.259 1.00 37.41 O ATOM 93 C3' C C 22 26.690 14.121 25.839 1.00 36.74 C ATOM 94 O3' C C 22 27.390 15.375 25.920 1.00 42.33 O ATOM 95 C2' C C 22 25.784 13.764 24.645 1.00 33.23 C ATOM 96 O2' C C 22 26.221 14.242 23.382 1.00 32.30 O ATOM 97 C1' C C 22 25.854 12.230 24.661 1.00 31.68 C ATOM 98 N1 C C 22 24.794 11.622 25.440 1.00 28.09 N ATOM 99 C2 C C 22 23.545 11.644 24.883 1.00 27.06 C ATOM 100 O2 C C 22 23.406 12.186 23.771 1.00 25.87 O ATOM 101 N3 C C 22 22.520 11.085 25.538 1.00 24.76 N ATOM 102 C4 C C 22 22.726 10.500 26.721 1.00 25.75 C ATOM 103 N4 C C 22 21.686 9.919 27.319 1.00 25.87 N ATOM 104 C5 C C 22 24.013 10.475 27.337 1.00 27.06 C ATOM 105 C6 C C 22 25.014 11.046 26.665 1.00 25.66 C ATOM 106 P C C 23 26.680 16.723 26.495 1.00 41.17 P ATOM 107 OP1 C C 23 27.466 17.749 25.765 1.00 44.03 O ATOM 108 OP2 C C 23 26.655 16.757 27.989 1.00 42.29 O ATOM 109 O5' C C 23 25.168 16.752 25.956 1.00 40.64 O ATOM 110 C5' C C 23 24.856 17.111 24.604 1.00 39.21 C ATOM 111 C4' C C 23 23.386 17.012 24.412 1.00 39.75 C ATOM 112 O4' C C 23 22.950 15.738 24.888 1.00 38.38 O ATOM 113 C3' C C 23 22.558 18.085 25.073 1.00 38.88 C ATOM 114 O3' C C 23 21.595 18.358 24.022 1.00 40.92 O ATOM 115 C2' C C 23 21.765 17.352 26.163 1.00 37.14 C ATOM 116 O2' C C 23 20.494 17.817 26.502 1.00 37.37 O ATOM 117 C1' C C 23 21.824 15.890 25.713 1.00 35.95 C ATOM 118 N1 C C 23 21.852 14.848 26.724 1.00 35.45 N ATOM 119 C2 C C 23 20.695 14.130 27.015 1.00 35.09 C ATOM 120 O2 C C 23 19.683 14.323 26.345 1.00 37.99 O ATOM 121 N3 C C 23 20.727 13.212 28.012 1.00 35.70 N ATOM 122 C4 C C 23 21.853 13.008 28.700 1.00 36.71 C ATOM 123 N4 C C 23 21.813 12.127 29.706 1.00 38.50 N ATOM 124 C5 C C 23 23.055 13.703 28.389 1.00 36.49 C ATOM 125 C6 C C 23 23.006 14.590 27.386 1.00 35.37 C ATOM 126 P G C 24 21.704 19.609 22.994 1.00 46.20 P ATOM 127 OP1 G C 24 20.914 19.109 21.851 1.00 45.30 O ATOM 128 OP2 G C 24 23.038 20.245 22.725 1.00 46.66 O ATOM 129 O5' G C 24 20.645 20.632 23.603 1.00 40.32 O ATOM 130 C5' G C 24 20.967 21.703 24.485 1.00 32.56 C ATOM 131 C4' G C 24 19.739 22.536 24.660 1.00 22.72 C ATOM 132 O4' G C 24 19.808 23.498 23.604 1.00 22.23 O ATOM 133 C3' G C 24 18.338 21.908 24.527 1.00 22.20 C ATOM 134 O3' G C 24 17.835 21.420 25.780 1.00 24.66 O ATOM 135 C2' G C 24 17.511 23.125 24.104 1.00 22.60 C ATOM 136 O2' G C 24 17.202 23.971 25.200 1.00 20.62 O ATOM 137 C1' G C 24 18.505 23.858 23.202 1.00 22.52 C ATOM 138 N9 G C 24 18.395 23.585 21.774 1.00 19.18 N ATOM 139 C8 G C 24 19.197 22.754 21.020 1.00 19.87 C ATOM 140 N7 G C 24 18.886 22.755 19.752 1.00 20.05 N ATOM 141 C5 G C 24 17.810 23.632 19.661 1.00 20.63 C ATOM 142 C6 G C 24 17.060 24.048 18.528 1.00 18.87 C ATOM 143 O6 G C 24 17.207 23.713 17.345 1.00 20.15 O ATOM 144 N1 G C 24 16.054 24.954 18.879 1.00 18.92 N ATOM 145 C2 G C 24 15.803 25.401 20.156 1.00 19.28 C ATOM 146 N2 G C 24 14.779 26.273 20.291 1.00 17.66 N ATOM 147 N3 G C 24 16.502 25.023 21.224 1.00 18.32 N ATOM 148 C4 G C 24 17.485 24.142 20.902 1.00 21.11 C ATOM 149 P A C 25 16.740 20.230 25.834 1.00 20.91 P ATOM 150 OP1 A C 25 17.341 19.123 26.636 1.00 20.93 O ATOM 151 OP2 A C 25 16.223 19.948 24.475 1.00 21.28 O ATOM 152 O5' A C 25 15.574 20.868 26.711 1.00 20.03 O ATOM 153 C5' A C 25 15.823 21.307 28.046 1.00 16.75 C ATOM 154 C4' A C 25 14.610 22.010 28.603 1.00 20.40 C ATOM 155 O4' A C 25 14.348 23.195 27.807 1.00 22.04 O ATOM 156 C3' A C 25 13.314 21.207 28.561 1.00 19.25 C ATOM 157 O3' A C 25 13.193 20.424 29.752 1.00 18.06 O ATOM 158 C2' A C 25 12.259 22.307 28.504 1.00 18.53 C ATOM 159 O2' A C 25 12.029 22.881 29.775 1.00 22.32 O ATOM 160 C1' A C 25 12.953 23.343 27.619 1.00 22.46 C ATOM 161 N9 A C 25 12.685 23.223 26.185 1.00 21.21 N ATOM 162 C8 A C 25 13.559 22.794 25.219 1.00 17.25 C ATOM 163 N7 A C 25 13.092 22.892 24.002 1.00 20.49 N ATOM 164 C5 A C 25 11.812 23.399 24.176 1.00 20.49 C ATOM 165 C6 A C 25 10.807 23.761 23.259 1.00 20.04 C ATOM 166 N6 A C 25 10.953 23.678 21.932 1.00 20.32 N ATOM 167 N1 A C 25 9.638 24.228 23.760 1.00 17.96 N ATOM 168 C2 A C 25 9.505 24.325 25.091 1.00 18.53 C ATOM 169 N3 A C 25 10.384 24.028 26.052 1.00 19.50 N ATOM 170 C4 A C 25 11.533 23.572 25.519 1.00 19.39 C ATOM 171 P G C 26 12.464 18.983 29.709 1.00 19.86 P ATOM 172 OP1 G C 26 12.777 18.330 31.000 1.00 20.76 O ATOM 173 OP2 G C 26 12.833 18.310 28.435 1.00 19.90 O ATOM 174 O5' G C 26 10.892 19.298 29.644 1.00 25.22 O ATOM 175 C5' G C 26 10.222 20.205 30.553 1.00 25.25 C ATOM 176 C4' G C 26 8.833 20.510 30.011 1.00 25.61 C ATOM 177 O4' G C 26 8.934 21.220 28.748 1.00 23.23 O ATOM 178 C3' G C 26 8.047 19.215 29.746 1.00 25.34 C ATOM 179 O3' G C 26 6.699 19.363 30.225 1.00 28.82 O ATOM 180 C2' G C 26 7.927 19.165 28.226 1.00 23.44 C ATOM 181 O2' G C 26 6.821 18.545 27.631 1.00 23.58 O ATOM 182 C1' G C 26 8.012 20.644 27.867 1.00 20.17 C ATOM 183 N9 G C 26 8.320 20.929 26.476 1.00 22.13 N ATOM 184 C8 G C 26 7.482 21.557 25.584 1.00 23.59 C ATOM 185 N7 G C 26 7.938 21.553 24.363 1.00 19.95 N ATOM 186 C5 G C 26 9.164 20.913 24.462 1.00 21.37 C ATOM 187 C6 G C 26 10.107 20.598 23.463 1.00 20.21 C ATOM 188 O6 G C 26 10.031 20.800 22.246 1.00 22.24 O ATOM 189 N1 G C 26 11.226 19.968 23.997 1.00 18.49 N ATOM 190 C2 G C 26 11.403 19.660 25.319 1.00 19.79 C ATOM 191 N2 G C 26 12.549 19.037 25.626 1.00 18.21 N ATOM 192 N3 G C 26 10.521 19.937 26.267 1.00 19.77 N ATOM 193 C4 G C 26 9.430 20.556 25.768 1.00 21.98 C ATOM 194 P C C 27 6.187 18.635 31.554 1.00 22.91 P ATOM 195 OP1 C C 27 4.782 19.077 31.741 1.00 27.95 O ATOM 196 OP2 C C 27 7.166 18.857 32.643 1.00 24.48 O ATOM 197 O5' C C 27 6.160 17.092 31.181 1.00 22.69 O ATOM 198 C5' C C 27 5.170 16.561 30.306 1.00 22.94 C ATOM 199 C4' C C 27 5.315 15.069 30.245 1.00 27.43 C ATOM 200 O4' C C 27 6.482 14.728 29.451 1.00 25.39 O ATOM 201 C3' C C 27 5.584 14.452 31.608 1.00 26.28 C ATOM 202 O3' C C 27 4.371 14.239 32.325 1.00 29.33 O ATOM 203 C2' C C 27 6.323 13.176 31.240 1.00 27.16 C ATOM 204 O2' C C 27 5.449 12.153 30.805 1.00 29.87 O ATOM 205 C1' C C 27 7.185 13.662 30.070 1.00 26.63 C ATOM 206 N1 C C 27 8.532 14.147 30.462 1.00 23.01 N ATOM 207 C2 C C 27 9.458 13.229 30.986 1.00 24.06 C ATOM 208 O2 C C 27 9.134 12.039 31.087 1.00 23.80 O ATOM 209 N3 C C 27 10.686 13.664 31.361 1.00 22.76 N ATOM 210 C4 C C 27 11.012 14.951 31.217 1.00 23.40 C ATOM 211 N4 C C 27 12.241 15.339 31.602 1.00 22.79 N ATOM 212 C5 C C 27 10.097 15.903 30.675 1.00 24.12 C ATOM 213 C6 C C 27 8.880 15.464 30.318 1.00 24.71 C ATOM 214 P C C 28 4.361 14.354 33.929 1.00 29.22 P ATOM 215 OP1 C C 28 2.946 14.312 34.371 1.00 34.60 O ATOM 216 OP2 C C 28 5.236 15.458 34.401 1.00 27.80 O ATOM 217 O5' C C 28 5.067 13.004 34.379 1.00 29.22 O ATOM 218 C5' C C 28 4.579 11.747 33.931 1.00 30.91 C ATOM 219 C4' C C 28 5.377 10.636 34.558 1.00 31.06 C ATOM 220 O4' C C 28 6.687 10.561 33.933 1.00 28.93 O ATOM 221 C3' C C 28 5.684 10.807 36.039 1.00 30.73 C ATOM 222 O3' C C 28 4.599 10.398 36.863 1.00 31.18 O ATOM 223 C2' C C 28 6.897 9.907 36.207 1.00 30.26 C ATOM 224 O2' C C 28 6.546 8.540 36.233 1.00 31.80 O ATOM 225 C1' C C 28 7.649 10.195 34.908 1.00 26.67 C ATOM 226 N1 C C 28 8.636 11.284 35.040 1.00 24.31 N ATOM 227 C2 C C 28 9.879 10.976 35.592 1.00 23.38 C ATOM 228 O2 C C 28 10.086 9.816 35.996 1.00 24.77 O ATOM 229 N3 C C 28 10.821 11.937 35.679 1.00 21.31 N ATOM 230 C4 C C 28 10.562 13.171 35.247 1.00 20.01 C ATOM 231 N4 C C 28 11.541 14.080 35.337 1.00 17.25 N ATOM 232 C5 C C 28 9.290 13.528 34.701 1.00 20.16 C ATOM 233 C6 C C 28 8.361 12.562 34.622 1.00 21.91 C ATOM 234 P A C 29 4.455 11.002 38.346 1.00 34.54 P ATOM 235 OP1 A C 29 3.200 10.472 38.926 1.00 37.10 O ATOM 236 OP2 A C 29 4.685 12.469 38.310 1.00 30.54 O ATOM 237 O5' A C 29 5.680 10.374 39.146 1.00 30.16 O ATOM 238 C5' A C 29 5.710 8.988 39.463 1.00 33.04 C ATOM 239 C4' A C 29 7.011 8.637 40.143 1.00 32.79 C ATOM 240 O4' A C 29 8.104 8.954 39.243 1.00 29.27 O ATOM 241 C3' A C 29 7.355 9.414 41.406 1.00 34.76 C ATOM 242 O3' A C 29 6.747 8.832 42.550 1.00 38.46 O ATOM 243 C2' A C 29 8.862 9.241 41.473 1.00 33.88 C ATOM 244 O2' A C 29 9.207 7.958 41.958 1.00 37.62 O ATOM 245 C1' A C 29 9.236 9.343 39.993 1.00 30.21 C ATOM 246 N9 A C 29 9.649 10.686 39.580 1.00 25.85 N ATOM 247 C8 A C 29 8.941 11.681 38.945 1.00 24.68 C ATOM 248 N7 A C 29 9.644 12.770 38.723 1.00 24.78 N ATOM 249 C5 A C 29 10.898 12.468 39.241 1.00 24.95 C ATOM 250 C6 A C 29 12.107 13.194 39.312 1.00 25.14 C ATOM 251 N6 A C 29 12.277 14.421 38.819 1.00 21.45 N ATOM 252 N1 A C 29 13.161 12.595 39.911 1.00 25.15 N ATOM 253 C2 A C 29 13.011 11.353 40.382 1.00 25.64 C ATOM 254 N3 A C 29 11.946 10.569 40.359 1.00 24.62 N ATOM 255 C4 A C 29 10.910 11.191 39.774 1.00 26.67 C ATOM 256 P G C 30 6.402 9.748 43.823 1.00 42.43 P ATOM 257 OP1 G C 30 5.426 8.974 44.632 1.00 42.13 O ATOM 258 OP2 G C 30 6.042 11.108 43.352 1.00 39.82 O ATOM 259 O5' G C 30 7.782 9.854 44.613 1.00 40.02 O ATOM 260 C5' G C 30 8.383 8.706 45.209 1.00 39.82 C ATOM 261 C4' G C 30 9.782 9.030 45.686 1.00 39.05 C ATOM 262 O4' G C 30 10.608 9.406 44.553 1.00 37.31 O ATOM 263 C3' G C 30 9.909 10.206 46.643 1.00 38.96 C ATOM 264 O3' G C 30 9.631 9.847 47.998 1.00 36.79 O ATOM 265 C2' G C 30 11.360 10.624 46.457 1.00 38.26 C ATOM 266 O2' G C 30 12.253 9.804 47.186 1.00 42.92 O ATOM 267 C1' G C 30 11.552 10.386 44.958 1.00 34.60 C ATOM 268 N9 G C 30 11.373 11.580 44.134 1.00 31.36 N ATOM 269 C8 G C 30 10.258 11.954 43.419 1.00 30.49 C ATOM 270 N7 G C 30 10.427 13.065 42.753 1.00 29.79 N ATOM 271 C5 G C 30 11.728 13.449 43.053 1.00 28.94 C ATOM 272 C6 G C 30 12.479 14.570 42.619 1.00 27.40 C ATOM 273 O6 G C 30 12.144 15.471 41.847 1.00 25.65 O ATOM 274 N1 G C 30 13.750 14.579 43.178 1.00 26.24 N ATOM 275 C2 G C 30 14.241 13.632 44.041 1.00 27.92 C ATOM 276 N2 G C 30 15.487 13.826 44.489 1.00 26.87 N ATOM 277 N3 G C 30 13.560 12.575 44.439 1.00 29.14 N ATOM 278 C4 G C 30 12.318 12.549 43.911 1.00 29.19 C TER 279 G C 30 ATOM 280 O5' G D 39 15.580 24.447 39.152 1.00 33.03 O ATOM 281 C5' G D 39 16.579 25.200 39.839 1.00 27.57 C ATOM 282 C4' G D 39 17.036 24.565 41.134 1.00 25.64 C ATOM 283 O4' G D 39 15.911 24.471 42.043 1.00 24.02 O ATOM 284 C3' G D 39 17.574 23.144 41.042 1.00 25.73 C ATOM 285 O3' G D 39 18.960 23.143 40.706 1.00 27.78 O ATOM 286 C2' G D 39 17.354 22.631 42.460 1.00 25.98 C ATOM 287 O2' G D 39 18.355 23.069 43.357 1.00 24.81 O ATOM 288 C1' G D 39 16.014 23.280 42.810 1.00 26.00 C ATOM 289 N9 G D 39 14.872 22.426 42.491 1.00 22.67 N ATOM 290 C8 G D 39 13.959 22.591 41.474 1.00 22.47 C ATOM 291 N7 G D 39 13.044 21.662 41.453 1.00 23.40 N ATOM 292 C5 G D 39 13.366 20.838 42.522 1.00 22.76 C ATOM 293 C6 G D 39 12.724 19.685 43.004 1.00 21.46 C ATOM 294 O6 G D 39 11.695 19.149 42.578 1.00 24.05 O ATOM 295 N1 G D 39 13.392 19.147 44.102 1.00 20.85 N ATOM 296 C2 G D 39 14.535 19.667 44.663 1.00 22.44 C ATOM 297 N2 G D 39 15.049 19.005 45.711 1.00 22.05 N ATOM 298 N3 G D 39 15.133 20.754 44.227 1.00 22.24 N ATOM 299 C4 G D 39 14.500 21.287 43.163 1.00 22.86 C ATOM 300 P C D 40 19.620 21.848 40.015 1.00 30.68 P ATOM 301 OP1 C D 40 21.038 22.178 39.715 1.00 34.05 O ATOM 302 OP2 C D 40 18.725 21.395 38.923 1.00 29.44 O ATOM 303 O5' C D 40 19.570 20.718 41.133 1.00 31.77 O ATOM 304 C5' C D 40 20.473 20.722 42.233 1.00 33.09 C ATOM 305 C4' C D 40 20.238 19.505 43.093 1.00 31.28 C ATOM 306 O4' C D 40 18.893 19.571 43.639 1.00 30.44 O ATOM 307 C3' C D 40 20.260 18.161 42.377 1.00 28.98 C ATOM 308 O3' C D 40 21.587 17.691 42.169 1.00 33.37 O ATOM 309 C2' C D 40 19.487 17.294 43.360 1.00 28.89 C ATOM 310 O2' C D 40 20.232 16.932 44.509 1.00 29.09 O ATOM 311 C1' C D 40 18.378 18.259 43.780 1.00 28.20 C ATOM 312 N1 C D 40 17.180 18.108 42.931 1.00 26.57 N ATOM 313 C2 C D 40 16.332 17.031 43.181 1.00 24.69 C ATOM 314 O2 C D 40 16.619 16.249 44.094 1.00 27.33 O ATOM 315 N3 C D 40 15.230 16.863 42.419 1.00 25.06 N ATOM 316 C4 C D 40 14.964 17.721 41.434 1.00 25.09 C ATOM 317 N4 C D 40 13.862 17.519 40.706 1.00 23.55 N ATOM 318 C5 C D 40 15.814 18.827 41.150 1.00 25.99 C ATOM 319 C6 C D 40 16.899 18.985 41.918 1.00 26.11 C ATOM 320 P U D 41 21.904 16.684 40.948 1.00 32.03 P ATOM 321 OP1 U D 41 23.373 16.462 40.974 1.00 37.18 O ATOM 322 OP2 U D 41 21.265 17.186 39.704 1.00 33.65 O ATOM 323 O5' U D 41 21.177 15.326 41.367 1.00 31.89 O ATOM 324 C5' U D 41 21.619 14.585 42.500 1.00 30.58 C ATOM 325 C4' U D 41 20.741 13.376 42.725 1.00 30.18 C ATOM 326 O4' U D 41 19.395 13.795 43.095 1.00 28.73 O ATOM 327 C3' U D 41 20.506 12.481 41.521 1.00 29.40 C ATOM 328 O3' U D 41 21.615 11.639 41.229 1.00 32.07 O ATOM 329 C2' U D 41 19.260 11.726 41.955 1.00 27.29 C ATOM 330 O2' U D 41 19.534 10.742 42.939 1.00 27.33 O ATOM 331 C1' U D 41 18.449 12.866 42.581 1.00 26.47 C ATOM 332 N1 U D 41 17.596 13.561 41.597 1.00 22.79 N ATOM 333 C2 U D 41 16.358 13.008 41.307 1.00 23.11 C ATOM 334 O2 U D 41 15.944 11.978 41.820 1.00 23.12 O ATOM 335 N3 U D 41 15.619 13.705 40.387 1.00 23.64 N ATOM 336 C4 U D 41 15.976 14.867 39.736 1.00 23.76 C ATOM 337 O4 U D 41 15.196 15.369 38.925 1.00 20.71 O ATOM 338 C5 U D 41 17.266 15.373 40.084 1.00 23.11 C ATOM 339 C6 U D 41 18.012 14.721 40.979 1.00 21.23 C ATOM 340 P G D 42 21.927 11.250 39.699 1.00 32.33 P ATOM 341 OP1 G D 42 23.228 10.524 39.666 1.00 39.24 O ATOM 342 OP2 G D 42 21.751 12.457 38.852 1.00 31.29 O ATOM 343 O5' G D 42 20.767 10.218 39.337 1.00 28.37 O ATOM 344 C5' G D 42 20.591 9.038 40.113 1.00 29.21 C ATOM 345 C4' G D 42 19.311 8.326 39.744 1.00 28.08 C ATOM 346 O4' G D 42 18.154 9.092 40.179 1.00 24.74 O ATOM 347 C3' G D 42 19.039 8.061 38.272 1.00 25.74 C ATOM 348 O3' G D 42 19.816 6.958 37.805 1.00 29.08 O ATOM 349 C2' G D 42 17.544 7.766 38.315 1.00 26.48 C ATOM 350 O2' G D 42 17.270 6.492 38.877 1.00 24.35 O ATOM 351 C1' G D 42 17.067 8.837 39.302 1.00 25.49 C ATOM 352 N9 G D 42 16.649 10.086 38.656 1.00 23.59 N ATOM 353 C8 G D 42 17.380 11.237 38.448 1.00 23.14 C ATOM 354 N7 G D 42 16.711 12.159 37.796 1.00 23.26 N ATOM 355 C5 G D 42 15.464 11.585 37.572 1.00 20.19 C ATOM 356 C6 G D 42 14.308 12.092 36.897 1.00 20.41 C ATOM 357 O6 G D 42 14.158 13.177 36.322 1.00 19.52 O ATOM 358 N1 G D 42 13.264 11.170 36.915 1.00 19.98 N ATOM 359 C2 G D 42 13.327 9.916 37.473 1.00 21.41 C ATOM 360 N2 G D 42 12.234 9.148 37.359 1.00 23.53 N ATOM 361 N3 G D 42 14.387 9.436 38.091 1.00 22.20 N ATOM 362 C4 G D 42 15.409 10.313 38.105 1.00 21.46 C ATOM 363 P G D 43 19.951 6.687 36.226 1.00 32.61 P ATOM 364 OP1 G D 43 20.691 5.408 36.046 1.00 33.66 O ATOM 365 OP2 G D 43 20.458 7.913 35.572 1.00 25.17 O ATOM 366 O5' G D 43 18.436 6.436 35.816 1.00 30.26 O ATOM 367 C5' G D 43 17.980 6.604 34.495 1.00 33.17 C ATOM 368 C4' G D 43 16.508 6.330 34.455 1.00 28.79 C ATOM 369 O4' G D 43 15.835 7.250 35.359 1.00 28.83 O ATOM 370 C3' G D 43 15.852 6.557 33.108 1.00 30.17 C ATOM 371 O3' G D 43 15.997 5.397 32.292 1.00 32.74 O ATOM 372 C2' G D 43 14.415 6.833 33.520 1.00 26.40 C ATOM 373 O2' G D 43 13.726 5.653 33.880 1.00 28.16 O ATOM 374 C1' G D 43 14.638 7.711 34.757 1.00 26.39 C ATOM 375 N9 G D 43 14.816 9.120 34.402 1.00 21.21 N ATOM 376 C8 G D 43 15.944 9.896 34.547 1.00 21.63 C ATOM 377 N7 G D 43 15.794 11.111 34.086 1.00 20.27 N ATOM 378 C5 G D 43 14.484 11.138 33.617 1.00 21.81 C ATOM 379 C6 G D 43 13.746 12.178 32.986 1.00 20.63 C ATOM 380 O6 G D 43 14.118 13.323 32.695 1.00 18.69 O ATOM 381 N1 G D 43 12.451 11.769 32.676 1.00 20.04 N ATOM 382 C2 G D 43 11.935 10.518 32.921 1.00 22.33 C ATOM 383 N2 G D 43 10.669 10.298 32.528 1.00 18.17 N ATOM 384 N3 G D 43 12.610 9.546 33.502 1.00 20.95 N ATOM 385 C4 G D 43 13.866 9.921 33.820 1.00 21.80 C ATOM 386 P G D 44 16.190 5.563 30.707 1.00 33.40 P ATOM 387 OP1 G D 44 16.312 4.205 30.116 1.00 35.96 O ATOM 388 OP2 G D 44 17.252 6.569 30.455 1.00 35.69 O ATOM 389 O5' G D 44 14.803 6.176 30.237 1.00 30.57 O ATOM 390 C5' G D 44 13.601 5.443 30.410 1.00 25.73 C ATOM 391 C4' G D 44 12.426 6.266 29.963 1.00 27.00 C ATOM 392 O4' G D 44 12.351 7.471 30.767 1.00 26.15 O ATOM 393 C3' G D 44 12.510 6.805 28.546 1.00 26.48 C ATOM 394 O3' G D 44 12.143 5.827 27.588 1.00 25.77 O ATOM 395 C2' G D 44 11.506 7.941 28.602 1.00 24.23 C ATOM 396 O2' G D 44 10.182 7.454 28.558 1.00 28.51 O ATOM 397 C1' G D 44 11.810 8.524 29.984 1.00 23.81 C ATOM 398 N9 G D 44 12.792 9.603 29.907 1.00 23.13 N ATOM 399 C8 G D 44 14.100 9.580 30.321 1.00 22.05 C ATOM 400 N7 G D 44 14.726 10.704 30.103 1.00 22.17 N ATOM 401 C5 G D 44 13.770 11.520 29.510 1.00 20.87 C ATOM 402 C6 G D 44 13.861 12.860 29.052 1.00 24.31 C ATOM 403 O6 G D 44 14.833 13.618 29.085 1.00 26.12 O ATOM 404 N1 G D 44 12.658 13.301 28.517 1.00 23.19 N ATOM 405 C2 G D 44 11.509 12.559 28.439 1.00 24.17 C ATOM 406 N2 G D 44 10.443 13.177 27.902 1.00 23.85 N ATOM 407 N3 G D 44 11.408 11.308 28.861 1.00 21.76 N ATOM 408 C4 G D 44 12.572 10.857 29.384 1.00 23.79 C ATOM 409 P A D 45 12.925 5.765 26.182 1.00 29.11 P ATOM 410 OP1 A D 45 12.329 4.649 25.409 1.00 33.23 O ATOM 411 OP2 A D 45 14.384 5.777 26.453 1.00 26.93 O ATOM 412 O5' A D 45 12.543 7.137 25.467 1.00 27.36 O ATOM 413 C5' A D 45 11.189 7.419 25.131 1.00 31.54 C ATOM 414 C4' A D 45 11.059 8.830 24.613 1.00 28.35 C ATOM 415 O4' A D 45 11.362 9.769 25.678 1.00 27.97 O ATOM 416 C3' A D 45 12.022 9.207 23.501 1.00 29.48 C ATOM 417 O3' A D 45 11.546 8.753 22.240 1.00 35.84 O ATOM 418 C2' A D 45 12.043 10.725 23.625 1.00 28.98 C ATOM 419 O2' A D 45 10.881 11.333 23.087 1.00 32.95 O ATOM 420 C1' A D 45 12.051 10.893 25.148 1.00 25.61 C ATOM 421 N9 A D 45 13.403 10.908 25.720 1.00 25.60 N ATOM 422 C8 A D 45 14.054 9.859 26.330 1.00 24.15 C ATOM 423 N7 A D 45 15.272 10.146 26.723 1.00 23.49 N ATOM 424 C5 A D 45 15.439 11.473 26.351 1.00 24.52 C ATOM 425 C6 A D 45 16.525 12.358 26.471 1.00 25.37 C ATOM 426 N6 A D 45 17.703 12.025 27.001 1.00 26.02 N ATOM 427 N1 A D 45 16.362 13.616 26.005 1.00 25.93 N ATOM 428 C2 A D 45 15.195 13.944 25.446 1.00 22.76 C ATOM 429 N3 A D 45 14.106 13.201 25.263 1.00 26.59 N ATOM 430 C4 A D 45 14.292 11.960 25.744 1.00 25.78 C ATOM 431 P G D 46 12.570 8.097 21.186 1.00 39.79 P ATOM 432 OP1 G D 46 11.761 7.696 20.002 1.00 39.94 O ATOM 433 OP2 G D 46 13.404 7.083 21.886 1.00 33.85 O ATOM 434 O5' G D 46 13.536 9.294 20.781 1.00 29.88 O ATOM 435 C5' G D 46 13.033 10.439 20.100 1.00 30.66 C ATOM 436 C4' G D 46 14.082 11.525 20.049 1.00 25.52 C ATOM 437 O4' G D 46 14.381 12.009 21.389 1.00 26.88 O ATOM 438 C3' G D 46 15.443 11.110 19.514 1.00 26.41 C ATOM 439 O3' G D 46 15.464 11.092 18.098 1.00 23.14 O ATOM 440 C2' G D 46 16.332 12.213 20.062 1.00 24.79 C ATOM 441 O2' G D 46 16.157 13.414 19.338 1.00 26.86 O ATOM 442 C1' G D 46 15.758 12.375 21.470 1.00 24.14 C ATOM 443 N9 G D 46 16.418 11.504 22.444 1.00 22.19 N ATOM 444 C8 G D 46 15.892 10.378 23.029 1.00 22.96 C ATOM 445 N7 G D 46 16.707 9.811 23.881 1.00 23.03 N ATOM 446 C5 G D 46 17.842 10.611 23.862 1.00 23.07 C ATOM 447 C6 G D 46 19.058 10.498 24.592 1.00 23.20 C ATOM 448 O6 G D 46 19.356 9.679 25.469 1.00 24.50 O ATOM 449 N1 G D 46 19.968 11.483 24.227 1.00 24.47 N ATOM 450 C2 G D 46 19.734 12.466 23.301 1.00 22.63 C ATOM 451 N2 G D 46 20.763 13.294 23.059 1.00 24.50 N ATOM 452 N3 G D 46 18.585 12.617 22.649 1.00 22.77 N ATOM 453 C4 G D 46 17.694 11.653 22.969 1.00 22.25 C ATOM 454 P U D 47 16.478 10.105 17.328 1.00 27.43 P ATOM 455 OP1 U D 47 16.144 10.165 15.886 1.00 24.16 O ATOM 456 OP2 U D 47 16.491 8.793 18.027 1.00 22.32 O ATOM 457 O5' U D 47 17.911 10.749 17.566 1.00 22.27 O ATOM 458 C5' U D 47 18.304 11.947 16.903 1.00 22.89 C ATOM 459 C4' U D 47 19.746 12.272 17.224 1.00 23.03 C ATOM 460 O4' U D 47 19.892 12.540 18.644 1.00 23.49 O ATOM 461 C3' U D 47 20.762 11.170 16.948 1.00 23.86 C ATOM 462 O3' U D 47 21.155 11.211 15.586 1.00 24.10 O ATOM 463 C2' U D 47 21.915 11.590 17.847 1.00 25.20 C ATOM 464 O2' U D 47 22.628 12.674 17.286 1.00 24.40 O ATOM 465 C1' U D 47 21.160 12.065 19.090 1.00 24.30 C ATOM 466 N1 U D 47 20.960 10.993 20.086 1.00 21.95 N ATOM 467 C2 U D 47 22.052 10.618 20.867 1.00 24.01 C ATOM 468 O2 U D 47 23.165 11.097 20.731 1.00 24.73 O ATOM 469 N3 U D 47 21.794 9.649 21.803 1.00 22.33 N ATOM 470 C4 U D 47 20.603 9.006 22.025 1.00 23.63 C ATOM 471 O4 U D 47 20.527 8.177 22.931 1.00 22.27 O ATOM 472 C5 U D 47 19.532 9.416 21.167 1.00 22.35 C ATOM 473 C6 U D 47 19.740 10.375 20.253 1.00 23.24 C ATOM 474 P C D 48 21.476 9.850 14.797 1.00 29.10 P ATOM 475 OP1 C D 48 21.540 10.235 13.363 1.00 29.71 O ATOM 476 OP2 C D 48 20.561 8.761 15.222 1.00 27.80 O ATOM 477 O5' C D 48 22.934 9.453 15.293 1.00 27.74 O ATOM 478 C5' C D 48 24.065 10.244 14.941 1.00 25.44 C ATOM 479 C4' C D 48 25.297 9.710 15.626 1.00 28.52 C ATOM 480 O4' C D 48 25.150 9.859 17.062 1.00 28.30 O ATOM 481 C3' C D 48 25.531 8.219 15.441 1.00 26.41 C ATOM 482 O3' C D 48 26.174 7.943 14.206 1.00 28.56 O ATOM 483 C2' C D 48 26.405 7.880 16.640 1.00 25.57 C ATOM 484 O2' C D 48 27.765 8.220 16.455 1.00 26.08 O ATOM 485 C1' C D 48 25.784 8.768 17.720 1.00 23.93 C ATOM 486 N1 C D 48 24.796 8.073 18.576 1.00 23.47 N ATOM 487 C2 C D 48 25.260 7.390 19.714 1.00 23.73 C ATOM 488 O2 C D 48 26.488 7.325 19.920 1.00 24.13 O ATOM 489 N3 C D 48 24.367 6.816 20.552 1.00 23.80 N ATOM 490 C4 C D 48 23.059 6.884 20.286 1.00 23.81 C ATOM 491 N4 C D 48 22.210 6.330 21.165 1.00 21.02 N ATOM 492 C5 C D 48 22.560 7.529 19.114 1.00 21.52 C ATOM 493 C6 C D 48 23.455 8.106 18.294 1.00 21.07 C ATOM 494 P C D 49 25.876 6.558 13.441 1.00 32.35 P ATOM 495 OP1 C D 49 26.631 6.611 12.168 1.00 33.56 O ATOM 496 OP2 C D 49 24.411 6.326 13.414 1.00 26.74 O ATOM 497 O5' C D 49 26.527 5.447 14.377 1.00 30.33 O ATOM 498 C5' C D 49 27.942 5.308 14.477 1.00 30.52 C ATOM 499 C4' C D 49 28.295 4.260 15.507 1.00 27.26 C ATOM 500 O4' C D 49 27.842 4.698 16.816 1.00 26.49 O ATOM 501 C3' C D 49 27.621 2.907 15.331 1.00 29.04 C ATOM 502 O3' C D 49 28.188 2.071 14.310 1.00 27.99 O ATOM 503 C2' C D 49 27.707 2.318 16.731 1.00 27.96 C ATOM 504 O2' C D 49 28.952 1.692 16.980 1.00 32.96 O ATOM 505 C1' C D 49 27.522 3.563 17.610 1.00 26.81 C ATOM 506 N1 C D 49 26.135 3.693 18.122 1.00 25.89 N ATOM 507 C2 C D 49 25.841 3.203 19.406 1.00 26.23 C ATOM 508 O2 C D 49 26.761 2.775 20.114 1.00 26.46 O ATOM 509 N3 C D 49 24.558 3.211 19.844 1.00 24.37 N ATOM 510 C4 C D 49 23.589 3.683 19.059 1.00 25.18 C ATOM 511 N4 C D 49 22.325 3.587 19.497 1.00 22.61 N ATOM 512 C5 C D 49 23.867 4.251 17.776 1.00 25.81 C ATOM 513 C6 C D 49 25.143 4.236 17.352 1.00 25.68 C TER 514 C D 49 HETATM 515 MG MG C 418 8.760 17.146 38.939 1.00 34.02 MG HETATM 516 MG MG C 419 18.920 4.500 24.792 1.00 74.78 MG HETATM 517 SR SR C 420 17.070 16.376 25.848 1.00 57.18 SR HETATM 518 SR SR D 422 18.099 15.648 34.533 1.00 85.14 SR HETATM 519 O HOH C 66 15.450 25.493 27.372 1.00 29.85 O HETATM 520 O HOH C 124 10.337 16.617 34.825 1.00 22.85 O HETATM 521 O HOH C 126 30.097 4.043 23.565 1.00 44.58 O HETATM 522 O HOH C 128 10.727 7.036 34.450 1.00 40.46 O HETATM 523 O HOH C 130 18.769 2.040 25.006 1.00 31.09 O HETATM 524 O HOH C 132 5.938 14.838 37.212 1.00 29.89 O HETATM 525 O HOH C 133 1.738 18.108 32.580 1.00 49.46 O HETATM 526 O HOH C 134 2.376 17.662 36.176 1.00 56.12 O HETATM 527 O HOH C 136 21.000 4.395 24.911 1.00 29.29 O HETATM 528 O HOH C 137 19.908 2.856 27.900 1.00 48.23 O HETATM 529 O HOH C 138 6.608 9.522 30.505 1.00 38.85 O HETATM 530 O HOH C 140 20.430 22.379 28.577 1.00 47.94 O HETATM 531 O HOH C 142 21.141 5.928 27.141 1.00 40.60 O HETATM 532 O HOH C 143 8.881 20.660 33.823 1.00 47.59 O HETATM 533 O HOH C 144 22.032 -6.766 24.719 1.00 35.18 O HETATM 534 O HOH C 145 27.246 11.485 19.867 1.00 47.55 O HETATM 535 O HOH C 147 17.273 15.899 23.225 1.00 55.53 O HETATM 536 O HOH C 148 17.632 -0.681 33.125 1.00 48.28 O HETATM 537 O HOH C 151 6.707 15.411 40.495 1.00 31.14 O HETATM 538 O HOH C 152 1.601 14.220 30.768 1.00 52.94 O HETATM 539 O HOH C 155 22.845 -5.288 27.280 1.00 47.85 O HETATM 540 O HOH C 156 23.434 6.137 28.554 1.00 38.62 O HETATM 541 O HOH C 157 17.476 16.261 28.090 1.00 45.72 O HETATM 542 O HOH C 159 18.536 23.849 27.888 1.00 35.59 O HETATM 543 O HOH C 165 23.649 17.475 29.392 1.00 40.77 O HETATM 544 O HOH C 167 7.537 16.727 34.237 1.00 32.52 O HETATM 545 O HOH C 168 12.019 18.590 33.544 1.00 32.18 O HETATM 546 O HOH C 175 30.958 7.249 22.441 1.00 50.89 O HETATM 547 O HOH C 176 28.143 9.839 22.028 1.00 35.68 O HETATM 548 O HOH C 179 6.652 13.442 44.936 1.00 53.43 O HETATM 549 O HOH C 180 10.942 16.903 37.552 1.00 27.46 O HETATM 550 O HOH C 187 16.700 23.958 14.777 1.00 35.82 O HETATM 551 O HOH C 190 7.283 15.957 43.271 1.00 34.54 O HETATM 552 O HOH C 191 22.489 8.410 29.918 1.00 48.98 O HETATM 553 O HOH C 193 5.667 6.348 43.930 1.00 48.85 O HETATM 554 O HOH C 194 24.534 13.534 21.304 1.00 36.52 O HETATM 555 O HOH C 197 15.695 17.531 31.505 1.00 56.33 O HETATM 556 O HOH C 198 9.686 15.867 40.722 1.00 30.84 O HETATM 557 O HOH C 199 12.330 8.249 41.899 1.00 34.48 O HETATM 558 O HOH C 244 18.183 19.158 22.162 1.00 40.20 O HETATM 559 O HOH C 286 8.462 15.000 37.950 1.00 31.68 O HETATM 560 O HOH C 301 13.301 22.244 32.309 1.00 41.58 O HETATM 561 O HOH C 310 13.783 10.471 49.269 1.00 33.91 O HETATM 562 O HOH C 311 19.801 21.087 16.943 1.00 48.88 O HETATM 563 O HOH C 317 26.732 -1.299 24.814 1.00 33.45 O HETATM 564 O HOH C 322 26.994 -2.875 29.563 1.00 34.43 O HETATM 565 O HOH C 325 14.985 16.505 27.760 1.00 43.60 O HETATM 566 O HOH C 368 24.558 4.465 30.383 1.00 38.66 O HETATM 567 O HOH C 371 7.404 17.866 40.608 1.00 42.85 O HETATM 568 O HOH C 373 4.799 19.960 27.620 1.00 50.55 O HETATM 569 O HOH C 384 8.906 6.907 36.157 1.00 38.29 O HETATM 570 O HOH C 393 7.591 25.174 22.241 1.00 34.20 O HETATM 571 O HOH C 395 14.939 17.593 24.128 1.00 32.96 O HETATM 572 O HOH D 121 17.726 13.317 33.414 1.00 48.19 O HETATM 573 O HOH D 123 18.108 14.514 36.566 1.00 28.29 O HETATM 574 O HOH D 125 29.492 2.899 20.711 1.00 27.41 O HETATM 575 O HOH D 127 20.220 4.870 17.645 1.00 33.16 O HETATM 576 O HOH D 129 11.773 15.660 27.350 1.00 33.75 O HETATM 577 O HOH D 131 19.198 5.775 20.286 1.00 26.71 O HETATM 578 O HOH D 135 20.501 12.010 35.875 1.00 42.91 O HETATM 579 O HOH D 139 18.931 18.306 38.603 1.00 27.77 O HETATM 580 O HOH D 141 24.607 13.314 18.367 1.00 46.65 O HETATM 581 O HOH D 146 11.626 15.225 24.362 1.00 49.13 O HETATM 582 O HOH D 149 24.070 8.614 37.902 1.00 46.66 O HETATM 583 O HOH D 150 11.370 21.077 38.991 1.00 29.79 O HETATM 584 O HOH D 153 14.472 2.876 33.987 1.00 47.99 O HETATM 585 O HOH D 154 18.967 7.529 17.354 1.00 32.65 O HETATM 586 O HOH D 158 16.484 4.211 23.738 1.00 30.26 O HETATM 587 O HOH D 161 20.254 15.722 21.505 1.00 42.94 O HETATM 588 O HOH D 162 15.557 12.722 14.945 1.00 35.30 O HETATM 589 O HOH D 163 16.510 7.238 20.455 1.00 40.44 O HETATM 590 O HOH D 170 7.736 11.486 26.560 1.00 44.38 O HETATM 591 O HOH D 171 26.301 2.040 11.740 1.00 49.01 O HETATM 592 O HOH D 172 9.137 7.690 32.258 1.00 54.34 O HETATM 593 O HOH D 173 19.208 7.130 27.085 1.00 46.95 O HETATM 594 O HOH D 174 19.972 7.228 30.810 1.00 44.29 O HETATM 595 O HOH D 177 22.461 14.436 14.805 1.00 49.47 O HETATM 596 O HOH D 178 17.080 2.166 33.324 1.00 48.93 O HETATM 597 O HOH D 181 13.095 18.620 37.971 1.00 33.51 O HETATM 598 O HOH D 182 17.838 15.144 19.831 1.00 32.78 O HETATM 599 O HOH D 183 20.390 14.905 38.209 1.00 31.97 O HETATM 600 O HOH D 185 16.951 8.057 26.057 1.00 42.75 O HETATM 601 O HOH D 186 15.929 18.063 37.062 1.00 48.86 O HETATM 602 O HOH D 188 23.375 18.437 37.710 1.00 60.11 O HETATM 603 O HOH D 189 17.436 14.844 14.908 1.00 44.71 O HETATM 604 O HOH D 192 15.713 15.557 35.390 1.00 44.12 O HETATM 605 O HOH D 195 19.195 9.803 35.000 1.00 40.48 O HETATM 606 O HOH D 200 21.761 6.072 15.254 1.00 40.54 O HETATM 607 O HOH D 303 18.477 8.177 43.156 1.00 27.55 O HETATM 608 O HOH D 339 17.056 19.838 47.242 1.00 42.75 O HETATM 609 O HOH D 348 18.601 6.410 23.726 1.00 32.48 O HETATM 610 O HOH D 372 10.107 18.814 39.938 1.00 42.48 O HETATM 611 O HOH D 380 18.393 16.431 17.344 1.00 49.31 O HETATM 612 O HOH D 385 29.345 9.850 14.480 1.00 34.65 O ENDMDL MASTER 16 0 0 0 0 0 28 6 610 2 0 8 END